| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.7 | Very low | 82.3 | Confident | 233 Ų | 233 | 79.7 Ų | 79.7 | 100% | 1.148 | 37% | 0.369 | S | S | * | . | 0 | 141.2 | 0 | -71.3 | 176.1 | 175.6 | 0 | 0 | 107.7 | |||||
| 2 | P | 59.1 | Low | 83.3 | Confident | 54 Ų | 54 | 73.2 Ų | 73.2 | 35% | 0.351 | 34% | 0.339 | S | S | . | . | trans | -58 | 139.4 | 170.6 | -16.6 | 30 | 0 | 0 | 0 | 108.8 | L6 Y7 | P2-L6 HydrophobicContact CB-CD2 3.86Å; P2-Y7 HydrophobicContact CB-CD2 4.49Å; P2-Y7 HydrophobicContact CB-CE2 3.74Å; P2-Y7 HydrophobicContact CG-CE2 3.92Å; P2-Y7 WeakPolarHBondContact CG-OH 3.11Å | ||
| 3 | P | 77 | Confident | 84.1 | Confident | 32 Ų | 32 | 67.5 Ų | 67.5 | 21% | 0.208 | 31% | 0.313 | C | S | . | . | trans | -62 | 147.1 | 179.5 | 30.8 | -39.5 | 0 | 0 | 0 | 109.5 | R5 L6 L225 | P3-R5 PolarHBondContact O-N 2.71Å; P3-L6 PolarHBondContact O-N 3.03Å; P3-L225 WeakPolarHBondContact CD-O 3.49Å; P3-L225 WeakPolarHBondContact CG-O 3.22Å | ||
| 4 | W | 86.4 | Confident | 84.8 | Confident | 172 Ų | 172 | 63 Ų | 63 | 65% | 0.652 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -49.4 | -28.3 | -179.8 | 70 | -93.4 | 0 | 0 | 0 | 113.3 | L6 Y7 F8 | W4-L6 PolarHBondContact O-N 3.18Å; W4-Y7 PolarHBondContact O-N 2.99Å; W4-F8 HydrophobicContact CE3-CB 3.89Å; W4-F8 HydrophobicContact CE3-CG 4.41Å; W4-F8 HydrophobicContact CZ3-CB 3.94Å; W4-F8 HydrophobicContact CZ3-CD1 4.48Å; W4-F8 HydrophobicContact CZ3-CD2 4.25Å; W4-F8 AromaticContact CZ3-CG 3.96Å; W4-F8 HydrophobicContact CZ3-CG 3.96Å; W4-F8 WeakPolarHBondContact O-CB 3.39Å; W4-F8 PolarHBondContact O-N 3.47Å |
| 5 | R | 89 | Confident | 85.4 | Confident | 106 Ų | 106 | 61.7 Ų | 61.7 | 40% | 0.4 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.3 | -37.8 | 177.2 | -71.2 | -172.7 | 171.6 | -175.8 | -4.8 | 113.8 | P3 F8 T9 L224 | P3-R5 PolarHBondContact O-N 2.71Å; R5-F8 PolarHBondContact O-N 3.28Å; R5-T9 WeakPolarHBondContact O-CB 3.35Å; R5-T9 PolarHBondContact O-N 3.03Å; R5-T9 PolarHBondContact O-OG1 3.45Å; R5-L224 WeakPolarHBondContact CB-O 3.47Å; R5-L224 WeakPolarHBondContact CD-O 3.42Å |
| 6 | L | 90.2 | Very high | 85.6 | Confident | 4 Ų | 4 | 57.9 Ų | 57.9 | 2% | 0.021 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.5 | -48 | 177.1 | -179.9 | 64.4 | 0 | 0 | 0 | 110.7 | P2 P3 W4 T9 Y10 I141 P143 L225 | P2-L6 HydrophobicContact CB-CD2 3.86Å; P3-L6 PolarHBondContact O-N 3.03Å; W4-L6 PolarHBondContact O-N 3.18Å; L6-T9 PolarHBondContact O-N 2.93Å; L6-Y10 HydrophobicContact CD1-CE1 3.95Å; L6-Y10 HydrophobicContact CD1-CE2 4.15Å; L6-Y10 HydrophobicContact CD2-CE2 4.07Å; L6-Y10 HydrophobicContact CG-CD2 4.31Å; L6-Y10 HydrophobicContact CG-CE1 4.44Å; L6-Y10 HydrophobicContact CG-CE2 3.76Å; L6-Y10 PolarHBondContact O-N 3.15Å; L6-I141 HydrophobicContact CD1-CB 4.45Å; L6-I141 HydrophobicContact CD1-CD1 4.38Å; L6-I141 HydrophobicContact CD1-CG1 4.2Å; L6-P143 HydrophobicContact CD2-CG 4.21Å; L6-L225 HydrophobicContact CD1-CD2 4.14Å |
| 7 | Y | 89.4 | Confident | 86.1 | Confident | 121 Ų | 121 | 54.5 Ų | 54.5 | 48% | 0.475 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 177.7 | -65.3 | -70 | 0 | 0 | 0 | 112 | P2 W4 T9 Y10 V11 | P2-Y7 HydrophobicContact CB-CD2 4.49Å; P2-Y7 HydrophobicContact CB-CE2 3.74Å; P2-Y7 HydrophobicContact CG-CE2 3.92Å; P2-Y7 WeakPolarHBondContact CG-OH 3.11Å; W4-Y7 PolarHBondContact O-N 2.99Å; Y7-T9 VanDerWaalsContact C-N 3.31Å; Y7-T9 PolarHBondContact O-N 2.87Å; Y7-Y10 HydrophobicContact CD1-CD2 4.33Å; Y7-Y10 PolarHBondContact O-N 3.28Å; Y7-V11 WeakPolarHBondContact O-CG2 3.02Å; Y7-V11 PolarHBondContact O-N 3.3Å |
| 8 | F | 92.4 | Very high | 86.5 | Confident | 59 Ų | 59 | 51.6 Ų | 51.6 | 26% | 0.259 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -57.3 | -45.2 | 172.3 | 172.5 | -93.2 | 0 | 0 | 0 | 111.2 | W4 R5 V11 S12 L197 F200 | W4-F8 HydrophobicContact CE3-CB 3.89Å; W4-F8 HydrophobicContact CE3-CG 4.41Å; W4-F8 HydrophobicContact CZ3-CB 3.94Å; W4-F8 HydrophobicContact CZ3-CD1 4.48Å; W4-F8 HydrophobicContact CZ3-CD2 4.25Å; W4-F8 AromaticContact CZ3-CG 3.96Å; W4-F8 HydrophobicContact CZ3-CG 3.96Å; W4-F8 WeakPolarHBondContact O-CB 3.39Å; W4-F8 PolarHBondContact O-N 3.47Å; R5-F8 PolarHBondContact O-N 3.28Å; F8-V11 PolarHBondContact O-N 3.2Å; F8-S12 WeakPolarHBondContact CE1-OG 3.3Å; F8-S12 WeakPolarHBondContact CZ-OG 3.2Å; F8-S12 WeakPolarHBondContact O-CB 3.45Å; F8-S12 PolarHBondContact O-N 3.46Å; F8-S12 PolarHBondContact O-OG 3.43Å; F8-L197 HydrophobicContact CE2-CD2 3.87Å; F8-L197 HydrophobicContact CZ-CD2 3.93Å; F8-F200 HydrophobicContact CE1-CB 3.81Å; F8-F200 HydrophobicContact CZ-CB 4.04Å; F8-F200 HydrophobicContact CZ-CD2 4.47Å |
| 9 | T | 93.3 | Very high | 87.1 | Confident | 3 Ų | 3 | 50.1 Ų | 50.1 | 2% | 0.018 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -66 | -39.8 | 177.5 | -59.7 | 0 | 0 | 0 | 0 | 111.6 | R5 L6 Y7 S12 I13 I141 C201 | R5-T9 WeakPolarHBondContact O-CB 3.35Å; R5-T9 PolarHBondContact O-N 3.03Å; R5-T9 PolarHBondContact O-OG1 3.45Å; L6-T9 PolarHBondContact O-N 2.93Å; Y7-T9 VanDerWaalsContact C-N 3.31Å; Y7-T9 PolarHBondContact O-N 2.87Å; T9-S12 PolarHBondContact O-N 3.27Å; T9-I13 HydrophobicContact CG2-CD1 3.7Å; T9-I13 HydrophobicContact CG2-CG1 4.24Å; T9-I13 WeakPolarHBondContact O-CB 3.29Å; T9-I13 WeakPolarHBondContact O-CD1 3.45Å; T9-I13 WeakPolarHBondContact O-CG1 3.4Å; T9-I13 PolarHBondContact O-N 3.23Å; T9-I141 HydrophobicContact CG2-CD1 3.46Å; T9-I141 VanDerWaalsContact CG2-CD1 3.46Å; T9-C201 HydrophobicContact CG2-CB 4.1Å |
| 10 | Y | 92.2 | Very high | 87.5 | Confident | 16 Ų | 16 | 47.6 Ų | 47.6 | 6% | 0.063 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -58.7 | -49 | 173.5 | -69.7 | -26.1 | 0 | 0 | 0 | 113 | L6 Y7 I13 T14 L138 I141 A142 A150 | L6-Y10 HydrophobicContact CD1-CE1 3.95Å; L6-Y10 HydrophobicContact CD1-CE2 4.15Å; L6-Y10 HydrophobicContact CD2-CE2 4.07Å; L6-Y10 HydrophobicContact CG-CD2 4.31Å; L6-Y10 HydrophobicContact CG-CE1 4.44Å; L6-Y10 HydrophobicContact CG-CE2 3.76Å; L6-Y10 PolarHBondContact O-N 3.15Å; Y7-Y10 HydrophobicContact CD1-CD2 4.33Å; Y7-Y10 PolarHBondContact O-N 3.28Å; Y10-I13 PolarHBondContact O-N 3.46Å; Y10-T14 WeakPolarHBondContact O-CG2 3.27Å; Y10-T14 PolarHBondContact O-N 3.18Å; Y10-T14 VanDerWaalsContact O-N 3.09Å; Y10-T14 PolarHBondContact O-OG1 2.82Å; Y10-L138 HydrophobicContact CD1-CD2 3.43Å; Y10-L138 VanDerWaalsContact CD1-CD2 3.43Å; Y10-L138 HydrophobicContact CE1-CD2 4.06Å; Y10-L138 HydrophobicContact CG-CD2 4.25Å; Y10-I141 HydrophobicContact CD1-CD1 3.67Å; Y10-I141 HydrophobicContact CD1-CG1 4.14Å; Y10-I141 HydrophobicContact CE1-CD1 3.64Å; Y10-I141 HydrophobicContact CE1-CG1 3.57Å; Y10-A142 WeakPolarHBondContact OH-CA 3.4Å; Y10-A142 WeakPolarHBondContact OH-CB 3.4Å; Y10-A150 HydrophobicContact CE1-CB 4.43Å |
| 11 | V | 92.4 | Very high | 87.8 | Confident | 77 Ų | 77 | 46.3 Ų | 46.3 | 47% | 0.467 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -64.5 | -45.2 | 178.3 | 173.4 | 0 | 0 | 0 | 0 | 110.4 | Y7 F8 I13 T14 I15 | Y7-V11 WeakPolarHBondContact O-CG2 3.02Å; Y7-V11 PolarHBondContact O-N 3.3Å; F8-V11 PolarHBondContact O-N 3.2Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.27Å; V11-T14 PolarHBondContact O-N 2.93Å; V11-T14 PolarHBondContact O-OG1 3.33Å; V11-I15 WeakPolarHBondContact O-CB 3.43Å; V11-I15 WeakPolarHBondContact O-CG2 3.45Å; V11-I15 PolarHBondContact O-N 3.04Å |
| 12 | S | 94 | Very high | 90.2 | Very high | 1 Ų | 1 | 35.2 Ų | 35.2 | 1% | 0.007 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -60.4 | -40.4 | 179 | -60.5 | 0 | 0 | 0 | 0 | 112.1 | F8 T9 I15 H194 C201 | F8-S12 WeakPolarHBondContact CE1-OG 3.3Å; F8-S12 WeakPolarHBondContact CZ-OG 3.2Å; F8-S12 WeakPolarHBondContact O-CB 3.45Å; F8-S12 PolarHBondContact O-N 3.46Å; F8-S12 PolarHBondContact O-OG 3.43Å; T9-S12 PolarHBondContact O-N 3.27Å; S12-I15 WeakPolarHBondContact O-CG2 3.33Å; S12-H194 PolarHBondContact O-CE1 3.42Å; S12-H194 PolarHBondContact O-ND1 2.91Å; S12-C201 VanDerWaalsContact CB-SG 3.51Å |
| 13 | I | 94.5 | Very high | 92 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.2 | -54.2 | 176 | -71.1 | 163.1 | 0 | 0 | 0 | 109.9 | T9 Y10 V11 S17 L90 T134 Y137 L138 I141 H194 M198 | T9-I13 HydrophobicContact CG2-CD1 3.7Å; T9-I13 HydrophobicContact CG2-CG1 4.24Å; T9-I13 WeakPolarHBondContact O-CB 3.29Å; T9-I13 WeakPolarHBondContact O-CD1 3.45Å; T9-I13 WeakPolarHBondContact O-CG1 3.4Å; T9-I13 PolarHBondContact O-N 3.23Å; Y10-I13 PolarHBondContact O-N 3.46Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.27Å; I13-S17 WeakPolarHBondContact O-CB 3.43Å; I13-S17 PolarHBondContact O-OG 2.72Å; I13-L90 HydrophobicContact CG1-CD1 4.3Å; I13-L90 HydrophobicContact CG2-CD1 3.96Å; I13-T134 HydrophobicContact CG2-CG2 3.7Å; I13-Y137 HydrophobicContact CD1-CD1 3.34Å; I13-Y137 HydrophobicContact CD1-CD2 4.37Å; I13-Y137 HydrophobicContact CD1-CE1 3.39Å; I13-Y137 HydrophobicContact CD1-CE2 4.41Å; I13-Y137 HydrophobicContact CD1-CG 3.83Å; I13-Y137 HydrophobicContact CG1-CD1 3.6Å; I13-Y137 HydrophobicContact CG1-CE1 3.55Å; I13-Y137 HydrophobicContact CG2-CD1 4.48Å; I13-L138 HydrophobicContact CB-CD2 4.14Å; I13-L138 HydrophobicContact CD1-CD2 3.86Å; I13-L138 HydrophobicContact CG2-CD2 4.02Å; I13-L138 HydrophobicContact CG2-CG 4.12Å; I13-I141 HydrophobicContact CD1-CD1 3.62Å; I13-H194 PolarHBondContact O-CE1 3.04Å; I13-M198 HydrophobicContact CG1-SD 4.3Å |
| 14 | T | 94.1 | Very high | 92.8 | Very high | 4 Ų | 4 | 31.1 Ų | 31.1 | 3% | 0.025 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -74 | -30.4 | -167.4 | 51.3 | 0 | 0 | 0 | 0 | 114.3 | Y10 V11 G16 S17 S18 F19 T134 L138 M153 V157 | Y10-T14 WeakPolarHBondContact O-CG2 3.27Å; Y10-T14 PolarHBondContact O-N 3.18Å; Y10-T14 VanDerWaalsContact O-N 3.09Å; Y10-T14 PolarHBondContact O-OG1 2.82Å; V11-T14 PolarHBondContact O-N 2.93Å; V11-T14 PolarHBondContact O-OG1 3.33Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.49Å; T14-S17 WeakPolarHBondContact CA-OG 3.34Å; T14-S17 PolarHBondContact O-N 3.24Å; T14-S18 PolarHBondContact O-N 3.21Å; T14-F19 PolarHBondContact O-N 3.43Å; T14-F19 VanDerWaalsContact O-N 3.09Å; T14-T134 HydrophobicContact CG2-CG2 4.41Å; T14-L138 HydrophobicContact CG2-CD1 3.82Å; T14-L138 HydrophobicContact CG2-CD2 4.32Å; T14-M153 HydrophobicContact CG2-CG 4.05Å; T14-V157 HydrophobicContact CG2-CG2 4.46Å |
| 15 | I | 92.8 | Very high | 92.9 | Very high | 44 Ų | 44 | 23.1 Ų | 23.1 | 23% | 0.226 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.4 | -31.6 | -177.8 | -165.3 | 170.9 | 0 | 0 | 0 | 114 | V11 S12 F19 V190 L193 H194 L197 | V11-I15 WeakPolarHBondContact O-CB 3.43Å; V11-I15 WeakPolarHBondContact O-CG2 3.45Å; V11-I15 PolarHBondContact O-N 3.04Å; S12-I15 WeakPolarHBondContact O-CG2 3.33Å; I15-F19 WeakPolarHBondContact O-CB 3.34Å; I15-V190 HydrophobicContact CG1-CG1 4.14Å; I15-V190 WeakPolarHBondContact O-CG1 3.31Å; I15-L193 HydrophobicContact CD1-CD2 3.91Å; I15-H194 HydrophobicContact CG2-CB 4.28Å; I15-L197 HydrophobicContact CG2-CD1 3.94Å |
| 16 | G | 88.6 | Confident | 92.9 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 9% | 0.087 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -105 | 1.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | T14 V20 Y130 H194 | T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.49Å; G16-V20 WeakPolarHBondContact O-CG2 3.28Å; G16-Y130 WeakPolarHBondContact O-CE2 3.37Å; G16-H194 VanDerWaalsContact CA-CG 3.43Å |
| 17 | S | 94.5 | Very high | 93 | Very high | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 9% | 0.086 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -123.1 | -77 | -173.2 | 62 | 0 | 0 | 0 | 0 | 111.2 | I13 T14 F19 V20 F21 T134 | I13-S17 WeakPolarHBondContact O-CB 3.43Å; I13-S17 PolarHBondContact O-OG 2.72Å; T14-S17 WeakPolarHBondContact CA-OG 3.34Å; T14-S17 PolarHBondContact O-N 3.24Å; S17-F19 PolarHBondContact O-N 3.29Å; S17-V20 PolarHBondContact O-N 2.95Å; S17-V20 VanDerWaalsContact O-N 3.08Å; S17-F21 PolarHBondContact O-N 2.99Å; S17-F21 VanDerWaalsContact O-N 3.17Å; S17-T134 WeakPolarHBondContact CB-OG1 3.3Å; S17-T134 PolarHBondContact OG-OG1 3.46Å; S17-T134 VanDerWaalsContact OG-OG1 3.14Å |
| 18 | S | 94.3 | Very high | 93 | Very high | 2 Ų | 2 | 12.4 Ų | 12.4 | 1% | 0.014 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -54.7 | -38.1 | 175.5 | -43.2 | 0 | 0 | 0 | 0 | 112.3 | T14 G22 N154 T158 | T14-S18 PolarHBondContact O-N 3.21Å; S18-G22 PolarHBondContact O-N 2.82Å; S18-N154 VanDerWaalsContact CB-OD1 3.26Å; S18-N154 WeakPolarHBondContact CB-OD1 3.27Å; S18-N154 PolarHBondContact OG-OD1 3.08Å; S18-T158 PolarHBondContact O-OG1 2.93Å; S18-T158 VanDerWaalsContact O-OG1 3.11Å |
| 19 | F | 96.1 | Very high | 92.5 | Very high | 23 Ų | 23 | 10 Ų | 10 | 10% | 0.101 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -63 | -48.2 | 176.4 | -178.3 | -87.8 | 0 | 0 | 0 | 111.5 | T14 I15 S17 F21 G22 Y23 V157 A161 L164 V190 | T14-F19 PolarHBondContact O-N 3.43Å; T14-F19 VanDerWaalsContact O-N 3.09Å; I15-F19 WeakPolarHBondContact O-CB 3.34Å; S17-F19 PolarHBondContact O-N 3.29Å; F19-F21 VanDerWaalsContact C-N 3.3Å; F19-F21 PolarHBondContact O-N 3.33Å; F19-G22 PolarHBondContact O-N 3.19Å; F19-Y23 AromaticContact CE1-CD2 3.93Å; F19-Y23 HydrophobicContact CE1-CD2 3.93Å; F19-Y23 AromaticContact CE1-CG 4Å; F19-Y23 HydrophobicContact CE1-CG 4Å; F19-Y23 AromaticContact CZ-CD2 3.71Å; F19-Y23 HydrophobicContact CZ-CD2 3.71Å; F19-Y23 HydrophobicContact CZ-CE2 4.35Å; F19-Y23 HydrophobicContact CZ-CG 4.25Å; F19-Y23 WeakPolarHBondContact O-CB 3.08Å; F19-Y23 PolarHBondContact O-N 3.46Å; F19-V157 HydrophobicContact CB-CG1 3.97Å; F19-A161 HydrophobicContact CB-CB 4.37Å; F19-A161 HydrophobicContact CD2-CB 3.54Å; F19-A161 HydrophobicContact CE2-CB 3.9Å; F19-A161 HydrophobicContact CG-CB 3.98Å; F19-A161 WeakPolarHBondContact O-CB 3.29Å; F19-L164 HydrophobicContact CE2-CD2 3.81Å; F19-L164 HydrophobicContact CZ-CD2 3.98Å; F19-V190 HydrophobicContact CD1-CB 4.43Å; F19-V190 HydrophobicContact CD1-CG1 3.75Å; F19-V190 HydrophobicContact CE1-CB 4.29Å; F19-V190 HydrophobicContact CE1-CG1 3.99Å; F19-V190 HydrophobicContact CE1-CG2 3.92Å; F19-V190 HydrophobicContact CG-CG1 4.34Å; F19-V190 HydrophobicContact CZ-CG2 4.38Å |
| 20 | V | 96.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 11.4 Ų | 11.4 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -59.7 | -44.8 | -179.1 | 174.5 | 0 | 0 | 0 | 0 | 110.3 | G16 S17 H24 T97 V123 Y130 C187 C191 | G16-V20 WeakPolarHBondContact O-CG2 3.28Å; S17-V20 PolarHBondContact O-N 2.95Å; S17-V20 VanDerWaalsContact O-N 3.08Å; V20-H24 WeakPolarHBondContact O-CB 3.33Å; V20-H24 PolarHBondContact O-CD2 3.12Å; V20-H24 PolarHBondContact O-N 2.98Å; V20-T97 HydrophobicContact CG1-CG2 3.69Å; V20-T97 HydrophobicContact CG2-CG2 3.98Å; V20-V123 HydrophobicContact CG1-CG1 3.79Å; V20-Y130 HydrophobicContact CB-CD2 4.33Å; V20-Y130 HydrophobicContact CB-CE2 4.24Å; V20-Y130 HydrophobicContact CG1-CE2 4.31Å; V20-Y130 HydrophobicContact CG2-CE2 4.33Å; V20-C187 HydrophobicContact CG2-CB 4.32Å; V20-C191 VanDerWaalsContact CG2-SG 3.53Å |
| 21 | F | 93.9 | Very high | 91.9 | Very high | 21 Ų | 21 | 10.7 Ų | 10.7 | 9% | 0.092 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -60.2 | -52.4 | 176.4 | 171.5 | -118.8 | 0 | 0 | 0 | 111.9 | S17 F19 T25 F66 A127 T131 T158 W410 | S17-F21 PolarHBondContact O-N 2.99Å; S17-F21 VanDerWaalsContact O-N 3.17Å; F19-F21 VanDerWaalsContact C-N 3.3Å; F19-F21 PolarHBondContact O-N 3.33Å; F21-T25 WeakPolarHBondContact O-CB 3.26Å; F21-T25 PolarHBondContact O-N 3.35Å; F21-T25 VanDerWaalsContact O-N 3.12Å; F21-T25 PolarHBondContact O-OG1 2.87Å; F21-F66 HydrophobicContact CD2-CZ 4.17Å; F21-A127 HydrophobicContact CB-CB 4.29Å; F21-A127 HydrophobicContact CD2-CB 4.41Å; F21-T131 HydrophobicContact CD1-CG2 4.1Å; F21-T131 HydrophobicContact CD2-CG2 4.14Å; F21-T131 HydrophobicContact CE1-CG2 4.33Å; F21-T131 HydrophobicContact CE2-CG2 4.37Å; F21-T131 HydrophobicContact CG-CG2 4Å; F21-T131 HydrophobicContact CZ-CG2 4.46Å; F21-T158 HydrophobicContact CD1-CG2 3.65Å; F21-T158 HydrophobicContact CE1-CG2 3.78Å; F21-W410 AromaticContact CD2-CH2 3.66Å; F21-W410 HydrophobicContact CD2-CH2 3.66Å; F21-W410 AromaticContact CD2-CZ2 3.95Å; F21-W410 HydrophobicContact CD2-CZ2 3.95Å; F21-W410 AromaticContact CE2-CH2 3.4Å; F21-W410 HydrophobicContact CE2-CH2 3.4Å; F21-W410 VanDerWaalsContact CE2-CH2 3.4Å; F21-W410 AromaticContact CE2-CZ2 3.76Å; F21-W410 HydrophobicContact CE2-CZ2 3.76Å; F21-W410 HydrophobicContact CE2-CZ3 4.25Å |
| 22 | G | 94.3 | Very high | 91.7 | Very high | 0 Ų | 0 | 8.4 Ų | 8.4 | 0% | 0 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -64.3 | -43.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | S18 F19 T25 G26 T158 I162 | S18-G22 PolarHBondContact O-N 2.82Å; F19-G22 PolarHBondContact O-N 3.19Å; G22-T25 WeakPolarHBondContact O-CB 3.18Å; G22-T25 PolarHBondContact O-N 2.89Å; G22-G26 PolarHBondContact O-N 3.27Å; G22-T158 WeakPolarHBondContact CA-O 3.5Å; G22-I162 WeakPolarHBondContact O-CG1 3.32Å |
| 23 | Y | 95.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -62 | -51.3 | -179.7 | -167.8 | -92 | 0 | 0 | 0 | 110.9 | F19 T25 G26 V27 L168 L183 L186 | F19-Y23 AromaticContact CE1-CD2 3.93Å; F19-Y23 HydrophobicContact CE1-CD2 3.93Å; F19-Y23 AromaticContact CE1-CG 4Å; F19-Y23 HydrophobicContact CE1-CG 4Å; F19-Y23 AromaticContact CZ-CD2 3.71Å; F19-Y23 HydrophobicContact CZ-CD2 3.71Å; F19-Y23 HydrophobicContact CZ-CE2 4.35Å; F19-Y23 HydrophobicContact CZ-CG 4.25Å; F19-Y23 WeakPolarHBondContact O-CB 3.08Å; F19-Y23 PolarHBondContact O-N 3.46Å; Y23-T25 PolarHBondContact O-N 3.27Å; Y23-G26 PolarHBondContact O-N 2.79Å; Y23-V27 HydrophobicContact CD1-CB 4.13Å; Y23-V27 HydrophobicContact CD1-CG1 4.25Å; Y23-V27 HydrophobicContact CD1-CG2 4.41Å; Y23-V27 HydrophobicContact CE1-CB 3.95Å; Y23-V27 HydrophobicContact CE1-CG1 4.3Å; Y23-V27 HydrophobicContact CE1-CG2 3.72Å; Y23-V27 WeakPolarHBondContact O-CB 3.47Å; Y23-V27 WeakPolarHBondContact O-CG1 3.46Å; Y23-V27 PolarHBondContact O-N 3.41Å; Y23-L168 HydrophobicContact CE2-CD1 4.21Å; Y23-L183 WeakPolarHBondContact CE1-O 3.24Å; Y23-L183 VanDerWaalsContact OH-CD1 3.32Å; Y23-L183 WeakPolarHBondContact OH-CD1 3.37Å; Y23-L183 PolarHBondContact OH-O 2.7Å; Y23-L186 HydrophobicContact CE1-CB 4.05Å; Y23-L186 HydrophobicContact CE2-CD2 3.8Å; Y23-L186 VanDerWaalsContact OH-CD2 3.26Å; Y23-L186 WeakPolarHBondContact OH-CD2 3.33Å |
| 24 | H | 93.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 12.3 Ų | 12.3 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -68.7 | -20.4 | 178.6 | -82.1 | -85.2 | 0 | 0 | 0 | 114.6 | V20 F66 R120 V123 L184 C187 | V20-H24 WeakPolarHBondContact O-CB 3.33Å; V20-H24 PolarHBondContact O-CD2 3.12Å; V20-H24 PolarHBondContact O-N 2.98Å; H24-F66 HydrophobicContact CB-CD2 3.83Å; H24-F66 HydrophobicContact CB-CE1 4.23Å; H24-F66 HydrophobicContact CB-CE2 3.36Å; H24-F66 HydrophobicContact CB-CG 4.45Å; H24-F66 HydrophobicContact CB-CZ 3.58Å; H24-R120 PolarHBondContact O-NH1 2.97Å; H24-V123 VanDerWaalsContact CD2-CG1 3.47Å; H24-V123 WeakPolarHBondContact CD2-CG1 3.26Å; H24-L184 PolarHBondContact CE1-O 2.94Å; H24-C187 PolarHBondContact CD2-SG 3.06Å; H24-C187 PolarHBondContact NE2-SG 3.08Å |
| 25 | T | 90.2 | Very high | 91 | Very high | 5 Ų | 5 | 12.2 Ų | 12.2 | 3% | 0.031 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -71.5 | -46.1 | 171.4 | -62.8 | 0 | 0 | 0 | 0 | 110.8 | F21 G22 Y23 I162 L285 Y286 | F21-T25 WeakPolarHBondContact O-CB 3.26Å; F21-T25 PolarHBondContact O-N 3.35Å; F21-T25 VanDerWaalsContact O-N 3.12Å; F21-T25 PolarHBondContact O-OG1 2.87Å; G22-T25 WeakPolarHBondContact O-CB 3.18Å; G22-T25 PolarHBondContact O-N 2.89Å; Y23-T25 PolarHBondContact O-N 3.27Å; T25-I162 HydrophobicContact CG2-CD1 4.31Å; T25-L285 HydrophobicContact CG2-CD1 4.23Å; T25-Y286 HydrophobicContact CG2-CE1 3.63Å; T25-Y286 WeakPolarHBondContact O-CD1 3.22Å; T25-Y286 WeakPolarHBondContact O-CE1 3.36Å |
| 26 | G | 88.9 | Confident | 90.8 | Very high | 2 Ų | 2 | 14.5 Ų | 14.5 | 2% | 0.021 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -84.8 | -35 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115 | G22 Y23 I28 S165 | G22-G26 PolarHBondContact O-N 3.27Å; Y23-G26 PolarHBondContact O-N 2.79Å; G26-I28 VanDerWaalsContact C-N 3.3Å; G26-I28 PolarHBondContact O-N 3.44Å; G26-S165 WeakPolarHBondContact CA-OG 3.31Å |
| 27 | V | 92.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 11% | 0.108 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.5 | -28.3 | -167.1 | 71.5 | 0 | 0 | 0 | 0 | 113.7 | Y23 N29 P31 S165 L183 L184 | Y23-V27 HydrophobicContact CD1-CB 4.13Å; Y23-V27 HydrophobicContact CD1-CG1 4.25Å; Y23-V27 HydrophobicContact CD1-CG2 4.41Å; Y23-V27 HydrophobicContact CE1-CB 3.95Å; Y23-V27 HydrophobicContact CE1-CG1 4.3Å; Y23-V27 HydrophobicContact CE1-CG2 3.72Å; Y23-V27 WeakPolarHBondContact O-CB 3.47Å; Y23-V27 WeakPolarHBondContact O-CG1 3.46Å; Y23-V27 PolarHBondContact O-N 3.41Å; V27-N29 PolarHBondContact O-N 3.31Å; V27-P31 WeakPolarHBondContact O-CD 3.49Å; V27-S165 PolarHBondContact N-OG 2.88Å; V27-S165 VanDerWaalsContact N-OG 3.13Å; V27-L183 HydrophobicContact CG2-CD1 3.97Å; V27-L183 HydrophobicContact CG2-CD2 3.93Å; V27-L183 HydrophobicContact CG2-CG 3.53Å; V27-L184 HydrophobicContact CB-CD2 4.38Å; V27-L184 HydrophobicContact CG1-CD2 3.52Å; V27-L184 HydrophobicContact CG2-CD2 4.03Å |
| 28 | I | 87.9 | Confident | 90.9 | Very high | 3 Ų | 3 | 20.4 Ų | 20.4 | 2% | 0.015 | 11% | 0.113 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -22.6 | -170.7 | -167.1 | 57.2 | 0 | 0 | 0 | 113.2 | G26 P31 L32 I35 V63 L184 Y286 | G26-I28 VanDerWaalsContact C-N 3.3Å; G26-I28 PolarHBondContact O-N 3.44Å; I28-P31 WeakPolarHBondContact O-CD 3.47Å; I28-L32 PolarHBondContact O-N 2.93Å; I28-I35 HydrophobicContact CD1-CD1 3.92Å; I28-V63 HydrophobicContact CG1-CG2 3.87Å; I28-L184 HydrophobicContact CD1-CD2 4.41Å; I28-Y286 HydrophobicContact CG2-CD1 4.36Å |
| 29 | N | 82.6 | Confident | 90.8 | Very high | 8 Ų | 8 | 20.3 Ų | 20.3 | 4% | 0.043 | 11% | 0.112 | C | C | . | . | S | Bend | trans | -66.5 | -47.1 | -176.4 | -169.4 | -27.5 | 0 | 0 | 0 | 111.6 | V27 L32 L285 S288 V289 | V27-N29 PolarHBondContact O-N 3.31Å; N29-L32 WeakPolarHBondContact O-CB 3.4Å; N29-L32 PolarHBondContact O-N 3.44Å; N29-L285 PolarHBondContact ND2-O 3.48Å; N29-S288 PolarHBondContact ND2-N 3.39Å; N29-S288 PolarHBondContact ND2-OG 3.43Å; N29-V289 WeakPolarHBondContact OD1-CB 3.12Å; N29-V289 WeakPolarHBondContact OD1-CG2 2.97Å |
| 30 | A | 85 | Confident | 90.6 | Very high | 34 Ų | 34 | 22.1 Ų | 22.1 | 28% | 0.281 | 12% | 0.121 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63 | -50.3 | -177 | 0 | 0 | 0 | 0 | 0 | 114.8 | L32 G169 L183 | A30-L32 VanDerWaalsContact C-N 3.28Å; A30-L32 PolarHBondContact O-N 3.47Å; A30-G169 VanDerWaalsContact CB-O 3.25Å; A30-G169 WeakPolarHBondContact CB-O 3.4Å; A30-L183 HydrophobicContact CB-CD2 4.45Å |
| 31 | P | 88.9 | Confident | 90.3 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 15% | 0.147 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | 8.9 | -178.9 | 37.6 | -38.1 | 0 | 0 | 0 | 113.4 | V27 I28 S33 L34 I35 W180 L183 L184 | V27-P31 WeakPolarHBondContact O-CD 3.49Å; I28-P31 WeakPolarHBondContact O-CD 3.47Å; P31-S33 PolarHBondContact O-N 3.45Å; P31-L34 HydrophobicContact CB-CD1 4.46Å; P31-L34 WeakPolarHBondContact O-CB 3.35Å; P31-L34 PolarHBondContact O-N 2.97Å; P31-L34 VanDerWaalsContact O-N 3.09Å; P31-I35 HydrophobicContact CB-CD1 4.05Å; P31-I35 HydrophobicContact CB-CG1 4.26Å; P31-I35 HydrophobicContact CG-CD1 3.9Å; P31-I35 VanDerWaalsContact O-CG1 3.25Å; P31-I35 WeakPolarHBondContact O-CG1 3.38Å; P31-I35 PolarHBondContact O-N 3.35Å; P31-W180 HydrophobicContact CB-CB 3.71Å; P31-W180 HydrophobicContact CB-CG 4.37Å; P31-L183 HydrophobicContact CG-CD2 4.35Å; P31-L184 HydrophobicContact CG-CD2 4.33Å; P31-L184 HydrophobicContact CG-CG 4.44Å |
| 32 | L | 86.5 | Confident | 90.3 | Very high | 30 Ų | 30 | 27.4 Ų | 27.4 | 16% | 0.157 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -57.3 | -46 | -171.1 | -170.1 | 67.9 | 0 | 0 | 0 | 112.6 | I28 N29 A30 Q36 M59 V63 Y287 | I28-L32 PolarHBondContact O-N 2.93Å; N29-L32 WeakPolarHBondContact O-CB 3.4Å; N29-L32 PolarHBondContact O-N 3.44Å; A30-L32 VanDerWaalsContact C-N 3.28Å; A30-L32 PolarHBondContact O-N 3.47Å; L32-Q36 WeakPolarHBondContact O-CB 3.44Å; L32-Q36 PolarHBondContact O-N 2.94Å; L32-M59 HydrophobicContact CD1-CE 3.55Å; L32-M59 HydrophobicContact CG-CE 4.23Å; L32-M59 VanDerWaalsContact O-CE 3.3Å; L32-M59 WeakPolarHBondContact O-CE 3.4Å; L32-V63 HydrophobicContact CD1-CG2 3.9Å; L32-Y287 HydrophobicContact CD2-CD1 4.45Å |
| 33 | S | 85.7 | Confident | 90.2 | Very high | 61 Ų | 61 | 27.6 Ų | 27.6 | 43% | 0.427 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -67.9 | -37 | 176.7 | 55.2 | 0 | 0 | 0 | 0 | 112.6 | P31 Q36 N37 | P31-S33 PolarHBondContact O-N 3.45Å; S33-Q36 WeakPolarHBondContact O-CB 3.48Å; S33-Q36 PolarHBondContact O-N 3.46Å; S33-N37 VanDerWaalsContact O-CG 3.3Å; S33-N37 PolarHBondContact O-N 2.89Å; S33-N37 PolarHBondContact O-ND2 2.98Å |
| 34 | L | 91 | Very high | 89.9 | Confident | 22 Ų | 22 | 31.5 Ų | 31.5 | 12% | 0.115 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -66 | -43.6 | 177.5 | -55.2 | 176.4 | 0 | 0 | 0 | 111.3 | P31 Q36 N37 F38 D177 W180 | P31-L34 HydrophobicContact CB-CD1 4.46Å; P31-L34 WeakPolarHBondContact O-CB 3.35Å; P31-L34 PolarHBondContact O-N 2.97Å; P31-L34 VanDerWaalsContact O-N 3.09Å; L34-Q36 VanDerWaalsContact C-N 3.32Å; L34-N37 PolarHBondContact O-N 2.96Å; L34-F38 WeakPolarHBondContact O-CB 3.41Å; L34-F38 PolarHBondContact O-N 2.75Å; L34-D177 WeakPolarHBondContact CD2-OD1 3.16Å; L34-W180 HydrophobicContact CB-CG 4.23Å; L34-W180 HydrophobicContact CD1-CB 3.89Å; L34-W180 HydrophobicContact CD1-CG 4.24Å |
| 35 | I | 91.1 | Very high | 89.7 | Confident | 1 Ų | 1 | 35.7 Ų | 35.7 | 1% | 0.005 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -64.2 | -41.1 | 175.2 | -63.6 | 163.7 | 0 | 0 | 0 | 109.7 | I28 P31 N37 F38 T39 M59 I116 W180 L184 | I28-I35 HydrophobicContact CD1-CD1 3.92Å; P31-I35 HydrophobicContact CB-CD1 4.05Å; P31-I35 HydrophobicContact CB-CG1 4.26Å; P31-I35 HydrophobicContact CG-CD1 3.9Å; P31-I35 VanDerWaalsContact O-CG1 3.25Å; P31-I35 WeakPolarHBondContact O-CG1 3.38Å; P31-I35 PolarHBondContact O-N 3.35Å; I35-N37 PolarHBondContact O-N 2.9Å; I35-F38 PolarHBondContact O-N 3.22Å; I35-T39 WeakPolarHBondContact O-CB 3.24Å; I35-T39 PolarHBondContact O-N 3Å; I35-T39 PolarHBondContact O-OG1 3.03Å; I35-T39 VanDerWaalsContact O-OG1 3.08Å; I35-M59 HydrophobicContact CB-CE 3.85Å; I35-M59 HydrophobicContact CB-SD 4.35Å; I35-M59 HydrophobicContact CG2-CE 3.68Å; I35-M59 HydrophobicContact CG2-SD 3.73Å; I35-I116 HydrophobicContact CG2-CD1 4.02Å; I35-W180 HydrophobicContact CD1-CE3 4.27Å; I35-W180 HydrophobicContact CD1-CZ3 4.31Å; I35-W180 HydrophobicContact CG1-CD2 4.23Å; I35-W180 HydrophobicContact CG1-CE3 3.69Å; I35-W180 HydrophobicContact CG1-CH2 4.19Å; I35-W180 HydrophobicContact CG1-CZ3 3.69Å; I35-L184 HydrophobicContact CD1-CD1 3.96Å |
| 36 | Q | 89.9 | Confident | 89.8 | Confident | 92 Ų | 92 | 39.6 Ų | 39.6 | 43% | 0.43 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -59.5 | -46.4 | 176 | -176.9 | 177.1 | -20 | 0 | 0 | 111.9 | L32 S33 L34 T39 Q40 V55 M59 | L32-Q36 WeakPolarHBondContact O-CB 3.44Å; L32-Q36 PolarHBondContact O-N 2.94Å; S33-Q36 WeakPolarHBondContact O-CB 3.48Å; S33-Q36 PolarHBondContact O-N 3.46Å; L34-Q36 VanDerWaalsContact C-N 3.32Å; Q36-T39 PolarHBondContact O-N 2.92Å; Q36-Q40 PolarHBondContact O-N 3.03Å; Q36-V55 HydrophobicContact CG-CG1 3.74Å; Q36-M59 VanDerWaalsContact CA-SD 3.57Å; Q36-M59 HydrophobicContact CB-CE 4.19Å; Q36-M59 HydrophobicContact CB-CG 4.1Å; Q36-M59 HydrophobicContact CB-SD 3.99Å; Q36-M59 HydrophobicContact CG-CG 4.19Å |
| 37 | N | 91.1 | Very high | 89.7 | Confident | 99 Ų | 99 | 47.6 Ų | 47.6 | 53% | 0.529 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.5 | -42.3 | 176.6 | -69.7 | -18.4 | 0 | 0 | 0 | 111.8 | S33 L34 I35 Q40 K41 | S33-N37 VanDerWaalsContact O-CG 3.3Å; S33-N37 PolarHBondContact O-N 2.89Å; S33-N37 PolarHBondContact O-ND2 2.98Å; L34-N37 PolarHBondContact O-N 2.96Å; I35-N37 PolarHBondContact O-N 2.9Å; N37-Q40 PolarHBondContact O-N 2.81Å; N37-K41 WeakPolarHBondContact O-CB 3.22Å; N37-K41 PolarHBondContact O-N 3.01Å |
| 38 | F | 93.1 | Very high | 89.3 | Confident | 25 Ų | 25 | 55 Ų | 55 | 11% | 0.11 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -60.6 | -45.8 | 174.7 | 169.9 | -103.1 | 0 | 0 | 0 | 111.9 | L34 I35 Q40 K41 V42 V108 F113 I116 W180 | L34-F38 WeakPolarHBondContact O-CB 3.41Å; L34-F38 PolarHBondContact O-N 2.75Å; I35-F38 PolarHBondContact O-N 3.22Å; F38-Q40 PolarHBondContact O-N 2.7Å; F38-K41 PolarHBondContact O-N 3.05Å; F38-V42 HydrophobicContact CD1-CG2 4.49Å; F38-V42 HydrophobicContact CD2-CG2 4.17Å; F38-V42 HydrophobicContact CE1-CG2 4.03Å; F38-V42 HydrophobicContact CE2-CG2 3.67Å; F38-V42 HydrophobicContact CZ-CG2 3.6Å; F38-V42 WeakPolarHBondContact O-CG2 2.94Å; F38-V42 PolarHBondContact O-N 2.85Å; F38-V108 HydrophobicContact CD2-CG2 4.32Å; F38-V108 HydrophobicContact CE2-CB 4.33Å; F38-V108 HydrophobicContact CE2-CG1 4.44Å; F38-V108 HydrophobicContact CE2-CG2 4.05Å; F38-V108 HydrophobicContact CZ-CG2 4.43Å; F38-F113 HydrophobicContact CE1-CB 4.3Å; F38-I116 HydrophobicContact CD1-CD1 3.87Å; F38-I116 HydrophobicContact CE1-CD1 3.79Å; F38-W180 HydrophobicContact CB-CZ2 4.18Å; F38-W180 HydrophobicContact CD1-CH2 4.26Å; F38-W180 HydrophobicContact CD1-CZ2 4.1Å; F38-W180 HydrophobicContact CD2-CZ2 4.41Å; F38-W180 AromaticContact CG-CZ2 3.96Å; F38-W180 HydrophobicContact CG-CZ2 3.96Å |
| 39 | T | 92.3 | Very high | 88.9 | Confident | 0 Ų | 0 | 62.1 Ų | 62.1 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -60 | -45.6 | 177.5 | -69.4 | 0 | 0 | 0 | 0 | 111.3 | I35 Q36 V42 I43 V55 I58 F113 | I35-T39 WeakPolarHBondContact O-CB 3.24Å; I35-T39 PolarHBondContact O-N 3Å; I35-T39 PolarHBondContact O-OG1 3.03Å; I35-T39 VanDerWaalsContact O-OG1 3.08Å; Q36-T39 PolarHBondContact O-N 2.92Å; T39-V42 PolarHBondContact O-N 3.16Å; T39-I43 HydrophobicContact CG2-CD1 3.92Å; T39-I43 VanDerWaalsContact O-CG1 3.29Å; T39-I43 WeakPolarHBondContact O-CG1 3.33Å; T39-I43 PolarHBondContact O-N 3.4Å; T39-V55 HydrophobicContact CG2-CG1 4.43Å; T39-I58 HydrophobicContact CG2-CB 4.3Å; T39-I58 HydrophobicContact CG2-CD1 4.33Å; T39-I58 HydrophobicContact CG2-CG2 3.73Å; T39-F113 HydrophobicContact CG2-CB 4.39Å; T39-F113 HydrophobicContact CG2-CD1 4.27Å; T39-F113 HydrophobicContact CG2-CG 4.22Å |
| 40 | Q | 91.6 | Very high | 88.7 | Confident | 62 Ų | 62 | 62.7 Ų | 62.7 | 29% | 0.29 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -59.6 | -48.3 | 175.3 | -175.4 | 67 | 62.2 | 0 | 0 | 111.1 | Q36 N37 F38 V42 I43 D44 V55 | Q36-Q40 PolarHBondContact O-N 3.03Å; N37-Q40 PolarHBondContact O-N 2.81Å; F38-Q40 PolarHBondContact O-N 2.7Å; Q40-V42 VanDerWaalsContact C-N 3.33Å; Q40-V42 PolarHBondContact O-N 3.15Å; Q40-I43 WeakPolarHBondContact O-CB 3.44Å; Q40-I43 PolarHBondContact O-N 3.29Å; Q40-I43 VanDerWaalsContact O-N 3.11Å; Q40-D44 PolarHBondContact NE2-OD1 3.2Å; Q40-D44 PolarHBondContact O-N 3.33Å; Q40-V55 VanDerWaalsContact OE1-CG2 3.31Å |
| 41 | K | 91.8 | Very high | 88.6 | Confident | 127 Ų | 127 | 63.5 Ų | 63.5 | 55% | 0.552 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -58 | -43.5 | 179 | -176.5 | 178.9 | 178.7 | 178.8 | 0 | 112.5 | N37 F38 I43 D44 E45 | N37-K41 WeakPolarHBondContact O-CB 3.22Å; N37-K41 PolarHBondContact O-N 3.01Å; F38-K41 PolarHBondContact O-N 3.05Å; K41-I43 VanDerWaalsContact C-N 3.34Å; K41-D44 PolarHBondContact O-N 3.09Å; K41-E45 VanDerWaalsContact CE-OE1 3.24Å; K41-E45 WeakPolarHBondContact CE-OE1 3.28Å; K41-E45 WeakPolarHBondContact O-CB 3.23Å; K41-E45 WeakPolarHBondContact O-CG 3.48Å; K41-E45 PolarHBondContact O-N 3.2Å |
| 42 | V | 92.5 | Very high | 88.1 | Confident | 4 Ų | 4 | 67.6 Ų | 67.6 | 2% | 0.024 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.9 | -39.7 | 177.4 | 170.5 | 0 | 0 | 0 | 0 | 111.3 | F38 T39 Q40 R46 K111 F113 | F38-V42 HydrophobicContact CD1-CG2 4.49Å; F38-V42 HydrophobicContact CD2-CG2 4.17Å; F38-V42 HydrophobicContact CE1-CG2 4.03Å; F38-V42 HydrophobicContact CE2-CG2 3.67Å; F38-V42 HydrophobicContact CZ-CG2 3.6Å; F38-V42 WeakPolarHBondContact O-CG2 2.94Å; F38-V42 PolarHBondContact O-N 2.85Å; T39-V42 PolarHBondContact O-N 3.16Å; Q40-V42 VanDerWaalsContact C-N 3.33Å; Q40-V42 PolarHBondContact O-N 3.15Å; V42-R46 WeakPolarHBondContact O-CB 3.49Å; V42-R46 VanDerWaalsContact O-CG 3.25Å; V42-R46 WeakPolarHBondContact O-CG 3.42Å; V42-R46 PolarHBondContact O-N 3.04Å; V42-K111 VanDerWaalsContact CG1-O 3.22Å; V42-K111 WeakPolarHBondContact CG1-O 3.42Å; V42-F113 HydrophobicContact CB-CD1 4.17Å; V42-F113 HydrophobicContact CG1-CD1 3.74Å; V42-F113 HydrophobicContact CG1-CE1 4.12Å |
| 43 | I | 91.5 | Very high | 87.9 | Confident | 4 Ų | 4 | 69.7 Ų | 69.7 | 2% | 0.021 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.7 | -45.6 | 176.8 | -74.7 | 171.2 | 0 | 0 | 0 | 111.2 | T39 Q40 K41 R46 Q47 Y48 C50 V55 I58 F113 | T39-I43 HydrophobicContact CG2-CD1 3.92Å; T39-I43 VanDerWaalsContact O-CG1 3.29Å; T39-I43 WeakPolarHBondContact O-CG1 3.33Å; T39-I43 PolarHBondContact O-N 3.4Å; Q40-I43 WeakPolarHBondContact O-CB 3.44Å; Q40-I43 PolarHBondContact O-N 3.29Å; Q40-I43 VanDerWaalsContact O-N 3.11Å; K41-I43 VanDerWaalsContact C-N 3.34Å; I43-R46 CarbonylContact O-C 3.48Å; I43-R46 PolarHBondContact O-N 3.5Å; I43-R46 VanDerWaalsContact O-N 3.15Å; I43-Q47 PolarHBondContact O-N 2.87Å; I43-Q47 VanDerWaalsContact O-N 3.1Å; I43-Y48 WeakPolarHBondContact CG2-O 3.41Å; I43-Y48 PolarHBondContact O-N 2.88Å; I43-C50 HydrophobicContact CD1-CB 3.97Å; I43-C50 HydrophobicContact CG2-CB 3.71Å; I43-V55 HydrophobicContact CD1-CG2 4.23Å; I43-I58 HydrophobicContact CD1-CD1 3.64Å; I43-F113 HydrophobicContact CG1-CE1 3.92Å |
| 44 | D | 90.4 | Very high | 87.9 | Confident | 83 Ų | 83 | 69.4 Ų | 69.4 | 44% | 0.444 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -63.5 | -43.8 | 178.7 | -62.3 | -18.8 | 0 | 0 | 0 | 110.9 | Q40 K41 R46 Q47 | Q40-D44 PolarHBondContact NE2-OD1 3.2Å; Q40-D44 PolarHBondContact O-N 3.33Å; K41-D44 PolarHBondContact O-N 3.09Å; D44-R46 PolarHBondContact O-N 3.28Å; D44-Q47 PolarHBondContact O-N 2.97Å; D44-Q47 PolarHBondContact O-NE2 3.23Å |
| 45 | E | 90.5 | Very high | 87.5 | Confident | 88 Ų | 88 | 68.5 Ų | 68.5 | 41% | 0.411 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.1 | -32.8 | 174.8 | -76.9 | -175.4 | -163.7 | 0 | 0 | 112.4 | K41 Q47 K111 | K41-E45 VanDerWaalsContact CE-OE1 3.24Å; K41-E45 WeakPolarHBondContact CE-OE1 3.28Å; K41-E45 WeakPolarHBondContact O-CB 3.23Å; K41-E45 WeakPolarHBondContact O-CG 3.48Å; K41-E45 PolarHBondContact O-N 3.2Å; E45-Q47 VanDerWaalsContact C-N 3.32Å; E45-K111 IonicContact OE1-NZ 2.74Å; E45-K111 WeakPolarHBondContact OE2-CD 3.49Å; E45-K111 WeakPolarHBondContact OE2-CE 3.45Å; E45-K111 IonicContact OE2-NZ 2.72Å; E45-K111 PolarHBondContact OE2-NZ 3.23Å |
| 46 | R | 91.2 | Very high | 87 | Confident | 87 Ų | 87 | 74.1 Ų | 74.1 | 33% | 0.328 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | 1.7 | 176.8 | -66.9 | 178.4 | -172 | -179.6 | 6.9 | 114 | V42 I43 D44 Y48 K111 E114 | V42-R46 WeakPolarHBondContact O-CB 3.49Å; V42-R46 VanDerWaalsContact O-CG 3.25Å; V42-R46 WeakPolarHBondContact O-CG 3.42Å; V42-R46 PolarHBondContact O-N 3.04Å; I43-R46 CarbonylContact O-C 3.48Å; I43-R46 PolarHBondContact O-N 3.5Å; I43-R46 VanDerWaalsContact O-N 3.15Å; D44-R46 PolarHBondContact O-N 3.28Å; R46-Y48 HydrophobicContact CB-CD2 3.52Å; R46-Y48 HydrophobicContact CB-CE2 3.65Å; R46-Y48 HydrophobicContact CG-CE2 4.41Å; R46-Y48 PolarHBondContact O-N 2.91Å; R46-K111 PolarHBondContact NH2-O 2.97Å; R46-E114 IonicContact CZ-OE1 3.58Å; R46-E114 IonicContact CZ-OE2 3.83Å; R46-E114 IonicContact NH1-OE1 3.32Å; R46-E114 PolarHBondContact NH1-OE1 3.28Å; R46-E114 IonicContact NH1-OE2 3.52Å; R46-E114 PolarHBondContact NH1-OE2 3.29Å; R46-E114 IonicContact NH2-OE1 2.89Å; R46-E114 IonicContact NH2-OE2 3.62Å; R46-E114 PolarHBondContact NH2-OE2 3.4Å |
| 47 | Q | 86.1 | Confident | 86.8 | Confident | 169 Ų | 169 | 73.5 Ų | 73.5 | 79% | 0.79 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58 | 31.5 | 178 | -55.9 | -68.8 | -63.3 | 0 | 0 | 113.9 | I43 D44 E45 | I43-Q47 PolarHBondContact O-N 2.87Å; I43-Q47 VanDerWaalsContact O-N 3.1Å; D44-Q47 PolarHBondContact O-N 2.97Å; D44-Q47 PolarHBondContact O-NE2 3.23Å; E45-Q47 VanDerWaalsContact C-N 3.32Å |
| 48 | Y | 84.5 | Confident | 86.5 | Confident | 157 Ų | 157 | 69.9 Ų | 69.9 | 62% | 0.616 | 37% | 0.368 | S | S | * | . | trans | -89.3 | 138.5 | 173.7 | -68.7 | -61.6 | 0 | 0 | 0 | 111.3 | I43 R46 C50 | I43-Y48 WeakPolarHBondContact CG2-O 3.41Å; I43-Y48 PolarHBondContact O-N 2.88Å; R46-Y48 HydrophobicContact CB-CD2 3.52Å; R46-Y48 HydrophobicContact CB-CE2 3.65Å; R46-Y48 HydrophobicContact CG-CE2 4.41Å; R46-Y48 PolarHBondContact O-N 2.91Å; Y48-C50 PolarHBondContact O-N 3.32Å | ||
| 49 | T | 79.8 | Confident | 86.1 | Confident | 152 Ų | 152 | 69.3 Ų | 69.3 | 93% | 0.933 | 37% | 0.366 | S | S | * | . | trans | -81.6 | 97.4 | 173 | 46.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 50 | C | 78.6 | Confident | 85.6 | Confident | 20 Ų | 20 | 70 Ų | 70 | 14% | 0.135 | 37% | 0.371 | C | S | . | . | trans | -124.1 | 113.7 | 176 | -176.7 | 0 | 0 | 0 | 0 | 109.5 | I43 Y48 C54 V55 | I43-C50 HydrophobicContact CD1-CB 3.97Å; I43-C50 HydrophobicContact CG2-CB 3.71Å; Y48-C50 PolarHBondContact O-N 3.32Å; C50-C54 HydrophobicContact CB-CB 4.05Å; C50-C54 WeakPolarHBondContact CB-SG 3.21Å; C50-C54 VanDerWaalsContact SG-C 3.52Å; C50-C54 WeakPolarHBondContact SG-CB 3.4Å; C50-C54 CovalentContact SG-SG 2.03Å; C50-C54 PolarHBondContact SG-SG 3.36Å; C50-V55 PolarHBondContact SG-N 3.49Å; C50-V55 VanDerWaalsContact SG-N 3.39Å | ||
| 51 | G | 81.9 | Confident | 85.3 | Confident | 50 Ų | 50 | 70.5 Ų | 70.5 | 52% | 0.515 | 38% | 0.375 | S | S | . | . | trans | -73.6 | 175 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | S53 C54 V55 | G51-S53 PolarHBondContact O-N 2.75Å; G51-C54 WeakPolarHBondContact O-CB 3.39Å; G51-C54 PolarHBondContact O-N 2.92Å; G51-V55 PolarHBondContact O-N 2.83Å; G51-V55 VanDerWaalsContact O-N 3.17Å | ||
| 52 | S | 80.2 | Confident | 85 | Confident | 87 Ų | 87 | 64.5 Ų | 64.5 | 61% | 0.608 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -55.4 | -35.6 | -179.6 | 59 | 0 | 0 | 0 | 0 | 113.9 | R56 | S52-R56 WeakPolarHBondContact O-CB 3.45Å; S52-R56 PolarHBondContact O-N 2.93Å |
| 53 | S | 81.6 | Confident | 84.5 | Confident | 74 Ų | 74 | 64.5 Ų | 64.5 | 52% | 0.517 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.6 | -40 | 174.7 | -60 | 0 | 0 | 0 | 0 | 112.6 | G51 R56 V57 | G51-S53 PolarHBondContact O-N 2.75Å; S53-R56 PolarHBondContact O-N 2.92Å; S53-V57 WeakPolarHBondContact O-CG2 3.49Å; S53-V57 PolarHBondContact O-N 3.38Å |
| 54 | C | 84.4 | Confident | 84.2 | Confident | 55 Ų | 55 | 64.4 Ų | 64.4 | 37% | 0.372 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.9 | -43.7 | 179 | 157.9 | 0 | 0 | 0 | 0 | 110.6 | C50 G51 R56 V57 I58 | C50-C54 HydrophobicContact CB-CB 4.05Å; C50-C54 WeakPolarHBondContact CB-SG 3.21Å; C50-C54 VanDerWaalsContact SG-C 3.52Å; C50-C54 WeakPolarHBondContact SG-CB 3.4Å; C50-C54 CovalentContact SG-SG 2.03Å; C50-C54 PolarHBondContact SG-SG 3.36Å; G51-C54 WeakPolarHBondContact O-CB 3.39Å; G51-C54 PolarHBondContact O-N 2.92Å; C54-R56 VanDerWaalsContact C-N 3.34Å; C54-R56 PolarHBondContact O-N 2.94Å; C54-V57 PolarHBondContact O-N 3.1Å; C54-V57 VanDerWaalsContact O-N 3.16Å; C54-I58 WeakPolarHBondContact O-CG1 3.45Å; C54-I58 PolarHBondContact O-N 3.42Å |
| 55 | V | 84.4 | Confident | 84.3 | Confident | 2 Ų | 2 | 60.7 Ų | 60.7 | 1% | 0.012 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60.6 | -42.6 | 173.5 | 176.7 | 0 | 0 | 0 | 0 | 111.5 | Q36 T39 Q40 I43 C50 G51 V57 I58 M59 | Q36-V55 HydrophobicContact CG-CG1 3.74Å; T39-V55 HydrophobicContact CG2-CG1 4.43Å; Q40-V55 VanDerWaalsContact OE1-CG2 3.31Å; I43-V55 HydrophobicContact CD1-CG2 4.23Å; C50-V55 PolarHBondContact SG-N 3.49Å; C50-V55 VanDerWaalsContact SG-N 3.39Å; G51-V55 PolarHBondContact O-N 2.83Å; G51-V55 VanDerWaalsContact O-N 3.17Å; V55-V57 VanDerWaalsContact C-N 3.29Å; V55-V57 PolarHBondContact O-N 3.05Å; V55-I58 PolarHBondContact O-N 3.25Å; V55-M59 HydrophobicContact CG1-CG 4.29Å; V55-M59 WeakPolarHBondContact O-CB 3.47Å; V55-M59 VanDerWaalsContact O-CG 3.3Å; V55-M59 WeakPolarHBondContact O-CG 3.42Å; V55-M59 PolarHBondContact O-N 3.29Å |
| 56 | R | 80.8 | Confident | 84.4 | Confident | 119 Ų | 119 | 56.6 Ų | 56.6 | 45% | 0.449 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.3 | -38 | 176.4 | -167.2 | -173.1 | -56.2 | 138 | 5.4 | 112.5 | S52 S53 C54 M59 S60 | S52-R56 WeakPolarHBondContact O-CB 3.45Å; S52-R56 PolarHBondContact O-N 2.93Å; S53-R56 PolarHBondContact O-N 2.92Å; C54-R56 VanDerWaalsContact C-N 3.34Å; C54-R56 PolarHBondContact O-N 2.94Å; R56-M59 PolarHBondContact O-N 3.37Å; R56-S60 WeakPolarHBondContact O-CB 3.33Å; R56-S60 PolarHBondContact O-N 2.87Å; R56-S60 PolarHBondContact O-OG 2.99Å |
| 57 | V | 83.9 | Confident | 84.4 | Confident | 79 Ų | 79 | 52.5 Ų | 52.5 | 48% | 0.479 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66.7 | -46.3 | 175.2 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | S53 C54 V55 M59 S60 I61 | S53-V57 WeakPolarHBondContact O-CG2 3.49Å; S53-V57 PolarHBondContact O-N 3.38Å; C54-V57 PolarHBondContact O-N 3.1Å; C54-V57 VanDerWaalsContact O-N 3.16Å; V55-V57 VanDerWaalsContact C-N 3.29Å; V55-V57 PolarHBondContact O-N 3.05Å; V57-M59 VanDerWaalsContact C-N 3.29Å; V57-M59 PolarHBondContact O-N 3.17Å; V57-S60 WeakPolarHBondContact O-CB 3.37Å; V57-S60 PolarHBondContact O-N 3.45Å; V57-S60 VanDerWaalsContact O-N 3.13Å; V57-I61 HydrophobicContact CG1-CD1 3.87Å; V57-I61 HydrophobicContact CG1-CG1 4.48Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 3.24Å |
| 58 | I | 86.2 | Confident | 84.8 | Confident | 24 Ų | 24 | 47.1 Ų | 47.1 | 12% | 0.123 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -58.1 | -44.6 | 175.7 | -64.9 | 167.6 | 0 | 0 | 0 | 110.4 | T39 I43 C54 V55 S60 I61 C62 F113 I117 | T39-I58 HydrophobicContact CG2-CB 4.3Å; T39-I58 HydrophobicContact CG2-CD1 4.33Å; T39-I58 HydrophobicContact CG2-CG2 3.73Å; I43-I58 HydrophobicContact CD1-CD1 3.64Å; C54-I58 WeakPolarHBondContact O-CG1 3.45Å; C54-I58 PolarHBondContact O-N 3.42Å; V55-I58 PolarHBondContact O-N 3.25Å; I58-S60 PolarHBondContact O-N 2.93Å; I58-I61 PolarHBondContact O-N 3.05Å; I58-C62 PolarHBondContact O-N 3.25Å; I58-C62 PolarHBondContact O-SG 3.44Å; I58-C62 VanDerWaalsContact O-SG 3.33Å; I58-F113 HydrophobicContact CD1-CE2 4.3Å; I58-F113 HydrophobicContact CD1-CZ 4.3Å; I58-F113 HydrophobicContact CG2-CD2 3.66Å; I58-F113 HydrophobicContact CG2-CE2 3.89Å; I58-F113 HydrophobicContact CG2-CG 4.36Å; I58-I117 HydrophobicContact CG2-CD1 4.49Å |
| 59 | M | 84.1 | Confident | 85.4 | Confident | 12 Ų | 12 | 39.6 Ų | 39.6 | 6% | 0.059 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.7 | -42.1 | 176.1 | -72.2 | -52.9 | -61.4 | 0 | 0 | 112.6 | L32 I35 Q36 V55 R56 V57 I61 C62 V63 | L32-M59 HydrophobicContact CD1-CE 3.55Å; L32-M59 HydrophobicContact CG-CE 4.23Å; L32-M59 VanDerWaalsContact O-CE 3.3Å; L32-M59 WeakPolarHBondContact O-CE 3.4Å; I35-M59 HydrophobicContact CB-CE 3.85Å; I35-M59 HydrophobicContact CB-SD 4.35Å; I35-M59 HydrophobicContact CG2-CE 3.68Å; I35-M59 HydrophobicContact CG2-SD 3.73Å; Q36-M59 VanDerWaalsContact CA-SD 3.57Å; Q36-M59 HydrophobicContact CB-CE 4.19Å; Q36-M59 HydrophobicContact CB-CG 4.1Å; Q36-M59 HydrophobicContact CB-SD 3.99Å; Q36-M59 HydrophobicContact CG-CG 4.19Å; V55-M59 HydrophobicContact CG1-CG 4.29Å; V55-M59 WeakPolarHBondContact O-CB 3.47Å; V55-M59 VanDerWaalsContact O-CG 3.3Å; V55-M59 WeakPolarHBondContact O-CG 3.42Å; V55-M59 PolarHBondContact O-N 3.29Å; R56-M59 PolarHBondContact O-N 3.37Å; V57-M59 VanDerWaalsContact C-N 3.29Å; V57-M59 PolarHBondContact O-N 3.17Å; M59-I61 VanDerWaalsContact C-N 3.32Å; M59-I61 PolarHBondContact O-N 3.06Å; M59-C62 WeakPolarHBondContact O-CB 3.37Å; M59-C62 PolarHBondContact O-N 3.27Å; M59-V63 WeakPolarHBondContact O-CG2 3.3Å; M59-V63 PolarHBondContact O-N 3.11Å |
| 60 | S | 81.6 | Confident | 86.1 | Confident | 15 Ų | 15 | 32.4 Ų | 32.4 | 11% | 0.105 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.9 | -44.3 | 175.2 | -56.4 | 0 | 0 | 0 | 0 | 110.4 | R56 V57 I58 C62 V63 T64 | R56-S60 WeakPolarHBondContact O-CB 3.33Å; R56-S60 PolarHBondContact O-N 2.87Å; R56-S60 PolarHBondContact O-OG 2.99Å; V57-S60 WeakPolarHBondContact O-CB 3.37Å; V57-S60 PolarHBondContact O-N 3.45Å; V57-S60 VanDerWaalsContact O-N 3.13Å; I58-S60 PolarHBondContact O-N 2.93Å; S60-C62 PolarHBondContact O-N 3.49Å; S60-V63 PolarHBondContact O-N 3.47Å; S60-T64 WeakPolarHBondContact O-CG2 3.42Å; S60-T64 PolarHBondContact O-N 3.27Å; S60-T64 PolarHBondContact O-OG1 3.4Å |
| 61 | I | 86.2 | Confident | 86.8 | Confident | 73 Ų | 73 | 32.9 Ų | 32.9 | 37% | 0.374 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -62.9 | -40.1 | 175.9 | -65.5 | 166.3 | 0 | 0 | 0 | 111.6 | V57 I58 M59 V63 T64 G65 I117 | V57-I61 HydrophobicContact CG1-CD1 3.87Å; V57-I61 HydrophobicContact CG1-CG1 4.48Å; V57-I61 WeakPolarHBondContact O-CG1 3.41Å; V57-I61 PolarHBondContact O-N 3.24Å; I58-I61 PolarHBondContact O-N 3.05Å; M59-I61 VanDerWaalsContact C-N 3.32Å; M59-I61 PolarHBondContact O-N 3.06Å; I61-V63 VanDerWaalsContact C-N 3.35Å; I61-V63 PolarHBondContact O-N 3.09Å; I61-T64 PolarHBondContact O-N 2.84Å; I61-G65 WeakPolarHBondContact O-CA 3.32Å; I61-G65 PolarHBondContact O-N 2.82Å; I61-I117 HydrophobicContact CG2-CD1 4Å; I61-I117 HydrophobicContact CG2-CG1 4.33Å; I61-I117 HydrophobicContact CG2-CG2 3.9Å |
| 62 | C | 85.1 | Confident | 87.3 | Confident | 1 Ų | 1 | 34.9 Ų | 34.9 | 1% | 0.007 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.6 | -44.4 | 174.3 | -72.4 | 0 | 0 | 0 | 0 | 111.9 | I58 M59 S60 I117 R120 | I58-C62 PolarHBondContact O-N 3.25Å; I58-C62 PolarHBondContact O-SG 3.44Å; I58-C62 VanDerWaalsContact O-SG 3.33Å; M59-C62 WeakPolarHBondContact O-CB 3.37Å; M59-C62 PolarHBondContact O-N 3.27Å; S60-C62 PolarHBondContact O-N 3.49Å; C62-I117 HydrophobicContact CB-CG1 4.38Å; C62-I117 WeakPolarHBondContact SG-CG1 3.49Å; C62-R120 PolarHBondContact O-NE 3.32Å |
| 63 | V | 81.4 | Confident | 88 | Confident | 4 Ų | 4 | 30.8 Ų | 30.8 | 2% | 0.024 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -66.8 | -49.7 | 176.5 | 177.5 | 0 | 0 | 0 | 0 | 109.7 | I28 L32 M59 S60 I61 G65 R120 | I28-V63 HydrophobicContact CG1-CG2 3.87Å; L32-V63 HydrophobicContact CD1-CG2 3.9Å; M59-V63 WeakPolarHBondContact O-CG2 3.3Å; M59-V63 PolarHBondContact O-N 3.11Å; S60-V63 PolarHBondContact O-N 3.47Å; I61-V63 VanDerWaalsContact C-N 3.35Å; I61-V63 PolarHBondContact O-N 3.09Å; V63-G65 VanDerWaalsContact C-N 3.35Å; V63-G65 PolarHBondContact O-N 3.07Å; V63-R120 PolarHBondContact O-NH2 3.31Å |
| 64 | T | 85.7 | Confident | 88.3 | Confident | 2 Ų | 2 | 27.2 Ų | 27.2 | 1% | 0.012 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -77.8 | -17.5 | -173.9 | 59.3 | 0 | 0 | 0 | 0 | 114.1 | S60 I61 F66 V67 I68 L418 | S60-T64 WeakPolarHBondContact O-CG2 3.42Å; S60-T64 PolarHBondContact O-N 3.27Å; S60-T64 PolarHBondContact O-OG1 3.4Å; I61-T64 PolarHBondContact O-N 2.84Å; T64-F66 PolarHBondContact O-N 3.47Å; T64-V67 WeakPolarHBondContact O-CA 3.42Å; T64-V67 PolarHBondContact O-N 3.19Å; T64-I68 WeakPolarHBondContact O-CG1 3.48Å; T64-I68 PolarHBondContact O-N 3.17Å; T64-L418 HydrophobicContact CG2-CD2 3.51Å; T64-L418 HydrophobicContact CG2-CG 3.81Å |
| 65 | G | 91.6 | Very high | 88.4 | Confident | 5 Ų | 5 | 28.5 Ų | 28.5 | 5% | 0.052 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -54.2 | -40.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | I61 V63 V67 I68 G69 F121 | I61-G65 WeakPolarHBondContact O-CA 3.32Å; I61-G65 PolarHBondContact O-N 2.82Å; V63-G65 VanDerWaalsContact C-N 3.35Å; V63-G65 PolarHBondContact O-N 3.07Å; G65-V67 PolarHBondContact O-N 3.25Å; G65-I68 PolarHBondContact O-N 3.47Å; G65-G69 PolarHBondContact O-N 3.16Å; G65-F121 VanDerWaalsContact O-CA 3.31Å; G65-F121 WeakPolarHBondContact O-CA 3.01Å |
| 66 | F | 93.4 | Very high | 88.5 | Confident | 1 Ų | 1 | 33.7 Ų | 33.7 | 0% | 0.004 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61 | -42.5 | 172.9 | 171.4 | -103.4 | 0 | 0 | 0 | 112.8 | F21 H24 T64 G69 G70 R120 V123 G124 A127 W410 | F21-F66 HydrophobicContact CD2-CZ 4.17Å; H24-F66 HydrophobicContact CB-CD2 3.83Å; H24-F66 HydrophobicContact CB-CE1 4.23Å; H24-F66 HydrophobicContact CB-CE2 3.36Å; H24-F66 HydrophobicContact CB-CG 4.45Å; H24-F66 HydrophobicContact CB-CZ 3.58Å; T64-F66 PolarHBondContact O-N 3.47Å; F66-G69 PolarHBondContact O-N 2.85Å; F66-G70 PolarHBondContact O-N 3.15Å; F66-R120 VanDerWaalsContact CA-O 3.3Å; F66-R120 WeakPolarHBondContact CA-O 3.37Å; F66-R120 HydrophobicContact CB-CB 4.29Å; F66-V123 HydrophobicContact CD2-CG1 4.49Å; F66-V123 HydrophobicContact CE2-CG1 4.28Å; F66-G124 VanDerWaalsContact CD2-CA 3.42Å; F66-G124 WeakPolarHBondContact O-CA 3.39Å; F66-A127 HydrophobicContact CE2-CB 3.57Å; F66-A127 HydrophobicContact CZ-CB 3.7Å; F66-W410 HydrophobicContact CE1-CH2 4.22Å; F66-W410 HydrophobicContact CE1-CZ3 4.3Å; F66-W410 HydrophobicContact CZ-CH2 4.38Å |
| 67 | V | 92.1 | Very high | 88.8 | Confident | 1 Ų | 1 | 28 Ų | 28 | 1% | 0.006 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -73.4 | -37.7 | -177.5 | -165.2 | 0 | 0 | 0 | 0 | 111.3 | T64 G65 G70 L71 W410 N413 I414 | T64-V67 WeakPolarHBondContact O-CA 3.42Å; T64-V67 PolarHBondContact O-N 3.19Å; G65-V67 PolarHBondContact O-N 3.25Å; V67-G70 CarbonylContact O-C 3.56Å; V67-G70 WeakPolarHBondContact O-CA 3.02Å; V67-G70 PolarHBondContact O-N 3.34Å; V67-G70 VanDerWaalsContact O-N 3.15Å; V67-L71 PolarHBondContact O-N 2.78Å; V67-W410 HydrophobicContact CG1-CE3 3.69Å; V67-W410 HydrophobicContact CG1-CZ3 4.03Å; V67-N413 HydrophobicContact CG1-CB 3.53Å; V67-N413 VanDerWaalsContact CG1-CG 3.46Å; V67-N413 VanDerWaalsContact CG1-OD1 3.31Å; V67-N413 WeakPolarHBondContact CG1-OD1 3.46Å; V67-I414 HydrophobicContact CB-CG1 4.03Å; V67-I414 HydrophobicContact CG1-CB 4.39Å; V67-I414 HydrophobicContact CG1-CG1 3.57Å |
| 68 | I | 93.9 | Very high | 88.6 | Confident | 56 Ų | 56 | 24.7 Ų | 24.7 | 29% | 0.287 | 13% | 0.125 | S | C | . | . | H | α-helix | trans | -62.8 | -46.6 | 173.4 | -64.2 | 166.3 | 0 | 0 | 0 | 110 | T64 G65 G70 L71 F72 F121 I414 | T64-I68 WeakPolarHBondContact O-CG1 3.48Å; T64-I68 PolarHBondContact O-N 3.17Å; G65-I68 PolarHBondContact O-N 3.47Å; I68-G70 VanDerWaalsContact C-N 3.26Å; I68-G70 PolarHBondContact O-N 3.27Å; I68-L71 WeakPolarHBondContact O-CB 3.31Å; I68-L71 PolarHBondContact O-N 2.86Å; I68-F72 HydrophobicContact CG2-CD2 4.28Å; I68-F72 HydrophobicContact CG2-CE2 3.98Å; I68-F72 VanDerWaalsContact O-CD2 3.29Å; I68-F72 WeakPolarHBondContact O-CD2 3.35Å; I68-F72 PolarHBondContact O-N 3.18Å; I68-F121 HydrophobicContact CG2-CD2 4.2Å; I68-F121 HydrophobicContact CG2-CE2 4.03Å; I68-I414 HydrophobicContact CG1-CD1 4.02Å; I68-I414 HydrophobicContact CG1-CG1 4.23Å; I68-I414 HydrophobicContact CG1-CG2 4.48Å |
| 69 | G | 96.2 | Very high | 88.4 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -55 | -46.6 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | G65 F66 L71 F72 G73 F121 G124 F125 | G65-G69 PolarHBondContact O-N 3.16Å; F66-G69 PolarHBondContact O-N 2.85Å; G69-L71 VanDerWaalsContact C-N 3.32Å; G69-L71 PolarHBondContact O-N 3.36Å; G69-F72 PolarHBondContact O-N 2.99Å; G69-G73 PolarHBondContact O-N 3.5Å; G69-F121 WeakPolarHBondContact CA-O 3.34Å; G69-G124 CarbonylContact C-O 3.58Å; G69-F125 VanDerWaalsContact C-N 3.3Å; G69-F125 WeakPolarHBondContact O-CA 3.4Å; G69-F125 PolarHBondContact O-N 3.02Å |
| 70 | G | 94.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -54.6 | -41.5 | 177 | 0 | 0 | 0 | 0 | 0 | 114.2 | F66 V67 I68 G73 G74 G124 G128 | F66-G70 PolarHBondContact O-N 3.15Å; V67-G70 CarbonylContact O-C 3.56Å; V67-G70 WeakPolarHBondContact O-CA 3.02Å; V67-G70 PolarHBondContact O-N 3.34Å; V67-G70 VanDerWaalsContact O-N 3.15Å; I68-G70 VanDerWaalsContact C-N 3.26Å; I68-G70 PolarHBondContact O-N 3.27Å; G70-G73 PolarHBondContact O-N 3.06Å; G70-G74 PolarHBondContact O-N 2.88Å; G70-G124 WeakPolarHBondContact CA-O 3.37Å; G70-G124 VanDerWaalsContact N-C 3.25Å; G70-G124 PolarHBondContact N-O 3.01Å; G70-G128 WeakPolarHBondContact O-CA 3.24Å |
| 71 | L | 93.6 | Very high | 88.9 | Confident | 31 Ų | 31 | 30.5 Ų | 30.5 | 16% | 0.162 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.1 | -53.8 | 174.9 | 174.3 | 62 | 0 | 0 | 0 | 111.8 | V67 I68 G69 G73 G74 L75 G407 W410 I414 | V67-L71 PolarHBondContact O-N 2.78Å; I68-L71 WeakPolarHBondContact O-CB 3.31Å; I68-L71 PolarHBondContact O-N 2.86Å; G69-L71 VanDerWaalsContact C-N 3.32Å; G69-L71 PolarHBondContact O-N 3.36Å; L71-G73 PolarHBondContact O-N 3.33Å; L71-G74 PolarHBondContact O-N 2.96Å; L71-L75 HydrophobicContact CD1-CD1 4.16Å; L71-L75 HydrophobicContact CD1-CG 4.41Å; L71-L75 HydrophobicContact CG-CD1 4.37Å; L71-L75 WeakPolarHBondContact O-CG 3.34Å; L71-L75 PolarHBondContact O-N 2.69Å; L71-L75 VanDerWaalsContact O-N 3.1Å; L71-G407 VanDerWaalsContact CD1-O 3.27Å; L71-G407 WeakPolarHBondContact CD1-O 3.44Å; L71-W410 HydrophobicContact CB-CB 3.93Å; L71-W410 HydrophobicContact CD1-CB 4.04Å; L71-I414 HydrophobicContact CB-CD1 3.99Å; L71-I414 HydrophobicContact CD2-CD1 3.75Å; L71-I414 HydrophobicContact CG-CD1 4.5Å |
| 72 | F | 93.7 | Very high | 88.8 | Confident | 92 Ų | 92 | 28.7 Ų | 28.7 | 40% | 0.404 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -62.1 | -46.6 | 178.8 | -71.6 | -73.2 | 0 | 0 | 0 | 110.8 | I68 G69 G74 L75 F76 F121 F125 | I68-F72 HydrophobicContact CG2-CD2 4.28Å; I68-F72 HydrophobicContact CG2-CE2 3.98Å; I68-F72 VanDerWaalsContact O-CD2 3.29Å; I68-F72 WeakPolarHBondContact O-CD2 3.35Å; I68-F72 PolarHBondContact O-N 3.18Å; G69-F72 PolarHBondContact O-N 2.99Å; F72-G74 VanDerWaalsContact C-N 3.32Å; F72-G74 PolarHBondContact O-N 3.34Å; F72-L75 PolarHBondContact O-N 3.39Å; F72-F76 HydrophobicContact CB-CD2 4.36Å; F72-F76 HydrophobicContact CB-CE2 4.4Å; F72-F76 HydrophobicContact CD1-CE2 4.2Å; F72-F76 WeakPolarHBondContact O-CD2 3.21Å; F72-F76 PolarHBondContact O-N 3.48Å; F72-F121 AromaticContact CD2-CE2 3.99Å; F72-F121 HydrophobicContact CD2-CE2 3.99Å; F72-F121 HydrophobicContact CD2-CZ 4.24Å; F72-F121 HydrophobicContact CE2-CE2 4.41Å; F72-F125 HydrophobicContact CB-CD2 4.14Å; F72-F125 HydrophobicContact CB-CE2 4.49Å |
| 73 | G | 92.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -52.2 | -48.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | G69 G70 L71 L75 F76 G77 F125 G128 A129 | G69-G73 PolarHBondContact O-N 3.5Å; G70-G73 PolarHBondContact O-N 3.06Å; L71-G73 PolarHBondContact O-N 3.33Å; G73-L75 PolarHBondContact O-N 3Å; G73-F76 PolarHBondContact O-N 3.32Å; G73-G77 WeakPolarHBondContact O-CA 3.36Å; G73-G77 PolarHBondContact O-N 3.44Å; G73-F125 WeakPolarHBondContact CA-O 3.47Å; G73-G128 VanDerWaalsContact C-C 3.46Å; G73-A129 WeakPolarHBondContact O-CA 3.44Å; G73-A129 WeakPolarHBondContact O-CB 3.37Å; G73-A129 PolarHBondContact O-N 3.26Å |
| 74 | G | 88.5 | Confident | 89.3 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.5 | -41.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G70 L71 F72 G128 V132 | G70-G74 PolarHBondContact O-N 2.88Å; L71-G74 PolarHBondContact O-N 2.96Å; F72-G74 VanDerWaalsContact C-N 3.32Å; F72-G74 PolarHBondContact O-N 3.34Å; G74-G128 WeakPolarHBondContact CA-O 3.27Å; G74-G128 VanDerWaalsContact N-C 3.3Å; G74-V132 WeakPolarHBondContact O-CG2 3.34Å |
| 75 | L | 86.7 | Confident | 89.6 | Confident | 82 Ų | 82 | 39.6 Ų | 39.6 | 43% | 0.429 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -67.3 | -36.9 | 177.2 | -66.3 | 173.3 | 0 | 0 | 0 | 112.6 | L71 F72 G73 | L71-L75 HydrophobicContact CD1-CD1 4.16Å; L71-L75 HydrophobicContact CD1-CG 4.41Å; L71-L75 HydrophobicContact CG-CD1 4.37Å; L71-L75 WeakPolarHBondContact O-CG 3.34Å; L71-L75 PolarHBondContact O-N 2.69Å; L71-L75 VanDerWaalsContact O-N 3.1Å; F72-L75 PolarHBondContact O-N 3.39Å; G73-L75 PolarHBondContact O-N 3Å |
| 76 | F | 87.2 | Confident | 89.6 | Confident | 111 Ų | 111 | 39.5 Ų | 39.5 | 49% | 0.487 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -86.2 | -21.9 | -179.3 | -71.8 | -69.7 | 0 | 0 | 0 | 114 | F72 G73 G78 F79 L80 F125 | F72-F76 HydrophobicContact CB-CD2 4.36Å; F72-F76 HydrophobicContact CB-CE2 4.4Å; F72-F76 HydrophobicContact CD1-CE2 4.2Å; F72-F76 WeakPolarHBondContact O-CD2 3.21Å; F72-F76 PolarHBondContact O-N 3.48Å; G73-F76 PolarHBondContact O-N 3.32Å; F76-G78 PolarHBondContact O-N 3.5Å; F76-F79 PolarHBondContact O-N 2.81Å; F76-L80 PolarHBondContact O-N 3.34Å; F76-F125 HydrophobicContact CB-CE2 4.39Å; F76-F125 HydrophobicContact CB-CZ 4.33Å; F76-F125 AromaticContact CD2-CE2 3.93Å; F76-F125 HydrophobicContact CD2-CE2 3.93Å; F76-F125 HydrophobicContact CG-CE2 4.49Å |
| 77 | G | 86 | Confident | 89.7 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.1 | -43.8 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | G73 L80 A81 V133 | G73-G77 WeakPolarHBondContact O-CA 3.36Å; G73-G77 PolarHBondContact O-N 3.44Å; G77-L80 PolarHBondContact O-N 3.46Å; G77-A81 WeakPolarHBondContact O-CB 3.4Å; G77-A81 PolarHBondContact O-N 3.35Å; G77-V133 WeakPolarHBondContact O-CG2 3.24Å |
| 78 | G | 79.7 | Confident | 89.8 | Confident | 8 Ų | 8 | 49.5 Ų | 49.5 | 8% | 0.082 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.8 | -45.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | F76 L80 A81 N82 | F76-G78 PolarHBondContact O-N 3.5Å; G78-L80 VanDerWaalsContact C-N 3.31Å; G78-L80 PolarHBondContact O-N 2.64Å; G78-A81 PolarHBondContact O-N 2.96Å; G78-N82 PolarHBondContact O-N 3.29Å |
| 79 | F | 83.1 | Confident | 89.8 | Confident | 125 Ų | 125 | 46.8 Ų | 46.8 | 55% | 0.548 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -58.2 | -44.5 | 175.5 | 174.2 | -98.9 | 0 | 0 | 0 | 111.8 | F76 N82 R83 | F76-F79 PolarHBondContact O-N 2.81Å; F79-N82 PolarHBondContact O-N 2.89Å; F79-R83 WeakPolarHBondContact O-CB 3.47Å; F79-R83 PolarHBondContact O-N 3.48Å |
| 80 | L | 87.8 | Confident | 89.8 | Confident | 45 Ų | 45 | 46.8 Ų | 46.8 | 24% | 0.236 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.8 | -44.5 | 179.6 | -166.3 | 59.7 | 0 | 0 | 0 | 111.3 | F76 G77 G78 N82 R83 L84 T89 L93 | F76-L80 PolarHBondContact O-N 3.34Å; G77-L80 PolarHBondContact O-N 3.46Å; G78-L80 VanDerWaalsContact C-N 3.31Å; G78-L80 PolarHBondContact O-N 2.64Å; L80-N82 VanDerWaalsContact C-N 3.35Å; L80-N82 PolarHBondContact O-N 3.18Å; L80-R83 PolarHBondContact O-N 3.19Å; L80-L84 HydrophobicContact CD1-CD1 3.35Å; L80-L84 HydrophobicContact CD1-CG 4.01Å; L80-L84 HydrophobicContact CG-CD1 4.09Å; L80-L84 WeakPolarHBondContact O-CB 3.42Å; L80-L84 PolarHBondContact O-N 3.44Å; L80-T89 VanDerWaalsContact C-OG1 3.28Å; L80-T89 HydrophobicContact CB-CG2 3.96Å; L80-T89 HydrophobicContact CD2-CG2 3.71Å; L80-T89 HydrophobicContact CG-CG2 3.66Å; L80-T89 PolarHBondContact O-OG1 3.43Å; L80-T89 VanDerWaalsContact O-OG1 3.09Å; L80-L93 HydrophobicContact CD2-CD2 4.23Å; L80-L93 HydrophobicContact CD2-CG 4.38Å |
| 81 | A | 88 | Confident | 89.8 | Confident | 4 Ų | 4 | 50.9 Ų | 50.9 | 3% | 0.033 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.3 | -36.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | G77 G78 G85 R86 T89 V133 | G77-A81 WeakPolarHBondContact O-CB 3.4Å; G77-A81 PolarHBondContact O-N 3.35Å; G78-A81 PolarHBondContact O-N 2.96Å; A81-G85 CarbonylContact O-C 3.52Å; A81-G85 WeakPolarHBondContact O-CA 3.47Å; A81-G85 PolarHBondContact O-N 2.84Å; A81-R86 PolarHBondContact O-NH1 2.9Å; A81-T89 WeakPolarHBondContact CA-OG1 3.06Å; A81-T89 PolarHBondContact N-OG1 3.36Å; A81-V133 HydrophobicContact CB-CB 4.49Å; A81-V133 HydrophobicContact CB-CG1 4.09Å; A81-V133 HydrophobicContact CB-CG2 3.82Å |
| 82 | N | 83.4 | Confident | 89.9 | Confident | 35 Ų | 35 | 53 Ų | 53 | 19% | 0.187 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -75.4 | -34.1 | 177.2 | -75.7 | -17.5 | 0 | 0 | 0 | 112.6 | G78 F79 L80 R86 Y207 D399 | G78-N82 PolarHBondContact O-N 3.29Å; F79-N82 PolarHBondContact O-N 2.89Å; L80-N82 VanDerWaalsContact C-N 3.35Å; L80-N82 PolarHBondContact O-N 3.18Å; N82-R86 PolarHBondContact OD1-NH1 3.44Å; N82-R86 PolarHBondContact OD1-NH2 3.38Å; N82-Y207 WeakPolarHBondContact O-CE2 3.4Å; N82-D399 PolarHBondContact ND2-OD2 3.3Å; N82-D399 PolarHBondContact OD1-OD2 2.99Å |
| 83 | R | 86.8 | Confident | 90 | Very high | 180 Ų | 180 | 48.9 Ų | 48.9 | 68% | 0.679 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -76.9 | -41.5 | 178 | -169.9 | 173.9 | -179.7 | 169.6 | 1 | 113.5 | F79 L80 | F79-R83 WeakPolarHBondContact O-CB 3.47Å; F79-R83 PolarHBondContact O-N 3.48Å; L80-R83 PolarHBondContact O-N 3.19Å |
| 84 | L | 91 | Very high | 90.1 | Very high | 56 Ų | 56 | 48.9 Ų | 48.9 | 29% | 0.293 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -107 | -14 | -169.9 | -58.8 | -176.3 | 0 | 0 | 0 | 114.2 | L80 K88 L92 | L80-L84 HydrophobicContact CD1-CD1 3.35Å; L80-L84 HydrophobicContact CD1-CG 4.01Å; L80-L84 HydrophobicContact CG-CD1 4.09Å; L80-L84 WeakPolarHBondContact O-CB 3.42Å; L80-L84 PolarHBondContact O-N 3.44Å; L84-K88 HydrophobicContact CB-CB 4.3Å; L84-K88 WeakPolarHBondContact O-CD 3.2Å; L84-L92 HydrophobicContact CD1-CD1 3.45Å; L84-L92 VanDerWaalsContact CD1-CD1 3.45Å |
| 85 | G | 91.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 24% | 0.243 | C | C | . | . | trans | 91.4 | 170.6 | -165.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A81 T89 E203 Y207 | A81-G85 CarbonylContact O-C 3.52Å; A81-G85 WeakPolarHBondContact O-CA 3.47Å; A81-G85 PolarHBondContact O-N 2.84Å; G85-T89 WeakPolarHBondContact O-CB 3.31Å; G85-T89 PolarHBondContact O-N 3.34Å; G85-T89 PolarHBondContact O-OG1 2.89Å; G85-E203 WeakPolarHBondContact CA-OE2 3.38Å; G85-Y207 VanDerWaalsContact N-CZ 3.33Å; G85-Y207 PolarHBondContact N-OH 3.11Å | ||
| 86 | R | 92.1 | Very high | 90.9 | Very high | 3 Ų | 3 | 50.5 Ų | 50.5 | 1% | 0.011 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -83.3 | -45.8 | -170.2 | -68.5 | 57.5 | 168.9 | 138.3 | -1.9 | 109.1 | A81 N82 T89 L90 V133 Y137 E140 E203 | A81-R86 PolarHBondContact O-NH1 2.9Å; N82-R86 PolarHBondContact OD1-NH1 3.44Å; N82-R86 PolarHBondContact OD1-NH2 3.38Å; R86-T89 PolarHBondContact O-N 3.11Å; R86-L90 WeakPolarHBondContact O-CG 3.49Å; R86-L90 PolarHBondContact O-N 3.31Å; R86-L90 VanDerWaalsContact O-N 3.07Å; R86-V133 HydrophobicContact CB-CG1 4.39Å; R86-Y137 HydrophobicContact CB-CD1 3.91Å; R86-Y137 HydrophobicContact CB-CD2 3.76Å; R86-Y137 HydrophobicContact CB-CE2 4.38Å; R86-Y137 HydrophobicContact CB-CG 3.54Å; R86-Y137 HydrophobicContact CG-CD2 4.25Å; R86-Y137 HydrophobicContact CG-CG 4.18Å; R86-E140 WeakPolarHBondContact CD-OE2 3.36Å; R86-E140 IonicContact CZ-OE1 3.42Å; R86-E140 IonicContact CZ-OE2 3.7Å; R86-E140 IonicContact NE-OE1 3.26Å; R86-E140 PolarHBondContact NE-OE1 3.01Å; R86-E140 IonicContact NE-OE2 2.79Å; R86-E140 PolarHBondContact NE-OE2 3.47Å; R86-E140 IonicContact NH2-OE1 2.75Å; R86-E140 PolarHBondContact NH2-OE1 3.25Å; R86-E140 IonicContact NH2-OE2 3.76Å; R86-E203 WeakPolarHBondContact CA-OE1 3.31Å; R86-E203 WeakPolarHBondContact CB-OE1 3.44Å; R86-E203 PolarHBondContact N-OE1 3.13Å; R86-E203 PolarHBondContact N-OE2 3.32Å |
| 87 | R | 95.4 | Very high | 91.4 | Very high | 86 Ų | 86 | 45.2 Ų | 45.2 | 33% | 0.325 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.6 | -51.6 | 178.2 | -167.1 | -172.9 | 88.2 | 173 | 5.5 | 112 | T89 L90 F91 M198 C201 P202 E203 | R87-T89 VanDerWaalsContact C-N 3.32Å; R87-T89 PolarHBondContact O-N 3.37Å; R87-L90 PolarHBondContact O-N 3.25Å; R87-F91 PolarHBondContact O-N 3.49Å; R87-F91 VanDerWaalsContact O-N 3.09Å; R87-M198 HydrophobicContact CB-CE 4.14Å; R87-M198 HydrophobicContact CG-CE 3.48Å; R87-M198 VanDerWaalsContact CG-CE 3.48Å; R87-C201 WeakPolarHBondContact CD-O 3.4Å; R87-C201 PolarHBondContact NH1-O 3.11Å; R87-P202 WeakPolarHBondContact CD-O 3.41Å; R87-E203 HydrophobicContact CB-CB 4.49Å; R87-E203 VanDerWaalsContact CB-OE2 3.3Å; R87-E203 WeakPolarHBondContact CB-OE2 3.22Å; R87-E203 PolarHBondContact N-OE1 2.83Å; R87-E203 PolarHBondContact N-OE2 3.5Å; R87-E203 VanDerWaalsContact N-OE2 3.08Å |
| 88 | K | 94 | Very high | 92 | Very high | 125 Ų | 125 | 47.5 Ų | 47.5 | 54% | 0.543 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -65 | -37.6 | -178.7 | -71.1 | -172.7 | -177.6 | 175.5 | 0 | 112 | L84 F91 L92 | L84-K88 HydrophobicContact CB-CB 4.3Å; L84-K88 WeakPolarHBondContact O-CD 3.2Å; K88-F91 WeakPolarHBondContact O-CB 3.35Å; K88-F91 PolarHBondContact O-N 2.9Å; K88-L92 WeakPolarHBondContact O-CG 3.43Å; K88-L92 PolarHBondContact O-N 3.04Å |
| 89 | T | 94.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.3 | -48.6 | 176.5 | -64.4 | 0 | 0 | 0 | 0 | 111.8 | L80 A81 G85 R86 R87 F91 L92 L93 V133 | L80-T89 VanDerWaalsContact C-OG1 3.28Å; L80-T89 HydrophobicContact CB-CG2 3.96Å; L80-T89 HydrophobicContact CD2-CG2 3.71Å; L80-T89 HydrophobicContact CG-CG2 3.66Å; L80-T89 PolarHBondContact O-OG1 3.43Å; L80-T89 VanDerWaalsContact O-OG1 3.09Å; A81-T89 WeakPolarHBondContact CA-OG1 3.06Å; A81-T89 PolarHBondContact N-OG1 3.36Å; G85-T89 WeakPolarHBondContact O-CB 3.31Å; G85-T89 PolarHBondContact O-N 3.34Å; G85-T89 PolarHBondContact O-OG1 2.89Å; R86-T89 PolarHBondContact O-N 3.11Å; R87-T89 VanDerWaalsContact C-N 3.32Å; R87-T89 PolarHBondContact O-N 3.37Å; T89-F91 VanDerWaalsContact C-N 3.32Å; T89-F91 PolarHBondContact O-N 3.49Å; T89-L92 PolarHBondContact O-N 3.41Å; T89-L93 HydrophobicContact CG2-CD1 3.73Å; T89-L93 HydrophobicContact CG2-CG 4.24Å; T89-L93 WeakPolarHBondContact O-CB 3.08Å; T89-L93 VanDerWaalsContact O-CG 3.26Å; T89-L93 WeakPolarHBondContact O-CG 3.49Å; T89-L93 PolarHBondContact O-N 3.35Å; T89-V133 HydrophobicContact CG2-CB 4.49Å; T89-V133 HydrophobicContact CG2-CG1 4.12Å; T89-V133 HydrophobicContact CG2-CG2 3.78Å |
| 90 | L | 95.6 | Very high | 93.5 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -59.6 | -41.9 | 176 | -69.8 | 179.5 | 0 | 0 | 0 | 112.5 | I13 R86 R87 L92 L93 S94 Y130 V133 Y137 M198 | I13-L90 HydrophobicContact CG1-CD1 4.3Å; I13-L90 HydrophobicContact CG2-CD1 3.96Å; R86-L90 WeakPolarHBondContact O-CG 3.49Å; R86-L90 PolarHBondContact O-N 3.31Å; R86-L90 VanDerWaalsContact O-N 3.07Å; R87-L90 PolarHBondContact O-N 3.25Å; L90-L92 PolarHBondContact O-N 3.32Å; L90-L93 PolarHBondContact O-N 2.9Å; L90-S94 PolarHBondContact O-N 3.09Å; L90-S94 PolarHBondContact O-OG 2.77Å; L90-Y130 HydrophobicContact CD2-CD1 3.62Å; L90-Y130 HydrophobicContact CD2-CE1 3.94Å; L90-V133 HydrophobicContact CD2-CB 4.17Å; L90-V133 HydrophobicContact CD2-CG1 3.94Å; L90-V133 HydrophobicContact CG-CG1 3.97Å; L90-Y137 HydrophobicContact CD1-CD1 3.69Å; L90-Y137 HydrophobicContact CD1-CE1 4.24Å; L90-M198 HydrophobicContact CB-CE 4.07Å; L90-M198 HydrophobicContact CD1-CE 3.92Å; L90-M198 HydrophobicContact CD1-SD 4.48Å |
| 91 | F | 94.3 | Very high | 94 | Very high | 86 Ų | 86 | 44 Ų | 44 | 38% | 0.377 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -58.5 | -47.9 | 174.8 | -177.2 | -82.5 | 0 | 0 | 0 | 111.9 | R87 K88 T89 S94 V195 | R87-F91 PolarHBondContact O-N 3.49Å; R87-F91 VanDerWaalsContact O-N 3.09Å; K88-F91 WeakPolarHBondContact O-CB 3.35Å; K88-F91 PolarHBondContact O-N 2.9Å; T89-F91 VanDerWaalsContact C-N 3.32Å; T89-F91 PolarHBondContact O-N 3.49Å; F91-S94 VanDerWaalsContact O-CB 3.28Å; F91-S94 WeakPolarHBondContact O-CB 3.3Å; F91-S94 PolarHBondContact O-N 3.36Å; F91-S94 PolarHBondContact O-OG 3.23Å; F91-V195 HydrophobicContact CD2-CG1 4.06Å; F91-V195 HydrophobicContact CE2-CG1 3.51Å; F91-V195 HydrophobicContact CZ-CG1 4.06Å |
| 92 | L | 95.2 | Very high | 94.5 | Very high | 76 Ų | 76 | 47.2 Ų | 47.2 | 40% | 0.398 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -69.3 | -35.3 | -179.4 | -71.3 | 173.8 | 0 | 0 | 0 | 113 | L84 K88 T89 L90 S94 I95 P96 | L84-L92 HydrophobicContact CD1-CD1 3.45Å; L84-L92 VanDerWaalsContact CD1-CD1 3.45Å; K88-L92 WeakPolarHBondContact O-CG 3.43Å; K88-L92 PolarHBondContact O-N 3.04Å; T89-L92 PolarHBondContact O-N 3.41Å; L90-L92 PolarHBondContact O-N 3.32Å; L92-S94 PolarHBondContact O-N 2.79Å; L92-I95 HydrophobicContact CD2-CD1 4.23Å; L92-I95 WeakPolarHBondContact O-CB 3.47Å; L92-I95 PolarHBondContact O-N 3.05Å; L92-P96 WeakPolarHBondContact O-CD 3.26Å |
| 93 | L | 96.4 | Very high | 95.1 | Very high | 4 Ų | 4 | 47.8 Ų | 47.8 | 2% | 0.021 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -66.9 | -20 | 176.9 | -72.5 | 170.5 | 0 | 0 | 0 | 113.1 | L80 T89 L90 I95 P96 T97 F125 S126 A129 Y130 | L80-L93 HydrophobicContact CD2-CD2 4.23Å; L80-L93 HydrophobicContact CD2-CG 4.38Å; T89-L93 HydrophobicContact CG2-CD1 3.73Å; T89-L93 HydrophobicContact CG2-CG 4.24Å; T89-L93 WeakPolarHBondContact O-CB 3.08Å; T89-L93 VanDerWaalsContact O-CG 3.26Å; T89-L93 WeakPolarHBondContact O-CG 3.49Å; T89-L93 PolarHBondContact O-N 3.35Å; L90-L93 PolarHBondContact O-N 2.9Å; L93-I95 VanDerWaalsContact C-N 3.25Å; L93-I95 PolarHBondContact O-N 2.86Å; L93-P96 VanDerWaalsContact O-CD 3.25Å; L93-P96 WeakPolarHBondContact O-CD 3.45Å; L93-P96 WeakPolarHBondContact O-CG 3.28Å; L93-T97 PolarHBondContact O-N 3.48Å; L93-T97 PolarHBondContact O-OG1 3.14Å; L93-F125 HydrophobicContact CD2-CE1 4.1Å; L93-S126 PolarHBondContact O-OG 3.21Å; L93-A129 HydrophobicContact CD1-CB 3.47Å; L93-A129 VanDerWaalsContact CD1-CB 3.47Å; L93-A129 HydrophobicContact CD2-CB 3.57Å; L93-A129 HydrophobicContact CG-CB 4.17Å; L93-Y130 HydrophobicContact CB-CD1 4.22Å; L93-Y130 HydrophobicContact CB-CE1 3.37Å; L93-Y130 HydrophobicContact CD1-CD1 3.83Å; L93-Y130 HydrophobicContact CD1-CE1 3.83Å; L93-Y130 HydrophobicContact CG-CE1 4.26Å; L93-Y130 PolarHBondContact O-OH 2.68Å |
| 94 | S | 95.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -65.2 | -30.3 | 174.6 | -57.6 | 0 | 0 | 0 | 0 | 112.2 | L90 F91 L92 T97 I98 Y130 H194 | L90-S94 PolarHBondContact O-N 3.09Å; L90-S94 PolarHBondContact O-OG 2.77Å; F91-S94 VanDerWaalsContact O-CB 3.28Å; F91-S94 WeakPolarHBondContact O-CB 3.3Å; F91-S94 PolarHBondContact O-N 3.36Å; F91-S94 PolarHBondContact O-OG 3.23Å; L92-S94 PolarHBondContact O-N 2.79Å; S94-T97 PolarHBondContact O-N 2.84Å; S94-I98 VanDerWaalsContact O-CG1 3.3Å; S94-I98 WeakPolarHBondContact O-CG1 3.25Å; S94-I98 PolarHBondContact O-N 3.16Å; S94-Y130 WeakPolarHBondContact CA-OH 3.47Å; S94-Y130 PolarHBondContact N-OH 2.88Å; S94-H194 PolarHBondContact OG-CD2 2.74Å |
| 95 | I | 95.7 | Very high | 95.9 | Very high | 88 Ų | 88 | 38 Ų | 38 | 45% | 0.451 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -61.1 | -57.4 | 178.9 | -60.5 | 169.9 | 0 | 0 | 0 | 111 | L92 L93 T97 I98 L99 | L92-I95 HydrophobicContact CD2-CD1 4.23Å; L92-I95 WeakPolarHBondContact O-CB 3.47Å; L92-I95 PolarHBondContact O-N 3.05Å; L93-I95 VanDerWaalsContact C-N 3.25Å; L93-I95 PolarHBondContact O-N 2.86Å; I95-T97 VanDerWaalsContact C-N 3.26Å; I95-T97 PolarHBondContact O-N 2.85Å; I95-I98 PolarHBondContact O-N 3.04Å; I95-L99 HydrophobicContact CG2-CD1 3.95Å; I95-L99 HydrophobicContact CG2-CG 4.43Å; I95-L99 WeakPolarHBondContact O-CG 3.16Å; I95-L99 PolarHBondContact O-N 2.99Å |
| 96 | P | 96.9 | Very high | 96.1 | Very high | 29 Ų | 29 | 40.6 Ų | 40.6 | 19% | 0.188 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -59.8 | -35.3 | 174.8 | 13.5 | -21.2 | 0 | 0 | 0 | 112.4 | L92 L93 I98 L99 G100 I122 S126 | L92-P96 WeakPolarHBondContact O-CD 3.26Å; L93-P96 VanDerWaalsContact O-CD 3.25Å; L93-P96 WeakPolarHBondContact O-CD 3.45Å; L93-P96 WeakPolarHBondContact O-CG 3.28Å; P96-I98 PolarHBondContact O-N 3.17Å; P96-L99 PolarHBondContact O-N 2.95Å; P96-G100 PolarHBondContact O-N 2.03Å; P96-I122 HydrophobicContact CB-CG2 3.62Å; P96-I122 WeakPolarHBondContact O-CG2 3.3Å; P96-S126 WeakPolarHBondContact CB-OG 3.47Å; P96-S126 WeakPolarHBondContact CG-OG 3.25Å |
| 97 | T | 97.4 | Very high | 96.3 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.4 | -45.6 | 177.4 | -48.9 | 0 | 0 | 0 | 0 | 112.1 | V20 L93 S94 I95 S101 V123 S126 Y130 C187 C191 | V20-T97 HydrophobicContact CG1-CG2 3.69Å; V20-T97 HydrophobicContact CG2-CG2 3.98Å; L93-T97 PolarHBondContact O-N 3.48Å; L93-T97 PolarHBondContact O-OG1 3.14Å; S94-T97 PolarHBondContact O-N 2.84Å; I95-T97 VanDerWaalsContact C-N 3.26Å; I95-T97 PolarHBondContact O-N 2.85Å; T97-S101 VanDerWaalsContact O-CB 3.24Å; T97-S101 WeakPolarHBondContact O-CB 3.39Å; T97-S101 PolarHBondContact O-N 3.25Å; T97-S101 PolarHBondContact O-OG 3.22Å; T97-V123 HydrophobicContact CG2-CG1 4.3Å; T97-S126 PolarHBondContact N-OG 3.22Å; T97-S126 WeakPolarHBondContact OG1-CB 3.48Å; T97-S126 PolarHBondContact OG1-OG 2.87Å; T97-Y130 PolarHBondContact OG1-OH 3.18Å; T97-C187 HydrophobicContact CG2-CB 4.21Å; T97-C191 HydrophobicContact CG2-CB 4.42Å; T97-C191 WeakPolarHBondContact CG2-SG 3.37Å |
| 98 | I | 97.3 | Very high | 96.3 | Very high | 47 Ų | 47 | 39.2 Ų | 39.2 | 24% | 0.241 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.2 | -48.4 | 177 | -67.5 | 166.1 | 0 | 0 | 0 | 109.9 | S94 I95 P96 G100 S101 V102 C191 | S94-I98 VanDerWaalsContact O-CG1 3.3Å; S94-I98 WeakPolarHBondContact O-CG1 3.25Å; S94-I98 PolarHBondContact O-N 3.16Å; I95-I98 PolarHBondContact O-N 3.04Å; P96-I98 PolarHBondContact O-N 3.17Å; I98-G100 PolarHBondContact O-N 3.23Å; I98-S101 PolarHBondContact O-N 2.89Å; I98-V102 HydrophobicContact CG2-CG2 4.22Å; I98-V102 WeakPolarHBondContact O-CB 3.39Å; I98-V102 VanDerWaalsContact O-CG2 3.27Å; I98-V102 WeakPolarHBondContact O-CG2 3.16Å; I98-V102 PolarHBondContact O-N 3.39Å; I98-C191 HydrophobicContact CD1-CB 4.26Å; I98-C191 HydrophobicContact CG1-CB 3.8Å |
| 99 | L | 97.6 | Very high | 96.3 | Very high | 106 Ų | 106 | 38.3 Ų | 38.3 | 56% | 0.555 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -59.3 | -47.2 | -179.8 | -70.8 | 175 | 0 | 0 | 0 | 112.4 | I95 P96 V102 L103 | I95-L99 HydrophobicContact CG2-CD1 3.95Å; I95-L99 HydrophobicContact CG2-CG 4.43Å; I95-L99 WeakPolarHBondContact O-CG 3.16Å; I95-L99 PolarHBondContact O-N 2.99Å; P96-L99 PolarHBondContact O-N 2.95Å; L99-V102 PolarHBondContact O-N 3.49Å; L99-L103 VanDerWaalsContact O-CB 3.31Å; L99-L103 WeakPolarHBondContact O-CB 3.41Å; L99-L103 PolarHBondContact O-N 3.32Å |
| 100 | G | 97.8 | Very high | 96.3 | Very high | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.9 | -39.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | P96 I98 L103 I104 G119 | P96-G100 PolarHBondContact O-N 2.03Å; I98-G100 PolarHBondContact O-N 3.23Å; G100-L103 PolarHBondContact O-N 3.42Å; G100-I104 WeakPolarHBondContact O-CG1 3.27Å; G100-I104 PolarHBondContact O-N 2.9Å; G100-G119 WeakPolarHBondContact O-CA 3.15Å |
| 101 | S | 97.7 | Very high | 96.1 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -66.6 | -41.4 | 177 | -60.9 | 0 | 0 | 0 | 0 | 112.3 | T97 I98 I104 T105 | T97-S101 VanDerWaalsContact O-CB 3.24Å; T97-S101 WeakPolarHBondContact O-CB 3.39Å; T97-S101 PolarHBondContact O-N 3.25Å; T97-S101 PolarHBondContact O-OG 3.22Å; I98-S101 PolarHBondContact O-N 2.89Å; S101-I104 PolarHBondContact O-N 3.44Å; S101-T105 PolarHBondContact O-N 3.37Å; S101-T105 PolarHBondContact O-OG1 3.38Å |
| 102 | V | 97.7 | Very high | 96.1 | Very high | 70 Ų | 70 | 45.3 Ų | 45.3 | 42% | 0.424 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -65 | -44.2 | 174.9 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | I98 L99 I104 T105 V106 A188 | I98-V102 HydrophobicContact CG2-CG2 4.22Å; I98-V102 WeakPolarHBondContact O-CB 3.39Å; I98-V102 VanDerWaalsContact O-CG2 3.27Å; I98-V102 WeakPolarHBondContact O-CG2 3.16Å; I98-V102 PolarHBondContact O-N 3.39Å; L99-V102 PolarHBondContact O-N 3.49Å; V102-I104 VanDerWaalsContact C-N 3.3Å; V102-I104 PolarHBondContact O-N 3.04Å; V102-T105 WeakPolarHBondContact O-CB 3.49Å; V102-T105 PolarHBondContact O-N 3.13Å; V102-V106 HydrophobicContact CG1-CG1 4.47Å; V102-V106 WeakPolarHBondContact O-CG2 3.44Å; V102-V106 PolarHBondContact O-N 3.43Å; V102-A188 HydrophobicContact CG2-CB 4.31Å |
| 103 | L | 97.6 | Very high | 96 | Very high | 48 Ų | 48 | 42.8 Ų | 42.8 | 25% | 0.251 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.8 | -40.5 | 178 | -176.1 | 60.6 | 0 | 0 | 0 | 112.3 | L99 G100 S107 L110 A115 F118 I122 | L99-L103 VanDerWaalsContact O-CB 3.31Å; L99-L103 WeakPolarHBondContact O-CB 3.41Å; L99-L103 PolarHBondContact O-N 3.32Å; G100-L103 PolarHBondContact O-N 3.42Å; L103-S107 PolarHBondContact O-N 3.47Å; L103-L110 HydrophobicContact CD1-CD1 4.37Å; L103-A115 HydrophobicContact CD1-CB 3.91Å; L103-A115 HydrophobicContact CG-CB 4.1Å; L103-F118 HydrophobicContact CD2-CB 3.92Å; L103-I122 HydrophobicContact CD2-CD1 4.28Å |
| 104 | I | 96.5 | Very high | 95.9 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.2 | -44.6 | 172.7 | -63 | 163.4 | 0 | 0 | 0 | 110.7 | G100 S101 V102 V106 S107 R120 L184 | G100-I104 WeakPolarHBondContact O-CG1 3.27Å; G100-I104 PolarHBondContact O-N 2.9Å; S101-I104 PolarHBondContact O-N 3.44Å; V102-I104 VanDerWaalsContact C-N 3.3Å; V102-I104 PolarHBondContact O-N 3.04Å; I104-V106 VanDerWaalsContact C-N 3.28Å; I104-V106 PolarHBondContact O-N 2.99Å; I104-S107 WeakPolarHBondContact O-CB 2.94Å; I104-S107 PolarHBondContact O-N 3.43Å; I104-S107 VanDerWaalsContact O-N 3.1Å; I104-S107 PolarHBondContact O-OG 3.15Å; I104-R120 HydrophobicContact CD1-CG 4.24Å; I104-L184 HydrophobicContact CG2-CB 3.52Å; I104-L184 HydrophobicContact CG2-CD1 3.64Å; I104-L184 HydrophobicContact CG2-CG 4.25Å |
| 105 | T | 96.8 | Very high | 95.9 | Very high | 31 Ų | 31 | 45.4 Ų | 45.4 | 19% | 0.19 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60.1 | -39.9 | -177.6 | -54.5 | 0 | 0 | 0 | 0 | 112 | S101 V102 S107 F182 G185 | S101-T105 PolarHBondContact O-N 3.37Å; S101-T105 PolarHBondContact O-OG1 3.38Å; V102-T105 WeakPolarHBondContact O-CB 3.49Å; V102-T105 PolarHBondContact O-N 3.13Å; T105-S107 VanDerWaalsContact C-N 3.32Å; T105-F182 HydrophobicContact CG2-CD1 3.54Å; T105-F182 HydrophobicContact CG2-CE1 3.63Å; T105-F182 HydrophobicContact CG2-CG 4.22Å; T105-F182 HydrophobicContact CG2-CZ 4.37Å; T105-G185 WeakPolarHBondContact OG1-CA 3.15Å |
| 106 | V | 96.9 | Very high | 95.9 | Very high | 53 Ų | 53 | 41.2 Ų | 41.2 | 32% | 0.321 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.3 | -0.7 | -179.6 | -56.2 | 0 | 0 | 0 | 0 | 113.5 | V102 I104 V108 S109 L110 | V102-V106 HydrophobicContact CG1-CG1 4.47Å; V102-V106 WeakPolarHBondContact O-CG2 3.44Å; V102-V106 PolarHBondContact O-N 3.43Å; I104-V106 VanDerWaalsContact C-N 3.28Å; I104-V106 PolarHBondContact O-N 2.99Å; V106-V108 PolarHBondContact O-N 2.57Å; V106-S109 PolarHBondContact O-N 3.22Å; V106-S109 VanDerWaalsContact O-N 3.09Å; V106-L110 HydrophobicContact CG2-CD1 3.71Å; V106-L110 HydrophobicContact CG2-CG 4.19Å; V106-L110 WeakPolarHBondContact O-CG 3.5Å; V106-L110 PolarHBondContact O-N 3.4Å |
| 107 | S | 95.8 | Very high | 95.8 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -34.8 | -173.7 | 75.7 | 0 | 0 | 0 | 0 | 113.1 | L103 I104 T105 L110 K111 S112 I116 | L103-S107 PolarHBondContact O-N 3.47Å; I104-S107 WeakPolarHBondContact O-CB 2.94Å; I104-S107 PolarHBondContact O-N 3.43Å; I104-S107 VanDerWaalsContact O-N 3.1Å; I104-S107 PolarHBondContact O-OG 3.15Å; T105-S107 VanDerWaalsContact C-N 3.32Å; S107-L110 CarbonylContact O-C 3.53Å; S107-L110 PolarHBondContact O-N 3.15Å; S107-K111 PolarHBondContact O-N 3Å; S107-S112 PolarHBondContact O-N 3.22Å; S107-I116 WeakPolarHBondContact OG-CG1 3.49Å |
| 108 | V | 93.9 | Very high | 95.8 | Very high | 60 Ų | 60 | 47.7 Ų | 47.7 | 36% | 0.364 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68 | -46.1 | 177.4 | 175.8 | 0 | 0 | 0 | 0 | 110.9 | F38 V106 L110 K111 W180 P181 | F38-V108 HydrophobicContact CD2-CG2 4.32Å; F38-V108 HydrophobicContact CE2-CB 4.33Å; F38-V108 HydrophobicContact CE2-CG1 4.44Å; F38-V108 HydrophobicContact CE2-CG2 4.05Å; F38-V108 HydrophobicContact CZ-CG2 4.43Å; V106-V108 PolarHBondContact O-N 2.57Å; V108-L110 VanDerWaalsContact C-N 3.26Å; V108-L110 PolarHBondContact O-N 2.96Å; V108-K111 PolarHBondContact O-N 3.47Å; V108-W180 HydrophobicContact CG2-CH2 4.05Å; V108-W180 HydrophobicContact CG2-CZ2 3.45Å; V108-W180 VanDerWaalsContact CG2-CZ2 3.45Å; V108-P181 HydrophobicContact CB-CG 4.39Å; V108-P181 HydrophobicContact CG2-CB 4.33Å; V108-P181 HydrophobicContact CG2-CG 3.43Å; V108-P181 VanDerWaalsContact CG2-CG 3.43Å |
| 109 | S | 93.9 | Very high | 95.8 | Very high | 106 Ų | 106 | 45.4 Ų | 45.4 | 74% | 0.741 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63 | -35.2 | 176.1 | -54.9 | 0 | 0 | 0 | 0 | 111.9 | V106 K111 | V106-S109 PolarHBondContact O-N 3.22Å; V106-S109 VanDerWaalsContact O-N 3.09Å; S109-K111 VanDerWaalsContact C-N 3.28Å |
| 110 | L | 94.9 | Very high | 95.7 | Very high | 103 Ų | 103 | 40.5 Ų | 40.5 | 54% | 0.539 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | -6.8 | 175.8 | -64.7 | 179.3 | 0 | 0 | 0 | 113.8 | L103 V106 S107 V108 S112 A115 | L103-L110 HydrophobicContact CD1-CD1 4.37Å; V106-L110 HydrophobicContact CG2-CD1 3.71Å; V106-L110 HydrophobicContact CG2-CG 4.19Å; V106-L110 WeakPolarHBondContact O-CG 3.5Å; V106-L110 PolarHBondContact O-N 3.4Å; S107-L110 CarbonylContact O-C 3.53Å; S107-L110 PolarHBondContact O-N 3.15Å; V108-L110 VanDerWaalsContact C-N 3.26Å; V108-L110 PolarHBondContact O-N 2.96Å; L110-S112 PolarHBondContact O-N 3.44Å; L110-A115 HydrophobicContact CD1-CB 4.43Å |
| 111 | K | 93.2 | Very high | 95.6 | Very high | 111 Ų | 111 | 44 Ų | 44 | 48% | 0.483 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 46.9 | 46.3 | -172.9 | -60.4 | -179.6 | 167.3 | -153.9 | 0 | 112.2 | V42 E45 R46 S107 V108 S109 | V42-K111 VanDerWaalsContact CG1-O 3.22Å; V42-K111 WeakPolarHBondContact CG1-O 3.42Å; E45-K111 IonicContact OE1-NZ 2.74Å; E45-K111 WeakPolarHBondContact OE2-CD 3.49Å; E45-K111 WeakPolarHBondContact OE2-CE 3.45Å; E45-K111 IonicContact OE2-NZ 2.72Å; E45-K111 PolarHBondContact OE2-NZ 3.23Å; R46-K111 PolarHBondContact NH2-O 2.97Å; S107-K111 PolarHBondContact O-N 3Å; V108-K111 PolarHBondContact O-N 3.47Å; S109-K111 VanDerWaalsContact C-N 3.28Å |
| 112 | S | 94.2 | Very high | 95.6 | Very high | 19 Ų | 19 | 46.3 Ų | 46.3 | 13% | 0.133 | 25% | 0.247 | C | C | . | . | trans | -133.7 | 113.2 | -173.8 | 175.9 | 0 | 0 | 0 | 0 | 111.5 | S107 L110 E114 A115 | S107-S112 PolarHBondContact O-N 3.22Å; L110-S112 PolarHBondContact O-N 3.44Å; S112-E114 WeakPolarHBondContact OG-CB 3.34Å; S112-E114 PolarHBondContact OG-N 3.45Å; S112-E114 PolarHBondContact OG-OE2 3.44Å; S112-A115 PolarHBondContact OG-N 3.08Å | ||
| 113 | F | 92.2 | Very high | 95.6 | Very high | 24 Ų | 24 | 43 Ų | 43 | 11% | 0.105 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -72.7 | -22.9 | 167.1 | 64.7 | -99.9 | 0 | 0 | 0 | 111.1 | F38 T39 V42 I43 I58 A115 I116 I117 | F38-F113 HydrophobicContact CE1-CB 4.3Å; T39-F113 HydrophobicContact CG2-CB 4.39Å; T39-F113 HydrophobicContact CG2-CD1 4.27Å; T39-F113 HydrophobicContact CG2-CG 4.22Å; V42-F113 HydrophobicContact CB-CD1 4.17Å; V42-F113 HydrophobicContact CG1-CD1 3.74Å; V42-F113 HydrophobicContact CG1-CE1 4.12Å; I43-F113 HydrophobicContact CG1-CE1 3.92Å; I58-F113 HydrophobicContact CD1-CE2 4.3Å; I58-F113 HydrophobicContact CD1-CZ 4.3Å; I58-F113 HydrophobicContact CG2-CD2 3.66Å; I58-F113 HydrophobicContact CG2-CE2 3.89Å; I58-F113 HydrophobicContact CG2-CG 4.36Å; F113-A115 VanDerWaalsContact C-N 3.32Å; F113-A115 PolarHBondContact O-N 3.42Å; F113-I116 VanDerWaalsContact O-CB 3.31Å; F113-I116 WeakPolarHBondContact O-CB 3.08Å; F113-I116 PolarHBondContact O-N 2.99Å; F113-I116 VanDerWaalsContact O-N 3.11Å; F113-I117 HydrophobicContact CD2-CD1 4.15Å; F113-I117 PolarHBondContact O-N 3.39Å |
| 114 | E | 94.5 | Very high | 95.6 | Very high | 53 Ų | 53 | 40.7 Ų | 40.7 | 25% | 0.248 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.2 | -38.3 | 173.9 | -56.5 | 85 | 172.2 | 0 | 0 | 111.8 | R46 S112 I116 I117 F118 | R46-E114 IonicContact CZ-OE1 3.58Å; R46-E114 IonicContact CZ-OE2 3.83Å; R46-E114 IonicContact NH1-OE1 3.32Å; R46-E114 PolarHBondContact NH1-OE1 3.28Å; R46-E114 IonicContact NH1-OE2 3.52Å; R46-E114 PolarHBondContact NH1-OE2 3.29Å; R46-E114 IonicContact NH2-OE1 2.89Å; R46-E114 IonicContact NH2-OE2 3.62Å; R46-E114 PolarHBondContact NH2-OE2 3.4Å; S112-E114 WeakPolarHBondContact OG-CB 3.34Å; S112-E114 PolarHBondContact OG-N 3.45Å; S112-E114 PolarHBondContact OG-OE2 3.44Å; E114-I116 PolarHBondContact O-N 3.31Å; E114-I117 WeakPolarHBondContact O-CB 3.14Å; E114-I117 PolarHBondContact O-N 3.47Å; E114-F118 HydrophobicContact CB-CD2 4.26Å; E114-F118 HydrophobicContact CB-CE2 4.32Å; E114-F118 VanDerWaalsContact O-CD2 3.25Å; E114-F118 WeakPolarHBondContact O-CD2 3.36Å; E114-F118 PolarHBondContact O-N 3.21Å |
| 115 | A | 96.2 | Very high | 95.6 | Very high | 6 Ų | 6 | 43.5 Ų | 43.5 | 5% | 0.05 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -57.2 | -34.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L103 L110 S112 F113 G119 | L103-A115 HydrophobicContact CD1-CB 3.91Å; L103-A115 HydrophobicContact CG-CB 4.1Å; L110-A115 HydrophobicContact CD1-CB 4.43Å; S112-A115 PolarHBondContact OG-N 3.08Å; F113-A115 VanDerWaalsContact C-N 3.32Å; F113-A115 PolarHBondContact O-N 3.42Å; A115-G119 WeakPolarHBondContact O-CA 3.48Å; A115-G119 PolarHBondContact O-N 3.04Å |
| 116 | I | 95.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -66.9 | -46.7 | 174 | -51.7 | 172.5 | 0 | 0 | 0 | 110.1 | I35 F38 S107 F113 E114 G119 R120 W180 | I35-I116 HydrophobicContact CG2-CD1 4.02Å; F38-I116 HydrophobicContact CD1-CD1 3.87Å; F38-I116 HydrophobicContact CE1-CD1 3.79Å; S107-I116 WeakPolarHBondContact OG-CG1 3.49Å; F113-I116 VanDerWaalsContact O-CB 3.31Å; F113-I116 WeakPolarHBondContact O-CB 3.08Å; F113-I116 PolarHBondContact O-N 2.99Å; F113-I116 VanDerWaalsContact O-N 3.11Å; E114-I116 PolarHBondContact O-N 3.31Å; I116-G119 PolarHBondContact O-N 2.84Å; I116-R120 HydrophobicContact CG2-CG 4.22Å; I116-R120 VanDerWaalsContact O-CB 3.24Å; I116-R120 WeakPolarHBondContact O-CB 3.46Å; I116-R120 WeakPolarHBondContact O-CG 3.35Å; I116-R120 PolarHBondContact O-N 3.42Å; I116-W180 HydrophobicContact CD1-CH2 3.59Å; I116-W180 HydrophobicContact CD1-CZ3 4.06Å; I116-W180 HydrophobicContact CG1-CH2 4.35Å |
| 117 | I | 94.6 | Very high | 95.6 | Very high | 34 Ų | 34 | 39.5 Ų | 39.5 | 17% | 0.174 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.7 | -51.7 | 179.7 | -62.3 | 169.6 | 0 | 0 | 0 | 110.8 | I58 I61 C62 F113 E114 R120 F121 | I58-I117 HydrophobicContact CG2-CD1 4.49Å; I61-I117 HydrophobicContact CG2-CD1 4Å; I61-I117 HydrophobicContact CG2-CG1 4.33Å; I61-I117 HydrophobicContact CG2-CG2 3.9Å; C62-I117 HydrophobicContact CB-CG1 4.38Å; C62-I117 WeakPolarHBondContact SG-CG1 3.49Å; F113-I117 HydrophobicContact CD2-CD1 4.15Å; F113-I117 PolarHBondContact O-N 3.39Å; E114-I117 WeakPolarHBondContact O-CB 3.14Å; E114-I117 PolarHBondContact O-N 3.47Å; I117-R120 PolarHBondContact O-N 3.47Å; I117-F121 PolarHBondContact O-N 2.9Å |
| 118 | F | 96.8 | Very high | 95.5 | Very high | 130 Ų | 130 | 39.5 Ų | 39.5 | 57% | 0.57 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -65.3 | -42.6 | 178.9 | -76.9 | -68.4 | 0 | 0 | 0 | 111.7 | L103 E114 R120 F121 I122 | L103-F118 HydrophobicContact CD2-CB 3.92Å; E114-F118 HydrophobicContact CB-CD2 4.26Å; E114-F118 HydrophobicContact CB-CE2 4.32Å; E114-F118 VanDerWaalsContact O-CD2 3.25Å; E114-F118 WeakPolarHBondContact O-CD2 3.36Å; E114-F118 PolarHBondContact O-N 3.21Å; F118-R120 PolarHBondContact O-N 2.83Å; F118-F121 WeakPolarHBondContact O-CB 3.24Å; F118-F121 PolarHBondContact O-N 3.36Å; F118-I122 VanDerWaalsContact O-CG1 3.25Å; F118-I122 WeakPolarHBondContact O-CG1 3.33Å; F118-I122 PolarHBondContact O-N 3.41Å |
| 119 | G | 97.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 36.7 Ų | 36.7 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.5 | -42.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | G100 A115 I116 F121 I122 V123 | G100-G119 WeakPolarHBondContact O-CA 3.15Å; A115-G119 WeakPolarHBondContact O-CA 3.48Å; A115-G119 PolarHBondContact O-N 3.04Å; I116-G119 PolarHBondContact O-N 2.84Å; G119-F121 PolarHBondContact O-N 2.89Å; G119-I122 PolarHBondContact O-N 3.28Å; G119-V123 WeakPolarHBondContact O-CG2 3.45Å; G119-V123 PolarHBondContact O-N 2.98Å |
| 120 | R | 95.5 | Very high | 95.4 | Very high | 2 Ų | 2 | 31.7 Ų | 31.7 | 1% | 0.008 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.4 | -45.8 | 172.4 | -75 | -85.5 | -71.3 | 169.8 | 1.2 | 111.1 | H24 C62 V63 F66 I104 I116 I117 F118 G124 | H24-R120 PolarHBondContact O-NH1 2.97Å; C62-R120 PolarHBondContact O-NE 3.32Å; V63-R120 PolarHBondContact O-NH2 3.31Å; F66-R120 VanDerWaalsContact CA-O 3.3Å; F66-R120 WeakPolarHBondContact CA-O 3.37Å; F66-R120 HydrophobicContact CB-CB 4.29Å; I104-R120 HydrophobicContact CD1-CG 4.24Å; I116-R120 HydrophobicContact CG2-CG 4.22Å; I116-R120 VanDerWaalsContact O-CB 3.24Å; I116-R120 WeakPolarHBondContact O-CB 3.46Å; I116-R120 WeakPolarHBondContact O-CG 3.35Å; I116-R120 PolarHBondContact O-N 3.42Å; I117-R120 PolarHBondContact O-N 3.47Å; F118-R120 PolarHBondContact O-N 2.83Å; R120-G124 WeakPolarHBondContact O-CA 3.25Å; R120-G124 PolarHBondContact O-N 3.09Å |
| 121 | F | 97.1 | Very high | 95.2 | Very high | 73 Ų | 73 | 26.9 Ų | 26.9 | 32% | 0.32 | 13% | 0.125 | S | C | . | . | H | α-helix | trans | -60.4 | -46.6 | 176.8 | 175.2 | -89.8 | 0 | 0 | 0 | 112.6 | G65 I68 G69 F72 I117 F118 G119 G124 F125 | G65-F121 VanDerWaalsContact O-CA 3.31Å; G65-F121 WeakPolarHBondContact O-CA 3.01Å; I68-F121 HydrophobicContact CG2-CD2 4.2Å; I68-F121 HydrophobicContact CG2-CE2 4.03Å; G69-F121 WeakPolarHBondContact CA-O 3.34Å; F72-F121 AromaticContact CD2-CE2 3.99Å; F72-F121 HydrophobicContact CD2-CE2 3.99Å; F72-F121 HydrophobicContact CD2-CZ 4.24Å; F72-F121 HydrophobicContact CE2-CE2 4.41Å; I117-F121 PolarHBondContact O-N 2.9Å; F118-F121 WeakPolarHBondContact O-CB 3.24Å; F118-F121 PolarHBondContact O-N 3.36Å; G119-F121 PolarHBondContact O-N 2.89Å; F121-G124 CarbonylContact O-C 3.21Å; F121-G124 WeakPolarHBondContact O-CA 3.18Å; F121-G124 PolarHBondContact O-N 3.28Å; F121-F125 PolarHBondContact O-N 3.08Å |
| 122 | I | 97.8 | Very high | 94.8 | Very high | 50 Ų | 50 | 22 Ų | 22 | 26% | 0.256 | 10% | 0.104 | S | C | . | . | H | α-helix | trans | -64.5 | -45.8 | -179.5 | -64.2 | 166.5 | 0 | 0 | 0 | 110.7 | P96 L103 F118 G119 G124 F125 S126 | P96-I122 HydrophobicContact CB-CG2 3.62Å; P96-I122 WeakPolarHBondContact O-CG2 3.3Å; L103-I122 HydrophobicContact CD2-CD1 4.28Å; F118-I122 VanDerWaalsContact O-CG1 3.25Å; F118-I122 WeakPolarHBondContact O-CG1 3.33Å; F118-I122 PolarHBondContact O-N 3.41Å; G119-I122 PolarHBondContact O-N 3.28Å; I122-G124 VanDerWaalsContact C-N 3.27Å; I122-G124 PolarHBondContact O-N 3.44Å; I122-F125 WeakPolarHBondContact O-CB 3.5Å; I122-F125 PolarHBondContact O-N 2.81Å; I122-S126 PolarHBondContact O-N 2.9Å |
| 123 | V | 97.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.3 | -38 | 174.7 | 177.3 | 0 | 0 | 0 | 0 | 111 | V20 H24 F66 T97 G119 F125 S126 A127 | V20-V123 HydrophobicContact CG1-CG1 3.79Å; H24-V123 VanDerWaalsContact CD2-CG1 3.47Å; H24-V123 WeakPolarHBondContact CD2-CG1 3.26Å; F66-V123 HydrophobicContact CD2-CG1 4.49Å; F66-V123 HydrophobicContact CE2-CG1 4.28Å; T97-V123 HydrophobicContact CG2-CG1 4.3Å; G119-V123 WeakPolarHBondContact O-CG2 3.45Å; G119-V123 PolarHBondContact O-N 2.98Å; V123-F125 VanDerWaalsContact C-N 3.34Å; V123-F125 PolarHBondContact O-N 3.28Å; V123-S126 PolarHBondContact O-N 2.67Å; V123-A127 WeakPolarHBondContact O-CB 3.4Å; V123-A127 PolarHBondContact O-N 3.47Å |
| 124 | G | 96.7 | Very high | 94.4 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -54.5 | -48.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F66 G69 G70 R120 F121 I122 S126 A127 G128 | F66-G124 VanDerWaalsContact CD2-CA 3.42Å; F66-G124 WeakPolarHBondContact O-CA 3.39Å; G69-G124 CarbonylContact C-O 3.58Å; G70-G124 WeakPolarHBondContact CA-O 3.37Å; G70-G124 VanDerWaalsContact N-C 3.25Å; G70-G124 PolarHBondContact N-O 3.01Å; R120-G124 WeakPolarHBondContact O-CA 3.25Å; R120-G124 PolarHBondContact O-N 3.09Å; F121-G124 CarbonylContact O-C 3.21Å; F121-G124 WeakPolarHBondContact O-CA 3.18Å; F121-G124 PolarHBondContact O-N 3.28Å; I122-G124 VanDerWaalsContact C-N 3.27Å; I122-G124 PolarHBondContact O-N 3.44Å; G124-S126 VanDerWaalsContact C-N 3.34Å; G124-S126 PolarHBondContact O-N 2.84Å; G124-A127 PolarHBondContact O-N 3.48Å; G124-A127 VanDerWaalsContact O-N 3.13Å; G124-G128 PolarHBondContact O-N 3Å |
| 125 | F | 97 | Very high | 94 | Very high | 58 Ų | 58 | 18.1 Ų | 18.1 | 25% | 0.254 | 9% | 0.086 | S | C | . | . | H | α-helix | trans | -55.4 | -47.5 | 176.2 | 179.3 | -85.8 | 0 | 0 | 0 | 112.1 | G69 F72 G73 F76 L93 F121 I122 V123 A129 | G69-F125 VanDerWaalsContact C-N 3.3Å; G69-F125 WeakPolarHBondContact O-CA 3.4Å; G69-F125 PolarHBondContact O-N 3.02Å; F72-F125 HydrophobicContact CB-CD2 4.14Å; F72-F125 HydrophobicContact CB-CE2 4.49Å; G73-F125 WeakPolarHBondContact CA-O 3.47Å; F76-F125 HydrophobicContact CB-CE2 4.39Å; F76-F125 HydrophobicContact CB-CZ 4.33Å; F76-F125 AromaticContact CD2-CE2 3.93Å; F76-F125 HydrophobicContact CD2-CE2 3.93Å; F76-F125 HydrophobicContact CG-CE2 4.49Å; L93-F125 HydrophobicContact CD2-CE1 4.1Å; F121-F125 PolarHBondContact O-N 3.08Å; I122-F125 WeakPolarHBondContact O-CB 3.5Å; I122-F125 PolarHBondContact O-N 2.81Å; V123-F125 VanDerWaalsContact C-N 3.34Å; V123-F125 PolarHBondContact O-N 3.28Å; F125-A129 PolarHBondContact O-N 2.98Å; F125-A129 VanDerWaalsContact O-N 3.11Å |
| 126 | S | 97.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -61.2 | -48 | 174.2 | -64.8 | 0 | 0 | 0 | 0 | 112.1 | L93 P96 T97 I122 V123 G124 G128 A129 Y130 | L93-S126 PolarHBondContact O-OG 3.21Å; P96-S126 WeakPolarHBondContact CB-OG 3.47Å; P96-S126 WeakPolarHBondContact CG-OG 3.25Å; T97-S126 PolarHBondContact N-OG 3.22Å; T97-S126 WeakPolarHBondContact OG1-CB 3.48Å; T97-S126 PolarHBondContact OG1-OG 2.87Å; I122-S126 PolarHBondContact O-N 2.9Å; V123-S126 PolarHBondContact O-N 2.67Å; G124-S126 VanDerWaalsContact C-N 3.34Å; G124-S126 PolarHBondContact O-N 2.84Å; S126-G128 VanDerWaalsContact C-N 3.33Å; S126-G128 PolarHBondContact O-N 3.34Å; S126-A129 PolarHBondContact O-N 3.34Å; S126-Y130 WeakPolarHBondContact O-CB 3.35Å; S126-Y130 WeakPolarHBondContact O-CD2 3.45Å; S126-Y130 PolarHBondContact O-N 3.38Å |
| 127 | A | 95.7 | Very high | 93.1 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -59.4 | -42.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | F21 F66 V123 G124 Y130 T131 | F21-A127 HydrophobicContact CB-CB 4.29Å; F21-A127 HydrophobicContact CD2-CB 4.41Å; F66-A127 HydrophobicContact CE2-CB 3.57Å; F66-A127 HydrophobicContact CZ-CB 3.7Å; V123-A127 WeakPolarHBondContact O-CB 3.4Å; V123-A127 PolarHBondContact O-N 3.47Å; G124-A127 PolarHBondContact O-N 3.48Å; G124-A127 VanDerWaalsContact O-N 3.13Å; A127-Y130 WeakPolarHBondContact O-CB 3.43Å; A127-Y130 PolarHBondContact O-N 3.41Å; A127-T131 WeakPolarHBondContact O-CG2 3.13Å; A127-T131 PolarHBondContact O-N 3.25Å |
| 128 | G | 93.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 17.2 Ų | 17.2 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -56.9 | -51.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | G70 G73 G74 G124 S126 Y130 T131 | G70-G128 WeakPolarHBondContact O-CA 3.24Å; G73-G128 VanDerWaalsContact C-C 3.46Å; G74-G128 WeakPolarHBondContact CA-O 3.27Å; G74-G128 VanDerWaalsContact N-C 3.3Å; G124-G128 PolarHBondContact O-N 3Å; S126-G128 VanDerWaalsContact C-N 3.33Å; S126-G128 PolarHBondContact O-N 3.34Å; G128-Y130 VanDerWaalsContact C-N 3.3Å; G128-Y130 PolarHBondContact O-N 2.95Å; G128-T131 PolarHBondContact O-N 3.36Å; G128-T131 VanDerWaalsContact O-N 3.13Å; G128-T131 PolarHBondContact O-OG1 3.28Å |
| 129 | A | 93 | Very high | 92.2 | Very high | 1 Ų | 1 | 12.3 Ų | 12.3 | 1% | 0.008 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -63.2 | -39.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | G73 L93 F125 S126 T131 V132 V133 | G73-A129 WeakPolarHBondContact O-CA 3.44Å; G73-A129 WeakPolarHBondContact O-CB 3.37Å; G73-A129 PolarHBondContact O-N 3.26Å; L93-A129 HydrophobicContact CD1-CB 3.47Å; L93-A129 VanDerWaalsContact CD1-CB 3.47Å; L93-A129 HydrophobicContact CD2-CB 3.57Å; L93-A129 HydrophobicContact CG-CB 4.17Å; F125-A129 PolarHBondContact O-N 2.98Å; F125-A129 VanDerWaalsContact O-N 3.11Å; S126-A129 PolarHBondContact O-N 3.34Å; A129-T131 VanDerWaalsContact C-N 3.28Å; A129-T131 PolarHBondContact O-N 3.47Å; A129-V132 PolarHBondContact O-N 3.44Å; A129-V133 WeakPolarHBondContact O-CG2 3.2Å; A129-V133 PolarHBondContact O-N 2.85Å |
| 130 | Y | 93.6 | Very high | 91.6 | Very high | 1 Ų | 1 | 12.8 Ų | 12.8 | 0% | 0.004 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -57.7 | -38.2 | 174 | -66.3 | -35.1 | 0 | 0 | 0 | 112.7 | G16 V20 L90 L93 S94 T97 S126 A127 G128 V132 V133 T134 | G16-Y130 WeakPolarHBondContact O-CE2 3.37Å; V20-Y130 HydrophobicContact CB-CD2 4.33Å; V20-Y130 HydrophobicContact CB-CE2 4.24Å; V20-Y130 HydrophobicContact CG1-CE2 4.31Å; V20-Y130 HydrophobicContact CG2-CE2 4.33Å; L90-Y130 HydrophobicContact CD2-CD1 3.62Å; L90-Y130 HydrophobicContact CD2-CE1 3.94Å; L93-Y130 HydrophobicContact CB-CD1 4.22Å; L93-Y130 HydrophobicContact CB-CE1 3.37Å; L93-Y130 HydrophobicContact CD1-CD1 3.83Å; L93-Y130 HydrophobicContact CD1-CE1 3.83Å; L93-Y130 HydrophobicContact CG-CE1 4.26Å; L93-Y130 PolarHBondContact O-OH 2.68Å; S94-Y130 WeakPolarHBondContact CA-OH 3.47Å; S94-Y130 PolarHBondContact N-OH 2.88Å; T97-Y130 PolarHBondContact OG1-OH 3.18Å; S126-Y130 WeakPolarHBondContact O-CB 3.35Å; S126-Y130 WeakPolarHBondContact O-CD2 3.45Å; S126-Y130 PolarHBondContact O-N 3.38Å; A127-Y130 WeakPolarHBondContact O-CB 3.43Å; A127-Y130 PolarHBondContact O-N 3.41Å; G128-Y130 VanDerWaalsContact C-N 3.3Å; G128-Y130 PolarHBondContact O-N 2.95Å; Y130-V132 PolarHBondContact O-N 3.43Å; Y130-V132 VanDerWaalsContact O-N 3.17Å; Y130-V133 PolarHBondContact O-N 2.95Å; Y130-T134 WeakPolarHBondContact O-CB 3.39Å; Y130-T134 PolarHBondContact O-N 2.9Å; Y130-T134 PolarHBondContact O-OG1 3.37Å |
| 131 | T | 89.8 | Confident | 91.3 | Very high | 3 Ų | 3 | 12.7 Ų | 12.7 | 2% | 0.018 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -64.7 | -16 | 177.5 | 60.5 | 0 | 0 | 0 | 0 | 114.2 | F21 A127 G128 A129 P135 W386 W410 | F21-T131 HydrophobicContact CD1-CG2 4.1Å; F21-T131 HydrophobicContact CD2-CG2 4.14Å; F21-T131 HydrophobicContact CE1-CG2 4.33Å; F21-T131 HydrophobicContact CE2-CG2 4.37Å; F21-T131 HydrophobicContact CG-CG2 4Å; F21-T131 HydrophobicContact CZ-CG2 4.46Å; A127-T131 WeakPolarHBondContact O-CG2 3.13Å; A127-T131 PolarHBondContact O-N 3.25Å; G128-T131 PolarHBondContact O-N 3.36Å; G128-T131 VanDerWaalsContact O-N 3.13Å; G128-T131 PolarHBondContact O-OG1 3.28Å; A129-T131 VanDerWaalsContact C-N 3.28Å; A129-T131 PolarHBondContact O-N 3.47Å; T131-P135 WeakPolarHBondContact O-CD 3.48Å; T131-P135 VanDerWaalsContact O-CG 3.23Å; T131-P135 WeakPolarHBondContact O-CG 3.38Å; T131-W386 HydrophobicContact CG2-CH2 4.08Å; T131-W386 HydrophobicContact CG2-CZ3 4.49Å; T131-W410 HydrophobicContact CG2-CZ2 3.89Å; T131-W410 PolarHBondContact OG1-NE1 3.44Å; T131-W410 VanDerWaalsContact OG1-NE1 3.11Å |
| 132 | V | 85.5 | Confident | 90.8 | Very high | 7 Ų | 7 | 9.2 Ų | 9.2 | 4% | 0.042 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -97.3 | -52.7 | 173.1 | -178.7 | 0 | 0 | 0 | 0 | 111.1 | G74 A129 Y130 T134 P135 T136 V406 | G74-V132 WeakPolarHBondContact O-CG2 3.34Å; A129-V132 PolarHBondContact O-N 3.44Å; Y130-V132 PolarHBondContact O-N 3.43Å; Y130-V132 VanDerWaalsContact O-N 3.17Å; V132-T134 PolarHBondContact O-N 2.96Å; V132-P135 WeakPolarHBondContact O-CD 3.45Å; V132-P135 WeakPolarHBondContact O-CG 3.39Å; V132-T136 PolarHBondContact O-OG1 3.32Å; V132-T136 VanDerWaalsContact O-OG1 3.1Å; V132-V406 HydrophobicContact CG2-CB 4.13Å; V132-V406 HydrophobicContact CG2-CG1 3.72Å; V132-V406 HydrophobicContact CG2-CG2 4.19Å |
| 133 | V | 88.9 | Confident | 90 | Very high | 1 Ų | 1 | 8.4 Ų | 8.4 | 1% | 0.006 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -71.5 | -35.3 | -169.9 | -175.7 | 0 | 0 | 0 | 0 | 112.2 | G77 A81 R86 T89 L90 A129 Y130 Y137 | G77-V133 WeakPolarHBondContact O-CG2 3.24Å; A81-V133 HydrophobicContact CB-CB 4.49Å; A81-V133 HydrophobicContact CB-CG1 4.09Å; A81-V133 HydrophobicContact CB-CG2 3.82Å; R86-V133 HydrophobicContact CB-CG1 4.39Å; T89-V133 HydrophobicContact CG2-CB 4.49Å; T89-V133 HydrophobicContact CG2-CG1 4.12Å; T89-V133 HydrophobicContact CG2-CG2 3.78Å; L90-V133 HydrophobicContact CD2-CB 4.17Å; L90-V133 HydrophobicContact CD2-CG1 3.94Å; L90-V133 HydrophobicContact CG-CG1 3.97Å; A129-V133 WeakPolarHBondContact O-CG2 3.2Å; A129-V133 PolarHBondContact O-N 2.85Å; Y130-V133 PolarHBondContact O-N 2.95Å; V133-Y137 VanDerWaalsContact O-CB 3.27Å; V133-Y137 WeakPolarHBondContact O-CB 3.24Å; V133-Y137 PolarHBondContact O-N 3.23Å |
| 134 | T | 90.5 | Very high | 88.6 | Confident | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -64.8 | -57.8 | -177.1 | -54.8 | 0 | 0 | 0 | 0 | 113 | I13 T14 S17 Y130 V132 T136 Y137 L138 | I13-T134 HydrophobicContact CG2-CG2 3.7Å; T14-T134 HydrophobicContact CG2-CG2 4.41Å; S17-T134 WeakPolarHBondContact CB-OG1 3.3Å; S17-T134 PolarHBondContact OG-OG1 3.46Å; S17-T134 VanDerWaalsContact OG-OG1 3.14Å; Y130-T134 WeakPolarHBondContact O-CB 3.39Å; Y130-T134 PolarHBondContact O-N 2.9Å; Y130-T134 PolarHBondContact O-OG1 3.37Å; V132-T134 PolarHBondContact O-N 2.96Å; T134-T136 VanDerWaalsContact C-N 3.28Å; T134-T136 PolarHBondContact O-N 3.37Å; T134-Y137 PolarHBondContact O-N 3.47Å; T134-L138 HydrophobicContact CG2-CD1 3.75Å; T134-L138 HydrophobicContact CG2-CG 4.26Å; T134-L138 WeakPolarHBondContact O-CB 3.47Å; T134-L138 VanDerWaalsContact O-CG 3.25Å; T134-L138 WeakPolarHBondContact O-CG 3.26Å; T134-L138 PolarHBondContact O-N 2.86Å |
| 135 | P | 84.7 | Confident | 87.3 | Confident | 15 Ų | 15 | 23.1 Ų | 23.1 | 10% | 0.097 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.5 | -38.1 | 179.6 | 24.1 | -33.9 | 0 | 0 | 0 | 111.9 | T131 V132 L138 S139 | T131-P135 WeakPolarHBondContact O-CD 3.48Å; T131-P135 VanDerWaalsContact O-CG 3.23Å; T131-P135 WeakPolarHBondContact O-CG 3.38Å; V132-P135 WeakPolarHBondContact O-CD 3.45Å; V132-P135 WeakPolarHBondContact O-CG 3.39Å; P135-L138 PolarHBondContact O-N 3.37Å; P135-S139 VanDerWaalsContact O-CB 3.28Å; P135-S139 WeakPolarHBondContact O-CB 3.42Å; P135-S139 PolarHBondContact O-N 2.82Å; P135-S139 PolarHBondContact O-OG 3.33Å |
| 136 | T | 83.4 | Confident | 86.1 | Confident | 20 Ų | 20 | 22.8 Ų | 22.8 | 12% | 0.123 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -57.7 | -53.3 | 174.1 | -62.5 | 0 | 0 | 0 | 0 | 110.5 | V132 T134 L138 S139 E140 | V132-T136 PolarHBondContact O-OG1 3.32Å; V132-T136 VanDerWaalsContact O-OG1 3.1Å; T134-T136 VanDerWaalsContact C-N 3.28Å; T134-T136 PolarHBondContact O-N 3.37Å; T136-L138 PolarHBondContact O-N 3.46Å; T136-S139 PolarHBondContact O-N 3.47Å; T136-S139 VanDerWaalsContact O-N 3.16Å; T136-S139 PolarHBondContact O-OG 2.96Å; T136-E140 HydrophobicContact CG2-CG 4.37Å; T136-E140 WeakPolarHBondContact CG2-OE1 3.4Å; T136-E140 WeakPolarHBondContact O-CG 3.36Å; T136-E140 PolarHBondContact O-N 3.13Å |
| 137 | Y | 89.2 | Confident | 84.9 | Confident | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.6 | -43.4 | -177.5 | -168.9 | -164.5 | 0 | 0 | 0 | 112.6 | I13 R86 L90 V133 T134 S139 E140 I141 M198 P202 | I13-Y137 HydrophobicContact CD1-CD1 3.34Å; I13-Y137 HydrophobicContact CD1-CD2 4.37Å; I13-Y137 HydrophobicContact CD1-CE1 3.39Å; I13-Y137 HydrophobicContact CD1-CE2 4.41Å; I13-Y137 HydrophobicContact CD1-CG 3.83Å; I13-Y137 HydrophobicContact CG1-CD1 3.6Å; I13-Y137 HydrophobicContact CG1-CE1 3.55Å; I13-Y137 HydrophobicContact CG2-CD1 4.48Å; R86-Y137 HydrophobicContact CB-CD1 3.91Å; R86-Y137 HydrophobicContact CB-CD2 3.76Å; R86-Y137 HydrophobicContact CB-CE2 4.38Å; R86-Y137 HydrophobicContact CB-CG 3.54Å; R86-Y137 HydrophobicContact CG-CD2 4.25Å; R86-Y137 HydrophobicContact CG-CG 4.18Å; L90-Y137 HydrophobicContact CD1-CD1 3.69Å; L90-Y137 HydrophobicContact CD1-CE1 4.24Å; V133-Y137 VanDerWaalsContact O-CB 3.27Å; V133-Y137 WeakPolarHBondContact O-CB 3.24Å; V133-Y137 PolarHBondContact O-N 3.23Å; T134-Y137 PolarHBondContact O-N 3.47Å; Y137-S139 VanDerWaalsContact C-N 3.3Å; Y137-S139 PolarHBondContact O-N 2.82Å; Y137-E140 PolarHBondContact O-N 3.46Å; Y137-I141 HydrophobicContact CD2-CG2 3.73Å; Y137-I141 HydrophobicContact CE2-CG2 3.32Å; Y137-I141 WeakPolarHBondContact O-CG1 3.5Å; Y137-I141 PolarHBondContact O-N 3.38Å; Y137-I141 VanDerWaalsContact O-N 3.11Å; Y137-M198 HydrophobicContact CE1-CE 4Å; Y137-P202 PolarHBondContact OH-O 2.95Å |
| 138 | L | 89.3 | Confident | 83.5 | Confident | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -58.8 | -41.4 | 175.4 | -69.8 | 174.2 | 0 | 0 | 0 | 111.7 | Y10 I13 T14 T134 P135 T136 I141 A142 A150 N154 | Y10-L138 HydrophobicContact CD1-CD2 3.43Å; Y10-L138 VanDerWaalsContact CD1-CD2 3.43Å; Y10-L138 HydrophobicContact CE1-CD2 4.06Å; Y10-L138 HydrophobicContact CG-CD2 4.25Å; I13-L138 HydrophobicContact CB-CD2 4.14Å; I13-L138 HydrophobicContact CD1-CD2 3.86Å; I13-L138 HydrophobicContact CG2-CD2 4.02Å; I13-L138 HydrophobicContact CG2-CG 4.12Å; T14-L138 HydrophobicContact CG2-CD1 3.82Å; T14-L138 HydrophobicContact CG2-CD2 4.32Å; T134-L138 HydrophobicContact CG2-CD1 3.75Å; T134-L138 HydrophobicContact CG2-CG 4.26Å; T134-L138 WeakPolarHBondContact O-CB 3.47Å; T134-L138 VanDerWaalsContact O-CG 3.25Å; T134-L138 WeakPolarHBondContact O-CG 3.26Å; T134-L138 PolarHBondContact O-N 2.86Å; P135-L138 PolarHBondContact O-N 3.37Å; T136-L138 PolarHBondContact O-N 3.46Å; L138-I141 WeakPolarHBondContact O-CG1 3.24Å; L138-A142 WeakPolarHBondContact O-CB 3.43Å; L138-A142 PolarHBondContact O-N 3.33Å; L138-A142 VanDerWaalsContact O-N 3.1Å; L138-A150 HydrophobicContact CB-CB 4.12Å; L138-A150 WeakPolarHBondContact CD1-O 3.44Å; L138-N154 HydrophobicContact CD1-CB 4.07Å |
| 139 | S | 83.1 | Confident | 82.5 | Confident | 27 Ų | 27 | 29.5 Ų | 29.5 | 19% | 0.189 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -71.4 | -32.1 | -179.9 | 76.9 | 0 | 0 | 0 | 0 | 113.8 | P135 T136 Y137 R147 | P135-S139 VanDerWaalsContact O-CB 3.28Å; P135-S139 WeakPolarHBondContact O-CB 3.42Å; P135-S139 PolarHBondContact O-N 2.82Å; P135-S139 PolarHBondContact O-OG 3.33Å; T136-S139 PolarHBondContact O-N 3.47Å; T136-S139 VanDerWaalsContact O-N 3.16Å; T136-S139 PolarHBondContact O-OG 2.96Å; Y137-S139 VanDerWaalsContact C-N 3.3Å; Y137-S139 PolarHBondContact O-N 2.82Å; S139-R147 PolarHBondContact O-NE 3.11Å |
| 140 | E | 85.4 | Confident | 81.7 | Confident | 10 Ų | 10 | 29.6 Ų | 29.6 | 5% | 0.047 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -78.5 | -29.5 | -179.6 | -71.9 | 175.5 | 170 | 0 | 0 | 112.5 | R86 T136 Y137 S204 | R86-E140 WeakPolarHBondContact CD-OE2 3.36Å; R86-E140 IonicContact CZ-OE1 3.42Å; R86-E140 IonicContact CZ-OE2 3.7Å; R86-E140 IonicContact NE-OE1 3.26Å; R86-E140 PolarHBondContact NE-OE1 3.01Å; R86-E140 IonicContact NE-OE2 2.79Å; R86-E140 PolarHBondContact NE-OE2 3.47Å; R86-E140 IonicContact NH2-OE1 2.75Å; R86-E140 PolarHBondContact NH2-OE1 3.25Å; R86-E140 IonicContact NH2-OE2 3.76Å; T136-E140 HydrophobicContact CG2-CG 4.37Å; T136-E140 WeakPolarHBondContact CG2-OE1 3.4Å; T136-E140 WeakPolarHBondContact O-CG 3.36Å; T136-E140 PolarHBondContact O-N 3.13Å; Y137-E140 PolarHBondContact O-N 3.46Å; E140-S204 VanDerWaalsContact CB-OG 3.28Å; E140-S204 WeakPolarHBondContact CB-OG 3.41Å; E140-S204 VanDerWaalsContact CD-OG 3.32Å; E140-S204 WeakPolarHBondContact OE2-CB 3.18Å; E140-S204 PolarHBondContact OE2-OG 3.36Å |
| 141 | I | 89.6 | Confident | 80.6 | Confident | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -88.3 | -17.7 | 173.3 | 69.6 | -179.4 | 0 | 0 | 0 | 112.7 | L6 T9 Y10 I13 Y137 L138 L225 R226 | L6-I141 HydrophobicContact CD1-CB 4.45Å; L6-I141 HydrophobicContact CD1-CD1 4.38Å; L6-I141 HydrophobicContact CD1-CG1 4.2Å; T9-I141 HydrophobicContact CG2-CD1 3.46Å; T9-I141 VanDerWaalsContact CG2-CD1 3.46Å; Y10-I141 HydrophobicContact CD1-CD1 3.67Å; Y10-I141 HydrophobicContact CD1-CG1 4.14Å; Y10-I141 HydrophobicContact CE1-CD1 3.64Å; Y10-I141 HydrophobicContact CE1-CG1 3.57Å; I13-I141 HydrophobicContact CD1-CD1 3.62Å; Y137-I141 HydrophobicContact CD2-CG2 3.73Å; Y137-I141 HydrophobicContact CE2-CG2 3.32Å; Y137-I141 WeakPolarHBondContact O-CG1 3.5Å; Y137-I141 PolarHBondContact O-N 3.38Å; Y137-I141 VanDerWaalsContact O-N 3.11Å; L138-I141 WeakPolarHBondContact O-CG1 3.24Å; I141-L225 HydrophobicContact CB-CD1 3.86Å; I141-L225 HydrophobicContact CB-CD2 4.4Å; I141-L225 HydrophobicContact CG2-CD1 3.85Å; I141-R226 PolarHBondContact O-NH1 2.77Å; I141-R226 PolarHBondContact O-NH2 3.31Å |
| 142 | A | 86.2 | Confident | 79.9 | Confident | 1 Ų | 1 | 29.9 Ų | 29.9 | 1% | 0.008 | 16% | 0.162 | C | C | . | . | S | Bend | trans | -70.1 | 139.8 | -180 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y10 L138 R147 A150 | Y10-A142 WeakPolarHBondContact OH-CA 3.4Å; Y10-A142 WeakPolarHBondContact OH-CB 3.4Å; L138-A142 WeakPolarHBondContact O-CB 3.43Å; L138-A142 PolarHBondContact O-N 3.33Å; L138-A142 VanDerWaalsContact O-N 3.1Å; A142-R147 HydrophobicContact CB-CG 4.13Å; A142-A150 HydrophobicContact CB-CB 3.76Å |
| 143 | P | 80 | Confident | 79.8 | Confident | 32 Ų | 32 | 32.2 Ų | 32.2 | 21% | 0.208 | 17% | 0.173 | C | C | . | . | trans | -54.5 | 144.8 | 164.4 | -22.4 | 32.6 | 0 | 0 | 0 | 110.2 | L6 K145 S146 R147 | L6-P143 HydrophobicContact CD2-CG 4.21Å; P143-K145 PolarHBondContact O-N 2.86Å; P143-K145 VanDerWaalsContact O-N 3.08Å; P143-S146 PolarHBondContact O-N 3.2Å; P143-R147 PolarHBondContact O-N 3.25Å | ||
| 144 | I | 69.5 | Low | 79.7 | Confident | 108 Ų | 108 | 32.4 Ų | 32.4 | 55% | 0.554 | 17% | 0.174 | S | C | * | . | G | 310 helix | trans | -50.8 | -41.5 | -175.8 | -62.5 | 169.9 | 0 | 0 | 0 | 112 | S146 | I144-S146 PolarHBondContact O-N 3.02Š|
| 145 | K | 69.2 | Low | 79.6 | Confident | 202 Ų | 202 | 33 Ų | 33 | 88% | 0.878 | 18% | 0.177 | S | C | * | . | G | 310 helix | trans | -70.9 | -13 | -179.5 | -63.2 | -176.7 | -179.8 | 179.1 | 0 | 114.3 | P143 | P143-K145 PolarHBondContact O-N 2.86Å; P143-K145 VanDerWaalsContact O-N 3.08Å |
| 146 | S | 71.8 | Confident | 80 | Confident | 50 Ų | 50 | 34.9 Ų | 34.9 | 35% | 0.35 | 18% | 0.183 | S | C | . | . | G | 310 helix | trans | -121.6 | 13.2 | -172 | -55.9 | 0 | 0 | 0 | 0 | 113.6 | P143 I144 G148 A149 A150 | P143-S146 PolarHBondContact O-N 3.2Å; I144-S146 PolarHBondContact O-N 3.02Å; S146-G148 VanDerWaalsContact C-N 3.27Å; S146-G148 PolarHBondContact O-N 3.06Å; S146-A149 PolarHBondContact O-N 2.86Å; S146-A150 PolarHBondContact O-N 2.9Å |
| 147 | R | 70.4 | Confident | 80.5 | Confident | 93 Ų | 93 | 34.8 Ų | 34.8 | 35% | 0.351 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -59.9 | -35.2 | 178.1 | -74.6 | -177.4 | 171.3 | 169.6 | 0.8 | 113.1 | S139 A142 P143 A150 G151 | S139-R147 PolarHBondContact O-NE 3.11Å; A142-R147 HydrophobicContact CB-CG 4.13Å; P143-R147 PolarHBondContact O-N 3.25Å; R147-A150 WeakPolarHBondContact O-CB 3.29Å; R147-A150 PolarHBondContact O-N 3.1Å; R147-G151 PolarHBondContact O-N 3.15Å; R147-G151 VanDerWaalsContact O-N 3.15Å |
| 148 | G | 68 | Low | 80.7 | Confident | 9 Ų | 9 | 35 Ų | 35 | 9% | 0.093 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -58.7 | -50.4 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | S146 A150 G151 I152 | S146-G148 VanDerWaalsContact C-N 3.27Å; S146-G148 PolarHBondContact O-N 3.06Å; G148-A150 VanDerWaalsContact C-N 3.27Å; G148-A150 PolarHBondContact O-N 3.31Å; G148-G151 PolarHBondContact O-N 3.06Å; G148-G151 VanDerWaalsContact O-N 3.13Å; G148-I152 WeakPolarHBondContact O-CG1 3.39Å; G148-I152 PolarHBondContact O-N 2.87Å; G148-I152 VanDerWaalsContact O-N 3.12Å |
| 149 | A | 71.9 | Confident | 80.9 | Confident | 40 Ų | 40 | 35 Ų | 35 | 33% | 0.331 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -58.6 | -36.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113 | S146 I152 M153 | S146-A149 PolarHBondContact O-N 2.86Å; A149-I152 PolarHBondContact O-N 2.92Å; A149-M153 PolarHBondContact O-N 2.97Å |
| 150 | A | 75.5 | Confident | 81.5 | Confident | 2 Ų | 2 | 37.1 Ų | 37.1 | 2% | 0.017 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.9 | -42.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y10 L138 A142 S146 R147 G148 I152 M153 | Y10-A150 HydrophobicContact CE1-CB 4.43Å; L138-A150 HydrophobicContact CB-CB 4.12Å; L138-A150 WeakPolarHBondContact CD1-O 3.44Å; A142-A150 HydrophobicContact CB-CB 3.76Å; S146-A150 PolarHBondContact O-N 2.9Å; R147-A150 WeakPolarHBondContact O-CB 3.29Å; R147-A150 PolarHBondContact O-N 3.1Å; G148-A150 VanDerWaalsContact C-N 3.27Å; G148-A150 PolarHBondContact O-N 3.31Å; A150-I152 VanDerWaalsContact C-N 3.34Å; A150-I152 PolarHBondContact O-N 3.43Å; A150-M153 PolarHBondContact O-N 3.27Å |
| 151 | G | 71.1 | Confident | 82.1 | Confident | 10 Ų | 10 | 36.7 Ų | 36.7 | 10% | 0.103 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.6 | -37.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | R147 G148 N154 | R147-G151 PolarHBondContact O-N 3.15Å; R147-G151 VanDerWaalsContact O-N 3.15Å; G148-G151 PolarHBondContact O-N 3.06Å; G148-G151 VanDerWaalsContact O-N 3.13Å; G151-N154 WeakPolarHBondContact O-CB 3.25Å; G151-N154 PolarHBondContact O-N 3.39Å |
| 152 | I | 76 | Confident | 82.3 | Confident | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.005 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -72.1 | -32.4 | 177.7 | -52.6 | 160 | 0 | 0 | 0 | 112.2 | G148 A149 A150 N154 Q155 F156 T317 V321 I324 | G148-I152 WeakPolarHBondContact O-CG1 3.39Å; G148-I152 PolarHBondContact O-N 2.87Å; G148-I152 VanDerWaalsContact O-N 3.12Å; A149-I152 PolarHBondContact O-N 2.92Å; A150-I152 VanDerWaalsContact C-N 3.34Å; A150-I152 PolarHBondContact O-N 3.43Å; I152-N154 PolarHBondContact O-N 3.49Å; I152-Q155 CarbonylContact O-C 3.32Å; I152-Q155 WeakPolarHBondContact O-CA 3.48Å; I152-Q155 PolarHBondContact O-N 2.89Å; I152-F156 WeakPolarHBondContact O-CB 3.39Å; I152-F156 PolarHBondContact O-N 3.49Å; I152-T317 HydrophobicContact CG2-CG2 4.45Å; I152-V321 HydrophobicContact CB-CG2 4.27Å; I152-V321 HydrophobicContact CD1-CB 4.32Å; I152-V321 HydrophobicContact CD1-CG1 4.37Å; I152-V321 HydrophobicContact CD1-CG2 4.32Å; I152-V321 HydrophobicContact CG2-CB 4.34Å; I152-V321 HydrophobicContact CG2-CG2 3.31Å; I152-I324 HydrophobicContact CD1-CB 3.84Å; I152-I324 HydrophobicContact CD1-CD1 3.92Å; I152-I324 HydrophobicContact CD1-CG1 4.47Å; I152-I324 HydrophobicContact CD1-CG2 3.15Å; I152-I324 HydrophobicContact CG1-CD1 3.71Å; I152-I324 HydrophobicContact CG1-CG2 4.06Å |
| 153 | M | 83.1 | Confident | 82.8 | Confident | 55 Ų | 55 | 39.5 Ų | 39.5 | 27% | 0.271 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -55.1 | -39.7 | 177.3 | -173.1 | 66.2 | 91.7 | 0 | 0 | 111.1 | T14 A149 A150 F156 V157 | T14-M153 HydrophobicContact CG2-CG 4.05Å; A149-M153 PolarHBondContact O-N 2.97Å; A150-M153 PolarHBondContact O-N 3.27Å; M153-F156 PolarHBondContact O-N 3.47Å; M153-F156 HydrophobicContact SD-CD1 4.35Å; M153-V157 WeakPolarHBondContact O-CG2 3.45Å; M153-V157 PolarHBondContact O-N 2.91Å |
| 154 | N | 86.4 | Confident | 83.6 | Confident | 5 Ų | 5 | 41.1 Ų | 41.1 | 3% | 0.027 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -57.7 | -52.9 | 172.4 | -178.9 | 59.5 | 0 | 0 | 0 | 111.3 | S18 L138 G151 I152 F156 V157 T158 | S18-N154 VanDerWaalsContact CB-OD1 3.26Å; S18-N154 WeakPolarHBondContact CB-OD1 3.27Å; S18-N154 PolarHBondContact OG-OD1 3.08Å; L138-N154 HydrophobicContact CD1-CB 4.07Å; G151-N154 WeakPolarHBondContact O-CB 3.25Å; G151-N154 PolarHBondContact O-N 3.39Å; I152-N154 PolarHBondContact O-N 3.49Å; N154-F156 PolarHBondContact O-N 2.8Å; N154-V157 PolarHBondContact O-N 3.44Å; N154-T158 WeakPolarHBondContact O-CB 3.41Å; N154-T158 PolarHBondContact O-N 2.97Å; N154-T158 PolarHBondContact O-OG1 3.44Å; N154-T158 VanDerWaalsContact O-OG1 3.1Å |
| 155 | Q | 89 | Confident | 84.9 | Confident | 13 Ų | 13 | 36 Ų | 36 | 6% | 0.061 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62.1 | -42.1 | 179.6 | -175.9 | 61.4 | 19.1 | 0 | 0 | 112.4 | I152 T158 V159 T317 G382 | I152-Q155 CarbonylContact O-C 3.32Å; I152-Q155 WeakPolarHBondContact O-CA 3.48Å; I152-Q155 PolarHBondContact O-N 2.89Å; Q155-T158 WeakPolarHBondContact O-CB 3.36Å; Q155-T158 PolarHBondContact O-N 3.27Å; Q155-V159 WeakPolarHBondContact O-CG2 3.33Å; Q155-V159 PolarHBondContact O-N 3.08Å; Q155-T317 HydrophobicContact CG-CG2 4.16Å; Q155-G382 PolarHBondContact OE1-O 3Å; Q155-G382 VanDerWaalsContact OE1-O 3.1Å |
| 156 | F | 91.6 | Very high | 86.1 | Confident | 54 Ų | 54 | 26.8 Ų | 26.8 | 24% | 0.237 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.1 | -49 | 178.5 | 174.5 | -106.2 | 0 | 0 | 0 | 111.3 | I152 M153 N154 T158 V159 L160 V314 T317 I318 | I152-F156 WeakPolarHBondContact O-CB 3.39Å; I152-F156 PolarHBondContact O-N 3.49Å; M153-F156 PolarHBondContact O-N 3.47Å; M153-F156 HydrophobicContact SD-CD1 4.35Å; N154-F156 PolarHBondContact O-N 2.8Å; F156-T158 VanDerWaalsContact C-N 3.33Å; F156-T158 PolarHBondContact O-N 3.44Å; F156-V159 WeakPolarHBondContact O-CG2 3.45Å; F156-V159 PolarHBondContact O-N 3.16Å; F156-L160 HydrophobicContact CE1-CD2 4.22Å; F156-L160 HydrophobicContact CZ-CD2 4.33Å; F156-L160 VanDerWaalsContact O-CB 3.25Å; F156-L160 WeakPolarHBondContact O-CB 3.47Å; F156-L160 PolarHBondContact O-N 3.32Å; F156-V314 HydrophobicContact CE2-CG1 4.48Å; F156-T317 HydrophobicContact CB-CG2 4.17Å; F156-T317 HydrophobicContact CD2-CG2 4.43Å; F156-I318 HydrophobicContact CD2-CG1 4.17Å; F156-I318 HydrophobicContact CE2-CD1 4.14Å; F156-I318 HydrophobicContact CE2-CG1 3.69Å |
| 157 | V | 94.2 | Very high | 87.2 | Confident | 18 Ų | 18 | 26.3 Ų | 26.3 | 11% | 0.109 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -66.8 | -37.1 | 178 | 175.6 | 0 | 0 | 0 | 0 | 111.2 | T14 F19 M153 N154 L160 A161 | T14-V157 HydrophobicContact CG2-CG2 4.46Å; F19-V157 HydrophobicContact CB-CG1 3.97Å; M153-V157 WeakPolarHBondContact O-CG2 3.45Å; M153-V157 PolarHBondContact O-N 2.91Å; N154-V157 PolarHBondContact O-N 3.44Å; V157-L160 PolarHBondContact O-N 3.36Å; V157-A161 VanDerWaalsContact O-CB 3.23Å; V157-A161 WeakPolarHBondContact O-CB 3.22Å; V157-A161 PolarHBondContact O-N 3.08Å |
| 158 | T | 93.7 | Very high | 88.5 | Confident | 5 Ų | 5 | 23.5 Ų | 23.5 | 3% | 0.031 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -59.9 | -49.2 | 173.8 | -67.3 | 0 | 0 | 0 | 0 | 112 | S18 F21 G22 N154 Q155 F156 A161 I162 | S18-T158 PolarHBondContact O-OG1 2.93Å; S18-T158 VanDerWaalsContact O-OG1 3.11Å; F21-T158 HydrophobicContact CD1-CG2 3.65Å; F21-T158 HydrophobicContact CE1-CG2 3.78Å; G22-T158 WeakPolarHBondContact CA-O 3.5Å; N154-T158 WeakPolarHBondContact O-CB 3.41Å; N154-T158 PolarHBondContact O-N 2.97Å; N154-T158 PolarHBondContact O-OG1 3.44Å; N154-T158 VanDerWaalsContact O-OG1 3.1Å; Q155-T158 WeakPolarHBondContact O-CB 3.36Å; Q155-T158 PolarHBondContact O-N 3.27Å; F156-T158 VanDerWaalsContact C-N 3.33Å; F156-T158 PolarHBondContact O-N 3.44Å; T158-A161 PolarHBondContact O-N 2.95Å; T158-I162 HydrophobicContact CG2-CD1 4.33Å; T158-I162 WeakPolarHBondContact O-CG1 3.49Å; T158-I162 PolarHBondContact O-N 3.38Å |
| 159 | V | 94.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -70.5 | -33.6 | 179.7 | -60 | 0 | 0 | 0 | 0 | 112.5 | Q155 F156 A161 I162 F163 I313 V314 T317 | Q155-V159 WeakPolarHBondContact O-CG2 3.33Å; Q155-V159 PolarHBondContact O-N 3.08Å; F156-V159 WeakPolarHBondContact O-CG2 3.45Å; F156-V159 PolarHBondContact O-N 3.16Å; V159-A161 VanDerWaalsContact C-N 3.31Å; V159-I162 PolarHBondContact O-N 3.32Å; V159-F163 PolarHBondContact O-N 3.24Å; V159-I313 HydrophobicContact CB-CG1 4.36Å; V159-I313 HydrophobicContact CB-CG2 4.24Å; V159-I313 HydrophobicContact CG1-CD1 3.86Å; V159-I313 HydrophobicContact CG1-CG1 3.85Å; V159-V314 HydrophobicContact CB-CG2 4.33Å; V159-V314 HydrophobicContact CG2-CG2 4.08Å; V159-V314 WeakPolarHBondContact O-CG2 3.45Å; V159-T317 HydrophobicContact CG2-CG2 3.95Å; V159-T317 WeakPolarHBondContact CG2-OG1 3.5Å |
| 160 | L | 95.7 | Very high | 90.7 | Very high | 72 Ų | 72 | 22.4 Ų | 22.4 | 38% | 0.377 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -64.1 | -39.9 | 173.6 | -178.1 | 62.2 | 0 | 0 | 0 | 110.9 | F156 V157 F163 L164 | F156-L160 HydrophobicContact CE1-CD2 4.22Å; F156-L160 HydrophobicContact CZ-CD2 4.33Å; F156-L160 VanDerWaalsContact O-CB 3.25Å; F156-L160 WeakPolarHBondContact O-CB 3.47Å; F156-L160 PolarHBondContact O-N 3.32Å; V157-L160 PolarHBondContact O-N 3.36Å; L160-F163 PolarHBondContact O-N 3.28Å; L160-L164 WeakPolarHBondContact O-CB 3.48Å; L160-L164 PolarHBondContact O-N 2.97Å |
| 161 | A | 96.6 | Very high | 91.4 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -68.6 | -37.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | F19 V157 T158 V159 L164 S165 | F19-A161 HydrophobicContact CB-CB 4.37Å; F19-A161 HydrophobicContact CD2-CB 3.54Å; F19-A161 HydrophobicContact CE2-CB 3.9Å; F19-A161 HydrophobicContact CG-CB 3.98Å; F19-A161 WeakPolarHBondContact O-CB 3.29Å; V157-A161 VanDerWaalsContact O-CB 3.23Å; V157-A161 WeakPolarHBondContact O-CB 3.22Å; V157-A161 PolarHBondContact O-N 3.08Å; T158-A161 PolarHBondContact O-N 2.95Å; V159-A161 VanDerWaalsContact C-N 3.31Å; A161-L164 PolarHBondContact O-N 2.94Å; A161-S165 WeakPolarHBondContact O-CB 3.43Å; A161-S165 PolarHBondContact O-N 3.26Å; A161-S165 PolarHBondContact O-OG 3.2Å |
| 162 | I | 95 | Very high | 92.3 | Very high | 6 Ų | 6 | 30 Ų | 30 | 3% | 0.031 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -57.6 | -52.7 | 170.1 | -69.3 | 166.5 | 0 | 0 | 0 | 109.5 | G22 T25 T158 V159 L164 S165 Q166 L285 | G22-I162 WeakPolarHBondContact O-CG1 3.32Å; T25-I162 HydrophobicContact CG2-CD1 4.31Å; T158-I162 HydrophobicContact CG2-CD1 4.33Å; T158-I162 WeakPolarHBondContact O-CG1 3.49Å; T158-I162 PolarHBondContact O-N 3.38Å; V159-I162 PolarHBondContact O-N 3.32Å; I162-L164 PolarHBondContact O-N 3.37Å; I162-S165 PolarHBondContact O-N 2.87Å; I162-S165 PolarHBondContact O-OG 2.97Å; I162-Q166 WeakPolarHBondContact O-CG 3.46Å; I162-Q166 PolarHBondContact O-N 2.9Å; I162-Q166 VanDerWaalsContact O-N 3.11Å; I162-L285 HydrophobicContact CD1-CD1 4.06Å; I162-L285 HydrophobicContact CG2-CD2 4.16Å |
| 163 | F | 96.3 | Very high | 93.2 | Very high | 55 Ų | 55 | 33.6 Ų | 33.6 | 24% | 0.241 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.2 | -45.8 | 179.5 | 176.8 | -117.6 | 0 | 0 | 0 | 112.2 | V159 L160 S165 Q166 V167 L307 G310 A311 V314 | V159-F163 PolarHBondContact O-N 3.24Å; L160-F163 PolarHBondContact O-N 3.28Å; F163-S165 VanDerWaalsContact C-N 3.29Å; F163-S165 PolarHBondContact O-N 3.3Å; F163-Q166 WeakPolarHBondContact O-CB 3.45Å; F163-Q166 PolarHBondContact O-N 3.02Å; F163-Q166 VanDerWaalsContact O-N 3.08Å; F163-V167 HydrophobicContact CD1-CG2 4.46Å; F163-V167 HydrophobicContact CD2-CG2 4.48Å; F163-V167 HydrophobicContact CE1-CG2 4.11Å; F163-V167 HydrophobicContact CE2-CG2 4.17Å; F163-V167 HydrophobicContact CZ-CG2 3.96Å; F163-V167 WeakPolarHBondContact O-CG2 3.41Å; F163-V167 PolarHBondContact O-N 3.32Å; F163-L307 HydrophobicContact CD2-CD1 3.76Å; F163-L307 HydrophobicContact CE2-CD1 3.25Å; F163-L307 HydrophobicContact CE2-CG 3.86Å; F163-L307 HydrophobicContact CZ-CD1 4.02Å; F163-G310 VanDerWaalsContact CD2-C 3.43Å; F163-A311 HydrophobicContact CD2-CB 4.45Å; F163-A311 HydrophobicContact CE2-CB 3.89Å; F163-A311 HydrophobicContact CZ-CB 4.41Å; F163-V314 HydrophobicContact CB-CG2 3.74Å; F163-V314 HydrophobicContact CG-CG2 4.25Å |
| 164 | L | 96.6 | Very high | 93.7 | Very high | 65 Ų | 65 | 32.7 Ų | 32.7 | 34% | 0.34 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -61.4 | -38.9 | 177.6 | -175.2 | 63.2 | 0 | 0 | 0 | 111.8 | F19 L160 A161 I162 Q166 V167 L168 | F19-L164 HydrophobicContact CE2-CD2 3.81Å; F19-L164 HydrophobicContact CZ-CD2 3.98Å; L160-L164 WeakPolarHBondContact O-CB 3.48Å; L160-L164 PolarHBondContact O-N 2.97Å; A161-L164 PolarHBondContact O-N 2.94Å; I162-L164 PolarHBondContact O-N 3.37Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 3.33Å; L164-V167 PolarHBondContact O-N 3.16Å; L164-L168 HydrophobicContact CD1-CD1 4.27Å; L164-L168 HydrophobicContact CD1-CG 4.21Å; L164-L168 HydrophobicContact CG-CD1 4.02Å; L164-L168 HydrophobicContact CG-CG 4.34Å; L164-L168 WeakPolarHBondContact O-CB 3.48Å; L164-L168 WeakPolarHBondContact O-CG 3.34Å; L164-L168 PolarHBondContact O-N 3.16Å |
| 165 | S | 95.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.7 | -33.2 | 175.7 | 76.5 | 0 | 0 | 0 | 0 | 112.9 | G26 V27 A161 I162 F163 G169 | G26-S165 WeakPolarHBondContact CA-OG 3.31Å; V27-S165 PolarHBondContact N-OG 2.88Å; V27-S165 VanDerWaalsContact N-OG 3.13Å; A161-S165 WeakPolarHBondContact O-CB 3.43Å; A161-S165 PolarHBondContact O-N 3.26Å; A161-S165 PolarHBondContact O-OG 3.2Å; I162-S165 PolarHBondContact O-N 2.87Å; I162-S165 PolarHBondContact O-OG 2.97Å; F163-S165 VanDerWaalsContact C-N 3.29Å; F163-S165 PolarHBondContact O-N 3.3Å; S165-G169 WeakPolarHBondContact O-CA 3.49Å; S165-G169 PolarHBondContact O-N 2.62Å |
| 166 | Q | 94.5 | Very high | 94.1 | Very high | 10 Ų | 10 | 34.4 Ų | 34.4 | 5% | 0.047 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -72.6 | -41.3 | 174.8 | -66.3 | 172.2 | -15.6 | 0 | 0 | 111.5 | I162 F163 L164 G169 L170 N306 L307 | I162-Q166 WeakPolarHBondContact O-CG 3.46Å; I162-Q166 PolarHBondContact O-N 2.9Å; I162-Q166 VanDerWaalsContact O-N 3.11Å; F163-Q166 WeakPolarHBondContact O-CB 3.45Å; F163-Q166 PolarHBondContact O-N 3.02Å; F163-Q166 VanDerWaalsContact O-N 3.08Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 3.33Å; Q166-G169 PolarHBondContact O-N 3.48Å; Q166-L170 PolarHBondContact O-N 3.12Å; Q166-N306 PolarHBondContact NE2-OD1 3.11Å; Q166-N306 PolarHBondContact OE1-O 3.43Å; Q166-L307 HydrophobicContact CB-CD1 4.25Å |
| 167 | V | 96.3 | Very high | 94 | Very high | 39 Ų | 39 | 37.5 Ų | 37.5 | 24% | 0.236 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.2 | -54 | 173.5 | 174.2 | 0 | 0 | 0 | 0 | 110 | F163 L164 G169 L170 I173 L307 | F163-V167 HydrophobicContact CD1-CG2 4.46Å; F163-V167 HydrophobicContact CD2-CG2 4.48Å; F163-V167 HydrophobicContact CE1-CG2 4.11Å; F163-V167 HydrophobicContact CE2-CG2 4.17Å; F163-V167 HydrophobicContact CZ-CG2 3.96Å; F163-V167 WeakPolarHBondContact O-CG2 3.41Å; F163-V167 PolarHBondContact O-N 3.32Å; L164-V167 PolarHBondContact O-N 3.16Å; V167-G169 VanDerWaalsContact C-N 3.26Å; V167-G169 PolarHBondContact O-N 3.13Å; V167-L170 WeakPolarHBondContact O-CB 3.32Å; V167-L170 WeakPolarHBondContact O-CG 3.49Å; V167-L170 PolarHBondContact O-N 2.72Å; V167-I173 HydrophobicContact CG1-CD1 4.13Å; V167-I173 WeakPolarHBondContact O-CD1 3.43Å; V167-L307 HydrophobicContact CB-CD1 4.37Å; V167-L307 HydrophobicContact CG2-CD1 3.43Å; V167-L307 VanDerWaalsContact CG2-CD1 3.43Å |
| 168 | L | 96.3 | Very high | 94 | Very high | 34 Ų | 34 | 44 Ų | 44 | 18% | 0.178 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -68 | -30 | -178.4 | -63.9 | 178.1 | 0 | 0 | 0 | 112.2 | Y23 L164 L170 I173 M174 L183 L186 | Y23-L168 HydrophobicContact CE2-CD1 4.21Å; L164-L168 HydrophobicContact CD1-CD1 4.27Å; L164-L168 HydrophobicContact CD1-CG 4.21Å; L164-L168 HydrophobicContact CG-CD1 4.02Å; L164-L168 HydrophobicContact CG-CG 4.34Å; L164-L168 WeakPolarHBondContact O-CB 3.48Å; L164-L168 WeakPolarHBondContact O-CG 3.34Å; L164-L168 PolarHBondContact O-N 3.16Å; L168-L170 PolarHBondContact O-N 3.38Å; L168-I173 HydrophobicContact CD2-CG2 3.93Å; L168-M174 WeakPolarHBondContact O-CA 3.32Å; L168-M174 WeakPolarHBondContact O-CB 3.36Å; L168-M174 PolarHBondContact O-N 3.45Å; L168-L183 HydrophobicContact CB-CD1 3.63Å; L168-L186 HydrophobicContact CD1-CD2 3.35Å |
| 169 | G | 94.2 | Very high | 94.1 | Very high | 8 Ų | 8 | 47.9 Ų | 47.9 | 8% | 0.082 | 25% | 0.248 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -8.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115 | A30 S165 Q166 V167 G175 | A30-G169 VanDerWaalsContact CB-O 3.25Å; A30-G169 WeakPolarHBondContact CB-O 3.4Å; S165-G169 WeakPolarHBondContact O-CA 3.49Å; S165-G169 PolarHBondContact O-N 2.62Å; Q166-G169 PolarHBondContact O-N 3.48Å; V167-G169 VanDerWaalsContact C-N 3.26Å; V167-G169 PolarHBondContact O-N 3.13Å; G169-G175 WeakPolarHBondContact O-CA 3.3Å |
| 170 | L | 93.4 | Very high | 94.1 | Very high | 19 Ų | 19 | 48.1 Ų | 48.1 | 10% | 0.099 | 25% | 0.249 | C | C | . | . | S | Bend | trans | -58.4 | 143.2 | 172.6 | -69.3 | 177.2 | 0 | 0 | 0 | 111 | Q166 V167 L168 Q172 I173 M174 G175 F304 L307 | Q166-L170 PolarHBondContact O-N 3.12Å; V167-L170 WeakPolarHBondContact O-CB 3.32Å; V167-L170 WeakPolarHBondContact O-CG 3.49Å; V167-L170 PolarHBondContact O-N 2.72Å; L168-L170 PolarHBondContact O-N 3.38Å; L170-Q172 PolarHBondContact O-N 2.95Å; L170-Q172 VanDerWaalsContact O-N 3.15Å; L170-I173 HydrophobicContact CB-CD1 4.4Å; L170-I173 HydrophobicContact CD1-CD1 4.42Å; L170-I173 PolarHBondContact O-N 3.21Å; L170-M174 PolarHBondContact O-N 3.11Å; L170-G175 PolarHBondContact O-N 3.01Å; L170-F304 HydrophobicContact CD1-CE1 4.43Å; L170-L307 HydrophobicContact CD1-CD2 4.49Å |
| 171 | S | 89.3 | Confident | 94.1 | Very high | 66 Ų | 66 | 44.9 Ų | 44.9 | 46% | 0.462 | 23% | 0.233 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -19.7 | -179.2 | 57.9 | 0 | 0 | 0 | 0 | 113.4 | I173 G175 T176 | S171-I173 VanDerWaalsContact C-N 3.31Å; S171-G175 WeakPolarHBondContact CA-O 3.36Å; S171-T176 WeakPolarHBondContact O-CG2 3.12Å |
| 172 | Q | 91 | Very high | 94.1 | Very high | 105 Ų | 105 | 50.1 Ų | 50.1 | 49% | 0.491 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | -12 | 174 | -57.1 | 86.9 | -16.8 | 0 | 0 | 113.4 | L170 | L170-Q172 PolarHBondContact O-N 2.95Å; L170-Q172 VanDerWaalsContact O-N 3.15Å |
| 173 | I | 93.9 | Very high | 94.2 | Very high | 77 Ų | 77 | 49.8 Ų | 49.8 | 40% | 0.395 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -116.1 | -86.6 | -174.4 | -64.1 | 165.5 | 0 | 0 | 0 | 110.3 | V167 L168 L170 S171 | V167-I173 HydrophobicContact CG1-CD1 4.13Å; V167-I173 WeakPolarHBondContact O-CD1 3.43Å; L168-I173 HydrophobicContact CD2-CG2 3.93Å; L170-I173 HydrophobicContact CB-CD1 4.4Å; L170-I173 HydrophobicContact CD1-CD1 4.42Å; L170-I173 PolarHBondContact O-N 3.21Å; S171-I173 VanDerWaalsContact C-N 3.31Å |
| 174 | M | 93.6 | Very high | 94.1 | Very high | 36 Ų | 36 | 47.2 Ų | 47.2 | 18% | 0.177 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -123.8 | -5.9 | -178.5 | -63.8 | 176.3 | 78 | 0 | 0 | 113.6 | L168 L170 T176 F179 W180 F182 L183 | L168-M174 WeakPolarHBondContact O-CA 3.32Å; L168-M174 WeakPolarHBondContact O-CB 3.36Å; L168-M174 PolarHBondContact O-N 3.45Å; L170-M174 PolarHBondContact O-N 3.11Å; M174-T176 PolarHBondContact O-N 3.27Å; M174-F179 HydrophobicContact CB-CB 4.08Å; M174-F179 HydrophobicContact CG-CB 4.42Å; M174-F179 CarbonylContact O-C 3.26Å; M174-F179 VanDerWaalsContact O-C 3.26Å; M174-F179 WeakPolarHBondContact O-CB 3.28Å; M174-W180 PolarHBondContact O-N 3.4Å; M174-F182 HydrophobicContact CE-CB 3.71Å; M174-L183 HydrophobicContact CB-CB 4.01Å; M174-L183 HydrophobicContact CB-CD1 4.04Å; M174-L183 HydrophobicContact CB-CG 4.47Å; M174-L183 HydrophobicContact CE-CB 4.3Å; M174-L183 HydrophobicContact SD-CD1 4.45Å |
| 175 | G | 90.4 | Very high | 94.1 | Very high | 11 Ų | 11 | 44.3 Ų | 44.3 | 11% | 0.113 | 23% | 0.229 | C | C | . | . | trans | -73.4 | 45.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114 | G169 L170 S171 | G169-G175 WeakPolarHBondContact O-CA 3.3Å; L170-G175 PolarHBondContact O-N 3.01Å; S171-G175 WeakPolarHBondContact CA-O 3.36Å | ||
| 176 | T | 93 | Very high | 94.1 | Very high | 42 Ų | 42 | 46.4 Ų | 46.4 | 26% | 0.258 | 24% | 0.24 | S | C | . | . | S | Bend | trans | -119.1 | 160.1 | -178.3 | 64 | 0 | 0 | 0 | 0 | 110.8 | S171 M174 K178 F179 W180 | S171-T176 WeakPolarHBondContact O-CG2 3.12Å; M174-T176 PolarHBondContact O-N 3.27Å; T176-K178 PolarHBondContact O-N 3.1Å; T176-F179 PolarHBondContact O-N 3.04Å; T176-F179 VanDerWaalsContact O-N 3.1Å; T176-F179 WeakPolarHBondContact OG1-CD2 3.42Å; T176-F179 PolarHBondContact OG1-N 2.85Å; T176-W180 PolarHBondContact O-N 3.37Å |
| 177 | D | 90.4 | Very high | 94.2 | Very high | 119 Ų | 119 | 46 Ų | 46 | 64% | 0.636 | 24% | 0.238 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -51.1 | -31.8 | 176.6 | -74.9 | -54.6 | 0 | 0 | 0 | 113.5 | L34 W180 | L34-D177 WeakPolarHBondContact CD2-OD1 3.16Å; D177-W180 VanDerWaalsContact O-CD1 3.24Å; D177-W180 PolarHBondContact O-NE1 3.42Å |
| 178 | K | 92.9 | Very high | 94.1 | Very high | 154 Ų | 154 | 44.8 Ų | 44.8 | 67% | 0.67 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -84.1 | -37.6 | -179.6 | -175.1 | 175.7 | 177.9 | 179.5 | 0 | 113.3 | T176 | T176-K178 PolarHBondContact O-N 3.1Š|
| 179 | F | 96 | Very high | 94.1 | Very high | 87 Ų | 87 | 46.9 Ų | 46.9 | 38% | 0.382 | 25% | 0.248 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104.5 | -9.5 | -167.2 | -67.5 | -63.5 | 0 | 0 | 0 | 115 | M174 T176 F182 L183 | M174-F179 HydrophobicContact CB-CB 4.08Å; M174-F179 HydrophobicContact CG-CB 4.42Å; M174-F179 CarbonylContact O-C 3.26Å; M174-F179 VanDerWaalsContact O-C 3.26Å; M174-F179 WeakPolarHBondContact O-CB 3.28Å; T176-F179 PolarHBondContact O-N 3.04Å; T176-F179 VanDerWaalsContact O-N 3.1Å; T176-F179 WeakPolarHBondContact OG1-CD2 3.42Å; T176-F179 PolarHBondContact OG1-N 2.85Å; F179-F182 HydrophobicContact CD1-CD2 4.24Å; F179-F182 WeakPolarHBondContact O-CB 3.37Å; F179-F182 PolarHBondContact O-N 2.8Å; F179-F182 VanDerWaalsContact O-N 3.13Å; F179-L183 PolarHBondContact O-N 3.2Å |
| 180 | W | 95.3 | Very high | 94.1 | Very high | 6 Ų | 6 | 47.8 Ų | 47.8 | 2% | 0.023 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.8 | -33.6 | -179.4 | 77 | -98.1 | 0 | 0 | 0 | 115.5 | P31 L34 I35 F38 V108 I116 M174 T176 D177 F182 L183 L184 | P31-W180 HydrophobicContact CB-CB 3.71Å; P31-W180 HydrophobicContact CB-CG 4.37Å; L34-W180 HydrophobicContact CB-CG 4.23Å; L34-W180 HydrophobicContact CD1-CB 3.89Å; L34-W180 HydrophobicContact CD1-CG 4.24Å; I35-W180 HydrophobicContact CD1-CE3 4.27Å; I35-W180 HydrophobicContact CD1-CZ3 4.31Å; I35-W180 HydrophobicContact CG1-CD2 4.23Å; I35-W180 HydrophobicContact CG1-CE3 3.69Å; I35-W180 HydrophobicContact CG1-CH2 4.19Å; I35-W180 HydrophobicContact CG1-CZ3 3.69Å; F38-W180 HydrophobicContact CB-CZ2 4.18Å; F38-W180 HydrophobicContact CD1-CH2 4.26Å; F38-W180 HydrophobicContact CD1-CZ2 4.1Å; F38-W180 HydrophobicContact CD2-CZ2 4.41Å; F38-W180 AromaticContact CG-CZ2 3.96Å; F38-W180 HydrophobicContact CG-CZ2 3.96Å; V108-W180 HydrophobicContact CG2-CH2 4.05Å; V108-W180 HydrophobicContact CG2-CZ2 3.45Å; V108-W180 VanDerWaalsContact CG2-CZ2 3.45Å; I116-W180 HydrophobicContact CD1-CH2 3.59Å; I116-W180 HydrophobicContact CD1-CZ3 4.06Å; I116-W180 HydrophobicContact CG1-CH2 4.35Å; M174-W180 PolarHBondContact O-N 3.4Å; T176-W180 PolarHBondContact O-N 3.37Å; D177-W180 VanDerWaalsContact O-CD1 3.24Å; D177-W180 PolarHBondContact O-NE1 3.42Å; W180-F182 VanDerWaalsContact C-N 3.35Å; W180-L183 WeakPolarHBondContact O-CB 3.37Å; W180-L183 PolarHBondContact O-N 3.24Å; W180-L184 HydrophobicContact CE3-CD1 3.85Å; W180-L184 HydrophobicContact CZ3-CD1 3.82Å; W180-L184 PolarHBondContact O-N 2.81Å |
| 181 | P | 95.6 | Very high | 94.2 | Very high | 4 Ų | 4 | 46.9 Ų | 46.9 | 3% | 0.026 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -67.8 | -38.8 | 177.5 | -17.8 | 32 | 0 | 0 | 0 | 111.2 | V108 L183 L184 G185 | V108-P181 HydrophobicContact CB-CG 4.39Å; V108-P181 HydrophobicContact CG2-CB 4.33Å; V108-P181 HydrophobicContact CG2-CG 3.43Å; V108-P181 VanDerWaalsContact CG2-CG 3.43Å; P181-L183 VanDerWaalsContact C-N 3.33Å; P181-L184 PolarHBondContact O-N 3.44Å; P181-G185 PolarHBondContact O-N 2.84Å |
| 182 | F | 96.5 | Very high | 94.4 | Very high | 109 Ų | 109 | 50 Ų | 50 | 48% | 0.478 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -68.4 | -33.9 | 175.7 | -59.8 | -83.7 | 0 | 0 | 0 | 111.8 | T105 M174 F179 W180 G185 L186 | T105-F182 HydrophobicContact CG2-CD1 3.54Å; T105-F182 HydrophobicContact CG2-CE1 3.63Å; T105-F182 HydrophobicContact CG2-CG 4.22Å; T105-F182 HydrophobicContact CG2-CZ 4.37Å; M174-F182 HydrophobicContact CE-CB 3.71Å; F179-F182 HydrophobicContact CD1-CD2 4.24Å; F179-F182 WeakPolarHBondContact O-CB 3.37Å; F179-F182 PolarHBondContact O-N 2.8Å; F179-F182 VanDerWaalsContact O-N 3.13Å; W180-F182 VanDerWaalsContact C-N 3.35Å; F182-G185 CarbonylContact O-C 3.59Å; F182-G185 PolarHBondContact O-N 3.01Å; F182-L186 PolarHBondContact O-N 3.49Å |
| 183 | L | 96.6 | Very high | 94.5 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.5 | -47.9 | 174.1 | 174.7 | 69.7 | 0 | 0 | 0 | 110.5 | Y23 V27 A30 P31 L168 M174 F179 W180 P181 G185 | Y23-L183 WeakPolarHBondContact CE1-O 3.24Å; Y23-L183 VanDerWaalsContact OH-CD1 3.32Å; Y23-L183 WeakPolarHBondContact OH-CD1 3.37Å; Y23-L183 PolarHBondContact OH-O 2.7Å; V27-L183 HydrophobicContact CG2-CD1 3.97Å; V27-L183 HydrophobicContact CG2-CD2 3.93Å; V27-L183 HydrophobicContact CG2-CG 3.53Å; A30-L183 HydrophobicContact CB-CD2 4.45Å; P31-L183 HydrophobicContact CG-CD2 4.35Å; L168-L183 HydrophobicContact CB-CD1 3.63Å; M174-L183 HydrophobicContact CB-CB 4.01Å; M174-L183 HydrophobicContact CB-CD1 4.04Å; M174-L183 HydrophobicContact CB-CG 4.47Å; M174-L183 HydrophobicContact CE-CB 4.3Å; M174-L183 HydrophobicContact SD-CD1 4.45Å; F179-L183 PolarHBondContact O-N 3.2Å; W180-L183 WeakPolarHBondContact O-CB 3.37Å; W180-L183 PolarHBondContact O-N 3.24Å; P181-L183 VanDerWaalsContact C-N 3.33Å; L183-G185 VanDerWaalsContact C-N 3.34Å |
| 184 | L | 94.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -70.5 | -30.6 | 175.6 | -67.8 | 171.9 | 0 | 0 | 0 | 112.6 | H24 V27 I28 P31 I35 I104 W180 P181 L186 | H24-L184 PolarHBondContact CE1-O 2.94Å; V27-L184 HydrophobicContact CB-CD2 4.38Å; V27-L184 HydrophobicContact CG1-CD2 3.52Å; V27-L184 HydrophobicContact CG2-CD2 4.03Å; I28-L184 HydrophobicContact CD1-CD2 4.41Å; P31-L184 HydrophobicContact CG-CD2 4.33Å; P31-L184 HydrophobicContact CG-CG 4.44Å; I35-L184 HydrophobicContact CD1-CD1 3.96Å; I104-L184 HydrophobicContact CG2-CB 3.52Å; I104-L184 HydrophobicContact CG2-CD1 3.64Å; I104-L184 HydrophobicContact CG2-CG 4.25Å; W180-L184 HydrophobicContact CE3-CD1 3.85Å; W180-L184 HydrophobicContact CZ3-CD1 3.82Å; W180-L184 PolarHBondContact O-N 2.81Å; P181-L184 PolarHBondContact O-N 3.44Å; L184-L186 VanDerWaalsContact C-N 3.34Å |
| 185 | G | 95.9 | Very high | 94.6 | Very high | 5 Ų | 5 | 44.8 Ų | 44.8 | 5% | 0.052 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -79.3 | -5.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | T105 P181 F182 L183 C187 A188 | T105-G185 WeakPolarHBondContact OG1-CA 3.15Å; P181-G185 PolarHBondContact O-N 2.84Å; F182-G185 CarbonylContact O-C 3.59Å; F182-G185 PolarHBondContact O-N 3.01Å; L183-G185 VanDerWaalsContact C-N 3.34Å; G185-C187 PolarHBondContact O-N 3.22Å; G185-A188 WeakPolarHBondContact O-CB 3.32Å; G185-A188 PolarHBondContact O-N 3.2Å |
| 186 | L | 96.2 | Very high | 94.8 | Very high | 44 Ų | 44 | 47.9 Ų | 47.9 | 23% | 0.23 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -22.4 | -173.6 | -170 | 69.6 | 0 | 0 | 0 | 113.7 | Y23 L168 F182 L184 A188 P189 V190 | Y23-L186 HydrophobicContact CE1-CB 4.05Å; Y23-L186 HydrophobicContact CE2-CD2 3.8Å; Y23-L186 VanDerWaalsContact OH-CD2 3.26Å; Y23-L186 WeakPolarHBondContact OH-CD2 3.33Å; L168-L186 HydrophobicContact CD1-CD2 3.35Å; F182-L186 PolarHBondContact O-N 3.49Å; L184-L186 VanDerWaalsContact C-N 3.34Å; L186-A188 PolarHBondContact O-N 3.39Å; L186-P189 HydrophobicContact CD1-CG 4.38Å; L186-P189 WeakPolarHBondContact O-CD 2.88Å; L186-P189 VanDerWaalsContact O-CG 3.23Å; L186-P189 WeakPolarHBondContact O-CG 3.33Å; L186-V190 WeakPolarHBondContact O-CG2 3.4Å |
| 187 | C | 95.5 | Very high | 94.9 | Very high | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.6 | -22.3 | 174.9 | -70 | 0 | 0 | 0 | 0 | 113.3 | V20 H24 T97 G185 V190 C191 | V20-C187 HydrophobicContact CG2-CB 4.32Å; H24-C187 PolarHBondContact CD2-SG 3.06Å; H24-C187 PolarHBondContact NE2-SG 3.08Å; T97-C187 HydrophobicContact CG2-CB 4.21Å; G185-C187 PolarHBondContact O-N 3.22Å; C187-V190 PolarHBondContact O-N 3.11Å; C187-C191 VanDerWaalsContact O-CB 3.27Å; C187-C191 WeakPolarHBondContact O-CB 3.33Å; C187-C191 PolarHBondContact O-N 2.74Å; C187-C191 PolarHBondContact O-SG 2.81Å; C187-C191 VanDerWaalsContact O-SG 3.34Å |
| 188 | A | 96.1 | Very high | 95.1 | Very high | 15 Ų | 15 | 41.8 Ų | 41.8 | 12% | 0.124 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.4 | -57.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | V102 G185 L186 V190 C191 F192 | V102-A188 HydrophobicContact CG2-CB 4.31Å; G185-A188 WeakPolarHBondContact O-CB 3.32Å; G185-A188 PolarHBondContact O-N 3.2Å; L186-A188 PolarHBondContact O-N 3.39Å; A188-V190 VanDerWaalsContact C-N 3.31Å; A188-V190 PolarHBondContact O-N 3.23Å; A188-C191 PolarHBondContact O-N 3.47Å; A188-F192 PolarHBondContact O-N 3.27Å |
| 189 | P | 95.5 | Very high | 95.1 | Very high | 78 Ų | 78 | 38 Ų | 38 | 51% | 0.506 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -63.9 | -34.4 | 177.3 | 23 | -34 | 0 | 0 | 0 | 112.8 | L186 F192 L193 | L186-P189 HydrophobicContact CD1-CG 4.38Å; L186-P189 WeakPolarHBondContact O-CD 2.88Å; L186-P189 VanDerWaalsContact O-CG 3.23Å; L186-P189 WeakPolarHBondContact O-CG 3.33Å; P189-F192 PolarHBondContact O-N 2.9Å; P189-L193 PolarHBondContact O-N 3.12Å |
| 190 | V | 94.9 | Very high | 94.9 | Very high | 26 Ų | 26 | 40.9 Ų | 40.9 | 16% | 0.158 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.8 | -43.1 | 176.9 | 178.5 | 0 | 0 | 0 | 0 | 111.3 | I15 F19 L186 C187 A188 F192 L193 H194 | I15-V190 HydrophobicContact CG1-CG1 4.14Å; I15-V190 WeakPolarHBondContact O-CG1 3.31Å; F19-V190 HydrophobicContact CD1-CB 4.43Å; F19-V190 HydrophobicContact CD1-CG1 3.75Å; F19-V190 HydrophobicContact CE1-CB 4.29Å; F19-V190 HydrophobicContact CE1-CG1 3.99Å; F19-V190 HydrophobicContact CE1-CG2 3.92Å; F19-V190 HydrophobicContact CG-CG1 4.34Å; F19-V190 HydrophobicContact CZ-CG2 4.38Å; L186-V190 WeakPolarHBondContact O-CG2 3.4Å; C187-V190 PolarHBondContact O-N 3.11Å; A188-V190 VanDerWaalsContact C-N 3.31Å; A188-V190 PolarHBondContact O-N 3.23Å; V190-F192 VanDerWaalsContact C-N 3.35Å; V190-L193 PolarHBondContact O-N 3.12Å; V190-H194 PolarHBondContact O-N 2.7Å |
| 191 | C | 93.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -68.3 | -33.4 | 175 | -76 | 0 | 0 | 0 | 0 | 112.6 | V20 T97 I98 C187 A188 L193 H194 V195 | V20-C191 VanDerWaalsContact CG2-SG 3.53Å; T97-C191 HydrophobicContact CG2-CB 4.42Å; T97-C191 WeakPolarHBondContact CG2-SG 3.37Å; I98-C191 HydrophobicContact CD1-CB 4.26Å; I98-C191 HydrophobicContact CG1-CB 3.8Å; C187-C191 VanDerWaalsContact O-CB 3.27Å; C187-C191 WeakPolarHBondContact O-CB 3.33Å; C187-C191 PolarHBondContact O-N 2.74Å; C187-C191 PolarHBondContact O-SG 2.81Å; C187-C191 VanDerWaalsContact O-SG 3.34Å; A188-C191 PolarHBondContact O-N 3.47Å; C191-L193 VanDerWaalsContact C-N 3.35Å; C191-H194 WeakPolarHBondContact O-CB 3.26Å; C191-H194 PolarHBondContact O-N 3.42Å; C191-V195 WeakPolarHBondContact O-CG2 3.39Å; C191-V195 PolarHBondContact O-N 3.36Å |
| 192 | F | 93.5 | Very high | 94.8 | Very high | 131 Ų | 131 | 41.1 Ų | 41.1 | 58% | 0.575 | 21% | 0.214 | S | C | * | . | H | α-helix | trans | -62.2 | -43.9 | 173 | -172.3 | -97.9 | 0 | 0 | 0 | 111.5 | A188 P189 V190 H194 V195 I196 | A188-F192 PolarHBondContact O-N 3.27Å; P189-F192 PolarHBondContact O-N 2.9Å; V190-F192 VanDerWaalsContact C-N 3.35Å; F192-H194 VanDerWaalsContact C-N 3.35Å; F192-H194 PolarHBondContact O-N 3.38Å; F192-V195 PolarHBondContact O-N 3.44Å; F192-I196 HydrophobicContact CD1-CD1 4.07Å; F192-I196 HydrophobicContact CE1-CD1 3.73Å; F192-I196 HydrophobicContact CZ-CD1 4.44Å; F192-I196 PolarHBondContact O-N 3.41Å |
| 193 | L | 94.6 | Very high | 94.8 | Very high | 80 Ų | 80 | 37 Ų | 37 | 42% | 0.419 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.7 | -43.8 | 172 | 176.1 | 61.6 | 0 | 0 | 0 | 111.6 | I15 P189 V190 C191 V195 I196 L197 | I15-L193 HydrophobicContact CD1-CD2 3.91Å; P189-L193 PolarHBondContact O-N 3.12Å; V190-L193 PolarHBondContact O-N 3.12Å; C191-L193 VanDerWaalsContact C-N 3.35Å; L193-V195 VanDerWaalsContact C-N 3.33Å; L193-V195 PolarHBondContact O-N 3.14Å; L193-I196 PolarHBondContact O-N 3.15Å; L193-L197 HydrophobicContact CD1-CD1 4.21Å; L193-L197 HydrophobicContact CD1-CG 4.14Å; L193-L197 HydrophobicContact CG-CD1 3.95Å; L193-L197 HydrophobicContact CG-CG 4.32Å; L193-L197 WeakPolarHBondContact O-CG 3.23Å; L193-L197 PolarHBondContact O-N 3.16Å |
| 194 | H | 94.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -57.4 | -44.1 | 176.7 | 174.6 | 72 | 0 | 0 | 0 | 112.6 | S12 I13 I15 G16 S94 V190 C191 F192 I196 L197 M198 | S12-H194 PolarHBondContact O-CE1 3.42Å; S12-H194 PolarHBondContact O-ND1 2.91Å; I13-H194 PolarHBondContact O-CE1 3.04Å; I15-H194 HydrophobicContact CG2-CB 4.28Å; G16-H194 VanDerWaalsContact CA-CG 3.43Å; S94-H194 PolarHBondContact OG-CD2 2.74Å; V190-H194 PolarHBondContact O-N 2.7Å; C191-H194 WeakPolarHBondContact O-CB 3.26Å; C191-H194 PolarHBondContact O-N 3.42Å; F192-H194 VanDerWaalsContact C-N 3.35Å; F192-H194 PolarHBondContact O-N 3.38Å; H194-I196 VanDerWaalsContact C-N 3.3Å; H194-I196 PolarHBondContact O-N 3.2Å; H194-L197 PolarHBondContact O-N 3.39Å; H194-M198 WeakPolarHBondContact CE1-CG 3.32Å; H194-M198 WeakPolarHBondContact O-CB 3.47Å; H194-M198 VanDerWaalsContact O-CG 3.25Å; H194-M198 WeakPolarHBondContact O-CG 3.37Å; H194-M198 PolarHBondContact O-N 2.67Å |
| 195 | V | 95 | Very high | 94.5 | Very high | 29 Ų | 29 | 37 Ų | 37 | 18% | 0.176 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -55.6 | -45.7 | 176.3 | 165.3 | 0 | 0 | 0 | 0 | 111.1 | F91 C191 F192 L193 M198 T199 | F91-V195 HydrophobicContact CD2-CG1 4.06Å; F91-V195 HydrophobicContact CE2-CG1 3.51Å; F91-V195 HydrophobicContact CZ-CG1 4.06Å; C191-V195 WeakPolarHBondContact O-CG2 3.39Å; C191-V195 PolarHBondContact O-N 3.36Å; F192-V195 PolarHBondContact O-N 3.44Å; L193-V195 VanDerWaalsContact C-N 3.33Å; L193-V195 PolarHBondContact O-N 3.14Å; V195-M198 PolarHBondContact O-N 3.11Å; V195-T199 WeakPolarHBondContact O-CG2 3.42Å; V195-T199 PolarHBondContact O-N 2.94Å |
| 196 | I | 95.1 | Very high | 94.1 | Very high | 76 Ų | 76 | 37.1 Ų | 37.1 | 39% | 0.39 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -62.8 | -49.9 | 177.4 | -64.1 | 169.7 | 0 | 0 | 0 | 110.4 | F192 L193 H194 M198 T199 F200 | F192-I196 HydrophobicContact CD1-CD1 4.07Å; F192-I196 HydrophobicContact CE1-CD1 3.73Å; F192-I196 HydrophobicContact CZ-CD1 4.44Å; F192-I196 PolarHBondContact O-N 3.41Å; L193-I196 PolarHBondContact O-N 3.15Å; H194-I196 VanDerWaalsContact C-N 3.3Å; H194-I196 PolarHBondContact O-N 3.2Å; I196-M198 VanDerWaalsContact C-N 3.29Å; I196-M198 PolarHBondContact O-N 3.39Å; I196-T199 WeakPolarHBondContact O-CB 3.23Å; I196-T199 PolarHBondContact O-N 3.41Å; I196-T199 VanDerWaalsContact O-N 3.17Å; I196-T199 PolarHBondContact O-OG1 2.76Å; I196-F200 HydrophobicContact CG2-CE2 4.21Å; I196-F200 WeakPolarHBondContact O-CD2 3.24Å |
| 197 | L | 94.4 | Very high | 93.7 | Very high | 32 Ų | 32 | 36.1 Ų | 36.1 | 17% | 0.168 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -61.8 | -37.1 | -178.3 | -67.3 | 174.8 | 0 | 0 | 0 | 112.5 | F8 I15 L193 H194 T199 F200 | F8-L197 HydrophobicContact CE2-CD2 3.87Å; F8-L197 HydrophobicContact CZ-CD2 3.93Å; I15-L197 HydrophobicContact CG2-CD1 3.94Å; L193-L197 HydrophobicContact CD1-CD1 4.21Å; L193-L197 HydrophobicContact CD1-CG 4.14Å; L193-L197 HydrophobicContact CG-CD1 3.95Å; L193-L197 HydrophobicContact CG-CG 4.32Å; L193-L197 WeakPolarHBondContact O-CG 3.23Å; L193-L197 PolarHBondContact O-N 3.16Å; H194-L197 PolarHBondContact O-N 3.39Å; L197-T199 PolarHBondContact O-N 3.48Å; L197-F200 PolarHBondContact O-N 3.22Å |
| 198 | M | 93.5 | Very high | 93.6 | Very high | 2 Ų | 2 | 36.8 Ų | 36.8 | 1% | 0.01 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.8 | -22.6 | 179 | -77.3 | -55.2 | -67.4 | 0 | 0 | 113.7 | I13 R87 L90 Y137 H194 V195 I196 F200 C201 | I13-M198 HydrophobicContact CG1-SD 4.3Å; R87-M198 HydrophobicContact CB-CE 4.14Å; R87-M198 HydrophobicContact CG-CE 3.48Å; R87-M198 VanDerWaalsContact CG-CE 3.48Å; L90-M198 HydrophobicContact CB-CE 4.07Å; L90-M198 HydrophobicContact CD1-CE 3.92Å; L90-M198 HydrophobicContact CD1-SD 4.48Å; Y137-M198 HydrophobicContact CE1-CE 4Å; H194-M198 WeakPolarHBondContact CE1-CG 3.32Å; H194-M198 WeakPolarHBondContact O-CB 3.47Å; H194-M198 VanDerWaalsContact O-CG 3.25Å; H194-M198 WeakPolarHBondContact O-CG 3.37Å; H194-M198 PolarHBondContact O-N 2.67Å; V195-M198 PolarHBondContact O-N 3.11Å; I196-M198 VanDerWaalsContact C-N 3.29Å; I196-M198 PolarHBondContact O-N 3.39Å; M198-F200 PolarHBondContact O-N 2.89Å; M198-C201 PolarHBondContact O-N 3.46Å; M198-C201 HydrophobicContact SD-CB 4.38Å |
| 199 | T | 92.9 | Very high | 93.3 | Very high | 75 Ų | 75 | 36.4 Ų | 36.4 | 46% | 0.46 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -64.3 | -28.9 | 174.9 | 67 | 0 | 0 | 0 | 0 | 112.8 | V195 I196 L197 | V195-T199 WeakPolarHBondContact O-CG2 3.42Å; V195-T199 PolarHBondContact O-N 2.94Å; I196-T199 WeakPolarHBondContact O-CB 3.23Å; I196-T199 PolarHBondContact O-N 3.41Å; I196-T199 VanDerWaalsContact O-N 3.17Å; I196-T199 PolarHBondContact O-OG1 2.76Å; L197-T199 PolarHBondContact O-N 3.48Å |
| 200 | F | 93 | Very high | 92.7 | Very high | 146 Ų | 146 | 34 Ų | 34 | 64% | 0.64 | 17% | 0.171 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -90.1 | -10.6 | -179.7 | -58.2 | -75.2 | 0 | 0 | 0 | 113.5 | F8 I196 L197 M198 | F8-F200 HydrophobicContact CE1-CB 3.81Å; F8-F200 HydrophobicContact CZ-CB 4.04Å; F8-F200 HydrophobicContact CZ-CD2 4.47Å; I196-F200 HydrophobicContact CG2-CE2 4.21Å; I196-F200 WeakPolarHBondContact O-CD2 3.24Å; L197-F200 PolarHBondContact O-N 3.22Å; M198-F200 PolarHBondContact O-N 2.89Å |
| 201 | C | 94.2 | Very high | 92.1 | Very high | 2 Ų | 2 | 34.6 Ų | 34.6 | 1% | 0.014 | 18% | 0.175 | C | C | . | . | S | Bend | trans | -80.4 | 142.5 | 179.5 | -66.8 | 0 | 0 | 0 | 0 | 110.6 | T9 S12 R87 M198 | T9-C201 HydrophobicContact CG2-CB 4.1Å; S12-C201 VanDerWaalsContact CB-SG 3.51Å; R87-C201 WeakPolarHBondContact CD-O 3.4Å; R87-C201 PolarHBondContact NH1-O 3.11Å; M198-C201 PolarHBondContact O-N 3.46Å; M198-C201 HydrophobicContact SD-CB 4.38Å |
| 202 | P | 94.7 | Very high | 91.7 | Very high | 14 Ų | 14 | 40.4 Ų | 40.4 | 9% | 0.091 | 20% | 0.2 | C | C | . | . | trans | -66.1 | 177 | 169.2 | 28.4 | -31.3 | 0 | 0 | 0 | 110.5 | R87 Y137 A221 L224 L225 | R87-P202 WeakPolarHBondContact CD-O 3.41Å; Y137-P202 PolarHBondContact OH-O 2.95Å; P202-A221 HydrophobicContact CB-CB 4.11Å; P202-L224 HydrophobicContact CB-CD1 4.04Å; P202-L225 HydrophobicContact CG-CD1 4.07Å; P202-L225 HydrophobicContact CG-CD2 3.66Å; P202-L225 HydrophobicContact CG-CG 3.72Å | ||
| 203 | E | 95.6 | Very high | 91.4 | Very high | 22 Ų | 22 | 36.7 Ų | 36.7 | 10% | 0.103 | 20% | 0.199 | C | C | . | . | trans | -91.5 | 161.1 | 163.8 | 179.9 | 60 | -88.7 | 0 | 0 | 108.9 | G85 R86 R87 P205 Y207 L208 | G85-E203 WeakPolarHBondContact CA-OE2 3.38Å; R86-E203 WeakPolarHBondContact CA-OE1 3.31Å; R86-E203 WeakPolarHBondContact CB-OE1 3.44Å; R86-E203 PolarHBondContact N-OE1 3.13Å; R86-E203 PolarHBondContact N-OE2 3.32Å; R87-E203 HydrophobicContact CB-CB 4.49Å; R87-E203 VanDerWaalsContact CB-OE2 3.3Å; R87-E203 WeakPolarHBondContact CB-OE2 3.22Å; R87-E203 PolarHBondContact N-OE1 2.83Å; R87-E203 PolarHBondContact N-OE2 3.5Å; R87-E203 VanDerWaalsContact N-OE2 3.08Å; E203-P205 WeakPolarHBondContact O-CD 3.43Å; E203-Y207 HydrophobicContact CG-CD1 3.74Å; E203-Y207 HydrophobicContact CG-CE1 4.3Å; E203-L208 HydrophobicContact CB-CD1 4.02Å; E203-L208 HydrophobicContact CB-CD2 4.34Å; E203-L208 HydrophobicContact CB-CG 4.21Å; E203-L208 HydrophobicContact CG-CD1 4.36Å; E203-L208 HydrophobicContact CG-CD2 4.06Å; E203-L208 HydrophobicContact CG-CG 3.99Å | ||
| 204 | S | 93.2 | Very high | 91.2 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 19% | 0.191 | C | C | . | . | trans | -53.7 | 122.8 | 176.1 | 163.7 | 0 | 0 | 0 | 0 | 112.2 | E140 S206 Y207 L208 | E140-S204 VanDerWaalsContact CB-OG 3.28Å; E140-S204 WeakPolarHBondContact CB-OG 3.41Å; E140-S204 VanDerWaalsContact CD-OG 3.32Å; E140-S204 WeakPolarHBondContact OE2-CB 3.18Å; E140-S204 PolarHBondContact OE2-OG 3.36Å; S204-S206 VanDerWaalsContact C-N 3.32Å; S204-S206 PolarHBondContact O-N 3.43Å; S204-S206 PolarHBondContact OG-N 3.13Å; S204-Y207 PolarHBondContact O-N 3.42Å; S204-Y207 PolarHBondContact OG-N 3.18Å; S204-Y207 VanDerWaalsContact OG-N 3.11Å; S204-L208 VanDerWaalsContact O-CG 3.3Å; S204-L208 WeakPolarHBondContact O-CG 3.26Å; S204-L208 PolarHBondContact O-N 2.9Å | ||
| 205 | P | 92.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.7 | -40.6 | 175.8 | -22.8 | 32.2 | 0 | 0 | 0 | 113 | E203 L208 Y209 A221 L222 L225 F239 | E203-P205 WeakPolarHBondContact O-CD 3.43Å; P205-L208 PolarHBondContact O-N 3.22Å; P205-Y209 WeakPolarHBondContact O-CB 3.42Å; P205-Y209 PolarHBondContact O-N 2.85Å; P205-A221 HydrophobicContact CB-CB 4.42Å; P205-A221 HydrophobicContact CG-CB 3.93Å; P205-L222 HydrophobicContact CB-CD2 3.8Å; P205-L222 HydrophobicContact CB-CG 3.78Å; P205-L222 HydrophobicContact CG-CD2 3.79Å; P205-L222 HydrophobicContact CG-CG 4.05Å; P205-L225 HydrophobicContact CG-CD1 3.7Å; P205-F239 HydrophobicContact CB-CE2 4.38Å |
| 206 | S | 87.3 | Confident | 91 | Very high | 8 Ų | 8 | 44.4 Ų | 44.4 | 6% | 0.056 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.2 | -42.9 | 177.6 | -58.6 | 0 | 0 | 0 | 0 | 111.3 | S204 Y209 L210 F239 | S204-S206 VanDerWaalsContact C-N 3.32Å; S204-S206 PolarHBondContact O-N 3.43Å; S204-S206 PolarHBondContact OG-N 3.13Å; S206-Y209 PolarHBondContact O-N 2.99Å; S206-L210 VanDerWaalsContact O-CB 3.23Å; S206-L210 WeakPolarHBondContact O-CB 3.44Å; S206-L210 WeakPolarHBondContact O-CG 3.48Å; S206-L210 PolarHBondContact O-N 3.47Å; S206-F239 VanDerWaalsContact OG-CE1 3.29Å; S206-F239 WeakPolarHBondContact OG-CE1 3.49Å; S206-F239 WeakPolarHBondContact OG-CZ 3.49Å |
| 207 | Y | 88 | Confident | 91 | Very high | 22 Ų | 22 | 42.1 Ų | 42.1 | 9% | 0.086 | 23% | 0.228 | C | C | . | . | I | π-helix | trans | -62 | -48.5 | 174.6 | 172.3 | -109 | 0 | 0 | 0 | 112.6 | N82 G85 E203 S204 Y209 V211 K212 | N82-Y207 WeakPolarHBondContact O-CE2 3.4Å; G85-Y207 VanDerWaalsContact N-CZ 3.33Å; G85-Y207 PolarHBondContact N-OH 3.11Å; E203-Y207 HydrophobicContact CG-CD1 3.74Å; E203-Y207 HydrophobicContact CG-CE1 4.3Å; S204-Y207 PolarHBondContact O-N 3.42Å; S204-Y207 PolarHBondContact OG-N 3.18Å; S204-Y207 VanDerWaalsContact OG-N 3.11Å; Y207-Y209 VanDerWaalsContact C-N 3.26Å; Y207-Y209 PolarHBondContact O-N 2.65Å; Y207-V211 HydrophobicContact CD2-CB 3.58Å; Y207-V211 HydrophobicContact CD2-CG1 3.97Å; Y207-V211 HydrophobicContact CD2-CG2 3.84Å; Y207-V211 HydrophobicContact CE2-CB 3.7Å; Y207-V211 HydrophobicContact CE2-CG1 3.56Å; Y207-V211 HydrophobicContact CE2-CG2 4.3Å; Y207-V211 WeakPolarHBondContact O-CA 3.3Å; Y207-V211 WeakPolarHBondContact O-CB 3.41Å; Y207-V211 PolarHBondContact O-N 3.35Å; Y207-K212 PolarHBondContact O-N 2.9Å |
| 208 | L | 92.6 | Very high | 91 | Very high | 15 Ų | 15 | 40.6 Ų | 40.6 | 8% | 0.079 | 22% | 0.22 | C | C | . | . | I | π-helix | trans | -59.6 | -40.9 | -179.8 | -71.4 | 169.8 | 0 | 0 | 0 | 111.1 | E203 S204 P205 K212 G213 D214 A217 A218 A221 | E203-L208 HydrophobicContact CB-CD1 4.02Å; E203-L208 HydrophobicContact CB-CD2 4.34Å; E203-L208 HydrophobicContact CB-CG 4.21Å; E203-L208 HydrophobicContact CG-CD1 4.36Å; E203-L208 HydrophobicContact CG-CD2 4.06Å; E203-L208 HydrophobicContact CG-CG 3.99Å; S204-L208 VanDerWaalsContact O-CG 3.3Å; S204-L208 WeakPolarHBondContact O-CG 3.26Å; S204-L208 PolarHBondContact O-N 2.9Å; P205-L208 PolarHBondContact O-N 3.22Å; L208-K212 HydrophobicContact CD2-CD 3.87Å; L208-K212 CarbonylContact O-C 3.49Å; L208-K212 WeakPolarHBondContact O-CB 3.46Å; L208-G213 PolarHBondContact O-N 2.93Å; L208-G213 VanDerWaalsContact O-N 3.09Å; L208-D214 PolarHBondContact O-N 3.31Å; L208-A217 HydrophobicContact CD1-CB 3.99Å; L208-A217 HydrophobicContact CD2-CB 4.09Å; L208-A217 HydrophobicContact CG-CB 4.46Å; L208-A218 HydrophobicContact CB-CB 3.9Å; L208-A221 HydrophobicContact CD1-CB 3.93Å |
| 209 | Y | 90.5 | Very high | 91 | Very high | 6 Ų | 6 | 44.2 Ų | 44.2 | 2% | 0.024 | 24% | 0.236 | C | C | . | . | I | π-helix | trans | -77.1 | -54.9 | -178.5 | -163.4 | -84.4 | 0 | 0 | 0 | 112.9 | P205 S206 Y207 G213 K215 A218 L236 F239 Q240 Y245 | P205-Y209 WeakPolarHBondContact O-CB 3.42Å; P205-Y209 PolarHBondContact O-N 2.85Å; S206-Y209 PolarHBondContact O-N 2.99Å; Y207-Y209 VanDerWaalsContact C-N 3.26Å; Y207-Y209 PolarHBondContact O-N 2.65Å; Y209-G213 WeakPolarHBondContact O-CA 3.34Å; Y209-G213 PolarHBondContact O-N 2.93Å; Y209-K215 HydrophobicContact CD2-CB 4.33Å; Y209-K215 HydrophobicContact CD2-CG 4.02Å; Y209-K215 HydrophobicContact CE2-CB 4.09Å; Y209-K215 HydrophobicContact CE2-CD 3.83Å; Y209-K215 HydrophobicContact CE2-CG 3.58Å; Y209-K215 WeakPolarHBondContact OH-CE 3.43Å; Y209-K215 PolarHBondContact OH-NZ 3.2Å; Y209-A218 HydrophobicContact CD2-CB 4Å; Y209-A218 HydrophobicContact CG-CB 4.41Å; Y209-L236 HydrophobicContact CD2-CD2 3.69Å; Y209-L236 HydrophobicContact CE2-CD2 3.88Å; Y209-F239 HydrophobicContact CD1-CB 3.39Å; Y209-F239 HydrophobicContact CD1-CD2 4.04Å; Y209-F239 HydrophobicContact CD1-CG 4.12Å; Y209-F239 HydrophobicContact CD2-CD2 4.18Å; Y209-F239 HydrophobicContact CE1-CB 3.61Å; Y209-F239 HydrophobicContact CG-CB 4.02Å; Y209-F239 AromaticContact CG-CD2 3.75Å; Y209-F239 HydrophobicContact CG-CD2 3.75Å; Y209-F239 HydrophobicContact CG-CG 4.29Å; Y209-Q240 HydrophobicContact CE1-CG 4.24Å; Y209-Q240 WeakPolarHBondContact OH-CG 3.49Å; Y209-Q240 PolarHBondContact OH-NE2 3.19Å; Y209-Y245 HydrophobicContact CE1-CD2 4.11Å; Y209-Y245 HydrophobicContact CE1-CE2 4.04Å |
| 210 | L | 83.6 | Confident | 91 | Very high | 27 Ų | 27 | 46 Ų | 46 | 14% | 0.141 | 24% | 0.238 | C | C | . | . | I | π-helix | trans | -80.2 | -41.3 | -169.9 | -61.9 | 172.1 | 0 | 0 | 0 | 112.5 | S206 F239 D242 Y245 | S206-L210 VanDerWaalsContact O-CB 3.23Å; S206-L210 WeakPolarHBondContact O-CB 3.44Å; S206-L210 WeakPolarHBondContact O-CG 3.48Å; S206-L210 PolarHBondContact O-N 3.47Å; L210-F239 HydrophobicContact CD2-CB 4.09Å; L210-D242 HydrophobicContact CD2-CB 4.15Å; L210-Y245 HydrophobicContact CD2-CD2 4.49Å |
| 211 | V | 82.2 | Confident | 91.1 | Very high | 40 Ų | 40 | 39.2 Ų | 39.2 | 24% | 0.242 | 21% | 0.209 | C | C | . | . | I | π-helix | trans | -96.5 | -47.6 | -173.1 | -177.3 | 0 | 0 | 0 | 0 | 111.6 | Y207 | Y207-V211 HydrophobicContact CD2-CB 3.58Å; Y207-V211 HydrophobicContact CD2-CG1 3.97Å; Y207-V211 HydrophobicContact CD2-CG2 3.84Å; Y207-V211 HydrophobicContact CE2-CB 3.7Å; Y207-V211 HydrophobicContact CE2-CG1 3.56Å; Y207-V211 HydrophobicContact CE2-CG2 4.3Å; Y207-V211 WeakPolarHBondContact O-CA 3.3Å; Y207-V211 WeakPolarHBondContact O-CB 3.41Å; Y207-V211 PolarHBondContact O-N 3.35Å |
| 212 | K | 86 | Confident | 91.1 | Very high | 121 Ų | 121 | 39.1 Ų | 39.1 | 53% | 0.526 | 21% | 0.208 | S | C | . | . | S | Bend | trans | -82.2 | -22.3 | -178.7 | -162.5 | -171.5 | 172.8 | -152.3 | 0 | 112.7 | Y207 L208 D214 | Y207-K212 PolarHBondContact O-N 2.9Å; L208-K212 HydrophobicContact CD2-CD 3.87Å; L208-K212 CarbonylContact O-C 3.49Å; L208-K212 WeakPolarHBondContact O-CB 3.46Å; K212-D214 HydrophobicContact CB-CB 4.34Å; K212-D214 HydrophobicContact CD-CB 3.85Å; K212-D214 HydrophobicContact CG-CB 4.11Å; K212-D214 IonicContact NZ-OD2 2.72Å; K212-D214 PolarHBondContact NZ-OD2 3.26Å; K212-D214 PolarHBondContact O-N 3.48Å |
| 213 | G | 85.7 | Confident | 91 | Very high | 54 Ų | 54 | 40.8 Ų | 40.8 | 56% | 0.557 | 22% | 0.216 | S | C | * | . | trans | 70.2 | 14 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | L208 Y209 K215 | L208-G213 PolarHBondContact O-N 2.93Å; L208-G213 VanDerWaalsContact O-N 3.09Å; Y209-G213 WeakPolarHBondContact O-CA 3.34Å; Y209-G213 PolarHBondContact O-N 2.93Å; G213-K215 PolarHBondContact O-N 3.39Å | ||
| 214 | D | 91.8 | Very high | 90.8 | Very high | 46 Ų | 46 | 41.9 Ų | 41.9 | 25% | 0.246 | 22% | 0.223 | C | C | . | . | trans | -94.1 | 82.6 | -174.8 | -170.6 | -16.9 | 0 | 0 | 0 | 110.1 | L208 K212 D216 A217 A218 | L208-D214 PolarHBondContact O-N 3.31Å; K212-D214 HydrophobicContact CB-CB 4.34Å; K212-D214 HydrophobicContact CD-CB 3.85Å; K212-D214 HydrophobicContact CG-CB 4.11Å; K212-D214 IonicContact NZ-OD2 2.72Å; K212-D214 PolarHBondContact NZ-OD2 3.26Å; K212-D214 PolarHBondContact O-N 3.48Å; D214-D216 VanDerWaalsContact C-N 3.33Å; D214-D216 PolarHBondContact O-N 2.98Å; D214-A217 HydrophobicContact CB-CB 4.13Å; D214-A217 PolarHBondContact O-N 3.21Å; D214-A217 VanDerWaalsContact OD1-CB 3.25Å; D214-A217 WeakPolarHBondContact OD1-CB 3.46Å; D214-A217 PolarHBondContact OD1-N 3.28Å; D214-A217 WeakPolarHBondContact OD2-CB 3.5Å; D214-A218 WeakPolarHBondContact O-CB 3.36Å; D214-A218 PolarHBondContact O-N 2.77Å | ||
| 215 | K | 91.1 | Very high | 90.7 | Very high | 93 Ų | 93 | 42 Ų | 42 | 40% | 0.404 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.9 | -37.6 | -174.6 | -60.6 | -167.7 | 177.6 | -173.6 | 0 | 112.7 | Y209 G213 A218 K219 | Y209-K215 HydrophobicContact CD2-CB 4.33Å; Y209-K215 HydrophobicContact CD2-CG 4.02Å; Y209-K215 HydrophobicContact CE2-CB 4.09Å; Y209-K215 HydrophobicContact CE2-CD 3.83Å; Y209-K215 HydrophobicContact CE2-CG 3.58Å; Y209-K215 WeakPolarHBondContact OH-CE 3.43Å; Y209-K215 PolarHBondContact OH-NZ 3.2Å; G213-K215 PolarHBondContact O-N 3.39Å; K215-A218 PolarHBondContact O-N 2.84Å; K215-K219 WeakPolarHBondContact O-CB 3.36Å; K215-K219 PolarHBondContact O-N 3.14Å |
| 216 | D | 93.7 | Very high | 90.6 | Very high | 131 Ų | 131 | 43.1 Ų | 43.1 | 70% | 0.701 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -68.5 | -43.8 | -179.3 | -66.4 | -37.9 | 0 | 0 | 0 | 111.1 | D214 A218 K219 H220 | D214-D216 VanDerWaalsContact C-N 3.33Å; D214-D216 PolarHBondContact O-N 2.98Å; D216-A218 VanDerWaalsContact C-N 3.33Å; D216-A218 PolarHBondContact O-N 3.44Å; D216-K219 PolarHBondContact O-N 3.14Å; D216-H220 WeakPolarHBondContact O-CB 3.34Å; D216-H220 PolarHBondContact O-N 3.33Å |
| 217 | A | 94.7 | Very high | 90.7 | Very high | 29 Ų | 29 | 43.8 Ų | 43.8 | 24% | 0.24 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -64 | -39.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | L208 D214 H220 A221 | L208-A217 HydrophobicContact CD1-CB 3.99Å; L208-A217 HydrophobicContact CD2-CB 4.09Å; L208-A217 HydrophobicContact CG-CB 4.46Å; D214-A217 HydrophobicContact CB-CB 4.13Å; D214-A217 PolarHBondContact O-N 3.21Å; D214-A217 VanDerWaalsContact OD1-CB 3.25Å; D214-A217 WeakPolarHBondContact OD1-CB 3.46Å; D214-A217 PolarHBondContact OD1-N 3.28Å; D214-A217 WeakPolarHBondContact OD2-CB 3.5Å; A217-H220 PolarHBondContact O-N 3.04Å; A217-A221 WeakPolarHBondContact O-CB 3.49Å; A217-A221 PolarHBondContact O-N 2.95Å |
| 218 | A | 93.9 | Very high | 90.5 | Very high | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.7 | -45 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L208 Y209 D214 K215 D216 H220 A221 L222 L236 | L208-A218 HydrophobicContact CB-CB 3.9Å; Y209-A218 HydrophobicContact CD2-CB 4Å; Y209-A218 HydrophobicContact CG-CB 4.41Å; D214-A218 WeakPolarHBondContact O-CB 3.36Å; D214-A218 PolarHBondContact O-N 2.77Å; K215-A218 PolarHBondContact O-N 2.84Å; D216-A218 VanDerWaalsContact C-N 3.33Å; D216-A218 PolarHBondContact O-N 3.44Å; A218-H220 PolarHBondContact O-N 3.33Å; A218-A221 PolarHBondContact O-N 3.48Å; A218-L222 PolarHBondContact O-N 2.9Å; A218-L236 HydrophobicContact CB-CD2 4.38Å |
| 219 | K | 94.3 | Very high | 90.1 | Very high | 78 Ų | 78 | 58.8 Ų | 58.8 | 34% | 0.339 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59.2 | -46 | 174.3 | -178.8 | 159.9 | -176.9 | 151.6 | 0 | 111.3 | K215 D216 L222 L223 V232 D233 L236 | K215-K219 WeakPolarHBondContact O-CB 3.36Å; K215-K219 PolarHBondContact O-N 3.14Å; D216-K219 PolarHBondContact O-N 3.14Å; K219-L222 PolarHBondContact O-N 3.38Å; K219-L223 HydrophobicContact CG-CD1 4.33Å; K219-L223 WeakPolarHBondContact O-CG 3.44Å; K219-L223 PolarHBondContact O-N 3.3Å; K219-V232 HydrophobicContact CD-CG2 4.09Å; K219-V232 HydrophobicContact CG-CG2 3.93Å; K219-D233 IonicContact NZ-OD1 3.24Å; K219-D233 PolarHBondContact NZ-OD1 3.27Å; K219-L236 HydrophobicContact CB-CD1 4.11Å; K219-L236 HydrophobicContact CD-CD1 4.23Å; K219-L236 HydrophobicContact CG-CD1 4.28Å |
| 220 | H | 93.6 | Very high | 89.9 | Confident | 112 Ų | 112 | 63 Ų | 63 | 52% | 0.519 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 176.8 | -171.7 | 72 | 0 | 0 | 0 | 112 | D216 A217 A218 L222 L223 L224 | D216-H220 WeakPolarHBondContact O-CB 3.34Å; D216-H220 PolarHBondContact O-N 3.33Å; A217-H220 PolarHBondContact O-N 3.04Å; A218-H220 PolarHBondContact O-N 3.33Å; H220-L222 VanDerWaalsContact C-N 3.34Å; H220-L222 PolarHBondContact O-N 2.87Å; H220-L223 PolarHBondContact O-N 3.44Å; H220-L224 VanDerWaalsContact O-CG 3.32Å; H220-L224 WeakPolarHBondContact O-CG 3.43Å; H220-L224 PolarHBondContact O-N 3.34Å |
| 221 | A | 94.2 | Very high | 90 | Very high | 3 Ų | 3 | 65.6 Ų | 65.6 | 3% | 0.025 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.8 | -42 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | P202 P205 L208 A217 A218 L224 L225 | P202-A221 HydrophobicContact CB-CB 4.11Å; P205-A221 HydrophobicContact CB-CB 4.42Å; P205-A221 HydrophobicContact CG-CB 3.93Å; L208-A221 HydrophobicContact CD1-CB 3.93Å; A217-A221 WeakPolarHBondContact O-CB 3.49Å; A217-A221 PolarHBondContact O-N 2.95Å; A218-A221 PolarHBondContact O-N 3.48Å; A221-L224 PolarHBondContact O-N 2.91Å; A221-L225 WeakPolarHBondContact O-CB 3.39Å; A221-L225 WeakPolarHBondContact O-CD1 3.17Å; A221-L225 VanDerWaalsContact O-CG 3.28Å; A221-L225 WeakPolarHBondContact O-CG 3.31Å; A221-L225 PolarHBondContact O-N 3.46Å; A221-L225 VanDerWaalsContact O-N 3.09Å |
| 222 | L | 93.2 | Very high | 90.3 | Very high | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.4 | -46.8 | 174.1 | -75.1 | 173.2 | 0 | 0 | 0 | 112 | P205 A218 K219 H220 L224 L225 R226 V232 E235 L236 F239 | P205-L222 HydrophobicContact CB-CD2 3.8Å; P205-L222 HydrophobicContact CB-CG 3.78Å; P205-L222 HydrophobicContact CG-CD2 3.79Å; P205-L222 HydrophobicContact CG-CG 4.05Å; A218-L222 PolarHBondContact O-N 2.9Å; K219-L222 PolarHBondContact O-N 3.38Å; H220-L222 VanDerWaalsContact C-N 3.34Å; H220-L222 PolarHBondContact O-N 2.87Å; L222-L224 VanDerWaalsContact C-N 3.27Å; L222-L224 PolarHBondContact O-N 2.9Å; L222-L225 CarbonylContact O-C 3.6Å; L222-L225 PolarHBondContact O-N 2.84Å; L222-R226 HydrophobicContact CD2-CG 4.47Å; L222-R226 VanDerWaalsContact O-CB 3.26Å; L222-R226 WeakPolarHBondContact O-CB 3.2Å; L222-R226 VanDerWaalsContact O-CG 3.26Å; L222-R226 WeakPolarHBondContact O-CG 3.45Å; L222-R226 PolarHBondContact O-N 2.96Å; L222-V232 HydrophobicContact CB-CB 4.37Å; L222-V232 HydrophobicContact CB-CG1 3.66Å; L222-V232 HydrophobicContact CD1-CB 4.21Å; L222-V232 HydrophobicContact CD1-CG1 4.37Å; L222-E235 HydrophobicContact CD1-CB 4.31Å; L222-E235 HydrophobicContact CD1-CG 4.35Å; L222-E235 HydrophobicContact CD2-CG 4.21Å; L222-E235 WeakPolarHBondContact CD2-OE1 3.23Å; L222-L236 HydrophobicContact CD1-CD2 3.78Å; L222-L236 HydrophobicContact CD1-CG 3.89Å; L222-F239 HydrophobicContact CD1-CE2 4.4Å |
| 223 | L | 92.9 | Very high | 90.3 | Very high | 49 Ų | 49 | 61.9 Ų | 61.9 | 26% | 0.257 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -61.4 | -36.1 | 178.1 | -68.8 | 171.2 | 0 | 0 | 0 | 112.2 | K219 H220 L225 G227 V232 | K219-L223 HydrophobicContact CG-CD1 4.33Å; K219-L223 WeakPolarHBondContact O-CG 3.44Å; K219-L223 PolarHBondContact O-N 3.3Å; H220-L223 PolarHBondContact O-N 3.44Å; L223-L225 VanDerWaalsContact C-N 3.34Å; L223-G227 CarbonylContact O-C 3.57Å; L223-G227 VanDerWaalsContact O-CA 3.32Å; L223-G227 WeakPolarHBondContact O-CA 3.25Å; L223-G227 PolarHBondContact O-N 2.96Å; L223-V232 HydrophobicContact CD2-CG1 3.68Å; L223-V232 HydrophobicContact CG-CG1 3.97Å |
| 224 | L | 92 | Very high | 90.2 | Very high | 46 Ų | 46 | 65.4 Ų | 65.4 | 24% | 0.241 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.3 | -36.8 | 174 | -65.2 | 174.7 | 0 | 0 | 0 | 112.2 | R5 P202 H220 A221 L222 | R5-L224 WeakPolarHBondContact CB-O 3.47Å; R5-L224 WeakPolarHBondContact CD-O 3.42Å; P202-L224 HydrophobicContact CB-CD1 4.04Å; H220-L224 VanDerWaalsContact O-CG 3.32Å; H220-L224 WeakPolarHBondContact O-CG 3.43Å; H220-L224 PolarHBondContact O-N 3.34Å; A221-L224 PolarHBondContact O-N 2.91Å; L222-L224 VanDerWaalsContact C-N 3.27Å; L222-L224 PolarHBondContact O-N 2.9Å |
| 225 | L | 92 | Very high | 90 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.005 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -89 | -27 | -175.3 | -69.9 | 167.7 | 0 | 0 | 0 | 114.4 | P3 L6 I141 P202 P205 A221 L222 L223 | P3-L225 WeakPolarHBondContact CD-O 3.49Å; P3-L225 WeakPolarHBondContact CG-O 3.22Å; L6-L225 HydrophobicContact CD1-CD2 4.14Å; I141-L225 HydrophobicContact CB-CD1 3.86Å; I141-L225 HydrophobicContact CB-CD2 4.4Å; I141-L225 HydrophobicContact CG2-CD1 3.85Å; P202-L225 HydrophobicContact CG-CD1 4.07Å; P202-L225 HydrophobicContact CG-CD2 3.66Å; P202-L225 HydrophobicContact CG-CG 3.72Å; P205-L225 HydrophobicContact CG-CD1 3.7Å; A221-L225 WeakPolarHBondContact O-CB 3.39Å; A221-L225 WeakPolarHBondContact O-CD1 3.17Å; A221-L225 VanDerWaalsContact O-CG 3.28Å; A221-L225 WeakPolarHBondContact O-CG 3.31Å; A221-L225 PolarHBondContact O-N 3.46Å; A221-L225 VanDerWaalsContact O-N 3.09Å; L222-L225 CarbonylContact O-C 3.6Å; L222-L225 PolarHBondContact O-N 2.84Å; L223-L225 VanDerWaalsContact C-N 3.34Å |
| 226 | R | 90.5 | Very high | 89.8 | Confident | 25 Ų | 25 | 60.2 Ų | 60.2 | 9% | 0.094 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -107.2 | -22.2 | -174.4 | -57.2 | -72.4 | 179.9 | -95.6 | -1.8 | 112.6 | I141 L222 Y230 E235 | I141-R226 PolarHBondContact O-NH1 2.77Å; I141-R226 PolarHBondContact O-NH2 3.31Å; L222-R226 HydrophobicContact CD2-CG 4.47Å; L222-R226 VanDerWaalsContact O-CB 3.26Å; L222-R226 WeakPolarHBondContact O-CB 3.2Å; L222-R226 VanDerWaalsContact O-CG 3.26Å; L222-R226 WeakPolarHBondContact O-CG 3.45Å; L222-R226 PolarHBondContact O-N 2.96Å; R226-Y230 HydrophobicContact CB-CD1 3.44Å; R226-Y230 VanDerWaalsContact CB-CD1 3.44Å; R226-Y230 HydrophobicContact CB-CD2 4.06Å; R226-Y230 HydrophobicContact CB-CE1 4Å; R226-Y230 HydrophobicContact CB-CG 3.44Å; R226-Y230 VanDerWaalsContact CB-CG 3.44Å; R226-Y230 HydrophobicContact CG-CD1 3.67Å; R226-Y230 HydrophobicContact CG-CE1 3.72Å; R226-Y230 HydrophobicContact CG-CG 4.13Å; R226-E235 IonicContact CZ-OE1 3.54Å; R226-E235 IonicContact CZ-OE2 3.85Å; R226-E235 IonicContact NE-OE1 3.5Å; R226-E235 IonicContact NE-OE2 3.04Å; R226-E235 PolarHBondContact NE-OE2 3.09Å; R226-E235 IonicContact NH2-OE1 2.77Å; R226-E235 PolarHBondContact NH2-OE1 2.93Å; R226-E235 IonicContact NH2-OE2 3.78Å |
| 227 | G | 88.2 | Confident | 89.4 | Confident | 21 Ų | 21 | 57.4 Ų | 57.4 | 22% | 0.216 | 29% | 0.288 | C | S | . | . | trans | 107.9 | 158.5 | -173.8 | 0 | 0 | 0 | 0 | 0 | 111 | L223 D229 Y230 | L223-G227 CarbonylContact O-C 3.57Å; L223-G227 VanDerWaalsContact O-CA 3.32Å; L223-G227 WeakPolarHBondContact O-CA 3.25Å; L223-G227 PolarHBondContact O-N 2.96Å; G227-D229 VanDerWaalsContact C-N 3.28Å; G227-D229 PolarHBondContact O-N 3.13Å; G227-Y230 PolarHBondContact O-N 2.76Å | ||
| 228 | K | 84.6 | Confident | 88.8 | Confident | 187 Ų | 187 | 58.2 Ų | 58.2 | 81% | 0.813 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | -29.3 | -176.1 | -67.9 | -175 | 177.9 | -177.7 | 0 | 113.3 | ||
| 229 | D | 84.3 | Confident | 88.1 | Confident | 166 Ų | 166 | 58.6 Ų | 58.6 | 89% | 0.888 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.3 | 4.7 | -175 | -47.2 | -46.6 | 0 | 0 | 0 | 113 | G227 | G227-D229 VanDerWaalsContact C-N 3.28Å; G227-D229 PolarHBondContact O-N 3.13Å |
| 230 | Y | 85 | Confident | 87.3 | Confident | 95 Ų | 95 | 58.9 Ų | 58.9 | 37% | 0.373 | 30% | 0.296 | S | S | . | . | S | Bend | trans | -79.5 | 131.2 | 179.7 | -178.2 | -99 | 0 | 0 | 0 | 110.7 | R226 G227 V232 E235 | R226-Y230 HydrophobicContact CB-CD1 3.44Å; R226-Y230 VanDerWaalsContact CB-CD1 3.44Å; R226-Y230 HydrophobicContact CB-CD2 4.06Å; R226-Y230 HydrophobicContact CB-CE1 4Å; R226-Y230 HydrophobicContact CB-CG 3.44Å; R226-Y230 VanDerWaalsContact CB-CG 3.44Å; R226-Y230 HydrophobicContact CG-CD1 3.67Å; R226-Y230 HydrophobicContact CG-CE1 3.72Å; R226-Y230 HydrophobicContact CG-CG 4.13Å; G227-Y230 PolarHBondContact O-N 2.76Å; Y230-V232 HydrophobicContact CD1-CG1 3.87Å; Y230-V232 PolarHBondContact O-N 2.71Å; Y230-E235 WeakPolarHBondContact CE1-OE2 3.26Å; Y230-E235 PolarHBondContact OH-OE2 3.1Å; Y230-E235 VanDerWaalsContact OH-OE2 3.06Å |
| 231 | D | 85.8 | Confident | 86.2 | Confident | 80 Ų | 80 | 62.8 Ų | 62.8 | 43% | 0.428 | 31% | 0.307 | S | S | . | . | trans | -70.3 | 97.3 | 170.5 | -177.4 | 4.2 | 0 | 0 | 0 | 110.2 | D233 M234 | D231-D233 VanDerWaalsContact C-N 3.31Å; D231-D233 WeakPolarHBondContact OD1-CB 3.33Å; D231-D233 PolarHBondContact OD1-N 3.25Å; D231-M234 HydrophobicContact CB-CE 4.43Å | ||
| 232 | V | 88.2 | Confident | 84.9 | Confident | 4 Ų | 4 | 64.4 Ų | 64.4 | 2% | 0.024 | 32% | 0.315 | C | S | . | . | trans | -75.7 | -18.5 | 178 | -67.2 | 0 | 0 | 0 | 0 | 112.9 | K219 L222 L223 Y230 M234 E235 L236 | K219-V232 HydrophobicContact CD-CG2 4.09Å; K219-V232 HydrophobicContact CG-CG2 3.93Å; L222-V232 HydrophobicContact CB-CB 4.37Å; L222-V232 HydrophobicContact CB-CG1 3.66Å; L222-V232 HydrophobicContact CD1-CB 4.21Å; L222-V232 HydrophobicContact CD1-CG1 4.37Å; L223-V232 HydrophobicContact CD2-CG1 3.68Å; L223-V232 HydrophobicContact CG-CG1 3.97Å; Y230-V232 HydrophobicContact CD1-CG1 3.87Å; Y230-V232 PolarHBondContact O-N 2.71Å; V232-M234 VanDerWaalsContact C-N 3.35Å; V232-M234 PolarHBondContact O-N 3Å; V232-E235 PolarHBondContact O-N 3.27Å; V232-E235 VanDerWaalsContact O-N 3.1Å; V232-L236 HydrophobicContact CB-CD1 4.32Å; V232-L236 HydrophobicContact CG2-CD1 4.14Å; V232-L236 WeakPolarHBondContact O-CG 3.36Å; V232-L236 PolarHBondContact O-N 2.75Å | ||
| 233 | D | 86.9 | Confident | 83.3 | Confident | 80 Ų | 80 | 66.4 Ų | 66.4 | 43% | 0.428 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -68.6 | -38.1 | -169.2 | -63.2 | -27.2 | 0 | 0 | 0 | 110.2 | K219 D231 E235 L236 D237 | K219-D233 IonicContact NZ-OD1 3.24Å; K219-D233 PolarHBondContact NZ-OD1 3.27Å; D231-D233 VanDerWaalsContact C-N 3.31Å; D231-D233 WeakPolarHBondContact OD1-CB 3.33Å; D231-D233 PolarHBondContact OD1-N 3.25Å; D233-E235 VanDerWaalsContact C-N 3.32Å; D233-E235 PolarHBondContact O-N 3.27Å; D233-L236 PolarHBondContact O-N 3.05Å; D233-D237 WeakPolarHBondContact O-CB 3.2Å; D233-D237 VanDerWaalsContact O-CG 3.29Å; D233-D237 PolarHBondContact O-N 2.91Å |
| 234 | M | 84.2 | Confident | 81.5 | Confident | 128 Ų | 128 | 65.8 Ų | 65.8 | 63% | 0.631 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -58.4 | -39 | 171.2 | -73.1 | -167.8 | -71.4 | 0 | 0 | 113.7 | D231 V232 S238 | D231-M234 HydrophobicContact CB-CE 4.43Å; V232-M234 VanDerWaalsContact C-N 3.35Å; V232-M234 PolarHBondContact O-N 3Å; M234-S238 PolarHBondContact O-N 3.02Å |
| 235 | E | 87.2 | Confident | 79.8 | Confident | 15 Ų | 15 | 67.3 Ų | 67.3 | 7% | 0.07 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -75.9 | -38.1 | -179.8 | -166.2 | 165.4 | 170.9 | 0 | 0 | 110.7 | L222 R226 Y230 V232 D233 S238 F239 | L222-E235 HydrophobicContact CD1-CB 4.31Å; L222-E235 HydrophobicContact CD1-CG 4.35Å; L222-E235 HydrophobicContact CD2-CG 4.21Å; L222-E235 WeakPolarHBondContact CD2-OE1 3.23Å; R226-E235 IonicContact CZ-OE1 3.54Å; R226-E235 IonicContact CZ-OE2 3.85Å; R226-E235 IonicContact NE-OE1 3.5Å; R226-E235 IonicContact NE-OE2 3.04Å; R226-E235 PolarHBondContact NE-OE2 3.09Å; R226-E235 IonicContact NH2-OE1 2.77Å; R226-E235 PolarHBondContact NH2-OE1 2.93Å; R226-E235 IonicContact NH2-OE2 3.78Å; Y230-E235 WeakPolarHBondContact CE1-OE2 3.26Å; Y230-E235 PolarHBondContact OH-OE2 3.1Å; Y230-E235 VanDerWaalsContact OH-OE2 3.06Å; V232-E235 PolarHBondContact O-N 3.27Å; V232-E235 VanDerWaalsContact O-N 3.1Å; D233-E235 VanDerWaalsContact C-N 3.32Å; D233-E235 PolarHBondContact O-N 3.27Å; E235-S238 WeakPolarHBondContact O-CB 3.38Å; E235-S238 PolarHBondContact O-N 3.39Å; E235-S238 PolarHBondContact O-OG 3.45Å; E235-F239 HydrophobicContact CG-CZ 4.42Å; E235-F239 PolarHBondContact O-N 3.21Å |
| 236 | L | 87.5 | Confident | 77.9 | Confident | 15 Ų | 15 | 72.8 Ų | 72.8 | 8% | 0.079 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -65.7 | -39.3 | 173.7 | -69.4 | 170.8 | 0 | 0 | 0 | 112.5 | Y209 A218 K219 L222 V232 D233 S238 F239 Q240 | Y209-L236 HydrophobicContact CD2-CD2 3.69Å; Y209-L236 HydrophobicContact CE2-CD2 3.88Å; A218-L236 HydrophobicContact CB-CD2 4.38Å; K219-L236 HydrophobicContact CB-CD1 4.11Å; K219-L236 HydrophobicContact CD-CD1 4.23Å; K219-L236 HydrophobicContact CG-CD1 4.28Å; L222-L236 HydrophobicContact CD1-CD2 3.78Å; L222-L236 HydrophobicContact CD1-CG 3.89Å; V232-L236 HydrophobicContact CB-CD1 4.32Å; V232-L236 HydrophobicContact CG2-CD1 4.14Å; V232-L236 WeakPolarHBondContact O-CG 3.36Å; V232-L236 PolarHBondContact O-N 2.75Å; D233-L236 PolarHBondContact O-N 3.05Å; L236-S238 PolarHBondContact O-N 2.98Å; L236-F239 HydrophobicContact CD2-CD2 4.18Å; L236-F239 HydrophobicContact CD2-CE2 4.38Å; L236-F239 WeakPolarHBondContact O-CB 3.32Å; L236-F239 PolarHBondContact O-N 2.7Å; L236-F239 VanDerWaalsContact O-N 3.09Å; L236-Q240 PolarHBondContact O-N 2.97Å |
| 237 | D | 85 | Confident | 76.3 | Confident | 71 Ų | 71 | 74 Ų | 74 | 38% | 0.38 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.8 | -33.9 | 174.4 | -79.6 | -6.3 | 0 | 0 | 0 | 111.6 | D233 F239 Q240 R241 | D233-D237 WeakPolarHBondContact O-CB 3.2Å; D233-D237 VanDerWaalsContact O-CG 3.29Å; D233-D237 PolarHBondContact O-N 2.91Å; D237-F239 VanDerWaalsContact C-N 3.26Å; D237-F239 PolarHBondContact O-N 3.12Å; D237-Q240 WeakPolarHBondContact O-CB 3.42Å; D237-Q240 PolarHBondContact O-N 3.1Å; D237-Q240 VanDerWaalsContact O-N 3.17Å; D237-R241 PolarHBondContact O-N 2.77Å |
| 238 | S | 81.2 | Confident | 74.5 | Confident | 47 Ų | 47 | 83.1 Ų | 83.1 | 33% | 0.329 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.3 | -33.4 | 174.5 | 84.4 | 0 | 0 | 0 | 0 | 112.2 | M234 E235 L236 R241 D242 | M234-S238 PolarHBondContact O-N 3.02Å; E235-S238 WeakPolarHBondContact O-CB 3.38Å; E235-S238 PolarHBondContact O-N 3.39Å; E235-S238 PolarHBondContact O-OG 3.45Å; L236-S238 PolarHBondContact O-N 2.98Å; S238-R241 PolarHBondContact O-N 3.32Å; S238-D242 PolarHBondContact O-N 3.19Å |
| 239 | F | 79.9 | Confident | 72.9 | Confident | 8 Ų | 8 | 79.5 Ų | 79.5 | 4% | 0.035 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -71.3 | -29.5 | 174.5 | -59.2 | -32.4 | 0 | 0 | 0 | 112.8 | P205 S206 Y209 L210 L222 E235 L236 D237 R241 D242 Y245 | P205-F239 HydrophobicContact CB-CE2 4.38Å; S206-F239 VanDerWaalsContact OG-CE1 3.29Å; S206-F239 WeakPolarHBondContact OG-CE1 3.49Å; S206-F239 WeakPolarHBondContact OG-CZ 3.49Å; Y209-F239 HydrophobicContact CD1-CB 3.39Å; Y209-F239 HydrophobicContact CD1-CD2 4.04Å; Y209-F239 HydrophobicContact CD1-CG 4.12Å; Y209-F239 HydrophobicContact CD2-CD2 4.18Å; Y209-F239 HydrophobicContact CE1-CB 3.61Å; Y209-F239 HydrophobicContact CG-CB 4.02Å; Y209-F239 AromaticContact CG-CD2 3.75Å; Y209-F239 HydrophobicContact CG-CD2 3.75Å; Y209-F239 HydrophobicContact CG-CG 4.29Å; L210-F239 HydrophobicContact CD2-CB 4.09Å; L222-F239 HydrophobicContact CD1-CE2 4.4Å; E235-F239 HydrophobicContact CG-CZ 4.42Å; E235-F239 PolarHBondContact O-N 3.21Å; L236-F239 HydrophobicContact CD2-CD2 4.18Å; L236-F239 HydrophobicContact CD2-CE2 4.38Å; L236-F239 WeakPolarHBondContact O-CB 3.32Å; L236-F239 PolarHBondContact O-N 2.7Å; L236-F239 VanDerWaalsContact O-N 3.09Å; D237-F239 VanDerWaalsContact C-N 3.26Å; D237-F239 PolarHBondContact O-N 3.12Å; F239-R241 VanDerWaalsContact C-N 3.29Å; F239-R241 PolarHBondContact O-N 3.04Å; F239-D242 WeakPolarHBondContact O-CB 3.49Å; F239-D242 PolarHBondContact O-N 3.03Å; F239-Y245 WeakPolarHBondContact O-CB 3.5Å |
| 240 | Q | 76.2 | Confident | 71.4 | Confident | 83 Ų | 83 | 79.4 Ų | 79.4 | 39% | 0.388 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -69.5 | -29.3 | 175.3 | -65.3 | -178.1 | 12.1 | 0 | 0 | 112.9 | Y209 L236 D237 D242 Y245 | Y209-Q240 HydrophobicContact CE1-CG 4.24Å; Y209-Q240 WeakPolarHBondContact OH-CG 3.49Å; Y209-Q240 PolarHBondContact OH-NE2 3.19Å; L236-Q240 PolarHBondContact O-N 2.97Å; D237-Q240 WeakPolarHBondContact O-CB 3.42Å; D237-Q240 PolarHBondContact O-N 3.1Å; D237-Q240 VanDerWaalsContact O-N 3.17Å; Q240-D242 VanDerWaalsContact C-N 3.27Å; Q240-Y245 HydrophobicContact CB-CE1 4.48Å; Q240-Y245 WeakPolarHBondContact O-CD1 3.18Å |
| 241 | R | 71.7 | Confident | 70.1 | Confident | 195 Ų | 195 | 78 Ų | 78 | 74% | 0.736 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.6 | -2.9 | 176.4 | -62.1 | 179.5 | -170.9 | 172 | 5.2 | 112.6 | D237 S238 F239 | D237-R241 PolarHBondContact O-N 2.77Å; S238-R241 PolarHBondContact O-N 3.32Å; F239-R241 VanDerWaalsContact C-N 3.29Å; F239-R241 PolarHBondContact O-N 3.04Å |
| 242 | D | 67.1 | Low | 68.9 | Low | 36 Ų | 36 | 76 Ų | 76 | 19% | 0.193 | 37% | 0.365 | C | S | . | . | trans | -70 | 128.4 | 178.9 | -157.8 | -52.5 | 0 | 0 | 0 | 109.8 | L210 S238 F239 Q240 E244 Y245 I246 | L210-D242 HydrophobicContact CD2-CB 4.15Å; S238-D242 PolarHBondContact O-N 3.19Å; F239-D242 WeakPolarHBondContact O-CB 3.49Å; F239-D242 PolarHBondContact O-N 3.03Å; Q240-D242 VanDerWaalsContact C-N 3.27Å; D242-E244 PolarHBondContact O-N 3.22Å; D242-E244 PolarHBondContact OD1-N 3.07Å; D242-E244 VanDerWaalsContact OD1-N 3.11Å; D242-Y245 WeakPolarHBondContact O-CB 3.12Å; D242-Y245 PolarHBondContact O-N 3.06Å; D242-I246 WeakPolarHBondContact O-CG1 3.39Å; D242-I246 PolarHBondContact O-N 3.05Å | ||
| 243 | P | 58.2 | Low | 67.9 | Low | 43 Ų | 43 | 80 Ų | 80 | 28% | 0.279 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -50.8 | -36.1 | 174.9 | -28.9 | 36 | 0 | 0 | 0 | 113.7 | Y245 I246 T247 E396 | P243-Y245 PolarHBondContact O-N 2.95Å; P243-I246 PolarHBondContact O-N 3.46Å; P243-T247 PolarHBondContact O-N 3.46Å; P243-T247 PolarHBondContact O-OG1 3.3Å; P243-E396 VanDerWaalsContact CB-CD 3.49Å; P243-E396 HydrophobicContact CB-CG 3.97Å; P243-E396 WeakPolarHBondContact CB-OE1 3.37Å |
| 244 | E | 55.9 | Low | 67.2 | Low | 35 Ų | 35 | 78.5 Ų | 78.5 | 16% | 0.164 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -59.5 | -36.2 | 176.9 | -170.2 | 178.5 | -161.7 | 0 | 0 | 112 | D242 R248 Q395 E396 | D242-E244 PolarHBondContact O-N 3.22Å; D242-E244 PolarHBondContact OD1-N 3.07Å; D242-E244 VanDerWaalsContact OD1-N 3.11Å; E244-R248 PolarHBondContact O-N 3.39Å; E244-Q395 HydrophobicContact CB-CG 4.23Å; E244-Q395 WeakPolarHBondContact OE2-CG 3.43Å; E244-E396 HydrophobicContact CB-CG 4.35Å |
| 245 | Y | 55.5 | Low | 67 | Low | 78 Ų | 78 | 74.3 Ų | 74.3 | 31% | 0.306 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -72.2 | -36.3 | 174.2 | -177.1 | -96.9 | 0 | 0 | 0 | 112.2 | Y209 L210 F239 Q240 D242 P243 | Y209-Y245 HydrophobicContact CE1-CD2 4.11Å; Y209-Y245 HydrophobicContact CE1-CE2 4.04Å; L210-Y245 HydrophobicContact CD2-CD2 4.49Å; F239-Y245 WeakPolarHBondContact O-CB 3.5Å; Q240-Y245 HydrophobicContact CB-CE1 4.48Å; Q240-Y245 WeakPolarHBondContact O-CD1 3.18Å; D242-Y245 WeakPolarHBondContact O-CB 3.12Å; D242-Y245 PolarHBondContact O-N 3.06Å; P243-Y245 PolarHBondContact O-N 2.95Å |
| 246 | I | 53.7 | Low | 66.8 | Low | 117 Ų | 117 | 73.6 Ų | 73.6 | 60% | 0.6 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -77.4 | -45.1 | -175.3 | -63.1 | 169.1 | 0 | 0 | 0 | 111.5 | D242 P243 | D242-I246 WeakPolarHBondContact O-CG1 3.39Å; D242-I246 PolarHBondContact O-N 3.05Å; P243-I246 PolarHBondContact O-N 3.46Å |
| 247 | T | 55.2 | Low | 66.9 | Low | 51 Ų | 51 | 78.4 Ų | 78.4 | 31% | 0.313 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -81.9 | -28.7 | -173.4 | 55.9 | 0 | 0 | 0 | 0 | 112.5 | P243 N249 E396 | P243-T247 PolarHBondContact O-N 3.46Å; P243-T247 PolarHBondContact O-OG1 3.3Å; T247-N249 PolarHBondContact O-N 3.08Å; T247-E396 VanDerWaalsContact CG2-OE1 3.24Å; T247-E396 WeakPolarHBondContact CG2-OE1 3.25Å; T247-E396 PolarHBondContact OG1-OE1 3.35Å |
| 248 | R | 52.3 | Low | 66.9 | Low | 211 Ų | 211 | 84.6 Ų | 84.6 | 80% | 0.796 | 40% | 0.403 | S | S | * | . | trans | 46.1 | 7.4 | -171.7 | -81.7 | -171.1 | 177.8 | -177.7 | -0.4 | 114.9 | E244 Y250 | E244-R248 PolarHBondContact O-N 3.39Å; R248-Y250 PolarHBondContact O-N 3.23Å | ||
| 249 | N | 49.3 | Very low | 67.2 | Low | 112 Ų | 112 | 84.5 Ų | 84.5 | 60% | 0.599 | 40% | 0.401 | S | S | * | . | trans | -92.1 | 108.5 | -178.1 | -79.3 | -26.3 | 0 | 0 | 0 | 106.2 | T247 F251 | T247-N249 PolarHBondContact O-N 3.08Å; N249-F251 VanDerWaalsContact C-N 3.32Å; N249-F251 HydrophobicContact CB-CE2 4.48Å; N249-F251 WeakPolarHBondContact O-CD2 3.14Å; N249-F251 PolarHBondContact O-N 3.47Å | ||
| 250 | Y | 52.9 | Low | 67.6 | Low | 164 Ų | 164 | 89.4 Ų | 89.4 | 64% | 0.643 | 42% | 0.424 | S | S | * | . | trans | -64.6 | 98.9 | 163.8 | -90.4 | -94.7 | 0 | 0 | 0 | 107.6 | R248 G252 | R248-Y250 PolarHBondContact O-N 3.23Å; Y250-G252 PolarHBondContact O-N 3.13Å | ||
| 251 | F | 58.1 | Low | 68.2 | Low | 64 Ų | 64 | 87 Ų | 87 | 28% | 0.281 | 41% | 0.413 | S | S | . | . | trans | -63.5 | 132.7 | 168.9 | -69.5 | -81.8 | 0 | 0 | 0 | 108.8 | N249 D255 E396 Y397 | N249-F251 VanDerWaalsContact C-N 3.32Å; N249-F251 HydrophobicContact CB-CE2 4.48Å; N249-F251 WeakPolarHBondContact O-CD2 3.14Å; N249-F251 PolarHBondContact O-N 3.47Å; F251-D255 WeakPolarHBondContact CA-OD2 3.34Å; F251-E396 HydrophobicContact CD2-CB 4.02Å; F251-E396 HydrophobicContact CE2-CB 4.31Å; F251-Y397 HydrophobicContact CB-CD1 3.82Å; F251-Y397 HydrophobicContact CB-CE1 3.4Å; F251-Y397 VanDerWaalsContact CB-CE1 3.4Å; F251-Y397 AromaticContact CD1-CE1 3.62Å; F251-Y397 HydrophobicContact CD1-CE1 3.62Å; F251-Y397 AromaticContact CD1-CZ 3.94Å; F251-Y397 WeakPolarHBondContact CD1-OH 3.35Å; F251-Y397 HydrophobicContact CD2-CD1 4.4Å; F251-Y397 AromaticContact CD2-CE1 3.63Å; F251-Y397 HydrophobicContact CD2-CE1 3.63Å; F251-Y397 AromaticContact CD2-CZ 3.77Å; F251-Y397 HydrophobicContact CE1-CE1 4.26Å; F251-Y397 WeakPolarHBondContact CE1-OH 3.4Å; F251-Y397 HydrophobicContact CE2-CE1 4.26Å; F251-Y397 AromaticContact CE2-CZ 3.92Å; F251-Y397 WeakPolarHBondContact CE2-OH 3.35Å; F251-Y397 HydrophobicContact CG-CD1 4.11Å; F251-Y397 AromaticContact CG-CE1 3.25Å; F251-Y397 HydrophobicContact CG-CE1 3.25Å; F251-Y397 AromaticContact CG-CZ 3.76Å; F251-Y397 WeakPolarHBondContact CZ-OH 3.3Å | ||
| 252 | G | 60 | Low | 69 | Low | 39 Ų | 39 | 77.9 Ų | 77.9 | 40% | 0.402 | 38% | 0.379 | S | S | . | . | trans | -74.3 | 154.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y250 G254 D255 | Y250-G252 PolarHBondContact O-N 3.13Å; G252-G254 PolarHBondContact O-N 3.11Å; G252-D255 PolarHBondContact N-OD2 3.48Å; G252-D255 WeakPolarHBondContact O-CB 3.12Å; G252-D255 PolarHBondContact O-N 3.19Å | ||
| 253 | M | 67.7 | Low | 70.2 | Confident | 88 Ų | 88 | 82 Ų | 82 | 43% | 0.433 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -53.3 | -25.4 | 169.4 | -175.3 | 176.9 | -93.6 | 0 | 0 | 112.1 | D255 L256 F257 A400 S403 V404 | M253-D255 VanDerWaalsContact C-N 3.3Å; M253-D255 PolarHBondContact O-N 3.15Å; M253-L256 PolarHBondContact O-N 2.93Å; M253-F257 HydrophobicContact CG-CE2 4.35Å; M253-F257 WeakPolarHBondContact O-CD2 3.32Å; M253-A400 HydrophobicContact CB-CB 4.41Å; M253-S403 VanDerWaalsContact CE-CB 3.49Å; M253-V404 HydrophobicContact CE-CG2 3.91Å; M253-V404 HydrophobicContact CG-CG2 4.2Å; M253-V404 HydrophobicContact SD-CG2 4.14Å |
| 254 | G | 71.7 | Confident | 71.8 | Confident | 48 Ų | 48 | 83.1 Ų | 83.1 | 50% | 0.495 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.9 | -26.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | G252 L256 F257 R258 | G252-G254 PolarHBondContact O-N 3.11Å; G254-L256 VanDerWaalsContact C-N 3.31Å; G254-L256 PolarHBondContact O-N 3.47Å; G254-F257 PolarHBondContact O-N 3.24Å; G254-F257 VanDerWaalsContact O-N 3.15Å; G254-R258 WeakPolarHBondContact O-CB 3.03Å; G254-R258 PolarHBondContact O-N 2.94Å |
| 255 | D | 80.9 | Confident | 73.7 | Confident | 40 Ų | 40 | 81.4 Ų | 81.4 | 21% | 0.214 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -68.7 | -32.2 | -179.2 | -67 | -43.1 | 0 | 0 | 0 | 112.1 | F251 G252 M253 F257 R258 V259 Y397 | F251-D255 WeakPolarHBondContact CA-OD2 3.34Å; G252-D255 PolarHBondContact N-OD2 3.48Å; G252-D255 WeakPolarHBondContact O-CB 3.12Å; G252-D255 PolarHBondContact O-N 3.19Å; M253-D255 VanDerWaalsContact C-N 3.3Å; M253-D255 PolarHBondContact O-N 3.15Å; D255-F257 PolarHBondContact O-N 3.4Å; D255-R258 PolarHBondContact O-N 2.87Å; D255-R258 VanDerWaalsContact O-N 3.11Å; D255-V259 WeakPolarHBondContact O-CB 3.22Å; D255-V259 WeakPolarHBondContact O-CG2 3.08Å; D255-V259 PolarHBondContact O-N 2.79Å; D255-Y397 HydrophobicContact CB-CE1 4.47Å |
| 256 | L | 83.9 | Confident | 75.5 | Confident | 0 Ų | 0 | 78 Ų | 78 | 0% | 0 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -56.9 | -34.4 | 173 | -68 | 174.5 | 0 | 0 | 0 | 112.3 | M253 G254 L262 R263 L266 F393 A400 A401 V404 | M253-L256 PolarHBondContact O-N 2.93Å; G254-L256 VanDerWaalsContact C-N 3.31Å; G254-L256 PolarHBondContact O-N 3.47Å; L256-L262 HydrophobicContact CD2-CB 4.31Å; L256-R263 WeakPolarHBondContact O-CA 3.31Å; L256-R263 WeakPolarHBondContact O-CG 3.32Å; L256-R263 PolarHBondContact O-N 2.86Å; L256-L266 HydrophobicContact CB-CD2 4.35Å; L256-F393 HydrophobicContact CD2-CE1 4.01Å; L256-A400 HydrophobicContact CD1-CB 3.61Å; L256-A400 HydrophobicContact CG-CB 4.36Å; L256-A401 HydrophobicContact CD1-CB 4.28Å; L256-A401 HydrophobicContact CD2-CB 4.31Å; L256-V404 HydrophobicContact CD1-CG2 4.28Å |
| 257 | F | 87.7 | Confident | 77.5 | Confident | 116 Ų | 116 | 76.1 Ų | 76.1 | 51% | 0.509 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -92.7 | -16.1 | -179.8 | -60.4 | -79.4 | 0 | 0 | 0 | 112.8 | M253 G254 D255 R263 L266 V404 | M253-F257 HydrophobicContact CG-CE2 4.35Å; M253-F257 WeakPolarHBondContact O-CD2 3.32Å; G254-F257 PolarHBondContact O-N 3.24Å; G254-F257 VanDerWaalsContact O-N 3.15Å; D255-F257 PolarHBondContact O-N 3.4Å; F257-R263 WeakPolarHBondContact O-CD 3.37Å; F257-R263 WeakPolarHBondContact O-CG 3.21Å; F257-L266 HydrophobicContact CD1-CD2 4.31Å; F257-L266 HydrophobicContact CE1-CD2 3.75Å; F257-L266 HydrophobicContact CZ-CD2 3.95Å; F257-V404 HydrophobicContact CE2-CG2 4.18Å; F257-V404 HydrophobicContact CZ-CG1 4.16Å; F257-V404 HydrophobicContact CZ-CG2 4.03Å |
| 258 | R | 86.5 | Confident | 79.4 | Confident | 201 Ų | 201 | 73.7 Ų | 73.7 | 76% | 0.758 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -92.4 | -45.2 | -178.9 | -168.9 | 177.2 | -178.6 | -177.8 | 0.8 | 112.1 | G254 D255 | G254-R258 WeakPolarHBondContact O-CB 3.03Å; G254-R258 PolarHBondContact O-N 2.94Å; D255-R258 PolarHBondContact O-N 2.87Å; D255-R258 VanDerWaalsContact O-N 3.11Å |
| 259 | V | 86.8 | Confident | 81.4 | Confident | 46 Ų | 46 | 63.7 Ų | 63.7 | 28% | 0.279 | 30% | 0.304 | S | S | . | . | S | Bend | trans | -83 | 126.7 | -173.9 | -178.4 | 0 | 0 | 0 | 0 | 110.1 | D255 H261 L262 R263 | D255-V259 WeakPolarHBondContact O-CB 3.22Å; D255-V259 WeakPolarHBondContact O-CG2 3.08Å; D255-V259 PolarHBondContact O-N 2.79Å; V259-H261 WeakPolarHBondContact CG1-CE1 3.44Å; V259-H261 VanDerWaalsContact CG1-ND1 3.34Å; V259-H261 WeakPolarHBondContact CG1-ND1 3.47Å; V259-H261 PolarHBondContact O-N 3.21Å; V259-L262 HydrophobicContact CB-CB 4.11Å; V259-L262 HydrophobicContact CB-CD1 3.81Å; V259-L262 HydrophobicContact CB-CG 3.91Å; V259-L262 HydrophobicContact CG1-CB 4.41Å; V259-L262 HydrophobicContact CG1-CD1 4.15Å; V259-L262 HydrophobicContact CG1-CG 3.91Å; V259-L262 HydrophobicContact CG2-CD1 4.14Å; V259-L262 PolarHBondContact O-N 3.47Å; V259-R263 PolarHBondContact O-N 3.03Å |
| 260 | Q | 87.8 | Confident | 83.7 | Confident | 111 Ų | 111 | 59.7 Ų | 59.7 | 52% | 0.519 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.9 | -46.5 | -171 | -170.9 | -178.7 | -16.7 | 0 | 0 | 114.2 | L262 R263 W264 C469 | Q260-L262 VanDerWaalsContact C-N 3.33Å; Q260-L262 PolarHBondContact O-N 3.49Å; Q260-R263 WeakPolarHBondContact O-CB 3.1Å; Q260-R263 PolarHBondContact O-N 2.93Å; Q260-W264 PolarHBondContact O-N 3.5Å; Q260-C469 HydrophobicContact CG-CB 4.3Å |
| 261 | H | 88.4 | Confident | 85.8 | Confident | 32 Ų | 32 | 52.2 Ų | 52.2 | 15% | 0.148 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -70.9 | -29.8 | -179.6 | 68.4 | -90.1 | 0 | 0 | 0 | 112.3 | V259 W264 G265 E462 F465 K466 C469 | V259-H261 WeakPolarHBondContact CG1-CE1 3.44Å; V259-H261 VanDerWaalsContact CG1-ND1 3.34Å; V259-H261 WeakPolarHBondContact CG1-ND1 3.47Å; V259-H261 PolarHBondContact O-N 3.21Å; H261-W264 PolarHBondContact O-N 3.4Å; H261-G265 PolarHBondContact O-N 3.45Å; H261-E462 IonicContact CD2-OE1 3.88Å; H261-E462 IonicContact NE2-OE1 3.26Å; H261-E462 PolarHBondContact NE2-OE1 3.09Å; H261-F465 HydrophobicContact CB-CB 4.24Å; H261-K466 HydrophobicContact CB-CG 3.86Å; H261-K466 WeakPolarHBondContact NE2-CE 3.38Å; H261-C469 VanDerWaalsContact CA-SG 3.6Å |
| 262 | L | 89.9 | Confident | 87.6 | Confident | 4 Ų | 4 | 49.2 Ų | 49.2 | 2% | 0.021 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -70.9 | -41.5 | 173.2 | -60.5 | -176.6 | 0 | 0 | 0 | 111.6 | L256 V259 Q260 W264 G265 L266 F393 Y397 | L256-L262 HydrophobicContact CD2-CB 4.31Å; V259-L262 HydrophobicContact CB-CB 4.11Å; V259-L262 HydrophobicContact CB-CD1 3.81Å; V259-L262 HydrophobicContact CB-CG 3.91Å; V259-L262 HydrophobicContact CG1-CB 4.41Å; V259-L262 HydrophobicContact CG1-CD1 4.15Å; V259-L262 HydrophobicContact CG1-CG 3.91Å; V259-L262 HydrophobicContact CG2-CD1 4.14Å; V259-L262 PolarHBondContact O-N 3.47Å; Q260-L262 VanDerWaalsContact C-N 3.33Å; Q260-L262 PolarHBondContact O-N 3.49Å; L262-W264 PolarHBondContact O-N 2.83Å; L262-G265 PolarHBondContact O-N 3.25Å; L262-L266 WeakPolarHBondContact O-CB 3.34Å; L262-L266 PolarHBondContact O-N 2.85Å; L262-F393 HydrophobicContact CD2-CD1 4.48Å; L262-F393 HydrophobicContact CD2-CE1 4.39Å; L262-Y397 HydrophobicContact CD1-CD1 3.63Å; L262-Y397 HydrophobicContact CD1-CD2 4.15Å; L262-Y397 HydrophobicContact CD1-CE1 3.47Å; L262-Y397 VanDerWaalsContact CD1-CE1 3.47Å; L262-Y397 HydrophobicContact CD1-CE2 4.02Å; L262-Y397 HydrophobicContact CD1-CG 3.98Å; L262-Y397 HydrophobicContact CD2-CD2 3.76Å; L262-Y397 HydrophobicContact CD2-CE2 4.01Å; L262-Y397 HydrophobicContact CD2-CG 4.08Å |
| 263 | R | 92.9 | Very high | 89.3 | Confident | 123 Ų | 123 | 47.4 Ų | 47.4 | 46% | 0.464 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -55.6 | -43.1 | 171.5 | -81 | -172.2 | -77.2 | 166.9 | 3.8 | 111.6 | L256 F257 V259 Q260 L266 F267 | L256-R263 WeakPolarHBondContact O-CA 3.31Å; L256-R263 WeakPolarHBondContact O-CG 3.32Å; L256-R263 PolarHBondContact O-N 2.86Å; F257-R263 WeakPolarHBondContact O-CD 3.37Å; F257-R263 WeakPolarHBondContact O-CG 3.21Å; V259-R263 PolarHBondContact O-N 3.03Å; Q260-R263 WeakPolarHBondContact O-CB 3.1Å; Q260-R263 PolarHBondContact O-N 2.93Å; R263-L266 PolarHBondContact O-N 3.04Å; R263-F267 PolarHBondContact O-N 3.35Å |
| 264 | W | 91.6 | Very high | 90.7 | Very high | 65 Ų | 65 | 47 Ų | 47 | 25% | 0.246 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -68.4 | -45.7 | 179 | -170.1 | -114.7 | 0 | 0 | 0 | 112.2 | Q260 H261 L262 L266 F267 V268 Y449 F465 Q468 | Q260-W264 PolarHBondContact O-N 3.5Å; H261-W264 PolarHBondContact O-N 3.4Å; L262-W264 PolarHBondContact O-N 2.83Å; W264-L266 PolarHBondContact O-N 2.68Å; W264-F267 AromaticContact CE3-CD1 3.94Å; W264-F267 HydrophobicContact CE3-CD1 3.94Å; W264-F267 AromaticContact CH2-CD1 3.95Å; W264-F267 HydrophobicContact CH2-CD1 3.95Å; W264-F267 AromaticContact CH2-CE1 3.94Å; W264-F267 HydrophobicContact CH2-CE1 3.94Å; W264-F267 AromaticContact CZ3-CD1 3.61Å; W264-F267 HydrophobicContact CZ3-CD1 3.61Å; W264-F267 AromaticContact CZ3-CE1 3.92Å; W264-F267 HydrophobicContact CZ3-CE1 3.92Å; W264-F267 HydrophobicContact CZ3-CG 4.4Å; W264-F267 WeakPolarHBondContact O-CB 3.45Å; W264-F267 PolarHBondContact O-N 3.28Å; W264-V268 WeakPolarHBondContact O-CG2 2.96Å; W264-V268 PolarHBondContact O-N 3.23Å; W264-Y449 AromaticContact CH2-CD1 3.72Å; W264-Y449 HydrophobicContact CH2-CD1 3.72Å; W264-Y449 AromaticContact CH2-CE1 3.72Å; W264-Y449 HydrophobicContact CH2-CE1 3.72Å; W264-Y449 HydrophobicContact CH2-CG 4.24Å; W264-Y449 AromaticContact CZ2-CD1 3.44Å; W264-Y449 HydrophobicContact CZ2-CD1 3.44Å; W264-Y449 VanDerWaalsContact CZ2-CD1 3.44Å; W264-Y449 AromaticContact CZ2-CE1 3.84Å; W264-Y449 HydrophobicContact CZ2-CE1 3.84Å; W264-Y449 HydrophobicContact CZ2-CG 4.06Å; W264-F465 AromaticContact CD1-CD1 3.59Å; W264-Q468 VanDerWaalsContact CD1-OE1 3.31Å |
| 265 | G | 93.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -57.2 | -37.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.4 | H261 L262 V268 A269 | H261-G265 PolarHBondContact O-N 3.45Å; L262-G265 PolarHBondContact O-N 3.25Å; G265-V268 PolarHBondContact O-N 2.89Å; G265-A269 WeakPolarHBondContact O-CB 3.49Å; G265-A269 PolarHBondContact O-N 3.25Å |
| 266 | L | 94.1 | Very high | 92.5 | Very high | 7 Ų | 7 | 43.2 Ų | 43.2 | 4% | 0.037 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -69.1 | -44.3 | 178.8 | 178.8 | 62.4 | 0 | 0 | 0 | 111.1 | L256 F257 L262 R263 W264 V268 A269 L270 F393 V404 V405 | L256-L266 HydrophobicContact CB-CD2 4.35Å; F257-L266 HydrophobicContact CD1-CD2 4.31Å; F257-L266 HydrophobicContact CE1-CD2 3.75Å; F257-L266 HydrophobicContact CZ-CD2 3.95Å; L262-L266 WeakPolarHBondContact O-CB 3.34Å; L262-L266 PolarHBondContact O-N 2.85Å; R263-L266 PolarHBondContact O-N 3.04Å; W264-L266 PolarHBondContact O-N 2.68Å; L266-V268 VanDerWaalsContact C-N 3.3Å; L266-V268 PolarHBondContact O-N 3.45Å; L266-A269 PolarHBondContact O-N 2.86Å; L266-L270 HydrophobicContact CD1-CD1 4.29Å; L266-L270 HydrophobicContact CD1-CG 4.27Å; L266-L270 HydrophobicContact CG-CD1 4.04Å; L266-L270 HydrophobicContact CG-CG 4.48Å; L266-L270 WeakPolarHBondContact O-CB 3.3Å; L266-L270 VanDerWaalsContact O-CG 3.25Å; L266-L270 WeakPolarHBondContact O-CG 3.14Å; L266-L270 PolarHBondContact O-N 3.38Å; L266-F393 HydrophobicContact CB-CZ 4.19Å; L266-V404 HydrophobicContact CD1-CB 4.15Å; L266-V404 HydrophobicContact CD1-CG1 3.96Å; L266-V404 HydrophobicContact CD2-CG1 4.22Å; L266-V405 HydrophobicContact CD1-CG2 4.02Å |
| 267 | F | 95.5 | Very high | 93 | Very high | 77 Ų | 77 | 43.6 Ų | 43.6 | 34% | 0.338 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -55.5 | -47.3 | 172.3 | 172.4 | -105 | 0 | 0 | 0 | 111.3 | R263 W264 A269 L270 I271 L445 Y449 | R263-F267 PolarHBondContact O-N 3.35Å; W264-F267 AromaticContact CE3-CD1 3.94Å; W264-F267 HydrophobicContact CE3-CD1 3.94Å; W264-F267 AromaticContact CH2-CD1 3.95Å; W264-F267 HydrophobicContact CH2-CD1 3.95Å; W264-F267 AromaticContact CH2-CE1 3.94Å; W264-F267 HydrophobicContact CH2-CE1 3.94Å; W264-F267 AromaticContact CZ3-CD1 3.61Å; W264-F267 HydrophobicContact CZ3-CD1 3.61Å; W264-F267 AromaticContact CZ3-CE1 3.92Å; W264-F267 HydrophobicContact CZ3-CE1 3.92Å; W264-F267 HydrophobicContact CZ3-CG 4.4Å; W264-F267 WeakPolarHBondContact O-CB 3.45Å; W264-F267 PolarHBondContact O-N 3.28Å; F267-A269 PolarHBondContact O-N 3.14Å; F267-L270 PolarHBondContact O-N 2.89Å; F267-I271 HydrophobicContact CD1-CD1 4.34Å; F267-I271 HydrophobicContact CE1-CD1 3.94Å; F267-I271 HydrophobicContact CZ-CD1 4.21Å; F267-I271 HydrophobicContact CZ-CG1 4.49Å; F267-I271 WeakPolarHBondContact O-CG1 3.47Å; F267-I271 PolarHBondContact O-N 3.37Å; F267-L445 HydrophobicContact CZ-CD2 4.4Å; F267-Y449 HydrophobicContact CE1-CD2 4Å; F267-Y449 HydrophobicContact CE1-CE2 4.34Å; F267-Y449 HydrophobicContact CE1-CG 4.41Å |
| 268 | V | 95.7 | Very high | 93.3 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.2 | -41.1 | 177.8 | 172.6 | 0 | 0 | 0 | 0 | 112.1 | W264 G265 L266 L270 P272 L392 L450 F465 | W264-V268 WeakPolarHBondContact O-CG2 2.96Å; W264-V268 PolarHBondContact O-N 3.23Å; G265-V268 PolarHBondContact O-N 2.89Å; L266-V268 VanDerWaalsContact C-N 3.3Å; L266-V268 PolarHBondContact O-N 3.45Å; V268-L270 VanDerWaalsContact C-N 3.34Å; V268-L270 PolarHBondContact O-N 2.93Å; V268-P272 VanDerWaalsContact O-CD 3.26Å; V268-P272 WeakPolarHBondContact O-CD 3.31Å; V268-L392 HydrophobicContact CG1-CD1 4.36Å; V268-L392 HydrophobicContact CG1-CD2 4.41Å; V268-L450 HydrophobicContact CG1-CB 4.4Å; V268-L450 HydrophobicContact CG1-CD1 3.45Å; V268-L450 VanDerWaalsContact CG1-CD1 3.45Å; V268-F465 HydrophobicContact CB-CE1 4.32Å; V268-F465 HydrophobicContact CB-CZ 4.23Å; V268-F465 HydrophobicContact CG1-CE1 4.39Å; V268-F465 HydrophobicContact CG1-CZ 4.2Å; V268-F465 HydrophobicContact CG2-CE1 4.05Å; V268-F465 HydrophobicContact CG2-CZ 4.47Å |
| 269 | A | 94.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -68.2 | -30.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | G265 L266 F267 P272 H273 V389 L392 F393 V405 | G265-A269 WeakPolarHBondContact O-CB 3.49Å; G265-A269 PolarHBondContact O-N 3.25Å; L266-A269 PolarHBondContact O-N 2.86Å; F267-A269 PolarHBondContact O-N 3.14Å; A269-P272 WeakPolarHBondContact O-CD 3.24Å; A269-H273 PolarHBondContact O-CD2 2.92Å; A269-V389 HydrophobicContact CB-CG2 4.35Å; A269-L392 HydrophobicContact CB-CD1 3.68Å; A269-F393 HydrophobicContact CB-CE2 3.92Å; A269-V405 HydrophobicContact CB-CG2 4.04Å |
| 270 | L | 96.6 | Very high | 94 | Very high | 29 Ų | 29 | 28.1 Ų | 28.1 | 15% | 0.152 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -73.3 | -32.1 | 179.6 | -76 | 168.5 | 0 | 0 | 0 | 112.7 | L266 F267 V268 H273 F274 V405 T408 | L266-L270 HydrophobicContact CD1-CD1 4.29Å; L266-L270 HydrophobicContact CD1-CG 4.27Å; L266-L270 HydrophobicContact CG-CD1 4.04Å; L266-L270 HydrophobicContact CG-CG 4.48Å; L266-L270 WeakPolarHBondContact O-CB 3.3Å; L266-L270 VanDerWaalsContact O-CG 3.25Å; L266-L270 WeakPolarHBondContact O-CG 3.14Å; L266-L270 PolarHBondContact O-N 3.38Å; F267-L270 PolarHBondContact O-N 2.89Å; V268-L270 VanDerWaalsContact C-N 3.34Å; V268-L270 PolarHBondContact O-N 2.93Å; L270-H273 PolarHBondContact O-N 2.93Å; L270-H273 VanDerWaalsContact O-N 3.14Å; L270-F274 HydrophobicContact CB-CD2 4.01Å; L270-F274 HydrophobicContact CB-CE2 4Å; L270-F274 HydrophobicContact CD2-CE2 4.38Å; L270-F274 VanDerWaalsContact O-CD2 3.3Å; L270-F274 WeakPolarHBondContact O-CD2 3.36Å; L270-F274 PolarHBondContact O-N 2.93Å; L270-V405 HydrophobicContact CD2-CB 4.41Å; L270-V405 HydrophobicContact CD2-CG2 3.92Å; L270-V405 HydrophobicContact CG-CG2 4.24Å; L270-T408 HydrophobicContact CD2-CG2 3.89Å |
| 271 | I | 97.4 | Very high | 94.3 | Very high | 7 Ų | 7 | 23 Ų | 23 | 4% | 0.036 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -54.3 | -51.3 | -175.9 | -63.3 | 156.4 | 0 | 0 | 0 | 112.2 | F267 H273 F274 G275 V442 L445 I446 | F267-I271 HydrophobicContact CD1-CD1 4.34Å; F267-I271 HydrophobicContact CE1-CD1 3.94Å; F267-I271 HydrophobicContact CZ-CD1 4.21Å; F267-I271 HydrophobicContact CZ-CG1 4.49Å; F267-I271 WeakPolarHBondContact O-CG1 3.47Å; F267-I271 PolarHBondContact O-N 3.37Å; I271-H273 VanDerWaalsContact C-N 3.32Å; I271-H273 PolarHBondContact O-N 3.45Å; I271-F274 PolarHBondContact O-N 3.34Å; I271-G275 PolarHBondContact O-N 2.95Å; I271-V442 HydrophobicContact CG2-CG1 4.11Å; I271-L445 HydrophobicContact CD1-CB 3.83Å; I271-L445 HydrophobicContact CG1-CB 4.15Å; I271-L445 HydrophobicContact CG1-CD1 4.16Å; I271-L445 HydrophobicContact CG2-CB 3.84Å; I271-L445 HydrophobicContact CG2-CD1 4.46Å; I271-I446 HydrophobicContact CG2-CD1 4.26Å; I271-I446 HydrophobicContact CG2-CG1 3.62Å |
| 272 | P | 96.6 | Very high | 94.2 | Very high | 1 Ų | 1 | 21.9 Ų | 21.9 | 1% | 0.006 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -67.9 | -29.7 | -179.6 | -22.9 | 37.8 | 0 | 0 | 0 | 113.3 | V268 A269 Q276 L333 P385 L388 | V268-P272 VanDerWaalsContact O-CD 3.26Å; V268-P272 WeakPolarHBondContact O-CD 3.31Å; A269-P272 WeakPolarHBondContact O-CD 3.24Å; P272-Q276 VanDerWaalsContact O-CB 3.24Å; P272-Q276 WeakPolarHBondContact O-CB 3.12Å; P272-Q276 PolarHBondContact O-N 3.4Å; P272-L333 HydrophobicContact CB-CD1 4.1Å; P272-L333 HydrophobicContact CB-CD2 4.22Å; P272-L333 HydrophobicContact CG-CD1 3.92Å; P272-P385 HydrophobicContact CB-CB 4.12Å; P272-P385 HydrophobicContact CB-CG 3.81Å; P272-L388 HydrophobicContact CB-CD2 4.43Å; P272-L388 HydrophobicContact CG-CD2 3.77Å |
| 273 | H | 95.4 | Very high | 94.1 | Very high | 1 Ų | 1 | 21.7 Ų | 21.7 | 1% | 0.005 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -73.5 | -39.8 | 176.4 | -80.3 | -95.6 | 0 | 0 | 0 | 112.5 | A269 L270 I271 Q276 Q277 P385 V405 N409 | A269-H273 PolarHBondContact O-CD2 2.92Å; L270-H273 PolarHBondContact O-N 2.93Å; L270-H273 VanDerWaalsContact O-N 3.14Å; I271-H273 VanDerWaalsContact C-N 3.32Å; I271-H273 PolarHBondContact O-N 3.45Å; H273-Q276 PolarHBondContact O-N 3.47Å; H273-Q277 PolarHBondContact O-N 3.28Å; H273-Q277 VanDerWaalsContact O-N 3.15Å; H273-P385 VanDerWaalsContact NE2-C 3.29Å; H273-P385 VanDerWaalsContact NE2-CB 3.34Å; H273-P385 WeakPolarHBondContact NE2-CB 3.47Å; H273-P385 PolarHBondContact NE2-O 2.99Å; H273-P385 VanDerWaalsContact NE2-O 3.08Å; H273-V405 HydrophobicContact CB-CG1 3.94Å; H273-V405 WeakPolarHBondContact CD2-CG1 3.49Å; H273-V405 VanDerWaalsContact CE1-CG1 3.45Å; H273-V405 WeakPolarHBondContact CE1-CG1 3.47Å; H273-V405 WeakPolarHBondContact NE2-CG1 3.25Å; H273-N409 HydrophobicContact CB-CB 4.5Å; H273-N409 PolarHBondContact ND1-ND2 3.39Å; H273-N409 VanDerWaalsContact ND1-ND2 3.13Å |
| 274 | F | 96 | Very high | 93.9 | Very high | 79 Ų | 79 | 15.8 Ų | 15.8 | 35% | 0.346 | 7% | 0.072 | S | C | . | . | H | α-helix | trans | -59.4 | -50.2 | 168.6 | -85.1 | -67.3 | 0 | 0 | 0 | 110.3 | L270 I271 Q276 Q277 L278 T408 C412 | L270-F274 HydrophobicContact CB-CD2 4.01Å; L270-F274 HydrophobicContact CB-CE2 4Å; L270-F274 HydrophobicContact CD2-CE2 4.38Å; L270-F274 VanDerWaalsContact O-CD2 3.3Å; L270-F274 WeakPolarHBondContact O-CD2 3.36Å; L270-F274 PolarHBondContact O-N 2.93Å; I271-F274 PolarHBondContact O-N 3.34Å; F274-Q276 VanDerWaalsContact C-N 3.32Å; F274-Q276 PolarHBondContact O-N 3.25Å; F274-Q277 PolarHBondContact O-N 3.36Å; F274-L278 HydrophobicContact CD1-CD1 4.01Å; F274-L278 VanDerWaalsContact O-CB 3.24Å; F274-L278 WeakPolarHBondContact O-CB 3.48Å; F274-L278 WeakPolarHBondContact O-CG 3.35Å; F274-L278 PolarHBondContact O-N 2.96Å; F274-T408 HydrophobicContact CD2-CG2 4.5Å; F274-T408 HydrophobicContact CE1-CG2 3.81Å; F274-T408 HydrophobicContact CE2-CG2 3.78Å; F274-T408 HydrophobicContact CZ-CG2 3.38Å; F274-C412 WeakPolarHBondContact CD1-SG 3.24Å; F274-C412 WeakPolarHBondContact CE1-SG 2.96Å |
| 275 | G | 96.5 | Very high | 93.7 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -56.8 | -43.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | I271 S279 F337 | I271-G275 PolarHBondContact O-N 2.95Å; G275-S279 WeakPolarHBondContact O-CA 3.34Å; G275-S279 WeakPolarHBondContact O-CB 3.27Å; G275-S279 PolarHBondContact O-N 3.24Å; G275-F337 WeakPolarHBondContact O-CE1 3.47Å |
| 276 | Q | 95.3 | Very high | 93.2 | Very high | 8 Ų | 8 | 13.3 Ų | 13.3 | 4% | 0.037 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -60.7 | -53.2 | 178.9 | -176.6 | -175.3 | 30.4 | 0 | 0 | 111.5 | P272 H273 F274 S279 I281 F377 P381 G382 P385 N409 | P272-Q276 VanDerWaalsContact O-CB 3.24Å; P272-Q276 WeakPolarHBondContact O-CB 3.12Å; P272-Q276 PolarHBondContact O-N 3.4Å; H273-Q276 PolarHBondContact O-N 3.47Å; F274-Q276 VanDerWaalsContact C-N 3.32Å; F274-Q276 PolarHBondContact O-N 3.25Å; Q276-S279 WeakPolarHBondContact O-CB 3.39Å; Q276-S279 PolarHBondContact O-OG 3.3Å; Q276-I281 WeakPolarHBondContact O-CG2 3.29Å; Q276-F377 HydrophobicContact CG-CE2 3.88Å; Q276-F377 HydrophobicContact CG-CZ 3.6Å; Q276-P381 VanDerWaalsContact CG-O 3.26Å; Q276-P381 WeakPolarHBondContact CG-O 3.38Å; Q276-P381 PolarHBondContact NE2-O 3.4Å; Q276-G382 PolarHBondContact NE2-O 3.26Å; Q276-G382 VanDerWaalsContact NE2-O 3.11Å; Q276-P385 HydrophobicContact CB-CG 4.42Å; Q276-N409 PolarHBondContact OE1-ND2 2.92Å; Q276-N409 VanDerWaalsContact OE1-ND2 3.16Å |
| 277 | Q | 93.9 | Very high | 92.6 | Very high | 8 Ų | 8 | 14 Ų | 14 | 4% | 0.037 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -75.3 | -38.2 | -174.2 | -66.3 | -66.5 | -20.5 | 0 | 0 | 112.6 | H273 F274 S279 N282 N409 C412 N413 | H273-Q277 PolarHBondContact O-N 3.28Å; H273-Q277 VanDerWaalsContact O-N 3.15Å; F274-Q277 PolarHBondContact O-N 3.36Å; Q277-S279 VanDerWaalsContact C-N 3.29Å; Q277-S279 PolarHBondContact O-N 2.93Å; Q277-N282 PolarHBondContact OE1-ND2 3.4Å; Q277-N409 HydrophobicContact CG-CB 4.35Å; Q277-N409 WeakPolarHBondContact CG-ND2 3.34Å; Q277-N409 WeakPolarHBondContact CG-O 3.21Å; Q277-N409 VanDerWaalsContact NE2-CG 3.32Å; Q277-N409 PolarHBondContact NE2-ND2 3.42Å; Q277-N409 PolarHBondContact NE2-OD1 3.36Å; Q277-C412 HydrophobicContact CB-CB 3.55Å; Q277-C412 HydrophobicContact CG-CB 4.16Å; Q277-N413 PolarHBondContact OE1-ND2 3.29Å |
| 278 | L | 94.4 | Very high | 92.1 | Very high | 38 Ų | 38 | 10.3 Ų | 10.3 | 20% | 0.199 | 5% | 0.049 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -92.5 | 18.4 | 178.1 | -55 | 178.8 | 0 | 0 | 0 | 112.6 | F274 G280 C412 V416 F435 V438 | F274-L278 HydrophobicContact CD1-CD1 4.01Å; F274-L278 VanDerWaalsContact O-CB 3.24Å; F274-L278 WeakPolarHBondContact O-CB 3.48Å; F274-L278 WeakPolarHBondContact O-CG 3.35Å; F274-L278 PolarHBondContact O-N 2.96Å; L278-G280 VanDerWaalsContact C-N 3.26Å; L278-C412 HydrophobicContact CD2-CB 4.32Å; L278-C412 HydrophobicContact CG-CB 4.44Å; L278-V416 HydrophobicContact CD2-CG2 3.67Å; L278-F435 WeakPolarHBondContact O-CD1 3.3Å; L278-V438 HydrophobicContact CB-CB 4.37Å; L278-V438 HydrophobicContact CB-CG1 3.67Å; L278-V438 HydrophobicContact CD1-CG1 4.18Å |
| 279 | S | 95 | Very high | 91.7 | Very high | 0 Ų | 0 | 10.9 Ų | 10.9 | 0% | 0 | 5% | 0.052 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.2 | -15 | 171.5 | 59.8 | 0 | 0 | 0 | 0 | 113.2 | G275 Q276 Q277 I281 L344 | G275-S279 WeakPolarHBondContact O-CA 3.34Å; G275-S279 WeakPolarHBondContact O-CB 3.27Å; G275-S279 PolarHBondContact O-N 3.24Å; Q276-S279 WeakPolarHBondContact O-CB 3.39Å; Q276-S279 PolarHBondContact O-OG 3.3Å; Q277-S279 VanDerWaalsContact C-N 3.29Å; Q277-S279 PolarHBondContact O-N 2.93Å; S279-I281 WeakPolarHBondContact OG-CB 3.48Å; S279-I281 WeakPolarHBondContact OG-CG2 3.39Å; S279-I281 PolarHBondContact OG-N 2.82Å; S279-L344 WeakPolarHBondContact O-CD1 3.27Å |
| 280 | G | 92.1 | Very high | 91.1 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 7% | 0.066 | C | C | . | . | S | Bend | trans | 93.4 | -3.7 | -170 | 0 | 0 | 0 | 0 | 0 | 114.2 | L278 N282 G283 V284 F435 | L278-G280 VanDerWaalsContact C-N 3.26Å; G280-N282 PolarHBondContact O-N 3.37Å; G280-G283 PolarHBondContact O-N 2.78Å; G280-G283 VanDerWaalsContact O-N 3.11Å; G280-V284 PolarHBondContact O-N 3.29Å; G280-F435 VanDerWaalsContact N-CD1 3.34Å |
| 281 | I | 93.2 | Very high | 90.5 | Very high | 3 Ų | 3 | 11.9 Ų | 11.9 | 2% | 0.015 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -58.4 | -42.4 | -177 | -170 | 59.9 | 0 | 0 | 0 | 113.2 | Q276 S279 G283 V284 L285 F373 V374 F377 | Q276-I281 WeakPolarHBondContact O-CG2 3.29Å; S279-I281 WeakPolarHBondContact OG-CB 3.48Å; S279-I281 WeakPolarHBondContact OG-CG2 3.39Å; S279-I281 PolarHBondContact OG-N 2.82Å; I281-G283 VanDerWaalsContact C-N 3.32Å; I281-G283 PolarHBondContact O-N 3.38Å; I281-V284 WeakPolarHBondContact O-CB 3.25Å; I281-V284 PolarHBondContact O-N 3.46Å; I281-L285 HydrophobicContact CD1-CD1 4.44Å; I281-L285 HydrophobicContact CD1-CG 4.27Å; I281-L285 HydrophobicContact CG1-CD1 3.96Å; I281-L285 HydrophobicContact CG1-CG 4.2Å; I281-L285 WeakPolarHBondContact O-CG 3.33Å; I281-L285 PolarHBondContact O-N 3.06Å; I281-F373 HydrophobicContact CB-CE1 4.33Å; I281-F373 HydrophobicContact CB-CZ 4.25Å; I281-F373 HydrophobicContact CD1-CD1 4.47Å; I281-F373 HydrophobicContact CD1-CE1 3.69Å; I281-F373 HydrophobicContact CD1-CZ 4.37Å; I281-V374 HydrophobicContact CD1-CG1 3.94Å; I281-F377 HydrophobicContact CB-CD2 3.98Å; I281-F377 HydrophobicContact CB-CE2 3.79Å; I281-F377 HydrophobicContact CB-CG 4.46Å; I281-F377 HydrophobicContact CB-CZ 4.09Å; I281-F377 HydrophobicContact CD1-CB 4.44Å; I281-F377 HydrophobicContact CD1-CD1 4.18Å; I281-F377 HydrophobicContact CD1-CD2 4.44Å; I281-F377 HydrophobicContact CD1-CG 4.1Å; I281-F377 HydrophobicContact CG1-CD1 4Å; I281-F377 HydrophobicContact CG1-CD2 4.09Å; I281-F377 HydrophobicContact CG1-CE1 3.91Å; I281-F377 HydrophobicContact CG1-CE2 4.03Å; I281-F377 HydrophobicContact CG1-CG 4.08Å; I281-F377 HydrophobicContact CG1-CZ 3.93Å; I281-F377 HydrophobicContact CG2-CD2 4.3Å; I281-F377 HydrophobicContact CG2-CE1 4.49Å; I281-F377 HydrophobicContact CG2-CE2 3.59Å; I281-F377 HydrophobicContact CG2-CZ 3.7Å |
| 282 | N | 88.2 | Confident | 90 | Very high | 9 Ų | 9 | 11.6 Ų | 11.6 | 5% | 0.048 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -67.2 | -34.5 | 178.8 | -68.3 | -36.3 | 0 | 0 | 0 | 112.1 | Q277 G280 V284 L285 Y286 N413 V416 | Q277-N282 PolarHBondContact OE1-ND2 3.4Å; G280-N282 PolarHBondContact O-N 3.37Å; N282-V284 VanDerWaalsContact C-N 3.28Å; N282-V284 PolarHBondContact O-N 3.36Å; N282-L285 PolarHBondContact O-N 3.3Å; N282-Y286 HydrophobicContact CB-CD2 3.99Å; N282-Y286 HydrophobicContact CB-CE2 3.66Å; N282-Y286 VanDerWaalsContact O-CB 3.24Å; N282-Y286 WeakPolarHBondContact O-CB 3.37Å; N282-Y286 WeakPolarHBondContact O-CD2 3.47Å; N282-Y286 PolarHBondContact O-N 3.38Å; N282-N413 PolarHBondContact ND2-ND2 3.21Å; N282-V416 HydrophobicContact CB-CG1 3.9Å |
| 283 | G | 86 | Confident | 89.6 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -59.5 | -43.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | G280 I281 Y287 | G280-G283 PolarHBondContact O-N 2.78Å; G280-G283 VanDerWaalsContact O-N 3.11Å; I281-G283 VanDerWaalsContact C-N 3.32Å; I281-G283 PolarHBondContact O-N 3.38Å; G283-Y287 WeakPolarHBondContact O-CB 3.42Å; G283-Y287 PolarHBondContact O-N 3.1Å; G283-Y287 VanDerWaalsContact O-N 3.11Å |
| 284 | V | 89.4 | Confident | 88.8 | Confident | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.8 | -50 | 173.5 | 178.9 | 0 | 0 | 0 | 0 | 111.2 | G280 I281 N282 Y286 S288 V309 L370 F373 V374 F432 | G280-V284 PolarHBondContact O-N 3.29Å; I281-V284 WeakPolarHBondContact O-CB 3.25Å; I281-V284 PolarHBondContact O-N 3.46Å; N282-V284 VanDerWaalsContact C-N 3.28Å; N282-V284 PolarHBondContact O-N 3.36Å; V284-Y286 PolarHBondContact O-N 3.17Å; V284-S288 VanDerWaalsContact O-CA 3.31Å; V284-S288 WeakPolarHBondContact O-CA 3.44Å; V284-S288 WeakPolarHBondContact O-CB 3.34Å; V284-S288 PolarHBondContact O-N 3.45Å; V284-S288 PolarHBondContact O-OG 2.76Å; V284-V309 HydrophobicContact CG1-CG1 4.28Å; V284-L370 HydrophobicContact CG2-CD2 3.97Å; V284-F373 HydrophobicContact CB-CE1 4.38Å; V284-F373 HydrophobicContact CG2-CD1 4.18Å; V284-F373 HydrophobicContact CG2-CE1 3.81Å; V284-V374 HydrophobicContact CG1-CG1 4.43Å; V284-F432 HydrophobicContact CG2-CE1 4.15Å; V284-F432 HydrophobicContact CG2-CZ 4.21Å |
| 285 | L | 88 | Confident | 88.1 | Confident | 8 Ų | 8 | 14 Ų | 14 | 4% | 0.042 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -66.8 | -39.3 | -175 | -67.6 | 178.2 | 0 | 0 | 0 | 113.3 | T25 N29 I162 I281 N282 | T25-L285 HydrophobicContact CG2-CD1 4.23Å; N29-L285 PolarHBondContact ND2-O 3.48Å; I162-L285 HydrophobicContact CD1-CD1 4.06Å; I162-L285 HydrophobicContact CG2-CD2 4.16Å; I281-L285 HydrophobicContact CD1-CD1 4.44Å; I281-L285 HydrophobicContact CD1-CG 4.27Å; I281-L285 HydrophobicContact CG1-CD1 3.96Å; I281-L285 HydrophobicContact CG1-CG 4.2Å; I281-L285 WeakPolarHBondContact O-CG 3.33Å; I281-L285 PolarHBondContact O-N 3.06Å; N282-L285 PolarHBondContact O-N 3.3Å |
| 286 | Y | 83.1 | Confident | 87.5 | Confident | 4 Ų | 4 | 16.7 Ų | 16.7 | 2% | 0.016 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -80.8 | -30.5 | -178.1 | -59.5 | -22.7 | 0 | 0 | 0 | 113.1 | T25 I28 N282 V284 N413 | T25-Y286 HydrophobicContact CG2-CE1 3.63Å; T25-Y286 WeakPolarHBondContact O-CD1 3.22Å; T25-Y286 WeakPolarHBondContact O-CE1 3.36Å; I28-Y286 HydrophobicContact CG2-CD1 4.36Å; N282-Y286 HydrophobicContact CB-CD2 3.99Å; N282-Y286 HydrophobicContact CB-CE2 3.66Å; N282-Y286 VanDerWaalsContact O-CB 3.24Å; N282-Y286 WeakPolarHBondContact O-CB 3.37Å; N282-Y286 WeakPolarHBondContact O-CD2 3.47Å; N282-Y286 PolarHBondContact O-N 3.38Å; V284-Y286 PolarHBondContact O-N 3.17Å; Y286-N413 PolarHBondContact OH-ND2 3.05Å; Y286-N413 VanDerWaalsContact OH-ND2 3.12Å; Y286-N413 PolarHBondContact OH-OD1 2.79Å |
| 287 | Y | 82.4 | Confident | 87.3 | Confident | 22 Ų | 22 | 17.9 Ų | 17.9 | 9% | 0.086 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -131.2 | 18.1 | -168.8 | -50 | -74.2 | 0 | 0 | 0 | 114.5 | L32 G283 V289 P290 L291 G417 F420 P421 | L32-Y287 HydrophobicContact CD2-CD1 4.45Å; G283-Y287 WeakPolarHBondContact O-CB 3.42Å; G283-Y287 PolarHBondContact O-N 3.1Å; G283-Y287 VanDerWaalsContact O-N 3.11Å; Y287-V289 VanDerWaalsContact C-N 3.33Å; Y287-V289 PolarHBondContact O-N 3.03Å; Y287-P290 WeakPolarHBondContact O-CD 3.11Å; Y287-L291 VanDerWaalsContact O-CB 3.28Å; Y287-L291 WeakPolarHBondContact O-CB 3.43Å; Y287-L291 PolarHBondContact O-N 3.27Å; Y287-G417 PolarHBondContact OH-O 2.77Å; Y287-F420 AromaticContact CD2-CD1 3.34Å; Y287-F420 HydrophobicContact CD2-CD1 3.34Å; Y287-F420 AromaticContact CD2-CE1 3.72Å; Y287-F420 HydrophobicContact CD2-CE1 3.72Å; Y287-F420 HydrophobicContact CD2-CG 4.38Å; Y287-F420 HydrophobicContact CE2-CB 4.49Å; Y287-F420 AromaticContact CE2-CD1 3.79Å; Y287-F420 HydrophobicContact CE2-CD1 3.79Å; Y287-F420 HydrophobicContact CG-CD1 4.18Å; Y287-F420 HydrophobicContact CG-CE1 4.24Å; Y287-P421 HydrophobicContact CE1-CG 3.91Å; Y287-P421 HydrophobicContact CE2-CG 3.87Å; Y287-P421 VanDerWaalsContact CZ-CG 3.43Å; Y287-P421 VanDerWaalsContact OH-CG 3.28Å; Y287-P421 WeakPolarHBondContact OH-CG 3.45Å |
| 288 | S | 85 | Confident | 87.2 | Confident | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -56.5 | -40.6 | 179.2 | 46.9 | 0 | 0 | 0 | 0 | 113.8 | N29 V284 L291 F292 N306 | N29-S288 PolarHBondContact ND2-N 3.39Å; N29-S288 PolarHBondContact ND2-OG 3.43Å; V284-S288 VanDerWaalsContact O-CA 3.31Å; V284-S288 WeakPolarHBondContact O-CA 3.44Å; V284-S288 WeakPolarHBondContact O-CB 3.34Å; V284-S288 PolarHBondContact O-N 3.45Å; V284-S288 PolarHBondContact O-OG 2.76Å; S288-L291 WeakPolarHBondContact O-CB 3.41Å; S288-L291 PolarHBondContact O-N 3.01Å; S288-F292 WeakPolarHBondContact O-CB 3.15Å; S288-F292 WeakPolarHBondContact O-CD2 3.46Å; S288-F292 WeakPolarHBondContact O-CG 3.23Å; S288-F292 PolarHBondContact O-N 2.95Å; S288-N306 WeakPolarHBondContact CB-OD1 3.43Å; S288-N306 PolarHBondContact OG-OD1 3.22Å |
| 289 | V | 87 | Confident | 86.9 | Confident | 12 Ų | 12 | 23.3 Ų | 23.3 | 7% | 0.073 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.8 | -53.6 | -179.3 | 175.1 | 0 | 0 | 0 | 0 | 110.4 | N29 Y287 L291 F292 E293 A302 N306 | N29-V289 WeakPolarHBondContact OD1-CB 3.12Å; N29-V289 WeakPolarHBondContact OD1-CG2 2.97Å; Y287-V289 VanDerWaalsContact C-N 3.33Å; Y287-V289 PolarHBondContact O-N 3.03Å; V289-L291 VanDerWaalsContact C-N 3.25Å; V289-L291 PolarHBondContact O-N 3.2Å; V289-F292 PolarHBondContact O-N 3.13Å; V289-E293 WeakPolarHBondContact O-CG 3.42Å; V289-E293 PolarHBondContact O-N 3.12Å; V289-A302 HydrophobicContact CG1-CB 3.99Å; V289-N306 HydrophobicContact CG2-CB 3.85Å |
| 290 | P | 81.7 | Confident | 86.7 | Confident | 45 Ų | 45 | 31 Ų | 31 | 29% | 0.292 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -55.2 | -36.6 | 171.1 | -27.7 | 33.4 | 0 | 0 | 0 | 114.5 | Y287 F292 E293 S294 | Y287-P290 WeakPolarHBondContact O-CD 3.11Å; P290-F292 VanDerWaalsContact C-N 3.34Å; P290-E293 PolarHBondContact O-N 3.34Å; P290-S294 PolarHBondContact O-N 3.3Å |
| 291 | L | 83.7 | Confident | 86.7 | Confident | 4 Ų | 4 | 34.5 Ų | 34.5 | 2% | 0.021 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.8 | -36.3 | 176.8 | -176.2 | 67 | 0 | 0 | 0 | 112 | Y287 S288 V289 S294 V295 F347 L370 F432 | Y287-L291 VanDerWaalsContact O-CB 3.28Å; Y287-L291 WeakPolarHBondContact O-CB 3.43Å; Y287-L291 PolarHBondContact O-N 3.27Å; S288-L291 WeakPolarHBondContact O-CB 3.41Å; S288-L291 PolarHBondContact O-N 3.01Å; V289-L291 VanDerWaalsContact C-N 3.25Å; V289-L291 PolarHBondContact O-N 3.2Å; L291-S294 PolarHBondContact O-OG 3.47Å; L291-V295 PolarHBondContact O-N 2.98Å; L291-F347 HydrophobicContact CD1-CE1 4.21Å; L291-F347 HydrophobicContact CD1-CZ 4.14Å; L291-F347 HydrophobicContact CD2-CE1 4.05Å; L291-F347 HydrophobicContact CD2-CZ 3.79Å; L291-F347 HydrophobicContact CG-CE1 4.45Å; L291-F347 HydrophobicContact CG-CZ 4.01Å; L291-L370 HydrophobicContact CD2-CD1 4.06Å; L291-F432 HydrophobicContact CD1-CE2 4.04Å; L291-F432 HydrophobicContact CD2-CE2 4.06Å; L291-F432 HydrophobicContact CD2-CZ 3.96Å |
| 292 | F | 88.3 | Confident | 86.6 | Confident | 1 Ų | 1 | 34.4 Ų | 34.4 | 0% | 0.004 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -74.5 | -33.4 | 175.4 | -76.1 | -47.9 | 0 | 0 | 0 | 112.3 | S288 V289 P290 V295 L297 A302 V305 V309 I367 L370 | S288-F292 WeakPolarHBondContact O-CB 3.15Å; S288-F292 WeakPolarHBondContact O-CD2 3.46Å; S288-F292 WeakPolarHBondContact O-CG 3.23Å; S288-F292 PolarHBondContact O-N 2.95Å; V289-F292 PolarHBondContact O-N 3.13Å; P290-F292 VanDerWaalsContact C-N 3.34Å; F292-V295 HydrophobicContact CD1-CG2 4.29Å; F292-V295 WeakPolarHBondContact O-CG2 3.44Å; F292-V295 PolarHBondContact O-N 3.29Å; F292-L297 HydrophobicContact CB-CD1 4.02Å; F292-L297 HydrophobicContact CD1-CD1 4.26Å; F292-L297 HydrophobicContact CG-CD1 4.35Å; F292-L297 WeakPolarHBondContact O-CB 3.5Å; F292-L297 PolarHBondContact O-N 2.98Å; F292-A302 HydrophobicContact CB-CB 3.58Å; F292-V305 HydrophobicContact CD1-CG1 3.9Å; F292-V305 HydrophobicContact CD2-CB 4.27Å; F292-V305 HydrophobicContact CD2-CG1 3.8Å; F292-V305 HydrophobicContact CE1-CG1 3.61Å; F292-V305 HydrophobicContact CE2-CB 4.34Å; F292-V305 HydrophobicContact CE2-CG1 3.53Å; F292-V305 HydrophobicContact CG-CG1 4.01Å; F292-V305 HydrophobicContact CZ-CG1 3.43Å; F292-V305 VanDerWaalsContact CZ-CG1 3.43Å; F292-V309 HydrophobicContact CE2-CG2 3.95Å; F292-V309 HydrophobicContact CZ-CG2 4.06Å; F292-I367 HydrophobicContact CD1-CG1 4.23Å; F292-I367 HydrophobicContact CE1-CG1 3.86Å; F292-L370 HydrophobicContact CE1-CD1 3.52Å; F292-L370 HydrophobicContact CZ-CD1 3.53Å |
| 293 | E | 86.3 | Confident | 86.8 | Confident | 73 Ų | 73 | 35.2 Ų | 35.2 | 34% | 0.341 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -65.4 | -38.4 | 171.8 | -69.8 | 175.2 | 151.9 | 0 | 0 | 111.7 | V289 P290 V295 G296 L297 N299 A302 | V289-E293 WeakPolarHBondContact O-CG 3.42Å; V289-E293 PolarHBondContact O-N 3.12Å; P290-E293 PolarHBondContact O-N 3.34Å; E293-V295 PolarHBondContact O-N 3.02Å; E293-G296 WeakPolarHBondContact O-CA 3.26Å; E293-G296 PolarHBondContact O-N 2.56Å; E293-L297 WeakPolarHBondContact CA-O 3.47Å; E293-N299 VanDerWaalsContact OE1-CA 3.24Å; E293-N299 WeakPolarHBondContact OE1-CA 3.38Å; E293-N299 WeakPolarHBondContact OE1-CB 3.24Å; E293-N299 PolarHBondContact OE1-ND2 3.48Å; E293-A302 HydrophobicContact CG-CB 3.98Å |
| 294 | S | 79.4 | Confident | 87.2 | Confident | 57 Ų | 57 | 39.4 Ų | 39.4 | 40% | 0.399 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -66.3 | -23.8 | 177.1 | 78.6 | 0 | 0 | 0 | 0 | 113.2 | P290 L291 G296 R354 | P290-S294 PolarHBondContact O-N 3.3Å; L291-S294 PolarHBondContact O-OG 3.47Å; S294-G296 VanDerWaalsContact C-N 3.25Å; S294-G296 PolarHBondContact O-N 3.1Å; S294-R354 PolarHBondContact O-NH1 3.34Å |
| 295 | V | 81.9 | Confident | 87.4 | Confident | 2 Ų | 2 | 40.5 Ų | 40.5 | 1% | 0.012 | 22% | 0.222 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | 12.3 | 169.4 | -55.5 | 0 | 0 | 0 | 0 | 114 | L291 F292 E293 L297 L351 R354 T363 | L291-V295 PolarHBondContact O-N 2.98Å; F292-V295 HydrophobicContact CD1-CG2 4.29Å; F292-V295 WeakPolarHBondContact O-CG2 3.44Å; F292-V295 PolarHBondContact O-N 3.29Å; E293-V295 PolarHBondContact O-N 3.02Å; V295-L297 HydrophobicContact CG2-CG 4.44Å; V295-L351 HydrophobicContact CG1-CD2 3.17Å; V295-R354 PolarHBondContact O-NE 3.31Å; V295-R354 PolarHBondContact O-NH2 2.84Å; V295-T363 HydrophobicContact CB-CG2 4.26Å; V295-T363 HydrophobicContact CG2-CG2 3.78Å; V295-T363 PolarHBondContact O-OG1 3.04Å |
| 296 | G | 84.3 | Confident | 87.7 | Confident | 56 Ų | 56 | 40.6 Ų | 40.6 | 58% | 0.577 | 22% | 0.223 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 88.4 | 13.6 | 170 | 0 | 0 | 0 | 0 | 0 | 115.1 | E293 S294 | E293-G296 WeakPolarHBondContact O-CA 3.26Å; E293-G296 PolarHBondContact O-N 2.56Å; S294-G296 VanDerWaalsContact C-N 3.25Å; S294-G296 PolarHBondContact O-N 3.1Å |
| 297 | L | 90.5 | Very high | 88.2 | Confident | 33 Ų | 33 | 42.1 Ų | 42.1 | 17% | 0.173 | 23% | 0.231 | C | C | . | . | trans | -79 | 148.9 | 171.2 | -63.7 | 177.7 | 0 | 0 | 0 | 110.7 | F292 E293 V295 D301 A302 V305 T363 I367 | F292-L297 HydrophobicContact CB-CD1 4.02Å; F292-L297 HydrophobicContact CD1-CD1 4.26Å; F292-L297 HydrophobicContact CG-CD1 4.35Å; F292-L297 WeakPolarHBondContact O-CB 3.5Å; F292-L297 PolarHBondContact O-N 2.98Å; E293-L297 WeakPolarHBondContact CA-O 3.47Å; V295-L297 HydrophobicContact CG2-CG 4.44Å; L297-D301 HydrophobicContact CB-CB 4.29Å; L297-D301 HydrophobicContact CD2-CB 4.42Å; L297-A302 HydrophobicContact CB-CB 4.25Å; L297-V305 HydrophobicContact CD1-CB 4.49Å; L297-V305 HydrophobicContact CD1-CG2 4.01Å; L297-T363 HydrophobicContact CD1-CG2 4.23Å; L297-T363 HydrophobicContact CD2-CG2 3.81Å; L297-T363 HydrophobicContact CG-CG2 3.84Å; L297-I367 HydrophobicContact CD1-CD1 3.97Å | ||
| 298 | T | 91.2 | Very high | 88.8 | Confident | 78 Ų | 78 | 41.9 Ų | 41.9 | 48% | 0.479 | 24% | 0.236 | S | C | . | . | trans | -68.1 | 157.5 | 169.7 | 71.7 | 0 | 0 | 0 | 0 | 109.9 | R300 D301 A302 | T298-R300 PolarHBondContact O-N 3.22Å; T298-R300 VanDerWaalsContact O-N 3.16Å; T298-D301 PolarHBondContact O-N 3.09Å; T298-D301 VanDerWaalsContact O-N 3.09Å; T298-D301 PolarHBondContact OG1-N 3.24Å; T298-D301 PolarHBondContact OG1-OD2 3.44Å; T298-A302 VanDerWaalsContact O-CB 3.26Å; T298-A302 WeakPolarHBondContact O-CB 3.42Å; T298-A302 PolarHBondContact O-N 3.08Å | ||
| 299 | N | 88 | Confident | 89.3 | Confident | 82 Ų | 82 | 41.9 Ų | 41.9 | 44% | 0.439 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -52.8 | -38.7 | 176.1 | -178.2 | -95.8 | 0 | 0 | 0 | 112.9 | E293 S303 | E293-N299 VanDerWaalsContact OE1-CA 3.24Å; E293-N299 WeakPolarHBondContact OE1-CA 3.38Å; E293-N299 WeakPolarHBondContact OE1-CB 3.24Å; E293-N299 PolarHBondContact OE1-ND2 3.48Å; N299-S303 WeakPolarHBondContact O-CB 3.43Å; N299-S303 PolarHBondContact O-N 3.37Å; N299-S303 PolarHBondContact O-OG 3.11Å |
| 300 | R | 90.3 | Very high | 89.7 | Confident | 162 Ų | 162 | 41.3 Ų | 41.3 | 61% | 0.611 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -63.2 | -52.3 | 176.6 | -178 | 179.8 | 177.1 | 174.7 | 0.1 | 110.9 | T298 S303 F304 | T298-R300 PolarHBondContact O-N 3.22Å; T298-R300 VanDerWaalsContact O-N 3.16Å; R300-S303 WeakPolarHBondContact O-CB 3.31Å; R300-S303 PolarHBondContact O-N 3.17Å; R300-F304 HydrophobicContact CG-CD2 4.06Å; R300-F304 HydrophobicContact CG-CE2 3.87Å; R300-F304 WeakPolarHBondContact O-CD2 3.43Å; R300-F304 PolarHBondContact O-N 3.04Å; R300-F304 VanDerWaalsContact O-N 3.15Å |
| 301 | D | 92.8 | Very high | 90.4 | Very high | 74 Ų | 74 | 40.7 Ų | 40.7 | 40% | 0.396 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.7 | -41.9 | -177.8 | -58.2 | -36.7 | 0 | 0 | 0 | 111.2 | L297 T298 S303 F304 V305 | L297-D301 HydrophobicContact CB-CB 4.29Å; L297-D301 HydrophobicContact CD2-CB 4.42Å; T298-D301 PolarHBondContact O-N 3.09Å; T298-D301 VanDerWaalsContact O-N 3.09Å; T298-D301 PolarHBondContact OG1-N 3.24Å; T298-D301 PolarHBondContact OG1-OD2 3.44Å; D301-S303 VanDerWaalsContact C-N 3.27Å; D301-S303 PolarHBondContact O-N 3.25Å; D301-F304 PolarHBondContact O-N 2.96Å; D301-V305 WeakPolarHBondContact O-CB 3.43Å; D301-V305 VanDerWaalsContact O-CG2 3.26Å; D301-V305 WeakPolarHBondContact O-CG2 3.48Å; D301-V305 PolarHBondContact O-N 2.8Å |
| 302 | A | 92 | Very high | 91 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -56.6 | -40.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V289 F292 E293 L297 T298 V305 N306 | V289-A302 HydrophobicContact CG1-CB 3.99Å; F292-A302 HydrophobicContact CB-CB 3.58Å; E293-A302 HydrophobicContact CG-CB 3.98Å; L297-A302 HydrophobicContact CB-CB 4.25Å; T298-A302 VanDerWaalsContact O-CB 3.26Å; T298-A302 WeakPolarHBondContact O-CB 3.42Å; T298-A302 PolarHBondContact O-N 3.08Å; A302-V305 PolarHBondContact O-N 3.02Å; A302-N306 VanDerWaalsContact O-CB 3.3Å; A302-N306 WeakPolarHBondContact O-CB 3.31Å; A302-N306 PolarHBondContact O-N 3.31Å |
| 303 | S | 91.9 | Very high | 91.3 | Very high | 26 Ų | 26 | 42.2 Ų | 42.2 | 18% | 0.182 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.2 | -41.6 | 176.4 | -61.9 | 0 | 0 | 0 | 0 | 112.7 | N299 R300 D301 N306 L307 | N299-S303 WeakPolarHBondContact O-CB 3.43Å; N299-S303 PolarHBondContact O-N 3.37Å; N299-S303 PolarHBondContact O-OG 3.11Å; R300-S303 WeakPolarHBondContact O-CB 3.31Å; R300-S303 PolarHBondContact O-N 3.17Å; D301-S303 VanDerWaalsContact C-N 3.27Å; D301-S303 PolarHBondContact O-N 3.25Å; S303-N306 WeakPolarHBondContact O-CB 3.3Å; S303-N306 PolarHBondContact O-N 3.37Å; S303-L307 PolarHBondContact O-N 3.32Å |
| 304 | F | 94 | Very high | 91.7 | Very high | 88 Ų | 88 | 39.5 Ų | 39.5 | 39% | 0.386 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -69.3 | -37.4 | 175.2 | -79.7 | -71.3 | 0 | 0 | 0 | 112.7 | L170 R300 D301 N306 L307 G308 | L170-F304 HydrophobicContact CD1-CE1 4.43Å; R300-F304 HydrophobicContact CG-CD2 4.06Å; R300-F304 HydrophobicContact CG-CE2 3.87Å; R300-F304 WeakPolarHBondContact O-CD2 3.43Å; R300-F304 PolarHBondContact O-N 3.04Å; R300-F304 VanDerWaalsContact O-N 3.15Å; D301-F304 PolarHBondContact O-N 2.96Å; F304-N306 VanDerWaalsContact C-N 3.34Å; F304-L307 WeakPolarHBondContact O-CB 3.46Å; F304-L307 PolarHBondContact O-N 3.2Å; F304-G308 PolarHBondContact O-N 2.72Å |
| 305 | V | 94.2 | Very high | 92.5 | Very high | 23 Ų | 23 | 42 Ų | 42 | 14% | 0.139 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66 | -39.5 | 174.8 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | F292 L297 D301 A302 L307 G308 V309 I367 Y371 | F292-V305 HydrophobicContact CD1-CG1 3.9Å; F292-V305 HydrophobicContact CD2-CB 4.27Å; F292-V305 HydrophobicContact CD2-CG1 3.8Å; F292-V305 HydrophobicContact CE1-CG1 3.61Å; F292-V305 HydrophobicContact CE2-CB 4.34Å; F292-V305 HydrophobicContact CE2-CG1 3.53Å; F292-V305 HydrophobicContact CG-CG1 4.01Å; F292-V305 HydrophobicContact CZ-CG1 3.43Å; F292-V305 VanDerWaalsContact CZ-CG1 3.43Å; L297-V305 HydrophobicContact CD1-CB 4.49Å; L297-V305 HydrophobicContact CD1-CG2 4.01Å; D301-V305 WeakPolarHBondContact O-CB 3.43Å; D301-V305 VanDerWaalsContact O-CG2 3.26Å; D301-V305 WeakPolarHBondContact O-CG2 3.48Å; D301-V305 PolarHBondContact O-N 2.8Å; A302-V305 PolarHBondContact O-N 3.02Å; V305-L307 VanDerWaalsContact C-N 3.31Å; V305-L307 PolarHBondContact O-N 3.04Å; V305-G308 WeakPolarHBondContact O-CA 3.39Å; V305-G308 PolarHBondContact O-N 3.46Å; V305-V309 PolarHBondContact O-N 2.98Å; V305-V309 VanDerWaalsContact O-N 3.16Å; V305-I367 HydrophobicContact CG1-CB 4.36Å; V305-I367 HydrophobicContact CG1-CD1 4.03Å; V305-I367 HydrophobicContact CG1-CG1 3.77Å; V305-I367 HydrophobicContact CG1-CG2 3.72Å; V305-I367 HydrophobicContact CG2-CD1 4Å; V305-Y371 PolarHBondContact O-OH 2.97Å |
| 306 | N | 93 | Very high | 93 | Very high | 10 Ų | 10 | 42 Ų | 42 | 5% | 0.053 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.8 | -38.9 | 172.6 | 179.7 | 45.3 | 0 | 0 | 0 | 112.2 | Q166 S288 V289 A302 S303 F304 G308 V309 G310 | Q166-N306 PolarHBondContact NE2-OD1 3.11Å; Q166-N306 PolarHBondContact OE1-O 3.43Å; S288-N306 WeakPolarHBondContact CB-OD1 3.43Å; S288-N306 PolarHBondContact OG-OD1 3.22Å; V289-N306 HydrophobicContact CG2-CB 3.85Å; A302-N306 VanDerWaalsContact O-CB 3.3Å; A302-N306 WeakPolarHBondContact O-CB 3.31Å; A302-N306 PolarHBondContact O-N 3.31Å; S303-N306 WeakPolarHBondContact O-CB 3.3Å; S303-N306 PolarHBondContact O-N 3.37Å; F304-N306 VanDerWaalsContact C-N 3.34Å; N306-G308 PolarHBondContact O-N 3.21Å; N306-V309 WeakPolarHBondContact O-CA 3.39Å; N306-V309 VanDerWaalsContact O-CB 3.24Å; N306-V309 WeakPolarHBondContact O-CB 3.48Å; N306-V309 PolarHBondContact O-N 3.01Å; N306-G310 PolarHBondContact O-N 3.06Å; N306-G310 VanDerWaalsContact O-N 3.15Å |
| 307 | L | 94.6 | Very high | 93.4 | Very high | 36 Ų | 36 | 39.4 Ų | 39.4 | 19% | 0.188 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.9 | -37.4 | 172.5 | -177.3 | 67.1 | 0 | 0 | 0 | 111.8 | F163 Q166 V167 L170 S303 F304 V305 V309 G310 A311 | F163-L307 HydrophobicContact CD2-CD1 3.76Å; F163-L307 HydrophobicContact CE2-CD1 3.25Å; F163-L307 HydrophobicContact CE2-CG 3.86Å; F163-L307 HydrophobicContact CZ-CD1 4.02Å; Q166-L307 HydrophobicContact CB-CD1 4.25Å; V167-L307 HydrophobicContact CB-CD1 4.37Å; V167-L307 HydrophobicContact CG2-CD1 3.43Å; V167-L307 VanDerWaalsContact CG2-CD1 3.43Å; L170-L307 HydrophobicContact CD1-CD2 4.49Å; S303-L307 PolarHBondContact O-N 3.32Å; F304-L307 WeakPolarHBondContact O-CB 3.46Å; F304-L307 PolarHBondContact O-N 3.2Å; V305-L307 VanDerWaalsContact C-N 3.31Å; V305-L307 PolarHBondContact O-N 3.04Å; L307-V309 VanDerWaalsContact C-N 3.33Å; L307-V309 PolarHBondContact O-N 2.59Å; L307-G310 PolarHBondContact O-N 3.21Å; L307-A311 PolarHBondContact O-N 3.4Å |
| 308 | G | 95.5 | Very high | 93.5 | Very high | 18 Ų | 18 | 41.6 Ų | 41.6 | 19% | 0.186 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.4 | -36.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | F304 V305 N306 G310 A311 V312 Y371 | F304-G308 PolarHBondContact O-N 2.72Å; V305-G308 WeakPolarHBondContact O-CA 3.39Å; V305-G308 PolarHBondContact O-N 3.46Å; N306-G308 PolarHBondContact O-N 3.21Å; G308-G310 VanDerWaalsContact C-N 3.32Å; G308-G310 PolarHBondContact O-N 3.29Å; G308-A311 PolarHBondContact O-N 3.36Å; G308-V312 WeakPolarHBondContact O-CB 3.38Å; G308-V312 VanDerWaalsContact O-CG2 3.27Å; G308-V312 WeakPolarHBondContact O-CG2 3.24Å; G308-V312 PolarHBondContact O-N 3.28Å; G308-Y371 WeakPolarHBondContact CA-OH 3.28Å |
| 309 | V | 95 | Very high | 93.4 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58.3 | -46.9 | 172.2 | -177.5 | 0 | 0 | 0 | 0 | 110.1 | V284 F292 V305 N306 L307 V312 I313 Y371 V374 | V284-V309 HydrophobicContact CG1-CG1 4.28Å; F292-V309 HydrophobicContact CE2-CG2 3.95Å; F292-V309 HydrophobicContact CZ-CG2 4.06Å; V305-V309 PolarHBondContact O-N 2.98Å; V305-V309 VanDerWaalsContact O-N 3.16Å; N306-V309 WeakPolarHBondContact O-CA 3.39Å; N306-V309 VanDerWaalsContact O-CB 3.24Å; N306-V309 WeakPolarHBondContact O-CB 3.48Å; N306-V309 PolarHBondContact O-N 3.01Å; L307-V309 VanDerWaalsContact C-N 3.33Å; L307-V309 PolarHBondContact O-N 2.59Å; V309-V312 PolarHBondContact O-N 2.9Å; V309-I313 WeakPolarHBondContact O-CG2 3.38Å; V309-I313 PolarHBondContact O-N 3.46Å; V309-Y371 HydrophobicContact CB-CE1 4.34Å; V309-Y371 HydrophobicContact CG2-CD1 4.02Å; V309-Y371 HydrophobicContact CG2-CE1 3.62Å; V309-V374 HydrophobicContact CG1-CB 4.36Å; V309-V374 HydrophobicContact CG1-CG1 3.62Å; V309-V374 HydrophobicContact CG1-CG2 4.09Å |
| 310 | G | 94.6 | Very high | 93.4 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62 | -41.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | F163 N306 L307 G308 I313 V314 | F163-G310 VanDerWaalsContact CD2-C 3.43Å; N306-G310 PolarHBondContact O-N 3.06Å; N306-G310 VanDerWaalsContact O-N 3.15Å; L307-G310 PolarHBondContact O-N 3.21Å; G308-G310 VanDerWaalsContact C-N 3.32Å; G308-G310 PolarHBondContact O-N 3.29Å; G310-I313 WeakPolarHBondContact O-CG2 3.21Å; G310-V314 VanDerWaalsContact O-CG2 3.31Å; G310-V314 WeakPolarHBondContact O-CG2 3.22Å; G310-V314 PolarHBondContact O-N 3.45Å; G310-V314 VanDerWaalsContact O-N 3.16Å |
| 311 | A | 96.9 | Very high | 93.2 | Very high | 32 Ų | 32 | 32.2 Ų | 32.2 | 26% | 0.264 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -65.2 | -44.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | F163 L307 G308 V314 L315 | F163-A311 HydrophobicContact CD2-CB 4.45Å; F163-A311 HydrophobicContact CE2-CB 3.89Å; F163-A311 HydrophobicContact CZ-CB 4.41Å; L307-A311 PolarHBondContact O-N 3.4Å; G308-A311 PolarHBondContact O-N 3.36Å; A311-V314 PolarHBondContact O-N 2.91Å; A311-L315 WeakPolarHBondContact O-CB 3.43Å; A311-L315 VanDerWaalsContact O-CG 3.32Å; A311-L315 WeakPolarHBondContact O-CG 3.44Å; A311-L315 PolarHBondContact O-N 3.28Å |
| 312 | V | 96.7 | Very high | 92.7 | Very high | 34 Ų | 34 | 32.5 Ų | 32.5 | 21% | 0.206 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -66.5 | -39.5 | 179.9 | 175.6 | 0 | 0 | 0 | 0 | 111.4 | G308 V309 V314 L315 G316 Y371 V374 | G308-V312 WeakPolarHBondContact O-CB 3.38Å; G308-V312 VanDerWaalsContact O-CG2 3.27Å; G308-V312 WeakPolarHBondContact O-CG2 3.24Å; G308-V312 PolarHBondContact O-N 3.28Å; V309-V312 PolarHBondContact O-N 2.9Å; V312-V314 VanDerWaalsContact C-N 3.33Å; V312-V314 PolarHBondContact O-N 2.98Å; V312-L315 PolarHBondContact O-N 3.27Å; V312-G316 PolarHBondContact O-N 3.33Å; V312-Y371 WeakPolarHBondContact CG1-O 3.41Å; V312-Y371 HydrophobicContact CG2-CD1 4.42Å; V312-Y371 HydrophobicContact CG2-CD2 4.25Å; V312-Y371 HydrophobicContact CG2-CG 4.04Å; V312-V374 HydrophobicContact CB-CG2 4.06Å; V312-V374 HydrophobicContact CG1-CG2 3.8Å |
| 313 | I | 94.4 | Very high | 92.5 | Very high | 2 Ų | 2 | 35.1 Ų | 35.1 | 1% | 0.01 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -65.5 | -37.3 | 176.9 | -162.8 | 177.2 | 0 | 0 | 0 | 111.4 | V159 V309 G310 T317 V374 S378 | V159-I313 HydrophobicContact CB-CG1 4.36Å; V159-I313 HydrophobicContact CB-CG2 4.24Å; V159-I313 HydrophobicContact CG1-CD1 3.86Å; V159-I313 HydrophobicContact CG1-CG1 3.85Å; V309-I313 WeakPolarHBondContact O-CG2 3.38Å; V309-I313 PolarHBondContact O-N 3.46Å; G310-I313 WeakPolarHBondContact O-CG2 3.21Å; I313-T317 WeakPolarHBondContact O-CB 3.41Å; I313-T317 PolarHBondContact O-N 3.4Å; I313-T317 PolarHBondContact O-OG1 2.8Å; I313-V374 HydrophobicContact CB-CB 4.43Å; I313-S378 WeakPolarHBondContact CG1-OG 3.48Å; I313-S378 PolarHBondContact O-OG 3.41Å; I313-S378 VanDerWaalsContact O-OG 3.12Å |
| 314 | V | 95.1 | Very high | 92.1 | Very high | 16 Ų | 16 | 33.9 Ų | 33.9 | 10% | 0.097 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.1 | -52.1 | 174.1 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | F156 V159 F163 G310 A311 V312 G316 T317 I318 | F156-V314 HydrophobicContact CE2-CG1 4.48Å; V159-V314 HydrophobicContact CB-CG2 4.33Å; V159-V314 HydrophobicContact CG2-CG2 4.08Å; V159-V314 WeakPolarHBondContact O-CG2 3.45Å; F163-V314 HydrophobicContact CB-CG2 3.74Å; F163-V314 HydrophobicContact CG-CG2 4.25Å; G310-V314 VanDerWaalsContact O-CG2 3.31Å; G310-V314 WeakPolarHBondContact O-CG2 3.22Å; G310-V314 PolarHBondContact O-N 3.45Å; G310-V314 VanDerWaalsContact O-N 3.16Å; A311-V314 PolarHBondContact O-N 2.91Å; V312-V314 VanDerWaalsContact C-N 3.33Å; V312-V314 PolarHBondContact O-N 2.98Å; V314-G316 PolarHBondContact O-N 3.03Å; V314-T317 WeakPolarHBondContact O-CB 3.15Å; V314-T317 PolarHBondContact O-N 3.24Å; V314-T317 VanDerWaalsContact O-N 3.08Å; V314-I318 HydrophobicContact CG1-CD1 4.11Å; V314-I318 WeakPolarHBondContact O-CG1 3.42Å; V314-I318 PolarHBondContact O-N 3.02Å |
| 315 | L | 95.4 | Very high | 91.5 | Very high | 109 Ų | 109 | 33.4 Ų | 33.4 | 57% | 0.571 | 20% | 0.201 | S | C | * | . | H | α-helix | trans | -59.7 | -45.9 | 178.7 | -70.4 | 172.7 | 0 | 0 | 0 | 111.5 | A311 V312 T317 I318 V319 | A311-L315 WeakPolarHBondContact O-CB 3.43Å; A311-L315 VanDerWaalsContact O-CG 3.32Å; A311-L315 WeakPolarHBondContact O-CG 3.44Å; A311-L315 PolarHBondContact O-N 3.28Å; V312-L315 PolarHBondContact O-N 3.27Å; L315-T317 PolarHBondContact O-N 2.63Å; L315-I318 PolarHBondContact O-N 3.13Å; L315-I318 VanDerWaalsContact O-N 3.16Å; L315-V319 WeakPolarHBondContact O-CG2 3.34Å; L315-V319 PolarHBondContact O-N 3.13Å |
| 316 | G | 93.6 | Very high | 91 | Very high | 4 Ų | 4 | 42.1 Ų | 42.1 | 4% | 0.041 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.2 | -36.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | V312 V314 V319 S320 S378 | V312-G316 PolarHBondContact O-N 3.33Å; V314-G316 PolarHBondContact O-N 3.03Å; G316-V319 PolarHBondContact O-N 2.86Å; G316-S320 VanDerWaalsContact O-CB 3.3Å; G316-S320 WeakPolarHBondContact O-CB 3.25Å; G316-S320 PolarHBondContact O-N 3.46Å; G316-S378 VanDerWaalsContact C-CB 3.46Å |
| 317 | T | 92.2 | Very high | 90.6 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.006 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -71.1 | -38.4 | 176.5 | -57.7 | 0 | 0 | 0 | 0 | 111.8 | I152 Q155 F156 V159 I313 V314 L315 V319 S320 V321 | I152-T317 HydrophobicContact CG2-CG2 4.45Å; Q155-T317 HydrophobicContact CG-CG2 4.16Å; F156-T317 HydrophobicContact CB-CG2 4.17Å; F156-T317 HydrophobicContact CD2-CG2 4.43Å; V159-T317 HydrophobicContact CG2-CG2 3.95Å; V159-T317 WeakPolarHBondContact CG2-OG1 3.5Å; I313-T317 WeakPolarHBondContact O-CB 3.41Å; I313-T317 PolarHBondContact O-N 3.4Å; I313-T317 PolarHBondContact O-OG1 2.8Å; V314-T317 WeakPolarHBondContact O-CB 3.15Å; V314-T317 PolarHBondContact O-N 3.24Å; V314-T317 VanDerWaalsContact O-N 3.08Å; L315-T317 PolarHBondContact O-N 2.63Å; T317-V319 VanDerWaalsContact C-N 3.34Å; T317-V319 PolarHBondContact O-N 3.39Å; T317-S320 VanDerWaalsContact O-CB 3.31Å; T317-S320 WeakPolarHBondContact O-CB 3.28Å; T317-S320 PolarHBondContact O-N 3.27Å; T317-V321 WeakPolarHBondContact O-CG2 3.37Å; T317-V321 PolarHBondContact O-N 2.85Å |
| 318 | I | 91.2 | Very high | 90.4 | Very high | 78 Ų | 78 | 41.6 Ų | 41.6 | 40% | 0.4 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -60.4 | -45.3 | 173.3 | -66.9 | 167.7 | 0 | 0 | 0 | 110.5 | F156 V314 L315 S320 V321 | F156-I318 HydrophobicContact CD2-CG1 4.17Å; F156-I318 HydrophobicContact CE2-CD1 4.14Å; F156-I318 HydrophobicContact CE2-CG1 3.69Å; V314-I318 HydrophobicContact CG1-CD1 4.11Å; V314-I318 WeakPolarHBondContact O-CG1 3.42Å; V314-I318 PolarHBondContact O-N 3.02Å; L315-I318 PolarHBondContact O-N 3.13Å; L315-I318 VanDerWaalsContact O-N 3.16Å; I318-S320 VanDerWaalsContact C-N 3.32Å; I318-S320 PolarHBondContact O-N 3.4Å; I318-V321 WeakPolarHBondContact O-CB 3.45Å; I318-V321 PolarHBondContact O-N 3.3Å |
| 319 | V | 90.3 | Very high | 90.2 | Very high | 70 Ų | 70 | 41.2 Ų | 41.2 | 42% | 0.424 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64.2 | -40.7 | 175.8 | -177.2 | 0 | 0 | 0 | 0 | 110.7 | L315 G316 T317 V321 C322 V323 F379 | L315-V319 WeakPolarHBondContact O-CG2 3.34Å; L315-V319 PolarHBondContact O-N 3.13Å; G316-V319 PolarHBondContact O-N 2.86Å; T317-V319 VanDerWaalsContact C-N 3.34Å; T317-V319 PolarHBondContact O-N 3.39Å; V319-V321 VanDerWaalsContact C-N 3.27Å; V319-V321 PolarHBondContact O-N 3.45Å; V319-C322 WeakPolarHBondContact O-CB 3.37Å; V319-C322 PolarHBondContact O-N 3.45Å; V319-V323 HydrophobicContact CG1-CG2 4.24Å; V319-V323 WeakPolarHBondContact O-CG2 3.49Å; V319-V323 PolarHBondContact O-N 3.23Å; V319-V323 VanDerWaalsContact O-N 3.14Å; V319-F379 HydrophobicContact CB-CE1 4.15Å; V319-F379 HydrophobicContact CG1-CE1 3.7Å; V319-F379 HydrophobicContact CG1-CZ 4.33Å |
| 320 | S | 88.5 | Confident | 90.3 | Very high | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.007 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -56.5 | -39.6 | 175.4 | -170 | 0 | 0 | 0 | 0 | 112 | G316 T317 I318 C322 V323 I324 S378 | G316-S320 VanDerWaalsContact O-CB 3.3Å; G316-S320 WeakPolarHBondContact O-CB 3.25Å; G316-S320 PolarHBondContact O-N 3.46Å; T317-S320 VanDerWaalsContact O-CB 3.31Å; T317-S320 WeakPolarHBondContact O-CB 3.28Å; T317-S320 PolarHBondContact O-N 3.27Å; I318-S320 VanDerWaalsContact C-N 3.32Å; I318-S320 PolarHBondContact O-N 3.4Å; S320-C322 VanDerWaalsContact C-N 3.3Å; S320-C322 PolarHBondContact O-N 3.2Å; S320-V323 PolarHBondContact O-N 2.97Å; S320-V323 VanDerWaalsContact O-N 3.14Å; S320-I324 WeakPolarHBondContact O-CB 3.36Å; S320-I324 PolarHBondContact O-N 2.89Å; S320-S378 WeakPolarHBondContact CB-O 3.07Å; S320-S378 PolarHBondContact OG-O 2.78Å |
| 321 | V | 84.2 | Confident | 90.3 | Very high | 55 Ų | 55 | 49 Ų | 49 | 33% | 0.333 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -53.9 | -46.6 | 173.1 | 176.6 | 0 | 0 | 0 | 0 | 111.5 | I152 T317 I318 V319 V323 | I152-V321 HydrophobicContact CB-CG2 4.27Å; I152-V321 HydrophobicContact CD1-CB 4.32Å; I152-V321 HydrophobicContact CD1-CG1 4.37Å; I152-V321 HydrophobicContact CD1-CG2 4.32Å; I152-V321 HydrophobicContact CG2-CB 4.34Å; I152-V321 HydrophobicContact CG2-CG2 3.31Å; T317-V321 WeakPolarHBondContact O-CG2 3.37Å; T317-V321 PolarHBondContact O-N 2.85Å; I318-V321 WeakPolarHBondContact O-CB 3.45Å; I318-V321 PolarHBondContact O-N 3.3Å; V319-V321 VanDerWaalsContact C-N 3.27Å; V319-V321 PolarHBondContact O-N 3.45Å; V321-V323 VanDerWaalsContact C-N 3.31Å; V321-V323 PolarHBondContact O-N 3.27Å |
| 322 | C | 84.3 | Confident | 90.2 | Very high | 79 Ų | 79 | 48.2 Ų | 48.2 | 53% | 0.534 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -71.8 | -25.6 | -177.7 | -60.8 | 0 | 0 | 0 | 0 | 113.4 | V319 S320 | V319-C322 WeakPolarHBondContact O-CB 3.37Å; V319-C322 PolarHBondContact O-N 3.45Å; S320-C322 VanDerWaalsContact C-N 3.3Å; S320-C322 PolarHBondContact O-N 3.2Å |
| 323 | V | 86.6 | Confident | 90.2 | Very high | 56 Ų | 56 | 46.6 Ų | 46.6 | 34% | 0.339 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -94.8 | -29.9 | -175.6 | -178.6 | 0 | 0 | 0 | 0 | 111.7 | V319 S320 V321 D325 R326 G327 L332 | V319-V323 HydrophobicContact CG1-CG2 4.24Å; V319-V323 WeakPolarHBondContact O-CG2 3.49Å; V319-V323 PolarHBondContact O-N 3.23Å; V319-V323 VanDerWaalsContact O-N 3.14Å; S320-V323 PolarHBondContact O-N 2.97Å; S320-V323 VanDerWaalsContact O-N 3.14Å; V321-V323 VanDerWaalsContact C-N 3.31Å; V321-V323 PolarHBondContact O-N 3.27Å; V323-D325 VanDerWaalsContact C-N 3.35Å; V323-D325 PolarHBondContact O-N 2.62Å; V323-R326 CarbonylContact O-C 3.57Å; V323-R326 WeakPolarHBondContact O-CA 3.16Å; V323-R326 PolarHBondContact O-N 2.82Å; V323-G327 PolarHBondContact O-N 3.36Å; V323-L332 HydrophobicContact CG1-CD2 3.94Å |
| 324 | I | 84.3 | Confident | 90.3 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -59.2 | -43.8 | -170.8 | -136.5 | 163.7 | 0 | 0 | 0 | 112.4 | I152 S320 R326 G327 R329 L332 V384 F387 | I152-I324 HydrophobicContact CD1-CB 3.84Å; I152-I324 HydrophobicContact CD1-CD1 3.92Å; I152-I324 HydrophobicContact CD1-CG1 4.47Å; I152-I324 HydrophobicContact CD1-CG2 3.15Å; I152-I324 HydrophobicContact CG1-CD1 3.71Å; I152-I324 HydrophobicContact CG1-CG2 4.06Å; S320-I324 WeakPolarHBondContact O-CB 3.36Å; S320-I324 PolarHBondContact O-N 2.89Å; I324-R326 PolarHBondContact O-N 3.06Å; I324-G327 VanDerWaalsContact O-O 3.1Å; I324-R329 PolarHBondContact O-NH1 3.38Å; I324-L332 HydrophobicContact CG1-CD1 3.83Å; I324-V384 HydrophobicContact CD1-CG2 4.24Å; I324-F387 HydrophobicContact CD1-CE1 3.51Å; I324-F387 HydrophobicContact CD1-CZ 3.75Å; I324-F387 HydrophobicContact CG1-CE1 4.44Å; I324-F387 HydrophobicContact CG1-CZ 4.2Å |
| 325 | D | 80.2 | Confident | 90.4 | Very high | 77 Ų | 77 | 50.5 Ų | 50.5 | 41% | 0.412 | 27% | 0.269 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74 | -12.3 | -176 | -70.9 | -24.9 | 0 | 0 | 0 | 111.3 | V323 K454 | V323-D325 VanDerWaalsContact C-N 3.35Å; V323-D325 PolarHBondContact O-N 2.62Å; D325-K454 WeakPolarHBondContact O-CE 3.34Å; D325-K454 PolarHBondContact O-NZ 3.39Å |
| 326 | R | 83.9 | Confident | 90.5 | Very high | 207 Ų | 207 | 45.3 Ų | 45.3 | 78% | 0.781 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -101.5 | -35.8 | 178.3 | -61.8 | 179.9 | -178.3 | 166.3 | 1 | 112.2 | V323 I324 K454 | V323-R326 CarbonylContact O-C 3.57Å; V323-R326 WeakPolarHBondContact O-CA 3.16Å; V323-R326 PolarHBondContact O-N 2.82Å; I324-R326 PolarHBondContact O-N 3.06Å; R326-K454 PolarHBondContact O-NZ 3.29Å |
| 327 | G | 85.2 | Confident | 90.7 | Very high | 17 Ų | 17 | 45.1 Ų | 45.1 | 18% | 0.175 | 24% | 0.24 | C | C | . | . | S | Bend | trans | -86.9 | 142 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | V323 I324 K454 | V323-G327 PolarHBondContact O-N 3.36Å; I324-G327 VanDerWaalsContact O-O 3.1Å; G327-K454 WeakPolarHBondContact O-CD 3.42Å |
| 328 | G | 90.9 | Very high | 91 | Very high | 17 Ų | 17 | 47.6 Ų | 47.6 | 18% | 0.175 | 26% | 0.257 | C | S | . | . | trans | -67.2 | 143 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | R330 M331 L332 E452 | G328-R330 VanDerWaalsContact C-N 3.32Å; G328-R330 PolarHBondContact O-N 3.07Å; G328-M331 PolarHBondContact O-N 2.95Å; G328-L332 VanDerWaalsContact O-CG 3.28Å; G328-L332 WeakPolarHBondContact O-CG 3.42Å; G328-L332 PolarHBondContact O-N 3.3Å; G328-E452 WeakPolarHBondContact CA-OE1 3.43Å; G328-E452 WeakPolarHBondContact CA-OE2 3.32Å | ||
| 329 | R | 91.7 | Very high | 91.3 | Very high | 11 Ų | 11 | 46.5 Ų | 46.5 | 4% | 0.042 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.5 | -41.2 | -173.5 | -52.4 | -39.5 | -174.9 | -169.7 | 11 | 111.8 | I324 M331 L332 L333 V384 F387 L388 E391 E452 T453 K454 | I324-R329 PolarHBondContact O-NH1 3.38Å; R329-M331 VanDerWaalsContact C-N 3.35Å; R329-L332 PolarHBondContact O-N 2.9Å; R329-L333 WeakPolarHBondContact O-CG 3.46Å; R329-L333 PolarHBondContact O-N 3.11Å; R329-V384 HydrophobicContact CB-CG1 4.09Å; R329-F387 HydrophobicContact CG-CE2 4.49Å; R329-L388 HydrophobicContact CB-CD1 4.29Å; R329-L388 HydrophobicContact CG-CD1 4.48Å; R329-E391 VanDerWaalsContact CG-OE2 3.32Å; R329-E391 WeakPolarHBondContact CG-OE2 3.49Å; R329-E391 IonicContact CZ-OE1 3.68Å; R329-E391 IonicContact NE-OE1 2.64Å; R329-E391 PolarHBondContact NE-OE1 3.22Å; R329-E391 IonicContact NE-OE2 3.21Å; R329-E391 PolarHBondContact NE-OE2 2.69Å; R329-E391 IonicContact NH2-OE1 3.71Å; R329-E391 PolarHBondContact NH2-OE1 3.21Å; R329-E452 VanDerWaalsContact N-CD 3.3Å; R329-E452 PolarHBondContact N-OE1 3.33Å; R329-E452 PolarHBondContact N-OE2 2.84Å; R329-T453 WeakPolarHBondContact CG-OG1 3.35Å; R329-K454 HydrophobicContact CG-CB 4.42Å |
| 330 | R | 95.3 | Very high | 91.6 | Very high | 44 Ų | 44 | 43.2 Ų | 43.2 | 17% | 0.166 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.7 | -45 | 177.7 | -176.9 | -172.1 | 178.6 | -170.9 | -3.5 | 110.6 | G328 L333 L334 I446 A447 L450 E452 | G328-R330 VanDerWaalsContact C-N 3.32Å; G328-R330 PolarHBondContact O-N 3.07Å; R330-L333 PolarHBondContact O-N 2.99Å; R330-L334 HydrophobicContact CG-CD1 4.03Å; R330-L334 WeakPolarHBondContact O-CB 3.37Å; R330-L334 VanDerWaalsContact O-CG 3.27Å; R330-L334 WeakPolarHBondContact O-CG 3.36Å; R330-L334 PolarHBondContact O-N 2.99Å; R330-I446 HydrophobicContact CG-CG2 4.33Å; R330-A447 PolarHBondContact NH2-O 3.3Å; R330-L450 HydrophobicContact CB-CD2 4.44Å; R330-L450 VanDerWaalsContact CD-O 3.23Å; R330-L450 WeakPolarHBondContact CD-O 3.47Å; R330-L450 PolarHBondContact NE-O 2.8Å; R330-E452 PolarHBondContact N-OE2 3.02Å |
| 331 | M | 95.1 | Very high | 92.1 | Very high | 118 Ų | 118 | 44.9 Ų | 44.9 | 58% | 0.581 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -65.1 | -45 | 179.4 | -173.7 | 62.2 | 76.9 | 0 | 0 | 111.7 | G328 R329 L333 L334 V335 | G328-M331 PolarHBondContact O-N 2.95Å; R329-M331 VanDerWaalsContact C-N 3.35Å; M331-L333 VanDerWaalsContact C-N 3.33Å; M331-L333 PolarHBondContact O-N 3.43Å; M331-L334 PolarHBondContact O-N 2.81Å; M331-V335 HydrophobicContact CG-CG2 4.24Å; M331-V335 WeakPolarHBondContact O-CB 3.44Å; M331-V335 WeakPolarHBondContact O-CG2 3.09Å; M331-V335 PolarHBondContact O-N 3.24Å; M331-V335 HydrophobicContact SD-CG2 3.98Å |
| 332 | L | 94.3 | Very high | 92.7 | Very high | 16 Ų | 16 | 45 Ų | 45 | 8% | 0.084 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.2 | -42.6 | 179 | -69.2 | 169.9 | 0 | 0 | 0 | 112.1 | V323 I324 G328 R329 G336 V384 | V323-L332 HydrophobicContact CG1-CD2 3.94Å; I324-L332 HydrophobicContact CG1-CD1 3.83Å; G328-L332 VanDerWaalsContact O-CG 3.28Å; G328-L332 WeakPolarHBondContact O-CG 3.42Å; G328-L332 PolarHBondContact O-N 3.3Å; R329-L332 PolarHBondContact O-N 2.9Å; L332-G336 PolarHBondContact O-N 3.47Å; L332-V384 HydrophobicContact CB-CG2 4.28Å; L332-V384 HydrophobicContact CD1-CG2 4.43Å |
| 333 | L | 96.7 | Very high | 93.3 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -66.5 | -45.6 | 175.6 | -73.6 | 169.6 | 0 | 0 | 0 | 112.1 | P272 R329 R330 M331 G336 F337 V384 P385 L388 I446 L450 | P272-L333 HydrophobicContact CB-CD1 4.1Å; P272-L333 HydrophobicContact CB-CD2 4.22Å; P272-L333 HydrophobicContact CG-CD1 3.92Å; R329-L333 WeakPolarHBondContact O-CG 3.46Å; R329-L333 PolarHBondContact O-N 3.11Å; R330-L333 PolarHBondContact O-N 2.99Å; M331-L333 VanDerWaalsContact C-N 3.33Å; M331-L333 PolarHBondContact O-N 3.43Å; L333-G336 PolarHBondContact O-N 3.48Å; L333-F337 HydrophobicContact CB-CD2 4.37Å; L333-F337 HydrophobicContact CB-CE2 4.45Å; L333-F337 HydrophobicContact CD2-CE2 3.88Å; L333-F337 WeakPolarHBondContact O-CB 3.43Å; L333-F337 WeakPolarHBondContact O-CD2 3.43Å; L333-F337 PolarHBondContact O-N 3.33Å; L333-V384 HydrophobicContact CD1-CB 4.48Å; L333-V384 HydrophobicContact CD1-CG1 3.75Å; L333-V384 HydrophobicContact CD2-CB 3.88Å; L333-V384 HydrophobicContact CD2-CG1 4.07Å; L333-V384 HydrophobicContact CG-CB 4.05Å; L333-V384 HydrophobicContact CG-CG1 3.79Å; L333-P385 HydrophobicContact CD2-CG 4.37Å; L333-L388 HydrophobicContact CD1-CD2 4.2Å; L333-I446 HydrophobicContact CB-CD1 4.15Å; L333-I446 HydrophobicContact CB-CG2 4.42Å; L333-L450 HydrophobicContact CD1-CD2 3.47Å; L333-L450 VanDerWaalsContact CD1-CD2 3.47Å |
| 334 | L | 97.8 | Very high | 93.7 | Very high | 33 Ų | 33 | 39 Ų | 39 | 17% | 0.173 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.5 | -47.2 | 179 | -74.8 | 172.4 | 0 | 0 | 0 | 111.9 | R330 M331 S338 I443 I446 A447 | R330-L334 HydrophobicContact CG-CD1 4.03Å; R330-L334 WeakPolarHBondContact O-CB 3.37Å; R330-L334 VanDerWaalsContact O-CG 3.27Å; R330-L334 WeakPolarHBondContact O-CG 3.36Å; R330-L334 PolarHBondContact O-N 2.99Å; M331-L334 PolarHBondContact O-N 2.81Å; L334-S338 WeakPolarHBondContact O-CB 3.25Å; L334-S338 PolarHBondContact O-N 3.33Å; L334-S338 PolarHBondContact O-OG 3.49Å; L334-I443 HydrophobicContact CD2-CG2 4.07Å; L334-I446 HydrophobicContact CD2-CB 4.06Å; L334-I446 HydrophobicContact CD2-CG2 3.68Å; L334-I446 HydrophobicContact CG-CG2 3.77Å; L334-A447 HydrophobicContact CD2-CB 4.05Å |
| 335 | V | 96.6 | Very high | 94.3 | Very high | 68 Ų | 68 | 40.6 Ų | 40.6 | 41% | 0.412 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.7 | -49.7 | 178.3 | 171.9 | 0 | 0 | 0 | 0 | 110.3 | M331 S338 I339 | M331-V335 HydrophobicContact CG-CG2 4.24Å; M331-V335 WeakPolarHBondContact O-CB 3.44Å; M331-V335 WeakPolarHBondContact O-CG2 3.09Å; M331-V335 PolarHBondContact O-N 3.24Å; M331-V335 HydrophobicContact SD-CG2 3.98Å; V335-S338 PolarHBondContact O-N 3.42Å; V335-I339 HydrophobicContact CG1-CD1 3.85Å; V335-I339 WeakPolarHBondContact O-CG1 3.43Å; V335-I339 PolarHBondContact O-N 3.44Å |
| 336 | G | 96.7 | Very high | 95 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62 | -47.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L332 L333 S338 I339 C340 G376 | L332-G336 PolarHBondContact O-N 3.47Å; L333-G336 PolarHBondContact O-N 3.48Å; G336-S338 VanDerWaalsContact C-N 3.33Å; G336-S338 PolarHBondContact O-N 3.17Å; G336-I339 PolarHBondContact O-N 2.84Å; G336-C340 PolarHBondContact O-N 2.86Å; G336-C340 PolarHBondContact O-SG 3.1Å; G336-G376 WeakPolarHBondContact CA-O 3.15Å |
| 337 | F | 98 | Very high | 95.5 | Very high | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -66 | -33.4 | 175.8 | -75.1 | -53.6 | 0 | 0 | 0 | 113 | G275 L333 C340 L341 P381 L439 V442 I443 I446 | G275-F337 WeakPolarHBondContact O-CE1 3.47Å; L333-F337 HydrophobicContact CB-CD2 4.37Å; L333-F337 HydrophobicContact CB-CE2 4.45Å; L333-F337 HydrophobicContact CD2-CE2 3.88Å; L333-F337 WeakPolarHBondContact O-CB 3.43Å; L333-F337 WeakPolarHBondContact O-CD2 3.43Å; L333-F337 PolarHBondContact O-N 3.33Å; F337-C340 WeakPolarHBondContact O-CB 3.48Å; F337-C340 PolarHBondContact O-N 3.36Å; F337-L341 WeakPolarHBondContact O-CB 3.43Å; F337-L341 PolarHBondContact O-N 2.87Å; F337-P381 HydrophobicContact CD1-CB 4Å; F337-P381 HydrophobicContact CD1-CG 3.55Å; F337-P381 HydrophobicContact CD2-CG 4.15Å; F337-P381 HydrophobicContact CE1-CB 3.53Å; F337-P381 HydrophobicContact CE1-CG 3.61Å; F337-P381 HydrophobicContact CE2-CB 4.46Å; F337-P381 HydrophobicContact CE2-CG 4.21Å; F337-P381 HydrophobicContact CG-CG 3.82Å; F337-P381 HydrophobicContact CZ-CB 3.79Å; F337-P381 HydrophobicContact CZ-CG 3.94Å; F337-L439 HydrophobicContact CB-CD2 4.47Å; F337-L439 HydrophobicContact CD1-CD2 3.54Å; F337-L439 HydrophobicContact CE1-CD2 4.18Å; F337-L439 HydrophobicContact CG-CD2 4.36Å; F337-V442 HydrophobicContact CD2-CG1 3.9Å; F337-V442 HydrophobicContact CE2-CG1 3.78Å; F337-V442 HydrophobicContact CG-CG1 4.34Å; F337-V442 HydrophobicContact CZ-CG1 4.12Å; F337-I443 HydrophobicContact CB-CD1 4.08Å; F337-I443 HydrophobicContact CB-CG1 3.65Å; F337-I446 HydrophobicContact CD2-CD1 3.57Å; F337-I446 HydrophobicContact CE2-CD1 3.51Å |
| 338 | S | 98.2 | Very high | 95.8 | Very high | 52 Ų | 52 | 29.9 Ų | 29.9 | 36% | 0.364 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -66.7 | -40.2 | 176 | -60.7 | 0 | 0 | 0 | 0 | 112 | L334 V335 G336 L341 A342 | L334-S338 WeakPolarHBondContact O-CB 3.25Å; L334-S338 PolarHBondContact O-N 3.33Å; L334-S338 PolarHBondContact O-OG 3.49Å; V335-S338 PolarHBondContact O-N 3.42Å; G336-S338 VanDerWaalsContact C-N 3.33Å; G336-S338 PolarHBondContact O-N 3.17Å; S338-L341 PolarHBondContact O-N 2.82Å; S338-A342 WeakPolarHBondContact O-CB 3.21Å; S338-A342 PolarHBondContact O-N 3.45Å |
| 339 | I | 97.8 | Very high | 95.9 | Very high | 56 Ų | 56 | 32.9 Ų | 32.9 | 29% | 0.287 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -63.6 | -44.1 | 173.2 | -64.7 | 165.6 | 0 | 0 | 0 | 109.9 | V335 G336 L341 A342 S343 L372 F379 | V335-I339 HydrophobicContact CG1-CD1 3.85Å; V335-I339 WeakPolarHBondContact O-CG1 3.43Å; V335-I339 PolarHBondContact O-N 3.44Å; G336-I339 PolarHBondContact O-N 2.84Å; I339-L341 VanDerWaalsContact C-N 3.33Å; I339-L341 PolarHBondContact O-N 2.99Å; I339-A342 PolarHBondContact O-N 3.2Å; I339-S343 VanDerWaalsContact O-CB 3.22Å; I339-S343 WeakPolarHBondContact O-CB 3.36Å; I339-S343 PolarHBondContact O-N 3.45Å; I339-S343 PolarHBondContact O-OG 3.45Å; I339-L372 WeakPolarHBondContact CG2-O 3.3Å; I339-F379 HydrophobicContact CD1-CD2 4.45Å |
| 340 | C | 97.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.6 | -45.2 | 175.3 | -69.1 | 0 | 0 | 0 | 0 | 112 | G336 F337 S343 L344 F373 F377 L439 | G336-C340 PolarHBondContact O-N 2.86Å; G336-C340 PolarHBondContact O-SG 3.1Å; F337-C340 WeakPolarHBondContact O-CB 3.48Å; F337-C340 PolarHBondContact O-N 3.36Å; C340-S343 PolarHBondContact O-N 3.35Å; C340-L344 WeakPolarHBondContact O-CB 3.28Å; C340-L344 PolarHBondContact O-N 3.17Å; C340-F373 HydrophobicContact CB-CD2 3.89Å; C340-F373 HydrophobicContact CB-CE2 3.81Å; C340-F377 PolarHBondContact SG-N 3.09Å; C340-F377 VanDerWaalsContact SG-N 3.44Å; C340-L439 HydrophobicContact CB-CD1 4.12Å; C340-L439 HydrophobicContact CB-CD2 4.4Å |
| 341 | L | 98 | Very high | 95.6 | Very high | 37 Ų | 37 | 31.6 Ų | 31.6 | 19% | 0.194 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.7 | -53.3 | 179.5 | 173.5 | 62.2 | 0 | 0 | 0 | 111.4 | F337 S338 I339 S343 L344 A345 I436 L439 I440 I443 | F337-L341 WeakPolarHBondContact O-CB 3.43Å; F337-L341 PolarHBondContact O-N 2.87Å; S338-L341 PolarHBondContact O-N 2.82Å; I339-L341 VanDerWaalsContact C-N 3.33Å; I339-L341 PolarHBondContact O-N 2.99Å; L341-S343 VanDerWaalsContact C-N 3.26Å; L341-S343 PolarHBondContact O-N 3.09Å; L341-L344 PolarHBondContact O-N 3.25Å; L341-A345 VanDerWaalsContact O-CB 3.31Å; L341-A345 WeakPolarHBondContact O-CB 3.27Å; L341-A345 PolarHBondContact O-N 2.88Å; L341-I436 HydrophobicContact CD1-CB 4.4Å; L341-I436 HydrophobicContact CD1-CG2 3.7Å; L341-L439 HydrophobicContact CB-CB 4.24Å; L341-L439 HydrophobicContact CB-CD1 4.34Å; L341-L439 HydrophobicContact CD1-CB 4.08Å; L341-I440 HydrophobicContact CD1-CD1 4.34Å; L341-I440 HydrophobicContact CD1-CG1 3.75Å; L341-I440 HydrophobicContact CD2-CG1 3.77Å; L341-I440 HydrophobicContact CG-CG1 4.44Å; L341-I443 HydrophobicContact CB-CD1 4.05Å; L341-I443 HydrophobicContact CD2-CD1 3.72Å |
| 342 | A | 98 | Very high | 95.3 | Very high | 57 Ų | 57 | 27.2 Ų | 27.2 | 47% | 0.471 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -60.2 | -39.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | S338 I339 T346 | S338-A342 WeakPolarHBondContact O-CB 3.21Å; S338-A342 PolarHBondContact O-N 3.45Å; I339-A342 PolarHBondContact O-N 3.2Å; A342-T346 VanDerWaalsContact O-CB 3.3Å; A342-T346 WeakPolarHBondContact O-CB 3.28Å; A342-T346 PolarHBondContact O-N 3.11Å; A342-T346 PolarHBondContact O-OG1 3.45Å |
| 343 | S | 96.9 | Very high | 95.2 | Very high | 8 Ų | 8 | 30.6 Ų | 30.6 | 6% | 0.056 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.1 | -47.7 | 179 | -55.6 | 0 | 0 | 0 | 0 | 111.6 | I339 C340 L341 A345 T346 F347 V369 F373 | I339-S343 VanDerWaalsContact O-CB 3.22Å; I339-S343 WeakPolarHBondContact O-CB 3.36Å; I339-S343 PolarHBondContact O-N 3.45Å; I339-S343 PolarHBondContact O-OG 3.45Å; C340-S343 PolarHBondContact O-N 3.35Å; L341-S343 VanDerWaalsContact C-N 3.26Å; L341-S343 PolarHBondContact O-N 3.09Å; S343-A345 PolarHBondContact O-N 3.28Å; S343-T346 PolarHBondContact O-N 3.22Å; S343-F347 VanDerWaalsContact O-CB 3.23Å; S343-F347 WeakPolarHBondContact O-CB 3.41Å; S343-F347 PolarHBondContact O-N 3.09Å; S343-V369 WeakPolarHBondContact O-CG1 3.12Å; S343-F373 PolarHBondContact OG-N 2.92Å |
| 344 | L | 94.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.5 | -38.6 | 178.2 | -77.6 | -170.6 | 0 | 0 | 0 | 113.2 | S279 C340 L341 F347 T348 F373 F432 F435 I436 L439 | S279-L344 WeakPolarHBondContact O-CD1 3.27Å; C340-L344 WeakPolarHBondContact O-CB 3.28Å; C340-L344 PolarHBondContact O-N 3.17Å; L341-L344 PolarHBondContact O-N 3.25Å; L344-F347 PolarHBondContact O-N 2.81Å; L344-T348 WeakPolarHBondContact O-CB 3.42Å; L344-T348 PolarHBondContact O-N 3.38Å; L344-T348 PolarHBondContact O-OG1 2.94Å; L344-F373 HydrophobicContact CD1-CD2 4.32Å; L344-F373 HydrophobicContact CD1-CE2 3.73Å; L344-F373 HydrophobicContact CD1-CZ 4.35Å; L344-F373 HydrophobicContact CD2-CD2 3.9Å; L344-F373 HydrophobicContact CD2-CE2 3.93Å; L344-F373 HydrophobicContact CD2-CG 4.35Å; L344-F373 HydrophobicContact CD2-CZ 4.4Å; L344-F373 HydrophobicContact CG-CD2 3.63Å; L344-F373 HydrophobicContact CG-CE2 3.56Å; L344-F373 HydrophobicContact CG-CZ 4.4Å; L344-F432 HydrophobicContact CD1-CD1 4.16Å; L344-F432 HydrophobicContact CD2-CD1 3.67Å; L344-F432 HydrophobicContact CD2-CE1 4.06Å; L344-F432 HydrophobicContact CD2-CG 4.17Å; L344-F435 HydrophobicContact CD1-CB 4.23Å; L344-I436 HydrophobicContact CB-CD1 4.31Å; L344-I436 HydrophobicContact CB-CG1 3.85Å; L344-L439 HydrophobicContact CD1-CD1 3.98Å |
| 345 | A | 96.4 | Very high | 94 | Very high | 35 Ų | 35 | 36.7 Ų | 36.7 | 29% | 0.289 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -59.8 | -50.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | L341 S343 F347 T348 T349 I436 | L341-A345 VanDerWaalsContact O-CB 3.31Å; L341-A345 WeakPolarHBondContact O-CB 3.27Å; L341-A345 PolarHBondContact O-N 2.88Å; S343-A345 PolarHBondContact O-N 3.28Å; A345-F347 PolarHBondContact O-N 2.98Å; A345-T348 PolarHBondContact O-N 3.29Å; A345-T349 PolarHBondContact O-N 3.33Å; A345-T349 PolarHBondContact O-OG1 3.03Å; A345-T349 VanDerWaalsContact O-OG1 3.04Å; A345-I436 HydrophobicContact CB-CD1 4.32Å |
| 346 | T | 95.8 | Very high | 93.4 | Very high | 65 Ų | 65 | 41.2 Ų | 41.2 | 40% | 0.399 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.1 | -44.4 | 177.5 | -54.7 | 0 | 0 | 0 | 0 | 111.4 | A342 S343 T348 T349 V350 V369 | A342-T346 VanDerWaalsContact O-CB 3.3Å; A342-T346 WeakPolarHBondContact O-CB 3.28Å; A342-T346 PolarHBondContact O-N 3.11Å; A342-T346 PolarHBondContact O-OG1 3.45Å; S343-T346 PolarHBondContact O-N 3.22Å; T346-T348 PolarHBondContact O-N 3.15Å; T346-T349 PolarHBondContact O-N 3.05Å; T346-V350 HydrophobicContact CG2-CG2 4.23Å; T346-V350 WeakPolarHBondContact O-CB 3.47Å; T346-V350 WeakPolarHBondContact O-CG2 3.23Å; T346-V350 PolarHBondContact O-N 3.3Å; T346-V369 HydrophobicContact CG2-CG1 4.29Å; T346-V369 HydrophobicContact CG2-CG2 3.81Å |
| 347 | F | 93.4 | Very high | 92.9 | Very high | 2 Ų | 2 | 43.8 Ų | 43.8 | 1% | 0.009 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -59.3 | -48.9 | 178.9 | -177.5 | -102.5 | 0 | 0 | 0 | 111.2 | L291 S343 L344 A345 T349 V350 L351 S366 V369 L370 F432 | L291-F347 HydrophobicContact CD1-CE1 4.21Å; L291-F347 HydrophobicContact CD1-CZ 4.14Å; L291-F347 HydrophobicContact CD2-CE1 4.05Å; L291-F347 HydrophobicContact CD2-CZ 3.79Å; L291-F347 HydrophobicContact CG-CE1 4.45Å; L291-F347 HydrophobicContact CG-CZ 4.01Å; S343-F347 VanDerWaalsContact O-CB 3.23Å; S343-F347 WeakPolarHBondContact O-CB 3.41Å; S343-F347 PolarHBondContact O-N 3.09Å; L344-F347 PolarHBondContact O-N 2.81Å; A345-F347 PolarHBondContact O-N 2.98Å; F347-T349 PolarHBondContact O-N 3.3Å; F347-V350 PolarHBondContact O-N 3.29Å; F347-L351 HydrophobicContact CD1-CD1 3.93Å; F347-L351 HydrophobicContact CD1-CG 4.29Å; F347-L351 HydrophobicContact CE1-CD1 3.35Å; F347-L351 HydrophobicContact CE1-CG 3.98Å; F347-L351 HydrophobicContact CE2-CD2 4.47Å; F347-L351 HydrophobicContact CZ-CD1 3.74Å; F347-L351 HydrophobicContact CZ-CD2 4.18Å; F347-L351 HydrophobicContact CZ-CG 4.08Å; F347-L351 WeakPolarHBondContact O-CG 3.2Å; F347-L351 PolarHBondContact O-N 3.23Å; F347-S366 WeakPolarHBondContact CD2-O 3.33Å; F347-V369 HydrophobicContact CB-CG1 3.89Å; F347-L370 HydrophobicContact CD1-CD2 4.48Å; F347-L370 HydrophobicContact CD2-CD1 4.09Å; F347-L370 HydrophobicContact CD2-CD2 4.04Å; F347-L370 HydrophobicContact CD2-CG 3.61Å; F347-L370 HydrophobicContact CE1-CD2 4.45Å; F347-L370 HydrophobicContact CE2-CD1 3.34Å; F347-L370 HydrophobicContact CE2-CD2 4.01Å; F347-L370 HydrophobicContact CE2-CG 3.42Å; F347-L370 VanDerWaalsContact CE2-CG 3.42Å; F347-L370 HydrophobicContact CG-CD2 4.28Å; F347-L370 HydrophobicContact CG-CG 4.34Å; F347-L370 HydrophobicContact CZ-CD1 3.66Å; F347-L370 HydrophobicContact CZ-CD2 4.24Å; F347-L370 HydrophobicContact CZ-CG 4.02Å; F347-F432 HydrophobicContact CD1-CD2 4.07Å; F347-F432 HydrophobicContact CD1-CE2 4.17Å; F347-F432 AromaticContact CE1-CD2 3.95Å; F347-F432 HydrophobicContact CE1-CD2 3.95Å; F347-F432 AromaticContact CE1-CE2 3.66Å; F347-F432 HydrophobicContact CE1-CE2 3.66Å; F347-F432 HydrophobicContact CE1-CZ 4.41Å |
| 348 | T | 92.3 | Very high | 92 | Very high | 9 Ų | 9 | 51.5 Ų | 51.5 | 6% | 0.055 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61 | -43.8 | 178.2 | -55.8 | 0 | 0 | 0 | 0 | 111.4 | L344 A345 T346 L351 S352 F430 V433 | L344-T348 WeakPolarHBondContact O-CB 3.42Å; L344-T348 PolarHBondContact O-N 3.38Å; L344-T348 PolarHBondContact O-OG1 2.94Å; A345-T348 PolarHBondContact O-N 3.29Å; T346-T348 PolarHBondContact O-N 3.15Å; T348-L351 PolarHBondContact O-N 3.34Å; T348-S352 WeakPolarHBondContact O-CB 3.05Å; T348-S352 PolarHBondContact O-N 3.27Å; T348-F430 HydrophobicContact CG2-CD1 4.34Å; T348-V433 HydrophobicContact CG2-CG2 3.94Å |
| 349 | T | 93.2 | Very high | 91.3 | Very high | 79 Ų | 79 | 51.2 Ų | 51.2 | 49% | 0.485 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 176.4 | -60.1 | 0 | 0 | 0 | 0 | 111.9 | A345 T346 F347 S352 I353 | A345-T349 PolarHBondContact O-N 3.33Å; A345-T349 PolarHBondContact O-OG1 3.03Å; A345-T349 VanDerWaalsContact O-OG1 3.04Å; T346-T349 PolarHBondContact O-N 3.05Å; F347-T349 PolarHBondContact O-N 3.3Å; T349-S352 PolarHBondContact O-N 3.45Å; T349-I353 HydrophobicContact CG2-CD1 3.88Å; T349-I353 HydrophobicContact CG2-CG1 4.47Å; T349-I353 WeakPolarHBondContact O-CG1 3.44Å; T349-I353 PolarHBondContact O-N 3.41Å |
| 350 | V | 92 | Very high | 90.6 | Very high | 13 Ų | 13 | 53 Ų | 53 | 8% | 0.079 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 178.6 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | T346 F347 S352 I353 R354 L362 I365 S366 | T346-V350 HydrophobicContact CG2-CG2 4.23Å; T346-V350 WeakPolarHBondContact O-CB 3.47Å; T346-V350 WeakPolarHBondContact O-CG2 3.23Å; T346-V350 PolarHBondContact O-N 3.3Å; F347-V350 PolarHBondContact O-N 3.29Å; V350-S352 VanDerWaalsContact C-N 3.34Å; V350-S352 PolarHBondContact O-N 2.84Å; V350-I353 PolarHBondContact O-N 3.38Å; V350-R354 VanDerWaalsContact O-CB 3.29Å; V350-R354 WeakPolarHBondContact O-CB 3.37Å; V350-R354 PolarHBondContact O-N 2.57Å; V350-L362 HydrophobicContact CG1-CB 3.98Å; V350-L362 HydrophobicContact CG1-CD2 4.22Å; V350-L362 WeakPolarHBondContact CG1-O 3.1Å; V350-I365 HydrophobicContact CG1-CB 4.44Å; V350-I365 HydrophobicContact CG1-CG2 4.36Å; V350-I365 HydrophobicContact CG2-CG2 3.81Å; V350-S366 VanDerWaalsContact CG1-OG 3.27Å; V350-S366 WeakPolarHBondContact CG1-OG 3.41Å |
| 351 | L | 88.4 | Confident | 90.1 | Very high | 15 Ų | 15 | 59.9 Ų | 59.9 | 8% | 0.079 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -61 | -43.5 | 175.1 | -70.3 | -170 | 0 | 0 | 0 | 112.1 | V295 F347 T348 R354 K355 C429 | V295-L351 HydrophobicContact CG1-CD2 3.17Å; F347-L351 HydrophobicContact CD1-CD1 3.93Å; F347-L351 HydrophobicContact CD1-CG 4.29Å; F347-L351 HydrophobicContact CE1-CD1 3.35Å; F347-L351 HydrophobicContact CE1-CG 3.98Å; F347-L351 HydrophobicContact CE2-CD2 4.47Å; F347-L351 HydrophobicContact CZ-CD1 3.74Å; F347-L351 HydrophobicContact CZ-CD2 4.18Å; F347-L351 HydrophobicContact CZ-CG 4.08Å; F347-L351 WeakPolarHBondContact O-CG 3.2Å; F347-L351 PolarHBondContact O-N 3.23Å; T348-L351 PolarHBondContact O-N 3.34Å; L351-R354 PolarHBondContact O-N 3.14Å; L351-K355 PolarHBondContact O-N 3.15Å; L351-C429 HydrophobicContact CB-CB 3.72Å; L351-C429 HydrophobicContact CD1-CB 4.38Å |
| 352 | S | 89.3 | Confident | 89.7 | Confident | 27 Ų | 27 | 58.5 Ų | 58.5 | 19% | 0.189 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.5 | -50.1 | 177.3 | -177.6 | 0 | 0 | 0 | 0 | 111.3 | T348 T349 V350 R354 K355 F356 | T348-S352 WeakPolarHBondContact O-CB 3.05Å; T348-S352 PolarHBondContact O-N 3.27Å; T349-S352 PolarHBondContact O-N 3.45Å; V350-S352 VanDerWaalsContact C-N 3.34Å; V350-S352 PolarHBondContact O-N 2.84Å; S352-R354 PolarHBondContact O-N 3.29Å; S352-K355 WeakPolarHBondContact O-CB 3.47Å; S352-K355 PolarHBondContact O-N 3.33Å; S352-F356 WeakPolarHBondContact O-CD2 3.12Å |
| 353 | I | 90.7 | Very high | 89.3 | Confident | 87 Ų | 87 | 56.4 Ų | 56.4 | 45% | 0.446 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.9 | -47 | 177.9 | -65.7 | 167.9 | 0 | 0 | 0 | 110.7 | T349 V350 K355 F356 S357 L362 | T349-I353 HydrophobicContact CG2-CD1 3.88Å; T349-I353 HydrophobicContact CG2-CG1 4.47Å; T349-I353 WeakPolarHBondContact O-CG1 3.44Å; T349-I353 PolarHBondContact O-N 3.41Å; V350-I353 PolarHBondContact O-N 3.38Å; I353-K355 VanDerWaalsContact C-N 3.25Å; I353-K355 PolarHBondContact O-N 3.17Å; I353-F356 PolarHBondContact O-N 3.17Å; I353-S357 WeakPolarHBondContact O-CB 2.96Å; I353-S357 PolarHBondContact O-N 3.3Å; I353-S357 PolarHBondContact O-OG 3.48Å; I353-L362 HydrophobicContact CB-CD1 4.4Å; I353-L362 HydrophobicContact CG2-CD1 3.85Å |
| 354 | R | 86.1 | Confident | 89.1 | Confident | 58 Ų | 58 | 63.9 Ų | 63.9 | 22% | 0.219 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -58.8 | -38 | -179.6 | -177.5 | -175.7 | 167.3 | -78 | -6.9 | 112.1 | S294 V295 V350 L351 S352 F356 S357 H358 L362 T363 | S294-R354 PolarHBondContact O-NH1 3.34Å; V295-R354 PolarHBondContact O-NE 3.31Å; V295-R354 PolarHBondContact O-NH2 2.84Å; V350-R354 VanDerWaalsContact O-CB 3.29Å; V350-R354 WeakPolarHBondContact O-CB 3.37Å; V350-R354 PolarHBondContact O-N 2.57Å; L351-R354 PolarHBondContact O-N 3.14Å; S352-R354 PolarHBondContact O-N 3.29Å; R354-F356 PolarHBondContact O-N 2.97Å; R354-S357 PolarHBondContact O-N 2.92Å; R354-H358 WeakPolarHBondContact O-CA 3.25Å; R354-H358 PolarHBondContact O-N 3.36Å; R354-L362 HydrophobicContact CB-CB 4.11Å; R354-L362 HydrophobicContact CB-CD1 3.75Å; R354-L362 HydrophobicContact CG-CB 4.31Å; R354-L362 HydrophobicContact CG-CD1 4.4Å; R354-T363 PolarHBondContact NE-OG1 3.35Å |
| 355 | K | 83.2 | Confident | 89 | Confident | 103 Ų | 103 | 66.5 Ų | 66.5 | 45% | 0.448 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -58.9 | -31.5 | 177.7 | -175.2 | 172.6 | 179.9 | 166.6 | 0 | 112.4 | L351 S352 I353 D428 | L351-K355 PolarHBondContact O-N 3.15Å; S352-K355 WeakPolarHBondContact O-CB 3.47Å; S352-K355 PolarHBondContact O-N 3.33Å; I353-K355 VanDerWaalsContact C-N 3.25Å; I353-K355 PolarHBondContact O-N 3.17Å; K355-D428 IonicContact NZ-OD2 2.95Å; K355-D428 PolarHBondContact NZ-OD2 2.96Å |
| 356 | F | 85.1 | Confident | 88.8 | Confident | 163 Ų | 163 | 64.9 Ų | 64.9 | 72% | 0.715 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -94 | -38 | 177.8 | -63.9 | -74.6 | 0 | 0 | 0 | 113.4 | S352 I353 R354 | S352-F356 WeakPolarHBondContact O-CD2 3.12Å; I353-F356 PolarHBondContact O-N 3.17Å; R354-F356 PolarHBondContact O-N 2.97Å |
| 357 | S | 86.5 | Confident | 88.7 | Confident | 53 Ų | 53 | 62.6 Ų | 62.6 | 37% | 0.371 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -91.4 | -12.1 | -171.9 | 75.8 | 0 | 0 | 0 | 0 | 114.2 | I353 R354 T359 | I353-S357 WeakPolarHBondContact O-CB 2.96Å; I353-S357 PolarHBondContact O-N 3.3Å; I353-S357 PolarHBondContact O-OG 3.48Å; R354-S357 PolarHBondContact O-N 2.92Å; S357-T359 VanDerWaalsContact CB-OG1 3.22Å; S357-T359 WeakPolarHBondContact CB-OG1 3.32Å; S357-T359 PolarHBondContact O-N 2.91Å; S357-T359 PolarHBondContact O-OG1 3.21Å; S357-T359 PolarHBondContact OG-OG1 2.73Å |
| 358 | H | 77.9 | Confident | 88.8 | Confident | 162 Ų | 162 | 67.6 Ų | 67.6 | 75% | 0.75 | 33% | 0.334 | S | S | * | . | trans | 48.6 | 28.1 | -175.8 | -64.7 | -80.6 | 0 | 0 | 0 | 114.3 | R354 | R354-H358 WeakPolarHBondContact O-CA 3.25Å; R354-H358 PolarHBondContact O-N 3.36Å | ||
| 359 | T | 83.5 | Confident | 89 | Confident | 46 Ų | 46 | 67.7 Ų | 67.7 | 28% | 0.282 | 34% | 0.335 | S | S | . | . | trans | -88.3 | 124.4 | -170.4 | -35 | 0 | 0 | 0 | 0 | 111.9 | S357 W361 L362 | S357-T359 VanDerWaalsContact CB-OG1 3.22Å; S357-T359 WeakPolarHBondContact CB-OG1 3.32Å; S357-T359 PolarHBondContact O-N 2.91Å; S357-T359 PolarHBondContact O-OG1 3.21Å; S357-T359 PolarHBondContact OG-OG1 2.73Å; T359-W361 HydrophobicContact CG2-CG 4.38Å; T359-W361 PolarHBondContact O-N 3.46Å; T359-L362 PolarHBondContact O-N 3.18Å | ||
| 360 | S | 82.8 | Confident | 89 | Confident | 93 Ų | 93 | 64 Ų | 64 | 65% | 0.65 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67 | -34.2 | -171.9 | 52.8 | 0 | 0 | 0 | 0 | 114.7 | L362 T363 | S360-L362 PolarHBondContact O-N 2.96Å; S360-T363 WeakPolarHBondContact O-CB 3.41Å; S360-T363 PolarHBondContact O-N 3Å |
| 361 | W | 87.2 | Confident | 89.2 | Confident | 145 Ų | 145 | 66 Ų | 66 | 55% | 0.549 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66.6 | -22.5 | -177.8 | 67.2 | -93.1 | 0 | 0 | 0 | 113.6 | T359 T363 Y364 I365 | T359-W361 HydrophobicContact CG2-CG 4.38Å; T359-W361 PolarHBondContact O-N 3.46Å; W361-T363 PolarHBondContact O-N 3.49Å; W361-Y364 PolarHBondContact O-N 3.17Å; W361-Y364 VanDerWaalsContact O-N 3.15Å; W361-I365 HydrophobicContact CE3-CD1 3.55Å; W361-I365 HydrophobicContact CE3-CG1 4.13Å; W361-I365 HydrophobicContact CH2-CD1 4.26Å; W361-I365 HydrophobicContact CZ3-CD1 3.17Å; W361-I365 HydrophobicContact CZ3-CG1 4.22Å |
| 362 | L | 89.9 | Confident | 89.6 | Confident | 8 Ų | 8 | 69.6 Ų | 69.6 | 4% | 0.042 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.1 | -27.6 | 176.5 | -67.2 | 174.6 | 0 | 0 | 0 | 112.1 | V350 I353 R354 T359 S360 Y364 I365 S366 | V350-L362 HydrophobicContact CG1-CB 3.98Å; V350-L362 HydrophobicContact CG1-CD2 4.22Å; V350-L362 WeakPolarHBondContact CG1-O 3.1Å; I353-L362 HydrophobicContact CB-CD1 4.4Å; I353-L362 HydrophobicContact CG2-CD1 3.85Å; R354-L362 HydrophobicContact CB-CB 4.11Å; R354-L362 HydrophobicContact CB-CD1 3.75Å; R354-L362 HydrophobicContact CG-CB 4.31Å; R354-L362 HydrophobicContact CG-CD1 4.4Å; T359-L362 PolarHBondContact O-N 3.18Å; S360-L362 PolarHBondContact O-N 2.96Å; L362-Y364 VanDerWaalsContact C-N 3.32Å; L362-Y364 PolarHBondContact O-N 2.92Å; L362-I365 PolarHBondContact O-N 3.17Å; L362-S366 PolarHBondContact O-N 2.82Å; L362-S366 PolarHBondContact O-OG 2.84Å |
| 363 | T | 90.2 | Very high | 89.9 | Confident | 13 Ų | 13 | 68.4 Ų | 68.4 | 8% | 0.08 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -60.6 | -40.7 | 174.5 | -61.6 | 0 | 0 | 0 | 0 | 111.5 | V295 L297 R354 S360 W361 I365 S366 I367 | V295-T363 HydrophobicContact CB-CG2 4.26Å; V295-T363 HydrophobicContact CG2-CG2 3.78Å; V295-T363 PolarHBondContact O-OG1 3.04Å; L297-T363 HydrophobicContact CD1-CG2 4.23Å; L297-T363 HydrophobicContact CD2-CG2 3.81Å; L297-T363 HydrophobicContact CG-CG2 3.84Å; R354-T363 PolarHBondContact NE-OG1 3.35Å; S360-T363 WeakPolarHBondContact O-CB 3.41Å; S360-T363 PolarHBondContact O-N 3Å; W361-T363 PolarHBondContact O-N 3.49Å; T363-I365 VanDerWaalsContact C-N 3.33Å; T363-I365 PolarHBondContact O-N 3.33Å; T363-S366 WeakPolarHBondContact O-CB 3.5Å; T363-S366 PolarHBondContact O-N 3.45Å; T363-I367 HydrophobicContact CG2-CD1 4.43Å; T363-I367 WeakPolarHBondContact O-CG1 3.36Å; T363-I367 PolarHBondContact O-N 3.02Å; T363-I367 VanDerWaalsContact O-N 3.12Å |
| 364 | Y | 92 | Very high | 90.2 | Very high | 166 Ų | 166 | 64.2 Ų | 64.2 | 65% | 0.651 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -67.7 | -34.1 | 177.4 | -59.6 | -66.8 | 0 | 0 | 0 | 112.4 | W361 L362 I367 L368 | W361-Y364 PolarHBondContact O-N 3.17Å; W361-Y364 VanDerWaalsContact O-N 3.15Å; L362-Y364 VanDerWaalsContact C-N 3.32Å; L362-Y364 PolarHBondContact O-N 2.92Å; Y364-I367 PolarHBondContact O-N 3.34Å; Y364-L368 PolarHBondContact O-N 3.29Å |
| 365 | I | 93.7 | Very high | 90.6 | Very high | 55 Ų | 55 | 62.9 Ų | 62.9 | 28% | 0.282 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -67.5 | -44.3 | 174.1 | -64.1 | -166.1 | 0 | 0 | 0 | 110.9 | V350 W361 L362 T363 I367 L368 V369 | V350-I365 HydrophobicContact CG1-CB 4.44Å; V350-I365 HydrophobicContact CG1-CG2 4.36Å; V350-I365 HydrophobicContact CG2-CG2 3.81Å; W361-I365 HydrophobicContact CE3-CD1 3.55Å; W361-I365 HydrophobicContact CE3-CG1 4.13Å; W361-I365 HydrophobicContact CH2-CD1 4.26Å; W361-I365 HydrophobicContact CZ3-CD1 3.17Å; W361-I365 HydrophobicContact CZ3-CG1 4.22Å; L362-I365 PolarHBondContact O-N 3.17Å; T363-I365 VanDerWaalsContact C-N 3.33Å; T363-I365 PolarHBondContact O-N 3.33Å; I365-I367 PolarHBondContact O-N 3.41Å; I365-L368 PolarHBondContact O-N 2.96Å; I365-V369 HydrophobicContact CG2-CG2 3.93Å; I365-V369 WeakPolarHBondContact O-CB 3.21Å; I365-V369 VanDerWaalsContact O-CG2 3.22Å; I365-V369 WeakPolarHBondContact O-CG2 3.36Å; I365-V369 PolarHBondContact O-N 3.26Å |
| 366 | S | 91.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -53.8 | -42.1 | 174.4 | -70.2 | 0 | 0 | 0 | 0 | 111.9 | F347 V350 L362 T363 L370 | F347-S366 WeakPolarHBondContact CD2-O 3.33Å; V350-S366 VanDerWaalsContact CG1-OG 3.27Å; V350-S366 WeakPolarHBondContact CG1-OG 3.41Å; L362-S366 PolarHBondContact O-N 2.82Å; L362-S366 PolarHBondContact O-OG 2.84Å; T363-S366 WeakPolarHBondContact O-CB 3.5Å; T363-S366 PolarHBondContact O-N 3.45Å; S366-L370 WeakPolarHBondContact O-CG 3.45Å; S366-L370 PolarHBondContact O-N 3.08Å |
| 367 | I | 93.8 | Very high | 91.7 | Very high | 18 Ų | 18 | 50.7 Ų | 50.7 | 9% | 0.092 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64 | -53 | 176 | -63.8 | 164.8 | 0 | 0 | 0 | 111.4 | F292 L297 V305 T363 Y364 I365 V369 L370 Y371 | F292-I367 HydrophobicContact CD1-CG1 4.23Å; F292-I367 HydrophobicContact CE1-CG1 3.86Å; L297-I367 HydrophobicContact CD1-CD1 3.97Å; V305-I367 HydrophobicContact CG1-CB 4.36Å; V305-I367 HydrophobicContact CG1-CD1 4.03Å; V305-I367 HydrophobicContact CG1-CG1 3.77Å; V305-I367 HydrophobicContact CG1-CG2 3.72Å; V305-I367 HydrophobicContact CG2-CD1 4Å; T363-I367 HydrophobicContact CG2-CD1 4.43Å; T363-I367 WeakPolarHBondContact O-CG1 3.36Å; T363-I367 PolarHBondContact O-N 3.02Å; T363-I367 VanDerWaalsContact O-N 3.12Å; Y364-I367 PolarHBondContact O-N 3.34Å; I365-I367 PolarHBondContact O-N 3.41Å; I367-V369 VanDerWaalsContact C-N 3.28Å; I367-V369 PolarHBondContact O-N 2.94Å; I367-L370 PolarHBondContact O-N 3.17Å; I367-L370 VanDerWaalsContact O-N 3.15Å; I367-Y371 HydrophobicContact CG2-CD2 4.2Å; I367-Y371 HydrophobicContact CG2-CE1 4.04Å; I367-Y371 HydrophobicContact CG2-CE2 3.67Å; I367-Y371 PolarHBondContact O-N 3.33Å |
| 368 | L | 95.5 | Very high | 92 | Very high | 106 Ų | 106 | 48.2 Ų | 48.2 | 56% | 0.555 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -58.1 | -42.6 | -178.6 | -179.4 | 66.2 | 0 | 0 | 0 | 111.6 | Y364 I365 Y371 L372 | Y364-L368 PolarHBondContact O-N 3.29Å; I365-L368 PolarHBondContact O-N 2.96Å; L368-Y371 WeakPolarHBondContact O-CB 3.37Å; L368-Y371 PolarHBondContact O-N 2.87Å; L368-L372 WeakPolarHBondContact O-CG 3.36Å; L368-L372 PolarHBondContact O-N 3.43Å |
| 369 | V | 95.5 | Very high | 92.5 | Very high | 12 Ų | 12 | 43.1 Ų | 43.1 | 7% | 0.073 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -68.2 | -37 | 179.2 | 174.5 | 0 | 0 | 0 | 0 | 111.5 | S343 T346 F347 I365 I367 Y371 L372 F373 | S343-V369 WeakPolarHBondContact O-CG1 3.12Å; T346-V369 HydrophobicContact CG2-CG1 4.29Å; T346-V369 HydrophobicContact CG2-CG2 3.81Å; F347-V369 HydrophobicContact CB-CG1 3.89Å; I365-V369 HydrophobicContact CG2-CG2 3.93Å; I365-V369 WeakPolarHBondContact O-CB 3.21Å; I365-V369 VanDerWaalsContact O-CG2 3.22Å; I365-V369 WeakPolarHBondContact O-CG2 3.36Å; I365-V369 PolarHBondContact O-N 3.26Å; I367-V369 VanDerWaalsContact C-N 3.28Å; I367-V369 PolarHBondContact O-N 2.94Å; V369-Y371 VanDerWaalsContact C-N 3.32Å; V369-Y371 PolarHBondContact O-N 3.46Å; V369-L372 PolarHBondContact O-N 2.92Å; V369-F373 PolarHBondContact O-N 2.87Å |
| 370 | L | 94.1 | Very high | 92.8 | Very high | 1 Ų | 1 | 40.9 Ų | 40.9 | 1% | 0.005 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.2 | -34.1 | 171.9 | -80.2 | 176.9 | 0 | 0 | 0 | 112.6 | V284 L291 F292 F347 S366 I367 F373 V374 | V284-L370 HydrophobicContact CG2-CD2 3.97Å; L291-L370 HydrophobicContact CD2-CD1 4.06Å; F292-L370 HydrophobicContact CE1-CD1 3.52Å; F292-L370 HydrophobicContact CZ-CD1 3.53Å; F347-L370 HydrophobicContact CD1-CD2 4.48Å; F347-L370 HydrophobicContact CD2-CD1 4.09Å; F347-L370 HydrophobicContact CD2-CD2 4.04Å; F347-L370 HydrophobicContact CD2-CG 3.61Å; F347-L370 HydrophobicContact CE1-CD2 4.45Å; F347-L370 HydrophobicContact CE2-CD1 3.34Å; F347-L370 HydrophobicContact CE2-CD2 4.01Å; F347-L370 HydrophobicContact CE2-CG 3.42Å; F347-L370 VanDerWaalsContact CE2-CG 3.42Å; F347-L370 HydrophobicContact CG-CD2 4.28Å; F347-L370 HydrophobicContact CG-CG 4.34Å; F347-L370 HydrophobicContact CZ-CD1 3.66Å; F347-L370 HydrophobicContact CZ-CD2 4.24Å; F347-L370 HydrophobicContact CZ-CG 4.02Å; S366-L370 WeakPolarHBondContact O-CG 3.45Å; S366-L370 PolarHBondContact O-N 3.08Å; I367-L370 PolarHBondContact O-N 3.17Å; I367-L370 VanDerWaalsContact O-N 3.15Å; L370-F373 WeakPolarHBondContact O-CB 3.49Å; L370-F373 PolarHBondContact O-N 2.91Å; L370-V374 PolarHBondContact O-N 3.31Å |
| 371 | Y | 96.1 | Very high | 93.3 | Very high | 55 Ų | 55 | 36.5 Ų | 36.5 | 22% | 0.216 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.7 | -41 | 172.4 | -67.7 | -7.9 | 0 | 0 | 0 | 111.7 | V305 G308 V309 V312 I367 L368 V369 F373 V374 S375 | V305-Y371 PolarHBondContact O-OH 2.97Å; G308-Y371 WeakPolarHBondContact CA-OH 3.28Å; V309-Y371 HydrophobicContact CB-CE1 4.34Å; V309-Y371 HydrophobicContact CG2-CD1 4.02Å; V309-Y371 HydrophobicContact CG2-CE1 3.62Å; V312-Y371 WeakPolarHBondContact CG1-O 3.41Å; V312-Y371 HydrophobicContact CG2-CD1 4.42Å; V312-Y371 HydrophobicContact CG2-CD2 4.25Å; V312-Y371 HydrophobicContact CG2-CG 4.04Å; I367-Y371 HydrophobicContact CG2-CD2 4.2Å; I367-Y371 HydrophobicContact CG2-CE1 4.04Å; I367-Y371 HydrophobicContact CG2-CE2 3.67Å; I367-Y371 PolarHBondContact O-N 3.33Å; L368-Y371 WeakPolarHBondContact O-CB 3.37Å; L368-Y371 PolarHBondContact O-N 2.87Å; V369-Y371 VanDerWaalsContact C-N 3.32Å; V369-Y371 PolarHBondContact O-N 3.46Å; Y371-F373 VanDerWaalsContact C-N 3.34Å; Y371-F373 PolarHBondContact O-N 3.5Å; Y371-V374 WeakPolarHBondContact O-CG2 3.49Å; Y371-V374 PolarHBondContact O-N 3.44Å; Y371-S375 WeakPolarHBondContact O-CB 3.39Å; Y371-S375 PolarHBondContact O-N 3.1Å |
| 372 | L | 96.6 | Very high | 93.4 | Very high | 91 Ų | 91 | 29.6 Ų | 29.6 | 48% | 0.476 | 14% | 0.142 | S | C | . | . | H | α-helix | trans | -62.5 | -40.5 | 172.1 | -70.3 | 173 | 0 | 0 | 0 | 112 | I339 L368 V369 S375 G376 | I339-L372 WeakPolarHBondContact CG2-O 3.3Å; L368-L372 WeakPolarHBondContact O-CG 3.36Å; L368-L372 PolarHBondContact O-N 3.43Å; V369-L372 PolarHBondContact O-N 2.92Å; L372-S375 PolarHBondContact O-N 3.06Å; L372-G376 PolarHBondContact O-N 2.82Å |
| 373 | F | 96.7 | Very high | 93.3 | Very high | 1 Ų | 1 | 29.3 Ų | 29.3 | 0% | 0.004 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -57.5 | -53.3 | 176 | 170.1 | -102.4 | 0 | 0 | 0 | 111.8 | I281 V284 C340 S343 L344 V369 L370 Y371 S375 G376 F377 | I281-F373 HydrophobicContact CB-CE1 4.33Å; I281-F373 HydrophobicContact CB-CZ 4.25Å; I281-F373 HydrophobicContact CD1-CD1 4.47Å; I281-F373 HydrophobicContact CD1-CE1 3.69Å; I281-F373 HydrophobicContact CD1-CZ 4.37Å; V284-F373 HydrophobicContact CB-CE1 4.38Å; V284-F373 HydrophobicContact CG2-CD1 4.18Å; V284-F373 HydrophobicContact CG2-CE1 3.81Å; C340-F373 HydrophobicContact CB-CD2 3.89Å; C340-F373 HydrophobicContact CB-CE2 3.81Å; S343-F373 PolarHBondContact OG-N 2.92Å; L344-F373 HydrophobicContact CD1-CD2 4.32Å; L344-F373 HydrophobicContact CD1-CE2 3.73Å; L344-F373 HydrophobicContact CD1-CZ 4.35Å; L344-F373 HydrophobicContact CD2-CD2 3.9Å; L344-F373 HydrophobicContact CD2-CE2 3.93Å; L344-F373 HydrophobicContact CD2-CG 4.35Å; L344-F373 HydrophobicContact CD2-CZ 4.4Å; L344-F373 HydrophobicContact CG-CD2 3.63Å; L344-F373 HydrophobicContact CG-CE2 3.56Å; L344-F373 HydrophobicContact CG-CZ 4.4Å; V369-F373 PolarHBondContact O-N 2.87Å; L370-F373 WeakPolarHBondContact O-CB 3.49Å; L370-F373 PolarHBondContact O-N 2.91Å; Y371-F373 VanDerWaalsContact C-N 3.34Å; Y371-F373 PolarHBondContact O-N 3.5Å; F373-S375 VanDerWaalsContact C-N 3.32Å; F373-S375 PolarHBondContact O-N 3.11Å; F373-G376 PolarHBondContact O-N 3.01Å; F373-F377 PolarHBondContact O-N 3.46Å |
| 374 | V | 95.7 | Very high | 93.2 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -69.8 | -30 | -179 | -60.1 | 0 | 0 | 0 | 0 | 112.6 | I281 V284 V309 V312 I313 L370 Y371 F377 S378 | I281-V374 HydrophobicContact CD1-CG1 3.94Å; V284-V374 HydrophobicContact CG1-CG1 4.43Å; V309-V374 HydrophobicContact CG1-CB 4.36Å; V309-V374 HydrophobicContact CG1-CG1 3.62Å; V309-V374 HydrophobicContact CG1-CG2 4.09Å; V312-V374 HydrophobicContact CB-CG2 4.06Å; V312-V374 HydrophobicContact CG1-CG2 3.8Å; I313-V374 HydrophobicContact CB-CB 4.43Å; L370-V374 PolarHBondContact O-N 3.31Å; Y371-V374 WeakPolarHBondContact O-CG2 3.49Å; Y371-V374 PolarHBondContact O-N 3.44Å; V374-F377 PolarHBondContact O-N 3.29Å; V374-S378 PolarHBondContact O-N 3.19Å; V374-S378 VanDerWaalsContact O-N 3.08Å; V374-S378 PolarHBondContact O-OG 2.82Å |
| 375 | S | 95 | Very high | 93.2 | Very high | 29 Ų | 29 | 20.8 Ų | 20.8 | 20% | 0.203 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -64.1 | -47 | 171.5 | -177.3 | 0 | 0 | 0 | 0 | 111.5 | Y371 L372 F373 F377 S378 F379 | Y371-S375 WeakPolarHBondContact O-CB 3.39Å; Y371-S375 PolarHBondContact O-N 3.1Å; L372-S375 PolarHBondContact O-N 3.06Å; F373-S375 VanDerWaalsContact C-N 3.32Å; F373-S375 PolarHBondContact O-N 3.11Å; S375-F377 VanDerWaalsContact C-N 3.29Å; S375-F377 PolarHBondContact O-N 3.32Å; S375-S378 PolarHBondContact O-N 3.43Å; S375-S378 VanDerWaalsContact O-N 3.13Å; S375-F379 WeakPolarHBondContact O-CD2 3.08Å; S375-F379 PolarHBondContact O-N 3.11Å; S375-F379 WeakPolarHBondContact OG-CE2 3.42Å |
| 376 | G | 95.2 | Very high | 92.7 | Very high | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -56.6 | -42.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | G336 L372 F373 S378 F379 | G336-G376 WeakPolarHBondContact CA-O 3.15Å; L372-G376 PolarHBondContact O-N 2.82Å; F373-G376 PolarHBondContact O-N 3.01Å; G376-S378 VanDerWaalsContact C-N 3.34Å; G376-S378 PolarHBondContact O-N 3.21Å; G376-F379 PolarHBondContact O-N 3.15Å |
| 377 | F | 95.6 | Very high | 92.2 | Very high | 10 Ų | 10 | 19.4 Ų | 19.4 | 4% | 0.044 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -60.9 | -41.8 | 175.9 | -172.1 | -92.7 | 0 | 0 | 0 | 112.1 | Q276 I281 C340 F373 V374 S375 F379 P381 G382 | Q276-F377 HydrophobicContact CG-CE2 3.88Å; Q276-F377 HydrophobicContact CG-CZ 3.6Å; I281-F377 HydrophobicContact CB-CD2 3.98Å; I281-F377 HydrophobicContact CB-CE2 3.79Å; I281-F377 HydrophobicContact CB-CG 4.46Å; I281-F377 HydrophobicContact CB-CZ 4.09Å; I281-F377 HydrophobicContact CD1-CB 4.44Å; I281-F377 HydrophobicContact CD1-CD1 4.18Å; I281-F377 HydrophobicContact CD1-CD2 4.44Å; I281-F377 HydrophobicContact CD1-CG 4.1Å; I281-F377 HydrophobicContact CG1-CD1 4Å; I281-F377 HydrophobicContact CG1-CD2 4.09Å; I281-F377 HydrophobicContact CG1-CE1 3.91Å; I281-F377 HydrophobicContact CG1-CE2 4.03Å; I281-F377 HydrophobicContact CG1-CG 4.08Å; I281-F377 HydrophobicContact CG1-CZ 3.93Å; I281-F377 HydrophobicContact CG2-CD2 4.3Å; I281-F377 HydrophobicContact CG2-CE1 4.49Å; I281-F377 HydrophobicContact CG2-CE2 3.59Å; I281-F377 HydrophobicContact CG2-CZ 3.7Å; C340-F377 PolarHBondContact SG-N 3.09Å; C340-F377 VanDerWaalsContact SG-N 3.44Å; F373-F377 PolarHBondContact O-N 3.46Å; V374-F377 PolarHBondContact O-N 3.29Å; S375-F377 VanDerWaalsContact C-N 3.29Å; S375-F377 PolarHBondContact O-N 3.32Å; F377-F379 VanDerWaalsContact C-N 3.33Å; F377-F379 PolarHBondContact O-N 3.32Å; F377-P381 HydrophobicContact CD2-CB 3.71Å; F377-P381 HydrophobicContact CE2-CB 3.91Å; F377-P381 HydrophobicContact CG-CB 4.28Å; F377-P381 WeakPolarHBondContact O-CD 3.43Å; F377-G382 PolarHBondContact O-N 3.47Å |
| 378 | S | 92.9 | Very high | 91.9 | Very high | 2 Ų | 2 | 18.6 Ų | 18.6 | 1% | 0.014 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -65.8 | -28.4 | -179.2 | -65 | 0 | 0 | 0 | 0 | 114.7 | I313 G316 S320 V374 S375 G376 G380 | I313-S378 WeakPolarHBondContact CG1-OG 3.48Å; I313-S378 PolarHBondContact O-OG 3.41Å; I313-S378 VanDerWaalsContact O-OG 3.12Å; G316-S378 VanDerWaalsContact C-CB 3.46Å; S320-S378 WeakPolarHBondContact CB-O 3.07Å; S320-S378 PolarHBondContact OG-O 2.78Å; V374-S378 PolarHBondContact O-N 3.19Å; V374-S378 VanDerWaalsContact O-N 3.08Å; V374-S378 PolarHBondContact O-OG 2.82Å; S375-S378 PolarHBondContact O-N 3.43Å; S375-S378 VanDerWaalsContact O-N 3.13Å; G376-S378 VanDerWaalsContact C-N 3.34Å; G376-S378 PolarHBondContact O-N 3.21Å; S378-G380 VanDerWaalsContact C-N 3.33Å; S378-G380 PolarHBondContact O-N 2.64Å |
| 379 | F | 88.5 | Confident | 91.6 | Very high | 54 Ų | 54 | 13.6 Ų | 13.6 | 24% | 0.237 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -70.9 | -23.4 | -176.3 | -76.5 | -60.6 | 0 | 0 | 0 | 114.8 | V319 I339 S375 G376 F377 | V319-F379 HydrophobicContact CB-CE1 4.15Å; V319-F379 HydrophobicContact CG1-CE1 3.7Å; V319-F379 HydrophobicContact CG1-CZ 4.33Å; I339-F379 HydrophobicContact CD1-CD2 4.45Å; S375-F379 WeakPolarHBondContact O-CD2 3.08Å; S375-F379 PolarHBondContact O-N 3.11Å; S375-F379 WeakPolarHBondContact OG-CE2 3.42Å; G376-F379 PolarHBondContact O-N 3.15Å; F377-F379 VanDerWaalsContact C-N 3.33Å; F377-F379 PolarHBondContact O-N 3.32Å |
| 380 | G | 89.8 | Confident | 90.9 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 7% | 0.073 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -156.5 | -64.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | S378 G382 S383 V384 | S378-G380 VanDerWaalsContact C-N 3.33Å; S378-G380 PolarHBondContact O-N 2.64Å; G380-G382 PolarHBondContact O-N 3.47Å; G380-G382 VanDerWaalsContact O-N 3.08Å; G380-S383 PolarHBondContact O-N 3.26Å; G380-S383 VanDerWaalsContact O-N 3.12Å; G380-V384 WeakPolarHBondContact O-CB 3.43Å; G380-V384 WeakPolarHBondContact O-CG2 3.43Å; G380-V384 PolarHBondContact O-N 2.93Å |
| 381 | P | 93.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 8% | 0.08 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -51.1 | -35.6 | -176.4 | -32 | 37 | 0 | 0 | 0 | 114.8 | Q276 F337 F377 P385 | Q276-P381 VanDerWaalsContact CG-O 3.26Å; Q276-P381 WeakPolarHBondContact CG-O 3.38Å; Q276-P381 PolarHBondContact NE2-O 3.4Å; F337-P381 HydrophobicContact CD1-CB 4Å; F337-P381 HydrophobicContact CD1-CG 3.55Å; F337-P381 HydrophobicContact CD2-CG 4.15Å; F337-P381 HydrophobicContact CE1-CB 3.53Å; F337-P381 HydrophobicContact CE1-CG 3.61Å; F337-P381 HydrophobicContact CE2-CB 4.46Å; F337-P381 HydrophobicContact CE2-CG 4.21Å; F337-P381 HydrophobicContact CG-CG 3.82Å; F337-P381 HydrophobicContact CZ-CB 3.79Å; F337-P381 HydrophobicContact CZ-CG 3.94Å; F377-P381 HydrophobicContact CD2-CB 3.71Å; F377-P381 HydrophobicContact CE2-CB 3.91Å; F377-P381 HydrophobicContact CG-CB 4.28Å; F377-P381 WeakPolarHBondContact O-CD 3.43Å; P381-P385 WeakPolarHBondContact O-CD 3.16Å; P381-P385 WeakPolarHBondContact O-CG 3.39Å |
| 382 | G | 90.2 | Very high | 90.2 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 7% | 0.07 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -40.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q155 Q276 F377 G380 | Q155-G382 PolarHBondContact OE1-O 3Å; Q155-G382 VanDerWaalsContact OE1-O 3.1Å; Q276-G382 PolarHBondContact NE2-O 3.26Å; Q276-G382 VanDerWaalsContact NE2-O 3.11Å; F377-G382 PolarHBondContact O-N 3.47Å; G380-G382 PolarHBondContact O-N 3.47Å; G380-G382 VanDerWaalsContact O-N 3.08Å |
| 383 | S | 85.9 | Confident | 89.6 | Confident | 2 Ų | 2 | 9.1 Ų | 9.1 | 1% | 0.014 | 5% | 0.049 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.2 | -42.1 | -169.4 | 55.7 | 0 | 0 | 0 | 0 | 114.1 | G380 W386 F387 | G380-S383 PolarHBondContact O-N 3.26Å; G380-S383 VanDerWaalsContact O-N 3.12Å; S383-W386 PolarHBondContact O-N 3.43Å; S383-F387 WeakPolarHBondContact O-CD1 3.41Å |
| 384 | V | 90.1 | Very high | 88.9 | Confident | 0 Ų | 0 | 9.5 Ų | 9.5 | 0% | 0 | 5% | 0.051 | C | C | . | . | H | α-helix | trans | -59.8 | -45.9 | -170.6 | 176.8 | 0 | 0 | 0 | 0 | 113.5 | I324 R329 L332 L333 G380 W386 F387 L388 | I324-V384 HydrophobicContact CD1-CG2 4.24Å; R329-V384 HydrophobicContact CB-CG1 4.09Å; L332-V384 HydrophobicContact CB-CG2 4.28Å; L332-V384 HydrophobicContact CD1-CG2 4.43Å; L333-V384 HydrophobicContact CD1-CB 4.48Å; L333-V384 HydrophobicContact CD1-CG1 3.75Å; L333-V384 HydrophobicContact CD2-CB 3.88Å; L333-V384 HydrophobicContact CD2-CG1 4.07Å; L333-V384 HydrophobicContact CG-CB 4.05Å; L333-V384 HydrophobicContact CG-CG1 3.79Å; G380-V384 WeakPolarHBondContact O-CB 3.43Å; G380-V384 WeakPolarHBondContact O-CG2 3.43Å; G380-V384 PolarHBondContact O-N 2.93Å; V384-W386 VanDerWaalsContact C-N 3.27Å; V384-W386 PolarHBondContact O-N 3.43Å; V384-F387 VanDerWaalsContact CA-CE1 3.48Å; V384-F387 HydrophobicContact CB-CE1 4.36Å; V384-F387 HydrophobicContact CB-CZ 4.27Å; V384-F387 HydrophobicContact CG1-CZ 4.2Å; V384-F387 HydrophobicContact CG2-CE1 4.33Å; V384-F387 HydrophobicContact CG2-CZ 4.12Å; V384-F387 PolarHBondContact O-N 3.4Å; V384-L388 HydrophobicContact CG1-CB 4.33Å; V384-L388 VanDerWaalsContact O-CB 3.22Å; V384-L388 WeakPolarHBondContact O-CB 3.49Å; V384-L388 PolarHBondContact O-N 2.88Å |
| 385 | P | 90.8 | Very high | 87.7 | Confident | 1 Ų | 1 | 10.6 Ų | 10.6 | 1% | 0.006 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -54.1 | -42 | -176.5 | -26 | 34.8 | 0 | 0 | 0 | 113.4 | P272 H273 Q276 L333 P381 F387 L388 | P272-P385 HydrophobicContact CB-CB 4.12Å; P272-P385 HydrophobicContact CB-CG 3.81Å; H273-P385 VanDerWaalsContact NE2-C 3.29Å; H273-P385 VanDerWaalsContact NE2-CB 3.34Å; H273-P385 WeakPolarHBondContact NE2-CB 3.47Å; H273-P385 PolarHBondContact NE2-O 2.99Å; H273-P385 VanDerWaalsContact NE2-O 3.08Å; Q276-P385 HydrophobicContact CB-CG 4.42Å; L333-P385 HydrophobicContact CD2-CG 4.37Å; P381-P385 WeakPolarHBondContact O-CD 3.16Å; P381-P385 WeakPolarHBondContact O-CG 3.39Å; P385-F387 VanDerWaalsContact C-N 3.31Å; P385-F387 PolarHBondContact O-N 2.98Å; P385-L388 PolarHBondContact O-N 2.85Å |
| 386 | W | 83.9 | Confident | 86.5 | Confident | 7 Ų | 7 | 11 Ų | 11 | 3% | 0.027 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -60.8 | -32.4 | -174 | -68.5 | 112 | 0 | 0 | 0 | 114.9 | T131 S383 V384 Q402 V406 | T131-W386 HydrophobicContact CG2-CH2 4.08Å; T131-W386 HydrophobicContact CG2-CZ3 4.49Å; S383-W386 PolarHBondContact O-N 3.43Å; V384-W386 VanDerWaalsContact C-N 3.27Å; V384-W386 PolarHBondContact O-N 3.43Å; W386-Q402 PolarHBondContact O-NE2 3.26Å; W386-V406 HydrophobicContact CE3-CG2 4.5Å; W386-V406 HydrophobicContact CZ3-CG2 3.83Å |
| 387 | F | 81 | Confident | 85.7 | Confident | 18 Ų | 18 | 12 Ų | 12 | 8% | 0.079 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -106.3 | -14.8 | 176.7 | 70.8 | -99.3 | 0 | 0 | 0 | 113.1 | I324 R329 S383 V384 P385 V389 A390 E391 | I324-F387 HydrophobicContact CD1-CE1 3.51Å; I324-F387 HydrophobicContact CD1-CZ 3.75Å; I324-F387 HydrophobicContact CG1-CE1 4.44Å; I324-F387 HydrophobicContact CG1-CZ 4.2Å; R329-F387 HydrophobicContact CG-CE2 4.49Å; S383-F387 WeakPolarHBondContact O-CD1 3.41Å; V384-F387 VanDerWaalsContact CA-CE1 3.48Å; V384-F387 HydrophobicContact CB-CE1 4.36Å; V384-F387 HydrophobicContact CB-CZ 4.27Å; V384-F387 HydrophobicContact CG1-CZ 4.2Å; V384-F387 HydrophobicContact CG2-CE1 4.33Å; V384-F387 HydrophobicContact CG2-CZ 4.12Å; V384-F387 PolarHBondContact O-N 3.4Å; P385-F387 VanDerWaalsContact C-N 3.31Å; P385-F387 PolarHBondContact O-N 2.98Å; F387-V389 VanDerWaalsContact C-N 3.27Å; F387-V389 PolarHBondContact O-N 3.43Å; F387-A390 WeakPolarHBondContact O-CB 3.21Å; F387-A390 PolarHBondContact O-N 3.26Å; F387-E391 HydrophobicContact CD2-CG 4.41Å; F387-E391 WeakPolarHBondContact CE2-OE1 3.15Å; F387-E391 PolarHBondContact O-N 2.87Å |
| 388 | L | 88 | Confident | 84.9 | Confident | 2 Ų | 2 | 12.9 Ų | 12.9 | 1% | 0.01 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -58.6 | -38 | -178.3 | 179.7 | 65.8 | 0 | 0 | 0 | 112.3 | P272 R329 L333 V384 P385 A390 E391 L392 L450 T453 | P272-L388 HydrophobicContact CB-CD2 4.43Å; P272-L388 HydrophobicContact CG-CD2 3.77Å; R329-L388 HydrophobicContact CB-CD1 4.29Å; R329-L388 HydrophobicContact CG-CD1 4.48Å; L333-L388 HydrophobicContact CD1-CD2 4.2Å; V384-L388 HydrophobicContact CG1-CB 4.33Å; V384-L388 VanDerWaalsContact O-CB 3.22Å; V384-L388 WeakPolarHBondContact O-CB 3.49Å; V384-L388 PolarHBondContact O-N 2.88Å; P385-L388 PolarHBondContact O-N 2.85Å; L388-A390 PolarHBondContact O-N 2.92Å; L388-E391 CarbonylContact O-C 3.57Å; L388-E391 WeakPolarHBondContact O-CA 3.22Å; L388-E391 PolarHBondContact O-N 3.39Å; L388-L392 HydrophobicContact CD1-CD1 4.44Å; L388-L392 HydrophobicContact CD1-CG 4.26Å; L388-L392 HydrophobicContact CD2-CD1 4.21Å; L388-L392 HydrophobicContact CG-CD1 3.82Å; L388-L392 HydrophobicContact CG-CG 4.09Å; L388-L392 WeakPolarHBondContact O-CG 3.34Å; L388-L392 PolarHBondContact O-N 2.98Å; L388-L450 HydrophobicContact CD2-CD1 4.01Å; L388-L450 HydrophobicContact CD2-CD2 4.39Å; L388-T453 HydrophobicContact CD1-CG2 3.91Å |
| 389 | V | 87.9 | Confident | 84 | Confident | 1 Ų | 1 | 14.1 Ų | 14.1 | 1% | 0.006 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -59.3 | -34.6 | 177.4 | -175.3 | 0 | 0 | 0 | 0 | 111.4 | A269 F387 E391 L392 F393 A401 Q402 V405 | A269-V389 HydrophobicContact CB-CG2 4.35Å; F387-V389 VanDerWaalsContact C-N 3.27Å; F387-V389 PolarHBondContact O-N 3.43Å; V389-E391 VanDerWaalsContact C-N 3.29Å; V389-E391 PolarHBondContact O-N 3.44Å; V389-L392 PolarHBondContact O-N 3.18Å; V389-F393 HydrophobicContact CG1-CD2 3.74Å; V389-F393 HydrophobicContact CG1-CE2 4.2Å; V389-F393 PolarHBondContact O-N 3.4Å; V389-A401 HydrophobicContact CG1-CB 3.82Å; V389-Q402 HydrophobicContact CB-CG 4.15Å; V389-Q402 HydrophobicContact CG1-CG 3.81Å; V389-V405 HydrophobicContact CG2-CB 4.37Å; V389-V405 HydrophobicContact CG2-CG1 4.09Å; V389-V405 HydrophobicContact CG2-CG2 4.29Å |
| 390 | A | 82.2 | Confident | 83.5 | Confident | 22 Ų | 22 | 12.4 Ų | 12.4 | 18% | 0.182 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -70.9 | -25.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | F387 L388 R398 P458 | F387-A390 WeakPolarHBondContact O-CB 3.21Å; F387-A390 PolarHBondContact O-N 3.26Å; L388-A390 PolarHBondContact O-N 2.92Å; A390-R398 HydrophobicContact CB-CG 4.49Å; A390-R398 PolarHBondContact O-NE 3.34Å; A390-R398 PolarHBondContact O-NH2 2.92Å; A390-P458 WeakPolarHBondContact O-CG 3.32Å |
| 391 | E | 84.9 | Confident | 83.3 | Confident | 34 Ų | 34 | 12.4 Ų | 12.4 | 16% | 0.159 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -84.1 | -25.3 | 173 | -59.5 | -176.6 | 172.6 | 0 | 0 | 112 | R329 F387 L388 V389 T453 | R329-E391 VanDerWaalsContact CG-OE2 3.32Å; R329-E391 WeakPolarHBondContact CG-OE2 3.49Å; R329-E391 IonicContact CZ-OE1 3.68Å; R329-E391 IonicContact NE-OE1 2.64Å; R329-E391 PolarHBondContact NE-OE1 3.22Å; R329-E391 IonicContact NE-OE2 3.21Å; R329-E391 PolarHBondContact NE-OE2 2.69Å; R329-E391 IonicContact NH2-OE1 3.71Å; R329-E391 PolarHBondContact NH2-OE1 3.21Å; F387-E391 HydrophobicContact CD2-CG 4.41Å; F387-E391 WeakPolarHBondContact CE2-OE1 3.15Å; F387-E391 PolarHBondContact O-N 2.87Å; L388-E391 CarbonylContact O-C 3.57Å; L388-E391 WeakPolarHBondContact O-CA 3.22Å; L388-E391 PolarHBondContact O-N 3.39Å; V389-E391 VanDerWaalsContact C-N 3.29Å; V389-E391 PolarHBondContact O-N 3.44Å; E391-T453 HydrophobicContact CB-CG2 4.39Å; E391-T453 VanDerWaalsContact OE2-CB 3.3Å; E391-T453 WeakPolarHBondContact OE2-CB 3.17Å; E391-T453 PolarHBondContact OE2-OG1 2.84Å |
| 392 | L | 88.9 | Confident | 82.7 | Confident | 2 Ų | 2 | 13 Ų | 13 | 1% | 0.01 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -83.8 | -31.7 | 179.7 | -73.9 | 175.6 | 0 | 0 | 0 | 114.1 | V268 A269 L388 V389 P451 T453 I461 F465 | V268-L392 HydrophobicContact CG1-CD1 4.36Å; V268-L392 HydrophobicContact CG1-CD2 4.41Å; A269-L392 HydrophobicContact CB-CD1 3.68Å; L388-L392 HydrophobicContact CD1-CD1 4.44Å; L388-L392 HydrophobicContact CD1-CG 4.26Å; L388-L392 HydrophobicContact CD2-CD1 4.21Å; L388-L392 HydrophobicContact CG-CD1 3.82Å; L388-L392 HydrophobicContact CG-CG 4.09Å; L388-L392 WeakPolarHBondContact O-CG 3.34Å; L388-L392 PolarHBondContact O-N 2.98Å; V389-L392 PolarHBondContact O-N 3.18Å; L392-P451 HydrophobicContact CD2-CG 4.45Å; L392-T453 HydrophobicContact CD2-CG2 3.77Å; L392-T453 HydrophobicContact CG-CG2 4.38Å; L392-I461 HydrophobicContact CD2-CG2 3.85Å; L392-F465 HydrophobicContact CD2-CE2 4.03Å; L392-F465 HydrophobicContact CD2-CZ 3.65Å |
| 393 | F | 85.5 | Confident | 82.3 | Confident | 6 Ų | 6 | 13.7 Ų | 13.7 | 3% | 0.026 | 7% | 0.072 | C | C | . | . | S | Bend | trans | -120.3 | 140.3 | -173.9 | -68.8 | -88.9 | 0 | 0 | 0 | 112.6 | L256 L262 L266 A269 V389 R398 A401 P458 | L256-F393 HydrophobicContact CD2-CE1 4.01Å; L262-F393 HydrophobicContact CD2-CD1 4.48Å; L262-F393 HydrophobicContact CD2-CE1 4.39Å; L266-F393 HydrophobicContact CB-CZ 4.19Å; A269-F393 HydrophobicContact CB-CE2 3.92Å; V389-F393 HydrophobicContact CG1-CD2 3.74Å; V389-F393 HydrophobicContact CG1-CE2 4.2Å; V389-F393 PolarHBondContact O-N 3.4Å; F393-R398 HydrophobicContact CB-CB 4.37Å; F393-R398 PolarHBondContact O-NE 2.86Å; F393-R398 PolarHBondContact O-NH2 3.35Å; F393-A401 HydrophobicContact CD1-CB 4.22Å; F393-A401 HydrophobicContact CD2-CB 3.72Å; F393-A401 HydrophobicContact CE1-CB 4.17Å; F393-A401 HydrophobicContact CE2-CB 3.66Å; F393-A401 HydrophobicContact CG-CB 3.98Å; F393-A401 HydrophobicContact CZ-CB 3.86Å; F393-P458 WeakPolarHBondContact O-CB 3.36Å |
| 394 | T | 80.6 | Confident | 82.3 | Confident | 10 Ų | 10 | 14.6 Ų | 14.6 | 6% | 0.061 | 8% | 0.077 | C | C | . | . | trans | -61.7 | 154 | 165.5 | 56.4 | 0 | 0 | 0 | 0 | 109.9 | E396 Y397 R398 P458 V459 | T394-E396 PolarHBondContact O-N 3.49Å; T394-E396 VanDerWaalsContact O-N 3.15Å; T394-Y397 PolarHBondContact O-N 3.24Å; T394-Y397 VanDerWaalsContact O-N 3.09Å; T394-Y397 WeakPolarHBondContact OG1-CD2 3.49Å; T394-R398 WeakPolarHBondContact O-CB 3.28Å; T394-R398 PolarHBondContact O-N 3.08Å; T394-P458 HydrophobicContact CG2-CB 4.3Å; T394-V459 HydrophobicContact CG2-CG2 3.89Å | ||
| 395 | Q | 70.5 | Confident | 82.3 | Confident | 23 Ų | 23 | 14.6 Ų | 14.6 | 11% | 0.107 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -52.7 | -39.4 | -173.9 | -173.8 | 71.2 | 12 | 0 | 0 | 112.2 | E244 Y397 R398 | E244-Q395 HydrophobicContact CB-CG 4.23Å; E244-Q395 WeakPolarHBondContact OE2-CG 3.43Å; Q395-Y397 VanDerWaalsContact C-N 3.27Å; Q395-Y397 PolarHBondContact O-N 3.31Å; Q395-R398 PolarHBondContact O-N 3.1Å; Q395-R398 VanDerWaalsContact OE1-CZ 3.26Å |
| 396 | E | 71.1 | Confident | 82.2 | Confident | 37 Ų | 37 | 14.5 Ų | 14.5 | 17% | 0.173 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -52 | -37.1 | 178 | -57.9 | 179.3 | 155.2 | 0 | 0 | 114.7 | P243 E244 T247 F251 T394 | P243-E396 VanDerWaalsContact CB-CD 3.49Å; P243-E396 HydrophobicContact CB-CG 3.97Å; P243-E396 WeakPolarHBondContact CB-OE1 3.37Å; E244-E396 HydrophobicContact CB-CG 4.35Å; T247-E396 VanDerWaalsContact CG2-OE1 3.24Å; T247-E396 WeakPolarHBondContact CG2-OE1 3.25Å; T247-E396 PolarHBondContact OG1-OE1 3.35Å; F251-E396 HydrophobicContact CD2-CB 4.02Å; F251-E396 HydrophobicContact CE2-CB 4.31Å; T394-E396 PolarHBondContact O-N 3.49Å; T394-E396 VanDerWaalsContact O-N 3.15Å |
| 397 | Y | 77.9 | Confident | 82.5 | Confident | 21 Ų | 21 | 14.5 Ų | 14.5 | 8% | 0.082 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -109.1 | -10.6 | -177.8 | -56.8 | -66.7 | 0 | 0 | 0 | 112.9 | F251 D255 L262 T394 Q395 D399 A400 A401 | F251-Y397 HydrophobicContact CB-CD1 3.82Å; F251-Y397 HydrophobicContact CB-CE1 3.4Å; F251-Y397 VanDerWaalsContact CB-CE1 3.4Å; F251-Y397 AromaticContact CD1-CE1 3.62Å; F251-Y397 HydrophobicContact CD1-CE1 3.62Å; F251-Y397 AromaticContact CD1-CZ 3.94Å; F251-Y397 WeakPolarHBondContact CD1-OH 3.35Å; F251-Y397 HydrophobicContact CD2-CD1 4.4Å; F251-Y397 AromaticContact CD2-CE1 3.63Å; F251-Y397 HydrophobicContact CD2-CE1 3.63Å; F251-Y397 AromaticContact CD2-CZ 3.77Å; F251-Y397 HydrophobicContact CE1-CE1 4.26Å; F251-Y397 WeakPolarHBondContact CE1-OH 3.4Å; F251-Y397 HydrophobicContact CE2-CE1 4.26Å; F251-Y397 AromaticContact CE2-CZ 3.92Å; F251-Y397 WeakPolarHBondContact CE2-OH 3.35Å; F251-Y397 HydrophobicContact CG-CD1 4.11Å; F251-Y397 AromaticContact CG-CE1 3.25Å; F251-Y397 HydrophobicContact CG-CE1 3.25Å; F251-Y397 AromaticContact CG-CZ 3.76Å; F251-Y397 WeakPolarHBondContact CZ-OH 3.3Å; D255-Y397 HydrophobicContact CB-CE1 4.47Å; L262-Y397 HydrophobicContact CD1-CD1 3.63Å; L262-Y397 HydrophobicContact CD1-CD2 4.15Å; L262-Y397 HydrophobicContact CD1-CE1 3.47Å; L262-Y397 VanDerWaalsContact CD1-CE1 3.47Å; L262-Y397 HydrophobicContact CD1-CE2 4.02Å; L262-Y397 HydrophobicContact CD1-CG 3.98Å; L262-Y397 HydrophobicContact CD2-CD2 3.76Å; L262-Y397 HydrophobicContact CD2-CE2 4.01Å; L262-Y397 HydrophobicContact CD2-CG 4.08Å; T394-Y397 PolarHBondContact O-N 3.24Å; T394-Y397 VanDerWaalsContact O-N 3.09Å; T394-Y397 WeakPolarHBondContact OG1-CD2 3.49Å; Q395-Y397 VanDerWaalsContact C-N 3.27Å; Q395-Y397 PolarHBondContact O-N 3.31Å; Y397-D399 PolarHBondContact O-N 3.11Å; Y397-A400 PolarHBondContact O-N 2.77Å; Y397-A401 WeakPolarHBondContact O-CB 3.47Å; Y397-A401 PolarHBondContact O-N 3.16Å |
| 398 | R | 79.2 | Confident | 83 | Confident | 29 Ų | 29 | 15 Ų | 15 | 11% | 0.109 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.8 | -47.9 | -170.3 | -179.3 | -177.8 | -64.3 | 170.6 | 0.9 | 112.3 | A390 F393 T394 Q395 A400 A401 Q402 | A390-R398 HydrophobicContact CB-CG 4.49Å; A390-R398 PolarHBondContact O-NE 3.34Å; A390-R398 PolarHBondContact O-NH2 2.92Å; F393-R398 HydrophobicContact CB-CB 4.37Å; F393-R398 PolarHBondContact O-NE 2.86Å; F393-R398 PolarHBondContact O-NH2 3.35Å; T394-R398 WeakPolarHBondContact O-CB 3.28Å; T394-R398 PolarHBondContact O-N 3.08Å; Q395-R398 PolarHBondContact O-N 3.1Å; Q395-R398 VanDerWaalsContact OE1-CZ 3.26Å; R398-A400 VanDerWaalsContact C-N 3.34Å; R398-A400 PolarHBondContact O-N 3.12Å; R398-A401 PolarHBondContact O-N 2.67Å; R398-Q402 HydrophobicContact CG-CG 4.31Å; R398-Q402 VanDerWaalsContact O-CB 3.3Å; R398-Q402 WeakPolarHBondContact O-CB 3.28Å; R398-Q402 VanDerWaalsContact O-CG 3.28Å; R398-Q402 WeakPolarHBondContact O-CG 3.35Å; R398-Q402 PolarHBondContact O-N 3.41Å |
| 399 | D | 73.7 | Confident | 83.2 | Confident | 28 Ų | 28 | 15 Ų | 15 | 15% | 0.15 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -65.4 | -39.8 | -176.6 | -75.9 | -3.2 | 0 | 0 | 0 | 112 | N82 Y397 S403 | N82-D399 PolarHBondContact ND2-OD2 3.3Å; N82-D399 PolarHBondContact OD1-OD2 2.99Å; Y397-D399 PolarHBondContact O-N 3.11Å; D399-S403 WeakPolarHBondContact O-CB 3.32Å; D399-S403 PolarHBondContact O-N 3.41Å; D399-S403 PolarHBondContact O-OG 3.46Å |
| 400 | A | 78.8 | Confident | 83.3 | Confident | 18 Ų | 18 | 15 Ų | 15 | 15% | 0.149 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -65.9 | -45.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | M253 L256 Y397 R398 S403 V404 | M253-A400 HydrophobicContact CB-CB 4.41Å; L256-A400 HydrophobicContact CD1-CB 3.61Å; L256-A400 HydrophobicContact CG-CB 4.36Å; Y397-A400 PolarHBondContact O-N 2.77Å; R398-A400 VanDerWaalsContact C-N 3.34Å; R398-A400 PolarHBondContact O-N 3.12Å; A400-S403 PolarHBondContact O-N 3.07Å; A400-V404 WeakPolarHBondContact O-CG2 3.27Å; A400-V404 PolarHBondContact O-N 3.38Å; A400-V404 VanDerWaalsContact O-N 3.09Å |
| 401 | A | 84.3 | Confident | 83.8 | Confident | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63.6 | -43.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | L256 V389 F393 Y397 R398 S403 V404 V405 | L256-A401 HydrophobicContact CD1-CB 4.28Å; L256-A401 HydrophobicContact CD2-CB 4.31Å; V389-A401 HydrophobicContact CG1-CB 3.82Å; F393-A401 HydrophobicContact CD1-CB 4.22Å; F393-A401 HydrophobicContact CD2-CB 3.72Å; F393-A401 HydrophobicContact CE1-CB 4.17Å; F393-A401 HydrophobicContact CE2-CB 3.66Å; F393-A401 HydrophobicContact CG-CB 3.98Å; F393-A401 HydrophobicContact CZ-CB 3.86Å; Y397-A401 WeakPolarHBondContact O-CB 3.47Å; Y397-A401 PolarHBondContact O-N 3.16Å; R398-A401 PolarHBondContact O-N 2.67Å; A401-S403 VanDerWaalsContact C-N 3.32Å; A401-S403 PolarHBondContact O-N 3.41Å; A401-V404 PolarHBondContact O-N 2.9Å; A401-V405 WeakPolarHBondContact O-CB 3.44Å; A401-V405 WeakPolarHBondContact O-CG2 3.38Å; A401-V405 PolarHBondContact O-N 3.49Å |
| 402 | Q | 81.7 | Confident | 84.2 | Confident | 13 Ų | 13 | 16.7 Ų | 16.7 | 6% | 0.061 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -56.6 | -46.3 | 173.5 | -80.8 | -72.1 | 4.8 | 0 | 0 | 111 | W386 V389 R398 V404 V405 V406 | W386-Q402 PolarHBondContact O-NE2 3.26Å; V389-Q402 HydrophobicContact CB-CG 4.15Å; V389-Q402 HydrophobicContact CG1-CG 3.81Å; R398-Q402 HydrophobicContact CG-CG 4.31Å; R398-Q402 VanDerWaalsContact O-CB 3.3Å; R398-Q402 WeakPolarHBondContact O-CB 3.28Å; R398-Q402 VanDerWaalsContact O-CG 3.28Å; R398-Q402 WeakPolarHBondContact O-CG 3.35Å; R398-Q402 PolarHBondContact O-N 3.41Å; Q402-V404 PolarHBondContact O-N 3.01Å; Q402-V405 PolarHBondContact O-N 3.31Å; Q402-V406 VanDerWaalsContact O-CB 3.28Å; Q402-V406 WeakPolarHBondContact O-CB 3.37Å; Q402-V406 VanDerWaalsContact O-CG2 3.24Å; Q402-V406 WeakPolarHBondContact O-CG2 3.2Å; Q402-V406 PolarHBondContact O-N 3.3Å |
| 403 | S | 80.6 | Confident | 84.3 | Confident | 13 Ų | 13 | 16.7 Ų | 16.7 | 9% | 0.091 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -61.6 | -42.4 | 179.8 | -59.2 | 0 | 0 | 0 | 0 | 112.6 | M253 D399 A400 A401 G407 | M253-S403 VanDerWaalsContact CE-CB 3.49Å; D399-S403 WeakPolarHBondContact O-CB 3.32Å; D399-S403 PolarHBondContact O-N 3.41Å; D399-S403 PolarHBondContact O-OG 3.46Å; A400-S403 PolarHBondContact O-N 3.07Å; A401-S403 VanDerWaalsContact C-N 3.32Å; A401-S403 PolarHBondContact O-N 3.41Å; S403-G407 PolarHBondContact O-N 3.21Å |
| 404 | V | 86.9 | Confident | 84.5 | Confident | 21 Ų | 21 | 17.4 Ų | 17.4 | 13% | 0.127 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65.7 | -45.7 | 176.5 | 176.9 | 0 | 0 | 0 | 0 | 111.2 | M253 L256 F257 L266 A400 A401 Q402 G407 T408 | M253-V404 HydrophobicContact CE-CG2 3.91Å; M253-V404 HydrophobicContact CG-CG2 4.2Å; M253-V404 HydrophobicContact SD-CG2 4.14Å; L256-V404 HydrophobicContact CD1-CG2 4.28Å; F257-V404 HydrophobicContact CE2-CG2 4.18Å; F257-V404 HydrophobicContact CZ-CG1 4.16Å; F257-V404 HydrophobicContact CZ-CG2 4.03Å; L266-V404 HydrophobicContact CD1-CB 4.15Å; L266-V404 HydrophobicContact CD1-CG1 3.96Å; L266-V404 HydrophobicContact CD2-CG1 4.22Å; A400-V404 WeakPolarHBondContact O-CG2 3.27Å; A400-V404 PolarHBondContact O-N 3.38Å; A400-V404 VanDerWaalsContact O-N 3.09Å; A401-V404 PolarHBondContact O-N 2.9Å; Q402-V404 PolarHBondContact O-N 3.01Å; V404-G407 PolarHBondContact O-N 2.75Å; V404-T408 WeakPolarHBondContact O-CB 3.26Å; V404-T408 PolarHBondContact O-N 3.26Å; V404-T408 PolarHBondContact O-OG1 2.83Å |
| 405 | V | 90.7 | Very high | 84.9 | Confident | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -67.1 | -43.2 | -177.1 | 170.4 | 0 | 0 | 0 | 0 | 111.1 | L266 A269 L270 H273 V389 A401 Q402 T408 N409 | L266-V405 HydrophobicContact CD1-CG2 4.02Å; A269-V405 HydrophobicContact CB-CG2 4.04Å; L270-V405 HydrophobicContact CD2-CB 4.41Å; L270-V405 HydrophobicContact CD2-CG2 3.92Å; L270-V405 HydrophobicContact CG-CG2 4.24Å; H273-V405 HydrophobicContact CB-CG1 3.94Å; H273-V405 WeakPolarHBondContact CD2-CG1 3.49Å; H273-V405 VanDerWaalsContact CE1-CG1 3.45Å; H273-V405 WeakPolarHBondContact CE1-CG1 3.47Å; H273-V405 WeakPolarHBondContact NE2-CG1 3.25Å; V389-V405 HydrophobicContact CG2-CB 4.37Å; V389-V405 HydrophobicContact CG2-CG1 4.09Å; V389-V405 HydrophobicContact CG2-CG2 4.29Å; A401-V405 WeakPolarHBondContact O-CB 3.44Å; A401-V405 WeakPolarHBondContact O-CG2 3.38Å; A401-V405 PolarHBondContact O-N 3.49Å; Q402-V405 PolarHBondContact O-N 3.31Å; V405-T408 PolarHBondContact O-N 2.93Å; V405-N409 VanDerWaalsContact O-CB 3.3Å; V405-N409 WeakPolarHBondContact O-CB 3.45Å; V405-N409 PolarHBondContact O-N 3.29Å |
| 406 | V | 87.5 | Confident | 85.7 | Confident | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -67.5 | -43.5 | 175.3 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | V132 W386 Q402 T408 N409 W410 | V132-V406 HydrophobicContact CG2-CB 4.13Å; V132-V406 HydrophobicContact CG2-CG1 3.72Å; V132-V406 HydrophobicContact CG2-CG2 4.19Å; W386-V406 HydrophobicContact CE3-CG2 4.5Å; W386-V406 HydrophobicContact CZ3-CG2 3.83Å; Q402-V406 VanDerWaalsContact O-CB 3.28Å; Q402-V406 WeakPolarHBondContact O-CB 3.37Å; Q402-V406 VanDerWaalsContact O-CG2 3.24Å; Q402-V406 WeakPolarHBondContact O-CG2 3.2Å; Q402-V406 PolarHBondContact O-N 3.3Å; V406-T408 VanDerWaalsContact C-N 3.28Å; V406-T408 PolarHBondContact O-N 3.19Å; V406-N409 WeakPolarHBondContact O-CB 3.18Å; V406-N409 PolarHBondContact O-N 2.98Å; V406-N409 VanDerWaalsContact O-N 3.14Å; V406-W410 VanDerWaalsContact O-CD1 3.23Å; V406-W410 PolarHBondContact O-N 3.39Å |
| 407 | G | 89.7 | Confident | 86.2 | Confident | 7 Ų | 7 | 18.3 Ų | 18.3 | 7% | 0.072 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -57.3 | -43.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | L71 S403 V404 W410 L411 | L71-G407 VanDerWaalsContact CD1-O 3.27Å; L71-G407 WeakPolarHBondContact CD1-O 3.44Å; S403-G407 PolarHBondContact O-N 3.21Å; V404-G407 PolarHBondContact O-N 2.75Å; G407-W410 PolarHBondContact O-N 3.04Å; G407-L411 WeakPolarHBondContact O-CB 3.39Å; G407-L411 PolarHBondContact O-N 3.34Å |
| 408 | T | 91.8 | Very high | 86.5 | Confident | 27 Ų | 27 | 20.7 Ų | 20.7 | 17% | 0.166 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -65.6 | -40 | 175.8 | -56.2 | 0 | 0 | 0 | 0 | 111.8 | L270 F274 V404 V405 V406 L411 C412 | L270-T408 HydrophobicContact CD2-CG2 3.89Å; F274-T408 HydrophobicContact CD2-CG2 4.5Å; F274-T408 HydrophobicContact CE1-CG2 3.81Å; F274-T408 HydrophobicContact CE2-CG2 3.78Å; F274-T408 HydrophobicContact CZ-CG2 3.38Å; V404-T408 WeakPolarHBondContact O-CB 3.26Å; V404-T408 PolarHBondContact O-N 3.26Å; V404-T408 PolarHBondContact O-OG1 2.83Å; V405-T408 PolarHBondContact O-N 2.93Å; V406-T408 VanDerWaalsContact C-N 3.28Å; V406-T408 PolarHBondContact O-N 3.19Å; T408-L411 PolarHBondContact O-N 3.35Å; T408-C412 PolarHBondContact O-N 2.84Å; T408-C412 PolarHBondContact O-SG 2.91Å |
| 409 | N | 92.3 | Very high | 86.8 | Confident | 2 Ų | 2 | 23.9 Ų | 23.9 | 1% | 0.011 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -60.4 | -48.1 | 177 | -170.9 | -91 | 0 | 0 | 0 | 111.2 | H273 Q276 Q277 V405 V406 C412 N413 | H273-N409 HydrophobicContact CB-CB 4.5Å; H273-N409 PolarHBondContact ND1-ND2 3.39Å; H273-N409 VanDerWaalsContact ND1-ND2 3.13Å; Q276-N409 PolarHBondContact OE1-ND2 2.92Å; Q276-N409 VanDerWaalsContact OE1-ND2 3.16Å; Q277-N409 HydrophobicContact CG-CB 4.35Å; Q277-N409 WeakPolarHBondContact CG-ND2 3.34Å; Q277-N409 WeakPolarHBondContact CG-O 3.21Å; Q277-N409 VanDerWaalsContact NE2-CG 3.32Å; Q277-N409 PolarHBondContact NE2-ND2 3.42Å; Q277-N409 PolarHBondContact NE2-OD1 3.36Å; V405-N409 VanDerWaalsContact O-CB 3.3Å; V405-N409 WeakPolarHBondContact O-CB 3.45Å; V405-N409 PolarHBondContact O-N 3.29Å; V406-N409 WeakPolarHBondContact O-CB 3.18Å; V406-N409 PolarHBondContact O-N 2.98Å; V406-N409 VanDerWaalsContact O-N 3.14Å; N409-C412 PolarHBondContact O-N 2.94Å; N409-N413 PolarHBondContact O-N 3.44Å |
| 410 | W | 91.2 | Very high | 87.3 | Confident | 2 Ų | 2 | 22.6 Ų | 22.6 | 1% | 0.008 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -65 | -39.7 | 175.3 | -77.7 | 107.7 | 0 | 0 | 0 | 112.6 | F21 F66 V67 L71 T131 V406 G407 C412 N413 I414 | F21-W410 AromaticContact CD2-CH2 3.66Å; F21-W410 HydrophobicContact CD2-CH2 3.66Å; F21-W410 AromaticContact CD2-CZ2 3.95Å; F21-W410 HydrophobicContact CD2-CZ2 3.95Å; F21-W410 AromaticContact CE2-CH2 3.4Å; F21-W410 HydrophobicContact CE2-CH2 3.4Å; F21-W410 VanDerWaalsContact CE2-CH2 3.4Å; F21-W410 AromaticContact CE2-CZ2 3.76Å; F21-W410 HydrophobicContact CE2-CZ2 3.76Å; F21-W410 HydrophobicContact CE2-CZ3 4.25Å; F66-W410 HydrophobicContact CE1-CH2 4.22Å; F66-W410 HydrophobicContact CE1-CZ3 4.3Å; F66-W410 HydrophobicContact CZ-CH2 4.38Å; V67-W410 HydrophobicContact CG1-CE3 3.69Å; V67-W410 HydrophobicContact CG1-CZ3 4.03Å; L71-W410 HydrophobicContact CB-CB 3.93Å; L71-W410 HydrophobicContact CD1-CB 4.04Å; T131-W410 HydrophobicContact CG2-CZ2 3.89Å; T131-W410 PolarHBondContact OG1-NE1 3.44Å; T131-W410 VanDerWaalsContact OG1-NE1 3.11Å; V406-W410 VanDerWaalsContact O-CD1 3.23Å; V406-W410 PolarHBondContact O-N 3.39Å; G407-W410 PolarHBondContact O-N 3.04Å; W410-C412 VanDerWaalsContact C-N 3.35Å; W410-C412 PolarHBondContact O-N 3.44Å; W410-N413 WeakPolarHBondContact O-CB 3.2Å; W410-N413 PolarHBondContact O-N 3.33Å; W410-N413 VanDerWaalsContact O-N 3.13Å; W410-I414 WeakPolarHBondContact O-CG1 2.97Å; W410-I414 PolarHBondContact O-N 3.03Å |
| 411 | L | 92.3 | Very high | 87.4 | Confident | 88 Ų | 88 | 23 Ų | 23 | 46% | 0.461 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -61 | -44.1 | 175.5 | -177.4 | 62.6 | 0 | 0 | 0 | 111.6 | G407 T408 N413 I414 L415 | G407-L411 WeakPolarHBondContact O-CB 3.39Å; G407-L411 PolarHBondContact O-N 3.34Å; T408-L411 PolarHBondContact O-N 3.35Å; L411-N413 VanDerWaalsContact C-N 3.29Å; L411-N413 PolarHBondContact O-N 2.99Å; L411-I414 PolarHBondContact O-N 2.99Å; L411-L415 WeakPolarHBondContact O-CG 3.43Å; L411-L415 PolarHBondContact O-N 2.65Å; L411-L415 VanDerWaalsContact O-N 3.08Å |
| 412 | C | 93.2 | Very high | 87.4 | Confident | 4 Ų | 4 | 26.5 Ų | 26.5 | 3% | 0.027 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.2 | -39.6 | 173.7 | -66.7 | 0 | 0 | 0 | 0 | 111.6 | F274 Q277 L278 T408 N409 W410 L415 V416 | F274-C412 WeakPolarHBondContact CD1-SG 3.24Å; F274-C412 WeakPolarHBondContact CE1-SG 2.96Å; Q277-C412 HydrophobicContact CB-CB 3.55Å; Q277-C412 HydrophobicContact CG-CB 4.16Å; L278-C412 HydrophobicContact CD2-CB 4.32Å; L278-C412 HydrophobicContact CG-CB 4.44Å; T408-C412 PolarHBondContact O-N 2.84Å; T408-C412 PolarHBondContact O-SG 2.91Å; N409-C412 PolarHBondContact O-N 2.94Å; W410-C412 VanDerWaalsContact C-N 3.35Å; W410-C412 PolarHBondContact O-N 3.44Å; C412-L415 WeakPolarHBondContact O-CB 3.47Å; C412-L415 PolarHBondContact O-N 2.93Å; C412-V416 WeakPolarHBondContact O-CG2 3.42Å; C412-V416 PolarHBondContact O-N 2.94Å |
| 413 | N | 90.7 | Very high | 87.7 | Confident | 2 Ų | 2 | 27.9 Ų | 27.9 | 1% | 0.011 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -62.7 | -42 | 176.1 | -166.6 | -38.3 | 0 | 0 | 0 | 111.4 | V67 Q277 N282 Y286 N409 W410 L411 L415 V416 G417 | V67-N413 HydrophobicContact CG1-CB 3.53Å; V67-N413 VanDerWaalsContact CG1-CG 3.46Å; V67-N413 VanDerWaalsContact CG1-OD1 3.31Å; V67-N413 WeakPolarHBondContact CG1-OD1 3.46Å; Q277-N413 PolarHBondContact OE1-ND2 3.29Å; N282-N413 PolarHBondContact ND2-ND2 3.21Å; Y286-N413 PolarHBondContact OH-ND2 3.05Å; Y286-N413 VanDerWaalsContact OH-ND2 3.12Å; Y286-N413 PolarHBondContact OH-OD1 2.79Å; N409-N413 PolarHBondContact O-N 3.44Å; W410-N413 WeakPolarHBondContact O-CB 3.2Å; W410-N413 PolarHBondContact O-N 3.33Å; W410-N413 VanDerWaalsContact O-N 3.13Å; L411-N413 VanDerWaalsContact C-N 3.29Å; L411-N413 PolarHBondContact O-N 2.99Å; N413-L415 VanDerWaalsContact C-N 3.31Å; N413-L415 PolarHBondContact O-N 2.86Å; N413-V416 PolarHBondContact O-N 3.19Å; N413-G417 PolarHBondContact O-N 3.06Å |
| 414 | I | 89.1 | Confident | 87.9 | Confident | 20 Ų | 20 | 29.5 Ų | 29.5 | 10% | 0.103 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -57.8 | -47 | 174.9 | -64.8 | 170.1 | 0 | 0 | 0 | 110.1 | V67 I68 L71 W410 L411 V416 G417 L418 | V67-I414 HydrophobicContact CB-CG1 4.03Å; V67-I414 HydrophobicContact CG1-CB 4.39Å; V67-I414 HydrophobicContact CG1-CG1 3.57Å; I68-I414 HydrophobicContact CG1-CD1 4.02Å; I68-I414 HydrophobicContact CG1-CG1 4.23Å; I68-I414 HydrophobicContact CG1-CG2 4.48Å; L71-I414 HydrophobicContact CB-CD1 3.99Å; L71-I414 HydrophobicContact CD2-CD1 3.75Å; L71-I414 HydrophobicContact CG-CD1 4.5Å; W410-I414 WeakPolarHBondContact O-CG1 2.97Å; W410-I414 PolarHBondContact O-N 3.03Å; L411-I414 PolarHBondContact O-N 2.99Å; I414-V416 VanDerWaalsContact C-N 3.35Å; I414-V416 PolarHBondContact O-N 3.17Å; I414-G417 PolarHBondContact O-N 3.04Å; I414-L418 HydrophobicContact CG2-CD1 3.83Å; I414-L418 HydrophobicContact CG2-CG 4.34Å; I414-L418 WeakPolarHBondContact O-CB 3.19Å; I414-L418 WeakPolarHBondContact O-CG 3.43Å; I414-L418 PolarHBondContact O-N 3Å |
| 415 | L | 89 | Confident | 87.7 | Confident | 86 Ų | 86 | 31.8 Ų | 31.8 | 45% | 0.45 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -58.3 | -46.7 | 178 | -67.4 | 174.3 | 0 | 0 | 0 | 111.2 | L411 C412 N413 L418 L419 | L411-L415 WeakPolarHBondContact O-CG 3.43Å; L411-L415 PolarHBondContact O-N 2.65Å; L411-L415 VanDerWaalsContact O-N 3.08Å; C412-L415 WeakPolarHBondContact O-CB 3.47Å; C412-L415 PolarHBondContact O-N 2.93Å; N413-L415 VanDerWaalsContact C-N 3.31Å; N413-L415 PolarHBondContact O-N 2.86Å; L415-L418 PolarHBondContact O-N 2.78Å; L415-L419 HydrophobicContact CB-CD1 4.4Å; L415-L419 WeakPolarHBondContact O-CB 3.44Å; L415-L419 WeakPolarHBondContact O-CG 2.96Å; L415-L419 PolarHBondContact O-N 2.62Å |
| 416 | V | 88.1 | Confident | 87.5 | Confident | 4 Ų | 4 | 38.5 Ų | 38.5 | 2% | 0.024 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -66 | -44.6 | 178.7 | 177.6 | 0 | 0 | 0 | 0 | 111.6 | L278 N282 C412 N413 I414 L418 L419 F420 F435 | L278-V416 HydrophobicContact CD2-CG2 3.67Å; N282-V416 HydrophobicContact CB-CG1 3.9Å; C412-V416 WeakPolarHBondContact O-CG2 3.42Å; C412-V416 PolarHBondContact O-N 2.94Å; N413-V416 PolarHBondContact O-N 3.19Å; I414-V416 VanDerWaalsContact C-N 3.35Å; I414-V416 PolarHBondContact O-N 3.17Å; V416-L418 VanDerWaalsContact C-N 3.3Å; V416-L418 PolarHBondContact O-N 3.34Å; V416-L419 PolarHBondContact O-N 3.36Å; V416-F420 HydrophobicContact CG1-CB 4.27Å; V416-F420 WeakPolarHBondContact O-CB 3.37Å; V416-F420 PolarHBondContact O-N 3.29Å; V416-F435 HydrophobicContact CG1-CE1 4.14Å; V416-F435 HydrophobicContact CG1-CZ 4.27Å; V416-F435 HydrophobicContact CG2-CE1 3.93Å |
| 417 | G | 82.1 | Confident | 87.6 | Confident | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61.4 | -35.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y287 N413 I414 | Y287-G417 PolarHBondContact OH-O 2.77Å; N413-G417 PolarHBondContact O-N 3.06Å; I414-G417 PolarHBondContact O-N 3.04Å |
| 418 | L | 84.5 | Confident | 87.4 | Confident | 71 Ų | 71 | 44.4 Ų | 44.4 | 37% | 0.372 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -81.3 | -44 | 176.6 | -68.4 | 176.4 | 0 | 0 | 0 | 112.7 | T64 I414 L415 V416 | T64-L418 HydrophobicContact CG2-CD2 3.51Å; T64-L418 HydrophobicContact CG2-CG 3.81Å; I414-L418 HydrophobicContact CG2-CD1 3.83Å; I414-L418 HydrophobicContact CG2-CG 4.34Å; I414-L418 WeakPolarHBondContact O-CB 3.19Å; I414-L418 WeakPolarHBondContact O-CG 3.43Å; I414-L418 PolarHBondContact O-N 3Å; L415-L418 PolarHBondContact O-N 2.78Å; V416-L418 VanDerWaalsContact C-N 3.3Å; V416-L418 PolarHBondContact O-N 3.34Å |
| 419 | L | 84.4 | Confident | 87 | Confident | 96 Ų | 96 | 43.4 Ų | 43.4 | 50% | 0.503 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -86 | -30.8 | -169.4 | -62.4 | 176.1 | 0 | 0 | 0 | 113.1 | L415 V416 Q422 L423 | L415-L419 HydrophobicContact CB-CD1 4.4Å; L415-L419 WeakPolarHBondContact O-CB 3.44Å; L415-L419 WeakPolarHBondContact O-CG 2.96Å; L415-L419 PolarHBondContact O-N 2.62Å; V416-L419 PolarHBondContact O-N 3.36Å; L419-Q422 WeakPolarHBondContact O-CB 3.38Å; L419-Q422 PolarHBondContact O-N 2.61Å; L419-Q422 VanDerWaalsContact O-N 3.09Å; L419-L423 WeakPolarHBondContact O-CG 3.47Å; L419-L423 PolarHBondContact O-N 3.45Å |
| 420 | F | 85.1 | Confident | 86.9 | Confident | 1 Ų | 1 | 48 Ų | 48 | 0% | 0.004 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.5 | -46.5 | -174 | -176.8 | -92.3 | 0 | 0 | 0 | 113.4 | Y287 V416 Q422 L423 L424 F432 F435 | Y287-F420 AromaticContact CD2-CD1 3.34Å; Y287-F420 HydrophobicContact CD2-CD1 3.34Å; Y287-F420 AromaticContact CD2-CE1 3.72Å; Y287-F420 HydrophobicContact CD2-CE1 3.72Å; Y287-F420 HydrophobicContact CD2-CG 4.38Å; Y287-F420 HydrophobicContact CE2-CB 4.49Å; Y287-F420 AromaticContact CE2-CD1 3.79Å; Y287-F420 HydrophobicContact CE2-CD1 3.79Å; Y287-F420 HydrophobicContact CG-CD1 4.18Å; Y287-F420 HydrophobicContact CG-CE1 4.24Å; V416-F420 HydrophobicContact CG1-CB 4.27Å; V416-F420 WeakPolarHBondContact O-CB 3.37Å; V416-F420 PolarHBondContact O-N 3.29Å; F420-Q422 VanDerWaalsContact C-N 3.26Å; F420-Q422 PolarHBondContact O-N 3.49Å; F420-L423 PolarHBondContact O-N 3.49Å; F420-L424 PolarHBondContact O-N 2.51Å; F420-F432 HydrophobicContact CE2-CD1 4.25Å; F420-F432 AromaticContact CE2-CE1 3.73Å; F420-F432 HydrophobicContact CE2-CE1 3.73Å; F420-F432 HydrophobicContact CE2-CE2 4.25Å; F420-F432 AromaticContact CE2-CZ 3.74Å; F420-F432 HydrophobicContact CE2-CZ 3.74Å; F420-F432 HydrophobicContact CZ-CE1 4.01Å; F420-F432 HydrophobicContact CZ-CE2 4.01Å; F420-F432 AromaticContact CZ-CZ 3.54Å; F420-F432 HydrophobicContact CZ-CZ 3.54Å; F420-F435 AromaticContact CD2-CE2 3.75Å; F420-F435 HydrophobicContact CD2-CE2 3.75Å; F420-F435 AromaticContact CD2-CZ 3.78Å; F420-F435 HydrophobicContact CD2-CZ 3.78Å; F420-F435 HydrophobicContact CE2-CE2 4.19Å |
| 421 | P | 81.2 | Confident | 86.8 | Confident | 26 Ų | 26 | 48 Ų | 48 | 17% | 0.169 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.7 | -33.7 | 174.4 | -24.3 | 35.9 | 0 | 0 | 0 | 113.3 | Y287 L424 A425 | Y287-P421 HydrophobicContact CE1-CG 3.91Å; Y287-P421 HydrophobicContact CE2-CG 3.87Å; Y287-P421 VanDerWaalsContact CZ-CG 3.43Å; Y287-P421 VanDerWaalsContact OH-CG 3.28Å; Y287-P421 WeakPolarHBondContact OH-CG 3.45Å; P421-L424 PolarHBondContact O-N 2.94Å; P421-A425 WeakPolarHBondContact O-CB 3.42Å; P421-A425 PolarHBondContact O-N 3.08Å |
| 422 | Q | 84.7 | Confident | 86.8 | Confident | 73 Ų | 73 | 43.9 Ų | 43.9 | 34% | 0.341 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -70.3 | -41.6 | 177.3 | -55.8 | -57.8 | -41.9 | 0 | 0 | 111 | L419 F420 L424 A425 L426 | L419-Q422 WeakPolarHBondContact O-CB 3.38Å; L419-Q422 PolarHBondContact O-N 2.61Å; L419-Q422 VanDerWaalsContact O-N 3.09Å; F420-Q422 VanDerWaalsContact C-N 3.26Å; F420-Q422 PolarHBondContact O-N 3.49Å; Q422-L424 VanDerWaalsContact C-N 3.33Å; Q422-L424 PolarHBondContact O-N 2.99Å; Q422-A425 PolarHBondContact O-N 3.2Å; Q422-L426 WeakPolarHBondContact O-CB 3.43Å; Q422-L426 VanDerWaalsContact O-CG 3.24Å; Q422-L426 WeakPolarHBondContact O-CG 3.49Å; Q422-L426 PolarHBondContact O-N 3.46Å |
| 423 | L | 86.5 | Confident | 86.9 | Confident | 43 Ų | 43 | 46.4 Ų | 46.4 | 23% | 0.225 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -59.9 | -45 | 172.8 | -70.6 | 171.9 | 0 | 0 | 0 | 110.8 | L419 F420 A425 L426 I427 A431 P434 F435 | L419-L423 WeakPolarHBondContact O-CG 3.47Å; L419-L423 PolarHBondContact O-N 3.45Å; F420-L423 PolarHBondContact O-N 3.49Å; L423-A425 VanDerWaalsContact C-N 3.31Å; L423-A425 PolarHBondContact O-N 3.44Å; L423-L426 PolarHBondContact O-N 3.11Å; L423-I427 HydrophobicContact CB-CG1 4.48Å; L423-I427 HydrophobicContact CD2-CD1 4.16Å; L423-I427 WeakPolarHBondContact O-CG1 3.28Å; L423-I427 PolarHBondContact O-N 3.09Å; L423-A431 HydrophobicContact CB-CB 4.09Å; L423-P434 HydrophobicContact CD1-CG 4.43Å; L423-F435 HydrophobicContact CD1-CE2 4.12Å |
| 424 | L | 84.5 | Confident | 87.1 | Confident | 46 Ų | 46 | 49 Ų | 49 | 24% | 0.241 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 176.7 | -170.8 | 63.7 | 0 | 0 | 0 | 111.9 | F420 P421 Q422 D428 A431 | F420-L424 PolarHBondContact O-N 2.51Å; P421-L424 PolarHBondContact O-N 2.94Å; Q422-L424 VanDerWaalsContact C-N 3.33Å; Q422-L424 PolarHBondContact O-N 2.99Å; L424-D428 WeakPolarHBondContact O-CA 3.49Å; L424-D428 PolarHBondContact O-N 3.39Å; L424-A431 HydrophobicContact CB-CB 4.4Å; L424-A431 HydrophobicContact CD1-CB 4.27Å |
| 425 | A | 82.9 | Confident | 87.4 | Confident | 70 Ų | 70 | 48.6 Ų | 48.6 | 58% | 0.579 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -69.8 | -33.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | P421 Q422 L423 | P421-A425 WeakPolarHBondContact O-CB 3.42Å; P421-A425 PolarHBondContact O-N 3.08Å; Q422-A425 PolarHBondContact O-N 3.2Å; L423-A425 VanDerWaalsContact C-N 3.31Å; L423-A425 PolarHBondContact O-N 3.44Å |
| 426 | L | 87.4 | Confident | 87.7 | Confident | 141 Ų | 141 | 45.7 Ų | 45.7 | 74% | 0.738 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -88.8 | -40.8 | -174.6 | -69.6 | 171.9 | 0 | 0 | 0 | 113.5 | Q422 L423 | Q422-L426 WeakPolarHBondContact O-CB 3.43Å; Q422-L426 VanDerWaalsContact O-CG 3.24Å; Q422-L426 WeakPolarHBondContact O-CG 3.49Å; Q422-L426 PolarHBondContact O-N 3.46Å; L423-L426 PolarHBondContact O-N 3.11Å |
| 427 | I | 89.7 | Confident | 88.2 | Confident | 67 Ų | 67 | 48.6 Ų | 48.6 | 34% | 0.344 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -126 | 5.2 | -171.8 | 62.6 | 168.7 | 0 | 0 | 0 | 113.7 | L423 C429 F430 | L423-I427 HydrophobicContact CB-CG1 4.48Å; L423-I427 HydrophobicContact CD2-CD1 4.16Å; L423-I427 WeakPolarHBondContact O-CG1 3.28Å; L423-I427 PolarHBondContact O-N 3.09Å; I427-C429 PolarHBondContact O-N 3.22Å; I427-F430 HydrophobicContact CB-CB 4.27Å; I427-F430 HydrophobicContact CD1-CB 4.19Å; I427-F430 WeakPolarHBondContact CD1-O 3.47Å; I427-F430 HydrophobicContact CG1-CB 4.42Å; I427-F430 PolarHBondContact O-N 3.39Å |
| 428 | D | 85.1 | Confident | 88.8 | Confident | 63 Ų | 63 | 50.5 Ų | 50.5 | 34% | 0.337 | 28% | 0.282 | S | S | . | . | G | 310 helix | trans | 51 | -120.1 | 168.5 | -176.7 | 34.1 | 0 | 0 | 0 | 112.3 | K355 L424 F430 A431 | K355-D428 IonicContact NZ-OD2 2.95Å; K355-D428 PolarHBondContact NZ-OD2 2.96Å; L424-D428 WeakPolarHBondContact O-CA 3.49Å; L424-D428 PolarHBondContact O-N 3.39Å; D428-F430 PolarHBondContact O-N 3.4Å; D428-A431 VanDerWaalsContact O-CB 3.28Å; D428-A431 WeakPolarHBondContact O-CB 3.34Å; D428-A431 PolarHBondContact O-N 2.83Å |
| 429 | C | 83.6 | Confident | 89.5 | Confident | 7 Ų | 7 | 47.1 Ų | 47.1 | 5% | 0.047 | 26% | 0.264 | C | S | . | . | G | 310 helix | trans | -57.5 | -19.7 | -179.6 | 59.6 | 0 | 0 | 0 | 0 | 114.8 | L351 I427 A431 | L351-C429 HydrophobicContact CB-CB 3.72Å; L351-C429 HydrophobicContact CD1-CB 4.38Å; I427-C429 PolarHBondContact O-N 3.22Å; C429-A431 VanDerWaalsContact C-N 3.34Å |
| 430 | F | 89.9 | Confident | 90.1 | Very high | 98 Ų | 98 | 46.3 Ų | 46.3 | 43% | 0.43 | 26% | 0.259 | S | S | . | . | G | 310 helix | trans | -88.1 | 3.3 | 178.3 | -58.5 | -73.5 | 0 | 0 | 0 | 113.7 | T348 I427 D428 F432 V433 | T348-F430 HydrophobicContact CG2-CD1 4.34Å; I427-F430 HydrophobicContact CB-CB 4.27Å; I427-F430 HydrophobicContact CD1-CB 4.19Å; I427-F430 WeakPolarHBondContact CD1-O 3.47Å; I427-F430 HydrophobicContact CG1-CB 4.42Å; I427-F430 PolarHBondContact O-N 3.39Å; D428-F430 PolarHBondContact O-N 3.4Å; F430-F432 PolarHBondContact O-N 3.4Å; F430-V433 HydrophobicContact CB-CG2 3.98Å; F430-V433 HydrophobicContact CD1-CG2 4.04Å; F430-V433 WeakPolarHBondContact O-CB 3.11Å; F430-V433 WeakPolarHBondContact O-CG2 3.39Å; F430-V433 PolarHBondContact O-N 3.41Å |
| 431 | A | 89.2 | Confident | 90.8 | Very high | 1 Ų | 1 | 50.8 Ų | 50.8 | 1% | 0.008 | 28% | 0.282 | C | S | . | . | G | 310 helix | trans | -55.6 | -25 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | L423 L424 D428 C429 P434 F435 | L423-A431 HydrophobicContact CB-CB 4.09Å; L424-A431 HydrophobicContact CB-CB 4.4Å; L424-A431 HydrophobicContact CD1-CB 4.27Å; D428-A431 VanDerWaalsContact O-CB 3.28Å; D428-A431 WeakPolarHBondContact O-CB 3.34Å; D428-A431 PolarHBondContact O-N 2.83Å; C429-A431 VanDerWaalsContact C-N 3.34Å; A431-P434 WeakPolarHBondContact O-CD 3.41Å; A431-F435 WeakPolarHBondContact O-CD2 3.37Å; A431-F435 WeakPolarHBondContact O-CE2 3.29Å |
| 432 | F | 92.1 | Very high | 91.6 | Very high | 2 Ų | 2 | 49.8 Ų | 49.8 | 1% | 0.009 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -85 | -11.4 | 177.6 | -72.4 | -78.6 | 0 | 0 | 0 | 114.6 | V284 L291 L344 F347 F420 F430 F435 I436 | V284-F432 HydrophobicContact CG2-CE1 4.15Å; V284-F432 HydrophobicContact CG2-CZ 4.21Å; L291-F432 HydrophobicContact CD1-CE2 4.04Å; L291-F432 HydrophobicContact CD2-CE2 4.06Å; L291-F432 HydrophobicContact CD2-CZ 3.96Å; L344-F432 HydrophobicContact CD1-CD1 4.16Å; L344-F432 HydrophobicContact CD2-CD1 3.67Å; L344-F432 HydrophobicContact CD2-CE1 4.06Å; L344-F432 HydrophobicContact CD2-CG 4.17Å; F347-F432 HydrophobicContact CD1-CD2 4.07Å; F347-F432 HydrophobicContact CD1-CE2 4.17Å; F347-F432 AromaticContact CE1-CD2 3.95Å; F347-F432 HydrophobicContact CE1-CD2 3.95Å; F347-F432 AromaticContact CE1-CE2 3.66Å; F347-F432 HydrophobicContact CE1-CE2 3.66Å; F347-F432 HydrophobicContact CE1-CZ 4.41Å; F420-F432 HydrophobicContact CE2-CD1 4.25Å; F420-F432 AromaticContact CE2-CE1 3.73Å; F420-F432 HydrophobicContact CE2-CE1 3.73Å; F420-F432 HydrophobicContact CE2-CE2 4.25Å; F420-F432 AromaticContact CE2-CZ 3.74Å; F420-F432 HydrophobicContact CE2-CZ 3.74Å; F420-F432 HydrophobicContact CZ-CE1 4.01Å; F420-F432 HydrophobicContact CZ-CE2 4.01Å; F420-F432 AromaticContact CZ-CZ 3.54Å; F420-F432 HydrophobicContact CZ-CZ 3.54Å; F430-F432 PolarHBondContact O-N 3.4Å; F432-F435 HydrophobicContact CD1-CD2 4.45Å; F432-F435 WeakPolarHBondContact O-CB 3.41Å; F432-F435 PolarHBondContact O-N 3.44Å; F432-F435 VanDerWaalsContact O-N 3.11Å; F432-I436 PolarHBondContact O-N 3Å |
| 433 | V | 94.7 | Very high | 92.2 | Very high | 57 Ų | 57 | 47.6 Ų | 47.6 | 35% | 0.345 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -58.4 | -44.6 | -178.3 | 174.7 | 0 | 0 | 0 | 0 | 113.2 | T348 F430 F435 I436 C437 | T348-V433 HydrophobicContact CG2-CG2 3.94Å; F430-V433 HydrophobicContact CB-CG2 3.98Å; F430-V433 HydrophobicContact CD1-CG2 4.04Å; F430-V433 WeakPolarHBondContact O-CB 3.11Å; F430-V433 WeakPolarHBondContact O-CG2 3.39Å; F430-V433 PolarHBondContact O-N 3.41Å; V433-F435 PolarHBondContact O-N 2.89Å; V433-I436 WeakPolarHBondContact O-CB 3.3Å; V433-I436 PolarHBondContact O-N 2.63Å; V433-I436 VanDerWaalsContact O-N 3.17Å; V433-C437 PolarHBondContact O-N 3.18Å; V433-C437 VanDerWaalsContact O-N 3.1Å; V433-C437 PolarHBondContact O-SG 3.43Å |
| 434 | P | 94.9 | Very high | 92.8 | Very high | 56 Ų | 56 | 49.7 Ų | 49.7 | 36% | 0.364 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -58.1 | -37.3 | 175.9 | -25.6 | 35.8 | 0 | 0 | 0 | 113 | L423 A431 C437 V438 | L423-P434 HydrophobicContact CD1-CG 4.43Å; A431-P434 WeakPolarHBondContact O-CD 3.41Å; P434-C437 PolarHBondContact O-N 3.11Å; P434-V438 WeakPolarHBondContact O-CG2 3.5Å; P434-V438 PolarHBondContact O-N 2.79Å; P434-V438 VanDerWaalsContact O-N 3.09Å |
| 435 | F | 95.1 | Very high | 93.4 | Very high | 13 Ų | 13 | 49.6 Ų | 49.6 | 6% | 0.057 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -70.4 | -36.9 | 178.9 | -56.7 | -89.9 | 0 | 0 | 0 | 111.7 | L278 G280 L344 V416 F420 L423 A431 F432 V433 V438 L439 | L278-F435 WeakPolarHBondContact O-CD1 3.3Å; G280-F435 VanDerWaalsContact N-CD1 3.34Å; L344-F435 HydrophobicContact CD1-CB 4.23Å; V416-F435 HydrophobicContact CG1-CE1 4.14Å; V416-F435 HydrophobicContact CG1-CZ 4.27Å; V416-F435 HydrophobicContact CG2-CE1 3.93Å; F420-F435 AromaticContact CD2-CE2 3.75Å; F420-F435 HydrophobicContact CD2-CE2 3.75Å; F420-F435 AromaticContact CD2-CZ 3.78Å; F420-F435 HydrophobicContact CD2-CZ 3.78Å; F420-F435 HydrophobicContact CE2-CE2 4.19Å; L423-F435 HydrophobicContact CD1-CE2 4.12Å; A431-F435 WeakPolarHBondContact O-CD2 3.37Å; A431-F435 WeakPolarHBondContact O-CE2 3.29Å; F432-F435 HydrophobicContact CD1-CD2 4.45Å; F432-F435 WeakPolarHBondContact O-CB 3.41Å; F432-F435 PolarHBondContact O-N 3.44Å; F432-F435 VanDerWaalsContact O-N 3.11Å; V433-F435 PolarHBondContact O-N 2.89Å; F435-V438 PolarHBondContact O-N 2.92Å; F435-L439 WeakPolarHBondContact O-CB 3.5Å; F435-L439 VanDerWaalsContact O-CG 3.31Å; F435-L439 WeakPolarHBondContact O-CG 3.39Å; F435-L439 PolarHBondContact O-N 3.17Å |
| 436 | I | 96.9 | Very high | 94.1 | Very high | 25 Ų | 25 | 46.2 Ų | 46.2 | 13% | 0.128 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.8 | -47.1 | 172 | -69.3 | 166.3 | 0 | 0 | 0 | 110.6 | L341 L344 A345 F432 V433 V438 L439 I440 | L341-I436 HydrophobicContact CD1-CB 4.4Å; L341-I436 HydrophobicContact CD1-CG2 3.7Å; L344-I436 HydrophobicContact CB-CD1 4.31Å; L344-I436 HydrophobicContact CB-CG1 3.85Å; A345-I436 HydrophobicContact CB-CD1 4.32Å; F432-I436 PolarHBondContact O-N 3Å; V433-I436 WeakPolarHBondContact O-CB 3.3Å; V433-I436 PolarHBondContact O-N 2.63Å; V433-I436 VanDerWaalsContact O-N 3.17Å; I436-V438 VanDerWaalsContact C-N 3.34Å; I436-V438 PolarHBondContact O-N 3.09Å; I436-L439 PolarHBondContact O-N 3.43Å; I436-I440 HydrophobicContact CG2-CD1 4.25Å; I436-I440 WeakPolarHBondContact O-CG1 3.23Å; I436-I440 PolarHBondContact O-N 3.32Å |
| 437 | C | 97.1 | Very high | 94.5 | Very high | 65 Ų | 65 | 41.3 Ų | 41.3 | 44% | 0.439 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -59.9 | -44.3 | 177.3 | -65.1 | 0 | 0 | 0 | 0 | 111.8 | V433 P434 I440 I441 | V433-C437 PolarHBondContact O-N 3.18Å; V433-C437 VanDerWaalsContact O-N 3.1Å; V433-C437 PolarHBondContact O-SG 3.43Å; P434-C437 PolarHBondContact O-N 3.11Å; C437-I440 PolarHBondContact O-N 3.27Å; C437-I441 WeakPolarHBondContact O-CG1 3.37Å; C437-I441 PolarHBondContact O-N 2.91Å; C437-I441 VanDerWaalsContact O-N 3.14Å |
| 438 | V | 96.3 | Very high | 94.7 | Very high | 40 Ų | 40 | 41.6 Ų | 41.6 | 24% | 0.242 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.2 | -42.5 | 177 | 173.9 | 0 | 0 | 0 | 0 | 111.4 | L278 P434 F435 I436 I440 I441 V442 | L278-V438 HydrophobicContact CB-CB 4.37Å; L278-V438 HydrophobicContact CB-CG1 3.67Å; L278-V438 HydrophobicContact CD1-CG1 4.18Å; P434-V438 WeakPolarHBondContact O-CG2 3.5Å; P434-V438 PolarHBondContact O-N 2.79Å; P434-V438 VanDerWaalsContact O-N 3.09Å; F435-V438 PolarHBondContact O-N 2.92Å; I436-V438 VanDerWaalsContact C-N 3.34Å; I436-V438 PolarHBondContact O-N 3.09Å; V438-I440 VanDerWaalsContact C-N 3.35Å; V438-I440 PolarHBondContact O-N 3.43Å; V438-I441 PolarHBondContact O-N 3.31Å; V438-V442 HydrophobicContact CG1-CG2 4Å; V438-V442 WeakPolarHBondContact O-CB 3.35Å; V438-V442 VanDerWaalsContact O-CG2 3.25Å; V438-V442 WeakPolarHBondContact O-CG2 3.5Å; V438-V442 PolarHBondContact O-N 2.99Å |
| 439 | L | 97.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.3 | -42.3 | 177.3 | -75.5 | 172.2 | 0 | 0 | 0 | 112.2 | F337 C340 L341 L344 F435 I436 I441 V442 I443 | F337-L439 HydrophobicContact CB-CD2 4.47Å; F337-L439 HydrophobicContact CD1-CD2 3.54Å; F337-L439 HydrophobicContact CE1-CD2 4.18Å; F337-L439 HydrophobicContact CG-CD2 4.36Å; C340-L439 HydrophobicContact CB-CD1 4.12Å; C340-L439 HydrophobicContact CB-CD2 4.4Å; L341-L439 HydrophobicContact CB-CB 4.24Å; L341-L439 HydrophobicContact CB-CD1 4.34Å; L341-L439 HydrophobicContact CD1-CB 4.08Å; L344-L439 HydrophobicContact CD1-CD1 3.98Å; F435-L439 WeakPolarHBondContact O-CB 3.5Å; F435-L439 VanDerWaalsContact O-CG 3.31Å; F435-L439 WeakPolarHBondContact O-CG 3.39Å; F435-L439 PolarHBondContact O-N 3.17Å; I436-L439 PolarHBondContact O-N 3.43Å; L439-I441 PolarHBondContact O-N 3.18Å; L439-V442 PolarHBondContact O-N 2.96Å; L439-I443 WeakPolarHBondContact O-CB 3.49Å; L439-I443 WeakPolarHBondContact O-CD1 3.48Å; L439-I443 WeakPolarHBondContact O-CG1 3.4Å; L439-I443 PolarHBondContact O-N 3Å |
| 440 | I | 98.4 | Very high | 95.6 | Very high | 78 Ų | 78 | 40.1 Ų | 40.1 | 40% | 0.4 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -58.6 | -49.4 | 175 | -66.9 | 166.4 | 0 | 0 | 0 | 110.3 | L341 I436 C437 V438 V442 I443 I444 | L341-I440 HydrophobicContact CD1-CD1 4.34Å; L341-I440 HydrophobicContact CD1-CG1 3.75Å; L341-I440 HydrophobicContact CD2-CG1 3.77Å; L341-I440 HydrophobicContact CG-CG1 4.44Å; I436-I440 HydrophobicContact CG2-CD1 4.25Å; I436-I440 WeakPolarHBondContact O-CG1 3.23Å; I436-I440 PolarHBondContact O-N 3.32Å; C437-I440 PolarHBondContact O-N 3.27Å; V438-I440 VanDerWaalsContact C-N 3.35Å; V438-I440 PolarHBondContact O-N 3.43Å; I440-V442 PolarHBondContact O-N 2.93Å; I440-I443 PolarHBondContact O-N 2.76Å; I440-I444 HydrophobicContact CG2-CD1 3.86Å; I440-I444 VanDerWaalsContact O-CG1 3.3Å; I440-I444 WeakPolarHBondContact O-CG1 3.32Å; I440-I444 PolarHBondContact O-N 2.99Å |
| 441 | I | 98.2 | Very high | 95.7 | Very high | 95 Ų | 95 | 35.7 Ų | 35.7 | 49% | 0.487 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.3 | -48.2 | 179.3 | -66.4 | 166.1 | 0 | 0 | 0 | 110.3 | C437 V438 L439 I443 I444 L445 | C437-I441 WeakPolarHBondContact O-CG1 3.37Å; C437-I441 PolarHBondContact O-N 2.91Å; C437-I441 VanDerWaalsContact O-N 3.14Å; V438-I441 PolarHBondContact O-N 3.31Å; L439-I441 PolarHBondContact O-N 3.18Å; I441-I443 PolarHBondContact O-N 3.05Å; I441-I444 PolarHBondContact O-N 3.33Å; I441-L445 HydrophobicContact CG2-CD1 3.79Å; I441-L445 HydrophobicContact CG2-CG 4.12Å; I441-L445 WeakPolarHBondContact O-CB 3.5Å; I441-L445 VanDerWaalsContact O-CG 3.26Å; I441-L445 WeakPolarHBondContact O-CG 3.2Å; I441-L445 PolarHBondContact O-N 2.79Å |
| 442 | V | 97.9 | Very high | 95.9 | Very high | 5 Ų | 5 | 38.2 Ų | 38.2 | 3% | 0.03 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -60.5 | -44.8 | -179.9 | 166.1 | 0 | 0 | 0 | 0 | 111.5 | I271 F337 V438 L439 I440 I444 L445 I446 | I271-V442 HydrophobicContact CG2-CG1 4.11Å; F337-V442 HydrophobicContact CD2-CG1 3.9Å; F337-V442 HydrophobicContact CE2-CG1 3.78Å; F337-V442 HydrophobicContact CG-CG1 4.34Å; F337-V442 HydrophobicContact CZ-CG1 4.12Å; V438-V442 HydrophobicContact CG1-CG2 4Å; V438-V442 WeakPolarHBondContact O-CB 3.35Å; V438-V442 VanDerWaalsContact O-CG2 3.25Å; V438-V442 WeakPolarHBondContact O-CG2 3.5Å; V438-V442 PolarHBondContact O-N 2.99Å; L439-V442 PolarHBondContact O-N 2.96Å; I440-V442 PolarHBondContact O-N 2.93Å; V442-I444 VanDerWaalsContact C-N 3.32Å; V442-I444 PolarHBondContact O-N 3.43Å; V442-L445 PolarHBondContact O-N 2.73Å; V442-I446 HydrophobicContact CG1-CD1 3.65Å; V442-I446 HydrophobicContact CG1-CG1 4.32Å; V442-I446 WeakPolarHBondContact O-CB 3.26Å; V442-I446 VanDerWaalsContact O-CG1 3.26Å; V442-I446 WeakPolarHBondContact O-CG1 3.34Å; V442-I446 PolarHBondContact O-N 3.49Å |
| 443 | I | 98.2 | Very high | 95.8 | Very high | 27 Ų | 27 | 38.1 Ų | 38.1 | 14% | 0.138 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -60 | -45.1 | 177.4 | -70.9 | 163.8 | 0 | 0 | 0 | 110.4 | L334 F337 L341 L439 I440 I441 I446 A447 | L334-I443 HydrophobicContact CD2-CG2 4.07Å; F337-I443 HydrophobicContact CB-CD1 4.08Å; F337-I443 HydrophobicContact CB-CG1 3.65Å; L341-I443 HydrophobicContact CB-CD1 4.05Å; L341-I443 HydrophobicContact CD2-CD1 3.72Å; L439-I443 WeakPolarHBondContact O-CB 3.49Å; L439-I443 WeakPolarHBondContact O-CD1 3.48Å; L439-I443 WeakPolarHBondContact O-CG1 3.4Å; L439-I443 PolarHBondContact O-N 3Å; I440-I443 PolarHBondContact O-N 2.76Å; I441-I443 PolarHBondContact O-N 3.05Å; I443-I446 PolarHBondContact O-N 3.09Å; I443-A447 VanDerWaalsContact O-CB 3.24Å; I443-A447 WeakPolarHBondContact O-CB 3.39Å; I443-A447 PolarHBondContact O-N 2.9Å |
| 444 | I | 98.1 | Very high | 95.3 | Very high | 88 Ų | 88 | 38.6 Ų | 38.6 | 45% | 0.451 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.5 | -49 | 176.8 | -67.7 | 166.9 | 0 | 0 | 0 | 110.3 | I440 I441 V442 I446 A447 L448 | I440-I444 HydrophobicContact CG2-CD1 3.86Å; I440-I444 VanDerWaalsContact O-CG1 3.3Å; I440-I444 WeakPolarHBondContact O-CG1 3.32Å; I440-I444 PolarHBondContact O-N 2.99Å; I441-I444 PolarHBondContact O-N 3.33Å; V442-I444 VanDerWaalsContact C-N 3.32Å; V442-I444 PolarHBondContact O-N 3.43Å; I444-I446 PolarHBondContact O-N 3.33Å; I444-A447 PolarHBondContact O-N 3.1Å; I444-L448 HydrophobicContact CG2-CD1 3.7Å; I444-L448 HydrophobicContact CG2-CG 4.3Å; I444-L448 WeakPolarHBondContact O-CB 3.07Å; I444-L448 VanDerWaalsContact O-CG 3.27Å; I444-L448 WeakPolarHBondContact O-CG 3.35Å; I444-L448 PolarHBondContact O-N 3.23Å |
| 445 | L | 97.4 | Very high | 94.7 | Very high | 43 Ų | 43 | 40 Ų | 40 | 23% | 0.225 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.5 | -40.9 | -179.2 | -67.8 | 179.7 | 0 | 0 | 0 | 112.1 | F267 I271 I441 V442 L448 Y449 | F267-L445 HydrophobicContact CZ-CD2 4.4Å; I271-L445 HydrophobicContact CD1-CB 3.83Å; I271-L445 HydrophobicContact CG1-CB 4.15Å; I271-L445 HydrophobicContact CG1-CD1 4.16Å; I271-L445 HydrophobicContact CG2-CB 3.84Å; I271-L445 HydrophobicContact CG2-CD1 4.46Å; I441-L445 HydrophobicContact CG2-CD1 3.79Å; I441-L445 HydrophobicContact CG2-CG 4.12Å; I441-L445 WeakPolarHBondContact O-CB 3.5Å; I441-L445 VanDerWaalsContact O-CG 3.26Å; I441-L445 WeakPolarHBondContact O-CG 3.2Å; I441-L445 PolarHBondContact O-N 2.79Å; V442-L445 PolarHBondContact O-N 2.73Å; L445-L448 PolarHBondContact O-N 3.01Å; L445-Y449 HydrophobicContact CB-CD2 4.31Å; L445-Y449 HydrophobicContact CD2-CD2 3.82Å; L445-Y449 HydrophobicContact CD2-CE2 3.53Å; L445-Y449 WeakPolarHBondContact O-CB 3.21Å; L445-Y449 WeakPolarHBondContact O-CD2 3.26Å; L445-Y449 PolarHBondContact O-N 3.42Å |
| 446 | I | 97.2 | Very high | 94.1 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65 | -43.3 | 174.1 | -69.5 | 173.2 | 0 | 0 | 0 | 110.6 | I271 R330 L333 L334 F337 V442 I443 I444 L448 L450 | I271-I446 HydrophobicContact CG2-CD1 4.26Å; I271-I446 HydrophobicContact CG2-CG1 3.62Å; R330-I446 HydrophobicContact CG-CG2 4.33Å; L333-I446 HydrophobicContact CB-CD1 4.15Å; L333-I446 HydrophobicContact CB-CG2 4.42Å; L334-I446 HydrophobicContact CD2-CB 4.06Å; L334-I446 HydrophobicContact CD2-CG2 3.68Å; L334-I446 HydrophobicContact CG-CG2 3.77Å; F337-I446 HydrophobicContact CD2-CD1 3.57Å; F337-I446 HydrophobicContact CE2-CD1 3.51Å; V442-I446 HydrophobicContact CG1-CD1 3.65Å; V442-I446 HydrophobicContact CG1-CG1 4.32Å; V442-I446 WeakPolarHBondContact O-CB 3.26Å; V442-I446 VanDerWaalsContact O-CG1 3.26Å; V442-I446 WeakPolarHBondContact O-CG1 3.34Å; V442-I446 PolarHBondContact O-N 3.49Å; I443-I446 PolarHBondContact O-N 3.09Å; I444-I446 PolarHBondContact O-N 3.33Å; I446-L448 VanDerWaalsContact C-N 3.26Å; I446-L448 PolarHBondContact O-N 3.35Å; I446-L450 HydrophobicContact CG2-CB 4.07Å; I446-L450 HydrophobicContact CG2-CD2 3.84Å; I446-L450 WeakPolarHBondContact O-CB 3.36Å; I446-L450 PolarHBondContact O-N 3.43Å |
| 447 | A | 96.5 | Very high | 93.4 | Very high | 37 Ų | 37 | 47.1 Ų | 47.1 | 31% | 0.306 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -64.2 | -32 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | R330 L334 I443 I444 | R330-A447 PolarHBondContact NH2-O 3.3Å; L334-A447 HydrophobicContact CD2-CB 4.05Å; I443-A447 VanDerWaalsContact O-CB 3.24Å; I443-A447 WeakPolarHBondContact O-CB 3.39Å; I443-A447 PolarHBondContact O-N 2.9Å; I444-A447 PolarHBondContact O-N 3.1Å |
| 448 | L | 94.1 | Very high | 92.7 | Very high | 73 Ų | 73 | 45 Ų | 45 | 38% | 0.382 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -87.9 | -42.5 | -178.8 | -66 | 176.2 | 0 | 0 | 0 | 113.3 | I444 L445 I446 | I444-L448 HydrophobicContact CG2-CD1 3.7Å; I444-L448 HydrophobicContact CG2-CG 4.3Å; I444-L448 WeakPolarHBondContact O-CB 3.07Å; I444-L448 VanDerWaalsContact O-CG 3.27Å; I444-L448 WeakPolarHBondContact O-CG 3.35Å; I444-L448 PolarHBondContact O-N 3.23Å; L445-L448 PolarHBondContact O-N 3.01Å; I446-L448 VanDerWaalsContact C-N 3.26Å; I446-L448 PolarHBondContact O-N 3.35Å |
| 449 | Y | 93.2 | Very high | 92 | Very high | 39 Ų | 39 | 46.5 Ų | 46.5 | 15% | 0.153 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -115.3 | -25.8 | -162.1 | -57.7 | -58.6 | 0 | 0 | 0 | 115.5 | W264 F267 L445 P451 I474 | W264-Y449 AromaticContact CH2-CD1 3.72Å; W264-Y449 HydrophobicContact CH2-CD1 3.72Å; W264-Y449 AromaticContact CH2-CE1 3.72Å; W264-Y449 HydrophobicContact CH2-CE1 3.72Å; W264-Y449 HydrophobicContact CH2-CG 4.24Å; W264-Y449 AromaticContact CZ2-CD1 3.44Å; W264-Y449 HydrophobicContact CZ2-CD1 3.44Å; W264-Y449 VanDerWaalsContact CZ2-CD1 3.44Å; W264-Y449 AromaticContact CZ2-CE1 3.84Å; W264-Y449 HydrophobicContact CZ2-CE1 3.84Å; W264-Y449 HydrophobicContact CZ2-CG 4.06Å; F267-Y449 HydrophobicContact CE1-CD2 4Å; F267-Y449 HydrophobicContact CE1-CE2 4.34Å; F267-Y449 HydrophobicContact CE1-CG 4.41Å; L445-Y449 HydrophobicContact CB-CD2 4.31Å; L445-Y449 HydrophobicContact CD2-CD2 3.82Å; L445-Y449 HydrophobicContact CD2-CE2 3.53Å; L445-Y449 WeakPolarHBondContact O-CB 3.21Å; L445-Y449 WeakPolarHBondContact O-CD2 3.26Å; L445-Y449 PolarHBondContact O-N 3.42Å; Y449-P451 WeakPolarHBondContact O-CD 3.3Å; Y449-I474 HydrophobicContact CE1-CD1 4.49Å; Y449-I474 HydrophobicContact CE1-CG2 3.83Å |
| 450 | L | 94.7 | Very high | 91.4 | Very high | 1 Ų | 1 | 50.7 Ų | 50.7 | 1% | 0.005 | 28% | 0.279 | C | S | . | . | trans | -79.1 | 115.9 | -177.3 | -176.2 | 66.2 | 0 | 0 | 0 | 110.5 | V268 R330 L333 L388 I446 | V268-L450 HydrophobicContact CG1-CB 4.4Å; V268-L450 HydrophobicContact CG1-CD1 3.45Å; V268-L450 VanDerWaalsContact CG1-CD1 3.45Å; R330-L450 HydrophobicContact CB-CD2 4.44Å; R330-L450 VanDerWaalsContact CD-O 3.23Å; R330-L450 WeakPolarHBondContact CD-O 3.47Å; R330-L450 PolarHBondContact NE-O 2.8Å; L333-L450 HydrophobicContact CD1-CD2 3.47Å; L333-L450 VanDerWaalsContact CD1-CD2 3.47Å; L388-L450 HydrophobicContact CD2-CD1 4.01Å; L388-L450 HydrophobicContact CD2-CD2 4.39Å; I446-L450 HydrophobicContact CG2-CB 4.07Å; I446-L450 HydrophobicContact CG2-CD2 3.84Å; I446-L450 WeakPolarHBondContact O-CB 3.36Å; I446-L450 PolarHBondContact O-N 3.43Å | ||
| 451 | P | 92.2 | Very high | 90.9 | Very high | 5 Ų | 5 | 47 Ų | 47 | 3% | 0.032 | 26% | 0.261 | C | S | . | . | trans | -69.2 | 159.7 | 170.1 | 30.1 | -35.8 | 0 | 0 | 0 | 111.9 | L392 Y449 T453 I461 F465 V477 | L392-P451 HydrophobicContact CD2-CG 4.45Å; Y449-P451 WeakPolarHBondContact O-CD 3.3Å; P451-T453 PolarHBondContact O-N 2.82Å; P451-I461 HydrophobicContact CG-CG2 4.3Å; P451-F465 HydrophobicContact CG-CE1 4.18Å; P451-F465 HydrophobicContact CG-CZ 4.28Å; P451-V477 HydrophobicContact CB-CG1 3.88Å | ||
| 452 | E | 93 | Very high | 90.3 | Very high | 53 Ų | 53 | 43.8 Ų | 43.8 | 25% | 0.248 | 24% | 0.243 | C | C | . | . | trans | -72.2 | 126.2 | 164.4 | -176.4 | 51.3 | -113.9 | 0 | 0 | 108.9 | G328 R329 R330 K454 F456 | G328-E452 WeakPolarHBondContact CA-OE1 3.43Å; G328-E452 WeakPolarHBondContact CA-OE2 3.32Å; R329-E452 VanDerWaalsContact N-CD 3.3Å; R329-E452 PolarHBondContact N-OE1 3.33Å; R329-E452 PolarHBondContact N-OE2 2.84Å; R330-E452 PolarHBondContact N-OE2 3.02Å; E452-K454 WeakPolarHBondContact OE1-CB 3.41Å; E452-K454 PolarHBondContact OE1-N 2.95Å; E452-F456 WeakPolarHBondContact O-CD2 3.49Å | ||
| 453 | T | 89.3 | Confident | 89.8 | Confident | 1 Ų | 1 | 46.2 Ų | 46.2 | 1% | 0.006 | 26% | 0.261 | C | S | . | . | trans | -105.6 | -18.5 | -176.9 | 55.5 | 0 | 0 | 0 | 0 | 112.5 | R329 L388 E391 L392 P451 G455 F456 I461 | R329-T453 WeakPolarHBondContact CG-OG1 3.35Å; L388-T453 HydrophobicContact CD1-CG2 3.91Å; E391-T453 HydrophobicContact CB-CG2 4.39Å; E391-T453 VanDerWaalsContact OE2-CB 3.3Å; E391-T453 WeakPolarHBondContact OE2-CB 3.17Å; E391-T453 PolarHBondContact OE2-OG1 2.84Å; L392-T453 HydrophobicContact CD2-CG2 3.77Å; L392-T453 HydrophobicContact CG-CG2 4.38Å; P451-T453 PolarHBondContact O-N 2.82Å; T453-G455 PolarHBondContact O-N 3.42Å; T453-F456 PolarHBondContact O-N 3.26Å; T453-F456 VanDerWaalsContact O-N 3.11Å; T453-I461 HydrophobicContact CG2-CD1 4.21Å; T453-I461 HydrophobicContact CG2-CG1 4.44Å | ||
| 454 | K | 85.8 | Confident | 89.3 | Confident | 67 Ų | 67 | 45.3 Ų | 45.3 | 29% | 0.291 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | 124.3 | -177.5 | -174.1 | -160.5 | -178.7 | -168.1 | 0 | 111 | D325 R326 G327 R329 E452 F456 | D325-K454 WeakPolarHBondContact O-CE 3.34Å; D325-K454 PolarHBondContact O-NZ 3.39Å; R326-K454 PolarHBondContact O-NZ 3.29Å; G327-K454 WeakPolarHBondContact O-CD 3.42Å; R329-K454 HydrophobicContact CG-CB 4.42Å; E452-K454 WeakPolarHBondContact OE1-CB 3.41Å; E452-K454 PolarHBondContact OE1-N 2.95Å; K454-F456 VanDerWaalsContact O-CD2 3.31Å; K454-F456 WeakPolarHBondContact O-CD2 3.33Å; K454-F456 PolarHBondContact O-N 3.33Å |
| 455 | G | 81.2 | Confident | 88.9 | Confident | 85 Ų | 85 | 41.3 Ų | 41.3 | 88% | 0.876 | 24% | 0.235 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 81.3 | -1.5 | 177 | 0 | 0 | 0 | 0 | 0 | 114 | T453 | T453-G455 PolarHBondContact O-N 3.42Š|
| 456 | F | 83.2 | Confident | 88.4 | Confident | 87 Ų | 87 | 43.1 Ų | 43.1 | 38% | 0.382 | 24% | 0.242 | S | C | . | . | trans | -100.7 | 145.1 | 176.9 | -63.9 | -78.9 | 0 | 0 | 0 | 111 | E452 T453 K454 Y460 I461 | E452-F456 WeakPolarHBondContact O-CD2 3.49Å; T453-F456 PolarHBondContact O-N 3.26Å; T453-F456 VanDerWaalsContact O-N 3.11Å; K454-F456 VanDerWaalsContact O-CD2 3.31Å; K454-F456 WeakPolarHBondContact O-CD2 3.33Å; K454-F456 PolarHBondContact O-N 3.33Å; F456-Y460 HydrophobicContact CB-CD1 3.89Å; F456-Y460 HydrophobicContact CB-CE1 4.49Å; F456-Y460 AromaticContact CD1-CD1 3.4Å; F456-Y460 HydrophobicContact CD1-CD1 3.4Å; F456-Y460 AromaticContact CD1-CE1 3.34Å; F456-Y460 HydrophobicContact CD1-CE1 3.34Å; F456-Y460 HydrophobicContact CD1-CG 4.19Å; F456-Y460 HydrophobicContact CE1-CD1 4.18Å; F456-Y460 AromaticContact CE1-CE1 3.65Å; F456-Y460 HydrophobicContact CE1-CE1 3.65Å; F456-Y460 AromaticContact CG-CD1 3.87Å; F456-Y460 HydrophobicContact CG-CD1 3.87Å; F456-Y460 AromaticContact CG-CE1 4Å; F456-Y460 HydrophobicContact CG-CE1 4Å; F456-I461 HydrophobicContact CB-CD1 3.85Å; F456-I461 HydrophobicContact CB-CG1 4.19Å; F456-I461 HydrophobicContact CG-CD1 4.4Å | ||
| 457 | N | 82.2 | Confident | 87.8 | Confident | 100 Ų | 100 | 44.6 Ų | 44.6 | 54% | 0.535 | 25% | 0.253 | S | S | . | . | trans | -76.9 | 141.1 | 173 | -175.1 | -44.7 | 0 | 0 | 0 | 109.4 | V459 Y460 I461 | N457-V459 PolarHBondContact O-N 3.27Å; N457-V459 VanDerWaalsContact O-N 3.08Å; N457-V459 WeakPolarHBondContact OD1-CG2 3.49Å; N457-V459 PolarHBondContact OD1-N 3.17Å; N457-Y460 WeakPolarHBondContact O-CA 3.39Å; N457-Y460 WeakPolarHBondContact O-CB 3.49Å; N457-Y460 PolarHBondContact O-N 2.98Å; N457-I461 PolarHBondContact O-N 3.31Å; N457-I461 VanDerWaalsContact O-N 3.17Å | ||
| 458 | P | 81.8 | Confident | 87 | Confident | 21 Ų | 21 | 44.2 Ų | 44.2 | 14% | 0.136 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -48.3 | -34 | 172.6 | -29.9 | 34.2 | 0 | 0 | 0 | 115.1 | A390 F393 T394 Y460 I461 E462 | A390-P458 WeakPolarHBondContact O-CG 3.32Å; F393-P458 WeakPolarHBondContact O-CB 3.36Å; T394-P458 HydrophobicContact CG2-CB 4.3Å; P458-Y460 VanDerWaalsContact C-N 3.31Å; P458-Y460 PolarHBondContact O-N 3.49Å; P458-I461 PolarHBondContact O-N 3.09Å; P458-E462 WeakPolarHBondContact O-CB 3.39Å; P458-E462 PolarHBondContact O-N 2.93Å |
| 459 | V | 82.6 | Confident | 86.2 | Confident | 72 Ų | 72 | 42.4 Ų | 42.4 | 44% | 0.436 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.7 | -37.9 | 175.5 | 177.9 | 0 | 0 | 0 | 0 | 111.9 | T394 N457 S463 | T394-V459 HydrophobicContact CG2-CG2 3.89Å; N457-V459 PolarHBondContact O-N 3.27Å; N457-V459 VanDerWaalsContact O-N 3.08Å; N457-V459 WeakPolarHBondContact OD1-CG2 3.49Å; N457-V459 PolarHBondContact OD1-N 3.17Å; V459-S463 PolarHBondContact O-N 3.3Å; V459-S463 VanDerWaalsContact O-N 3.11Å |
| 460 | Y | 84.3 | Confident | 85.2 | Confident | 88 Ų | 88 | 49 Ų | 49 | 35% | 0.345 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -67.5 | -44.9 | 173.9 | 172.8 | -93.7 | 0 | 0 | 0 | 110.7 | F456 N457 P458 E462 S463 V464 | F456-Y460 HydrophobicContact CB-CD1 3.89Å; F456-Y460 HydrophobicContact CB-CE1 4.49Å; F456-Y460 AromaticContact CD1-CD1 3.4Å; F456-Y460 HydrophobicContact CD1-CD1 3.4Å; F456-Y460 AromaticContact CD1-CE1 3.34Å; F456-Y460 HydrophobicContact CD1-CE1 3.34Å; F456-Y460 HydrophobicContact CD1-CG 4.19Å; F456-Y460 HydrophobicContact CE1-CD1 4.18Å; F456-Y460 AromaticContact CE1-CE1 3.65Å; F456-Y460 HydrophobicContact CE1-CE1 3.65Å; F456-Y460 AromaticContact CG-CD1 3.87Å; F456-Y460 HydrophobicContact CG-CD1 3.87Å; F456-Y460 AromaticContact CG-CE1 4Å; F456-Y460 HydrophobicContact CG-CE1 4Å; N457-Y460 WeakPolarHBondContact O-CA 3.39Å; N457-Y460 WeakPolarHBondContact O-CB 3.49Å; N457-Y460 PolarHBondContact O-N 2.98Å; P458-Y460 VanDerWaalsContact C-N 3.31Å; P458-Y460 PolarHBondContact O-N 3.49Å; Y460-E462 VanDerWaalsContact C-N 3.3Å; Y460-E462 PolarHBondContact O-N 2.85Å; Y460-S463 WeakPolarHBondContact O-CA 3.42Å; Y460-S463 WeakPolarHBondContact O-CB 3.39Å; Y460-S463 PolarHBondContact O-N 3.27Å; Y460-S463 PolarHBondContact O-OG 3.02Å; Y460-V464 HydrophobicContact CD1-CG2 4.33Å; Y460-V464 HydrophobicContact CE1-CG2 3.9Å; Y460-V464 PolarHBondContact O-N 3.39Å; Y460-V464 VanDerWaalsContact O-N 3.07Å |
| 461 | I | 87.7 | Confident | 83.6 | Confident | 1 Ų | 1 | 54 Ų | 54 | 1% | 0.005 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.4 | -39.8 | 177.4 | -58.7 | -61.5 | 0 | 0 | 0 | 111.4 | L392 P451 T453 F456 N457 P458 S463 V464 F465 | L392-I461 HydrophobicContact CD2-CG2 3.85Å; P451-I461 HydrophobicContact CG-CG2 4.3Å; T453-I461 HydrophobicContact CG2-CD1 4.21Å; T453-I461 HydrophobicContact CG2-CG1 4.44Å; F456-I461 HydrophobicContact CB-CD1 3.85Å; F456-I461 HydrophobicContact CB-CG1 4.19Å; F456-I461 HydrophobicContact CG-CD1 4.4Å; N457-I461 PolarHBondContact O-N 3.31Å; N457-I461 VanDerWaalsContact O-N 3.17Å; P458-I461 PolarHBondContact O-N 3.09Å; I461-S463 VanDerWaalsContact C-N 3.28Å; I461-S463 PolarHBondContact O-N 3.39Å; I461-V464 WeakPolarHBondContact O-CB 3.49Å; I461-V464 PolarHBondContact O-N 3.3Å; I461-V464 VanDerWaalsContact O-N 3.11Å; I461-F465 HydrophobicContact CG2-CD2 4.22Å; I461-F465 HydrophobicContact CG2-CE2 3.63Å; I461-F465 HydrophobicContact CG2-CZ 3.91Å; I461-F465 PolarHBondContact O-N 3.37Å |
| 462 | E | 86.6 | Confident | 81.7 | Confident | 27 Ų | 27 | 60 Ų | 60 | 13% | 0.126 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -59.7 | -39.7 | 172.7 | -167.4 | -163.5 | 169.5 | 0 | 0 | 111.5 | H261 P458 Y460 V464 F465 K466 | H261-E462 IonicContact CD2-OE1 3.88Å; H261-E462 IonicContact NE2-OE1 3.26Å; H261-E462 PolarHBondContact NE2-OE1 3.09Å; P458-E462 WeakPolarHBondContact O-CB 3.39Å; P458-E462 PolarHBondContact O-N 2.93Å; Y460-E462 VanDerWaalsContact C-N 3.3Å; Y460-E462 PolarHBondContact O-N 2.85Å; E462-V464 VanDerWaalsContact C-N 3.31Å; E462-V464 PolarHBondContact O-N 3Å; E462-F465 PolarHBondContact O-N 2.99Å; E462-K466 HydrophobicContact CG-CD 4.48Å; E462-K466 WeakPolarHBondContact O-CG 3.47Å; E462-K466 PolarHBondContact O-N 3.43Å; E462-K466 WeakPolarHBondContact OE1-CE 3.43Å; E462-K466 IonicContact OE1-NZ 3.35Å; E462-K466 PolarHBondContact OE1-NZ 3.24Å; E462-K466 IonicContact OE2-NZ 2.65Å |
| 463 | S | 85.9 | Confident | 79.5 | Confident | 56 Ų | 56 | 62.3 Ų | 62.3 | 39% | 0.392 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.2 | -34.7 | 175.3 | 84.5 | 0 | 0 | 0 | 0 | 112.7 | V459 Y460 I461 K466 A467 | V459-S463 PolarHBondContact O-N 3.3Å; V459-S463 VanDerWaalsContact O-N 3.11Å; Y460-S463 WeakPolarHBondContact O-CA 3.42Å; Y460-S463 WeakPolarHBondContact O-CB 3.39Å; Y460-S463 PolarHBondContact O-N 3.27Å; Y460-S463 PolarHBondContact O-OG 3.02Å; I461-S463 VanDerWaalsContact C-N 3.28Å; I461-S463 PolarHBondContact O-N 3.39Å; S463-K466 PolarHBondContact O-N 3.37Å; S463-A467 WeakPolarHBondContact O-CB 3.25Å; S463-A467 PolarHBondContact O-N 2.97Å |
| 464 | V | 87.9 | Confident | 77.5 | Confident | 7 Ų | 7 | 67.8 Ų | 67.8 | 4% | 0.042 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.9 | -46 | 173.4 | 176.2 | 0 | 0 | 0 | 0 | 110.1 | Y460 I461 E462 K466 A467 Q468 | Y460-V464 HydrophobicContact CD1-CG2 4.33Å; Y460-V464 HydrophobicContact CE1-CG2 3.9Å; Y460-V464 PolarHBondContact O-N 3.39Å; Y460-V464 VanDerWaalsContact O-N 3.07Å; I461-V464 WeakPolarHBondContact O-CB 3.49Å; I461-V464 PolarHBondContact O-N 3.3Å; I461-V464 VanDerWaalsContact O-N 3.11Å; E462-V464 VanDerWaalsContact C-N 3.31Å; E462-V464 PolarHBondContact O-N 3Å; V464-K466 PolarHBondContact O-N 3.42Å; V464-A467 PolarHBondContact O-N 3.39Å; V464-Q468 WeakPolarHBondContact O-CG 3.05Å; V464-Q468 PolarHBondContact O-N 3.31Å |
| 465 | F | 89.5 | Confident | 75.8 | Confident | 4 Ų | 4 | 66.3 Ų | 66.3 | 2% | 0.018 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -64 | -39.2 | 175.6 | -63.1 | -38.2 | 0 | 0 | 0 | 112.5 | H261 W264 V268 L392 P451 I461 E462 Q468 C469 | H261-F465 HydrophobicContact CB-CB 4.24Å; W264-F465 AromaticContact CD1-CD1 3.59Å; V268-F465 HydrophobicContact CB-CE1 4.32Å; V268-F465 HydrophobicContact CB-CZ 4.23Å; V268-F465 HydrophobicContact CG1-CE1 4.39Å; V268-F465 HydrophobicContact CG1-CZ 4.2Å; V268-F465 HydrophobicContact CG2-CE1 4.05Å; V268-F465 HydrophobicContact CG2-CZ 4.47Å; L392-F465 HydrophobicContact CD2-CE2 4.03Å; L392-F465 HydrophobicContact CD2-CZ 3.65Å; P451-F465 HydrophobicContact CG-CE1 4.18Å; P451-F465 HydrophobicContact CG-CZ 4.28Å; I461-F465 HydrophobicContact CG2-CD2 4.22Å; I461-F465 HydrophobicContact CG2-CE2 3.63Å; I461-F465 HydrophobicContact CG2-CZ 3.91Å; I461-F465 PolarHBondContact O-N 3.37Å; E462-F465 PolarHBondContact O-N 2.99Å; F465-Q468 PolarHBondContact O-N 3.36Å; F465-C469 PolarHBondContact O-N 2.92Å; F465-C469 PolarHBondContact O-SG 3.36Å |
| 466 | K | 87.7 | Confident | 74.2 | Confident | 82 Ų | 82 | 65.9 Ų | 65.9 | 36% | 0.357 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 173.8 | -74.3 | 171.6 | -179.2 | 166 | 0 | 111.8 | H261 E462 S463 V464 C469 K470 | H261-K466 HydrophobicContact CB-CG 3.86Å; H261-K466 WeakPolarHBondContact NE2-CE 3.38Å; E462-K466 HydrophobicContact CG-CD 4.48Å; E462-K466 WeakPolarHBondContact O-CG 3.47Å; E462-K466 PolarHBondContact O-N 3.43Å; E462-K466 WeakPolarHBondContact OE1-CE 3.43Å; E462-K466 IonicContact OE1-NZ 3.35Å; E462-K466 PolarHBondContact OE1-NZ 3.24Å; E462-K466 IonicContact OE2-NZ 2.65Å; S463-K466 PolarHBondContact O-N 3.37Å; V464-K466 PolarHBondContact O-N 3.42Å; K466-C469 PolarHBondContact O-N 3.49Å; K466-K470 PolarHBondContact O-N 2.9Å |
| 467 | A | 84.8 | Confident | 72.9 | Confident | 30 Ų | 30 | 62 Ų | 62 | 25% | 0.248 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.9 | -42.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | S463 V464 C469 K470 H471 | S463-A467 WeakPolarHBondContact O-CB 3.25Å; S463-A467 PolarHBondContact O-N 2.97Å; V464-A467 PolarHBondContact O-N 3.39Å; A467-C469 VanDerWaalsContact C-N 3.28Å; A467-C469 PolarHBondContact O-N 2.87Å; A467-K470 PolarHBondContact O-N 3.47Å; A467-K470 VanDerWaalsContact O-N 3.1Å; A467-H471 PolarHBondContact O-CD2 3.07Å; A467-H471 PolarHBondContact O-N 3.02Å |
| 468 | Q | 78.8 | Confident | 71.2 | Confident | 30 Ų | 30 | 66.1 Ų | 66.1 | 14% | 0.14 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -61 | -34.8 | 174.3 | -74.1 | 178.5 | -21.8 | 0 | 0 | 112.7 | W264 V464 F465 K470 H471 | W264-Q468 VanDerWaalsContact CD1-OE1 3.31Å; V464-Q468 WeakPolarHBondContact O-CG 3.05Å; V464-Q468 PolarHBondContact O-N 3.31Å; F465-Q468 PolarHBondContact O-N 3.36Å; Q468-K470 VanDerWaalsContact C-N 3.31Å; Q468-K470 PolarHBondContact O-N 3.35Å; Q468-H471 VanDerWaalsContact O-O 3.1Å |
| 469 | C | 78.2 | Confident | 69 | Low | 35 Ų | 35 | 75.1 Ų | 75.1 | 24% | 0.236 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -70.5 | -25.1 | 175.7 | -64.9 | 0 | 0 | 0 | 0 | 113.6 | Q260 H261 F465 K466 A467 | Q260-C469 HydrophobicContact CG-CB 4.3Å; H261-C469 VanDerWaalsContact CA-SG 3.6Å; F465-C469 PolarHBondContact O-N 2.92Å; F465-C469 PolarHBondContact O-SG 3.36Å; K466-C469 PolarHBondContact O-N 3.49Å; A467-C469 VanDerWaalsContact C-N 3.28Å; A467-C469 PolarHBondContact O-N 2.87Å |
| 470 | K | 71.3 | Confident | 66.8 | Low | 177 Ų | 177 | 78.1 Ų | 78.1 | 77% | 0.77 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -80.9 | -24.7 | -179.6 | -73.3 | -178.2 | 179.2 | -176.3 | 0 | 113.1 | K466 A467 Q468 | K466-K470 PolarHBondContact O-N 2.9Å; A467-K470 PolarHBondContact O-N 3.47Å; A467-K470 VanDerWaalsContact O-N 3.1Å; Q468-K470 VanDerWaalsContact C-N 3.31Å; Q468-K470 PolarHBondContact O-N 3.35Å |
| 471 | H | 60.7 | Low | 66 | Low | 105 Ų | 105 | 77.7 Ų | 77.7 | 49% | 0.486 | 39% | 0.393 | S | S | . | . | trans | -97.8 | 119 | 176.5 | -68.4 | -70.5 | 0 | 0 | 0 | 110 | A467 Q468 T473 I475 | A467-H471 PolarHBondContact O-CD2 3.07Å; A467-H471 PolarHBondContact O-N 3.02Å; Q468-H471 VanDerWaalsContact O-O 3.1Å; H471-T473 PolarHBondContact O-N 3.43Å; H471-I475 HydrophobicContact CB-CD1 4.17Å | ||
| 472 | S | 52.4 | Low | 64.8 | Low | 131 Ų | 131 | 81.7 Ų | 81.7 | 92% | 0.916 | 41% | 0.414 | S | S | * | . | S | Bend | trans | -63.6 | -17 | 173.1 | 50 | 0 | 0 | 0 | 0 | 113 | ||
| 473 | T | 47.6 | Very low | 63.6 | Low | 102 Ų | 102 | 84.7 Ų | 84.7 | 63% | 0.626 | 43% | 0.43 | S | S | * | . | S | Bend | trans | -93.2 | 120.6 | 174.2 | -14.3 | 0 | 0 | 0 | 0 | 109.5 | H471 I475 | H471-T473 PolarHBondContact O-N 3.43Å; T473-I475 PolarHBondContact O-N 3.19Å |
| 474 | I | 47.4 | Very low | 62.3 | Low | 117 Ų | 117 | 86.4 Ų | 86.4 | 60% | 0.6 | 43% | 0.432 | S | S | * | . | trans | -59.6 | 102.8 | 172.6 | -60.7 | 169.3 | 0 | 0 | 0 | 107.8 | Y449 P476 | Y449-I474 HydrophobicContact CE1-CD1 4.49Å; Y449-I474 HydrophobicContact CE1-CG2 3.83Å; I474-P476 VanDerWaalsContact O-CD 3.29Å; I474-P476 WeakPolarHBondContact O-CD 3.38Å | ||
| 475 | I | 49.3 | Very low | 60.7 | Low | 36 Ų | 36 | 91.4 Ų | 91.4 | 19% | 0.185 | 46% | 0.456 | C | S | . | . | trans | -79.8 | 114.9 | 173.2 | -60.8 | 167.9 | 0 | 0 | 0 | 106.7 | H471 T473 V477 R479 F480 | H471-I475 HydrophobicContact CB-CD1 4.17Å; T473-I475 PolarHBondContact O-N 3.19Å; I475-V477 PolarHBondContact O-N 3.44Å; I475-R479 HydrophobicContact CG2-CB 3.77Å; I475-F480 HydrophobicContact CB-CE2 4.45Å; I475-F480 HydrophobicContact CG2-CE2 3.95Å | ||
| 476 | P | 48 | Very low | 58.8 | Low | 75 Ų | 75 | 97.2 Ų | 97.2 | 49% | 0.487 | 49% | 0.486 | S | S | . | . | trans | -57.8 | 133.3 | 173.6 | -19.1 | 31.3 | 0 | 0 | 0 | 109.1 | I474 K478 R479 | I474-P476 VanDerWaalsContact O-CD 3.29Å; I474-P476 WeakPolarHBondContact O-CD 3.38Å; P476-K478 PolarHBondContact O-N 3.32Å; P476-R479 PolarHBondContact O-N 3.37Å; P476-R479 VanDerWaalsContact O-N 3.13Å | ||
| 477 | V | 55.4 | Low | 56.7 | Low | 6 Ų | 6 | 98.3 Ų | 98.3 | 4% | 0.036 | 50% | 0.495 | C | S | . | . | G | 310 helix | trans | -59.7 | -10 | -171.7 | -171.7 | 0 | 0 | 0 | 0 | 113.9 | P451 I475 R479 F480 | P451-V477 HydrophobicContact CB-CG1 3.88Å; I475-V477 PolarHBondContact O-N 3.44Å; V477-R479 PolarHBondContact O-N 2.72Å; V477-F480 PolarHBondContact O-N 3.43Å; V477-F480 VanDerWaalsContact O-N 3.11Å |
| 478 | K | 47.6 | Very low | 54.6 | Low | 186 Ų | 186 | 103.5 Ų | 103.5 | 81% | 0.809 | 51% | 0.514 | S | S | * | . | G | 310 helix | trans | -56 | -13.4 | 169.2 | -82 | -170.6 | 175.6 | -176.9 | 0 | 114.3 | P476 | P476-K478 PolarHBondContact O-N 3.32Š|
| 479 | R | 34.9 | Very low | 52.6 | Low | 210 Ų | 210 | 109.7 Ų | 109.7 | 79% | 0.792 | 55% | 0.545 | S | S | * | . | G | 310 helix | trans | -90.9 | 2.1 | 176.6 | -101.7 | -173 | -177.8 | -173.6 | 1.6 | 115.8 | I475 P476 V477 | I475-R479 HydrophobicContact CG2-CB 3.77Å; P476-R479 PolarHBondContact O-N 3.37Å; P476-R479 VanDerWaalsContact O-N 3.13Å; V477-R479 PolarHBondContact O-N 2.72Å |
| 480 | F | 37.9 | Very low | 50.2 | Low | 136 Ų | 136 | 116.5 Ų | 116.5 | 60% | 0.596 | 57% | 0.573 | S | S | * | * | trans | -124.5 | 0 | 177.7 | -66 | -75.7 | 0 | 0 | 0 | 112.5 | I475 V477 | I475-F480 HydrophobicContact CB-CE2 4.45Å; I475-F480 HydrophobicContact CG2-CE2 3.95Å; V477-F480 PolarHBondContact O-N 3.43Å; V477-F480 VanDerWaalsContact O-N 3.11Å |
Retrieved 480 of 480 residues in 655.2 ms
(Link to these results)