| 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 | 40.9 | Very low | 79.5 | Confident | 223 Ų | 223 | 80.9 Ų | 80.9 | 100% | 1.099 | 46% | 0.458 | S | S | * | . | 0 | 112.4 | 0 | -82.7 | 173 | 160.8 | 0 | 0 | 108.4 | T3 | M1-T3 PolarHBondContact O-N 3.26Š| |||
| 2 | G | 47.7 | Very low | 81 | Confident | 42 Ų | 42 | 81.2 Ų | 81.2 | 43% | 0.433 | 45% | 0.451 | S | S | . | . | P | Polyproline II helix | trans | -72.7 | 118 | 177 | 0 | 0 | 0 | 0 | 0 | 109.9 | Q4 | G2-Q4 PolarHBondContact O-N 3.31Š|
| 3 | T | 60.3 | Low | 82.2 | Confident | 110 Ų | 110 | 74.9 Ų | 74.9 | 68% | 0.675 | 42% | 0.416 | S | S | * | . | P | Polyproline II helix | trans | -63.2 | 117.9 | 174.2 | 43.8 | 0 | 0 | 0 | 0 | 109.5 | M1 K5 | M1-T3 PolarHBondContact O-N 3.26Å; T3-K5 WeakPolarHBondContact O-CG 3.37Å; T3-K5 PolarHBondContact O-N 3.37Å |
| 4 | Q | 73.1 | Confident | 83.2 | Confident | 76 Ų | 76 | 69.7 Ų | 69.7 | 36% | 0.355 | 39% | 0.387 | S | S | . | . | P | Polyproline II helix | trans | -53.5 | 130.2 | 170.9 | -67 | 170.7 | -10.4 | 0 | 0 | 109.4 | G2 W230 D238 | G2-Q4 PolarHBondContact O-N 3.31Å; Q4-W230 HydrophobicContact CG-CE3 4.25Å; Q4-D238 PolarHBondContact NE2-OD1 3.12Å; Q4-D238 PolarHBondContact NE2-OD2 3.42Å |
| 5 | K | 84.6 | Confident | 84.1 | Confident | 125 Ų | 125 | 70.1 Ų | 70.1 | 54% | 0.543 | 39% | 0.392 | S | S | . | . | trans | -110.9 | 149.3 | -175.3 | -58.4 | -177.2 | -176.5 | 173.7 | 0 | 111.1 | T3 T7 W230 | T3-K5 WeakPolarHBondContact O-CG 3.37Å; T3-K5 PolarHBondContact O-N 3.37Å; K5-T7 PolarHBondContact O-N 3.4Å; K5-W230 PolarHBondContact N-O 3.39Å | ||
| 6 | V | 91.1 | Very high | 85 | Confident | 70 Ų | 70 | 66.1 Ų | 66.1 | 42% | 0.424 | 37% | 0.37 | S | S | . | . | trans | -79.1 | 100.9 | 166.8 | -177.7 | 0 | 0 | 0 | 0 | 108.1 | I11 L150 F154 | V6-I11 HydrophobicContact CG1-CD1 3.87Å; V6-I11 HydrophobicContact CG1-CG1 3.68Å; V6-L150 HydrophobicContact CG2-CD1 3.57Å; V6-F154 HydrophobicContact CG1-CZ 3.97Å; V6-F154 HydrophobicContact CG2-CZ 3.96Å | ||
| 7 | T | 94.7 | Very high | 85.7 | Confident | 17 Ų | 17 | 62.2 Ų | 62.2 | 10% | 0.104 | 35% | 0.348 | C | S | . | . | trans | -87.1 | 159.4 | -179.3 | 71.1 | 0 | 0 | 0 | 0 | 112 | K5 A9 L10 I11 L229 | K5-T7 PolarHBondContact O-N 3.4Å; T7-A9 PolarHBondContact O-N 3.21Å; T7-A9 PolarHBondContact OG1-N 3.04Å; T7-L10 PolarHBondContact O-N 3.41Å; T7-L10 VanDerWaalsContact O-N 3.14Å; T7-L10 PolarHBondContact OG1-N 3.21Å; T7-L10 VanDerWaalsContact OG1-N 3.16Å; T7-I11 WeakPolarHBondContact O-CG1 3.33Å; T7-I11 PolarHBondContact O-N 3.29Å; T7-I11 VanDerWaalsContact O-N 3.09Å; T7-L229 WeakPolarHBondContact CB-O 3.43Å; T7-L229 WeakPolarHBondContact CG2-O 3.33Å; T7-L229 PolarHBondContact OG1-O 2.93Å | ||
| 8 | P | 95.3 | Very high | 86.3 | Confident | 112 Ų | 112 | 60 Ų | 60 | 73% | 0.727 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -56.9 | -32.2 | 170.4 | -25.4 | 35 | 0 | 0 | 0 | 113.2 | I11 F12 | P8-I11 PolarHBondContact O-N 3.31Å; P8-F12 VanDerWaalsContact O-CB 3.28Å; P8-F12 WeakPolarHBondContact O-CB 3.29Å; P8-F12 PolarHBondContact O-N 3.23Å |
| 9 | A | 95.3 | Very high | 86.9 | Confident | 28 Ų | 28 | 58.2 Ų | 58.2 | 23% | 0.231 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -66 | -40.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112 | T7 A13 R228 L229 | T7-A9 PolarHBondContact O-N 3.21Å; T7-A9 PolarHBondContact OG1-N 3.04Å; A9-A13 WeakPolarHBondContact O-CB 3.33Å; A9-A13 PolarHBondContact O-N 3.38Å; A9-R228 HydrophobicContact CB-CG 4.49Å; A9-L229 HydrophobicContact CB-CD2 4.42Å |
| 10 | L | 95.4 | Very high | 87.4 | Confident | 0 Ų | 0 | 55.3 Ų | 55.3 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -66.3 | -46.2 | 175.6 | -178.8 | 63.4 | 0 | 0 | 0 | 111.4 | T7 F12 A13 I14 I145 P147 F154 L229 | T7-L10 PolarHBondContact O-N 3.41Å; T7-L10 VanDerWaalsContact O-N 3.14Å; T7-L10 PolarHBondContact OG1-N 3.21Å; T7-L10 VanDerWaalsContact OG1-N 3.16Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.48Å; L10-A13 PolarHBondContact O-N 3.24Å; L10-I14 HydrophobicContact CD1-CD1 3.78Å; L10-I14 HydrophobicContact CD1-CG1 4.23Å; L10-I14 HydrophobicContact CG-CD1 3.83Å; L10-I14 WeakPolarHBondContact O-CG1 3.46Å; L10-I14 PolarHBondContact O-N 2.98Å; L10-I145 HydrophobicContact CD1-CD1 4.17Å; L10-I145 HydrophobicContact CD1-CG1 4.14Å; L10-P147 HydrophobicContact CD2-CG 4.29Å; L10-F154 HydrophobicContact CD2-CE2 3.87Å; L10-F154 HydrophobicContact CD2-CZ 4.06Å; L10-L229 HydrophobicContact CB-CD2 4.24Å; L10-L229 HydrophobicContact CD1-CD2 4.25Å |
| 11 | I | 95.8 | Very high | 87.9 | Confident | 87 Ų | 87 | 52.7 Ų | 52.7 | 45% | 0.446 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.7 | -45.3 | 177.3 | -62.3 | 176 | 0 | 0 | 0 | 110.3 | V6 T7 P8 I14 T15 | V6-I11 HydrophobicContact CG1-CD1 3.87Å; V6-I11 HydrophobicContact CG1-CG1 3.68Å; T7-I11 WeakPolarHBondContact O-CG1 3.33Å; T7-I11 PolarHBondContact O-N 3.29Å; T7-I11 VanDerWaalsContact O-N 3.09Å; P8-I11 PolarHBondContact O-N 3.31Å; I11-I14 PolarHBondContact O-N 2.91Å; I11-T15 VanDerWaalsContact O-CB 3.28Å; I11-T15 WeakPolarHBondContact O-CB 3.45Å; I11-T15 PolarHBondContact O-N 2.95Å; I11-T15 PolarHBondContact O-OG1 3.25Å |
| 12 | F | 97.4 | Very high | 90.6 | Very high | 84 Ų | 84 | 43.7 Ų | 43.7 | 37% | 0.368 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -59.9 | -49.9 | 177.8 | 179 | -101.5 | 0 | 0 | 0 | 111.8 | P8 L10 I14 T15 V16 T201 F204 | P8-F12 VanDerWaalsContact O-CB 3.28Å; P8-F12 WeakPolarHBondContact O-CB 3.29Å; P8-F12 PolarHBondContact O-N 3.23Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.48Å; F12-I14 VanDerWaalsContact C-N 3.35Å; F12-I14 PolarHBondContact O-N 2.97Å; F12-T15 PolarHBondContact O-N 3.2Å; F12-V16 HydrophobicContact CD1-CG2 4.39Å; F12-V16 HydrophobicContact CD2-CG2 4.24Å; F12-V16 HydrophobicContact CE1-CG2 4.06Å; F12-V16 HydrophobicContact CE2-CG2 3.89Å; F12-V16 HydrophobicContact CG-CG2 4.48Å; F12-V16 HydrophobicContact CZ-CG2 3.8Å; F12-V16 WeakPolarHBondContact O-CB 3.19Å; F12-V16 VanDerWaalsContact O-CG2 3.3Å; F12-V16 WeakPolarHBondContact O-CG2 3.44Å; F12-V16 PolarHBondContact O-N 2.68Å; F12-T201 HydrophobicContact CZ-CG2 4.32Å; F12-F204 HydrophobicContact CE1-CB 4.09Å; F12-F204 HydrophobicContact CZ-CB 4.49Å |
| 13 | A | 97.3 | Very high | 93 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.7 | -43.5 | 180 | 0 | 0 | 0 | 0 | 0 | 112.5 | A9 L10 A17 Y141 I145 P206 | A9-A13 WeakPolarHBondContact O-CB 3.33Å; A9-A13 PolarHBondContact O-N 3.38Å; L10-A13 PolarHBondContact O-N 3.24Å; A13-A17 WeakPolarHBondContact O-CB 3.27Å; A13-A17 PolarHBondContact O-N 3.5Å; A13-A17 VanDerWaalsContact O-N 3.07Å; A13-Y141 HydrophobicContact CB-CE1 4.46Å; A13-I145 HydrophobicContact CB-CD1 3.95Å; A13-P206 HydrophobicContact CB-CG 4.46Å |
| 14 | I | 96.1 | Very high | 94.7 | Very high | 2 Ų | 2 | 37.4 Ų | 37.4 | 1% | 0.01 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -67.6 | -45.5 | 177.8 | -66 | 170 | 0 | 0 | 0 | 110.6 | L10 I11 F12 V16 A17 T18 I142 I145 F154 L157 | L10-I14 HydrophobicContact CD1-CD1 3.78Å; L10-I14 HydrophobicContact CD1-CG1 4.23Å; L10-I14 HydrophobicContact CG-CD1 3.83Å; L10-I14 WeakPolarHBondContact O-CG1 3.46Å; L10-I14 PolarHBondContact O-N 2.98Å; I11-I14 PolarHBondContact O-N 2.91Å; F12-I14 VanDerWaalsContact C-N 3.35Å; F12-I14 PolarHBondContact O-N 2.97Å; I14-V16 VanDerWaalsContact C-N 3.34Å; I14-V16 PolarHBondContact O-N 3.07Å; I14-A17 WeakPolarHBondContact O-CB 3.17Å; I14-A17 PolarHBondContact O-N 2.85Å; I14-A17 VanDerWaalsContact O-N 3.14Å; I14-T18 HydrophobicContact CG2-CG2 4.31Å; I14-T18 WeakPolarHBondContact O-CG2 3.43Å; I14-T18 PolarHBondContact O-N 2.7Å; I14-T18 PolarHBondContact O-OG1 2.95Å; I14-I142 HydrophobicContact CG2-CD1 4.12Å; I14-I142 HydrophobicContact CG2-CG1 4.22Å; I14-I145 HydrophobicContact CG1-CD1 3.75Å; I14-I145 HydrophobicContact CG1-CG1 4.38Å; I14-F154 HydrophobicContact CD1-CB 4.03Å; I14-F154 HydrophobicContact CD1-CD1 3.59Å; I14-F154 HydrophobicContact CD1-CD2 3.98Å; I14-F154 HydrophobicContact CD1-CE1 3.96Å; I14-F154 HydrophobicContact CD1-CE2 4.31Å; I14-F154 HydrophobicContact CD1-CG 3.6Å; I14-F154 HydrophobicContact CD1-CZ 4.3Å; I14-L157 HydrophobicContact CG2-CB 4.44Å; I14-L157 HydrophobicContact CG2-CD1 3.64Å |
| 15 | T | 96.6 | Very high | 95.7 | Very high | 76 Ų | 76 | 33.8 Ų | 33.8 | 47% | 0.466 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -60.1 | -45.2 | -179.6 | -56.6 | 0 | 0 | 0 | 0 | 111 | I11 F12 A17 T18 I19 | I11-T15 VanDerWaalsContact O-CB 3.28Å; I11-T15 WeakPolarHBondContact O-CB 3.45Å; I11-T15 PolarHBondContact O-N 2.95Å; I11-T15 PolarHBondContact O-OG1 3.25Å; F12-T15 PolarHBondContact O-N 3.2Å; T15-A17 VanDerWaalsContact C-N 3.34Å; T15-A17 PolarHBondContact O-N 3.4Å; T15-T18 WeakPolarHBondContact CA-OG1 3.37Å; T15-T18 PolarHBondContact O-N 2.77Å; T15-T18 PolarHBondContact O-OG1 3.41Å; T15-I19 PolarHBondContact O-N 3.29Å |
| 16 | V | 97.9 | Very high | 96.3 | Very high | 6 Ų | 6 | 27.8 Ų | 27.8 | 4% | 0.036 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -63 | -40.2 | 176.3 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | F12 I14 I19 Q198 T201 L202 | F12-V16 HydrophobicContact CD1-CG2 4.39Å; F12-V16 HydrophobicContact CD2-CG2 4.24Å; F12-V16 HydrophobicContact CE1-CG2 4.06Å; F12-V16 HydrophobicContact CE2-CG2 3.89Å; F12-V16 HydrophobicContact CG-CG2 4.48Å; F12-V16 HydrophobicContact CZ-CG2 3.8Å; F12-V16 WeakPolarHBondContact O-CB 3.19Å; F12-V16 VanDerWaalsContact O-CG2 3.3Å; F12-V16 WeakPolarHBondContact O-CG2 3.44Å; F12-V16 PolarHBondContact O-N 2.68Å; I14-V16 VanDerWaalsContact C-N 3.34Å; I14-V16 PolarHBondContact O-N 3.07Å; V16-I19 WeakPolarHBondContact O-CB 3.5Å; V16-I19 PolarHBondContact O-N 3.31Å; V16-Q198 HydrophobicContact CG1-CG 4.18Å; V16-Q198 PolarHBondContact O-NE2 3.06Å; V16-T201 WeakPolarHBondContact CG1-OG1 3.34Å; V16-L202 HydrophobicContact CG1-CD2 3.81Å; V16-L202 HydrophobicContact CG1-CG 3.85Å |
| 17 | A | 97.2 | Very high | 96.5 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.7 | -43.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | A13 I14 T15 I19 G20 M94 V138 Y141 I142 | A13-A17 WeakPolarHBondContact O-CB 3.27Å; A13-A17 PolarHBondContact O-N 3.5Å; A13-A17 VanDerWaalsContact O-N 3.07Å; I14-A17 WeakPolarHBondContact O-CB 3.17Å; I14-A17 PolarHBondContact O-N 2.85Å; I14-A17 VanDerWaalsContact O-N 3.14Å; T15-A17 VanDerWaalsContact C-N 3.34Å; T15-A17 PolarHBondContact O-N 3.4Å; A17-I19 PolarHBondContact O-N 3.28Å; A17-I19 VanDerWaalsContact O-N 3.1Å; A17-G20 PolarHBondContact O-N 3.04Å; A17-M94 HydrophobicContact CB-CE 4.32Å; A17-M94 HydrophobicContact CB-SD 4.22Å; A17-V138 HydrophobicContact CB-CG1 4.25Å; A17-V138 VanDerWaalsContact O-CG2 3.27Å; A17-V138 WeakPolarHBondContact O-CG2 3.23Å; A17-Y141 HydrophobicContact CB-CD1 3.61Å; A17-Y141 HydrophobicContact CB-CE1 4Å; A17-I142 HydrophobicContact CB-CG1 4.43Å |
| 18 | T | 96.9 | Very high | 96.3 | Very high | 22 Ų | 22 | 24.2 Ų | 24.2 | 14% | 0.135 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -66.6 | -9.4 | 179.7 | 56 | 0 | 0 | 0 | 0 | 114.7 | I14 T15 G20 S21 F22 I142 L157 | I14-T18 HydrophobicContact CG2-CG2 4.31Å; I14-T18 WeakPolarHBondContact O-CG2 3.43Å; I14-T18 PolarHBondContact O-N 2.7Å; I14-T18 PolarHBondContact O-OG1 2.95Å; T15-T18 WeakPolarHBondContact CA-OG1 3.37Å; T15-T18 PolarHBondContact O-N 2.77Å; T15-T18 PolarHBondContact O-OG1 3.41Å; T18-G20 PolarHBondContact O-N 3.34Å; T18-S21 WeakPolarHBondContact O-CA 3.45Å; T18-S21 VanDerWaalsContact O-CB 3.31Å; T18-S21 WeakPolarHBondContact O-CB 3.41Å; T18-S21 PolarHBondContact O-N 3.19Å; T18-F22 PolarHBondContact O-N 3.08Å; T18-I142 HydrophobicContact CG2-CD1 3.87Å; T18-L157 HydrophobicContact CG2-CB 4.03Å; T18-L157 WeakPolarHBondContact CG2-O 3.29Å |
| 19 | I | 98.1 | Very high | 95.9 | Very high | 25 Ų | 25 | 19.1 Ų | 19.1 | 13% | 0.128 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -59.3 | -35.2 | 167.8 | -61 | 171.4 | 0 | 0 | 0 | 110.5 | T15 V16 A17 S21 F22 Q23 P194 L197 Q198 | T15-I19 PolarHBondContact O-N 3.29Å; V16-I19 WeakPolarHBondContact O-CB 3.5Å; V16-I19 PolarHBondContact O-N 3.31Å; A17-I19 PolarHBondContact O-N 3.28Å; A17-I19 VanDerWaalsContact O-N 3.1Å; I19-S21 VanDerWaalsContact C-N 3.31Å; I19-S21 PolarHBondContact O-N 2.88Å; I19-F22 WeakPolarHBondContact O-CB 3.39Å; I19-F22 PolarHBondContact O-N 3.1Å; I19-Q23 HydrophobicContact CG2-CG 4.42Å; I19-Q23 WeakPolarHBondContact O-CG 3.4Å; I19-Q23 PolarHBondContact O-N 3.37Å; I19-P194 HydrophobicContact CG2-CB 3.63Å; I19-P194 WeakPolarHBondContact CG2-O 3.27Å; I19-L197 HydrophobicContact CD1-CD2 4.28Å; I19-L197 HydrophobicContact CD1-CG 4.29Å; I19-Q198 HydrophobicContact CB-CB 4.2Å; I19-Q198 HydrophobicContact CB-CG 4.17Å; I19-Q198 HydrophobicContact CD1-CB 4.02Å; I19-Q198 HydrophobicContact CD1-CG 4.27Å; I19-Q198 HydrophobicContact CG2-CB 3.92Å; I19-Q198 HydrophobicContact CG2-CG 4.38Å |
| 20 | G | 97.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 17.9 Ų | 17.9 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -63.8 | -37.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A17 T18 Q23 F24 | A17-G20 PolarHBondContact O-N 3.04Å; T18-G20 PolarHBondContact O-N 3.34Å; G20-Q23 PolarHBondContact O-N 2.86Å; G20-F24 PolarHBondContact O-N 2.96Å |
| 21 | S | 96.3 | Very high | 95.3 | Very high | 2 Ų | 2 | 17.9 Ų | 17.9 | 1% | 0.014 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -67.7 | -43.2 | 174.6 | -43.4 | 0 | 0 | 0 | 0 | 111.8 | T18 I19 Q23 F24 G25 V138 N158 I162 | T18-S21 WeakPolarHBondContact O-CA 3.45Å; T18-S21 VanDerWaalsContact O-CB 3.31Å; T18-S21 WeakPolarHBondContact O-CB 3.41Å; T18-S21 PolarHBondContact O-N 3.19Å; I19-S21 VanDerWaalsContact C-N 3.31Å; I19-S21 PolarHBondContact O-N 2.88Å; S21-Q23 VanDerWaalsContact C-N 3.31Å; S21-Q23 PolarHBondContact O-N 2.91Å; S21-F24 PolarHBondContact O-N 2.91Å; S21-G25 PolarHBondContact O-N 2.61Å; S21-V138 VanDerWaalsContact OG-CG1 3.28Å; S21-V138 WeakPolarHBondContact OG-CG1 3.01Å; S21-N158 WeakPolarHBondContact CB-O 3.44Å; S21-N158 WeakPolarHBondContact CB-OD1 3.32Å; S21-N158 PolarHBondContact OG-OD1 3.28Å; S21-I162 WeakPolarHBondContact O-CA 3.22Å; S21-I162 WeakPolarHBondContact O-CG1 2.89Å |
| 22 | F | 98.1 | Very high | 94.7 | Very high | 34 Ų | 34 | 14.8 Ų | 14.8 | 15% | 0.149 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -56.2 | -45.6 | 172.1 | 174.3 | -88.1 | 0 | 0 | 0 | 111.7 | T18 I19 F24 G25 Y26 G161 V164 G165 V168 F190 P194 | T18-F22 PolarHBondContact O-N 3.08Å; I19-F22 WeakPolarHBondContact O-CB 3.39Å; I19-F22 PolarHBondContact O-N 3.1Å; F22-F24 VanDerWaalsContact C-N 3.34Å; F22-F24 PolarHBondContact O-N 2.66Å; F22-G25 PolarHBondContact O-N 3.39Å; F22-Y26 HydrophobicContact CE1-CD2 4.37Å; F22-Y26 HydrophobicContact CE1-CG 4.48Å; F22-Y26 HydrophobicContact CZ-CD2 4.19Å; F22-Y26 WeakPolarHBondContact O-CB 3.18Å; F22-Y26 PolarHBondContact O-N 3.23Å; F22-G161 VanDerWaalsContact CA-O 3.24Å; F22-G161 WeakPolarHBondContact CA-O 3.4Å; F22-V164 HydrophobicContact CD2-CG1 4.11Å; F22-V164 HydrophobicContact CE2-CG1 4.18Å; F22-G165 VanDerWaalsContact CD2-CA 3.49Å; F22-V168 HydrophobicContact CE2-CB 4.02Å; F22-V168 HydrophobicContact CE2-CG1 4.39Å; F22-V168 HydrophobicContact CE2-CG2 3.98Å; F22-V168 HydrophobicContact CZ-CB 4.11Å; F22-V168 HydrophobicContact CZ-CG1 4.02Å; F22-V168 HydrophobicContact CZ-CG2 4.42Å; F22-F190 HydrophobicContact CE1-CE1 4.1Å; F22-F190 HydrophobicContact CZ-CE1 4.24Å; F22-P194 HydrophobicContact CD1-CB 4.4Å; F22-P194 HydrophobicContact CD1-CG 4.18Å; F22-P194 HydrophobicContact CE1-CG 3.89Å |
| 23 | Q | 97.9 | Very high | 94 | Very high | 0 Ų | 0 | 12.6 Ų | 12.6 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -63.6 | -39.7 | 178.5 | -68.3 | -89.1 | 40 | 0 | 0 | 112.7 | I19 G20 S21 N27 F130 T191 P194 A195 | I19-Q23 HydrophobicContact CG2-CG 4.42Å; I19-Q23 WeakPolarHBondContact O-CG 3.4Å; I19-Q23 PolarHBondContact O-N 3.37Å; G20-Q23 PolarHBondContact O-N 2.86Å; S21-Q23 VanDerWaalsContact C-N 3.31Å; S21-Q23 PolarHBondContact O-N 2.91Å; Q23-N27 WeakPolarHBondContact O-CB 3.36Å; Q23-N27 PolarHBondContact O-N 3.09Å; Q23-N27 PolarHBondContact O-ND2 3.25Å; Q23-F130 HydrophobicContact CB-CE1 3.61Å; Q23-F130 HydrophobicContact CB-CZ 4.25Å; Q23-F130 HydrophobicContact CG-CE1 4.04Å; Q23-F130 HydrophobicContact CG-CZ 4.28Å; Q23-T191 PolarHBondContact NE2-O 3.42Å; Q23-T191 PolarHBondContact OE1-OG1 3.15Å; Q23-P194 HydrophobicContact CG-CB 4.14Å; Q23-A195 VanDerWaalsContact NE2-N 3.19Å |
| 24 | F | 96 | Very high | 93.7 | Very high | 19 Ų | 19 | 12.6 Ų | 12.6 | 8% | 0.083 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -60.6 | -48.4 | 173.9 | 169.2 | -135.7 | 0 | 0 | 0 | 111 | G20 S21 F22 T28 F70 C131 T135 I162 W386 W410 | G20-F24 PolarHBondContact O-N 2.96Å; S21-F24 PolarHBondContact O-N 2.91Å; F22-F24 VanDerWaalsContact C-N 3.34Å; F22-F24 PolarHBondContact O-N 2.66Å; F24-T28 VanDerWaalsContact CE2-OG1 3.31Å; F24-T28 WeakPolarHBondContact CE2-OG1 3.39Å; F24-T28 WeakPolarHBondContact O-CB 3.39Å; F24-T28 PolarHBondContact O-N 3.36Å; F24-T28 PolarHBondContact O-OG1 3.09Å; F24-F70 HydrophobicContact CD2-CZ 4.21Å; F24-F70 HydrophobicContact CE2-CE1 4.45Å; F24-F70 HydrophobicContact CE2-CZ 4.46Å; F24-C131 HydrophobicContact CB-CB 4.27Å; F24-C131 HydrophobicContact CD2-CB 3.97Å; F24-C131 HydrophobicContact CG-CB 4.5Å; F24-T135 HydrophobicContact CD1-CG2 3.53Å; F24-T135 HydrophobicContact CD2-CG2 4.3Å; F24-T135 HydrophobicContact CE1-CG2 3.7Å; F24-T135 HydrophobicContact CE2-CG2 4.44Å; F24-T135 HydrophobicContact CG-CG2 3.88Å; F24-T135 HydrophobicContact CZ-CG2 4.17Å; F24-I162 HydrophobicContact CD1-CD1 3.55Å; F24-I162 HydrophobicContact CD1-CG1 3.66Å; F24-I162 HydrophobicContact CD1-CG2 4.19Å; F24-I162 HydrophobicContact CE1-CD1 3.73Å; F24-I162 HydrophobicContact CE1-CG1 4.23Å; F24-I162 HydrophobicContact CE1-CG2 4.26Å; F24-W386 HydrophobicContact CE1-CZ2 4.13Å; F24-W410 AromaticContact CD2-CH2 3.72Å; F24-W410 HydrophobicContact CD2-CH2 3.72Å; F24-W410 AromaticContact CD2-CZ2 3.83Å; F24-W410 HydrophobicContact CD2-CZ2 3.83Å; F24-W410 AromaticContact CE2-CH2 3.29Å; F24-W410 HydrophobicContact CE2-CH2 3.29Å; F24-W410 AromaticContact CE2-CZ2 3.49Å; F24-W410 HydrophobicContact CE2-CZ2 3.49Å; F24-W410 VanDerWaalsContact CE2-CZ2 3.49Å; F24-W410 HydrophobicContact CE2-CZ3 4.13Å; F24-W410 HydrophobicContact CZ-CH2 4.25Å; F24-W410 HydrophobicContact CZ-CZ2 4.14Å |
| 25 | G | 94.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -59.9 | -48.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | S21 F22 N27 T28 G29 I162 I166 | S21-G25 PolarHBondContact O-N 2.61Å; F22-G25 PolarHBondContact O-N 3.39Å; G25-N27 PolarHBondContact O-N 2.92Å; G25-T28 WeakPolarHBondContact O-CB 3.4Å; G25-T28 PolarHBondContact O-N 3.23Å; G25-T28 VanDerWaalsContact O-N 3.15Å; G25-G29 PolarHBondContact O-N 3.46Å; G25-I162 VanDerWaalsContact CA-O 3.27Å; G25-I162 WeakPolarHBondContact CA-O 3.31Å; G25-I166 VanDerWaalsContact O-CG1 3.31Å; G25-I166 WeakPolarHBondContact O-CG1 3.31Å |
| 26 | Y | 96.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 19.1 Ų | 19.1 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -57.8 | -52.7 | 179.9 | -174.5 | -89.7 | 0 | 0 | 0 | 111 | F22 T28 G29 V30 G165 V168 A169 F172 L187 F190 | F22-Y26 HydrophobicContact CE1-CD2 4.37Å; F22-Y26 HydrophobicContact CE1-CG 4.48Å; F22-Y26 HydrophobicContact CZ-CD2 4.19Å; F22-Y26 WeakPolarHBondContact O-CB 3.18Å; F22-Y26 PolarHBondContact O-N 3.23Å; Y26-T28 PolarHBondContact O-N 3.16Å; Y26-G29 PolarHBondContact O-N 2.96Å; Y26-V30 HydrophobicContact CD1-CB 4.27Å; Y26-V30 HydrophobicContact CD1-CG2 4.49Å; Y26-V30 HydrophobicContact CE1-CB 4Å; Y26-V30 HydrophobicContact CE1-CG1 4.42Å; Y26-V30 HydrophobicContact CE1-CG2 3.73Å; Y26-V30 WeakPolarHBondContact O-CB 3.45Å; Y26-V30 WeakPolarHBondContact O-CG1 3.38Å; Y26-V30 PolarHBondContact O-N 3.38Å; Y26-G165 WeakPolarHBondContact CA-O 3.42Å; Y26-V168 HydrophobicContact CD2-CG1 4.31Å; Y26-V168 HydrophobicContact CE2-CG1 4.24Å; Y26-A169 HydrophobicContact CD2-CB 3.64Å; Y26-A169 HydrophobicContact CE2-CB 3.86Å; Y26-A169 HydrophobicContact CG-CB 4.13Å; Y26-A169 WeakPolarHBondContact O-CB 3.44Å; Y26-F172 HydrophobicContact CE2-CD2 4.04Å; Y26-L187 WeakPolarHBondContact CE1-O 3.49Å; Y26-L187 WeakPolarHBondContact OH-CD1 3.35Å; Y26-L187 PolarHBondContact OH-O 3.14Å; Y26-F190 HydrophobicContact CD1-CD1 4.34Å; Y26-F190 HydrophobicContact CD2-CD1 4.09Å; Y26-F190 HydrophobicContact CD2-CE1 4.35Å; Y26-F190 HydrophobicContact CE1-CB 4.02Å; Y26-F190 AromaticContact CE1-CD1 3.84Å; Y26-F190 HydrophobicContact CE1-CD1 3.84Å; Y26-F190 HydrophobicContact CE1-CG 4.39Å; Y26-F190 AromaticContact CE2-CD1 3.53Å; Y26-F190 HydrophobicContact CE2-CD1 3.53Å; Y26-F190 HydrophobicContact CE2-CE1 4.03Å; Y26-F190 HydrophobicContact CE2-CG 4.36Å; Y26-F190 HydrophobicContact CG-CD1 4.47Å; Y26-F190 AromaticContact CZ-CD1 3.41Å; Y26-F190 VanDerWaalsContact CZ-CD1 3.41Å; Y26-F190 AromaticContact CZ-CG 3.91Å; Y26-F190 VanDerWaalsContact OH-CB 3.3Å; Y26-F190 WeakPolarHBondContact OH-CB 3.33Å |
| 27 | N | 95.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -68.1 | -20.4 | -179.8 | -74.4 | -74 | 0 | 0 | 0 | 113.7 | Q23 G25 F70 R124 I127 T191 | Q23-N27 WeakPolarHBondContact O-CB 3.36Å; Q23-N27 PolarHBondContact O-N 3.09Å; Q23-N27 PolarHBondContact O-ND2 3.25Å; G25-N27 PolarHBondContact O-N 2.92Å; N27-F70 HydrophobicContact CB-CE2 3.85Å; N27-F70 HydrophobicContact CB-CZ 4.05Å; N27-R124 PolarHBondContact O-NH1 2.53Å; N27-I127 HydrophobicContact CB-CG1 4.32Å; N27-I127 VanDerWaalsContact CG-CG1 3.48Å; N27-I127 WeakPolarHBondContact OD1-CG1 3.48Å; N27-T191 PolarHBondContact ND2-OG1 2.84Å |
| 28 | T | 90.2 | Very high | 92.3 | Very high | 12 Ų | 12 | 20.3 Ų | 20.3 | 7% | 0.074 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -74.3 | -44.1 | 172.2 | -60.8 | 0 | 0 | 0 | 0 | 111.5 | F24 G25 Y26 Y290 | F24-T28 VanDerWaalsContact CE2-OG1 3.31Å; F24-T28 WeakPolarHBondContact CE2-OG1 3.39Å; F24-T28 WeakPolarHBondContact O-CB 3.39Å; F24-T28 PolarHBondContact O-N 3.36Å; F24-T28 PolarHBondContact O-OG1 3.09Å; G25-T28 WeakPolarHBondContact O-CB 3.4Å; G25-T28 PolarHBondContact O-N 3.23Å; G25-T28 VanDerWaalsContact O-N 3.15Å; Y26-T28 PolarHBondContact O-N 3.16Å; T28-Y290 HydrophobicContact CG2-CE1 4.06Å |
| 29 | G | 87.3 | Confident | 92.1 | Very high | 5 Ų | 5 | 21.5 Ų | 21.5 | 5% | 0.052 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -87.2 | -27.5 | -176 | 0 | 0 | 0 | 0 | 0 | 115.5 | G25 Y26 I31 N32 | G25-G29 PolarHBondContact O-N 3.46Å; Y26-G29 PolarHBondContact O-N 2.96Å; G29-I31 PolarHBondContact O-N 3.24Å; G29-I31 VanDerWaalsContact O-N 3.16Å; G29-N32 PolarHBondContact O-N 2.97Å |
| 30 | V | 92.1 | Very high | 91.9 | Very high | 1 Ų | 1 | 23.6 Ų | 23.6 | 1% | 0.006 | 12% | 0.117 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64 | -26.3 | -167.7 | 71.4 | 0 | 0 | 0 | 0 | 114.3 | Y26 N32 P34 A169 L187 L188 | Y26-V30 HydrophobicContact CD1-CB 4.27Å; Y26-V30 HydrophobicContact CD1-CG2 4.49Å; Y26-V30 HydrophobicContact CE1-CB 4Å; Y26-V30 HydrophobicContact CE1-CG1 4.42Å; Y26-V30 HydrophobicContact CE1-CG2 3.73Å; Y26-V30 WeakPolarHBondContact O-CB 3.45Å; Y26-V30 WeakPolarHBondContact O-CG1 3.38Å; Y26-V30 PolarHBondContact O-N 3.38Å; V30-N32 VanDerWaalsContact C-N 3.32Å; V30-N32 PolarHBondContact O-N 2.98Å; V30-P34 WeakPolarHBondContact O-CD 3.49Å; V30-P34 WeakPolarHBondContact O-CG 3.48Å; V30-A169 HydrophobicContact CB-CB 3.95Å; V30-L187 HydrophobicContact CG2-CD1 3.79Å; V30-L187 HydrophobicContact CG2-CD2 4.13Å; V30-L187 HydrophobicContact CG2-CG 3.5Å; V30-L187 VanDerWaalsContact CG2-CG 3.5Å; V30-L188 HydrophobicContact CG1-CD2 3.79Å; V30-L188 HydrophobicContact CG2-CD2 3.99Å |
| 31 | I | 87.3 | Confident | 91.8 | Very high | 1 Ų | 1 | 24.4 Ų | 24.4 | 1% | 0.005 | 12% | 0.12 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.7 | -21.3 | -174.8 | -158 | 61.5 | 0 | 0 | 0 | 112 | G29 I38 W63 V67 L188 | G29-I31 PolarHBondContact O-N 3.24Å; G29-I31 VanDerWaalsContact O-N 3.16Å; I31-I38 HydrophobicContact CD1-CD1 3.71Å; I31-W63 HydrophobicContact CD1-CH2 4.16Å; I31-W63 HydrophobicContact CD1-CZ3 4.14Å; I31-W63 HydrophobicContact CG1-CH2 3.67Å; I31-W63 HydrophobicContact CG1-CZ2 4.44Å; I31-W63 HydrophobicContact CG1-CZ3 4.07Å; I31-W63 VanDerWaalsContact O-CH2 3.27Å; I31-W63 WeakPolarHBondContact O-CH2 3.17Å; I31-V67 HydrophobicContact CG1-CG2 4.03Å; I31-V67 HydrophobicContact CG2-CG1 4.5Å; I31-V67 HydrophobicContact CG2-CG2 4.26Å; I31-L188 HydrophobicContact CD1-CD2 4.25Å |
| 32 | N | 82 | Confident | 91.6 | Very high | 22 Ų | 22 | 24.3 Ų | 24.3 | 12% | 0.118 | 12% | 0.12 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -50.1 | -169.1 | -59.8 | -13.9 | 0 | 0 | 0 | 113.2 | G29 V30 E35 F289 | G29-N32 PolarHBondContact O-N 2.97Å; V30-N32 VanDerWaalsContact C-N 3.32Å; V30-N32 PolarHBondContact O-N 2.98Å; N32-E35 WeakPolarHBondContact O-CB 3.38Å; N32-E35 PolarHBondContact O-N 3.4Å; N32-F289 PolarHBondContact ND2-O 2.95Å |
| 33 | A | 84.2 | Confident | 91.4 | Very high | 37 Ų | 37 | 25.4 Ų | 25.4 | 31% | 0.306 | 13% | 0.127 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.9 | -45.6 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | E35 I305 | A33-E35 PolarHBondContact O-N 3.45Å; A33-I305 HydrophobicContact CB-CD1 4.1Å |
| 34 | P | 89.1 | Confident | 91.1 | Very high | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.006 | 15% | 0.148 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | 16.5 | -179.6 | 36.1 | -39.9 | 0 | 0 | 0 | 114.2 | V30 K36 I37 I38 W184 L187 | V30-P34 WeakPolarHBondContact O-CD 3.49Å; V30-P34 WeakPolarHBondContact O-CG 3.48Å; P34-K36 PolarHBondContact O-N 3.22Å; P34-I37 PolarHBondContact O-N 3.05Å; P34-I37 VanDerWaalsContact O-N 3.15Å; P34-I38 HydrophobicContact CB-CD1 4.02Å; P34-I38 HydrophobicContact CB-CG1 4.21Å; P34-I38 HydrophobicContact CG-CD1 3.76Å; P34-I38 HydrophobicContact CG-CG1 4.49Å; P34-I38 WeakPolarHBondContact O-CG1 3.44Å; P34-I38 PolarHBondContact O-N 2.94Å; P34-W184 HydrophobicContact CB-CB 4.26Å; P34-L187 HydrophobicContact CB-CD2 4.28Å; P34-L187 HydrophobicContact CG-CD2 3.87Å |
| 35 | E | 86.4 | Confident | 90.9 | Very high | 63 Ų | 63 | 29.5 Ų | 29.5 | 29% | 0.294 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -49.9 | -52.7 | -176 | 169.2 | 171.9 | -176.6 | 0 | 0 | 112.9 | N32 A33 I37 I38 K39 W63 | N32-E35 WeakPolarHBondContact O-CB 3.38Å; N32-E35 PolarHBondContact O-N 3.4Å; A33-E35 PolarHBondContact O-N 3.45Å; E35-I37 VanDerWaalsContact C-N 3.32Å; E35-I37 PolarHBondContact O-N 3Å; E35-I38 PolarHBondContact O-N 3.4Å; E35-K39 HydrophobicContact CG-CD 4.26Å; E35-K39 WeakPolarHBondContact O-CG 3.4Å; E35-K39 PolarHBondContact O-N 3.02Å; E35-K39 VanDerWaalsContact OE1-CE 3.23Å; E35-K39 WeakPolarHBondContact OE1-CE 3.45Å; E35-K39 IonicContact OE1-NZ 2.66Å; E35-K39 PolarHBondContact OE1-NZ 3.45Å; E35-W63 VanDerWaalsContact CA-CH2 3.45Å; E35-W63 HydrophobicContact CB-CH2 3.63Å; E35-W63 HydrophobicContact CB-CZ2 3.48Å; E35-W63 VanDerWaalsContact CB-CZ2 3.48Å; E35-W63 HydrophobicContact CB-CZ3 4.44Å; E35-W63 HydrophobicContact CG-CD2 4.18Å; E35-W63 HydrophobicContact CG-CH2 3.91Å; E35-W63 HydrophobicContact CG-CZ2 3.41Å; E35-W63 VanDerWaalsContact CG-CZ2 3.41Å; E35-W63 HydrophobicContact CG-CZ3 4.49Å; E35-W63 PolarHBondContact OE1-NE1 3.32Å |
| 36 | K | 88.1 | Confident | 90.7 | Very high | 151 Ų | 151 | 31.3 Ų | 31.3 | 66% | 0.657 | 16% | 0.155 | S | C | * | . | H | α-helix | trans | -61.6 | -44.1 | -177.2 | -171.6 | -174.7 | 174.4 | -163.6 | 0 | 111.1 | P34 K39 E40 | P34-K36 PolarHBondContact O-N 3.22Å; K36-K39 PolarHBondContact O-N 2.89Å; K36-E40 VanDerWaalsContact CE-OE1 3.27Å; K36-E40 WeakPolarHBondContact CE-OE1 3.44Å; K36-E40 WeakPolarHBondContact O-CG 3.05Å; K36-E40 PolarHBondContact O-N 3.15Å |
| 37 | I | 92.4 | Very high | 90.4 | Very high | 32 Ų | 32 | 33.5 Ų | 33.5 | 16% | 0.164 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -65.3 | -42.6 | -178.7 | -64 | 166.6 | 0 | 0 | 0 | 110.9 | P34 E35 E40 F41 G179 E181 W184 | P34-I37 PolarHBondContact O-N 3.05Å; P34-I37 VanDerWaalsContact O-N 3.15Å; E35-I37 VanDerWaalsContact C-N 3.32Å; E35-I37 PolarHBondContact O-N 3Å; I37-E40 PolarHBondContact O-N 2.99Å; I37-F41 PolarHBondContact O-N 3.14Å; I37-G179 WeakPolarHBondContact CD1-O 3.41Å; I37-E181 HydrophobicContact CG2-CB 4.48Å; I37-W184 HydrophobicContact CG2-CB 4.39Å; I37-W184 HydrophobicContact CG2-CG 3.93Å |
| 38 | I | 93.3 | Very high | 90.1 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -69 | -39.6 | 178.7 | -67.1 | 173.2 | 0 | 0 | 0 | 110.6 | I31 P34 E35 E40 F41 I42 W63 L120 W184 L188 | I31-I38 HydrophobicContact CD1-CD1 3.71Å; P34-I38 HydrophobicContact CB-CD1 4.02Å; P34-I38 HydrophobicContact CB-CG1 4.21Å; P34-I38 HydrophobicContact CG-CD1 3.76Å; P34-I38 HydrophobicContact CG-CG1 4.49Å; P34-I38 WeakPolarHBondContact O-CG1 3.44Å; P34-I38 PolarHBondContact O-N 2.94Å; E35-I38 PolarHBondContact O-N 3.4Å; I38-E40 VanDerWaalsContact C-N 3.32Å; I38-E40 PolarHBondContact O-N 3.34Å; I38-F41 WeakPolarHBondContact O-CB 3.41Å; I38-F41 PolarHBondContact O-N 2.98Å; I38-I42 HydrophobicContact CG2-CD1 4.09Å; I38-I42 HydrophobicContact CG2-CG1 4.47Å; I38-I42 WeakPolarHBondContact O-CG1 3.16Å; I38-I42 PolarHBondContact O-N 3.46Å; I38-W63 HydrophobicContact CB-CZ3 3.93Å; I38-W63 HydrophobicContact CD1-CZ3 4.22Å; I38-W63 HydrophobicContact CG2-CE3 4.13Å; I38-W63 HydrophobicContact CG2-CZ3 3.84Å; I38-L120 HydrophobicContact CG2-CD2 3.71Å; I38-W184 HydrophobicContact CD1-CE3 3.89Å; I38-W184 HydrophobicContact CD1-CZ3 4.09Å; I38-W184 HydrophobicContact CG1-CD2 3.98Å; I38-W184 HydrophobicContact CG1-CE3 3.62Å; I38-W184 HydrophobicContact CG1-CH2 4.36Å; I38-W184 HydrophobicContact CG1-CZ3 3.82Å; I38-L188 HydrophobicContact CD1-CD1 4.37Å |
| 39 | K | 91.3 | Very high | 90 | Very high | 46 Ų | 46 | 43.8 Ų | 43.8 | 20% | 0.2 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60 | -42.7 | 172.2 | -77.1 | -177 | -177 | 173.8 | 0 | 111.5 | E35 K36 F41 I42 N43 L59 W63 | E35-K39 HydrophobicContact CG-CD 4.26Å; E35-K39 WeakPolarHBondContact O-CG 3.4Å; E35-K39 PolarHBondContact O-N 3.02Å; E35-K39 VanDerWaalsContact OE1-CE 3.23Å; E35-K39 WeakPolarHBondContact OE1-CE 3.45Å; E35-K39 IonicContact OE1-NZ 2.66Å; E35-K39 PolarHBondContact OE1-NZ 3.45Å; K36-K39 PolarHBondContact O-N 2.89Å; K39-F41 VanDerWaalsContact C-N 3.34Å; K39-F41 PolarHBondContact O-N 3.28Å; K39-I42 PolarHBondContact O-N 3.33Å; K39-N43 WeakPolarHBondContact O-CB 3.37Å; K39-N43 PolarHBondContact O-N 3.19Å; K39-L59 HydrophobicContact CB-CD1 4.44Å; K39-L59 HydrophobicContact CB-CD2 4.24Å; K39-L59 HydrophobicContact CB-CG 4.38Å; K39-L59 HydrophobicContact CG-CG 4.43Å; K39-L59 WeakPolarHBondContact O-CD1 3.47Å; K39-W63 HydrophobicContact CD-CB 4.5Å; K39-W63 HydrophobicContact CD-CG 4.42Å; K39-W63 HydrophobicContact CG-CB 4.15Å; K39-W63 HydrophobicContact CG-CD2 4.36Å; K39-W63 HydrophobicContact CG-CE3 4.38Å; K39-W63 HydrophobicContact CG-CG 4.26Å |
| 40 | E | 93.7 | Very high | 89.7 | Confident | 70 Ų | 70 | 46.5 Ų | 46.5 | 33% | 0.327 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.3 | -40.3 | 174.5 | -73 | 172.2 | -165.4 | 0 | 0 | 112.1 | K36 I37 I38 N43 K44 | K36-E40 VanDerWaalsContact CE-OE1 3.27Å; K36-E40 WeakPolarHBondContact CE-OE1 3.44Å; K36-E40 WeakPolarHBondContact O-CG 3.05Å; K36-E40 PolarHBondContact O-N 3.15Å; I37-E40 PolarHBondContact O-N 2.99Å; I38-E40 VanDerWaalsContact C-N 3.32Å; I38-E40 PolarHBondContact O-N 3.34Å; E40-N43 PolarHBondContact O-N 3.49Å; E40-K44 WeakPolarHBondContact O-CB 3.39Å; E40-K44 WeakPolarHBondContact O-CG 3.46Å; E40-K44 PolarHBondContact O-N 3.38Å |
| 41 | F | 95.1 | Very high | 89.1 | Confident | 17 Ų | 17 | 53.3 Ų | 53.3 | 8% | 0.075 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.3 | -45.3 | 172.1 | 160.7 | -104.8 | 0 | 0 | 0 | 112.5 | I37 I38 K39 N43 K44 S45 K112 V117 W184 | I37-F41 PolarHBondContact O-N 3.14Å; I38-F41 WeakPolarHBondContact O-CB 3.41Å; I38-F41 PolarHBondContact O-N 2.98Å; K39-F41 VanDerWaalsContact C-N 3.34Å; K39-F41 PolarHBondContact O-N 3.28Å; F41-N43 VanDerWaalsContact C-N 3.33Å; F41-N43 PolarHBondContact O-N 3.23Å; F41-K44 PolarHBondContact O-N 3.03Å; F41-S45 WeakPolarHBondContact CD2-OG 3.35Å; F41-S45 WeakPolarHBondContact CE2-OG 3.43Å; F41-S45 VanDerWaalsContact O-CB 3.31Å; F41-S45 WeakPolarHBondContact O-CB 3.28Å; F41-S45 PolarHBondContact O-N 3.3Å; F41-S45 PolarHBondContact O-OG 2.87Å; F41-K112 HydrophobicContact CD2-CG 4.19Å; F41-K112 HydrophobicContact CE2-CB 4.27Å; F41-K112 HydrophobicContact CE2-CG 4.23Å; F41-V117 HydrophobicContact CE1-CG2 4.4Å; F41-W184 HydrophobicContact CB-CZ2 3.86Å; F41-W184 AromaticContact CD1-CH2 3.67Å; F41-W184 HydrophobicContact CD1-CH2 3.67Å; F41-W184 AromaticContact CD1-CZ2 3.65Å; F41-W184 HydrophobicContact CD1-CZ2 3.65Å; F41-W184 AromaticContact CD2-CZ2 3.98Å; F41-W184 HydrophobicContact CD2-CZ2 3.98Å; F41-W184 AromaticContact CE1-CH2 3.94Å; F41-W184 HydrophobicContact CE1-CH2 3.94Å; F41-W184 HydrophobicContact CE1-CZ2 4.19Å; F41-W184 HydrophobicContact CE2-CZ2 4.48Å; F41-W184 HydrophobicContact CG-CH2 4.06Å; F41-W184 AromaticContact CG-CZ2 3.53Å; F41-W184 HydrophobicContact CG-CZ2 3.53Å |
| 42 | I | 93.3 | Very high | 88.9 | Confident | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61.4 | -45.7 | 177.7 | -67.3 | 166.5 | 0 | 0 | 0 | 109.8 | I38 K39 S45 L46 L59 L62 V117 | I38-I42 HydrophobicContact CG2-CD1 4.09Å; I38-I42 HydrophobicContact CG2-CG1 4.47Å; I38-I42 WeakPolarHBondContact O-CG1 3.16Å; I38-I42 PolarHBondContact O-N 3.46Å; K39-I42 PolarHBondContact O-N 3.33Å; I42-S45 PolarHBondContact O-N 2.87Å; I42-L46 HydrophobicContact CG2-CD1 3.91Å; I42-L46 HydrophobicContact CG2-CG 4.47Å; I42-L46 WeakPolarHBondContact O-CB 3.47Å; I42-L46 WeakPolarHBondContact O-CG 3.48Å; I42-L46 PolarHBondContact O-N 3.05Å; I42-L59 HydrophobicContact CB-CD1 3.83Å; I42-L59 HydrophobicContact CG2-CD1 3.61Å; I42-L62 HydrophobicContact CG2-CB 4.34Å; I42-L62 HydrophobicContact CG2-CD1 3.87Å; I42-V117 HydrophobicContact CB-CG2 4.33Å; I42-V117 HydrophobicContact CG1-CG1 4.12Å; I42-V117 HydrophobicContact CG1-CG2 4.1Å; I42-V117 HydrophobicContact CG2-CG1 4.44Å; I42-V117 HydrophobicContact CG2-CG2 4.17Å |
| 43 | N | 93.1 | Very high | 89 | Confident | 57 Ų | 57 | 62.2 Ų | 62.2 | 31% | 0.305 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -59.4 | -51.6 | 178.3 | -175.3 | 32.7 | 0 | 0 | 0 | 111.9 | K39 E40 F41 S45 L46 T47 P54 L59 | K39-N43 WeakPolarHBondContact O-CB 3.37Å; K39-N43 PolarHBondContact O-N 3.19Å; E40-N43 PolarHBondContact O-N 3.49Å; F41-N43 VanDerWaalsContact C-N 3.33Å; F41-N43 PolarHBondContact O-N 3.23Å; N43-S45 PolarHBondContact O-N 3.3Å; N43-L46 PolarHBondContact O-N 3.19Å; N43-T47 WeakPolarHBondContact O-CB 3.34Å; N43-T47 PolarHBondContact O-N 3.44Å; N43-T47 PolarHBondContact O-OG1 3.17Å; N43-P54 WeakPolarHBondContact OD1-CD 3.48Å; N43-P54 WeakPolarHBondContact OD1-CG 3.32Å; N43-L59 HydrophobicContact CB-CD1 4.26Å |
| 44 | K | 92.4 | Very high | 89.1 | Confident | 99 Ų | 99 | 61.6 Ų | 61.6 | 43% | 0.43 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59 | -48.8 | 177.5 | -72.4 | 177.9 | -175.5 | -179.2 | 0 | 111.3 | E40 F41 L46 T47 E48 E181 | E40-K44 WeakPolarHBondContact O-CB 3.39Å; E40-K44 WeakPolarHBondContact O-CG 3.46Å; E40-K44 PolarHBondContact O-N 3.38Å; F41-K44 PolarHBondContact O-N 3.03Å; K44-L46 PolarHBondContact O-N 2.95Å; K44-T47 PolarHBondContact O-N 3.26Å; K44-E48 WeakPolarHBondContact O-CG 3.33Å; K44-E48 PolarHBondContact O-N 2.82Å; K44-E181 IonicContact NZ-OE1 2.69Å; K44-E181 PolarHBondContact NZ-OE1 2.9Å |
| 45 | S | 91.6 | Very high | 89.2 | Confident | 6 Ų | 6 | 65 Ų | 65 | 4% | 0.042 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.8 | -38.8 | -177.7 | -54.8 | 0 | 0 | 0 | 0 | 113.1 | F41 I42 N43 K49 | F41-S45 WeakPolarHBondContact CD2-OG 3.35Å; F41-S45 WeakPolarHBondContact CE2-OG 3.43Å; F41-S45 VanDerWaalsContact O-CB 3.31Å; F41-S45 WeakPolarHBondContact O-CB 3.28Å; F41-S45 PolarHBondContact O-N 3.3Å; F41-S45 PolarHBondContact O-OG 2.87Å; I42-S45 PolarHBondContact O-N 2.87Å; N43-S45 PolarHBondContact O-N 3.3Å; S45-K49 WeakPolarHBondContact O-CG 3.28Å; S45-K49 PolarHBondContact O-N 3.47Å |
| 46 | L | 89.9 | Confident | 89.1 | Confident | 38 Ų | 38 | 70 Ų | 70 | 20% | 0.199 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -74.7 | -39.5 | 177.7 | -71.5 | 177 | 0 | 0 | 0 | 112.2 | I42 N43 K44 E48 K49 A50 P54 L62 | I42-L46 HydrophobicContact CG2-CD1 3.91Å; I42-L46 HydrophobicContact CG2-CG 4.47Å; I42-L46 WeakPolarHBondContact O-CB 3.47Å; I42-L46 WeakPolarHBondContact O-CG 3.48Å; I42-L46 PolarHBondContact O-N 3.05Å; N43-L46 PolarHBondContact O-N 3.19Å; K44-L46 PolarHBondContact O-N 2.95Å; L46-E48 VanDerWaalsContact C-N 3.31Å; L46-E48 PolarHBondContact O-N 2.7Å; L46-K49 PolarHBondContact O-N 3.29Å; L46-A50 WeakPolarHBondContact O-CB 3.5Å; L46-A50 PolarHBondContact O-N 3.3Å; L46-P54 HydrophobicContact CB-CG 4.24Å; L46-P54 HydrophobicContact CD1-CB 4.06Å; L46-P54 HydrophobicContact CD1-CG 4.11Å; L46-L62 HydrophobicContact CD1-CD1 3.56Å |
| 47 | T | 90.5 | Very high | 89 | Confident | 45 Ų | 45 | 68 Ų | 68 | 28% | 0.276 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.7 | -42.3 | 177.2 | -55.1 | 0 | 0 | 0 | 0 | 110.7 | N43 K44 K49 N51 | N43-T47 WeakPolarHBondContact O-CB 3.34Å; N43-T47 PolarHBondContact O-N 3.44Å; N43-T47 PolarHBondContact O-OG1 3.17Å; K44-T47 PolarHBondContact O-N 3.26Å; T47-K49 VanDerWaalsContact C-N 3.33Å; T47-K49 PolarHBondContact O-N 3.19Å; T47-N51 VanDerWaalsContact O-CA 3.22Å; T47-N51 WeakPolarHBondContact O-CA 3.29Å; T47-N51 PolarHBondContact O-N 3.03Å |
| 48 | E | 89.4 | Confident | 88.7 | Confident | 111 Ų | 111 | 70.2 Ų | 70.2 | 52% | 0.519 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -65 | -32.4 | 176.2 | -73.2 | -177.6 | -178.6 | 0 | 0 | 113.3 | K44 L46 K115 | K44-E48 WeakPolarHBondContact O-CG 3.33Å; K44-E48 PolarHBondContact O-N 2.82Å; L46-E48 VanDerWaalsContact C-N 3.31Å; L46-E48 PolarHBondContact O-N 2.7Å; E48-K115 IonicContact OE1-NZ 3.52Å; E48-K115 WeakPolarHBondContact OE2-CD 3.41Å; E48-K115 WeakPolarHBondContact OE2-CE 3.32Å; E48-K115 IonicContact OE2-NZ 2.7Å; E48-K115 PolarHBondContact OE2-NZ 2.81Å |
| 49 | K | 87.2 | Confident | 88.4 | Confident | 118 Ų | 118 | 71.6 Ų | 71.6 | 51% | 0.513 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -82.3 | -40.4 | 179.4 | -75.2 | -178.5 | -178.5 | -177.6 | 0 | 113.3 | S45 L46 T47 K115 E118 | S45-K49 WeakPolarHBondContact O-CG 3.28Å; S45-K49 PolarHBondContact O-N 3.47Å; L46-K49 PolarHBondContact O-N 3.29Å; T47-K49 VanDerWaalsContact C-N 3.33Å; T47-K49 PolarHBondContact O-N 3.19Å; K49-K115 WeakPolarHBondContact CE-O 3.3Å; K49-E118 IonicContact NZ-OE1 3.23Å; K49-E118 PolarHBondContact NZ-OE1 3.29Å; K49-E118 IonicContact NZ-OE2 3.29Å; K49-E118 PolarHBondContact NZ-OE2 2.69Å |
| 50 | A | 82.3 | Confident | 88 | Confident | 62 Ų | 62 | 72.7 Ų | 72.7 | 51% | 0.512 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -106.3 | -5.2 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | L46 I52 | L46-A50 WeakPolarHBondContact O-CB 3.5Å; L46-A50 PolarHBondContact O-N 3.3Å; A50-I52 PolarHBondContact O-N 2.65Å |
| 51 | N | 79 | Confident | 87.6 | Confident | 144 Ų | 144 | 72.5 Ų | 72.5 | 77% | 0.77 | 40% | 0.4 | S | S | * | . | S | Bend | trans | 56.1 | 11.3 | -173.9 | -67.9 | -34 | 0 | 0 | 0 | 115.4 | T47 | T47-N51 VanDerWaalsContact O-CA 3.22Å; T47-N51 WeakPolarHBondContact O-CA 3.29Å; T47-N51 PolarHBondContact O-N 3.03Å |
| 52 | I | 83.1 | Confident | 87.3 | Confident | 122 Ų | 122 | 73.3 Ų | 73.3 | 63% | 0.626 | 40% | 0.404 | S | S | * | . | S | Bend | trans | -133.4 | 131.9 | 178.6 | -56.1 | 174.8 | 0 | 0 | 0 | 107.7 | A50 | A50-I52 PolarHBondContact O-N 2.65Š|
| 53 | P | 84 | Confident | 87 | Confident | 88 Ų | 88 | 74.2 Ų | 74.2 | 57% | 0.571 | 41% | 0.408 | S | S | * | . | P | Polyproline II helix | trans | -64.1 | 133.8 | 175.8 | 25.3 | -32.4 | 0 | 0 | 0 | 110.6 | ||
| 54 | P | 86.9 | Confident | 86.6 | Confident | 24 Ų | 24 | 74.1 Ų | 74.1 | 16% | 0.156 | 41% | 0.411 | C | S | . | . | P | Polyproline II helix | trans | -60.6 | 147.5 | 174.7 | 26.5 | -36.2 | 0 | 0 | 0 | 111.2 | N43 L46 L58 | N43-P54 WeakPolarHBondContact OD1-CD 3.48Å; N43-P54 WeakPolarHBondContact OD1-CG 3.32Å; L46-P54 HydrophobicContact CB-CG 4.24Å; L46-P54 HydrophobicContact CD1-CB 4.06Å; L46-P54 HydrophobicContact CD1-CG 4.11Å; P54-L58 HydrophobicContact CB-CB 4.48Å; P54-L58 HydrophobicContact CB-CD2 3.93Å; P54-L58 HydrophobicContact CB-CG 4.39Å |
| 55 | S | 89.9 | Confident | 86.4 | Confident | 72 Ų | 72 | 73 Ų | 73 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | P | Polyproline II helix | trans | -64.3 | 152.9 | 171.2 | 66.4 | 0 | 0 | 0 | 0 | 111.1 | V57 L58 L59 | S55-V57 PolarHBondContact O-N 3.27Å; S55-L58 PolarHBondContact O-N 3.24Å; S55-L58 WeakPolarHBondContact OG-CB 3.39Å; S55-L58 PolarHBondContact OG-N 3.11Å; S55-L59 PolarHBondContact O-N 2.94Å |
| 56 | E | 85.4 | Confident | 86.3 | Confident | 167 Ų | 167 | 72.8 Ų | 72.8 | 78% | 0.78 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -57.4 | -33.5 | 176.1 | -68.3 | -167.7 | 157.4 | 0 | 0 | 112.4 | L59 T60 | E56-L59 PolarHBondContact O-N 3.02Å; E56-T60 VanDerWaalsContact O-CB 3.32Å; E56-T60 WeakPolarHBondContact O-CB 3.46Å; E56-T60 PolarHBondContact O-N 3.33Å; E56-T60 PolarHBondContact O-OG1 2.84Å |
| 57 | V | 85.3 | Confident | 86.1 | Confident | 109 Ų | 109 | 72.2 Ų | 72.2 | 66% | 0.661 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -63.3 | -45.8 | 175.6 | 178.8 | 0 | 0 | 0 | 0 | 110.8 | S55 S61 | S55-V57 PolarHBondContact O-N 3.27Å; V57-S61 WeakPolarHBondContact O-CB 3.4Å; V57-S61 PolarHBondContact O-N 2.84Å; V57-S61 PolarHBondContact O-OG 3.3Å |
| 58 | L | 86.6 | Confident | 86 | Confident | 79 Ų | 79 | 71 Ų | 71 | 41% | 0.414 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.9 | -43.4 | 177.6 | 179 | 60.1 | 0 | 0 | 0 | 111 | P54 S55 T60 S61 L62 | P54-L58 HydrophobicContact CB-CB 4.48Å; P54-L58 HydrophobicContact CB-CD2 3.93Å; P54-L58 HydrophobicContact CB-CG 4.39Å; S55-L58 PolarHBondContact O-N 3.24Å; S55-L58 WeakPolarHBondContact OG-CB 3.39Å; S55-L58 PolarHBondContact OG-N 3.11Å; L58-T60 PolarHBondContact O-N 3.4Å; L58-S61 PolarHBondContact O-N 3.11Å; L58-L62 HydrophobicContact CD1-CD1 4.16Å; L58-L62 HydrophobicContact CD1-CG 4.14Å; L58-L62 HydrophobicContact CG-CD1 4.11Å; L58-L62 HydrophobicContact CG-CG 4.49Å; L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 3.35Å |
| 59 | L | 87 | Confident | 86.1 | Confident | 30 Ų | 30 | 67.1 Ų | 67.1 | 16% | 0.157 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -60.9 | -45.4 | 178.9 | -172.3 | 65.7 | 0 | 0 | 0 | 111.9 | K39 I42 N43 S55 E56 S61 L62 W63 | K39-L59 HydrophobicContact CB-CD1 4.44Å; K39-L59 HydrophobicContact CB-CD2 4.24Å; K39-L59 HydrophobicContact CB-CG 4.38Å; K39-L59 HydrophobicContact CG-CG 4.43Å; K39-L59 WeakPolarHBondContact O-CD1 3.47Å; I42-L59 HydrophobicContact CB-CD1 3.83Å; I42-L59 HydrophobicContact CG2-CD1 3.61Å; N43-L59 HydrophobicContact CB-CD1 4.26Å; S55-L59 PolarHBondContact O-N 2.94Å; E56-L59 PolarHBondContact O-N 3.02Å; L59-S61 VanDerWaalsContact C-N 3.32Å; L59-S61 PolarHBondContact O-N 2.95Å; L59-L62 PolarHBondContact O-N 2.78Å; L59-W63 WeakPolarHBondContact O-CB 3.42Å; L59-W63 PolarHBondContact O-N 3.06Å |
| 60 | T | 83.6 | Confident | 86.4 | Confident | 69 Ų | 69 | 61.5 Ų | 61.5 | 42% | 0.423 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -64.5 | -38.4 | 176.6 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | E56 L58 S64 | E56-T60 VanDerWaalsContact O-CB 3.32Å; E56-T60 WeakPolarHBondContact O-CB 3.46Å; E56-T60 PolarHBondContact O-N 3.33Å; E56-T60 PolarHBondContact O-OG1 2.84Å; L58-T60 PolarHBondContact O-N 3.4Å; T60-S64 WeakPolarHBondContact O-CB 3.28Å; T60-S64 PolarHBondContact O-N 3.39Å; T60-S64 PolarHBondContact O-OG 3.1Å |
| 61 | S | 84.2 | Confident | 86.9 | Confident | 66 Ų | 66 | 58.9 Ų | 58.9 | 46% | 0.462 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.3 | -44.1 | 177.1 | -59.5 | 0 | 0 | 0 | 0 | 112 | V57 L58 L59 S64 L65 | V57-S61 WeakPolarHBondContact O-CB 3.4Å; V57-S61 PolarHBondContact O-N 2.84Å; V57-S61 PolarHBondContact O-OG 3.3Å; L58-S61 PolarHBondContact O-N 3.11Å; L59-S61 VanDerWaalsContact C-N 3.32Å; L59-S61 PolarHBondContact O-N 2.95Å; S61-S64 PolarHBondContact O-N 2.97Å; S61-L65 WeakPolarHBondContact O-CB 3.28Å; S61-L65 PolarHBondContact O-N 3.48Å |
| 62 | L | 88.8 | Confident | 87.5 | Confident | 33 Ų | 33 | 54.1 Ų | 54.1 | 17% | 0.173 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -68.1 | -38.1 | 178.3 | -72.2 | 174 | 0 | 0 | 0 | 112.6 | I42 L46 L58 L59 L65 S66 | I42-L62 HydrophobicContact CG2-CB 4.34Å; I42-L62 HydrophobicContact CG2-CD1 3.87Å; L46-L62 HydrophobicContact CD1-CD1 3.56Å; L58-L62 HydrophobicContact CD1-CD1 4.16Å; L58-L62 HydrophobicContact CD1-CG 4.14Å; L58-L62 HydrophobicContact CG-CD1 4.11Å; L58-L62 HydrophobicContact CG-CG 4.49Å; L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 3.35Å; L59-L62 PolarHBondContact O-N 2.78Å; L62-L65 PolarHBondContact O-N 3.41Å; L62-S66 WeakPolarHBondContact O-CB 3.34Å; L62-S66 PolarHBondContact O-N 2.64Å; L62-S66 PolarHBondContact O-OG 3.09Å |
| 63 | W | 86.9 | Confident | 88.2 | Confident | 20 Ų | 20 | 48.3 Ų | 48.3 | 8% | 0.076 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -58.9 | -52.5 | 169.9 | 170.1 | -111.1 | 0 | 0 | 0 | 111.2 | I31 E35 I38 K39 L59 L65 S66 V67 | I31-W63 HydrophobicContact CD1-CH2 4.16Å; I31-W63 HydrophobicContact CD1-CZ3 4.14Å; I31-W63 HydrophobicContact CG1-CH2 3.67Å; I31-W63 HydrophobicContact CG1-CZ2 4.44Å; I31-W63 HydrophobicContact CG1-CZ3 4.07Å; I31-W63 VanDerWaalsContact O-CH2 3.27Å; I31-W63 WeakPolarHBondContact O-CH2 3.17Å; E35-W63 VanDerWaalsContact CA-CH2 3.45Å; E35-W63 HydrophobicContact CB-CH2 3.63Å; E35-W63 HydrophobicContact CB-CZ2 3.48Å; E35-W63 VanDerWaalsContact CB-CZ2 3.48Å; E35-W63 HydrophobicContact CB-CZ3 4.44Å; E35-W63 HydrophobicContact CG-CD2 4.18Å; E35-W63 HydrophobicContact CG-CH2 3.91Å; E35-W63 HydrophobicContact CG-CZ2 3.41Å; E35-W63 VanDerWaalsContact CG-CZ2 3.41Å; E35-W63 HydrophobicContact CG-CZ3 4.49Å; E35-W63 PolarHBondContact OE1-NE1 3.32Å; I38-W63 HydrophobicContact CB-CZ3 3.93Å; I38-W63 HydrophobicContact CD1-CZ3 4.22Å; I38-W63 HydrophobicContact CG2-CE3 4.13Å; I38-W63 HydrophobicContact CG2-CZ3 3.84Å; K39-W63 HydrophobicContact CD-CB 4.5Å; K39-W63 HydrophobicContact CD-CG 4.42Å; K39-W63 HydrophobicContact CG-CB 4.15Å; K39-W63 HydrophobicContact CG-CD2 4.36Å; K39-W63 HydrophobicContact CG-CE3 4.38Å; K39-W63 HydrophobicContact CG-CG 4.26Å; L59-W63 WeakPolarHBondContact O-CB 3.42Å; L59-W63 PolarHBondContact O-N 3.06Å; W63-L65 VanDerWaalsContact C-N 3.27Å; W63-L65 PolarHBondContact O-N 3.27Å; W63-S66 WeakPolarHBondContact O-CB 3.42Å; W63-S66 PolarHBondContact O-N 2.65Å; W63-V67 HydrophobicContact CD2-CG2 4.17Å; W63-V67 HydrophobicContact CH2-CG2 4.14Å; W63-V67 HydrophobicContact CZ2-CG2 3.7Å; W63-V67 PolarHBondContact O-N 2.86Å |
| 64 | S | 84.3 | Confident | 88.7 | Confident | 54 Ų | 54 | 44.1 Ų | 44.1 | 38% | 0.378 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59 | -40.6 | 180 | -57 | 0 | 0 | 0 | 0 | 111.4 | T60 S61 V67 A68 | T60-S64 WeakPolarHBondContact O-CB 3.28Å; T60-S64 PolarHBondContact O-N 3.39Å; T60-S64 PolarHBondContact O-OG 3.1Å; S61-S64 PolarHBondContact O-N 2.97Å; S64-V67 PolarHBondContact O-N 3.47Å; S64-A68 WeakPolarHBondContact O-CB 3.17Å; S64-A68 PolarHBondContact O-N 2.86Å |
| 65 | L | 88.2 | Confident | 89 | Confident | 77 Ų | 77 | 45.2 Ų | 45.2 | 40% | 0.403 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.5 | -44.2 | 173.7 | -180 | 60.6 | 0 | 0 | 0 | 111.8 | S61 L62 W63 V67 A68 I69 I121 | S61-L65 WeakPolarHBondContact O-CB 3.28Å; S61-L65 PolarHBondContact O-N 3.48Å; L62-L65 PolarHBondContact O-N 3.41Å; W63-L65 VanDerWaalsContact C-N 3.27Å; W63-L65 PolarHBondContact O-N 3.27Å; L65-V67 VanDerWaalsContact C-N 3.27Å; L65-V67 PolarHBondContact O-N 2.89Å; L65-A68 PolarHBondContact O-N 3Å; L65-I69 HydrophobicContact CD1-CB 4.39Å; L65-I69 HydrophobicContact CD1-CD1 4.35Å; L65-I69 WeakPolarHBondContact O-CB 3.42Å; L65-I69 VanDerWaalsContact O-CG2 3.28Å; L65-I69 WeakPolarHBondContact O-CG2 3.49Å; L65-I69 PolarHBondContact O-N 3.43Å; L65-I121 HydrophobicContact CD2-CD1 3.96Å; L65-I121 HydrophobicContact CG-CD1 4.37Å; L65-I121 HydrophobicContact CG-CG2 4.46Å |
| 66 | S | 89.6 | Confident | 89.3 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62 | -34.5 | 178.8 | -57.7 | 0 | 0 | 0 | 0 | 112.6 | L62 W63 R124 | L62-S66 WeakPolarHBondContact O-CB 3.34Å; L62-S66 PolarHBondContact O-N 2.64Å; L62-S66 PolarHBondContact O-OG 3.09Å; W63-S66 WeakPolarHBondContact O-CB 3.42Å; W63-S66 PolarHBondContact O-N 2.65Å; S66-R124 WeakPolarHBondContact O-CG 3.48Å; S66-R124 PolarHBondContact O-NE 3.33Å |
| 67 | V | 86.5 | Confident | 89.7 | Confident | 26 Ų | 26 | 38 Ų | 38 | 16% | 0.158 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -75 | -51.5 | 173.8 | 177.9 | 0 | 0 | 0 | 0 | 110.7 | I31 W63 S64 L65 F70 | I31-V67 HydrophobicContact CG1-CG2 4.03Å; I31-V67 HydrophobicContact CG2-CG1 4.5Å; I31-V67 HydrophobicContact CG2-CG2 4.26Å; W63-V67 HydrophobicContact CD2-CG2 4.17Å; W63-V67 HydrophobicContact CH2-CG2 4.14Å; W63-V67 HydrophobicContact CZ2-CG2 3.7Å; W63-V67 PolarHBondContact O-N 2.86Å; S64-V67 PolarHBondContact O-N 3.47Å; L65-V67 VanDerWaalsContact C-N 3.27Å; L65-V67 PolarHBondContact O-N 2.89Å; V67-F70 WeakPolarHBondContact O-CB 3.19Å |
| 68 | A | 86.9 | Confident | 90 | Very high | 19 Ų | 19 | 33 Ų | 33 | 16% | 0.157 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -75.1 | -29.6 | -169.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | S64 L65 F70 S71 V72 F414 | S64-A68 WeakPolarHBondContact O-CB 3.17Å; S64-A68 PolarHBondContact O-N 2.86Å; L65-A68 PolarHBondContact O-N 3Å; A68-F70 PolarHBondContact O-N 3.33Å; A68-S71 WeakPolarHBondContact O-CB 3.37Å; A68-S71 PolarHBondContact O-N 3.36Å; A68-V72 PolarHBondContact O-N 3.19Å; A68-F414 HydrophobicContact CB-CD2 4.07Å; A68-F414 HydrophobicContact CB-CE2 3.83Å |
| 69 | I | 92.9 | Very high | 90.1 | Very high | 30 Ų | 30 | 34.4 Ų | 34.4 | 15% | 0.154 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -62.6 | -25.6 | 179.8 | -160.6 | 67.8 | 0 | 0 | 0 | 112.5 | L65 S71 V72 G73 I121 R124 L125 | L65-I69 HydrophobicContact CD1-CB 4.39Å; L65-I69 HydrophobicContact CD1-CD1 4.35Å; L65-I69 WeakPolarHBondContact O-CB 3.42Å; L65-I69 VanDerWaalsContact O-CG2 3.28Å; L65-I69 WeakPolarHBondContact O-CG2 3.49Å; L65-I69 PolarHBondContact O-N 3.43Å; I69-S71 VanDerWaalsContact C-N 3.27Å; I69-S71 PolarHBondContact O-N 2.93Å; I69-V72 HydrophobicContact CD1-CB 4.19Å; I69-V72 HydrophobicContact CD1-CG1 4.45Å; I69-V72 HydrophobicContact CD1-CG2 4.36Å; I69-V72 PolarHBondContact O-N 3.16Å; I69-G73 PolarHBondContact O-N 2.91Å; I69-I121 HydrophobicContact CG1-CG2 4.33Å; I69-I121 HydrophobicContact CG2-CG2 4.14Å; I69-R124 HydrophobicContact CG2-CB 3.64Å; I69-L125 HydrophobicContact CD1-CD1 4.33Å; I69-L125 HydrophobicContact CG1-CB 3.91Å; I69-L125 HydrophobicContact CG1-CD1 4.03Å; I69-L125 HydrophobicContact CG1-CG 4.43Å |
| 70 | F | 93.8 | Very high | 90.3 | Very high | 1 Ų | 1 | 34.4 Ų | 34.4 | 0% | 0.004 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.3 | -41.5 | 170.4 | 171.9 | -106.8 | 0 | 0 | 0 | 111.7 | F24 N27 V67 A68 G73 G74 R124 I127 G128 C131 W410 | F24-F70 HydrophobicContact CD2-CZ 4.21Å; F24-F70 HydrophobicContact CE2-CE1 4.45Å; F24-F70 HydrophobicContact CE2-CZ 4.46Å; N27-F70 HydrophobicContact CB-CE2 3.85Å; N27-F70 HydrophobicContact CB-CZ 4.05Å; V67-F70 WeakPolarHBondContact O-CB 3.19Å; A68-F70 PolarHBondContact O-N 3.33Å; F70-G73 PolarHBondContact O-N 3.49Å; F70-G74 PolarHBondContact O-N 3.01Å; F70-R124 WeakPolarHBondContact CA-O 3.37Å; F70-I127 HydrophobicContact CD2-CG2 3.98Å; F70-I127 HydrophobicContact CE2-CG2 4.24Å; F70-G128 VanDerWaalsContact CD2-CA 3.41Å; F70-G128 VanDerWaalsContact O-CA 3.31Å; F70-G128 WeakPolarHBondContact O-CA 3.41Å; F70-C131 HydrophobicContact CE2-CB 3.93Å; F70-C131 HydrophobicContact CZ-CB 3.92Å; F70-W410 HydrophobicContact CD1-CH2 4.28Å; F70-W410 AromaticContact CD1-CZ3 3.85Å; F70-W410 HydrophobicContact CD1-CZ3 3.85Å; F70-W410 AromaticContact CE1-CH2 3.54Å; F70-W410 HydrophobicContact CE1-CH2 3.54Å; F70-W410 AromaticContact CE1-CZ3 3.51Å; F70-W410 HydrophobicContact CE1-CZ3 3.51Å; F70-W410 HydrophobicContact CE2-CH2 4.46Å; F70-W410 AromaticContact CZ-CH2 3.66Å; F70-W410 HydrophobicContact CZ-CH2 3.66Å; F70-W410 HydrophobicContact CZ-CZ3 4.09Å |
| 71 | S | 91.5 | Very high | 90.5 | Very high | 6 Ų | 6 | 31.2 Ų | 31.2 | 4% | 0.042 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -69.6 | -37.8 | 178.3 | -54.3 | 0 | 0 | 0 | 0 | 111.7 | A68 I69 G73 G74 M75 N413 | A68-S71 WeakPolarHBondContact O-CB 3.37Å; A68-S71 PolarHBondContact O-N 3.36Å; I69-S71 VanDerWaalsContact C-N 3.27Å; I69-S71 PolarHBondContact O-N 2.93Å; S71-G73 VanDerWaalsContact C-N 3.33Å; S71-G73 PolarHBondContact O-N 3.46Å; S71-G74 CarbonylContact O-C 3.59Å; S71-G74 WeakPolarHBondContact O-CA 3.45Å; S71-G74 PolarHBondContact O-N 3.36Å; S71-G74 VanDerWaalsContact O-N 3.12Å; S71-M75 VanDerWaalsContact O-CG 3.3Å; S71-M75 WeakPolarHBondContact O-CG 3.44Å; S71-M75 PolarHBondContact O-N 3.35Å; S71-N413 PolarHBondContact OG-OD1 2.86Å |
| 72 | V | 93.3 | Very high | 90.4 | Very high | 44 Ų | 44 | 29 Ų | 29 | 27% | 0.267 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60.5 | -44.7 | 173 | 178.3 | 0 | 0 | 0 | 0 | 110.8 | A68 I69 G74 M75 I76 F414 | A68-V72 PolarHBondContact O-N 3.19Å; I69-V72 HydrophobicContact CD1-CB 4.19Å; I69-V72 HydrophobicContact CD1-CG1 4.45Å; I69-V72 HydrophobicContact CD1-CG2 4.36Å; I69-V72 PolarHBondContact O-N 3.16Å; V72-G74 VanDerWaalsContact C-N 3.33Å; V72-G74 PolarHBondContact O-N 3.06Å; V72-M75 WeakPolarHBondContact O-CB 3.39Å; V72-M75 PolarHBondContact O-N 2.82Å; V72-I76 HydrophobicContact CG1-CD1 4.26Å; V72-I76 WeakPolarHBondContact O-CG1 3.14Å; V72-I76 PolarHBondContact O-N 3.4Å; V72-I76 VanDerWaalsContact O-N 3.14Å; V72-F414 HydrophobicContact CG2-CD2 4.12Å; V72-F414 HydrophobicContact CG2-CE2 3.9Å |
| 73 | G | 96.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -57.4 | -46.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | I69 F70 S71 M75 I76 G77 G128 L129 | I69-G73 PolarHBondContact O-N 2.91Å; F70-G73 PolarHBondContact O-N 3.49Å; S71-G73 VanDerWaalsContact C-N 3.33Å; S71-G73 PolarHBondContact O-N 3.46Å; G73-M75 VanDerWaalsContact C-N 3.34Å; G73-M75 PolarHBondContact O-N 2.92Å; G73-I76 PolarHBondContact O-N 3.38Å; G73-G77 PolarHBondContact O-N 3.46Å; G73-G128 CarbonylContact C-O 3.58Å; G73-L129 WeakPolarHBondContact O-CA 3.26Å; G73-L129 WeakPolarHBondContact O-CD2 3.39Å |
| 74 | G | 94.8 | Very high | 90.5 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -58.5 | -40.3 | 177 | 0 | 0 | 0 | 0 | 0 | 113.9 | F70 S71 V72 G77 S78 G128 G132 | F70-G74 PolarHBondContact O-N 3.01Å; S71-G74 CarbonylContact O-C 3.59Å; S71-G74 WeakPolarHBondContact O-CA 3.45Å; S71-G74 PolarHBondContact O-N 3.36Å; S71-G74 VanDerWaalsContact O-N 3.12Å; V72-G74 VanDerWaalsContact C-N 3.33Å; V72-G74 PolarHBondContact O-N 3.06Å; G74-G77 PolarHBondContact O-N 2.61Å; G74-S78 VanDerWaalsContact O-CB 3.27Å; G74-S78 WeakPolarHBondContact O-CB 3.13Å; G74-S78 PolarHBondContact O-N 2.89Å; G74-S78 PolarHBondContact O-OG 2.97Å; G74-G128 VanDerWaalsContact CA-O 3.27Å; G74-G128 WeakPolarHBondContact CA-O 3.37Å; G74-G128 PolarHBondContact N-O 2.61Å; G74-G132 WeakPolarHBondContact O-CA 3.49Å |
| 75 | M | 93.6 | Very high | 90.6 | Very high | 48 Ų | 48 | 32.3 Ų | 32.3 | 24% | 0.236 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.6 | -50.9 | 174.5 | -68.2 | 167.1 | 58.6 | 0 | 0 | 111.4 | S71 V72 G73 G77 S78 F79 W410 T411 F414 | S71-M75 VanDerWaalsContact O-CG 3.3Å; S71-M75 WeakPolarHBondContact O-CG 3.44Å; S71-M75 PolarHBondContact O-N 3.35Å; V72-M75 WeakPolarHBondContact O-CB 3.39Å; V72-M75 PolarHBondContact O-N 2.82Å; G73-M75 VanDerWaalsContact C-N 3.34Å; G73-M75 PolarHBondContact O-N 2.92Å; M75-G77 VanDerWaalsContact C-N 3.35Å; M75-G77 PolarHBondContact O-N 3.5Å; M75-S78 PolarHBondContact O-OG 3.44Å; M75-S78 VanDerWaalsContact O-OG 3.12Å; M75-F79 WeakPolarHBondContact O-CB 3.39Å; M75-F79 PolarHBondContact O-N 3.24Å; M75-F79 VanDerWaalsContact O-N 3.1Å; M75-W410 HydrophobicContact CB-CB 4.3Å; M75-W410 HydrophobicContact CG-CB 3.54Å; M75-T411 HydrophobicContact CE-CG2 4.37Å; M75-T411 WeakPolarHBondContact CE-OG1 3.22Å; M75-F414 HydrophobicContact SD-CB 4.42Å |
| 76 | I | 95 | Very high | 90.4 | Very high | 87 Ų | 87 | 31 Ų | 31 | 45% | 0.446 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64.4 | -42.7 | -180 | -63 | 167.6 | 0 | 0 | 0 | 110.4 | V72 G73 S80 L129 | V72-I76 HydrophobicContact CG1-CD1 4.26Å; V72-I76 WeakPolarHBondContact O-CG1 3.14Å; V72-I76 PolarHBondContact O-N 3.4Å; V72-I76 VanDerWaalsContact O-N 3.14Å; G73-I76 PolarHBondContact O-N 3.38Å; I76-S80 WeakPolarHBondContact O-CB 3.22Å; I76-S80 PolarHBondContact O-N 3.49Å; I76-S80 VanDerWaalsContact O-N 3.15Å; I76-S80 PolarHBondContact O-OG 3.36Å; I76-L129 HydrophobicContact CB-CD2 3.55Å; I76-L129 HydrophobicContact CD1-CD2 4.49Å; I76-L129 HydrophobicContact CG2-CD2 3.46Å; I76-L129 VanDerWaalsContact CG2-CD2 3.46Å |
| 77 | G | 94.9 | Very high | 90.3 | Very high | 1 Ų | 1 | 39.6 Ų | 39.6 | 1% | 0.01 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -63.7 | -51.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | G73 G74 M75 F79 S80 V81 L133 | G73-G77 PolarHBondContact O-N 3.46Å; G74-G77 PolarHBondContact O-N 2.61Å; M75-G77 VanDerWaalsContact C-N 3.35Å; M75-G77 PolarHBondContact O-N 3.5Å; G77-F79 VanDerWaalsContact C-N 3.33Å; G77-F79 PolarHBondContact O-N 3.47Å; G77-S80 PolarHBondContact O-N 2.93Å; G77-V81 PolarHBondContact O-N 3.1Å; G77-L133 WeakPolarHBondContact O-CD2 3.3Å; G77-L133 WeakPolarHBondContact O-CG 3.49Å |
| 78 | S | 91.1 | Very high | 90.6 | Very high | 2 Ų | 2 | 41.8 Ų | 41.8 | 1% | 0.014 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -63 | -37.9 | -179.8 | 58.1 | 0 | 0 | 0 | 0 | 112.6 | G74 M75 S80 V81 G132 C407 | G74-S78 VanDerWaalsContact O-CB 3.27Å; G74-S78 WeakPolarHBondContact O-CB 3.13Å; G74-S78 PolarHBondContact O-N 2.89Å; G74-S78 PolarHBondContact O-OG 2.97Å; M75-S78 PolarHBondContact O-OG 3.44Å; M75-S78 VanDerWaalsContact O-OG 3.12Å; S78-S80 PolarHBondContact O-N 3.4Å; S78-V81 WeakPolarHBondContact O-CB 3.49Å; S78-V81 VanDerWaalsContact O-CG2 3.24Å; S78-V81 WeakPolarHBondContact O-CG2 3.34Å; S78-V81 PolarHBondContact O-N 3.46Å; S78-G132 WeakPolarHBondContact CA-O 3.28Å; S78-C407 PolarHBondContact OG-N 3.42Å |
| 79 | F | 89.6 | Confident | 90.8 | Very high | 110 Ų | 110 | 40.9 Ų | 40.9 | 48% | 0.482 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -66.9 | -27.8 | 174.6 | -165.3 | -104 | 0 | 0 | 0 | 112.8 | M75 G77 V257 C407 | M75-F79 WeakPolarHBondContact O-CB 3.39Å; M75-F79 PolarHBondContact O-N 3.24Å; M75-F79 VanDerWaalsContact O-N 3.1Å; G77-F79 VanDerWaalsContact C-N 3.33Å; G77-F79 PolarHBondContact O-N 3.47Å; F79-V257 HydrophobicContact CE2-CG1 4.45Å; F79-V257 HydrophobicContact CE2-CG2 4.21Å; F79-V257 HydrophobicContact CZ-CG2 4.29Å; F79-C407 HydrophobicContact CB-CB 4.49Å; F79-C407 HydrophobicContact CD2-CB 4.3Å |
| 80 | S | 91.1 | Very high | 90.8 | Very high | 29 Ų | 29 | 39.6 Ų | 39.6 | 20% | 0.203 | 19% | 0.194 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.8 | -3.8 | -179 | -58.6 | 0 | 0 | 0 | 0 | 114.1 | I76 G77 S78 G82 L83 F84 | I76-S80 WeakPolarHBondContact O-CB 3.22Å; I76-S80 PolarHBondContact O-N 3.49Å; I76-S80 VanDerWaalsContact O-N 3.15Å; I76-S80 PolarHBondContact O-OG 3.36Å; G77-S80 PolarHBondContact O-N 2.93Å; S78-S80 PolarHBondContact O-N 3.4Å; S80-G82 VanDerWaalsContact C-N 3.31Å; S80-G82 PolarHBondContact O-N 3.43Å; S80-L83 WeakPolarHBondContact O-CB 3.49Å; S80-L83 PolarHBondContact O-N 3.5Å; S80-L83 VanDerWaalsContact O-N 3.1Å; S80-F84 WeakPolarHBondContact O-CD2 2.92Å |
| 81 | V | 87.8 | Confident | 90.9 | Very high | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.012 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -51.7 | -46.9 | -176.1 | 163.9 | 0 | 0 | 0 | 0 | 112.6 | G77 S78 L83 F84 V85 L133 F137 M140 | G77-V81 PolarHBondContact O-N 3.1Å; S78-V81 WeakPolarHBondContact O-CB 3.49Å; S78-V81 VanDerWaalsContact O-CG2 3.24Å; S78-V81 WeakPolarHBondContact O-CG2 3.34Å; S78-V81 PolarHBondContact O-N 3.46Å; V81-L83 PolarHBondContact O-N 3.13Å; V81-F84 PolarHBondContact O-N 3.44Å; V81-F84 VanDerWaalsContact O-N 3.16Å; V81-V85 HydrophobicContact CG1-CG1 4.11Å; V81-V85 HydrophobicContact CG1-CG2 4.47Å; V81-V85 WeakPolarHBondContact O-CG2 3.46Å; V81-V85 PolarHBondContact O-N 2.89Å; V81-V85 VanDerWaalsContact O-N 3.15Å; V81-L133 HydrophobicContact CG2-CD2 4.3Å; V81-F137 HydrophobicContact CB-CD1 4.48Å; V81-F137 HydrophobicContact CB-CE1 4.15Å; V81-F137 HydrophobicContact CG1-CD1 3.9Å; V81-F137 HydrophobicContact CG1-CE1 3.91Å; V81-F137 HydrophobicContact CG2-CD1 4.24Å; V81-F137 HydrophobicContact CG2-CE1 4.07Å; V81-M140 HydrophobicContact CG1-CE 4.38Å |
| 82 | G | 82.4 | Confident | 91.2 | Very high | 19 Ų | 19 | 44.4 Ų | 44.4 | 20% | 0.196 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.4 | -29.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | S80 F84 N86 | S80-G82 VanDerWaalsContact C-N 3.31Å; S80-G82 PolarHBondContact O-N 3.43Å; G82-F84 VanDerWaalsContact C-N 3.34Å; G82-N86 WeakPolarHBondContact O-CB 3.27Å; G82-N86 PolarHBondContact O-ND2 3.44Å; G82-N86 VanDerWaalsContact O-ND2 3.14Å |
| 83 | L | 87.6 | Confident | 91.3 | Very high | 124 Ų | 124 | 42.3 Ų | 42.3 | 65% | 0.649 | 20% | 0.202 | S | C | * | . | H | α-helix | trans | -69.2 | -34.6 | 179.8 | -60.1 | 174.9 | 0 | 0 | 0 | 111.7 | S80 V81 R87 | S80-L83 WeakPolarHBondContact O-CB 3.49Å; S80-L83 PolarHBondContact O-N 3.5Å; S80-L83 VanDerWaalsContact O-N 3.1Å; V81-L83 PolarHBondContact O-N 3.13Å; L83-R87 VanDerWaalsContact O-CB 3.3Å; L83-R87 WeakPolarHBondContact O-CB 3.3Å |
| 84 | F | 89.8 | Confident | 91.4 | Very high | 53 Ų | 53 | 42.4 Ų | 42.4 | 23% | 0.232 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -85.2 | -54.2 | -177.1 | -76.1 | -96.9 | 0 | 0 | 0 | 111.5 | S80 V81 G82 N86 R87 F88 S93 I96 V97 L133 F137 | S80-F84 WeakPolarHBondContact O-CD2 2.92Å; V81-F84 PolarHBondContact O-N 3.44Å; V81-F84 VanDerWaalsContact O-N 3.16Å; G82-F84 VanDerWaalsContact C-N 3.34Å; F84-N86 PolarHBondContact O-N 3.25Å; F84-N86 VanDerWaalsContact O-N 3.17Å; F84-R87 PolarHBondContact O-N 3.34Å; F84-R87 VanDerWaalsContact O-N 3.11Å; F84-F88 HydrophobicContact CB-CD2 4.3Å; F84-F88 AromaticContact CD1-CD2 3.84Å; F84-F88 HydrophobicContact CD1-CD2 3.84Å; F84-F88 AromaticContact CD1-CE2 3.87Å; F84-F88 HydrophobicContact CD1-CE2 3.87Å; F84-F88 HydrophobicContact CE1-CE2 4.29Å; F84-F88 HydrophobicContact CG-CD2 4.38Å; F84-F88 HydrophobicContact CG-CE2 4.5Å; F84-F88 PolarHBondContact O-N 3.34Å; F84-S93 WeakPolarHBondContact CB-OG 3.15Å; F84-S93 PolarHBondContact O-OG 2.99Å; F84-S93 VanDerWaalsContact O-OG 3.13Å; F84-I96 HydrophobicContact CE1-CG2 4.49Å; F84-V97 HydrophobicContact CD1-CG1 4.44Å; F84-V97 HydrophobicContact CE1-CG1 4.35Å; F84-L133 HydrophobicContact CD2-CD2 3.99Å; F84-L133 HydrophobicContact CE2-CD2 4.22Å; F84-F137 HydrophobicContact CB-CE1 4.01Å; F84-F137 HydrophobicContact CB-CZ 3.61Å; F84-F137 HydrophobicContact CG-CZ 4.06Å |
| 85 | V | 86.7 | Confident | 91.5 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63 | -30.2 | -170.7 | -60.9 | 0 | 0 | 0 | 0 | 113.5 | V81 G89 R90 S93 F137 M140 | V81-V85 HydrophobicContact CG1-CG1 4.11Å; V81-V85 HydrophobicContact CG1-CG2 4.47Å; V81-V85 WeakPolarHBondContact O-CG2 3.46Å; V81-V85 PolarHBondContact O-N 2.89Å; V81-V85 VanDerWaalsContact O-N 3.15Å; V85-G89 WeakPolarHBondContact O-CA 3.3Å; V85-G89 PolarHBondContact O-N 3.21Å; V85-R90 PolarHBondContact O-NH1 3.03Å; V85-S93 PolarHBondContact N-OG 2.95Å; V85-F137 HydrophobicContact CG1-CD1 3.4Å; V85-F137 VanDerWaalsContact CG1-CD1 3.4Å; V85-F137 HydrophobicContact CG1-CE1 3.48Å; V85-F137 VanDerWaalsContact CG1-CE1 3.48Å; V85-F137 HydrophobicContact CG1-CG 4.43Å; V85-M140 HydrophobicContact CB-SD 4Å; V85-M140 HydrophobicContact CG1-SD 4.02Å; V85-M140 HydrophobicContact CG2-CE 4.22Å; V85-M140 HydrophobicContact CG2-SD 3.87Å |
| 86 | N | 82.8 | Confident | 91.7 | Very high | 51 Ų | 51 | 46.6 Ų | 46.6 | 27% | 0.273 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -84 | -30.6 | 178.8 | -69.5 | -33.4 | 0 | 0 | 0 | 112.8 | G82 F84 | G82-N86 WeakPolarHBondContact O-CB 3.27Å; G82-N86 PolarHBondContact O-ND2 3.44Å; G82-N86 VanDerWaalsContact O-ND2 3.14Å; F84-N86 PolarHBondContact O-N 3.25Å; F84-N86 VanDerWaalsContact O-N 3.17Å |
| 87 | R | 87.6 | Confident | 91.9 | Very high | 180 Ų | 180 | 42.6 Ų | 42.6 | 68% | 0.679 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -85.1 | -46.5 | -178.3 | -173.1 | 172.6 | -178.3 | 170.6 | 1.1 | 112.2 | L83 F84 R216 | L83-R87 VanDerWaalsContact O-CB 3.3Å; L83-R87 WeakPolarHBondContact O-CB 3.3Å; F84-R87 PolarHBondContact O-N 3.34Å; F84-R87 VanDerWaalsContact O-N 3.11Å; R87-R216 PolarHBondContact O-NH2 3.17Å |
| 88 | F | 92.5 | Very high | 92 | Very high | 72 Ų | 72 | 42.6 Ų | 42.6 | 32% | 0.316 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -102.9 | -20.1 | -170.5 | -55 | -62.9 | 0 | 0 | 0 | 113.3 | F84 N92 I96 | F84-F88 HydrophobicContact CB-CD2 4.3Å; F84-F88 AromaticContact CD1-CD2 3.84Å; F84-F88 HydrophobicContact CD1-CD2 3.84Å; F84-F88 AromaticContact CD1-CE2 3.87Å; F84-F88 HydrophobicContact CD1-CE2 3.87Å; F84-F88 HydrophobicContact CE1-CE2 4.29Å; F84-F88 HydrophobicContact CG-CD2 4.38Å; F84-F88 HydrophobicContact CG-CE2 4.5Å; F84-F88 PolarHBondContact O-N 3.34Å; F88-N92 HydrophobicContact CB-CB 4.3Å; F88-N92 VanDerWaalsContact O-CB 3.27Å; F88-N92 WeakPolarHBondContact O-CB 3.36Å; F88-N92 PolarHBondContact O-ND2 3.34Å; F88-I96 HydrophobicContact CB-CD1 4.1Å; F88-I96 HydrophobicContact CD1-CD1 4.16Å; F88-I96 HydrophobicContact CD2-CD1 4.19Å; F88-I96 HydrophobicContact CG-CD1 3.89Å |
| 89 | G | 92.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 23% | 0.234 | C | C | . | . | trans | 94.9 | 167.2 | -167.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | V85 S93 E207 | V85-G89 WeakPolarHBondContact O-CA 3.3Å; V85-G89 PolarHBondContact O-N 3.21Å; G89-S93 WeakPolarHBondContact O-CB 3.48Å; G89-S93 PolarHBondContact O-N 3.08Å; G89-S93 VanDerWaalsContact O-N 3.13Å; G89-S93 PolarHBondContact O-OG 3.09Å; G89-E207 WeakPolarHBondContact CA-OE2 3.27Å | ||
| 90 | R | 92.3 | Very high | 92.8 | Very high | 3 Ų | 3 | 45.6 Ų | 45.6 | 1% | 0.011 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -76.1 | -51.3 | -171.1 | -74.5 | 62.2 | 164.9 | 144.1 | 0.1 | 110.2 | V85 S93 M94 M140 Y141 E144 E207 | V85-R90 PolarHBondContact O-NH1 3.03Å; R90-S93 PolarHBondContact O-N 3.25Å; R90-M94 PolarHBondContact O-N 3.15Å; R90-M140 HydrophobicContact CG-CG 4.27Å; R90-M140 HydrophobicContact CG-SD 4.14Å; R90-Y141 HydrophobicContact CB-CD2 3.82Å; R90-E144 WeakPolarHBondContact CD-OE2 3.3Å; R90-E144 IonicContact CZ-OE1 3.47Å; R90-E144 IonicContact CZ-OE2 3.72Å; R90-E144 IonicContact NE-OE1 3.2Å; R90-E144 PolarHBondContact NE-OE1 2.84Å; R90-E144 IonicContact NE-OE2 2.84Å; R90-E144 PolarHBondContact NE-OE2 2.97Å; R90-E144 IonicContact NH2-OE1 2.84Å; R90-E144 PolarHBondContact NH2-OE1 2.98Å; R90-E144 IonicContact NH2-OE2 3.79Å; R90-E207 PolarHBondContact N-OE1 2.99Å; R90-E207 PolarHBondContact N-OE2 3.19Å |
| 91 | R | 96.7 | Very high | 93.1 | Very high | 59 Ų | 59 | 44.2 Ų | 44.2 | 22% | 0.223 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.9 | -48 | 177.9 | -178.8 | -154.7 | 70.4 | 175.5 | -0.9 | 111.5 | S93 M94 L95 Y141 L202 C205 E207 | R91-S93 VanDerWaalsContact C-N 3.3Å; R91-S93 PolarHBondContact O-N 3.48Å; R91-M94 PolarHBondContact O-N 3.41Å; R91-L95 PolarHBondContact O-N 2.93Å; R91-L95 VanDerWaalsContact O-N 3.09Å; R91-Y141 HydrophobicContact CB-CE2 4.18Å; R91-L202 WeakPolarHBondContact CD-O 3.13Å; R91-L202 HydrophobicContact CG-CD2 4.04Å; R91-C205 WeakPolarHBondContact CD-O 3.47Å; R91-C205 PolarHBondContact NH1-O 3.36Å; R91-C205 VanDerWaalsContact NH1-O 3.14Å; R91-E207 WeakPolarHBondContact CB-OE2 3.48Å; R91-E207 PolarHBondContact N-OE1 3.44Å; R91-E207 PolarHBondContact N-OE2 3.37Å |
| 92 | N | 96.6 | Very high | 93.6 | Very high | 49 Ų | 49 | 46.3 Ų | 46.3 | 26% | 0.262 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -65.7 | -34.6 | -178.9 | -65 | -22.7 | 0 | 0 | 0 | 112.3 | F88 L95 I96 E207 | F88-N92 HydrophobicContact CB-CB 4.3Å; F88-N92 VanDerWaalsContact O-CB 3.27Å; F88-N92 WeakPolarHBondContact O-CB 3.36Å; F88-N92 PolarHBondContact O-ND2 3.34Å; N92-L95 PolarHBondContact O-N 3.45Å; N92-I96 WeakPolarHBondContact O-CD1 3.31Å; N92-I96 VanDerWaalsContact O-CG1 3.28Å; N92-I96 WeakPolarHBondContact O-CG1 3.28Å; N92-I96 PolarHBondContact O-N 2.55Å; N92-E207 PolarHBondContact N-OE2 3.03Å |
| 93 | S | 96.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.9 | -45.5 | 174.1 | -63.6 | 0 | 0 | 0 | 0 | 111.4 | F84 V85 G89 R90 R91 L95 I96 V97 | F84-S93 WeakPolarHBondContact CB-OG 3.15Å; F84-S93 PolarHBondContact O-OG 2.99Å; F84-S93 VanDerWaalsContact O-OG 3.13Å; V85-S93 PolarHBondContact N-OG 2.95Å; G89-S93 WeakPolarHBondContact O-CB 3.48Å; G89-S93 PolarHBondContact O-N 3.08Å; G89-S93 VanDerWaalsContact O-N 3.13Å; G89-S93 PolarHBondContact O-OG 3.09Å; R90-S93 PolarHBondContact O-N 3.25Å; R91-S93 VanDerWaalsContact C-N 3.3Å; R91-S93 PolarHBondContact O-N 3.48Å; S93-L95 VanDerWaalsContact C-N 3.27Å; S93-L95 PolarHBondContact O-N 3.04Å; S93-I96 PolarHBondContact O-N 3.3Å; S93-V97 WeakPolarHBondContact O-CG1 3.28Å; S93-V97 WeakPolarHBondContact O-CG2 3.11Å; S93-V97 PolarHBondContact O-N 3.29Å; S93-V97 VanDerWaalsContact O-N 3.14Å |
| 94 | M | 97.7 | Very high | 94.9 | Very high | 2 Ų | 2 | 42 Ų | 42 | 1% | 0.01 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -58.5 | -38.8 | 174.5 | -67.8 | -172.8 | -70.8 | 0 | 0 | 112.1 | A17 R90 R91 V97 F137 V138 Y141 L202 | A17-M94 HydrophobicContact CB-CE 4.32Å; A17-M94 HydrophobicContact CB-SD 4.22Å; R90-M94 PolarHBondContact O-N 3.15Å; R91-M94 PolarHBondContact O-N 3.41Å; M94-V97 WeakPolarHBondContact O-CG2 3.48Å; M94-F137 HydrophobicContact CG-CB 3.76Å; M94-F137 HydrophobicContact CG-CD2 3.96Å; M94-F137 HydrophobicContact CG-CG 4.29Å; M94-F137 HydrophobicContact SD-CB 4.39Å; M94-V138 HydrophobicContact SD-CG2 4.34Å; M94-Y141 HydrophobicContact CE-CD1 3.71Å; M94-Y141 HydrophobicContact CE-CD2 3.98Å; M94-Y141 HydrophobicContact CE-CE1 4.11Å; M94-Y141 HydrophobicContact CE-CE2 4.38Å; M94-Y141 HydrophobicContact CE-CG 3.61Å; M94-L202 HydrophobicContact CB-CD1 3.83Å; M94-L202 HydrophobicContact CB-CD2 4.38Å; M94-L202 HydrophobicContact CE-CD2 4.02Å |
| 95 | L | 98 | Very high | 95.3 | Very high | 56 Ų | 56 | 39.4 Ų | 39.4 | 29% | 0.293 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -67.6 | -46.3 | 178.3 | -179.4 | 60.7 | 0 | 0 | 0 | 112.2 | R91 N92 S93 V97 N98 L202 P203 | R91-L95 PolarHBondContact O-N 2.93Å; R91-L95 VanDerWaalsContact O-N 3.09Å; N92-L95 PolarHBondContact O-N 3.45Å; S93-L95 VanDerWaalsContact C-N 3.27Å; S93-L95 PolarHBondContact O-N 3.04Å; L95-V97 VanDerWaalsContact C-N 3.34Å; L95-V97 PolarHBondContact O-N 3.4Å; L95-N98 PolarHBondContact O-N 3.17Å; L95-L202 HydrophobicContact CB-CD1 3.93Å; L95-L202 HydrophobicContact CD1-CB 4.34Å; L95-L202 HydrophobicContact CD1-CD1 4.36Å; L95-P203 HydrophobicContact CD2-CG 4.5Å |
| 96 | I | 97.9 | Very high | 95.8 | Very high | 79 Ų | 79 | 41.7 Ų | 41.7 | 41% | 0.405 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -62.5 | -42.8 | -177.8 | -70 | 161.6 | 0 | 0 | 0 | 110.9 | F84 F88 N92 S93 N98 L99 | F84-I96 HydrophobicContact CE1-CG2 4.49Å; F88-I96 HydrophobicContact CB-CD1 4.1Å; F88-I96 HydrophobicContact CD1-CD1 4.16Å; F88-I96 HydrophobicContact CD2-CD1 4.19Å; F88-I96 HydrophobicContact CG-CD1 3.89Å; N92-I96 WeakPolarHBondContact O-CD1 3.31Å; N92-I96 VanDerWaalsContact O-CG1 3.28Å; N92-I96 WeakPolarHBondContact O-CG1 3.28Å; N92-I96 PolarHBondContact O-N 2.55Å; S93-I96 PolarHBondContact O-N 3.3Å; I96-N98 PolarHBondContact O-N 3.43Å; I96-L99 WeakPolarHBondContact O-CB 3.38Å; I96-L99 PolarHBondContact O-N 3.23Å |
| 97 | V | 97.8 | Very high | 96.6 | Very high | 3 Ų | 3 | 42.2 Ų | 42.2 | 2% | 0.018 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -72.4 | -13.3 | -174.8 | -60.3 | 0 | 0 | 0 | 0 | 113.6 | F84 S93 M94 L95 L99 L100 A101 F130 L133 F137 | F84-V97 HydrophobicContact CD1-CG1 4.44Å; F84-V97 HydrophobicContact CE1-CG1 4.35Å; S93-V97 WeakPolarHBondContact O-CG1 3.28Å; S93-V97 WeakPolarHBondContact O-CG2 3.11Å; S93-V97 PolarHBondContact O-N 3.29Å; S93-V97 VanDerWaalsContact O-N 3.14Å; M94-V97 WeakPolarHBondContact O-CG2 3.48Å; L95-V97 VanDerWaalsContact C-N 3.34Å; L95-V97 PolarHBondContact O-N 3.4Å; V97-L99 PolarHBondContact O-N 2.97Å; V97-L99 VanDerWaalsContact O-N 3.13Å; V97-L100 HydrophobicContact CB-CD1 4.46Å; V97-L100 VanDerWaalsContact O-CB 3.29Å; V97-L100 WeakPolarHBondContact O-CB 3.4Å; V97-L100 PolarHBondContact O-N 3.37Å; V97-A101 PolarHBondContact O-N 3.5Å; V97-F130 HydrophobicContact CB-CD2 4.15Å; V97-F130 HydrophobicContact CG2-CD2 3.92Å; V97-F130 HydrophobicContact CG2-CE2 3.97Å; V97-F130 VanDerWaalsContact O-CD2 3.28Å; V97-F130 WeakPolarHBondContact O-CD2 3.31Å; V97-L133 HydrophobicContact CB-CD1 4.42Å; V97-L133 HydrophobicContact CG1-CB 4.46Å; V97-L133 HydrophobicContact CG1-CD1 3.73Å; V97-F137 HydrophobicContact CB-CE2 4.42Å; V97-F137 HydrophobicContact CG1-CE2 3.71Å; V97-F137 HydrophobicContact CG1-CZ 4.3Å; V97-F137 HydrophobicContact CG2-CD2 4.19Å; V97-F137 HydrophobicContact CG2-CE2 3.85Å |
| 98 | N | 98.1 | Very high | 97.1 | Very high | 2 Ų | 2 | 33.6 Ų | 33.6 | 1% | 0.011 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59.7 | -21.9 | 170.8 | -81.1 | -35.7 | 0 | 0 | 0 | 112.9 | L95 I96 L100 A101 V102 A195 Q198 S199 | L95-N98 PolarHBondContact O-N 3.17Å; I96-N98 PolarHBondContact O-N 3.43Å; N98-L100 VanDerWaalsContact C-N 3.27Å; N98-L100 PolarHBondContact O-N 3.05Å; N98-A101 PolarHBondContact O-N 3Å; N98-V102 WeakPolarHBondContact O-CG2 3.34Å; N98-V102 PolarHBondContact O-N 2.88Å; N98-A195 HydrophobicContact CB-CB 4.45Å; N98-Q198 PolarHBondContact ND2-OE1 2.96Å; N98-Q198 PolarHBondContact OD1-OE1 2.92Å; N98-S199 WeakPolarHBondContact CB-OG 3.44Å; N98-S199 PolarHBondContact ND2-OG 3.3Å |
| 99 | L | 98 | Very high | 97.3 | Very high | 122 Ų | 122 | 31 Ų | 31 | 64% | 0.639 | 17% | 0.168 | S | C | * | . | H | α-helix | trans | -57.4 | -42.1 | 169.3 | -176.9 | 63.2 | 0 | 0 | 0 | 111.4 | I96 V97 V102 T103 | I96-L99 WeakPolarHBondContact O-CB 3.38Å; I96-L99 PolarHBondContact O-N 3.23Å; V97-L99 PolarHBondContact O-N 2.97Å; V97-L99 VanDerWaalsContact O-N 3.13Å; L99-V102 PolarHBondContact O-N 2.78Å; L99-T103 WeakPolarHBondContact O-CB 3.45Å; L99-T103 PolarHBondContact O-N 3.19Å; L99-T103 PolarHBondContact O-OG1 3.22Å |
| 100 | L | 98.3 | Very high | 97.5 | Very high | 52 Ų | 52 | 35.7 Ų | 35.7 | 27% | 0.272 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -64.8 | -41.3 | 176.3 | -60.4 | 175.5 | 0 | 0 | 0 | 111.2 | V97 N98 T103 G104 V126 L129 F130 L133 | V97-L100 HydrophobicContact CB-CD1 4.46Å; V97-L100 VanDerWaalsContact O-CB 3.29Å; V97-L100 WeakPolarHBondContact O-CB 3.4Å; V97-L100 PolarHBondContact O-N 3.37Å; N98-L100 VanDerWaalsContact C-N 3.27Å; N98-L100 PolarHBondContact O-N 3.05Å; L100-T103 PolarHBondContact O-N 3.25Å; L100-G104 PolarHBondContact O-N 3.21Å; L100-V126 HydrophobicContact CB-CG1 4.17Å; L100-V126 HydrophobicContact CD2-CG1 4.27Å; L100-V126 VanDerWaalsContact O-CG1 3.29Å; L100-V126 WeakPolarHBondContact O-CG1 3.4Å; L100-L129 HydrophobicContact CD1-CB 4.37Å; L100-F130 HydrophobicContact CB-CB 3.94Å; L100-L133 HydrophobicContact CD1-CD1 3.9Å |
| 101 | A | 98.1 | Very high | 97.7 | Very high | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.5 | -44.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V97 N98 G105 I127 F130 A195 | V97-A101 PolarHBondContact O-N 3.5Å; N98-A101 PolarHBondContact O-N 3Å; A101-G105 PolarHBondContact O-N 3.04Å; A101-I127 HydrophobicContact CB-CD1 4Å; A101-F130 HydrophobicContact CB-CD1 3.96Å; A101-F130 HydrophobicContact CB-CD2 3.83Å; A101-F130 HydrophobicContact CB-CE1 3.99Å; A101-F130 HydrophobicContact CB-CE2 3.83Å; A101-F130 HydrophobicContact CB-CG 3.87Å; A101-F130 HydrophobicContact CB-CZ 3.91Å; A101-A195 HydrophobicContact CB-CB 3.7Å |
| 102 | V | 98.5 | Very high | 97.7 | Very high | 47 Ų | 47 | 35.9 Ų | 35.9 | 29% | 0.285 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -64.4 | -47.4 | 176.1 | 175.2 | 0 | 0 | 0 | 0 | 110.8 | N98 L99 G105 C106 I192 A195 | N98-V102 WeakPolarHBondContact O-CG2 3.34Å; N98-V102 PolarHBondContact O-N 2.88Å; L99-V102 PolarHBondContact O-N 2.78Å; V102-G105 PolarHBondContact O-N 3.26Å; V102-C106 WeakPolarHBondContact O-CB 3.39Å; V102-C106 PolarHBondContact O-N 3.18Å; V102-C106 PolarHBondContact O-SG 3.34Å; V102-I192 HydrophobicContact CG2-CG2 4.46Å; V102-A195 HydrophobicContact CG2-CB 4.18Å |
| 103 | T | 98.4 | Very high | 97.6 | Very high | 51 Ų | 51 | 39.5 Ų | 39.5 | 31% | 0.313 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61.4 | -47.8 | 178.3 | -60.3 | 0 | 0 | 0 | 0 | 112.1 | L99 L100 C106 F107 V126 | L99-T103 WeakPolarHBondContact O-CB 3.45Å; L99-T103 PolarHBondContact O-N 3.19Å; L99-T103 PolarHBondContact O-OG1 3.22Å; L100-T103 PolarHBondContact O-N 3.25Å; T103-C106 PolarHBondContact O-N 2.92Å; T103-F107 HydrophobicContact CG2-CD2 4.04Å; T103-F107 HydrophobicContact CG2-CE2 3.55Å; T103-F107 HydrophobicContact CG2-CZ 3.93Å; T103-F107 WeakPolarHBondContact O-CG 3.26Å; T103-F107 PolarHBondContact O-N 2.86Å; T103-V126 HydrophobicContact CG2-CG1 4.43Å |
| 104 | G | 98.2 | Very high | 97.5 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.4 | -44.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.2 | L100 F107 M108 | L100-G104 PolarHBondContact O-N 3.21Å; G104-F107 PolarHBondContact O-N 3.25Å; G104-M108 WeakPolarHBondContact O-CG 3.16Å; G104-M108 PolarHBondContact O-N 3.02Å |
| 105 | G | 98.1 | Very high | 97.4 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.7 | -41.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | A101 V102 M108 G109 | A101-G105 PolarHBondContact O-N 3.04Å; V102-G105 PolarHBondContact O-N 3.26Å; G105-M108 PolarHBondContact O-N 2.95Å; G105-G109 PolarHBondContact O-N 3.28Å |
| 106 | C | 98.4 | Very high | 97.2 | Very high | 48 Ų | 48 | 45.1 Ų | 45.1 | 32% | 0.324 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -64.9 | -43.3 | 176 | -75.3 | 0 | 0 | 0 | 0 | 111.9 | V102 T103 M108 G109 L110 | V102-C106 WeakPolarHBondContact O-CB 3.39Å; V102-C106 PolarHBondContact O-N 3.18Å; V102-C106 PolarHBondContact O-SG 3.34Å; T103-C106 PolarHBondContact O-N 2.92Å; C106-M108 VanDerWaalsContact C-N 3.35Å; C106-M108 PolarHBondContact O-N 3.35Å; C106-G109 PolarHBondContact O-N 3.39Å; C106-L110 VanDerWaalsContact O-CB 3.3Å; C106-L110 WeakPolarHBondContact O-CB 3.42Å; C106-L110 WeakPolarHBondContact O-CG 3.41Å; C106-L110 PolarHBondContact O-N 2.92Å |
| 107 | F | 98.4 | Very high | 97.1 | Very high | 61 Ų | 61 | 41.7 Ų | 41.7 | 27% | 0.268 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -59.5 | -45 | 175.5 | -72.8 | -32 | 0 | 0 | 0 | 111.9 | T103 G104 C111 M119 L122 V126 | T103-F107 HydrophobicContact CG2-CD2 4.04Å; T103-F107 HydrophobicContact CG2-CE2 3.55Å; T103-F107 HydrophobicContact CG2-CZ 3.93Å; T103-F107 WeakPolarHBondContact O-CG 3.26Å; T103-F107 PolarHBondContact O-N 2.86Å; G104-F107 PolarHBondContact O-N 3.25Å; F107-C111 WeakPolarHBondContact O-CB 3.18Å; F107-C111 PolarHBondContact O-N 2.92Å; F107-C111 VanDerWaalsContact O-N 3.12Å; F107-M119 HydrophobicContact CD1-CE 4.07Å; F107-L122 HydrophobicContact CD2-CD2 4.17Å; F107-L122 HydrophobicContact CD2-CG 4.1Å; F107-L122 HydrophobicContact CE2-CD2 3.71Å; F107-L122 HydrophobicContact CE2-CG 3.97Å; F107-L122 HydrophobicContact CZ-CD2 4.02Å; F107-V126 HydrophobicContact CD2-CG2 4.48Å; F107-V126 HydrophobicContact CE2-CG2 4.39Å |
| 108 | M | 98 | Very high | 97 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -70 | -40 | 177.7 | -63.6 | -174.8 | -66.7 | 0 | 0 | 112.6 | G104 G105 C106 L110 C111 L120 R124 I127 L188 T191 | G104-M108 WeakPolarHBondContact O-CG 3.16Å; G104-M108 PolarHBondContact O-N 3.02Å; G105-M108 PolarHBondContact O-N 2.95Å; C106-M108 VanDerWaalsContact C-N 3.35Å; C106-M108 PolarHBondContact O-N 3.35Å; M108-L110 VanDerWaalsContact C-N 3.34Å; M108-L110 PolarHBondContact O-N 3.07Å; M108-C111 PolarHBondContact O-SG 3.22Å; M108-L120 HydrophobicContact CG-CD1 4.49Å; M108-R124 HydrophobicContact SD-CG 4.07Å; M108-I127 HydrophobicContact CE-CB 4.16Å; M108-I127 HydrophobicContact CE-CG1 4.34Å; M108-I127 HydrophobicContact CE-CG2 3.92Å; M108-I127 HydrophobicContact SD-CG2 4.25Å; M108-L188 HydrophobicContact CB-CB 3.69Å; M108-L188 HydrophobicContact CB-CD1 4.14Å; M108-L188 HydrophobicContact CG-CB 4.48Å; M108-L188 HydrophobicContact SD-CB 4.19Å; M108-L188 HydrophobicContact SD-CD1 4.44Å; M108-T191 HydrophobicContact CE-CG2 4.05Å |
| 109 | G | 96.9 | Very high | 97 | Very high | 18 Ų | 18 | 48.6 Ų | 48.6 | 19% | 0.186 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -68.8 | -30.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | G105 C106 P185 | G105-G109 PolarHBondContact O-N 3.28Å; C106-G109 PolarHBondContact O-N 3.39Å; G109-P185 WeakPolarHBondContact CA-O 3.16Å; G109-P185 VanDerWaalsContact O-CB 3.3Å; G109-P185 WeakPolarHBondContact O-CB 3.29Å |
| 110 | L | 97.3 | Very high | 96.9 | Very high | 98 Ų | 98 | 42.8 Ų | 42.8 | 51% | 0.513 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -97.5 | -8.7 | -178.1 | -61.9 | 173.2 | 0 | 0 | 0 | 113.7 | C106 M108 K112 V113 A114 M119 | C106-L110 VanDerWaalsContact O-CB 3.3Å; C106-L110 WeakPolarHBondContact O-CB 3.42Å; C106-L110 WeakPolarHBondContact O-CG 3.41Å; C106-L110 PolarHBondContact O-N 2.92Å; M108-L110 VanDerWaalsContact C-N 3.34Å; M108-L110 PolarHBondContact O-N 3.07Å; L110-K112 VanDerWaalsContact C-N 3.26Å; L110-K112 PolarHBondContact O-N 3.5Å; L110-V113 PolarHBondContact O-N 3.41Å; L110-V113 VanDerWaalsContact O-N 3.16Å; L110-A114 WeakPolarHBondContact O-CB 3.25Å; L110-A114 PolarHBondContact O-N 2.67Å; L110-M119 HydrophobicContact CB-CE 4.04Å |
| 111 | C | 96.4 | Very high | 96.8 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 23% | 0.232 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -34.7 | -173.7 | 70.8 | 0 | 0 | 0 | 0 | 113.6 | F107 M108 K115 S116 M119 L120 W184 | F107-C111 WeakPolarHBondContact O-CB 3.18Å; F107-C111 PolarHBondContact O-N 2.92Å; F107-C111 VanDerWaalsContact O-N 3.12Å; M108-C111 PolarHBondContact O-SG 3.22Å; C111-K115 PolarHBondContact O-N 3.41Å; C111-S116 WeakPolarHBondContact CB-O 3.31Å; C111-S116 PolarHBondContact O-N 3.43Å; C111-M119 HydrophobicContact CB-CB 3.85Å; C111-L120 HydrophobicContact CB-CB 4.19Å; C111-W184 WeakPolarHBondContact SG-CH2 3.46Å |
| 112 | K | 95.8 | Very high | 96.8 | Very high | 66 Ų | 66 | 45.4 Ų | 45.4 | 29% | 0.287 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -45.8 | 177.8 | -171.5 | -176 | 179.6 | -172.5 | 0 | 112 | F41 L110 A114 K115 E181 W184 P185 | F41-K112 HydrophobicContact CD2-CG 4.19Å; F41-K112 HydrophobicContact CE2-CB 4.27Å; F41-K112 HydrophobicContact CE2-CG 4.23Å; L110-K112 VanDerWaalsContact C-N 3.26Å; L110-K112 PolarHBondContact O-N 3.5Å; K112-A114 VanDerWaalsContact C-N 3.31Å; K112-A114 PolarHBondContact O-N 2.9Å; K112-K115 PolarHBondContact O-N 3.45Å; K112-K115 VanDerWaalsContact O-N 3.13Å; K112-E181 PolarHBondContact NZ-O 3.36Å; K112-W184 HydrophobicContact CB-CZ2 3.98Å; K112-W184 HydrophobicContact CD-CZ2 4.31Å; K112-W184 HydrophobicContact CG-CZ2 4.24Å; K112-P185 HydrophobicContact CB-CB 4.36Å; K112-P185 HydrophobicContact CB-CG 3.57Å; K112-P185 HydrophobicContact CD-CG 3.6Å; K112-P185 HydrophobicContact CG-CG 4.21Å |
| 113 | V | 95.3 | Very high | 96.8 | Very high | 125 Ų | 125 | 43.2 Ų | 43.2 | 76% | 0.758 | 24% | 0.237 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.4 | -40.2 | 178.1 | 178.3 | 0 | 0 | 0 | 0 | 110.5 | L110 K115 | L110-V113 PolarHBondContact O-N 3.41Å; L110-V113 VanDerWaalsContact O-N 3.16Å; V113-K115 PolarHBondContact O-N 3.16Å |
| 114 | A | 94.7 | Very high | 96.8 | Very high | 54 Ų | 54 | 40.9 Ų | 40.9 | 45% | 0.446 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -3.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114 | L110 K112 S116 M119 | L110-A114 WeakPolarHBondContact O-CB 3.25Å; L110-A114 PolarHBondContact O-N 2.67Å; K112-A114 VanDerWaalsContact C-N 3.31Å; K112-A114 PolarHBondContact O-N 2.9Å; A114-S116 PolarHBondContact O-N 3.21Å; A114-M119 HydrophobicContact CB-CE 4.3Å; A114-M119 HydrophobicContact CB-SD 3.4Å; A114-M119 WeakPolarHBondContact CB-SD 3.35Å |
| 115 | K | 94.1 | Very high | 96.8 | Very high | 104 Ų | 104 | 43 Ų | 43 | 45% | 0.452 | 23% | 0.234 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 48.2 | 42.3 | -176 | -59.1 | -176.3 | 170 | -160.8 | 0 | 113.1 | E48 K49 C111 K112 V113 | E48-K115 IonicContact OE1-NZ 3.52Å; E48-K115 WeakPolarHBondContact OE2-CD 3.41Å; E48-K115 WeakPolarHBondContact OE2-CE 3.32Å; E48-K115 IonicContact OE2-NZ 2.7Å; E48-K115 PolarHBondContact OE2-NZ 2.81Å; K49-K115 WeakPolarHBondContact CE-O 3.3Å; C111-K115 PolarHBondContact O-N 3.41Å; K112-K115 PolarHBondContact O-N 3.45Å; K112-K115 VanDerWaalsContact O-N 3.13Å; V113-K115 PolarHBondContact O-N 3.16Å |
| 116 | S | 95.4 | Very high | 96.8 | Very high | 17 Ų | 17 | 43.8 Ų | 43.8 | 12% | 0.119 | 24% | 0.239 | C | C | . | . | trans | -124.6 | 114.6 | -173 | 176.6 | 0 | 0 | 0 | 0 | 112 | C111 A114 E118 M119 | C111-S116 WeakPolarHBondContact CB-O 3.31Å; C111-S116 PolarHBondContact O-N 3.43Å; A114-S116 PolarHBondContact O-N 3.21Å; S116-E118 VanDerWaalsContact C-N 3.27Å; S116-E118 WeakPolarHBondContact CA-OE2 3.49Å; S116-E118 WeakPolarHBondContact CB-OE2 3.4Å; S116-E118 PolarHBondContact OG-N 2.73Å; S116-E118 PolarHBondContact OG-OE2 3.35Å; S116-M119 PolarHBondContact OG-N 3.23Å; S116-M119 VanDerWaalsContact OG-N 3.09Å | ||
| 117 | V | 94.9 | Very high | 96.8 | Very high | 7 Ų | 7 | 41.5 Ų | 41.5 | 4% | 0.042 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -70.4 | -31 | 171.2 | -178.9 | 0 | 0 | 0 | 0 | 110.2 | F41 I42 M119 L120 I121 | F41-V117 HydrophobicContact CE1-CG2 4.4Å; I42-V117 HydrophobicContact CB-CG2 4.33Å; I42-V117 HydrophobicContact CG1-CG1 4.12Å; I42-V117 HydrophobicContact CG1-CG2 4.1Å; I42-V117 HydrophobicContact CG2-CG1 4.44Å; I42-V117 HydrophobicContact CG2-CG2 4.17Å; V117-M119 VanDerWaalsContact C-N 3.34Å; V117-M119 PolarHBondContact O-N 3.04Å; V117-L120 WeakPolarHBondContact O-CB 3.06Å; V117-L120 PolarHBondContact O-N 3.46Å; V117-I121 HydrophobicContact CG1-CD1 4.07Å; V117-I121 WeakPolarHBondContact O-CG1 3.15Å; V117-I121 PolarHBondContact O-N 3.28Å |
| 118 | E | 95.6 | Very high | 96.7 | Very high | 105 Ų | 105 | 38.6 Ų | 38.6 | 49% | 0.491 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -62.6 | -40.8 | 177.9 | -51.1 | 84.9 | 169.1 | 0 | 0 | 111.2 | K49 S116 I121 L122 | K49-E118 IonicContact NZ-OE1 3.23Å; K49-E118 PolarHBondContact NZ-OE1 3.29Å; K49-E118 IonicContact NZ-OE2 3.29Å; K49-E118 PolarHBondContact NZ-OE2 2.69Å; S116-E118 VanDerWaalsContact C-N 3.27Å; S116-E118 WeakPolarHBondContact CA-OE2 3.49Å; S116-E118 WeakPolarHBondContact CB-OE2 3.4Å; S116-E118 PolarHBondContact OG-N 2.73Å; S116-E118 PolarHBondContact OG-OE2 3.35Å; E118-I121 PolarHBondContact O-N 2.87Å; E118-L122 VanDerWaalsContact O-CB 3.31Å; E118-L122 WeakPolarHBondContact O-CB 3.42Å; E118-L122 PolarHBondContact O-N 2.89Å |
| 119 | M | 97.4 | Very high | 96.7 | Very high | 45 Ų | 45 | 40.5 Ų | 40.5 | 22% | 0.222 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.6 | -38.3 | 173.6 | -75 | -177.8 | 69.2 | 0 | 0 | 112.7 | F107 L110 C111 A114 S116 V117 G123 | F107-M119 HydrophobicContact CD1-CE 4.07Å; L110-M119 HydrophobicContact CB-CE 4.04Å; C111-M119 HydrophobicContact CB-CB 3.85Å; A114-M119 HydrophobicContact CB-CE 4.3Å; A114-M119 HydrophobicContact CB-SD 3.4Å; A114-M119 WeakPolarHBondContact CB-SD 3.35Å; S116-M119 PolarHBondContact OG-N 3.23Å; S116-M119 VanDerWaalsContact OG-N 3.09Å; V117-M119 VanDerWaalsContact C-N 3.34Å; V117-M119 PolarHBondContact O-N 3.04Å; M119-G123 PolarHBondContact O-N 3.14Å |
| 120 | L | 97.3 | Very high | 96.8 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -61.8 | -49.8 | 175.1 | 173.8 | 63.8 | 0 | 0 | 0 | 110.7 | I38 M108 C111 V117 G123 R124 W184 L188 | I38-L120 HydrophobicContact CG2-CD2 3.71Å; M108-L120 HydrophobicContact CG-CD1 4.49Å; C111-L120 HydrophobicContact CB-CB 4.19Å; V117-L120 WeakPolarHBondContact O-CB 3.06Å; V117-L120 PolarHBondContact O-N 3.46Å; L120-G123 PolarHBondContact O-N 3.41Å; L120-R124 HydrophobicContact CD1-CG 4.44Å; L120-R124 VanDerWaalsContact O-CG 3.32Å; L120-R124 WeakPolarHBondContact O-CG 3.13Å; L120-R124 PolarHBondContact O-N 3.4Å; L120-W184 HydrophobicContact CD1-CZ3 4.4Å; L120-L188 HydrophobicContact CD1-CD1 3.62Å |
| 121 | I | 96.4 | Very high | 96.8 | Very high | 32 Ų | 32 | 35 Ų | 35 | 16% | 0.164 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.2 | -45 | -179.9 | -66.9 | 169.5 | 0 | 0 | 0 | 110.7 | L65 I69 V117 E118 R124 L125 | L65-I121 HydrophobicContact CD2-CD1 3.96Å; L65-I121 HydrophobicContact CG-CD1 4.37Å; L65-I121 HydrophobicContact CG-CG2 4.46Å; I69-I121 HydrophobicContact CG1-CG2 4.33Å; I69-I121 HydrophobicContact CG2-CG2 4.14Å; V117-I121 HydrophobicContact CG1-CD1 4.07Å; V117-I121 WeakPolarHBondContact O-CG1 3.15Å; V117-I121 PolarHBondContact O-N 3.28Å; E118-I121 PolarHBondContact O-N 2.87Å; I121-R124 PolarHBondContact O-N 3.45Å; I121-L125 PolarHBondContact O-N 3.1Å |
| 122 | L | 97.9 | Very high | 96.7 | Very high | 76 Ų | 76 | 35 Ų | 35 | 40% | 0.398 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -65.4 | -40.5 | 178.1 | -173 | 63.4 | 0 | 0 | 0 | 111.7 | F107 E118 R124 L125 V126 | F107-L122 HydrophobicContact CD2-CD2 4.17Å; F107-L122 HydrophobicContact CD2-CG 4.1Å; F107-L122 HydrophobicContact CE2-CD2 3.71Å; F107-L122 HydrophobicContact CE2-CG 3.97Å; F107-L122 HydrophobicContact CZ-CD2 4.02Å; E118-L122 VanDerWaalsContact O-CB 3.31Å; E118-L122 WeakPolarHBondContact O-CB 3.42Å; E118-L122 PolarHBondContact O-N 2.89Å; L122-R124 VanDerWaalsContact C-N 3.33Å; L122-R124 PolarHBondContact O-N 3.11Å; L122-L125 HydrophobicContact CD1-CD2 4.31Å; L122-L125 WeakPolarHBondContact O-CB 3.34Å; L122-L125 PolarHBondContact O-N 3.11Å; L122-V126 HydrophobicContact CD1-CG2 4.47Å; L122-V126 HydrophobicContact CG-CG2 4.48Å; L122-V126 VanDerWaalsContact O-CG2 3.3Å; L122-V126 WeakPolarHBondContact O-CG2 3.38Å; L122-V126 PolarHBondContact O-N 2.88Å |
| 123 | G | 98.2 | Very high | 96.7 | Very high | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.8 | -44.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | M119 L120 V126 I127 | M119-G123 PolarHBondContact O-N 3.14Å; L120-G123 PolarHBondContact O-N 3.41Å; G123-V126 PolarHBondContact O-N 2.95Å; G123-I127 WeakPolarHBondContact O-CB 3.39Å; G123-I127 VanDerWaalsContact O-CG2 3.27Å; G123-I127 WeakPolarHBondContact O-CG2 3.26Å; G123-I127 PolarHBondContact O-N 3.31Å |
| 124 | R | 97.4 | Very high | 96.7 | Very high | 3 Ų | 3 | 26.3 Ų | 26.3 | 1% | 0.011 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.8 | -38 | 174.8 | -70.6 | -70.4 | -66.1 | 168.5 | -0.8 | 112.8 | N27 S66 I69 F70 M108 L120 I121 L122 I127 G128 | N27-R124 PolarHBondContact O-NH1 2.53Å; S66-R124 WeakPolarHBondContact O-CG 3.48Å; S66-R124 PolarHBondContact O-NE 3.33Å; I69-R124 HydrophobicContact CG2-CB 3.64Å; F70-R124 WeakPolarHBondContact CA-O 3.37Å; M108-R124 HydrophobicContact SD-CG 4.07Å; L120-R124 HydrophobicContact CD1-CG 4.44Å; L120-R124 VanDerWaalsContact O-CG 3.32Å; L120-R124 WeakPolarHBondContact O-CG 3.13Å; L120-R124 PolarHBondContact O-N 3.4Å; I121-R124 PolarHBondContact O-N 3.45Å; L122-R124 VanDerWaalsContact C-N 3.33Å; L122-R124 PolarHBondContact O-N 3.11Å; R124-I127 WeakPolarHBondContact O-CG2 3.16Å; R124-G128 PolarHBondContact O-N 3.4Å |
| 125 | L | 98.1 | Very high | 96.4 | Very high | 44 Ų | 44 | 24 Ų | 24 | 23% | 0.23 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -63.8 | -49.7 | 173.8 | 176.8 | 62.8 | 0 | 0 | 0 | 111.4 | I69 I121 L122 G128 L129 | I69-L125 HydrophobicContact CD1-CD1 4.33Å; I69-L125 HydrophobicContact CG1-CB 3.91Å; I69-L125 HydrophobicContact CG1-CD1 4.03Å; I69-L125 HydrophobicContact CG1-CG 4.43Å; I121-L125 PolarHBondContact O-N 3.1Å; L122-L125 HydrophobicContact CD1-CD2 4.31Å; L122-L125 WeakPolarHBondContact O-CB 3.34Å; L122-L125 PolarHBondContact O-N 3.11Å; L125-G128 WeakPolarHBondContact O-CA 3.47Å; L125-G128 PolarHBondContact O-N 2.93Å; L125-L129 PolarHBondContact O-N 2.87Å |
| 126 | V | 98.5 | Very high | 96.1 | Very high | 17 Ų | 17 | 19.3 Ų | 19.3 | 10% | 0.103 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -66.2 | -43.3 | -175.9 | 174.6 | 0 | 0 | 0 | 0 | 111.5 | L100 T103 F107 L122 G123 G128 L129 F130 | L100-V126 HydrophobicContact CB-CG1 4.17Å; L100-V126 HydrophobicContact CD2-CG1 4.27Å; L100-V126 VanDerWaalsContact O-CG1 3.29Å; L100-V126 WeakPolarHBondContact O-CG1 3.4Å; T103-V126 HydrophobicContact CG2-CG1 4.43Å; F107-V126 HydrophobicContact CD2-CG2 4.48Å; F107-V126 HydrophobicContact CE2-CG2 4.39Å; L122-V126 HydrophobicContact CD1-CG2 4.47Å; L122-V126 HydrophobicContact CG-CG2 4.48Å; L122-V126 VanDerWaalsContact O-CG2 3.3Å; L122-V126 WeakPolarHBondContact O-CG2 3.38Å; L122-V126 PolarHBondContact O-N 2.88Å; G123-V126 PolarHBondContact O-N 2.95Å; V126-G128 VanDerWaalsContact C-N 3.26Å; V126-G128 PolarHBondContact O-N 3.07Å; V126-L129 WeakPolarHBondContact O-CB 3.45Å; V126-L129 PolarHBondContact O-N 3.33Å; V126-F130 PolarHBondContact O-N 2.83Å; V126-F130 VanDerWaalsContact O-N 3.12Å |
| 127 | I | 98.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -69.1 | -28.2 | 175.2 | -162.4 | 61.7 | 0 | 0 | 0 | 111.8 | N27 F70 A101 M108 G123 R124 F130 C131 T191 | N27-I127 HydrophobicContact CB-CG1 4.32Å; N27-I127 VanDerWaalsContact CG-CG1 3.48Å; N27-I127 WeakPolarHBondContact OD1-CG1 3.48Å; F70-I127 HydrophobicContact CD2-CG2 3.98Å; F70-I127 HydrophobicContact CE2-CG2 4.24Å; A101-I127 HydrophobicContact CB-CD1 4Å; M108-I127 HydrophobicContact CE-CB 4.16Å; M108-I127 HydrophobicContact CE-CG1 4.34Å; M108-I127 HydrophobicContact CE-CG2 3.92Å; M108-I127 HydrophobicContact SD-CG2 4.25Å; G123-I127 WeakPolarHBondContact O-CB 3.39Å; G123-I127 VanDerWaalsContact O-CG2 3.27Å; G123-I127 WeakPolarHBondContact O-CG2 3.26Å; G123-I127 PolarHBondContact O-N 3.31Å; R124-I127 WeakPolarHBondContact O-CG2 3.16Å; I127-F130 HydrophobicContact CD1-CB 4.34Å; I127-F130 HydrophobicContact CD1-CD1 3.7Å; I127-F130 HydrophobicContact CD1-CE1 4.43Å; I127-F130 HydrophobicContact CD1-CG 4.29Å; I127-F130 PolarHBondContact O-N 2.85Å; I127-C131 WeakPolarHBondContact O-CB 3.29Å; I127-C131 PolarHBondContact O-N 2.98Å; I127-C131 PolarHBondContact O-SG 3.38Å; I127-T191 HydrophobicContact CD1-CG2 4.03Å; I127-T191 WeakPolarHBondContact CD1-OG1 3.33Å; I127-T191 HydrophobicContact CG1-CG2 4.45Å |
| 128 | G | 97.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 18.2 Ų | 18.2 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.4 | -47.9 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F70 G73 G74 R124 L125 V126 F130 C131 G132 | F70-G128 VanDerWaalsContact CD2-CA 3.41Å; F70-G128 VanDerWaalsContact O-CA 3.31Å; F70-G128 WeakPolarHBondContact O-CA 3.41Å; G73-G128 CarbonylContact C-O 3.58Å; G74-G128 VanDerWaalsContact CA-O 3.27Å; G74-G128 WeakPolarHBondContact CA-O 3.37Å; G74-G128 PolarHBondContact N-O 2.61Å; R124-G128 PolarHBondContact O-N 3.4Å; L125-G128 WeakPolarHBondContact O-CA 3.47Å; L125-G128 PolarHBondContact O-N 2.93Å; V126-G128 VanDerWaalsContact C-N 3.26Å; V126-G128 PolarHBondContact O-N 3.07Å; G128-F130 VanDerWaalsContact C-N 3.31Å; G128-F130 PolarHBondContact O-N 2.99Å; G128-C131 PolarHBondContact O-N 3.31Å; G128-G132 PolarHBondContact O-N 2.94Å |
| 129 | L | 98.2 | Very high | 95.5 | Very high | 39 Ų | 39 | 13.4 Ų | 13.4 | 20% | 0.204 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -55.3 | -47.1 | 174.9 | -69.8 | 167.5 | 0 | 0 | 0 | 111.5 | G73 I76 L100 L125 V126 G132 L133 | G73-L129 WeakPolarHBondContact O-CA 3.26Å; G73-L129 WeakPolarHBondContact O-CD2 3.39Å; I76-L129 HydrophobicContact CB-CD2 3.55Å; I76-L129 HydrophobicContact CD1-CD2 4.49Å; I76-L129 HydrophobicContact CG2-CD2 3.46Å; I76-L129 VanDerWaalsContact CG2-CD2 3.46Å; L100-L129 HydrophobicContact CD1-CB 4.37Å; L125-L129 PolarHBondContact O-N 2.87Å; V126-L129 WeakPolarHBondContact O-CB 3.45Å; V126-L129 PolarHBondContact O-N 3.33Å; L129-G132 PolarHBondContact O-N 3.11Å; L129-L133 WeakPolarHBondContact O-CD1 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.33Å; L129-L133 PolarHBondContact O-N 3.14Å; L129-L133 VanDerWaalsContact O-N 3.11Å |
| 130 | F | 98.4 | Very high | 95 | Very high | 0 Ų | 0 | 11.4 Ų | 11.4 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -58.1 | -52.6 | 174.9 | 167.5 | -100.5 | 0 | 0 | 0 | 112.1 | Q23 V97 L100 A101 V126 I127 G128 G132 L133 C134 | Q23-F130 HydrophobicContact CB-CE1 3.61Å; Q23-F130 HydrophobicContact CB-CZ 4.25Å; Q23-F130 HydrophobicContact CG-CE1 4.04Å; Q23-F130 HydrophobicContact CG-CZ 4.28Å; V97-F130 HydrophobicContact CB-CD2 4.15Å; V97-F130 HydrophobicContact CG2-CD2 3.92Å; V97-F130 HydrophobicContact CG2-CE2 3.97Å; V97-F130 VanDerWaalsContact O-CD2 3.28Å; V97-F130 WeakPolarHBondContact O-CD2 3.31Å; L100-F130 HydrophobicContact CB-CB 3.94Å; A101-F130 HydrophobicContact CB-CD1 3.96Å; A101-F130 HydrophobicContact CB-CD2 3.83Å; A101-F130 HydrophobicContact CB-CE1 3.99Å; A101-F130 HydrophobicContact CB-CE2 3.83Å; A101-F130 HydrophobicContact CB-CG 3.87Å; A101-F130 HydrophobicContact CB-CZ 3.91Å; V126-F130 PolarHBondContact O-N 2.83Å; V126-F130 VanDerWaalsContact O-N 3.12Å; I127-F130 HydrophobicContact CD1-CB 4.34Å; I127-F130 HydrophobicContact CD1-CD1 3.7Å; I127-F130 HydrophobicContact CD1-CE1 4.43Å; I127-F130 HydrophobicContact CD1-CG 4.29Å; I127-F130 PolarHBondContact O-N 2.85Å; G128-F130 VanDerWaalsContact C-N 3.31Å; G128-F130 PolarHBondContact O-N 2.99Å; F130-G132 VanDerWaalsContact C-N 3.31Å; F130-G132 PolarHBondContact O-N 3.14Å; F130-L133 WeakPolarHBondContact O-CB 3.18Å; F130-L133 PolarHBondContact O-N 2.79Å; F130-L133 VanDerWaalsContact O-N 3.16Å; F130-C134 WeakPolarHBondContact CE2-SG 3.5Å; F130-C134 WeakPolarHBondContact CZ-SG 3.44Å; F130-C134 PolarHBondContact O-N 3.47Å; F130-C134 PolarHBondContact O-SG 3.35Å |
| 131 | C | 97.1 | Very high | 94.8 | Very high | 0 Ų | 0 | 11.4 Ų | 11.4 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -62.1 | -40.1 | -178.3 | -67.7 | 0 | 0 | 0 | 0 | 111.6 | F24 F70 I127 G128 L133 C134 T135 W410 | F24-C131 HydrophobicContact CB-CB 4.27Å; F24-C131 HydrophobicContact CD2-CB 3.97Å; F24-C131 HydrophobicContact CG-CB 4.5Å; F70-C131 HydrophobicContact CE2-CB 3.93Å; F70-C131 HydrophobicContact CZ-CB 3.92Å; I127-C131 WeakPolarHBondContact O-CB 3.29Å; I127-C131 PolarHBondContact O-N 2.98Å; I127-C131 PolarHBondContact O-SG 3.38Å; G128-C131 PolarHBondContact O-N 3.31Å; C131-L133 VanDerWaalsContact C-N 3.35Å; C131-L133 PolarHBondContact O-N 3.27Å; C131-C134 PolarHBondContact O-N 3.14Å; C131-T135 WeakPolarHBondContact O-CG2 3.41Å; C131-T135 PolarHBondContact O-N 3.03Å; C131-W410 HydrophobicContact CB-CH2 4.05Å; C131-W410 HydrophobicContact CB-CZ2 4.11Å |
| 132 | G | 95.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 9.9 Ų | 9.9 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -57.7 | -45.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G74 S78 G128 L129 F130 T135 | G74-G132 WeakPolarHBondContact O-CA 3.49Å; S78-G132 WeakPolarHBondContact CA-O 3.28Å; G128-G132 PolarHBondContact O-N 2.94Å; L129-G132 PolarHBondContact O-N 3.11Å; F130-G132 VanDerWaalsContact C-N 3.31Å; F130-G132 PolarHBondContact O-N 3.14Å; G132-T135 PolarHBondContact O-N 3.2Å; G132-T135 PolarHBondContact O-OG1 2.78Å |
| 133 | L | 95.1 | Very high | 94 | Very high | 7 Ų | 7 | 6.8 Ų | 6.8 | 4% | 0.037 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -63.4 | -45.2 | 175.2 | -70.3 | 158.7 | 0 | 0 | 0 | 111.2 | G77 V81 F84 V97 L100 L129 F130 C131 T135 G136 F137 | G77-L133 WeakPolarHBondContact O-CD2 3.3Å; G77-L133 WeakPolarHBondContact O-CG 3.49Å; V81-L133 HydrophobicContact CG2-CD2 4.3Å; F84-L133 HydrophobicContact CD2-CD2 3.99Å; F84-L133 HydrophobicContact CE2-CD2 4.22Å; V97-L133 HydrophobicContact CB-CD1 4.42Å; V97-L133 HydrophobicContact CG1-CB 4.46Å; V97-L133 HydrophobicContact CG1-CD1 3.73Å; L100-L133 HydrophobicContact CD1-CD1 3.9Å; L129-L133 WeakPolarHBondContact O-CD1 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.33Å; L129-L133 PolarHBondContact O-N 3.14Å; L129-L133 VanDerWaalsContact O-N 3.11Å; F130-L133 WeakPolarHBondContact O-CB 3.18Å; F130-L133 PolarHBondContact O-N 2.79Å; F130-L133 VanDerWaalsContact O-N 3.16Å; C131-L133 VanDerWaalsContact C-N 3.35Å; C131-L133 PolarHBondContact O-N 3.27Å; L133-T135 VanDerWaalsContact C-N 3.33Å; L133-T135 PolarHBondContact O-N 3.34Å; L133-G136 PolarHBondContact O-N 2.99Å; L133-G136 VanDerWaalsContact O-N 3.11Å; L133-F137 HydrophobicContact CB-CD2 4.29Å; L133-F137 HydrophobicContact CB-CE1 4.45Å; L133-F137 HydrophobicContact CB-CE2 3.78Å; L133-F137 HydrophobicContact CB-CZ 3.87Å; L133-F137 HydrophobicContact CD2-CE1 4.15Å; L133-F137 HydrophobicContact CD2-CE2 4.4Å; L133-F137 HydrophobicContact CD2-CZ 3.67Å; L133-F137 HydrophobicContact CG-CZ 4.31Å; L133-F137 WeakPolarHBondContact O-CD1 3.15Å; L133-F137 WeakPolarHBondContact O-CG 3.37Å; L133-F137 PolarHBondContact O-N 3.1Å |
| 134 | C | 94.8 | Very high | 93.5 | Very high | 3 Ų | 3 | 7 Ų | 7 | 2% | 0.02 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -60 | -38.6 | 177.9 | -72.5 | 0 | 0 | 0 | 0 | 113.2 | F130 C131 G136 F137 V138 | F130-C134 WeakPolarHBondContact CE2-SG 3.5Å; F130-C134 WeakPolarHBondContact CZ-SG 3.44Å; F130-C134 PolarHBondContact O-N 3.47Å; F130-C134 PolarHBondContact O-SG 3.35Å; C131-C134 PolarHBondContact O-N 3.14Å; C134-G136 PolarHBondContact O-N 3.38Å; C134-G136 VanDerWaalsContact O-N 3.16Å; C134-F137 PolarHBondContact O-N 3.05Å; C134-V138 WeakPolarHBondContact O-CG2 3.33Å; C134-V138 PolarHBondContact O-N 3.47Å |
| 135 | T | 89.7 | Confident | 93.3 | Very high | 6 Ų | 6 | 6.9 Ų | 6.9 | 4% | 0.037 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -62 | -21.5 | 177.5 | 57.3 | 0 | 0 | 0 | 0 | 113.5 | F24 C131 G132 L133 P139 W386 W410 | F24-T135 HydrophobicContact CD1-CG2 3.53Å; F24-T135 HydrophobicContact CD2-CG2 4.3Å; F24-T135 HydrophobicContact CE1-CG2 3.7Å; F24-T135 HydrophobicContact CE2-CG2 4.44Å; F24-T135 HydrophobicContact CG-CG2 3.88Å; F24-T135 HydrophobicContact CZ-CG2 4.17Å; C131-T135 WeakPolarHBondContact O-CG2 3.41Å; C131-T135 PolarHBondContact O-N 3.03Å; G132-T135 PolarHBondContact O-N 3.2Å; G132-T135 PolarHBondContact O-OG1 2.78Å; L133-T135 VanDerWaalsContact C-N 3.33Å; L133-T135 PolarHBondContact O-N 3.34Å; T135-P139 WeakPolarHBondContact O-CD 3.29Å; T135-P139 WeakPolarHBondContact O-CG 3.47Å; T135-W386 HydrophobicContact CG2-CH2 3.9Å; T135-W386 HydrophobicContact CG2-CZ2 4.46Å; T135-W386 HydrophobicContact CG2-CZ3 4.27Å; T135-W410 HydrophobicContact CG2-CZ2 4.04Å; T135-W410 PolarHBondContact OG1-NE1 2.89Å |
| 136 | G | 86.5 | Confident | 92.9 | Very high | 5 Ų | 5 | 4.9 Ų | 4.9 | 5% | 0.052 | 3% | 0.031 | C | C | . | . | H | α-helix | trans | -93.8 | -42.7 | 169.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L133 C134 M140 M402 | L133-G136 PolarHBondContact O-N 2.99Å; L133-G136 VanDerWaalsContact O-N 3.11Å; C134-G136 PolarHBondContact O-N 3.38Å; C134-G136 VanDerWaalsContact O-N 3.16Å; G136-M140 VanDerWaalsContact O-CB 3.29Å; G136-M140 WeakPolarHBondContact O-CB 3.28Å; G136-M140 PolarHBondContact O-N 2.89Å; G136-M402 WeakPolarHBondContact O-CE 3.29Å |
| 137 | F | 91.3 | Very high | 92.3 | Very high | 0 Ų | 0 | 4.3 Ų | 4.3 | 0% | 0 | 3% | 0.027 | C | C | . | . | H | α-helix | trans | -65.5 | -47.3 | -173.6 | -64.8 | -11.1 | 0 | 0 | 0 | 113.3 | V81 F84 V85 M94 V97 L133 C134 M140 Y141 | V81-F137 HydrophobicContact CB-CD1 4.48Å; V81-F137 HydrophobicContact CB-CE1 4.15Å; V81-F137 HydrophobicContact CG1-CD1 3.9Å; V81-F137 HydrophobicContact CG1-CE1 3.91Å; V81-F137 HydrophobicContact CG2-CD1 4.24Å; V81-F137 HydrophobicContact CG2-CE1 4.07Å; F84-F137 HydrophobicContact CB-CE1 4.01Å; F84-F137 HydrophobicContact CB-CZ 3.61Å; F84-F137 HydrophobicContact CG-CZ 4.06Å; V85-F137 HydrophobicContact CG1-CD1 3.4Å; V85-F137 VanDerWaalsContact CG1-CD1 3.4Å; V85-F137 HydrophobicContact CG1-CE1 3.48Å; V85-F137 VanDerWaalsContact CG1-CE1 3.48Å; V85-F137 HydrophobicContact CG1-CG 4.43Å; M94-F137 HydrophobicContact CG-CB 3.76Å; M94-F137 HydrophobicContact CG-CD2 3.96Å; M94-F137 HydrophobicContact CG-CG 4.29Å; M94-F137 HydrophobicContact SD-CB 4.39Å; V97-F137 HydrophobicContact CB-CE2 4.42Å; V97-F137 HydrophobicContact CG1-CE2 3.71Å; V97-F137 HydrophobicContact CG1-CZ 4.3Å; V97-F137 HydrophobicContact CG2-CD2 4.19Å; V97-F137 HydrophobicContact CG2-CE2 3.85Å; L133-F137 HydrophobicContact CB-CD2 4.29Å; L133-F137 HydrophobicContact CB-CE1 4.45Å; L133-F137 HydrophobicContact CB-CE2 3.78Å; L133-F137 HydrophobicContact CB-CZ 3.87Å; L133-F137 HydrophobicContact CD2-CE1 4.15Å; L133-F137 HydrophobicContact CD2-CE2 4.4Å; L133-F137 HydrophobicContact CD2-CZ 3.67Å; L133-F137 HydrophobicContact CG-CZ 4.31Å; L133-F137 WeakPolarHBondContact O-CD1 3.15Å; L133-F137 WeakPolarHBondContact O-CG 3.37Å; L133-F137 PolarHBondContact O-N 3.1Å; C134-F137 PolarHBondContact O-N 3.05Å; F137-M140 PolarHBondContact O-N 3.24Å; F137-Y141 WeakPolarHBondContact O-CB 3.38Å; F137-Y141 PolarHBondContact O-N 3.4Å |
| 138 | V | 93.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 6.4 Ų | 6.4 | 0% | 0 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -64.6 | -53.9 | -173.1 | -178.7 | 0 | 0 | 0 | 0 | 112 | A17 S21 M94 C134 M140 Y141 I142 | A17-V138 HydrophobicContact CB-CG1 4.25Å; A17-V138 VanDerWaalsContact O-CG2 3.27Å; A17-V138 WeakPolarHBondContact O-CG2 3.23Å; S21-V138 VanDerWaalsContact OG-CG1 3.28Å; S21-V138 WeakPolarHBondContact OG-CG1 3.01Å; M94-V138 HydrophobicContact SD-CG2 4.34Å; C134-V138 WeakPolarHBondContact O-CG2 3.33Å; C134-V138 PolarHBondContact O-N 3.47Å; V138-M140 VanDerWaalsContact C-N 3.29Å; V138-M140 PolarHBondContact O-N 3.38Å; V138-Y141 PolarHBondContact O-N 3.16Å; V138-I142 HydrophobicContact CG1-CD1 3.59Å; V138-I142 HydrophobicContact CG1-CG1 4.24Å; V138-I142 WeakPolarHBondContact O-CB 3.25Å; V138-I142 VanDerWaalsContact O-CG1 3.31Å; V138-I142 WeakPolarHBondContact O-CG1 3.26Å; V138-I142 PolarHBondContact O-N 3.38Å |
| 139 | P | 88.8 | Confident | 90.6 | Very high | 5 Ų | 5 | 10.1 Ų | 10.1 | 3% | 0.032 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -62.9 | -34.2 | 177.9 | 21.5 | -31.3 | 0 | 0 | 0 | 112.9 | T135 G143 M402 | T135-P139 WeakPolarHBondContact O-CD 3.29Å; T135-P139 WeakPolarHBondContact O-CG 3.47Å; P139-G143 PolarHBondContact O-N 2.91Å; P139-M402 HydrophobicContact CB-CE 4.21Å; P139-M402 HydrophobicContact CG-CE 3.79Å |
| 140 | M | 87.7 | Confident | 89.9 | Confident | 2 Ų | 2 | 11.4 Ų | 11.4 | 1% | 0.01 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -64.7 | -48.5 | 175.7 | -174.9 | -179.3 | -65.3 | 0 | 0 | 111.4 | V81 V85 R90 G136 F137 V138 G143 E144 P399 M402 | V81-M140 HydrophobicContact CG1-CE 4.38Å; V85-M140 HydrophobicContact CB-SD 4Å; V85-M140 HydrophobicContact CG1-SD 4.02Å; V85-M140 HydrophobicContact CG2-CE 4.22Å; V85-M140 HydrophobicContact CG2-SD 3.87Å; R90-M140 HydrophobicContact CG-CG 4.27Å; R90-M140 HydrophobicContact CG-SD 4.14Å; G136-M140 VanDerWaalsContact O-CB 3.29Å; G136-M140 WeakPolarHBondContact O-CB 3.28Å; G136-M140 PolarHBondContact O-N 2.89Å; F137-M140 PolarHBondContact O-N 3.24Å; V138-M140 VanDerWaalsContact C-N 3.29Å; V138-M140 PolarHBondContact O-N 3.38Å; M140-G143 PolarHBondContact O-N 3.23Å; M140-E144 WeakPolarHBondContact O-CB 3.28Å; M140-E144 VanDerWaalsContact O-CG 3.28Å; M140-E144 WeakPolarHBondContact O-CG 3.2Å; M140-E144 PolarHBondContact O-N 3.42Å; M140-P399 HydrophobicContact CE-CB 4.4Å; M140-P399 HydrophobicContact CE-CG 4.5Å; M140-M402 HydrophobicContact CB-CE 4.23Å; M140-M402 HydrophobicContact CB-SD 4.17Å; M140-M402 HydrophobicContact CE-SD 3.67Å |
| 141 | Y | 92.9 | Very high | 89.2 | Confident | 1 Ų | 1 | 12.3 Ų | 12.3 | 0% | 0.004 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -62.4 | -48.6 | 178.7 | -179 | -106.2 | 0 | 0 | 0 | 111.4 | A13 A17 R90 R91 M94 F137 V138 G143 E144 I145 P206 | A13-Y141 HydrophobicContact CB-CE1 4.46Å; A17-Y141 HydrophobicContact CB-CD1 3.61Å; A17-Y141 HydrophobicContact CB-CE1 4Å; R90-Y141 HydrophobicContact CB-CD2 3.82Å; R91-Y141 HydrophobicContact CB-CE2 4.18Å; M94-Y141 HydrophobicContact CE-CD1 3.71Å; M94-Y141 HydrophobicContact CE-CD2 3.98Å; M94-Y141 HydrophobicContact CE-CE1 4.11Å; M94-Y141 HydrophobicContact CE-CE2 4.38Å; M94-Y141 HydrophobicContact CE-CG 3.61Å; F137-Y141 WeakPolarHBondContact O-CB 3.38Å; F137-Y141 PolarHBondContact O-N 3.4Å; V138-Y141 PolarHBondContact O-N 3.16Å; Y141-G143 VanDerWaalsContact C-N 3.33Å; Y141-G143 PolarHBondContact O-N 2.98Å; Y141-E144 PolarHBondContact O-N 3.4Å; Y141-I145 HydrophobicContact CD1-CD1 4Å; Y141-I145 HydrophobicContact CD2-CG2 4.28Å; Y141-I145 HydrophobicContact CE1-CD1 3.56Å; Y141-I145 HydrophobicContact CE2-CG2 3.95Å; Y141-I145 WeakPolarHBondContact O-CG1 3.32Å; Y141-I145 PolarHBondContact O-N 3.5Å; Y141-I145 VanDerWaalsContact O-N 3.11Å; Y141-P206 WeakPolarHBondContact CE2-O 3.47Å; Y141-P206 PolarHBondContact OH-O 2.79Å |
| 142 | I | 91.6 | Very high | 88.3 | Confident | 0 Ų | 0 | 12.3 Ų | 12.3 | 0% | 0 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -58.6 | -46 | 177.6 | -67.3 | 173.7 | 0 | 0 | 0 | 110.6 | I14 A17 T18 V138 E144 I145 S146 F154 | I14-I142 HydrophobicContact CG2-CD1 4.12Å; I14-I142 HydrophobicContact CG2-CG1 4.22Å; A17-I142 HydrophobicContact CB-CG1 4.43Å; T18-I142 HydrophobicContact CG2-CD1 3.87Å; V138-I142 HydrophobicContact CG1-CD1 3.59Å; V138-I142 HydrophobicContact CG1-CG1 4.24Å; V138-I142 WeakPolarHBondContact O-CB 3.25Å; V138-I142 VanDerWaalsContact O-CG1 3.31Å; V138-I142 WeakPolarHBondContact O-CG1 3.26Å; V138-I142 PolarHBondContact O-N 3.38Å; I142-E144 VanDerWaalsContact C-N 3.28Å; I142-E144 PolarHBondContact O-N 3.28Å; I142-I145 PolarHBondContact O-N 3.49Å; I142-S146 WeakPolarHBondContact O-CB 3.33Å; I142-S146 PolarHBondContact O-N 3.42Å; I142-S146 PolarHBondContact O-OG 2.71Å; I142-F154 HydrophobicContact CG2-CB 3.79Å |
| 143 | G | 85.8 | Confident | 87.7 | Confident | 11 Ų | 11 | 13 Ų | 13 | 11% | 0.113 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -63.1 | -32.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | P139 M140 Y141 R151 | P139-G143 PolarHBondContact O-N 2.91Å; M140-G143 PolarHBondContact O-N 3.23Å; Y141-G143 VanDerWaalsContact C-N 3.33Å; Y141-G143 PolarHBondContact O-N 2.98Å; G143-R151 PolarHBondContact O-NE 3.45Å |
| 144 | E | 87.9 | Confident | 87.4 | Confident | 4 Ų | 4 | 13.9 Ų | 13.9 | 2% | 0.019 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -85 | -23.9 | -178.5 | -70.9 | 178.8 | 175 | 0 | 0 | 114.3 | R90 M140 Y141 I142 S208 R210 Q395 | R90-E144 WeakPolarHBondContact CD-OE2 3.3Å; R90-E144 IonicContact CZ-OE1 3.47Å; R90-E144 IonicContact CZ-OE2 3.72Å; R90-E144 IonicContact NE-OE1 3.2Å; R90-E144 PolarHBondContact NE-OE1 2.84Å; R90-E144 IonicContact NE-OE2 2.84Å; R90-E144 PolarHBondContact NE-OE2 2.97Å; R90-E144 IonicContact NH2-OE1 2.84Å; R90-E144 PolarHBondContact NH2-OE1 2.98Å; R90-E144 IonicContact NH2-OE2 3.79Å; M140-E144 WeakPolarHBondContact O-CB 3.28Å; M140-E144 VanDerWaalsContact O-CG 3.28Å; M140-E144 WeakPolarHBondContact O-CG 3.2Å; M140-E144 PolarHBondContact O-N 3.42Å; Y141-E144 PolarHBondContact O-N 3.4Å; I142-E144 VanDerWaalsContact C-N 3.28Å; I142-E144 PolarHBondContact O-N 3.28Å; E144-S208 WeakPolarHBondContact CB-OG 3.44Å; E144-S208 WeakPolarHBondContact OE2-CB 3.39Å; E144-S208 PolarHBondContact OE2-OG 2.87Å; E144-R210 HydrophobicContact CB-CB 4.3Å; E144-R210 HydrophobicContact CB-CG 4.45Å; E144-R210 HydrophobicContact CG-CB 4.25Å; E144-Q395 PolarHBondContact OE1-NE2 3.33Å; E144-Q395 PolarHBondContact OE1-OE1 3.44Å |
| 145 | I | 91.9 | Very high | 86.9 | Confident | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -96.5 | -18.1 | 177.3 | 69.7 | 174.3 | 0 | 0 | 0 | 113.7 | L10 A13 I14 Y141 I142 L229 W230 | L10-I145 HydrophobicContact CD1-CD1 4.17Å; L10-I145 HydrophobicContact CD1-CG1 4.14Å; A13-I145 HydrophobicContact CB-CD1 3.95Å; I14-I145 HydrophobicContact CG1-CD1 3.75Å; I14-I145 HydrophobicContact CG1-CG1 4.38Å; Y141-I145 HydrophobicContact CD1-CD1 4Å; Y141-I145 HydrophobicContact CD2-CG2 4.28Å; Y141-I145 HydrophobicContact CE1-CD1 3.56Å; Y141-I145 HydrophobicContact CE2-CG2 3.95Å; Y141-I145 WeakPolarHBondContact O-CG1 3.32Å; Y141-I145 PolarHBondContact O-N 3.5Å; Y141-I145 VanDerWaalsContact O-N 3.11Å; I142-I145 PolarHBondContact O-N 3.49Å; I145-L229 HydrophobicContact CB-CD1 4.07Å; I145-L229 HydrophobicContact CG2-CD1 4.42Å; I145-W230 PolarHBondContact O-NE1 3.28Å; I145-W230 VanDerWaalsContact O-NE1 3.15Å |
| 146 | S | 89.7 | Confident | 86.8 | Confident | 3 Ų | 3 | 13.9 Ų | 13.9 | 2% | 0.021 | 9% | 0.092 | C | C | . | . | S | Bend | trans | -79.4 | 141.8 | -175.2 | -66.1 | 0 | 0 | 0 | 0 | 112.4 | I142 F154 | I142-S146 WeakPolarHBondContact O-CB 3.33Å; I142-S146 PolarHBondContact O-N 3.42Å; I142-S146 PolarHBondContact O-OG 2.71Å; S146-F154 WeakPolarHBondContact OG-CB 3.23Å; S146-F154 WeakPolarHBondContact OG-CD2 2.97Å |
| 147 | P | 86.9 | Confident | 86.9 | Confident | 4 Ų | 4 | 15.7 Ų | 15.7 | 3% | 0.026 | 10% | 0.1 | C | C | . | . | trans | -55.3 | 141.9 | 166.3 | -22.2 | 32.1 | 0 | 0 | 0 | 111.5 | L10 A149 L150 R151 W230 | L10-P147 HydrophobicContact CD2-CG 4.29Å; P147-A149 PolarHBondContact O-N 3.26Å; P147-L150 PolarHBondContact O-N 3.35Å; P147-R151 PolarHBondContact O-N 2.79Å; P147-R151 VanDerWaalsContact O-N 3.11Å; P147-W230 HydrophobicContact CG-CG 4.37Å | ||
| 148 | T | 80 | Confident | 86.8 | Confident | 45 Ų | 45 | 15.9 Ų | 15.9 | 28% | 0.276 | 10% | 0.101 | S | C | . | . | G | 310 helix | trans | -55.6 | -38.9 | -177.1 | -61.4 | 0 | 0 | 0 | 0 | 112.6 | L150 R151 | T148-L150 VanDerWaalsContact C-N 3.3Å; T148-L150 PolarHBondContact O-N 2.97Å; T148-R151 PolarHBondContact OG1-NH2 2.84Å; T148-R151 VanDerWaalsContact OG1-NH2 3.08Å |
| 149 | A | 80.9 | Confident | 86.6 | Confident | 77 Ų | 77 | 16.4 Ų | 16.4 | 64% | 0.636 | 10% | 0.104 | S | C | * | . | G | 310 helix | trans | -69 | -21.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | P147 | P147-A149 PolarHBondContact O-N 3.26Š|
| 150 | L | 83.5 | Confident | 86.8 | Confident | 66 Ų | 66 | 18 Ų | 18 | 35% | 0.346 | 11% | 0.112 | S | C | . | . | G | 310 helix | trans | -116.6 | 9 | -176.5 | -63.6 | 177.3 | 0 | 0 | 0 | 112.6 | V6 P147 T148 G152 A153 F154 | V6-L150 HydrophobicContact CG2-CD1 3.57Å; P147-L150 PolarHBondContact O-N 3.35Å; T148-L150 VanDerWaalsContact C-N 3.3Å; T148-L150 PolarHBondContact O-N 2.97Å; L150-G152 PolarHBondContact O-N 3.28Å; L150-A153 PolarHBondContact O-N 2.96Å; L150-F154 HydrophobicContact CB-CD2 3.79Å; L150-F154 HydrophobicContact CB-CE2 3.64Å; L150-F154 HydrophobicContact CD1-CE2 3.92Å; L150-F154 HydrophobicContact CD1-CZ 4.25Å; L150-F154 HydrophobicContact CG-CE2 4.45Å; L150-F154 WeakPolarHBondContact O-CD2 3.29Å; L150-F154 PolarHBondContact O-N 3.31Å |
| 151 | R | 82.1 | Confident | 87.2 | Confident | 19 Ų | 19 | 18.4 Ų | 18.4 | 7% | 0.072 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.4 | -41.7 | -172.7 | -173.3 | -179 | -67.7 | 140.3 | 6.4 | 112.7 | G143 P147 T148 G155 F458 | G143-R151 PolarHBondContact O-NE 3.45Å; P147-R151 PolarHBondContact O-N 2.79Å; P147-R151 VanDerWaalsContact O-N 3.11Å; T148-R151 PolarHBondContact OG1-NH2 2.84Å; T148-R151 VanDerWaalsContact OG1-NH2 3.08Å; R151-G155 PolarHBondContact O-N 3.15Å; R151-F458 VanDerWaalsContact CZ-CE2 3.44Å |
| 152 | G | 78 | Confident | 87.2 | Confident | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -72.2 | -40.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L150 G155 T156 E327 | L150-G152 PolarHBondContact O-N 3.28Å; G152-G155 PolarHBondContact O-N 2.94Å; G152-T156 PolarHBondContact O-N 3.16Å; G152-T156 PolarHBondContact O-OG1 2.9Å; G152-E327 WeakPolarHBondContact CA-OE1 3.31Å; G152-E327 PolarHBondContact N-OE1 3.3Å |
| 153 | A | 83.6 | Confident | 87.3 | Confident | 16 Ų | 16 | 18.8 Ų | 18.8 | 13% | 0.132 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -58.2 | -50 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L150 T156 E327 | L150-A153 PolarHBondContact O-N 2.96Å; A153-T156 WeakPolarHBondContact O-CB 3.4Å; A153-T156 PolarHBondContact O-N 3.45Å; A153-E327 HydrophobicContact CB-CG 4.26Å; A153-E327 PolarHBondContact N-OE1 3.34Å; A153-E327 VanDerWaalsContact N-OE1 3.11Å |
| 154 | F | 88.3 | Confident | 87.8 | Confident | 25 Ų | 25 | 20.7 Ų | 20.7 | 11% | 0.11 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -69.2 | -34.6 | 175.6 | -69.5 | -48.6 | 0 | 0 | 0 | 112.8 | V6 L10 I14 I142 S146 L150 T156 L157 | V6-F154 HydrophobicContact CG1-CZ 3.97Å; V6-F154 HydrophobicContact CG2-CZ 3.96Å; L10-F154 HydrophobicContact CD2-CE2 3.87Å; L10-F154 HydrophobicContact CD2-CZ 4.06Å; I14-F154 HydrophobicContact CD1-CB 4.03Å; I14-F154 HydrophobicContact CD1-CD1 3.59Å; I14-F154 HydrophobicContact CD1-CD2 3.98Å; I14-F154 HydrophobicContact CD1-CE1 3.96Å; I14-F154 HydrophobicContact CD1-CE2 4.31Å; I14-F154 HydrophobicContact CD1-CG 3.6Å; I14-F154 HydrophobicContact CD1-CZ 4.3Å; I142-F154 HydrophobicContact CG2-CB 3.79Å; S146-F154 WeakPolarHBondContact OG-CB 3.23Å; S146-F154 WeakPolarHBondContact OG-CD2 2.97Å; L150-F154 HydrophobicContact CB-CD2 3.79Å; L150-F154 HydrophobicContact CB-CE2 3.64Å; L150-F154 HydrophobicContact CD1-CE2 3.92Å; L150-F154 HydrophobicContact CD1-CZ 4.25Å; L150-F154 HydrophobicContact CG-CE2 4.45Å; L150-F154 WeakPolarHBondContact O-CD2 3.29Å; L150-F154 PolarHBondContact O-N 3.31Å; F154-T156 PolarHBondContact O-N 3.48Å; F154-L157 HydrophobicContact CD1-CD1 3.79Å; F154-L157 VanDerWaalsContact O-CB 3.28Å; F154-L157 WeakPolarHBondContact O-CB 3.39Å; F154-L157 PolarHBondContact O-N 2.98Å |
| 155 | G | 85.5 | Confident | 88.2 | Confident | 7 Ų | 7 | 20.5 Ų | 20.5 | 7% | 0.072 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -57.8 | -33.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.6 | R151 G152 L157 N158 | R151-G155 PolarHBondContact O-N 3.15Å; G152-G155 PolarHBondContact O-N 2.94Å; G155-L157 PolarHBondContact O-N 2.92Å; G155-N158 VanDerWaalsContact O-CB 3.3Å; G155-N158 WeakPolarHBondContact O-CB 3.47Å; G155-N158 PolarHBondContact O-N 3.32Å |
| 156 | T | 85.6 | Confident | 88.3 | Confident | 1 Ų | 1 | 21.2 Ų | 21.2 | 1% | 0.006 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -67.9 | -22.7 | 176.5 | -51.9 | 0 | 0 | 0 | 0 | 112.6 | G152 A153 F154 N158 Q159 L160 T319 L323 P383 | G152-T156 PolarHBondContact O-N 3.16Å; G152-T156 PolarHBondContact O-OG1 2.9Å; A153-T156 WeakPolarHBondContact O-CB 3.4Å; A153-T156 PolarHBondContact O-N 3.45Å; F154-T156 PolarHBondContact O-N 3.48Å; T156-N158 PolarHBondContact O-N 3Å; T156-Q159 PolarHBondContact O-N 3.34Å; T156-L160 PolarHBondContact O-N 3.35Å; T156-T319 HydrophobicContact CG2-CG2 4.36Å; T156-L323 HydrophobicContact CG2-CB 3.77Å; T156-L323 HydrophobicContact CG2-CD1 4.49Å; T156-L323 HydrophobicContact CG2-CG 4.42Å; T156-P383 HydrophobicContact CG2-CB 4.01Å |
| 157 | L | 89.7 | Confident | 88.5 | Confident | 44 Ų | 44 | 22.3 Ų | 22.3 | 23% | 0.23 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -64.8 | -23.3 | 174.1 | -64 | 175.2 | 0 | 0 | 0 | 112.8 | I14 T18 F154 G155 L160 G161 L323 | I14-L157 HydrophobicContact CG2-CB 4.44Å; I14-L157 HydrophobicContact CG2-CD1 3.64Å; T18-L157 HydrophobicContact CG2-CB 4.03Å; T18-L157 WeakPolarHBondContact CG2-O 3.29Å; F154-L157 HydrophobicContact CD1-CD1 3.79Å; F154-L157 VanDerWaalsContact O-CB 3.28Å; F154-L157 WeakPolarHBondContact O-CB 3.39Å; F154-L157 PolarHBondContact O-N 2.98Å; G155-L157 PolarHBondContact O-N 2.92Å; L157-L160 HydrophobicContact CD2-CD2 3.79Å; L157-L160 PolarHBondContact O-N 3.02Å; L157-G161 PolarHBondContact O-N 3.47Å; L157-L323 HydrophobicContact CD2-CD1 3.51Å; L157-L323 HydrophobicContact CG-CD1 4.03Å |
| 158 | N | 89.4 | Confident | 88.9 | Confident | 4 Ų | 4 | 23.7 Ų | 23.7 | 2% | 0.021 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -59.5 | -51.1 | 168.6 | 177.6 | 67.7 | 0 | 0 | 0 | 110.4 | S21 G155 T156 L160 G161 I162 | S21-N158 WeakPolarHBondContact CB-O 3.44Å; S21-N158 WeakPolarHBondContact CB-OD1 3.32Å; S21-N158 PolarHBondContact OG-OD1 3.28Å; G155-N158 VanDerWaalsContact O-CB 3.3Å; G155-N158 WeakPolarHBondContact O-CB 3.47Å; G155-N158 PolarHBondContact O-N 3.32Å; T156-N158 PolarHBondContact O-N 3Å; N158-L160 VanDerWaalsContact C-N 3.33Å; N158-L160 PolarHBondContact O-N 2.99Å; N158-G161 PolarHBondContact O-N 3.46Å; N158-I162 WeakPolarHBondContact O-CG1 3.48Å; N158-I162 PolarHBondContact O-N 3.06Å |
| 159 | Q | 89.9 | Confident | 89.6 | Confident | 11 Ų | 11 | 21.6 Ų | 21.6 | 5% | 0.051 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -63.4 | -40.6 | 176.9 | -174.1 | 63.8 | 16.1 | 0 | 0 | 111.3 | T156 G161 I162 V163 T319 E378 P383 | T156-Q159 PolarHBondContact O-N 3.34Å; Q159-G161 VanDerWaalsContact C-N 3.29Å; Q159-G161 PolarHBondContact O-N 3.24Å; Q159-I162 WeakPolarHBondContact O-CB 3.12Å; Q159-I162 PolarHBondContact O-N 3.43Å; Q159-V163 HydrophobicContact CG-CG1 4.34Å; Q159-V163 PolarHBondContact O-N 3.36Å; Q159-T319 HydrophobicContact CB-CG2 4.02Å; Q159-T319 HydrophobicContact CG-CG2 3.73Å; Q159-E378 VanDerWaalsContact CG-OE2 3.29Å; Q159-E378 WeakPolarHBondContact CG-OE2 3.3Å; Q159-E378 PolarHBondContact NE2-OE1 2.99Å; Q159-E378 PolarHBondContact NE2-OE2 3.23Å; Q159-P383 HydrophobicContact CB-CB 3.83Å; Q159-P383 HydrophobicContact CG-CB 3.98Å |
| 160 | L | 92.2 | Very high | 90 | Very high | 38 Ų | 38 | 18.3 Ų | 18.3 | 20% | 0.199 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -58.5 | -41.7 | 176.8 | -172.9 | 61.5 | 0 | 0 | 0 | 112 | T156 L157 N158 I162 V163 V164 T316 T319 V320 | T156-L160 PolarHBondContact O-N 3.35Å; L157-L160 HydrophobicContact CD2-CD2 3.79Å; L157-L160 PolarHBondContact O-N 3.02Å; N158-L160 VanDerWaalsContact C-N 3.33Å; N158-L160 PolarHBondContact O-N 2.99Å; L160-I162 VanDerWaalsContact C-N 3.34Å; L160-I162 PolarHBondContact O-N 3.1Å; L160-V163 HydrophobicContact CD1-CG2 4.09Å; L160-V163 VanDerWaalsContact O-CG2 3.28Å; L160-V163 WeakPolarHBondContact O-CG2 3.45Å; L160-V164 HydrophobicContact CD1-CG2 4.24Å; L160-V164 HydrophobicContact CG-CG2 4.42Å; L160-V164 WeakPolarHBondContact O-CB 3.47Å; L160-V164 WeakPolarHBondContact O-CG2 3.28Å; L160-V164 PolarHBondContact O-N 2.94Å; L160-T316 HydrophobicContact CD1-CG2 4.31Å; L160-T319 HydrophobicContact CB-CG2 4.09Å; L160-T319 HydrophobicContact CD1-CG2 4.23Å; L160-V320 HydrophobicContact CD1-CG2 3.74Å; L160-V320 HydrophobicContact CD2-CG2 4.46Å |
| 161 | G | 95.1 | Very high | 90.5 | Very high | 11 Ų | 11 | 18 Ų | 18 | 11% | 0.113 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -58.8 | -45.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | F22 L157 N158 Q159 V164 G165 | F22-G161 VanDerWaalsContact CA-O 3.24Å; F22-G161 WeakPolarHBondContact CA-O 3.4Å; L157-G161 PolarHBondContact O-N 3.47Å; N158-G161 PolarHBondContact O-N 3.46Å; Q159-G161 VanDerWaalsContact C-N 3.29Å; Q159-G161 PolarHBondContact O-N 3.24Å; G161-V164 PolarHBondContact O-N 3.49Å; G161-G165 PolarHBondContact O-N 2.82Å |
| 162 | I | 94.4 | Very high | 91.1 | Very high | 9 Ų | 9 | 19.8 Ų | 19.8 | 5% | 0.046 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -59.8 | -52.3 | 179.2 | -61.6 | 166.8 | 0 | 0 | 0 | 110.9 | S21 F24 G25 N158 Q159 L160 V164 G165 I166 | S21-I162 WeakPolarHBondContact O-CA 3.22Å; S21-I162 WeakPolarHBondContact O-CG1 2.89Å; F24-I162 HydrophobicContact CD1-CD1 3.55Å; F24-I162 HydrophobicContact CD1-CG1 3.66Å; F24-I162 HydrophobicContact CD1-CG2 4.19Å; F24-I162 HydrophobicContact CE1-CD1 3.73Å; F24-I162 HydrophobicContact CE1-CG1 4.23Å; F24-I162 HydrophobicContact CE1-CG2 4.26Å; G25-I162 VanDerWaalsContact CA-O 3.27Å; G25-I162 WeakPolarHBondContact CA-O 3.31Å; N158-I162 WeakPolarHBondContact O-CG1 3.48Å; N158-I162 PolarHBondContact O-N 3.06Å; Q159-I162 WeakPolarHBondContact O-CB 3.12Å; Q159-I162 PolarHBondContact O-N 3.43Å; L160-I162 VanDerWaalsContact C-N 3.34Å; L160-I162 PolarHBondContact O-N 3.1Å; I162-V164 PolarHBondContact O-N 2.83Å; I162-G165 WeakPolarHBondContact O-CA 3.49Å; I162-G165 PolarHBondContact O-N 2.72Å; I162-G165 VanDerWaalsContact O-N 3.11Å; I162-I166 HydrophobicContact CG2-CD1 4.1Å; I162-I166 WeakPolarHBondContact O-CG1 3.31Å; I162-I166 PolarHBondContact O-N 3.42Å |
| 163 | V | 93.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -66.9 | -36.5 | -176.3 | -55.7 | 0 | 0 | 0 | 0 | 112.3 | Q159 L160 G165 I166 L167 N315 T316 T319 E378 | Q159-V163 HydrophobicContact CG-CG1 4.34Å; Q159-V163 PolarHBondContact O-N 3.36Å; L160-V163 HydrophobicContact CD1-CG2 4.09Å; L160-V163 VanDerWaalsContact O-CG2 3.28Å; L160-V163 WeakPolarHBondContact O-CG2 3.45Å; V163-G165 VanDerWaalsContact C-N 3.32Å; V163-I166 PolarHBondContact O-N 3.02Å; V163-L167 WeakPolarHBondContact O-CB 3.45Å; V163-L167 PolarHBondContact O-N 3.37Å; V163-N315 WeakPolarHBondContact CB-OD1 2.89Å; V163-N315 WeakPolarHBondContact CG1-OD1 3.18Å; V163-T316 HydrophobicContact CG2-CG2 4.44Å; V163-T319 WeakPolarHBondContact CG1-OG1 3.46Å; V163-T319 HydrophobicContact CG2-CG2 4.23Å; V163-E378 WeakPolarHBondContact CG1-OE1 3.35Å |
| 164 | V | 96.1 | Very high | 92.1 | Very high | 51 Ų | 51 | 20 Ų | 20 | 31% | 0.309 | 11% | 0.11 | S | C | . | . | H | α-helix | trans | -64.8 | -39.6 | 172.5 | 171.5 | 0 | 0 | 0 | 0 | 110.5 | F22 L160 G161 I162 L167 V168 T316 | F22-V164 HydrophobicContact CD2-CG1 4.11Å; F22-V164 HydrophobicContact CE2-CG1 4.18Å; L160-V164 HydrophobicContact CD1-CG2 4.24Å; L160-V164 HydrophobicContact CG-CG2 4.42Å; L160-V164 WeakPolarHBondContact O-CB 3.47Å; L160-V164 WeakPolarHBondContact O-CG2 3.28Å; L160-V164 PolarHBondContact O-N 2.94Å; G161-V164 PolarHBondContact O-N 3.49Å; I162-V164 PolarHBondContact O-N 2.83Å; V164-L167 PolarHBondContact O-N 3.5Å; V164-V168 HydrophobicContact CG1-CG2 4.32Å; V164-V168 WeakPolarHBondContact O-CB 3.21Å; V164-V168 VanDerWaalsContact O-CG2 3.32Å; V164-V168 WeakPolarHBondContact O-CG2 2.99Å; V164-V168 PolarHBondContact O-N 3.25Å; V164-T316 HydrophobicContact CG2-CG2 4.07Å |
| 165 | G | 96.6 | Very high | 92.2 | Very high | 0 Ų | 0 | 26.4 Ų | 26.4 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -58.5 | -47.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | F22 Y26 G161 I162 V163 V168 A169 | F22-G165 VanDerWaalsContact CD2-CA 3.49Å; Y26-G165 WeakPolarHBondContact CA-O 3.42Å; G161-G165 PolarHBondContact O-N 2.82Å; I162-G165 WeakPolarHBondContact O-CA 3.49Å; I162-G165 PolarHBondContact O-N 2.72Å; I162-G165 VanDerWaalsContact O-N 3.11Å; V163-G165 VanDerWaalsContact C-N 3.32Å; G165-V168 PolarHBondContact O-N 3.41Å; G165-A169 WeakPolarHBondContact O-CB 3.48Å; G165-A169 PolarHBondContact O-N 3.29Å |
| 166 | I | 92.5 | Very high | 92.4 | Very high | 14 Ų | 14 | 33.1 Ų | 33.1 | 7% | 0.072 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60.2 | -48.5 | 176.3 | -66.6 | 168.4 | 0 | 0 | 0 | 110.3 | G25 I162 V163 V168 A169 Q170 F289 | G25-I166 VanDerWaalsContact O-CG1 3.31Å; G25-I166 WeakPolarHBondContact O-CG1 3.31Å; I162-I166 HydrophobicContact CG2-CD1 4.1Å; I162-I166 WeakPolarHBondContact O-CG1 3.31Å; I162-I166 PolarHBondContact O-N 3.42Å; V163-I166 PolarHBondContact O-N 3.02Å; I166-V168 PolarHBondContact O-N 2.65Å; I166-A169 WeakPolarHBondContact O-CB 3.13Å; I166-A169 PolarHBondContact O-N 2.96Å; I166-Q170 HydrophobicContact CG2-CG 4.42Å; I166-Q170 WeakPolarHBondContact O-CG 3.46Å; I166-Q170 PolarHBondContact O-N 2.88Å; I166-F289 HydrophobicContact CG2-CD1 4.46Å; I166-F289 HydrophobicContact CG2-CE1 4.43Å |
| 167 | L | 93.8 | Very high | 92.9 | Very high | 27 Ų | 27 | 35.8 Ų | 35.8 | 14% | 0.141 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.7 | -45.6 | -179.2 | 178.6 | 59.5 | 0 | 0 | 0 | 111.9 | V163 V164 A169 Q170 I171 I309 V313 | V163-L167 WeakPolarHBondContact O-CB 3.45Å; V163-L167 PolarHBondContact O-N 3.37Å; V164-L167 PolarHBondContact O-N 3.5Å; L167-A169 VanDerWaalsContact C-N 3.32Å; L167-A169 PolarHBondContact O-N 3.36Å; L167-Q170 PolarHBondContact O-N 3.49Å; L167-I171 HydrophobicContact CD1-CD1 4.01Å; L167-I171 HydrophobicContact CD1-CG1 4.3Å; L167-I171 HydrophobicContact CG-CD1 3.94Å; L167-I171 VanDerWaalsContact O-CG1 3.3Å; L167-I171 WeakPolarHBondContact O-CG1 3.21Å; L167-I171 PolarHBondContact O-N 2.87Å; L167-I309 HydrophobicContact CD1-CG2 4.11Å; L167-V313 HydrophobicContact CD1-CG2 3.93Å; L167-V313 HydrophobicContact CD2-CG2 4.29Å |
| 168 | V | 96.1 | Very high | 93.1 | Very high | 33 Ų | 33 | 35.2 Ų | 35.2 | 20% | 0.2 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.1 | -40.1 | 176.9 | 171.7 | 0 | 0 | 0 | 0 | 111 | F22 Y26 V164 G165 I166 Q170 I171 F172 | F22-V168 HydrophobicContact CE2-CB 4.02Å; F22-V168 HydrophobicContact CE2-CG1 4.39Å; F22-V168 HydrophobicContact CE2-CG2 3.98Å; F22-V168 HydrophobicContact CZ-CB 4.11Å; F22-V168 HydrophobicContact CZ-CG1 4.02Å; F22-V168 HydrophobicContact CZ-CG2 4.42Å; Y26-V168 HydrophobicContact CD2-CG1 4.31Å; Y26-V168 HydrophobicContact CE2-CG1 4.24Å; V164-V168 HydrophobicContact CG1-CG2 4.32Å; V164-V168 WeakPolarHBondContact O-CB 3.21Å; V164-V168 VanDerWaalsContact O-CG2 3.32Å; V164-V168 WeakPolarHBondContact O-CG2 2.99Å; V164-V168 PolarHBondContact O-N 3.25Å; G165-V168 PolarHBondContact O-N 3.41Å; I166-V168 PolarHBondContact O-N 2.65Å; V168-Q170 PolarHBondContact O-N 3.04Å; V168-I171 PolarHBondContact O-N 3.35Å; V168-F172 HydrophobicContact CG1-CD1 4.27Å; V168-F172 HydrophobicContact CG1-CD2 4.03Å; V168-F172 HydrophobicContact CG1-CE1 4.08Å; V168-F172 HydrophobicContact CG1-CE2 3.83Å; V168-F172 HydrophobicContact CG1-CG 4.26Å; V168-F172 HydrophobicContact CG1-CZ 3.86Å; V168-F172 WeakPolarHBondContact O-CB 3.46Å; V168-F172 WeakPolarHBondContact O-CG 3.38Å; V168-F172 PolarHBondContact O-N 3Å |
| 169 | A | 93.8 | Very high | 93.2 | Very high | 1 Ų | 1 | 35.2 Ų | 35.2 | 1% | 0.008 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.8 | -40.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y26 V30 G165 I166 L167 G173 | Y26-A169 HydrophobicContact CD2-CB 3.64Å; Y26-A169 HydrophobicContact CE2-CB 3.86Å; Y26-A169 HydrophobicContact CG-CB 4.13Å; Y26-A169 WeakPolarHBondContact O-CB 3.44Å; V30-A169 HydrophobicContact CB-CB 3.95Å; G165-A169 WeakPolarHBondContact O-CB 3.48Å; G165-A169 PolarHBondContact O-N 3.29Å; I166-A169 WeakPolarHBondContact O-CB 3.13Å; I166-A169 PolarHBondContact O-N 2.96Å; L167-A169 VanDerWaalsContact C-N 3.32Å; L167-A169 PolarHBondContact O-N 3.36Å; A169-G173 PolarHBondContact O-N 2.77Å |
| 170 | Q | 90.3 | Very high | 93.3 | Very high | 8 Ų | 8 | 35.8 Ų | 35.8 | 4% | 0.037 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65.2 | -42.7 | 175.5 | -70.6 | 171.1 | -22.1 | 0 | 0 | 111.8 | I166 L167 V168 G173 T308 I309 | I166-Q170 HydrophobicContact CG2-CG 4.42Å; I166-Q170 WeakPolarHBondContact O-CG 3.46Å; I166-Q170 PolarHBondContact O-N 2.88Å; L167-Q170 PolarHBondContact O-N 3.49Å; V168-Q170 PolarHBondContact O-N 3.04Å; Q170-G173 PolarHBondContact O-N 3.12Å; Q170-T308 HydrophobicContact CG-CG2 4.45Å; Q170-T308 PolarHBondContact NE2-O 3.05Å; Q170-T308 PolarHBondContact OE1-O 3.19Å; Q170-I309 HydrophobicContact CB-CG1 3.98Å |
| 171 | I | 93.8 | Very high | 93.4 | Very high | 60 Ų | 60 | 38.7 Ų | 38.7 | 31% | 0.308 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -63.9 | -50.7 | 176.9 | -67.7 | 166.5 | 0 | 0 | 0 | 110 | L167 V168 G173 L174 I177 I309 | L167-I171 HydrophobicContact CD1-CD1 4.01Å; L167-I171 HydrophobicContact CD1-CG1 4.3Å; L167-I171 HydrophobicContact CG-CD1 3.94Å; L167-I171 VanDerWaalsContact O-CG1 3.3Å; L167-I171 WeakPolarHBondContact O-CG1 3.21Å; L167-I171 PolarHBondContact O-N 2.87Å; V168-I171 PolarHBondContact O-N 3.35Å; I171-G173 PolarHBondContact O-N 2.85Å; I171-L174 VanDerWaalsContact O-CB 3.3Å; I171-L174 WeakPolarHBondContact O-CB 3.45Å; I171-L174 WeakPolarHBondContact O-CD1 3.38Å; I171-L174 VanDerWaalsContact O-CG 3.28Å; I171-L174 WeakPolarHBondContact O-CG 3.2Å; I171-L174 PolarHBondContact O-N 2.91Å; I171-I177 HydrophobicContact CG2-CD1 3.93Å; I171-I177 WeakPolarHBondContact O-CD1 3.28Å; I171-I309 HydrophobicContact CG1-CG2 4.43Å |
| 172 | F | 95.4 | Very high | 93.4 | Very high | 55 Ų | 55 | 45.6 Ų | 45.6 | 24% | 0.241 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64 | -27.2 | 179.5 | -74.1 | 5.4 | 0 | 0 | 0 | 112.6 | Y26 V168 L174 I177 L178 G179 L187 F190 | Y26-F172 HydrophobicContact CE2-CD2 4.04Å; V168-F172 HydrophobicContact CG1-CD1 4.27Å; V168-F172 HydrophobicContact CG1-CD2 4.03Å; V168-F172 HydrophobicContact CG1-CE1 4.08Å; V168-F172 HydrophobicContact CG1-CE2 3.83Å; V168-F172 HydrophobicContact CG1-CG 4.26Å; V168-F172 HydrophobicContact CG1-CZ 3.86Å; V168-F172 WeakPolarHBondContact O-CB 3.46Å; V168-F172 WeakPolarHBondContact O-CG 3.38Å; V168-F172 PolarHBondContact O-N 3Å; F172-L174 PolarHBondContact O-N 2.98Å; F172-I177 HydrophobicContact CD1-CG2 4.14Å; F172-L178 HydrophobicContact CB-CD1 4.38Å; F172-L178 HydrophobicContact CD2-CD1 4.12Å; F172-L178 HydrophobicContact CG-CD1 4.39Å; F172-L178 WeakPolarHBondContact O-CA 3.47Å; F172-L178 WeakPolarHBondContact O-CB 3.32Å; F172-L178 PolarHBondContact O-N 3.34Å; F172-G179 PolarHBondContact O-N 3.37Å; F172-L187 HydrophobicContact CB-CD1 3.51Å; F172-F190 HydrophobicContact CD2-CD1 4.49Å; F172-F190 HydrophobicContact CD2-CD2 4.45Å; F172-F190 HydrophobicContact CD2-CG 4.43Å; F172-F190 HydrophobicContact CE2-CD1 4.26Å; F172-F190 AromaticContact CE2-CD2 3.93Å; F172-F190 HydrophobicContact CE2-CD2 3.93Å; F172-F190 AromaticContact CE2-CE1 3.97Å; F172-F190 HydrophobicContact CE2-CE1 3.97Å; F172-F190 AromaticContact CE2-CE2 3.64Å; F172-F190 HydrophobicContact CE2-CE2 3.64Å; F172-F190 HydrophobicContact CE2-CG 4.24Å; F172-F190 AromaticContact CE2-CZ 3.67Å; F172-F190 HydrophobicContact CE2-CZ 3.67Å; F172-F190 HydrophobicContact CZ-CE2 4.44Å; F172-F190 HydrophobicContact CZ-CZ 4.4Å |
| 173 | G | 91.4 | Very high | 93.5 | Very high | 7 Ų | 7 | 48.1 Ų | 48.1 | 7% | 0.072 | 24% | 0.24 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -5.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | A169 Q170 I171 G179 | A169-G173 PolarHBondContact O-N 2.77Å; Q170-G173 PolarHBondContact O-N 3.12Å; I171-G173 PolarHBondContact O-N 2.85Å; G173-G179 WeakPolarHBondContact O-CA 3.24Å |
| 174 | L | 90.8 | Very high | 93.6 | Very high | 15 Ų | 15 | 48.2 Ų | 48.2 | 8% | 0.079 | 24% | 0.24 | C | C | . | . | S | Bend | trans | -64.8 | 141.7 | 171.9 | -69.2 | 168.4 | 0 | 0 | 0 | 110.9 | I171 F172 F176 I177 L178 G179 I305 Y306 I309 | I171-L174 VanDerWaalsContact O-CB 3.3Å; I171-L174 WeakPolarHBondContact O-CB 3.45Å; I171-L174 WeakPolarHBondContact O-CD1 3.38Å; I171-L174 VanDerWaalsContact O-CG 3.28Å; I171-L174 WeakPolarHBondContact O-CG 3.2Å; I171-L174 PolarHBondContact O-N 2.91Å; F172-L174 PolarHBondContact O-N 2.98Å; L174-F176 VanDerWaalsContact C-N 3.26Å; L174-F176 HydrophobicContact CB-CD1 4.17Å; L174-F176 HydrophobicContact CB-CE1 3.82Å; L174-F176 HydrophobicContact CB-CZ 4.07Å; L174-F176 HydrophobicContact CD1-CE1 3.83Å; L174-F176 HydrophobicContact CD1-CE2 4.42Å; L174-F176 HydrophobicContact CD1-CZ 3.54Å; L174-F176 HydrophobicContact CD2-CE1 4.34Å; L174-F176 HydrophobicContact CG-CE1 4.21Å; L174-F176 HydrophobicContact CG-CZ 4.34Å; L174-F176 PolarHBondContact O-N 3.46Å; L174-I177 HydrophobicContact CB-CD1 4.42Å; L174-I177 HydrophobicContact CB-CG1 4.25Å; L174-I177 HydrophobicContact CD1-CD1 4.34Å; L174-I177 PolarHBondContact O-N 3.4Å; L174-L178 PolarHBondContact O-N 3.04Å; L174-G179 PolarHBondContact O-N 2.97Å; L174-I305 HydrophobicContact CD2-CG1 3.84Å; L174-I305 HydrophobicContact CD2-CG2 4.08Å; L174-Y306 HydrophobicContact CD2-CE1 4.15Å; L174-I309 HydrophobicContact CD1-CD1 3.94Å; L174-I309 HydrophobicContact CD2-CD1 3.87Å; L174-I309 HydrophobicContact CG-CD1 4.04Å |
| 175 | E | 89.2 | Confident | 93.7 | Very high | 158 Ų | 158 | 46.4 Ų | 46.4 | 74% | 0.738 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -56.3 | -39.3 | -174.9 | -174.5 | 177.2 | 179.7 | 0 | 0 | 112.7 | I177 | E175-I177 VanDerWaalsContact C-N 3.27Å; E175-I177 PolarHBondContact O-N 3.05Å |
| 176 | F | 90.8 | Very high | 93.7 | Very high | 149 Ų | 149 | 51.3 Ų | 51.3 | 65% | 0.654 | 26% | 0.255 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -2 | 179.7 | 64.5 | -96.6 | 0 | 0 | 0 | 114.5 | L174 | L174-F176 VanDerWaalsContact C-N 3.26Å; L174-F176 HydrophobicContact CB-CD1 4.17Å; L174-F176 HydrophobicContact CB-CE1 3.82Å; L174-F176 HydrophobicContact CB-CZ 4.07Å; L174-F176 HydrophobicContact CD1-CE1 3.83Å; L174-F176 HydrophobicContact CD1-CE2 4.42Å; L174-F176 HydrophobicContact CD1-CZ 3.54Å; L174-F176 HydrophobicContact CD2-CE1 4.34Å; L174-F176 HydrophobicContact CG-CE1 4.21Å; L174-F176 HydrophobicContact CG-CZ 4.34Å; L174-F176 PolarHBondContact O-N 3.46Å |
| 177 | I | 94.8 | Very high | 93.9 | Very high | 56 Ų | 56 | 50.7 Ų | 50.7 | 29% | 0.287 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.2 | -84.9 | 178.6 | -56.1 | -171.5 | 0 | 0 | 0 | 110.5 | I171 F172 L174 E175 | I171-I177 HydrophobicContact CG2-CD1 3.93Å; I171-I177 WeakPolarHBondContact O-CD1 3.28Å; F172-I177 HydrophobicContact CD1-CG2 4.14Å; L174-I177 HydrophobicContact CB-CD1 4.42Å; L174-I177 HydrophobicContact CB-CG1 4.25Å; L174-I177 HydrophobicContact CD1-CD1 4.34Å; L174-I177 PolarHBondContact O-N 3.4Å; E175-I177 VanDerWaalsContact C-N 3.27Å; E175-I177 PolarHBondContact O-N 3.05Å |
| 178 | L | 94.3 | Very high | 94.1 | Very high | 33 Ų | 33 | 49.4 Ų | 49.4 | 17% | 0.173 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -130.7 | -4.8 | 178.3 | -65.4 | 173.8 | 0 | 0 | 0 | 112.6 | F172 L174 S180 L183 W184 L186 L187 | F172-L178 HydrophobicContact CB-CD1 4.38Å; F172-L178 HydrophobicContact CD2-CD1 4.12Å; F172-L178 HydrophobicContact CG-CD1 4.39Å; F172-L178 WeakPolarHBondContact O-CA 3.47Å; F172-L178 WeakPolarHBondContact O-CB 3.32Å; F172-L178 PolarHBondContact O-N 3.34Å; L174-L178 PolarHBondContact O-N 3.04Å; L178-S180 PolarHBondContact O-N 3.21Å; L178-L183 HydrophobicContact CD2-CB 4.08Å; L178-L183 HydrophobicContact CD2-CD1 4.28Å; L178-L183 CarbonylContact O-C 3.54Å; L178-W184 WeakPolarHBondContact O-CA 3.31Å; L178-W184 PolarHBondContact O-N 3.05Å; L178-W184 VanDerWaalsContact O-N 3.16Å; L178-L186 HydrophobicContact CD2-CB 4.31Å; L178-L187 HydrophobicContact CB-CB 3.87Å; L178-L187 HydrophobicContact CB-CD1 4.03Å; L178-L187 HydrophobicContact CB-CG 4.47Å; L178-L187 HydrophobicContact CD1-CD1 4.49Å |
| 179 | G | 91.9 | Very high | 94.1 | Very high | 4 Ų | 4 | 48.3 Ų | 48.3 | 4% | 0.041 | 24% | 0.241 | C | C | . | . | trans | -80.8 | 23.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115 | I37 F172 G173 L174 | I37-G179 WeakPolarHBondContact CD1-O 3.41Å; F172-G179 PolarHBondContact O-N 3.37Å; G173-G179 WeakPolarHBondContact O-CA 3.24Å; L174-G179 PolarHBondContact O-N 2.97Å | ||
| 180 | S | 93.1 | Very high | 94.4 | Very high | 23 Ų | 23 | 50.3 Ų | 50.3 | 16% | 0.161 | 25% | 0.249 | C | C | . | . | S | Bend | trans | -90.7 | 165.3 | 178.8 | 68.5 | 0 | 0 | 0 | 0 | 112.3 | L178 E182 L183 W184 | L178-S180 PolarHBondContact O-N 3.21Å; S180-E182 PolarHBondContact O-N 3.47Å; S180-E182 VanDerWaalsContact O-N 3.15Å; S180-L183 PolarHBondContact O-N 2.77Å; S180-L183 PolarHBondContact OG-N 3.2Å; S180-W184 PolarHBondContact O-N 2.93Å; S180-W184 VanDerWaalsContact O-N 3.16Å |
| 181 | E | 93.6 | Very high | 94.7 | Very high | 99 Ų | 99 | 49.9 Ų | 49.9 | 46% | 0.463 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -54.6 | -34.7 | 175.4 | -175.1 | 178.4 | -175.6 | 0 | 0 | 111.6 | I37 K44 K112 W184 | I37-E181 HydrophobicContact CG2-CB 4.48Å; K44-E181 IonicContact NZ-OE1 2.69Å; K44-E181 PolarHBondContact NZ-OE1 2.9Å; K112-E181 PolarHBondContact NZ-O 3.36Å; E181-W184 PolarHBondContact O-NE1 2.93Å |
| 182 | E | 94.4 | Very high | 94.9 | Very high | 156 Ų | 156 | 48.9 Ų | 48.9 | 73% | 0.729 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -44.3 | -178 | -64.4 | -176.1 | 177 | 0 | 0 | 113.1 | S180 P185 | S180-E182 PolarHBondContact O-N 3.47Å; S180-E182 VanDerWaalsContact O-N 3.15Å; E182-P185 WeakPolarHBondContact O-CD 3.12Å |
| 183 | L | 97.1 | Very high | 95.1 | Very high | 62 Ų | 62 | 51.3 Ų | 51.3 | 33% | 0.325 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.4 | -6.1 | -164.1 | -57.8 | 175 | 0 | 0 | 0 | 115 | L178 S180 P185 L186 L187 | L178-L183 HydrophobicContact CD2-CB 4.08Å; L178-L183 HydrophobicContact CD2-CD1 4.28Å; L178-L183 CarbonylContact O-C 3.54Å; S180-L183 PolarHBondContact O-N 2.77Å; S180-L183 PolarHBondContact OG-N 3.2Å; L183-P185 VanDerWaalsContact C-N 3.26Å; L183-P185 VanDerWaalsContact O-N 3.11Å; L183-L186 HydrophobicContact CD2-CD1 3.89Å; L183-L186 WeakPolarHBondContact O-CA 3.43Å; L183-L186 WeakPolarHBondContact O-CB 3.27Å; L183-L186 PolarHBondContact O-N 3.31Å; L183-L187 PolarHBondContact O-N 3.18Å; L183-L187 VanDerWaalsContact O-N 3.11Å |
| 184 | W | 96.6 | Very high | 95.4 | Very high | 2 Ų | 2 | 51.6 Ų | 51.6 | 1% | 0.008 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -55.2 | -28.3 | 178.6 | 77.4 | -94.3 | 0 | 0 | 0 | 115.3 | P34 I37 I38 F41 C111 K112 L120 L178 S180 E181 L186 L187 L188 | P34-W184 HydrophobicContact CB-CB 4.26Å; I37-W184 HydrophobicContact CG2-CB 4.39Å; I37-W184 HydrophobicContact CG2-CG 3.93Å; I38-W184 HydrophobicContact CD1-CE3 3.89Å; I38-W184 HydrophobicContact CD1-CZ3 4.09Å; I38-W184 HydrophobicContact CG1-CD2 3.98Å; I38-W184 HydrophobicContact CG1-CE3 3.62Å; I38-W184 HydrophobicContact CG1-CH2 4.36Å; I38-W184 HydrophobicContact CG1-CZ3 3.82Å; F41-W184 HydrophobicContact CB-CZ2 3.86Å; F41-W184 AromaticContact CD1-CH2 3.67Å; F41-W184 HydrophobicContact CD1-CH2 3.67Å; F41-W184 AromaticContact CD1-CZ2 3.65Å; F41-W184 HydrophobicContact CD1-CZ2 3.65Å; F41-W184 AromaticContact CD2-CZ2 3.98Å; F41-W184 HydrophobicContact CD2-CZ2 3.98Å; F41-W184 AromaticContact CE1-CH2 3.94Å; F41-W184 HydrophobicContact CE1-CH2 3.94Å; F41-W184 HydrophobicContact CE1-CZ2 4.19Å; F41-W184 HydrophobicContact CE2-CZ2 4.48Å; F41-W184 HydrophobicContact CG-CH2 4.06Å; F41-W184 AromaticContact CG-CZ2 3.53Å; F41-W184 HydrophobicContact CG-CZ2 3.53Å; C111-W184 WeakPolarHBondContact SG-CH2 3.46Å; K112-W184 HydrophobicContact CB-CZ2 3.98Å; K112-W184 HydrophobicContact CD-CZ2 4.31Å; K112-W184 HydrophobicContact CG-CZ2 4.24Å; L120-W184 HydrophobicContact CD1-CZ3 4.4Å; L178-W184 WeakPolarHBondContact O-CA 3.31Å; L178-W184 PolarHBondContact O-N 3.05Å; L178-W184 VanDerWaalsContact O-N 3.16Å; S180-W184 PolarHBondContact O-N 2.93Å; S180-W184 VanDerWaalsContact O-N 3.16Å; E181-W184 PolarHBondContact O-NE1 2.93Å; W184-L186 VanDerWaalsContact C-N 3.31Å; W184-L186 PolarHBondContact O-N 3.43Å; W184-L187 VanDerWaalsContact O-CB 3.3Å; W184-L187 WeakPolarHBondContact O-CB 3.45Å; W184-L187 PolarHBondContact O-N 3.49Å; W184-L188 HydrophobicContact CE3-CD1 3.83Å; W184-L188 HydrophobicContact CE3-CG 4.3Å; W184-L188 HydrophobicContact CZ3-CD1 3.62Å; W184-L188 PolarHBondContact O-N 3.04Å |
| 185 | P | 97.3 | Very high | 95.7 | Very high | 12 Ų | 12 | 50.9 Ų | 50.9 | 8% | 0.078 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.7 | -35 | 173.2 | -19.8 | 34.4 | 0 | 0 | 0 | 111.7 | G109 K112 E182 L183 L187 L188 G189 | G109-P185 WeakPolarHBondContact CA-O 3.16Å; G109-P185 VanDerWaalsContact O-CB 3.3Å; G109-P185 WeakPolarHBondContact O-CB 3.29Å; K112-P185 HydrophobicContact CB-CB 4.36Å; K112-P185 HydrophobicContact CB-CG 3.57Å; K112-P185 HydrophobicContact CD-CG 3.6Å; K112-P185 HydrophobicContact CG-CG 4.21Å; E182-P185 WeakPolarHBondContact O-CD 3.12Å; L183-P185 VanDerWaalsContact C-N 3.26Å; L183-P185 VanDerWaalsContact O-N 3.11Å; P185-L187 VanDerWaalsContact C-N 3.35Å; P185-L188 PolarHBondContact O-N 2.9Å; P185-G189 PolarHBondContact O-N 2.63Å |
| 186 | L | 97.3 | Very high | 96.1 | Very high | 104 Ų | 104 | 48 Ų | 48 | 55% | 0.545 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -69.2 | -35.2 | 173.8 | -61.5 | 178.9 | 0 | 0 | 0 | 111.4 | L178 L183 W184 L188 G189 F190 | L178-L186 HydrophobicContact CD2-CB 4.31Å; L183-L186 HydrophobicContact CD2-CD1 3.89Å; L183-L186 WeakPolarHBondContact O-CA 3.43Å; L183-L186 WeakPolarHBondContact O-CB 3.27Å; L183-L186 PolarHBondContact O-N 3.31Å; W184-L186 VanDerWaalsContact C-N 3.31Å; W184-L186 PolarHBondContact O-N 3.43Å; L186-L188 VanDerWaalsContact C-N 3.31Å; L186-L188 PolarHBondContact O-N 3.27Å; L186-G189 CarbonylContact O-C 3.51Å; L186-G189 PolarHBondContact O-N 3.48Å; L186-F190 PolarHBondContact O-N 3.29Å |
| 187 | L | 97.1 | Very high | 96.5 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -55.3 | -46.6 | 172.4 | 179.2 | 65 | 0 | 0 | 0 | 111.1 | Y26 V30 P34 F172 L178 L183 W184 P185 | Y26-L187 WeakPolarHBondContact CE1-O 3.49Å; Y26-L187 WeakPolarHBondContact OH-CD1 3.35Å; Y26-L187 PolarHBondContact OH-O 3.14Å; V30-L187 HydrophobicContact CG2-CD1 3.79Å; V30-L187 HydrophobicContact CG2-CD2 4.13Å; V30-L187 HydrophobicContact CG2-CG 3.5Å; V30-L187 VanDerWaalsContact CG2-CG 3.5Å; P34-L187 HydrophobicContact CB-CD2 4.28Å; P34-L187 HydrophobicContact CG-CD2 3.87Å; F172-L187 HydrophobicContact CB-CD1 3.51Å; L178-L187 HydrophobicContact CB-CB 3.87Å; L178-L187 HydrophobicContact CB-CD1 4.03Å; L178-L187 HydrophobicContact CB-CG 4.47Å; L178-L187 HydrophobicContact CD1-CD1 4.49Å; L183-L187 PolarHBondContact O-N 3.18Å; L183-L187 VanDerWaalsContact O-N 3.11Å; W184-L187 VanDerWaalsContact O-CB 3.3Å; W184-L187 WeakPolarHBondContact O-CB 3.45Å; W184-L187 PolarHBondContact O-N 3.49Å; P185-L187 VanDerWaalsContact C-N 3.35Å |
| 188 | L | 96.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -74.1 | -38 | 175.6 | -58.7 | -176.9 | 0 | 0 | 0 | 112.7 | V30 I31 I38 M108 L120 W184 P185 L186 F190 | V30-L188 HydrophobicContact CG1-CD2 3.79Å; V30-L188 HydrophobicContact CG2-CD2 3.99Å; I31-L188 HydrophobicContact CD1-CD2 4.25Å; I38-L188 HydrophobicContact CD1-CD1 4.37Å; M108-L188 HydrophobicContact CB-CB 3.69Å; M108-L188 HydrophobicContact CB-CD1 4.14Å; M108-L188 HydrophobicContact CG-CB 4.48Å; M108-L188 HydrophobicContact SD-CB 4.19Å; M108-L188 HydrophobicContact SD-CD1 4.44Å; L120-L188 HydrophobicContact CD1-CD1 3.62Å; W184-L188 HydrophobicContact CE3-CD1 3.83Å; W184-L188 HydrophobicContact CE3-CG 4.3Å; W184-L188 HydrophobicContact CZ3-CD1 3.62Å; W184-L188 PolarHBondContact O-N 3.04Å; P185-L188 PolarHBondContact O-N 2.9Å; L186-L188 VanDerWaalsContact C-N 3.31Å; L186-L188 PolarHBondContact O-N 3.27Å; L188-F190 PolarHBondContact O-N 2.94Å |
| 189 | G | 97.3 | Very high | 96.8 | Very high | 11 Ų | 11 | 43.1 Ų | 43.1 | 11% | 0.113 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -69.2 | -15.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | P185 L186 T191 I192 | P185-G189 PolarHBondContact O-N 2.63Å; L186-G189 CarbonylContact O-C 3.51Å; L186-G189 PolarHBondContact O-N 3.48Å; G189-T191 PolarHBondContact O-N 3.35Å; G189-I192 WeakPolarHBondContact O-CB 3.44Å; G189-I192 VanDerWaalsContact O-CG1 3.27Å; G189-I192 WeakPolarHBondContact O-CG1 3.47Å; G189-I192 PolarHBondContact O-N 2.84Å |
| 190 | F | 98.2 | Very high | 97.1 | Very high | 42 Ų | 42 | 45.7 Ų | 45.7 | 18% | 0.184 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -54.1 | -29 | 178.9 | 179.9 | -100.6 | 0 | 0 | 0 | 113.1 | F22 Y26 F172 L186 L188 I192 L193 P194 | F22-F190 HydrophobicContact CE1-CE1 4.1Å; F22-F190 HydrophobicContact CZ-CE1 4.24Å; Y26-F190 HydrophobicContact CD1-CD1 4.34Å; Y26-F190 HydrophobicContact CD2-CD1 4.09Å; Y26-F190 HydrophobicContact CD2-CE1 4.35Å; Y26-F190 HydrophobicContact CE1-CB 4.02Å; Y26-F190 AromaticContact CE1-CD1 3.84Å; Y26-F190 HydrophobicContact CE1-CD1 3.84Å; Y26-F190 HydrophobicContact CE1-CG 4.39Å; Y26-F190 AromaticContact CE2-CD1 3.53Å; Y26-F190 HydrophobicContact CE2-CD1 3.53Å; Y26-F190 HydrophobicContact CE2-CE1 4.03Å; Y26-F190 HydrophobicContact CE2-CG 4.36Å; Y26-F190 HydrophobicContact CG-CD1 4.47Å; Y26-F190 AromaticContact CZ-CD1 3.41Å; Y26-F190 VanDerWaalsContact CZ-CD1 3.41Å; Y26-F190 AromaticContact CZ-CG 3.91Å; Y26-F190 VanDerWaalsContact OH-CB 3.3Å; Y26-F190 WeakPolarHBondContact OH-CB 3.33Å; F172-F190 HydrophobicContact CD2-CD1 4.49Å; F172-F190 HydrophobicContact CD2-CD2 4.45Å; F172-F190 HydrophobicContact CD2-CG 4.43Å; F172-F190 HydrophobicContact CE2-CD1 4.26Å; F172-F190 AromaticContact CE2-CD2 3.93Å; F172-F190 HydrophobicContact CE2-CD2 3.93Å; F172-F190 AromaticContact CE2-CE1 3.97Å; F172-F190 HydrophobicContact CE2-CE1 3.97Å; F172-F190 AromaticContact CE2-CE2 3.64Å; F172-F190 HydrophobicContact CE2-CE2 3.64Å; F172-F190 HydrophobicContact CE2-CG 4.24Å; F172-F190 AromaticContact CE2-CZ 3.67Å; F172-F190 HydrophobicContact CE2-CZ 3.67Å; F172-F190 HydrophobicContact CZ-CE2 4.44Å; F172-F190 HydrophobicContact CZ-CZ 4.4Å; L186-F190 PolarHBondContact O-N 3.29Å; L188-F190 PolarHBondContact O-N 2.94Å; F190-I192 PolarHBondContact O-N 3.34Å; F190-L193 HydrophobicContact CD2-CD1 3.8Å; F190-L193 HydrophobicContact CE2-CB 4.45Å; F190-L193 HydrophobicContact CE2-CD1 3.73Å; F190-L193 PolarHBondContact O-N 3.03Å; F190-P194 HydrophobicContact CE1-CG 4.07Å; F190-P194 WeakPolarHBondContact O-CD 3.42Å |
| 191 | T | 97.9 | Very high | 97.3 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -19.8 | 175.9 | -164.9 | 0 | 0 | 0 | 0 | 113.6 | Q23 N27 M108 I127 G189 | Q23-T191 PolarHBondContact NE2-O 3.42Å; Q23-T191 PolarHBondContact OE1-OG1 3.15Å; N27-T191 PolarHBondContact ND2-OG1 2.84Å; M108-T191 HydrophobicContact CE-CG2 4.05Å; I127-T191 HydrophobicContact CD1-CG2 4.03Å; I127-T191 WeakPolarHBondContact CD1-OG1 3.33Å; I127-T191 HydrophobicContact CG1-CG2 4.45Å; G189-T191 PolarHBondContact O-N 3.35Å |
| 192 | I | 98.5 | Very high | 97.4 | Very high | 38 Ų | 38 | 41.2 Ų | 41.2 | 20% | 0.195 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.4 | -38.6 | 173.2 | -60.7 | 169 | 0 | 0 | 0 | 111.5 | V102 G189 F190 A195 I196 | V102-I192 HydrophobicContact CG2-CG2 4.46Å; G189-I192 WeakPolarHBondContact O-CB 3.44Å; G189-I192 VanDerWaalsContact O-CG1 3.27Å; G189-I192 WeakPolarHBondContact O-CG1 3.47Å; G189-I192 PolarHBondContact O-N 2.84Å; F190-I192 PolarHBondContact O-N 3.34Å; I192-A195 WeakPolarHBondContact O-CB 3.39Å; I192-A195 PolarHBondContact O-N 3.1Å; I192-I196 HydrophobicContact CG2-CD1 3.64Å; I192-I196 HydrophobicContact CG2-CG1 4.16Å; I192-I196 WeakPolarHBondContact O-CG1 3.27Å; I192-I196 PolarHBondContact O-N 3.04Å |
| 193 | L | 98.1 | Very high | 97.6 | Very high | 107 Ų | 107 | 37 Ų | 37 | 56% | 0.56 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -65.5 | -50.7 | -173.4 | -66.8 | 177.6 | 0 | 0 | 0 | 112.7 | F190 A195 I196 L197 | F190-L193 HydrophobicContact CD2-CD1 3.8Å; F190-L193 HydrophobicContact CE2-CB 4.45Å; F190-L193 HydrophobicContact CE2-CD1 3.73Å; F190-L193 PolarHBondContact O-N 3.03Å; L193-A195 PolarHBondContact O-N 3.32Å; L193-I196 PolarHBondContact O-N 3.34Å; L193-L197 PolarHBondContact O-N 2.86Å |
| 194 | P | 97.8 | Very high | 97.5 | Very high | 12 Ų | 12 | 40.9 Ų | 40.9 | 8% | 0.078 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.7 | -29.2 | 175.2 | -12.9 | 24.4 | 0 | 0 | 0 | 112.5 | I19 F22 Q23 F190 L197 Q198 | I19-P194 HydrophobicContact CG2-CB 3.63Å; I19-P194 WeakPolarHBondContact CG2-O 3.27Å; F22-P194 HydrophobicContact CD1-CB 4.4Å; F22-P194 HydrophobicContact CD1-CG 4.18Å; F22-P194 HydrophobicContact CE1-CG 3.89Å; Q23-P194 HydrophobicContact CG-CB 4.14Å; F190-P194 HydrophobicContact CE1-CG 4.07Å; F190-P194 WeakPolarHBondContact O-CD 3.42Å; P194-L197 PolarHBondContact O-N 3.2Å; P194-Q198 VanDerWaalsContact O-CB 3.26Å; P194-Q198 WeakPolarHBondContact O-CB 3.44Å; P194-Q198 PolarHBondContact O-N 3.44Å |
| 195 | A | 97.9 | Very high | 97.5 | Very high | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -67.3 | -41.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q23 N98 A101 V102 I192 L193 S199 | Q23-A195 VanDerWaalsContact NE2-N 3.19Å; N98-A195 HydrophobicContact CB-CB 4.45Å; A101-A195 HydrophobicContact CB-CB 3.7Å; V102-A195 HydrophobicContact CG2-CB 4.18Å; I192-A195 WeakPolarHBondContact O-CB 3.39Å; I192-A195 PolarHBondContact O-N 3.1Å; L193-A195 PolarHBondContact O-N 3.32Å; A195-S199 VanDerWaalsContact O-CB 3.31Å; A195-S199 WeakPolarHBondContact O-CB 3.48Å; A195-S199 PolarHBondContact O-N 3.38Å; A195-S199 PolarHBondContact O-OG 2.88Å |
| 196 | I | 98.1 | Very high | 97.5 | Very high | 97 Ų | 97 | 41.4 Ų | 41.4 | 50% | 0.497 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -65 | -46.3 | 174 | -67.5 | 171.2 | 0 | 0 | 0 | 110 | I192 L193 Q198 S199 A200 | I192-I196 HydrophobicContact CG2-CD1 3.64Å; I192-I196 HydrophobicContact CG2-CG1 4.16Å; I192-I196 WeakPolarHBondContact O-CG1 3.27Å; I192-I196 PolarHBondContact O-N 3.04Å; L193-I196 PolarHBondContact O-N 3.34Å; I196-Q198 PolarHBondContact O-N 2.89Å; I196-S199 PolarHBondContact O-N 3.24Å; I196-A200 PolarHBondContact O-N 3.31Å |
| 197 | L | 98 | Very high | 97.4 | Very high | 98 Ų | 98 | 37.1 Ų | 37.1 | 51% | 0.513 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -58.9 | -46.6 | 177.8 | 177.9 | 63.3 | 0 | 0 | 0 | 111.6 | I19 L193 P194 S199 A200 T201 | I19-L197 HydrophobicContact CD1-CD2 4.28Å; I19-L197 HydrophobicContact CD1-CG 4.29Å; L193-L197 PolarHBondContact O-N 2.86Å; P194-L197 PolarHBondContact O-N 3.2Å; L197-S199 VanDerWaalsContact C-N 3.34Å; L197-A200 PolarHBondContact O-N 3.03Å; L197-T201 HydrophobicContact CD1-CG2 4.23Å; L197-T201 WeakPolarHBondContact O-CB 3.39Å; L197-T201 WeakPolarHBondContact O-CG2 3.47Å; L197-T201 PolarHBondContact O-N 2.98Å; L197-T201 PolarHBondContact O-OG1 2.75Å |
| 198 | Q | 97.8 | Very high | 97.3 | Very high | 2 Ų | 2 | 37.1 Ų | 37.1 | 1% | 0.009 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.5 | -40.1 | 177.5 | -165.8 | -178.6 | 43.7 | 0 | 0 | 111.3 | V16 I19 N98 P194 I196 A200 T201 L202 | V16-Q198 HydrophobicContact CG1-CG 4.18Å; V16-Q198 PolarHBondContact O-NE2 3.06Å; I19-Q198 HydrophobicContact CB-CB 4.2Å; I19-Q198 HydrophobicContact CB-CG 4.17Å; I19-Q198 HydrophobicContact CD1-CB 4.02Å; I19-Q198 HydrophobicContact CD1-CG 4.27Å; I19-Q198 HydrophobicContact CG2-CB 3.92Å; I19-Q198 HydrophobicContact CG2-CG 4.38Å; N98-Q198 PolarHBondContact ND2-OE1 2.96Å; N98-Q198 PolarHBondContact OD1-OE1 2.92Å; P194-Q198 VanDerWaalsContact O-CB 3.26Å; P194-Q198 WeakPolarHBondContact O-CB 3.44Å; P194-Q198 PolarHBondContact O-N 3.44Å; I196-Q198 PolarHBondContact O-N 2.89Å; Q198-A200 VanDerWaalsContact C-N 3.33Å; Q198-A200 PolarHBondContact O-N 2.84Å; Q198-T201 WeakPolarHBondContact CA-OG1 3.29Å; Q198-T201 PolarHBondContact O-N 3.28Å; Q198-T201 PolarHBondContact O-OG1 3.25Å; Q198-L202 HydrophobicContact CG-CD1 3.69Å; Q198-L202 HydrophobicContact CG-CG 3.86Å; Q198-L202 VanDerWaalsContact O-CB 3.29Å; Q198-L202 WeakPolarHBondContact O-CB 3.49Å; Q198-L202 VanDerWaalsContact O-CG 3.27Å; Q198-L202 WeakPolarHBondContact O-CG 3.4Å; Q198-L202 PolarHBondContact O-N 2.88Å |
| 199 | S | 98 | Very high | 97.1 | Very high | 37 Ų | 37 | 37.1 Ų | 37.1 | 26% | 0.259 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -65 | -36.6 | 177.5 | -59.4 | 0 | 0 | 0 | 0 | 112.7 | N98 A195 I196 L197 P203 | N98-S199 WeakPolarHBondContact CB-OG 3.44Å; N98-S199 PolarHBondContact ND2-OG 3.3Å; A195-S199 VanDerWaalsContact O-CB 3.31Å; A195-S199 WeakPolarHBondContact O-CB 3.48Å; A195-S199 PolarHBondContact O-N 3.38Å; A195-S199 PolarHBondContact O-OG 2.88Å; I196-S199 PolarHBondContact O-N 3.24Å; L197-S199 VanDerWaalsContact C-N 3.34Å; S199-P203 WeakPolarHBondContact O-CD 3.43Å |
| 200 | A | 97.9 | Very high | 96.7 | Very high | 58 Ų | 58 | 36.9 Ų | 36.9 | 48% | 0.479 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -71 | -32.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | I196 L197 Q198 F204 | I196-A200 PolarHBondContact O-N 3.31Å; L197-A200 PolarHBondContact O-N 3.03Å; Q198-A200 VanDerWaalsContact C-N 3.33Å; Q198-A200 PolarHBondContact O-N 2.84Å; A200-F204 WeakPolarHBondContact O-CD2 3.37Å; A200-F204 WeakPolarHBondContact O-CE2 3.44Å |
| 201 | T | 97.2 | Very high | 96.3 | Very high | 26 Ų | 26 | 35.1 Ų | 35.1 | 16% | 0.16 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -93.8 | -29.8 | -172.7 | 50.7 | 0 | 0 | 0 | 0 | 114.3 | F12 V16 L197 Q198 P203 F204 | F12-T201 HydrophobicContact CZ-CG2 4.32Å; V16-T201 WeakPolarHBondContact CG1-OG1 3.34Å; L197-T201 HydrophobicContact CD1-CG2 4.23Å; L197-T201 WeakPolarHBondContact O-CB 3.39Å; L197-T201 WeakPolarHBondContact O-CG2 3.47Å; L197-T201 PolarHBondContact O-N 2.98Å; L197-T201 PolarHBondContact O-OG1 2.75Å; Q198-T201 WeakPolarHBondContact CA-OG1 3.29Å; Q198-T201 PolarHBondContact O-N 3.28Å; Q198-T201 PolarHBondContact O-OG1 3.25Å; T201-P203 VanDerWaalsContact C-CD 3.47Å; T201-F204 PolarHBondContact O-N 3.06Å; T201-F204 VanDerWaalsContact O-N 3.11Å |
| 202 | L | 96.4 | Very high | 96 | Very high | 1 Ų | 1 | 36 Ų | 36 | 1% | 0.005 | 20% | 0.2 | C | C | . | . | G | 310 helix | trans | -57.1 | -38 | 179.4 | -85.4 | 171.6 | 0 | 0 | 0 | 114.9 | V16 R91 M94 L95 Q198 F204 C205 | V16-L202 HydrophobicContact CG1-CD2 3.81Å; V16-L202 HydrophobicContact CG1-CG 3.85Å; R91-L202 WeakPolarHBondContact CD-O 3.13Å; R91-L202 HydrophobicContact CG-CD2 4.04Å; M94-L202 HydrophobicContact CB-CD1 3.83Å; M94-L202 HydrophobicContact CB-CD2 4.38Å; M94-L202 HydrophobicContact CE-CD2 4.02Å; L95-L202 HydrophobicContact CB-CD1 3.93Å; L95-L202 HydrophobicContact CD1-CB 4.34Å; L95-L202 HydrophobicContact CD1-CD1 4.36Å; Q198-L202 HydrophobicContact CG-CD1 3.69Å; Q198-L202 HydrophobicContact CG-CG 3.86Å; Q198-L202 VanDerWaalsContact O-CB 3.29Å; Q198-L202 WeakPolarHBondContact O-CB 3.49Å; Q198-L202 VanDerWaalsContact O-CG 3.27Å; Q198-L202 WeakPolarHBondContact O-CG 3.4Å; Q198-L202 PolarHBondContact O-N 2.88Å; L202-F204 PolarHBondContact O-N 3.45Å; L202-F204 VanDerWaalsContact O-N 3.14Å; L202-C205 WeakPolarHBondContact O-CB 3.25Å; L202-C205 PolarHBondContact O-N 2.86Å |
| 203 | P | 97.3 | Very high | 95.7 | Very high | 68 Ų | 68 | 34.6 Ų | 34.6 | 44% | 0.442 | 19% | 0.193 | S | C | . | . | G | 310 helix | trans | -58.1 | -26.3 | 176.3 | -28.2 | 36.8 | 0 | 0 | 0 | 114.1 | L95 S199 T201 | L95-P203 HydrophobicContact CD2-CG 4.5Å; S199-P203 WeakPolarHBondContact O-CD 3.43Å; T201-P203 VanDerWaalsContact C-CD 3.47Å |
| 204 | F | 96.5 | Very high | 95.1 | Very high | 143 Ų | 143 | 29.6 Ų | 29.6 | 63% | 0.627 | 17% | 0.166 | S | C | * | . | G | 310 helix | trans | -85.7 | -10.8 | 177 | -54.6 | -73.2 | 0 | 0 | 0 | 113.3 | F12 A200 T201 L202 | F12-F204 HydrophobicContact CE1-CB 4.09Å; F12-F204 HydrophobicContact CZ-CB 4.49Å; A200-F204 WeakPolarHBondContact O-CD2 3.37Å; A200-F204 WeakPolarHBondContact O-CE2 3.44Å; T201-F204 PolarHBondContact O-N 3.06Å; T201-F204 VanDerWaalsContact O-N 3.11Å; L202-F204 PolarHBondContact O-N 3.45Å; L202-F204 VanDerWaalsContact O-N 3.14Å |
| 205 | C | 96.8 | Very high | 94.4 | Very high | 3 Ų | 3 | 31.6 Ų | 31.6 | 2% | 0.02 | 18% | 0.177 | C | C | . | . | S | Bend | trans | -82.8 | 145.4 | 174.9 | -61.8 | 0 | 0 | 0 | 0 | 110.7 | R91 L202 | R91-C205 WeakPolarHBondContact CD-O 3.47Å; R91-C205 PolarHBondContact NH1-O 3.36Å; R91-C205 VanDerWaalsContact NH1-O 3.14Å; L202-C205 WeakPolarHBondContact O-CB 3.25Å; L202-C205 PolarHBondContact O-N 2.86Å |
| 206 | P | 96.1 | Very high | 93.9 | Very high | 23 Ų | 23 | 37.7 Ų | 37.7 | 15% | 0.149 | 20% | 0.2 | C | C | . | . | P | Polyproline II helix | trans | -69.8 | 152.3 | 175 | 28.4 | -31.3 | 0 | 0 | 0 | 111.1 | A13 Y141 I225 L229 | A13-P206 HydrophobicContact CB-CG 4.46Å; Y141-P206 WeakPolarHBondContact CE2-O 3.47Å; Y141-P206 PolarHBondContact OH-O 2.79Å; P206-I225 HydrophobicContact CB-CD1 4.04Å; P206-I225 HydrophobicContact CB-CG1 4.27Å; P206-I225 HydrophobicContact CB-CG2 3.51Å; P206-I225 HydrophobicContact CG-CG2 4.11Å; P206-L229 HydrophobicContact CG-CD1 4.09Å; P206-L229 HydrophobicContact CG-CD2 3.87Å; P206-L229 HydrophobicContact CG-CG 4.2Å |
| 207 | E | 96.6 | Very high | 93.5 | Very high | 13 Ų | 13 | 39.1 Ų | 39.1 | 6% | 0.061 | 20% | 0.202 | C | C | . | . | P | Polyproline II helix | trans | -72 | 158.9 | 162.8 | -172.7 | 54.6 | -87.5 | 0 | 0 | 109.6 | G89 R90 R91 N92 P209 F211 L212 | G89-E207 WeakPolarHBondContact CA-OE2 3.27Å; R90-E207 PolarHBondContact N-OE1 2.99Å; R90-E207 PolarHBondContact N-OE2 3.19Å; R91-E207 WeakPolarHBondContact CB-OE2 3.48Å; R91-E207 PolarHBondContact N-OE1 3.44Å; R91-E207 PolarHBondContact N-OE2 3.37Å; N92-E207 PolarHBondContact N-OE2 3.03Å; E207-P209 WeakPolarHBondContact O-CD 3.37Å; E207-F211 HydrophobicContact CG-CD1 3.74Å; E207-F211 HydrophobicContact CG-CE1 4.37Å; E207-L212 HydrophobicContact CB-CD1 4.48Å; E207-L212 HydrophobicContact CB-CD2 4.42Å; E207-L212 HydrophobicContact CB-CG 4.43Å; E207-L212 HydrophobicContact CG-CD2 4.2Å; E207-L212 HydrophobicContact CG-CG 4.37Å |
| 208 | S | 94.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 19% | 0.194 | C | C | . | . | P | Polyproline II helix | trans | -55.6 | 122.5 | 177.4 | 163.5 | 0 | 0 | 0 | 0 | 111.6 | E144 R210 F211 L212 | E144-S208 WeakPolarHBondContact CB-OG 3.44Å; E144-S208 WeakPolarHBondContact OE2-CB 3.39Å; E144-S208 PolarHBondContact OE2-OG 2.87Å; S208-R210 PolarHBondContact O-N 3.21Å; S208-R210 PolarHBondContact OG-N 3.44Å; S208-F211 WeakPolarHBondContact O-CB 3.01Å; S208-F211 PolarHBondContact O-N 3.39Å; S208-F211 VanDerWaalsContact O-N 3.11Å; S208-F211 PolarHBondContact OG-N 2.93Å; S208-F211 VanDerWaalsContact OG-N 3.1Å; S208-L212 PolarHBondContact O-N 3.46Å |
| 209 | P | 92.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.4 | -38 | 175.2 | -24 | 33.1 | 0 | 0 | 0 | 112.3 | E207 L212 L213 A222 I225 L226 L229 | E207-P209 WeakPolarHBondContact O-CD 3.37Å; P209-L212 PolarHBondContact O-N 3.35Å; P209-L213 WeakPolarHBondContact O-CB 3.33Å; P209-L213 PolarHBondContact O-N 3.3Å; P209-A222 HydrophobicContact CB-CB 4.27Å; P209-A222 WeakPolarHBondContact O-CB 3.45Å; P209-I225 HydrophobicContact CG-CB 4.26Å; P209-I225 HydrophobicContact CG-CG2 3.66Å; P209-L226 HydrophobicContact CB-CD2 4.03Å; P209-L226 HydrophobicContact CB-CG 3.9Å; P209-L226 HydrophobicContact CG-CD2 3.9Å; P209-L226 HydrophobicContact CG-CG 4.12Å; P209-L229 HydrophobicContact CG-CD1 4.35Å |
| 210 | R | 88.9 | Confident | 92.9 | Very high | 6 Ų | 6 | 44.7 Ų | 44.7 | 2% | 0.023 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.7 | -42.4 | 175.9 | -68.6 | -161.7 | -178.4 | -115.3 | -2.2 | 111.1 | E144 S208 I214 E241 M242 E245 Q395 | E144-R210 HydrophobicContact CB-CB 4.3Å; E144-R210 HydrophobicContact CB-CG 4.45Å; E144-R210 HydrophobicContact CG-CB 4.25Å; S208-R210 PolarHBondContact O-N 3.21Å; S208-R210 PolarHBondContact OG-N 3.44Å; R210-I214 HydrophobicContact CB-CD1 4.13Å; R210-I214 WeakPolarHBondContact O-CB 3.48Å; R210-I214 VanDerWaalsContact O-CG1 3.26Å; R210-I214 WeakPolarHBondContact O-CG1 3.37Å; R210-I214 PolarHBondContact O-N 2.82Å; R210-E241 IonicContact CZ-OE1 3.73Å; R210-E241 IonicContact NH1-OE1 2.78Å; R210-E241 PolarHBondContact NH1-OE1 3.3Å; R210-E241 IonicContact NH2-OE1 2.65Å; R210-E241 PolarHBondContact NH2-OE1 3.22Å; R210-M242 HydrophobicContact CG-CE 3.7Å; R210-M242 HydrophobicContact CG-CG 4.06Å; R210-M242 HydrophobicContact CG-SD 3.78Å; R210-E245 IonicContact CZ-OE2 3.17Å; R210-E245 IonicContact NH1-OE1 3.53Å; R210-E245 IonicContact NH1-OE2 2.82Å; R210-E245 PolarHBondContact NH1-OE2 3.43Å; R210-Q395 VanDerWaalsContact CD-NE2 3.35Å |
| 211 | F | 89.7 | Confident | 92.7 | Very high | 5 Ų | 5 | 45.3 Ų | 45.3 | 2% | 0.022 | 22% | 0.217 | C | C | . | . | I | π-helix | trans | -62.2 | -45 | 174.8 | 176.6 | -106.6 | 0 | 0 | 0 | 112.2 | E207 S208 N215 R216 | E207-F211 HydrophobicContact CG-CD1 3.74Å; E207-F211 HydrophobicContact CG-CE1 4.37Å; S208-F211 WeakPolarHBondContact O-CB 3.01Å; S208-F211 PolarHBondContact O-N 3.39Å; S208-F211 VanDerWaalsContact O-N 3.11Å; S208-F211 PolarHBondContact OG-N 2.93Å; S208-F211 VanDerWaalsContact OG-N 3.1Å; F211-N215 HydrophobicContact CD2-CB 3.52Å; F211-N215 HydrophobicContact CE2-CB 3.6Å; F211-N215 HydrophobicContact CG-CB 4.36Å; F211-N215 HydrophobicContact CZ-CB 4.46Å; F211-N215 WeakPolarHBondContact O-CA 3.3Å; F211-N215 VanDerWaalsContact O-CB 3.27Å; F211-N215 WeakPolarHBondContact O-CB 3.1Å; F211-N215 PolarHBondContact O-N 3.27Å; F211-R216 HydrophobicContact CD1-CG 4.39Å; F211-R216 HydrophobicContact CE1-CG 3.88Å; F211-R216 HydrophobicContact CZ-CG 4.17Å; F211-R216 PolarHBondContact O-N 3.04Å; F211-R216 VanDerWaalsContact O-N 3.14Å |
| 212 | L | 92.6 | Very high | 92.6 | Very high | 20 Ų | 20 | 44.1 Ų | 44.1 | 11% | 0.105 | 21% | 0.209 | C | C | . | . | I | π-helix | trans | -63.2 | -47.9 | 179.7 | -67.3 | -178.5 | 0 | 0 | 0 | 111.9 | E207 S208 P209 R216 K217 E218 N221 A222 I225 | E207-L212 HydrophobicContact CB-CD1 4.48Å; E207-L212 HydrophobicContact CB-CD2 4.42Å; E207-L212 HydrophobicContact CB-CG 4.43Å; E207-L212 HydrophobicContact CG-CD2 4.2Å; E207-L212 HydrophobicContact CG-CG 4.37Å; S208-L212 PolarHBondContact O-N 3.46Å; P209-L212 PolarHBondContact O-N 3.35Å; L212-R216 CarbonylContact O-C 3.58Å; L212-R216 WeakPolarHBondContact O-CA 3.43Å; L212-R216 VanDerWaalsContact O-CB 3.31Å; L212-R216 WeakPolarHBondContact O-CB 3.34Å; L212-R216 PolarHBondContact O-N 2.84Å; L212-K217 PolarHBondContact O-N 3.19Å; L212-E218 HydrophobicContact CB-CB 4.37Å; L212-E218 PolarHBondContact O-N 2.95Å; L212-N221 HydrophobicContact CD1-CB 4.16Å; L212-A222 HydrophobicContact CB-CB 4.28Å; L212-I225 HydrophobicContact CD1-CD1 3.4Å; L212-I225 VanDerWaalsContact CD1-CD1 3.4Å |
| 213 | L | 91.2 | Very high | 92.5 | Very high | 7 Ų | 7 | 47.4 Ų | 47.4 | 4% | 0.037 | 22% | 0.224 | C | C | . | . | I | π-helix | trans | -70.4 | -46.7 | -179 | -169.5 | 155.7 | 0 | 0 | 0 | 112 | P209 K217 E219 A222 I239 M242 K243 | P209-L213 WeakPolarHBondContact O-CB 3.33Å; P209-L213 PolarHBondContact O-N 3.3Å; L213-K217 VanDerWaalsContact O-CA 3.25Å; L213-K217 WeakPolarHBondContact O-CA 3.45Å; L213-K217 PolarHBondContact O-N 3.04Å; L213-E219 HydrophobicContact CD1-CG 4.47Å; L213-A222 HydrophobicContact CB-CB 3.8Å; L213-A222 HydrophobicContact CD1-CB 4.32Å; L213-I239 HydrophobicContact CD1-CD1 3.77Å; L213-I239 HydrophobicContact CD1-CG2 4.27Å; L213-M242 HydrophobicContact CD1-CB 3.8Å; L213-M242 HydrophobicContact CD1-SD 4.39Å; L213-M242 HydrophobicContact CD2-CB 3.96Å; L213-M242 WeakPolarHBondContact CD2-O 3.33Å; L213-M242 HydrophobicContact CG-CB 4.39Å; L213-K243 HydrophobicContact CD2-CG 4.35Å |
| 214 | I | 85.3 | Confident | 92.4 | Very high | 2 Ų | 2 | 49.8 Ų | 49.8 | 1% | 0.01 | 23% | 0.229 | C | C | . | . | I | π-helix | trans | -84.8 | -50.4 | -169 | -59 | 170.1 | 0 | 0 | 0 | 111.3 | R210 K217 E245 M249 Q395 | R210-I214 HydrophobicContact CB-CD1 4.13Å; R210-I214 WeakPolarHBondContact O-CB 3.48Å; R210-I214 VanDerWaalsContact O-CG1 3.26Å; R210-I214 WeakPolarHBondContact O-CG1 3.37Å; R210-I214 PolarHBondContact O-N 2.82Å; I214-K217 WeakPolarHBondContact O-CE 3.39Å; I214-K217 PolarHBondContact O-NZ 3.48Å; I214-E245 HydrophobicContact CD1-CB 4.35Å; I214-E245 HydrophobicContact CD1-CG 3.98Å; I214-E245 WeakPolarHBondContact CD1-OE2 3.39Å; I214-M249 HydrophobicContact CG2-CB 4.4Å; I214-M249 HydrophobicContact CG2-CE 3.51Å; I214-M249 HydrophobicContact CG2-SD 3.43Å; I214-M249 WeakPolarHBondContact CG2-SD 3.45Å; I214-Q395 HydrophobicContact CD1-CG 4.25Å |
| 215 | N | 83.9 | Confident | 92.3 | Very high | 54 Ų | 54 | 44.3 Ų | 44.3 | 29% | 0.289 | 21% | 0.206 | S | C | . | . | I | π-helix | trans | -86.6 | -35.1 | -174.9 | -60.6 | 81.8 | 0 | 0 | 0 | 112.5 | F211 | F211-N215 HydrophobicContact CD2-CB 3.52Å; F211-N215 HydrophobicContact CE2-CB 3.6Å; F211-N215 HydrophobicContact CG-CB 4.36Å; F211-N215 HydrophobicContact CZ-CB 4.46Å; F211-N215 WeakPolarHBondContact O-CA 3.3Å; F211-N215 VanDerWaalsContact O-CB 3.27Å; F211-N215 WeakPolarHBondContact O-CB 3.1Å; F211-N215 PolarHBondContact O-N 3.27Å |
| 216 | R | 87.8 | Confident | 92.2 | Very high | 129 Ų | 129 | 44.2 Ų | 44.2 | 49% | 0.487 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -100.5 | -11.6 | -178.9 | -63.8 | -73.6 | -178.7 | 169.5 | -2.6 | 114.4 | R87 F211 L212 E218 | R87-R216 PolarHBondContact O-NH2 3.17Å; F211-R216 HydrophobicContact CD1-CG 4.39Å; F211-R216 HydrophobicContact CE1-CG 3.88Å; F211-R216 HydrophobicContact CZ-CG 4.17Å; F211-R216 PolarHBondContact O-N 3.04Å; F211-R216 VanDerWaalsContact O-N 3.14Å; L212-R216 CarbonylContact O-C 3.58Å; L212-R216 WeakPolarHBondContact O-CA 3.43Å; L212-R216 VanDerWaalsContact O-CB 3.31Å; L212-R216 WeakPolarHBondContact O-CB 3.34Å; L212-R216 PolarHBondContact O-N 2.84Å; R216-E218 HydrophobicContact CB-CB 4.49Å; R216-E218 HydrophobicContact CB-CG 3.95Å; R216-E218 PolarHBondContact O-N 3.36Å |
| 217 | K | 89.3 | Confident | 92 | Very high | 127 Ų | 127 | 45 Ų | 45 | 55% | 0.552 | 21% | 0.207 | S | C | * | . | trans | 60.3 | 29.2 | -176.2 | -50.6 | -56 | -172.9 | -160.3 | 0 | 113.3 | L212 L213 I214 E219 S246 | L212-K217 PolarHBondContact O-N 3.19Å; L213-K217 VanDerWaalsContact O-CA 3.25Å; L213-K217 WeakPolarHBondContact O-CA 3.45Å; L213-K217 PolarHBondContact O-N 3.04Å; I214-K217 WeakPolarHBondContact O-CE 3.39Å; I214-K217 PolarHBondContact O-NZ 3.48Å; K217-E219 PolarHBondContact O-N 3.14Å; K217-S246 PolarHBondContact NZ-OG 3.43Å | ||
| 218 | E | 93.5 | Very high | 91.9 | Very high | 73 Ų | 73 | 52.6 Ų | 52.6 | 34% | 0.341 | 24% | 0.235 | S | C | . | . | trans | -98.9 | 75.9 | -179.6 | -66.3 | 177 | -153.2 | 0 | 0 | 111.2 | L212 R216 N221 A222 | L212-E218 HydrophobicContact CB-CB 4.37Å; L212-E218 PolarHBondContact O-N 2.95Å; R216-E218 HydrophobicContact CB-CB 4.49Å; R216-E218 HydrophobicContact CB-CG 3.95Å; R216-E218 PolarHBondContact O-N 3.36Å; E218-N221 HydrophobicContact CB-CB 4.17Å; E218-N221 PolarHBondContact OE2-ND2 2.68Å; E218-A222 PolarHBondContact O-N 3.13Å; E218-A222 VanDerWaalsContact O-N 3.16Å | ||
| 219 | E | 93.3 | Very high | 91.9 | Very high | 73 Ų | 73 | 52.7 Ų | 52.7 | 34% | 0.341 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.4 | -49.1 | -175.2 | -177.6 | -179.4 | 157.2 | 0 | 0 | 113.5 | L213 K217 N221 A222 K223 I239 K243 | L213-E219 HydrophobicContact CD1-CG 4.47Å; K217-E219 PolarHBondContact O-N 3.14Å; E219-N221 VanDerWaalsContact C-N 3.32Å; E219-N221 PolarHBondContact O-N 2.97Å; E219-A222 WeakPolarHBondContact O-CB 3.45Å; E219-A222 PolarHBondContact O-N 2.81Å; E219-K223 PolarHBondContact O-N 3.03Å; E219-I239 HydrophobicContact CG-CG2 4.38Å; E219-K243 WeakPolarHBondContact OE1-CE 3.46Å; E219-K243 IonicContact OE1-NZ 3.4Å; E219-K243 PolarHBondContact OE1-NZ 3.16Å; E219-K243 WeakPolarHBondContact OE2-CE 3.46Å; E219-K243 IonicContact OE2-NZ 3.56Å; E219-K243 PolarHBondContact OE2-NZ 3.36Å |
| 220 | E | 93.8 | Very high | 91.9 | Very high | 107 Ų | 107 | 52.9 Ų | 52.9 | 50% | 0.5 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.9 | -38.4 | -176.4 | -74.3 | -59.4 | 158.6 | 0 | 0 | 112.1 | K223 Q224 | E220-K223 PolarHBondContact O-N 3Å; E220-Q224 WeakPolarHBondContact O-CG 3.44Å; E220-Q224 PolarHBondContact O-N 3.47Å |
| 221 | N | 94.8 | Very high | 92 | Very high | 72 Ų | 72 | 54.6 Ų | 54.6 | 39% | 0.385 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -65.1 | -43.4 | 175.8 | -67.2 | -18.5 | 0 | 0 | 0 | 111 | L212 E218 E219 K223 Q224 I225 | L212-N221 HydrophobicContact CD1-CB 4.16Å; E218-N221 HydrophobicContact CB-CB 4.17Å; E218-N221 PolarHBondContact OE2-ND2 2.68Å; E219-N221 VanDerWaalsContact C-N 3.32Å; E219-N221 PolarHBondContact O-N 2.97Å; N221-K223 VanDerWaalsContact C-N 3.33Å; N221-K223 PolarHBondContact O-N 3.33Å; N221-Q224 PolarHBondContact O-N 3.3Å; N221-I225 WeakPolarHBondContact O-CG1 3.24Å; N221-I225 PolarHBondContact O-N 2.85Å |
| 222 | A | 94.3 | Very high | 92 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | P209 L212 L213 E218 E219 I225 L226 I239 | P209-A222 HydrophobicContact CB-CB 4.27Å; P209-A222 WeakPolarHBondContact O-CB 3.45Å; L212-A222 HydrophobicContact CB-CB 4.28Å; L213-A222 HydrophobicContact CB-CB 3.8Å; L213-A222 HydrophobicContact CD1-CB 4.32Å; E218-A222 PolarHBondContact O-N 3.13Å; E218-A222 VanDerWaalsContact O-N 3.16Å; E219-A222 WeakPolarHBondContact O-CB 3.45Å; E219-A222 PolarHBondContact O-N 2.81Å; A222-I225 PolarHBondContact O-N 3.23Å; A222-L226 WeakPolarHBondContact O-CG 3.41Å; A222-L226 PolarHBondContact O-N 3.06Å; A222-I239 HydrophobicContact CB-CD1 4.42Å |
| 223 | K | 94.3 | Very high | 91.8 | Very high | 70 Ų | 70 | 61.2 Ų | 61.2 | 30% | 0.304 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.8 | -48.8 | 176.6 | -176.9 | -177.4 | 176.1 | -175.5 | 0 | 112 | E219 E220 N221 I225 L226 Q227 V235 I239 | E219-K223 PolarHBondContact O-N 3.03Å; E220-K223 PolarHBondContact O-N 3Å; N221-K223 VanDerWaalsContact C-N 3.33Å; N221-K223 PolarHBondContact O-N 3.33Å; K223-I225 VanDerWaalsContact C-N 3.3Å; K223-I225 PolarHBondContact O-N 3.01Å; K223-L226 PolarHBondContact O-N 3.49Å; K223-Q227 VanDerWaalsContact O-CG 3.29Å; K223-Q227 WeakPolarHBondContact O-CG 3.41Å; K223-Q227 PolarHBondContact O-N 3.41Å; K223-V235 HydrophobicContact CG-CG2 3.91Å; K223-I239 HydrophobicContact CB-CD1 4.05Å; K223-I239 HydrophobicContact CB-CG1 4.36Å |
| 224 | Q | 94.7 | Very high | 91.7 | Very high | 118 Ų | 118 | 65 Ų | 65 | 55% | 0.551 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -60.4 | -40.2 | 178.2 | -71.3 | 176.4 | 16.6 | 0 | 0 | 112.2 | E220 N221 R228 | E220-Q224 WeakPolarHBondContact O-CG 3.44Å; E220-Q224 PolarHBondContact O-N 3.47Å; N221-Q224 PolarHBondContact O-N 3.3Å; Q224-R228 WeakPolarHBondContact O-CB 3.49Å; Q224-R228 PolarHBondContact O-N 3.41Å; Q224-R228 VanDerWaalsContact O-N 3.09Å |
| 225 | I | 95.4 | Very high | 91.9 | Very high | 29 Ų | 29 | 65 Ų | 65 | 15% | 0.149 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.3 | -45.8 | 176.6 | -67.2 | 176.9 | 0 | 0 | 0 | 110.9 | P206 P209 L212 N221 A222 K223 Q227 R228 L229 | P206-I225 HydrophobicContact CB-CD1 4.04Å; P206-I225 HydrophobicContact CB-CG1 4.27Å; P206-I225 HydrophobicContact CB-CG2 3.51Å; P206-I225 HydrophobicContact CG-CG2 4.11Å; P209-I225 HydrophobicContact CG-CB 4.26Å; P209-I225 HydrophobicContact CG-CG2 3.66Å; L212-I225 HydrophobicContact CD1-CD1 3.4Å; L212-I225 VanDerWaalsContact CD1-CD1 3.4Å; N221-I225 WeakPolarHBondContact O-CG1 3.24Å; N221-I225 PolarHBondContact O-N 2.85Å; A222-I225 PolarHBondContact O-N 3.23Å; K223-I225 VanDerWaalsContact C-N 3.3Å; K223-I225 PolarHBondContact O-N 3.01Å; I225-Q227 VanDerWaalsContact C-N 3.35Å; I225-Q227 PolarHBondContact O-N 3.14Å; I225-R228 PolarHBondContact O-N 2.82Å; I225-L229 HydrophobicContact CG2-CD1 3.64Å; I225-L229 HydrophobicContact CG2-CG 4.02Å; I225-L229 WeakPolarHBondContact O-CB 3.35Å; I225-L229 WeakPolarHBondContact O-CG 3.4Å; I225-L229 PolarHBondContact O-N 2.96Å |
| 226 | L | 93.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 66 Ų | 66 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.5 | -45.3 | 177.8 | -77.8 | 179.1 | 0 | 0 | 0 | 112.1 | P209 A222 K223 R228 L229 W230 V235 D238 I239 M242 | P209-L226 HydrophobicContact CB-CD2 4.03Å; P209-L226 HydrophobicContact CB-CG 3.9Å; P209-L226 HydrophobicContact CG-CD2 3.9Å; P209-L226 HydrophobicContact CG-CG 4.12Å; A222-L226 WeakPolarHBondContact O-CG 3.41Å; A222-L226 PolarHBondContact O-N 3.06Å; K223-L226 PolarHBondContact O-N 3.49Å; L226-R228 VanDerWaalsContact C-N 3.28Å; L226-R228 PolarHBondContact O-N 2.86Å; L226-L229 PolarHBondContact O-N 3.48Å; L226-W230 HydrophobicContact CD1-CH2 4.49Å; L226-W230 HydrophobicContact CD1-CZ3 4.38Å; L226-W230 HydrophobicContact CD2-CD2 4.08Å; L226-W230 HydrophobicContact CD2-CE3 4.09Å; L226-W230 HydrophobicContact CD2-CH2 3.5Å; L226-W230 HydrophobicContact CD2-CZ2 3.46Å; L226-W230 VanDerWaalsContact CD2-CZ2 3.46Å; L226-W230 HydrophobicContact CD2-CZ3 3.78Å; L226-W230 PolarHBondContact O-N 3.38Å; L226-V235 HydrophobicContact CB-CB 4.19Å; L226-V235 HydrophobicContact CB-CG1 4.01Å; L226-V235 HydrophobicContact CB-CG2 4.27Å; L226-V235 HydrophobicContact CD1-CB 4.47Å; L226-D238 HydrophobicContact CD1-CB 4.44Å; L226-I239 HydrophobicContact CD1-CD1 3.77Å; L226-I239 HydrophobicContact CD1-CG1 4.09Å; L226-M242 HydrophobicContact CD1-CE 3.8Å; L226-M242 HydrophobicContact CD1-SD 4.24Å; L226-M242 HydrophobicContact CD2-CE 4.2Å; L226-M242 HydrophobicContact CG-CE 4.49Å |
| 227 | Q | 93.6 | Very high | 92.1 | Very high | 40 Ų | 40 | 67.1 Ų | 67.1 | 19% | 0.187 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -59.7 | -40.8 | 177.7 | -70 | 176.3 | -28.6 | 0 | 0 | 111.7 | K223 I225 G231 T232 Q233 V235 | K223-Q227 VanDerWaalsContact O-CG 3.29Å; K223-Q227 WeakPolarHBondContact O-CG 3.41Å; K223-Q227 PolarHBondContact O-N 3.41Å; I225-Q227 VanDerWaalsContact C-N 3.35Å; I225-Q227 PolarHBondContact O-N 3.14Å; Q227-G231 WeakPolarHBondContact O-CA 3.42Å; Q227-G231 PolarHBondContact O-N 3.3Å; Q227-T232 WeakPolarHBondContact CA-O 3.5Å; Q227-T232 WeakPolarHBondContact CG-O 3.42Å; Q227-Q233 PolarHBondContact NE2-O 3.4Å; Q227-Q233 VanDerWaalsContact NE2-O 3.07Å; Q227-Q233 VanDerWaalsContact NE2-OE1 3.12Å; Q227-V235 HydrophobicContact CG-CG1 4.12Å; Q227-V235 HydrophobicContact CG-CG2 3.78Å |
| 228 | R | 93.6 | Very high | 91.9 | Very high | 172 Ų | 172 | 61.6 Ų | 61.6 | 65% | 0.649 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -68.3 | -43.9 | 175.8 | -177.5 | 179.1 | 175.1 | -171.3 | -3.3 | 112.5 | A9 Q224 I225 L226 | A9-R228 HydrophobicContact CB-CG 4.49Å; Q224-R228 WeakPolarHBondContact O-CB 3.49Å; Q224-R228 PolarHBondContact O-N 3.41Å; Q224-R228 VanDerWaalsContact O-N 3.09Å; I225-R228 PolarHBondContact O-N 2.82Å; L226-R228 VanDerWaalsContact C-N 3.28Å; L226-R228 PolarHBondContact O-N 2.86Å |
| 229 | L | 93.6 | Very high | 91.8 | Very high | 2 Ų | 2 | 58.6 Ų | 58.6 | 1% | 0.01 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -70.2 | -38.6 | -176.5 | -78.2 | 179.4 | 0 | 0 | 0 | 112.6 | T7 A9 L10 I145 P206 P209 I225 L226 | T7-L229 WeakPolarHBondContact CB-O 3.43Å; T7-L229 WeakPolarHBondContact CG2-O 3.33Å; T7-L229 PolarHBondContact OG1-O 2.93Å; A9-L229 HydrophobicContact CB-CD2 4.42Å; L10-L229 HydrophobicContact CB-CD2 4.24Å; L10-L229 HydrophobicContact CD1-CD2 4.25Å; I145-L229 HydrophobicContact CB-CD1 4.07Å; I145-L229 HydrophobicContact CG2-CD1 4.42Å; P206-L229 HydrophobicContact CG-CD1 4.09Å; P206-L229 HydrophobicContact CG-CD2 3.87Å; P206-L229 HydrophobicContact CG-CG 4.2Å; P209-L229 HydrophobicContact CG-CD1 4.35Å; I225-L229 HydrophobicContact CG2-CD1 3.64Å; I225-L229 HydrophobicContact CG2-CG 4.02Å; I225-L229 WeakPolarHBondContact O-CB 3.35Å; I225-L229 WeakPolarHBondContact O-CG 3.4Å; I225-L229 PolarHBondContact O-N 2.96Å; L226-L229 PolarHBondContact O-N 3.48Å |
| 230 | W | 93.1 | Very high | 91.5 | Very high | 4 Ų | 4 | 59.6 Ų | 59.6 | 2% | 0.015 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -104 | -5.6 | -174.8 | -57.5 | -15.9 | 0 | 0 | 0 | 113.6 | Q4 K5 I145 P147 L226 T232 V235 D238 | Q4-W230 HydrophobicContact CG-CE3 4.25Å; K5-W230 PolarHBondContact N-O 3.39Å; I145-W230 PolarHBondContact O-NE1 3.28Å; I145-W230 VanDerWaalsContact O-NE1 3.15Å; P147-W230 HydrophobicContact CG-CG 4.37Å; L226-W230 HydrophobicContact CD1-CH2 4.49Å; L226-W230 HydrophobicContact CD1-CZ3 4.38Å; L226-W230 HydrophobicContact CD2-CD2 4.08Å; L226-W230 HydrophobicContact CD2-CE3 4.09Å; L226-W230 HydrophobicContact CD2-CH2 3.5Å; L226-W230 HydrophobicContact CD2-CZ2 3.46Å; L226-W230 VanDerWaalsContact CD2-CZ2 3.46Å; L226-W230 HydrophobicContact CD2-CZ3 3.78Å; L226-W230 PolarHBondContact O-N 3.38Å; W230-T232 VanDerWaalsContact C-N 3.25Å; W230-T232 HydrophobicContact CB-CG2 4.11Å; W230-T232 PolarHBondContact O-N 3.09Å; W230-V235 HydrophobicContact CE3-CG1 4.08Å; W230-D238 HydrophobicContact CH2-CB 3.79Å; W230-D238 VanDerWaalsContact CH2-CG 3.49Å; W230-D238 VanDerWaalsContact CH2-OD1 3.27Å; W230-D238 WeakPolarHBondContact CH2-OD1 3.32Å; W230-D238 HydrophobicContact CZ3-CB 3.63Å; W230-D238 WeakPolarHBondContact CZ3-OD1 3.31Å; W230-D238 WeakPolarHBondContact CZ3-OD2 3.33Å |
| 231 | G | 91.3 | Very high | 91.1 | Very high | 43 Ų | 43 | 57.1 Ų | 57.1 | 44% | 0.443 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65 | 28.8 | 174 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q227 | Q227-G231 WeakPolarHBondContact O-CA 3.42Å; Q227-G231 PolarHBondContact O-N 3.3Å |
| 232 | T | 90.1 | Very high | 90.6 | Very high | 16 Ų | 16 | 53.8 Ų | 53.8 | 10% | 0.098 | 27% | 0.268 | C | S | . | . | trans | -131.6 | 141.2 | 178.2 | 179.3 | 0 | 0 | 0 | 0 | 109.7 | Q227 W230 D234 V235 | Q227-T232 WeakPolarHBondContact CA-O 3.5Å; Q227-T232 WeakPolarHBondContact CG-O 3.42Å; W230-T232 VanDerWaalsContact C-N 3.25Å; W230-T232 HydrophobicContact CB-CG2 4.11Å; W230-T232 PolarHBondContact O-N 3.09Å; T232-D234 PolarHBondContact OG1-N 2.82Å; T232-V235 HydrophobicContact CG2-CG1 3.91Å | ||
| 233 | Q | 88.3 | Confident | 90.2 | Very high | 148 Ų | 148 | 57.1 Ų | 57.1 | 69% | 0.692 | 28% | 0.282 | S | S | * | . | S | Bend | trans | -76.7 | -29.3 | 174.6 | -68.5 | -63.3 | -28.1 | 0 | 0 | 111.7 | Q227 V235 | Q227-Q233 PolarHBondContact NE2-O 3.4Å; Q227-Q233 VanDerWaalsContact NE2-O 3.07Å; Q227-Q233 VanDerWaalsContact NE2-OE1 3.12Å; Q233-V235 PolarHBondContact O-N 3.49Å |
| 234 | D | 89.2 | Confident | 89.7 | Confident | 85 Ų | 85 | 57.5 Ų | 57.5 | 46% | 0.455 | 29% | 0.288 | S | S | . | . | trans | -85.9 | 92 | 179.9 | -171.6 | 15.7 | 0 | 0 | 0 | 110 | T232 S236 | T232-D234 PolarHBondContact OG1-N 2.82Å; D234-S236 PolarHBondContact OD1-OG 3.37Å | ||
| 235 | V | 89.9 | Confident | 88.7 | Confident | 2 Ų | 2 | 53 Ų | 53 | 1% | 0.012 | 27% | 0.267 | C | S | . | . | trans | -119.9 | 15.8 | 173.9 | -61.5 | 0 | 0 | 0 | 0 | 111 | K223 L226 Q227 W230 T232 Q233 Q237 D238 I239 | K223-V235 HydrophobicContact CG-CG2 3.91Å; L226-V235 HydrophobicContact CB-CB 4.19Å; L226-V235 HydrophobicContact CB-CG1 4.01Å; L226-V235 HydrophobicContact CB-CG2 4.27Å; L226-V235 HydrophobicContact CD1-CB 4.47Å; Q227-V235 HydrophobicContact CG-CG1 4.12Å; Q227-V235 HydrophobicContact CG-CG2 3.78Å; W230-V235 HydrophobicContact CE3-CG1 4.08Å; T232-V235 HydrophobicContact CG2-CG1 3.91Å; Q233-V235 PolarHBondContact O-N 3.49Å; V235-Q237 VanDerWaalsContact C-N 3.3Å; V235-Q237 PolarHBondContact O-N 2.84Å; V235-D238 PolarHBondContact O-N 3.37Å; V235-I239 HydrophobicContact CG2-CG1 4.2Å; V235-I239 WeakPolarHBondContact O-CG1 3.4Å; V235-I239 PolarHBondContact O-N 3.3Å | ||
| 236 | S | 89.4 | Confident | 88.1 | Confident | 77 Ų | 77 | 52.2 Ų | 52.2 | 54% | 0.538 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63.7 | -38.8 | -170.5 | -43.1 | 0 | 0 | 0 | 0 | 111.5 | D234 I239 Q240 | D234-S236 PolarHBondContact OD1-OG 3.37Å; S236-I239 PolarHBondContact O-N 2.98Å; S236-Q240 WeakPolarHBondContact O-CB 3.36Å; S236-Q240 PolarHBondContact O-N 3.19Å |
| 237 | Q | 86.1 | Confident | 87.6 | Confident | 151 Ų | 151 | 54.4 Ų | 54.4 | 71% | 0.706 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -63.5 | -47.7 | 177.7 | -173.8 | 176.4 | 2.7 | 0 | 0 | 111.5 | V235 Q240 E241 | V235-Q237 VanDerWaalsContact C-N 3.3Å; V235-Q237 PolarHBondContact O-N 2.84Å; Q237-Q240 PolarHBondContact O-N 3.02Å; Q237-E241 PolarHBondContact O-N 3.36Å |
| 238 | D | 85.3 | Confident | 86.5 | Confident | 12 Ų | 12 | 56.6 Ų | 56.6 | 6% | 0.064 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -68.8 | -36.2 | 179.4 | -59.5 | -97 | 0 | 0 | 0 | 112.2 | Q4 L226 W230 V235 E241 M242 | Q4-D238 PolarHBondContact NE2-OD1 3.12Å; Q4-D238 PolarHBondContact NE2-OD2 3.42Å; L226-D238 HydrophobicContact CD1-CB 4.44Å; W230-D238 HydrophobicContact CH2-CB 3.79Å; W230-D238 VanDerWaalsContact CH2-CG 3.49Å; W230-D238 VanDerWaalsContact CH2-OD1 3.27Å; W230-D238 WeakPolarHBondContact CH2-OD1 3.32Å; W230-D238 HydrophobicContact CZ3-CB 3.63Å; W230-D238 WeakPolarHBondContact CZ3-OD1 3.31Å; W230-D238 WeakPolarHBondContact CZ3-OD2 3.33Å; V235-D238 PolarHBondContact O-N 3.37Å; D238-E241 PolarHBondContact O-N 3.44Å; D238-M242 VanDerWaalsContact O-CG 3.23Å; D238-M242 WeakPolarHBondContact O-CG 3.25Å; D238-M242 PolarHBondContact O-N 3.29Å |
| 239 | I | 89.8 | Confident | 85.4 | Confident | 10 Ų | 10 | 50.5 Ų | 50.5 | 5% | 0.051 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 172.2 | -71.9 | -69 | 0 | 0 | 0 | 110.7 | L213 E219 A222 K223 L226 V235 S236 M242 K243 | L213-I239 HydrophobicContact CD1-CD1 3.77Å; L213-I239 HydrophobicContact CD1-CG2 4.27Å; E219-I239 HydrophobicContact CG-CG2 4.38Å; A222-I239 HydrophobicContact CB-CD1 4.42Å; K223-I239 HydrophobicContact CB-CD1 4.05Å; K223-I239 HydrophobicContact CB-CG1 4.36Å; L226-I239 HydrophobicContact CD1-CD1 3.77Å; L226-I239 HydrophobicContact CD1-CG1 4.09Å; V235-I239 HydrophobicContact CG2-CG1 4.2Å; V235-I239 WeakPolarHBondContact O-CG1 3.4Å; V235-I239 PolarHBondContact O-N 3.3Å; S236-I239 PolarHBondContact O-N 2.98Å; I239-M242 PolarHBondContact O-N 3.13Å; I239-K243 HydrophobicContact CG2-CD 4.43Å; I239-K243 WeakPolarHBondContact O-CG 3.48Å; I239-K243 PolarHBondContact O-N 3.27Å |
| 240 | Q | 88.1 | Confident | 84.5 | Confident | 93 Ų | 93 | 54.8 Ų | 54.8 | 44% | 0.435 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -64.1 | -42.9 | 177 | -171.5 | 59.2 | 45.1 | 0 | 0 | 111.3 | S236 Q237 M242 K243 D244 | S236-Q240 WeakPolarHBondContact O-CB 3.36Å; S236-Q240 PolarHBondContact O-N 3.19Å; Q237-Q240 PolarHBondContact O-N 3.02Å; Q240-M242 VanDerWaalsContact C-N 3.3Å; Q240-M242 PolarHBondContact O-N 3.06Å; Q240-K243 WeakPolarHBondContact O-CB 3.45Å; Q240-K243 PolarHBondContact O-N 3.22Å; Q240-K243 VanDerWaalsContact O-N 3.1Å; Q240-D244 PolarHBondContact NE2-OD1 3.35Å; Q240-D244 VanDerWaalsContact O-CG 3.26Å; Q240-D244 PolarHBondContact O-N 2.63Å |
| 241 | E | 84.3 | Confident | 83.5 | Confident | 56 Ų | 56 | 62.3 Ų | 62.3 | 26% | 0.262 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -55.7 | -46 | 173.2 | -171.9 | -159.6 | 128.8 | 0 | 0 | 111.1 | R210 Q237 D238 K243 D244 E245 | R210-E241 IonicContact CZ-OE1 3.73Å; R210-E241 IonicContact NH1-OE1 2.78Å; R210-E241 PolarHBondContact NH1-OE1 3.3Å; R210-E241 IonicContact NH2-OE1 2.65Å; R210-E241 PolarHBondContact NH2-OE1 3.22Å; Q237-E241 PolarHBondContact O-N 3.36Å; D238-E241 PolarHBondContact O-N 3.44Å; E241-K243 VanDerWaalsContact C-N 3.34Å; E241-K243 PolarHBondContact O-N 2.82Å; E241-D244 PolarHBondContact O-N 3.4Å; E241-E245 WeakPolarHBondContact O-CB 3.45Å; E241-E245 PolarHBondContact O-N 2.92Å |
| 242 | M | 84.3 | Confident | 82.4 | Confident | 2 Ų | 2 | 63 Ų | 63 | 1% | 0.01 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -67.4 | -31.6 | 177.5 | -69 | 179.5 | -163.2 | 0 | 0 | 113 | R210 L213 L226 D238 I239 Q240 S246 | R210-M242 HydrophobicContact CG-CE 3.7Å; R210-M242 HydrophobicContact CG-CG 4.06Å; R210-M242 HydrophobicContact CG-SD 3.78Å; L213-M242 HydrophobicContact CD1-CB 3.8Å; L213-M242 HydrophobicContact CD1-SD 4.39Å; L213-M242 HydrophobicContact CD2-CB 3.96Å; L213-M242 WeakPolarHBondContact CD2-O 3.33Å; L213-M242 HydrophobicContact CG-CB 4.39Å; L226-M242 HydrophobicContact CD1-CE 3.8Å; L226-M242 HydrophobicContact CD1-SD 4.24Å; L226-M242 HydrophobicContact CD2-CE 4.2Å; L226-M242 HydrophobicContact CG-CE 4.49Å; D238-M242 VanDerWaalsContact O-CG 3.23Å; D238-M242 WeakPolarHBondContact O-CG 3.25Å; D238-M242 PolarHBondContact O-N 3.29Å; I239-M242 PolarHBondContact O-N 3.13Å; Q240-M242 VanDerWaalsContact C-N 3.3Å; Q240-M242 PolarHBondContact O-N 3.06Å; M242-S246 VanDerWaalsContact O-CB 3.32Å; M242-S246 WeakPolarHBondContact O-CB 3.41Å; M242-S246 PolarHBondContact O-N 2.69Å |
| 243 | K | 86.9 | Confident | 81.4 | Confident | 69 Ų | 69 | 69.4 Ų | 69.4 | 30% | 0.3 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -68.6 | -45.4 | 173.7 | -77.1 | -179.2 | -179.2 | -170.8 | 0 | 111.8 | L213 E219 I239 Q240 E241 E245 S246 A247 | L213-K243 HydrophobicContact CD2-CG 4.35Å; E219-K243 WeakPolarHBondContact OE1-CE 3.46Å; E219-K243 IonicContact OE1-NZ 3.4Å; E219-K243 PolarHBondContact OE1-NZ 3.16Å; E219-K243 WeakPolarHBondContact OE2-CE 3.46Å; E219-K243 IonicContact OE2-NZ 3.56Å; E219-K243 PolarHBondContact OE2-NZ 3.36Å; I239-K243 HydrophobicContact CG2-CD 4.43Å; I239-K243 WeakPolarHBondContact O-CG 3.48Å; I239-K243 PolarHBondContact O-N 3.27Å; Q240-K243 WeakPolarHBondContact O-CB 3.45Å; Q240-K243 PolarHBondContact O-N 3.22Å; Q240-K243 VanDerWaalsContact O-N 3.1Å; E241-K243 VanDerWaalsContact C-N 3.34Å; E241-K243 PolarHBondContact O-N 2.82Å; K243-E245 PolarHBondContact O-N 3.48Å; K243-S246 WeakPolarHBondContact O-CB 3.25Å; K243-S246 PolarHBondContact O-N 3.43Å; K243-S246 VanDerWaalsContact O-N 3.09Å; K243-A247 PolarHBondContact O-N 3.13Å |
| 244 | D | 82.9 | Confident | 80.4 | Confident | 79 Ų | 79 | 69.4 Ų | 69.4 | 42% | 0.422 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 176.4 | -63.7 | -14.9 | 0 | 0 | 0 | 109.7 | Q240 E241 A247 R248 | Q240-D244 PolarHBondContact NE2-OD1 3.35Å; Q240-D244 VanDerWaalsContact O-CG 3.26Å; Q240-D244 PolarHBondContact O-N 2.63Å; E241-D244 PolarHBondContact O-N 3.4Å; D244-A247 PolarHBondContact O-N 2.91Å; D244-R248 VanDerWaalsContact O-CD 3.3Å; D244-R248 WeakPolarHBondContact O-CD 3.31Å; D244-R248 VanDerWaalsContact O-CG 3.27Å; D244-R248 WeakPolarHBondContact O-CG 3.4Å; D244-R248 PolarHBondContact O-N 3.39Å; D244-R248 VanDerWaalsContact O-N 3.1Å |
| 245 | E | 75 | Confident | 79.7 | Confident | 23 Ų | 23 | 66.1 Ų | 66.1 | 11% | 0.107 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 172.3 | -171.3 | 173.9 | -133.4 | 0 | 0 | 112.7 | R210 I214 E241 K243 R248 M249 Q395 | R210-E245 IonicContact CZ-OE2 3.17Å; R210-E245 IonicContact NH1-OE1 3.53Å; R210-E245 IonicContact NH1-OE2 2.82Å; R210-E245 PolarHBondContact NH1-OE2 3.43Å; I214-E245 HydrophobicContact CD1-CB 4.35Å; I214-E245 HydrophobicContact CD1-CG 3.98Å; I214-E245 WeakPolarHBondContact CD1-OE2 3.39Å; E241-E245 WeakPolarHBondContact O-CB 3.45Å; E241-E245 PolarHBondContact O-N 2.92Å; K243-E245 PolarHBondContact O-N 3.48Å; E245-R248 PolarHBondContact O-N 3.39Å; E245-M249 WeakPolarHBondContact O-CB 3.06Å; E245-M249 PolarHBondContact O-N 2.76Å; E245-Q395 HydrophobicContact CG-CB 4.38Å; E245-Q395 HydrophobicContact CG-CG 4Å; E245-Q395 WeakPolarHBondContact OE1-CG 3.11Å |
| 246 | S | 82.1 | Confident | 79.5 | Confident | 13 Ų | 13 | 69.5 Ų | 69.5 | 9% | 0.091 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.3 | -41.9 | 177.2 | -171.2 | 0 | 0 | 0 | 0 | 112.5 | K217 M242 K243 M249 S250 | K217-S246 PolarHBondContact NZ-OG 3.43Å; M242-S246 VanDerWaalsContact O-CB 3.32Å; M242-S246 WeakPolarHBondContact O-CB 3.41Å; M242-S246 PolarHBondContact O-N 2.69Å; K243-S246 WeakPolarHBondContact O-CB 3.25Å; K243-S246 PolarHBondContact O-N 3.43Å; K243-S246 VanDerWaalsContact O-N 3.09Å; S246-M249 PolarHBondContact O-N 3.42Å; S246-S250 PolarHBondContact O-N 2.9Å |
| 247 | A | 82.4 | Confident | 79.4 | Confident | 45 Ų | 45 | 68 Ų | 68 | 37% | 0.372 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63 | -45.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | K243 D244 S250 Q251 | K243-A247 PolarHBondContact O-N 3.13Å; D244-A247 PolarHBondContact O-N 2.91Å; A247-S250 PolarHBondContact O-N 3.25Å; A247-S250 PolarHBondContact O-OG 2.99Å; A247-Q251 WeakPolarHBondContact O-CG 3.41Å; A247-Q251 PolarHBondContact O-N 2.91Å; A247-Q251 VanDerWaalsContact O-N 3.16Å |
| 248 | R | 71.4 | Confident | 79.4 | Confident | 86 Ų | 86 | 65.4 Ų | 65.4 | 33% | 0.325 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.6 | -46.7 | 175.3 | -69.9 | 159.4 | -179.1 | -103.4 | 5.6 | 112.3 | D244 E245 S250 Q251 E252 E459 | D244-R248 VanDerWaalsContact O-CD 3.3Å; D244-R248 WeakPolarHBondContact O-CD 3.31Å; D244-R248 VanDerWaalsContact O-CG 3.27Å; D244-R248 WeakPolarHBondContact O-CG 3.4Å; D244-R248 PolarHBondContact O-N 3.39Å; D244-R248 VanDerWaalsContact O-N 3.1Å; E245-R248 PolarHBondContact O-N 3.39Å; R248-S250 PolarHBondContact O-N 3.02Å; R248-Q251 CarbonylContact O-C 3.56Å; R248-Q251 WeakPolarHBondContact O-CA 3.35Å; R248-Q251 WeakPolarHBondContact O-CB 3.43Å; R248-Q251 PolarHBondContact O-N 2.99Å; R248-E252 WeakPolarHBondContact O-CB 3.41Å; R248-E252 WeakPolarHBondContact O-CG 3.46Å; R248-E252 PolarHBondContact O-N 3.19Å; R248-E459 VanDerWaalsContact CZ-CD 3.42Å; R248-E459 IonicContact CZ-OE1 3.57Å; R248-E459 IonicContact CZ-OE2 3.03Å; R248-E459 IonicContact NE-OE2 2.65Å; R248-E459 IonicContact NH1-OE1 3.35Å; R248-E459 PolarHBondContact NH1-OE1 3.13Å; R248-E459 IonicContact NH1-OE2 3.98Å; R248-E459 PolarHBondContact NH1-OE2 3.19Å; R248-E459 IonicContact NH2-OE1 3.16Å; R248-E459 PolarHBondContact NH2-OE1 3.49Å; R248-E459 IonicContact NH2-OE2 3.34Å |
| 249 | M | 70.7 | Confident | 79.6 | Confident | 44 Ų | 44 | 66.7 Ų | 66.7 | 22% | 0.217 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -59.2 | -32.9 | 176.5 | -174.6 | -172.8 | -72 | 0 | 0 | 112.1 | I214 E245 S246 Q251 Q395 | I214-M249 HydrophobicContact CG2-CB 4.4Å; I214-M249 HydrophobicContact CG2-CE 3.51Å; I214-M249 HydrophobicContact CG2-SD 3.43Å; I214-M249 WeakPolarHBondContact CG2-SD 3.45Å; E245-M249 WeakPolarHBondContact O-CB 3.06Å; E245-M249 PolarHBondContact O-N 2.76Å; S246-M249 PolarHBondContact O-N 3.42Å; M249-Q251 VanDerWaalsContact C-N 3.31Å; M249-Q395 HydrophobicContact CE-CB 3.22Å; M249-Q395 HydrophobicContact CE-CG 4.31Å |
| 250 | S | 73.4 | Confident | 79.5 | Confident | 92 Ų | 92 | 66.2 Ų | 66.2 | 64% | 0.643 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -73.8 | -23.5 | 175.8 | 71.5 | 0 | 0 | 0 | 0 | 113.6 | S246 A247 R248 | S246-S250 PolarHBondContact O-N 2.9Å; A247-S250 PolarHBondContact O-N 3.25Å; A247-S250 PolarHBondContact O-OG 2.99Å; R248-S250 PolarHBondContact O-N 3.02Å |
| 251 | Q | 73 | Confident | 79.7 | Confident | 162 Ų | 162 | 65.8 Ų | 65.8 | 76% | 0.757 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -87.6 | -28.7 | 175.5 | -67.5 | 172.8 | 0.7 | 0 | 0 | 111.8 | A247 R248 M249 | A247-Q251 WeakPolarHBondContact O-CG 3.41Å; A247-Q251 PolarHBondContact O-N 2.91Å; A247-Q251 VanDerWaalsContact O-N 3.16Å; R248-Q251 CarbonylContact O-C 3.56Å; R248-Q251 WeakPolarHBondContact O-CA 3.35Å; R248-Q251 WeakPolarHBondContact O-CB 3.43Å; R248-Q251 PolarHBondContact O-N 2.99Å; M249-Q251 VanDerWaalsContact C-N 3.31Å |
| 252 | E | 67.2 | Low | 79.9 | Confident | 58 Ų | 58 | 71.2 Ų | 71.2 | 27% | 0.271 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -84.3 | 130.3 | 175.9 | -71.5 | 176.1 | -164.3 | 0 | 0 | 110.7 | R248 Q254 | R248-E252 WeakPolarHBondContact O-CB 3.41Å; R248-E252 WeakPolarHBondContact O-CG 3.46Å; R248-E252 PolarHBondContact O-N 3.19Å; E252-Q254 PolarHBondContact O-N 3.4Å |
| 253 | K | 69.4 | Low | 80 | Confident | 151 Ų | 151 | 73.9 Ų | 73.9 | 66% | 0.657 | 37% | 0.368 | S | S | * | . | P | Polyproline II helix | trans | -62.6 | 138.8 | 172 | -171.9 | -175.6 | 172.3 | -155.5 | 0 | 109.5 | V255 E259 | K253-V255 WeakPolarHBondContact O-CG2 3.3Å; K253-V255 PolarHBondContact O-N 3.02Å; K253-E259 IonicContact NZ-OE1 2.79Å; K253-E259 PolarHBondContact NZ-OE1 3.28Å |
| 254 | Q | 67.1 | Low | 79.8 | Confident | 147 Ų | 147 | 73 Ų | 73 | 69% | 0.687 | 37% | 0.37 | S | S | * | . | P | Polyproline II helix | trans | -54.5 | 116.1 | 172.9 | -125.4 | -173.4 | 0.2 | 0 | 0 | 109.9 | E252 T256 | E252-Q254 PolarHBondContact O-N 3.4Å; Q254-T256 PolarHBondContact O-N 3.32Å |
| 255 | V | 76 | Confident | 79.8 | Confident | 17 Ų | 17 | 70.3 Ų | 70.3 | 10% | 0.103 | 36% | 0.357 | C | S | . | . | P | Polyproline II helix | trans | -80.6 | 123 | -169.6 | -175.8 | 0 | 0 | 0 | 0 | 110 | K253 E259 L260 Y266 P397 | K253-V255 WeakPolarHBondContact O-CG2 3.3Å; K253-V255 PolarHBondContact O-N 3.02Å; V255-E259 WeakPolarHBondContact CA-OE2 3.47Å; V255-E259 HydrophobicContact CG1-CB 3.85Å; V255-L260 HydrophobicContact CG1-CD2 3.84Å; V255-L260 HydrophobicContact CG1-CG 4.15Å; V255-Y266 HydrophobicContact CB-CE2 4.45Å; V255-Y266 HydrophobicContact CG1-CD2 4Å; V255-Y266 HydrophobicContact CG1-CE2 3.85Å; V255-Y266 HydrophobicContact CG2-CE2 3.67Å; V255-P397 HydrophobicContact CB-CB 4.16Å; V255-P397 HydrophobicContact CG1-CB 4.25Å; V255-P397 HydrophobicContact CG2-CB 4.15Å |
| 256 | T | 84.8 | Confident | 80.5 | Confident | 72 Ų | 72 | 70.8 Ų | 70.8 | 44% | 0.442 | 36% | 0.358 | S | S | . | . | P | Polyproline II helix | trans | -81.8 | 159.1 | 173.1 | 60.8 | 0 | 0 | 0 | 0 | 111.3 | Q254 L258 E259 L260 | Q254-T256 PolarHBondContact O-N 3.32Å; T256-L258 PolarHBondContact O-N 3.22Å; T256-E259 PolarHBondContact N-OE2 2.75Å; T256-E259 PolarHBondContact O-N 2.9Å; T256-E259 VanDerWaalsContact OG1-CD 3.29Å; T256-E259 VanDerWaalsContact OG1-CG 3.28Å; T256-E259 WeakPolarHBondContact OG1-CG 3.47Å; T256-E259 PolarHBondContact OG1-N 3.38Å; T256-E259 PolarHBondContact OG1-OE2 2.77Å; T256-L260 PolarHBondContact O-N 3.35Å |
| 257 | V | 86.8 | Confident | 80.9 | Confident | 47 Ų | 47 | 75.6 Ų | 75.6 | 29% | 0.285 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -53 | -40 | 174.9 | 171.5 | 0 | 0 | 0 | 0 | 111.7 | F79 E259 L260 F261 A400 V404 | F79-V257 HydrophobicContact CE2-CG1 4.45Å; F79-V257 HydrophobicContact CE2-CG2 4.21Å; F79-V257 HydrophobicContact CZ-CG2 4.29Å; V257-E259 VanDerWaalsContact C-N 3.35Å; V257-E259 PolarHBondContact O-N 3.23Å; V257-L260 WeakPolarHBondContact O-CB 3.35Å; V257-L260 PolarHBondContact O-N 3.49Å; V257-F261 HydrophobicContact CG1-CE2 4.23Å; V257-F261 VanDerWaalsContact O-CD2 3.3Å; V257-F261 WeakPolarHBondContact O-CD2 3.34Å; V257-A400 HydrophobicContact CG2-CB 4.33Å; V257-V404 HydrophobicContact CB-CG2 4.39Å; V257-V404 HydrophobicContact CG1-CG2 3.54Å; V257-V404 HydrophobicContact CG2-CG2 4.18Å |
| 258 | L | 87.6 | Confident | 81.3 | Confident | 96 Ų | 96 | 76.5 Ų | 76.5 | 50% | 0.503 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -69.4 | -33.2 | -179 | -167.2 | 65.2 | 0 | 0 | 0 | 112.5 | T256 L260 F261 R262 | T256-L258 PolarHBondContact O-N 3.22Å; L258-L260 VanDerWaalsContact C-N 3.31Å; L258-L260 PolarHBondContact O-N 2.84Å; L258-F261 PolarHBondContact O-N 2.84Å; L258-R262 VanDerWaalsContact CD2-CZ 3.46Å; L258-R262 WeakPolarHBondContact O-CG 3.44Å; L258-R262 PolarHBondContact O-N 2.95Å |
| 259 | E | 87.8 | Confident | 82.3 | Confident | 38 Ų | 38 | 72.5 Ų | 72.5 | 18% | 0.178 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67.2 | -30.9 | 176.9 | -78.2 | 164.7 | 159.5 | 0 | 0 | 112.1 | K253 V255 T256 V257 F261 R262 V263 | K253-E259 IonicContact NZ-OE1 2.79Å; K253-E259 PolarHBondContact NZ-OE1 3.28Å; V255-E259 WeakPolarHBondContact CA-OE2 3.47Å; V255-E259 HydrophobicContact CG1-CB 3.85Å; T256-E259 PolarHBondContact N-OE2 2.75Å; T256-E259 PolarHBondContact O-N 2.9Å; T256-E259 VanDerWaalsContact OG1-CD 3.29Å; T256-E259 VanDerWaalsContact OG1-CG 3.28Å; T256-E259 WeakPolarHBondContact OG1-CG 3.47Å; T256-E259 PolarHBondContact OG1-N 3.38Å; T256-E259 PolarHBondContact OG1-OE2 2.77Å; V257-E259 VanDerWaalsContact C-N 3.35Å; V257-E259 PolarHBondContact O-N 3.23Å; E259-F261 PolarHBondContact O-N 3.41Å; E259-R262 PolarHBondContact O-N 3.01Å; E259-R262 VanDerWaalsContact O-N 3.09Å; E259-V263 WeakPolarHBondContact O-CG2 3.27Å; E259-V263 PolarHBondContact O-N 3.05Å |
| 260 | L | 88.5 | Confident | 83.4 | Confident | 0 Ų | 0 | 70.4 Ų | 70.4 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -57 | -33.8 | 175.3 | -65.5 | 174.2 | 0 | 0 | 0 | 113 | V255 T256 V257 L258 Y266 R267 I270 F393 P397 A400 A401 V404 | V255-L260 HydrophobicContact CG1-CD2 3.84Å; V255-L260 HydrophobicContact CG1-CG 4.15Å; T256-L260 PolarHBondContact O-N 3.35Å; V257-L260 WeakPolarHBondContact O-CB 3.35Å; V257-L260 PolarHBondContact O-N 3.49Å; L258-L260 VanDerWaalsContact C-N 3.31Å; L258-L260 PolarHBondContact O-N 2.84Å; L260-Y266 HydrophobicContact CD2-CD2 4.37Å; L260-Y266 HydrophobicContact CD2-CG 4.3Å; L260-Y266 CarbonylContact O-C 3.42Å; L260-R267 PolarHBondContact O-N 3.27Å; L260-I270 HydrophobicContact CB-CG1 4.33Å; L260-I270 HydrophobicContact CD1-CD1 4.07Å; L260-I270 HydrophobicContact CD1-CG1 4.39Å; L260-F393 HydrophobicContact CD2-CE1 4.11Å; L260-P397 HydrophobicContact CD2-CB 3.77Å; L260-A400 HydrophobicContact CD1-CB 3.76Å; L260-A400 HydrophobicContact CG-CB 4.41Å; L260-A401 HydrophobicContact CD1-CB 4.31Å; L260-V404 HydrophobicContact CD1-CG2 4.19Å |
| 261 | F | 92.1 | Very high | 84.5 | Confident | 84 Ų | 84 | 69.6 Ų | 69.6 | 37% | 0.368 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -88.8 | -22.7 | 179 | -62.8 | -78.8 | 0 | 0 | 0 | 112.9 | V257 L258 E259 R267 I270 I274 V404 | V257-F261 HydrophobicContact CG1-CE2 4.23Å; V257-F261 VanDerWaalsContact O-CD2 3.3Å; V257-F261 WeakPolarHBondContact O-CD2 3.34Å; L258-F261 PolarHBondContact O-N 2.84Å; E259-F261 PolarHBondContact O-N 3.41Å; F261-R267 PolarHBondContact O-NE 3.39Å; F261-R267 PolarHBondContact O-NH2 3.11Å; F261-R267 VanDerWaalsContact O-NH2 3.12Å; F261-I270 HydrophobicContact CD1-CG2 4.24Å; F261-I270 HydrophobicContact CE1-CG1 4.44Å; F261-I270 HydrophobicContact CE1-CG2 4.22Å; F261-I270 HydrophobicContact CZ-CG1 4.41Å; F261-I274 HydrophobicContact CE1-CD1 3.78Å; F261-I274 HydrophobicContact CZ-CD1 3.91Å; F261-V404 HydrophobicContact CE2-CG1 4.4Å; F261-V404 HydrophobicContact CE2-CG2 4.43Å; F261-V404 HydrophobicContact CZ-CG1 3.88Å |
| 262 | R | 89 | Confident | 85.6 | Confident | 171 Ų | 171 | 62 Ų | 62 | 65% | 0.645 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -85 | -42.6 | -177.7 | -72.7 | 177.4 | 175.2 | -171.6 | -2.2 | 112.6 | L258 E259 R267 | L258-R262 VanDerWaalsContact CD2-CZ 3.46Å; L258-R262 WeakPolarHBondContact O-CG 3.44Å; L258-R262 PolarHBondContact O-N 2.95Å; E259-R262 PolarHBondContact O-N 3.01Å; E259-R262 VanDerWaalsContact O-N 3.09Å; R262-R267 PolarHBondContact O-NH2 3.05Å; R262-R267 VanDerWaalsContact O-NH2 3.11Å |
| 263 | V | 86.8 | Confident | 86.9 | Confident | 57 Ų | 57 | 59.2 Ų | 59.2 | 35% | 0.345 | 29% | 0.286 | S | S | . | . | S | Bend | trans | -80.4 | 129.4 | -175.4 | -178 | 0 | 0 | 0 | 0 | 110.5 | E259 S265 Y266 R267 | E259-V263 WeakPolarHBondContact O-CG2 3.27Å; E259-V263 PolarHBondContact O-N 3.05Å; V263-S265 VanDerWaalsContact CG1-OG 3.29Å; V263-S265 WeakPolarHBondContact CG1-OG 3.42Å; V263-S265 PolarHBondContact O-N 2.81Å; V263-Y266 HydrophobicContact CB-CD2 3.69Å; V263-Y266 HydrophobicContact CB-CE2 4.28Å; V263-Y266 HydrophobicContact CB-CG 4.28Å; V263-Y266 HydrophobicContact CG1-CD2 3.95Å; V263-Y266 HydrophobicContact CG1-CE2 4.22Å; V263-Y266 HydrophobicContact CG1-CG 4.37Å; V263-Y266 HydrophobicContact CG2-CD2 4.12Å; V263-Y266 HydrophobicContact CG2-CE2 4.39Å; V263-Y266 PolarHBondContact O-N 2.86Å; V263-R267 WeakPolarHBondContact O-CB 3.46Å; V263-R267 PolarHBondContact O-N 2.86Å |
| 264 | S | 82.2 | Confident | 88.2 | Confident | 50 Ų | 50 | 53.7 Ų | 53.7 | 35% | 0.35 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -59.9 | -42.4 | -175.7 | -166.9 | 0 | 0 | 0 | 0 | 112.8 | Y266 R267 | S264-Y266 VanDerWaalsContact C-N 3.27Å; S264-Y266 PolarHBondContact O-N 3.44Å; S264-R267 PolarHBondContact O-N 3.5Å |
| 265 | S | 83.3 | Confident | 89.6 | Confident | 23 Ų | 23 | 47.9 Ų | 47.9 | 16% | 0.161 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.4 | -27.8 | 178.7 | 56.1 | 0 | 0 | 0 | 0 | 113.7 | V263 P269 | V263-S265 VanDerWaalsContact CG1-OG 3.29Å; V263-S265 WeakPolarHBondContact CG1-OG 3.42Å; V263-S265 PolarHBondContact O-N 2.81Å; S265-P269 WeakPolarHBondContact O-CD 3.2Å; S265-P269 VanDerWaalsContact O-CG 3.32Å; S265-P269 WeakPolarHBondContact O-CG 3.41Å |
| 266 | Y | 88.4 | Confident | 90.6 | Very high | 33 Ų | 33 | 47.1 Ų | 47.1 | 13% | 0.129 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -92.2 | -24.2 | 177.8 | -58.1 | -30.3 | 0 | 0 | 0 | 113.4 | V255 L260 V263 S264 Q268 P269 I270 P397 | V255-Y266 HydrophobicContact CB-CE2 4.45Å; V255-Y266 HydrophobicContact CG1-CD2 4Å; V255-Y266 HydrophobicContact CG1-CE2 3.85Å; V255-Y266 HydrophobicContact CG2-CE2 3.67Å; L260-Y266 HydrophobicContact CD2-CD2 4.37Å; L260-Y266 HydrophobicContact CD2-CG 4.3Å; L260-Y266 CarbonylContact O-C 3.42Å; V263-Y266 HydrophobicContact CB-CD2 3.69Å; V263-Y266 HydrophobicContact CB-CE2 4.28Å; V263-Y266 HydrophobicContact CB-CG 4.28Å; V263-Y266 HydrophobicContact CG1-CD2 3.95Å; V263-Y266 HydrophobicContact CG1-CE2 4.22Å; V263-Y266 HydrophobicContact CG1-CG 4.37Å; V263-Y266 HydrophobicContact CG2-CD2 4.12Å; V263-Y266 HydrophobicContact CG2-CE2 4.39Å; V263-Y266 PolarHBondContact O-N 2.86Å; S264-Y266 VanDerWaalsContact C-N 3.27Å; S264-Y266 PolarHBondContact O-N 3.44Å; Y266-Q268 PolarHBondContact O-N 3.04Å; Y266-P269 VanDerWaalsContact O-CD 3.3Å; Y266-P269 WeakPolarHBondContact O-CD 3.47Å; Y266-P269 WeakPolarHBondContact O-CG 3.37Å; Y266-I270 WeakPolarHBondContact O-CB 3.43Å; Y266-I270 VanDerWaalsContact O-CG2 3.31Å; Y266-I270 WeakPolarHBondContact O-CG2 3.33Å; Y266-I270 PolarHBondContact O-N 2.97Å; Y266-P397 HydrophobicContact CD1-CG 4.43Å; Y266-P397 HydrophobicContact CE1-CB 4.37Å; Y266-P397 HydrophobicContact CE1-CG 3.97Å |
| 267 | R | 90.8 | Very high | 91.1 | Very high | 114 Ų | 114 | 43.9 Ų | 43.9 | 43% | 0.43 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63.1 | -43.3 | -175.1 | -170.2 | -179 | -65.6 | 158 | 4.9 | 112.3 | L260 F261 R262 V263 S264 I270 I271 | L260-R267 PolarHBondContact O-N 3.27Å; F261-R267 PolarHBondContact O-NE 3.39Å; F261-R267 PolarHBondContact O-NH2 3.11Å; F261-R267 VanDerWaalsContact O-NH2 3.12Å; R262-R267 PolarHBondContact O-NH2 3.05Å; R262-R267 VanDerWaalsContact O-NH2 3.11Å; V263-R267 WeakPolarHBondContact O-CB 3.46Å; V263-R267 PolarHBondContact O-N 2.86Å; S264-R267 PolarHBondContact O-N 3.5Å; R267-I270 WeakPolarHBondContact O-CG2 3.48Å; R267-I271 HydrophobicContact CG-CD1 3.8Å; R267-I271 HydrophobicContact CG-CG1 4.47Å; R267-I271 WeakPolarHBondContact O-CB 3.4Å; R267-I271 WeakPolarHBondContact O-CD1 3.45Å; R267-I271 WeakPolarHBondContact O-CG1 3.47Å; R267-I271 PolarHBondContact O-N 3.49Å |
| 268 | Q | 90.8 | Very high | 91.5 | Very high | 64 Ų | 64 | 43.9 Ų | 43.9 | 30% | 0.299 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -67.4 | -50.6 | 180 | -165.1 | 160.6 | -11.5 | 0 | 0 | 113.1 | Y266 I270 I271 I272 F465 | Y266-Q268 PolarHBondContact O-N 3.04Å; Q268-I270 VanDerWaalsContact C-N 3.3Å; Q268-I270 PolarHBondContact O-N 2.94Å; Q268-I271 PolarHBondContact O-N 3.34Å; Q268-I272 HydrophobicContact CG-CD1 4.25Å; Q268-I272 WeakPolarHBondContact O-CG1 3.41Å; Q268-I272 PolarHBondContact O-N 3.45Å; Q268-F465 HydrophobicContact CB-CD1 4.23Å; Q268-F465 HydrophobicContact CB-CE1 4.43Å; Q268-F465 HydrophobicContact CG-CD1 4.25Å; Q268-F465 HydrophobicContact CG-CE1 4.1Å |
| 269 | P | 92.6 | Very high | 92 | Very high | 3 Ų | 3 | 39.3 Ų | 39.3 | 2% | 0.019 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.8 | -30.6 | 176.5 | 23.4 | -32.5 | 0 | 0 | 0 | 113.1 | S265 Y266 S273 L392 F393 F465 | S265-P269 WeakPolarHBondContact O-CD 3.2Å; S265-P269 VanDerWaalsContact O-CG 3.32Å; S265-P269 WeakPolarHBondContact O-CG 3.41Å; Y266-P269 VanDerWaalsContact O-CD 3.3Å; Y266-P269 WeakPolarHBondContact O-CD 3.47Å; Y266-P269 WeakPolarHBondContact O-CG 3.37Å; P269-S273 WeakPolarHBondContact O-CB 3.47Å; P269-S273 PolarHBondContact O-N 3.48Å; P269-S273 PolarHBondContact O-OG 3.24Å; P269-L392 HydrophobicContact CB-CB 4.24Å; P269-F393 HydrophobicContact CB-CE1 3.99Å; P269-F393 HydrophobicContact CB-CE2 3.97Å; P269-F393 HydrophobicContact CB-CZ 3.65Å; P269-F393 HydrophobicContact CG-CE1 3.81Å; P269-F393 HydrophobicContact CG-CZ 3.9Å; P269-F465 HydrophobicContact CB-CD2 4.2Å; P269-F465 HydrophobicContact CB-CE1 4.49Å; P269-F465 HydrophobicContact CB-CE2 3.9Å; P269-F465 HydrophobicContact CB-CZ 4.05Å; P269-F465 HydrophobicContact CG-CD2 4.26Å; P269-F465 HydrophobicContact CG-CE2 4.45Å; P269-F465 HydrophobicContact CG-CG 4.35Å |
| 270 | I | 94.5 | Very high | 92.4 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -74.3 | -37.8 | 177.4 | -160.9 | 61 | 0 | 0 | 0 | 111.9 | L260 F261 Y266 R267 Q268 I272 S273 I274 F393 A401 V404 | L260-I270 HydrophobicContact CB-CG1 4.33Å; L260-I270 HydrophobicContact CD1-CD1 4.07Å; L260-I270 HydrophobicContact CD1-CG1 4.39Å; F261-I270 HydrophobicContact CD1-CG2 4.24Å; F261-I270 HydrophobicContact CE1-CG1 4.44Å; F261-I270 HydrophobicContact CE1-CG2 4.22Å; F261-I270 HydrophobicContact CZ-CG1 4.41Å; Y266-I270 WeakPolarHBondContact O-CB 3.43Å; Y266-I270 VanDerWaalsContact O-CG2 3.31Å; Y266-I270 WeakPolarHBondContact O-CG2 3.33Å; Y266-I270 PolarHBondContact O-N 2.97Å; R267-I270 WeakPolarHBondContact O-CG2 3.48Å; Q268-I270 VanDerWaalsContact C-N 3.3Å; Q268-I270 PolarHBondContact O-N 2.94Å; I270-I272 VanDerWaalsContact C-N 3.34Å; I270-S273 WeakPolarHBondContact O-CB 3.4Å; I270-S273 PolarHBondContact O-N 3.26Å; I270-I274 HydrophobicContact CG1-CD1 4.18Å; I270-I274 WeakPolarHBondContact O-CG1 3.15Å; I270-I274 PolarHBondContact O-N 2.93Å; I270-F393 HydrophobicContact CB-CZ 3.9Å; I270-F393 HydrophobicContact CD1-CE2 4.3Å; I270-F393 HydrophobicContact CD1-CZ 3.97Å; I270-A401 HydrophobicContact CD1-CB 3.91Å; I270-V404 HydrophobicContact CD1-CB 4.1Å; I270-V404 HydrophobicContact CD1-CG1 3.97Å; I270-V404 HydrophobicContact CG1-CG1 4.15Å |
| 271 | I | 95.9 | Very high | 92.6 | Very high | 75 Ų | 75 | 38.1 Ų | 38.1 | 39% | 0.385 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -62 | -45.4 | 172.9 | -71.5 | 168.2 | 0 | 0 | 0 | 109.9 | R267 Q268 S273 I274 V275 F445 | R267-I271 HydrophobicContact CG-CD1 3.8Å; R267-I271 HydrophobicContact CG-CG1 4.47Å; R267-I271 WeakPolarHBondContact O-CB 3.4Å; R267-I271 WeakPolarHBondContact O-CD1 3.45Å; R267-I271 WeakPolarHBondContact O-CG1 3.47Å; R267-I271 PolarHBondContact O-N 3.49Å; Q268-I271 PolarHBondContact O-N 3.34Å; I271-S273 VanDerWaalsContact C-N 3.3Å; I271-S273 PolarHBondContact O-N 2.93Å; I271-I274 PolarHBondContact O-N 3.11Å; I271-V275 HydrophobicContact CG2-CG2 4.22Å; I271-V275 WeakPolarHBondContact O-CB 3.49Å; I271-V275 VanDerWaalsContact O-CG2 3.24Å; I271-V275 WeakPolarHBondContact O-CG2 3.26Å; I271-V275 PolarHBondContact O-N 3Å; I271-F445 HydrophobicContact CG2-CE2 4.3Å; I271-F445 HydrophobicContact CG2-CZ 4.11Å |
| 272 | I | 95.6 | Very high | 92.8 | Very high | 2 Ų | 2 | 35.7 Ų | 35.7 | 1% | 0.01 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -57.2 | -48 | 175 | -70.1 | 162.8 | 0 | 0 | 0 | 110.2 | Q268 I270 I274 V275 L276 L392 F445 K449 V450 F465 | Q268-I272 HydrophobicContact CG-CD1 4.25Å; Q268-I272 WeakPolarHBondContact O-CG1 3.41Å; Q268-I272 PolarHBondContact O-N 3.45Å; I270-I272 VanDerWaalsContact C-N 3.34Å; I272-I274 PolarHBondContact O-N 2.79Å; I272-V275 PolarHBondContact O-N 3.26Å; I272-L276 HydrophobicContact CG2-CD1 3.73Å; I272-L276 HydrophobicContact CG2-CG 4.23Å; I272-L276 WeakPolarHBondContact O-CB 3.41Å; I272-L276 VanDerWaalsContact O-CG 3.25Å; I272-L276 WeakPolarHBondContact O-CG 3.44Å; I272-L276 PolarHBondContact O-N 3.45Å; I272-L392 HydrophobicContact CB-CD1 4.3Å; I272-L392 HydrophobicContact CG2-CD1 3.66Å; I272-F445 HydrophobicContact CG1-CE1 4.31Å; I272-F445 HydrophobicContact CG1-CZ 4.21Å; I272-K449 VanDerWaalsContact CD1-O 3.31Å; I272-K449 WeakPolarHBondContact CD1-O 3.49Å; I272-V450 HydrophobicContact CG2-CG1 4.46Å; I272-V450 HydrophobicContact CG2-CG2 4Å; I272-F465 HydrophobicContact CD1-CE1 3.88Å; I272-F465 HydrophobicContact CD1-CZ 3.94Å |
| 273 | S | 94.6 | Very high | 93 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.5 | -50.5 | -179.9 | -62.9 | 0 | 0 | 0 | 0 | 111.7 | P269 I270 I271 L276 Q277 F393 | P269-S273 WeakPolarHBondContact O-CB 3.47Å; P269-S273 PolarHBondContact O-N 3.48Å; P269-S273 PolarHBondContact O-OG 3.24Å; I270-S273 WeakPolarHBondContact O-CB 3.4Å; I270-S273 PolarHBondContact O-N 3.26Å; I271-S273 VanDerWaalsContact C-N 3.3Å; I271-S273 PolarHBondContact O-N 2.93Å; S273-L276 PolarHBondContact O-N 3.07Å; S273-Q277 VanDerWaalsContact O-CG 3.25Å; S273-Q277 WeakPolarHBondContact O-CG 3.49Å; S273-Q277 PolarHBondContact O-N 3.16Å; S273-Q277 VanDerWaalsContact O-N 3.16Å; S273-F393 WeakPolarHBondContact OG-CE2 3.41Å |
| 274 | I | 96.3 | Very high | 93.1 | Very high | 35 Ų | 35 | 24.8 Ų | 24.8 | 18% | 0.179 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -60.8 | -48.9 | 178.4 | -67.5 | 165.1 | 0 | 0 | 0 | 110.7 | F261 I270 I271 I272 L276 Q277 L278 V404 | F261-I274 HydrophobicContact CE1-CD1 3.78Å; F261-I274 HydrophobicContact CZ-CD1 3.91Å; I270-I274 HydrophobicContact CG1-CD1 4.18Å; I270-I274 WeakPolarHBondContact O-CG1 3.15Å; I270-I274 PolarHBondContact O-N 2.93Å; I271-I274 PolarHBondContact O-N 3.11Å; I272-I274 PolarHBondContact O-N 2.79Å; I274-L276 VanDerWaalsContact C-N 3.3Å; I274-L276 PolarHBondContact O-N 3.43Å; I274-Q277 WeakPolarHBondContact O-CB 3.03Å; I274-Q277 PolarHBondContact O-N 3.11Å; I274-Q277 VanDerWaalsContact O-N 3.13Å; I274-L278 HydrophobicContact CG2-CD1 4.09Å; I274-L278 HydrophobicContact CG2-CG 4.28Å; I274-L278 WeakPolarHBondContact O-CG 3.48Å; I274-L278 PolarHBondContact O-N 3.44Å; I274-V404 HydrophobicContact CD1-CG1 3.82Å; I274-V404 HydrophobicContact CG1-CG1 3.94Å |
| 275 | V | 97.4 | Very high | 93.4 | Very high | 25 Ų | 25 | 22.6 Ų | 22.6 | 15% | 0.152 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -64.6 | -35.1 | -177 | 175.3 | 0 | 0 | 0 | 0 | 111.7 | I271 I272 L278 S279 F442 F445 | I271-V275 HydrophobicContact CG2-CG2 4.22Å; I271-V275 WeakPolarHBondContact O-CB 3.49Å; I271-V275 VanDerWaalsContact O-CG2 3.24Å; I271-V275 WeakPolarHBondContact O-CG2 3.26Å; I271-V275 PolarHBondContact O-N 3Å; I272-V275 PolarHBondContact O-N 3.26Å; V275-L278 PolarHBondContact O-N 3.24Å; V275-S279 WeakPolarHBondContact O-CB 3.28Å; V275-S279 PolarHBondContact O-N 2.93Å; V275-F442 HydrophobicContact CG1-CD1 3.68Å; V275-F442 HydrophobicContact CG1-CE1 3.94Å; V275-F445 HydrophobicContact CB-CD1 4.08Å; V275-F445 HydrophobicContact CB-CE1 3.7Å; V275-F445 HydrophobicContact CB-CE2 4.45Å; V275-F445 HydrophobicContact CB-CZ 3.91Å; V275-F445 HydrophobicContact CG1-CB 4.41Å; V275-F445 HydrophobicContact CG1-CD1 3.4Å; V275-F445 VanDerWaalsContact CG1-CD1 3.4Å; V275-F445 HydrophobicContact CG1-CD2 4.18Å; V275-F445 HydrophobicContact CG1-CE1 3.59Å; V275-F445 HydrophobicContact CG1-CE2 4.32Å; V275-F445 HydrophobicContact CG1-CG 3.73Å; V275-F445 HydrophobicContact CG1-CZ 4.05Å; V275-F445 HydrophobicContact CG2-CE1 4.26Å; V275-F445 HydrophobicContact CG2-CE2 4.15Å; V275-F445 HydrophobicContact CG2-CZ 3.94Å |
| 276 | L | 96.4 | Very high | 93.3 | Very high | 1 Ų | 1 | 22.1 Ų | 22.1 | 1% | 0.005 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -66.4 | -38.6 | 174.3 | -71 | 177.5 | 0 | 0 | 0 | 112.1 | I272 S273 I274 S279 Q280 H335 P385 I388 V450 | I272-L276 HydrophobicContact CG2-CD1 3.73Å; I272-L276 HydrophobicContact CG2-CG 4.23Å; I272-L276 WeakPolarHBondContact O-CB 3.41Å; I272-L276 VanDerWaalsContact O-CG 3.25Å; I272-L276 WeakPolarHBondContact O-CG 3.44Å; I272-L276 PolarHBondContact O-N 3.45Å; S273-L276 PolarHBondContact O-N 3.07Å; I274-L276 VanDerWaalsContact C-N 3.3Å; I274-L276 PolarHBondContact O-N 3.43Å; L276-S279 WeakPolarHBondContact CA-OG 3.27Å; L276-S279 PolarHBondContact O-N 3.24Å; L276-S279 PolarHBondContact O-OG 3.14Å; L276-Q280 PolarHBondContact O-N 2.86Å; L276-Q280 VanDerWaalsContact O-N 3.13Å; L276-H335 WeakPolarHBondContact CD2-NE2 3.48Å; L276-P385 HydrophobicContact CB-CB 4.25Å; L276-P385 HydrophobicContact CB-CG 4.35Å; L276-I388 HydrophobicContact CD1-CD1 3.91Å; L276-I388 HydrophobicContact CD1-CG2 3.6Å; L276-V450 HydrophobicContact CD1-CG1 4.38Å; L276-V450 HydrophobicContact CD1-CG2 4.48Å; L276-V450 HydrophobicContact CD2-CG2 4.15Å; L276-V450 HydrophobicContact CG-CG2 4.47Å |
| 277 | Q | 95.3 | Very high | 92.8 | Very high | 3 Ų | 3 | 20.6 Ų | 20.6 | 1% | 0.014 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -65.9 | -42.4 | 173.6 | -60.2 | -63.9 | -9.8 | 0 | 0 | 111.8 | S273 I274 S279 Q280 Q281 P385 A405 S408 N409 | S273-Q277 VanDerWaalsContact O-CG 3.25Å; S273-Q277 WeakPolarHBondContact O-CG 3.49Å; S273-Q277 PolarHBondContact O-N 3.16Å; S273-Q277 VanDerWaalsContact O-N 3.16Å; I274-Q277 WeakPolarHBondContact O-CB 3.03Å; I274-Q277 PolarHBondContact O-N 3.11Å; I274-Q277 VanDerWaalsContact O-N 3.13Å; Q277-S279 VanDerWaalsContact C-N 3.29Å; Q277-S279 PolarHBondContact O-N 2.94Å; Q277-Q280 WeakPolarHBondContact O-CB 3.21Å; Q277-Q280 PolarHBondContact O-N 3.41Å; Q277-Q281 PolarHBondContact O-N 3.46Å; Q277-P385 PolarHBondContact NE2-O 3.32Å; Q277-A405 HydrophobicContact CG-CB 3.93Å; Q277-A405 WeakPolarHBondContact CG-O 3.21Å; Q277-S408 WeakPolarHBondContact CB-OG 3.38Å; Q277-N409 HydrophobicContact CB-CB 4.06Å; Q277-N409 HydrophobicContact CG-CB 4.37Å; Q277-N409 PolarHBondContact OE1-ND2 3.37Å |
| 278 | L | 96.6 | Very high | 92.3 | Very high | 48 Ų | 48 | 15.3 Ų | 15.3 | 25% | 0.251 | 8% | 0.079 | S | C | . | . | H | α-helix | trans | -60.1 | -41.4 | 172.5 | -66 | -179.7 | 0 | 0 | 0 | 111 | I274 V275 Q280 Q281 L282 F442 | I274-L278 HydrophobicContact CG2-CD1 4.09Å; I274-L278 HydrophobicContact CG2-CG 4.28Å; I274-L278 WeakPolarHBondContact O-CG 3.48Å; I274-L278 PolarHBondContact O-N 3.44Å; V275-L278 PolarHBondContact O-N 3.24Å; L278-Q280 PolarHBondContact O-N 2.92Å; L278-Q281 PolarHBondContact O-N 3.45Å; L278-L282 HydrophobicContact CB-CD1 4.23Å; L278-L282 HydrophobicContact CD2-CD1 4.3Å; L278-L282 WeakPolarHBondContact O-CA 3.39Å; L278-L282 VanDerWaalsContact O-CB 3.24Å; L278-L282 WeakPolarHBondContact O-CB 3.39Å; L278-L282 PolarHBondContact O-N 3.48Å; L278-F442 HydrophobicContact CB-CE1 4.15Å; L278-F442 HydrophobicContact CB-CZ 3.9Å |
| 279 | S | 97.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -63.5 | -29.5 | 178.7 | 80.2 | 0 | 0 | 0 | 0 | 113.4 | V275 L276 Q277 S283 H335 F442 | V275-S279 WeakPolarHBondContact O-CB 3.28Å; V275-S279 PolarHBondContact O-N 2.93Å; L276-S279 WeakPolarHBondContact CA-OG 3.27Å; L276-S279 PolarHBondContact O-N 3.24Å; L276-S279 PolarHBondContact O-OG 3.14Å; Q277-S279 VanDerWaalsContact C-N 3.29Å; Q277-S279 PolarHBondContact O-N 2.94Å; S279-S283 WeakPolarHBondContact O-CB 3.44Å; S279-H335 PolarHBondContact OG-CE1 2.66Å; S279-H335 PolarHBondContact OG-NE2 3.44Å; S279-F442 VanDerWaalsContact CA-CD2 3.44Å; S279-F442 VanDerWaalsContact CB-CG 3.46Å |
| 280 | Q | 95.7 | Very high | 90.5 | Very high | 4 Ų | 4 | 13.8 Ų | 13.8 | 2% | 0.019 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -70.2 | -49.5 | 173.4 | -176.1 | -180 | 92 | 0 | 0 | 111.2 | L276 Q277 L278 S283 F377 P381 G382 P385 N409 | L276-Q280 PolarHBondContact O-N 2.86Å; L276-Q280 VanDerWaalsContact O-N 3.13Å; Q277-Q280 WeakPolarHBondContact O-CB 3.21Å; Q277-Q280 PolarHBondContact O-N 3.41Å; L278-Q280 PolarHBondContact O-N 2.92Å; Q280-S283 WeakPolarHBondContact O-CB 3.43Å; Q280-S283 PolarHBondContact O-OG 3.33Å; Q280-F377 HydrophobicContact CG-CE2 3.82Å; Q280-F377 HydrophobicContact CG-CZ 3.83Å; Q280-P381 WeakPolarHBondContact CG-O 3.45Å; Q280-P381 PolarHBondContact NE2-O 2.96Å; Q280-G382 PolarHBondContact NE2-O 2.84Å; Q280-P385 HydrophobicContact CB-CG 4.22Å; Q280-N409 PolarHBondContact OE1-ND2 3.33Å |
| 281 | Q | 93.7 | Very high | 89.4 | Confident | 9 Ų | 9 | 17.2 Ų | 17.2 | 4% | 0.042 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -83.4 | -45.7 | -169.7 | -61.8 | -65.1 | -33.7 | 0 | 0 | 112.6 | Q277 L278 S283 G284 N286 N409 S412 N413 | Q277-Q281 PolarHBondContact O-N 3.46Å; L278-Q281 PolarHBondContact O-N 3.45Å; Q281-S283 PolarHBondContact O-N 3.17Å; Q281-G284 PolarHBondContact O-N 2.84Å; Q281-N286 PolarHBondContact OE1-ND2 3.32Å; Q281-N409 WeakPolarHBondContact CG-O 3.43Å; Q281-N409 PolarHBondContact NE2-ND2 3.34Å; Q281-N409 PolarHBondContact NE2-OD1 3.4Å; Q281-S412 VanDerWaalsContact CB-OG 3.24Å; Q281-S412 WeakPolarHBondContact CB-OG 3.31Å; Q281-S412 WeakPolarHBondContact CG-OG 3.23Å; Q281-N413 HydrophobicContact CG-CB 4.43Å; Q281-N413 VanDerWaalsContact OE1-CB 3.23Å; Q281-N413 PolarHBondContact OE1-ND2 3.15Å |
| 282 | L | 95.1 | Very high | 88.4 | Confident | 32 Ų | 32 | 13.7 Ų | 13.7 | 17% | 0.168 | 7% | 0.066 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | 2.7 | 176.1 | -61.2 | 177.7 | 0 | 0 | 0 | 113 | L278 G284 V416 F435 F438 F442 | L278-L282 HydrophobicContact CB-CD1 4.23Å; L278-L282 HydrophobicContact CD2-CD1 4.3Å; L278-L282 WeakPolarHBondContact O-CA 3.39Å; L278-L282 VanDerWaalsContact O-CB 3.24Å; L278-L282 WeakPolarHBondContact O-CB 3.39Å; L278-L282 PolarHBondContact O-N 3.48Å; L282-G284 PolarHBondContact O-N 3.25Å; L282-V416 HydrophobicContact CD2-CG2 3.64Å; L282-F435 WeakPolarHBondContact O-CD1 3.27Å; L282-F438 HydrophobicContact CB-CD2 4.33Å; L282-F438 HydrophobicContact CB-CG 4.3Å; L282-F438 HydrophobicContact CD1-CD1 4.39Å; L282-F438 HydrophobicContact CD1-CE1 4.22Å; L282-F438 HydrophobicContact CD1-CZ 4.42Å; L282-F442 HydrophobicContact CB-CE2 3.94Å; L282-F442 HydrophobicContact CB-CZ 4.32Å; L282-F442 HydrophobicContact CD1-CZ 4.09Å |
| 283 | S | 94.9 | Very high | 87.4 | Confident | 0 Ų | 0 | 15.8 Ų | 15.8 | 0% | 0 | 8% | 0.079 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | -23.3 | 164.8 | 69.5 | 0 | 0 | 0 | 0 | 112.6 | S279 Q280 Q281 I285 M342 F373 | S279-S283 WeakPolarHBondContact O-CB 3.44Å; Q280-S283 WeakPolarHBondContact O-CB 3.43Å; Q280-S283 PolarHBondContact O-OG 3.33Å; Q281-S283 PolarHBondContact O-N 3.17Å; S283-I285 PolarHBondContact OG-N 3.45Å; S283-M342 VanDerWaalsContact CB-CE 3.47Å; S283-F373 WeakPolarHBondContact O-CZ 3.4Å |
| 284 | G | 87.9 | Confident | 86.3 | Confident | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 10% | 0.096 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 91.9 | 5.9 | -174 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q281 L282 N286 A287 V288 F435 | Q281-G284 PolarHBondContact O-N 2.84Å; L282-G284 PolarHBondContact O-N 3.25Å; G284-N286 VanDerWaalsContact C-N 3.32Å; G284-N286 PolarHBondContact O-N 3.19Å; G284-A287 WeakPolarHBondContact O-CB 3.23Å; G284-A287 PolarHBondContact O-N 3.25Å; G284-V288 PolarHBondContact O-N 3.18Å; G284-V288 VanDerWaalsContact O-N 3.08Å; G284-F435 VanDerWaalsContact CA-CE1 3.4Å |
| 285 | I | 88.8 | Confident | 85.3 | Confident | 3 Ų | 3 | 16.8 Ų | 16.8 | 2% | 0.015 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -58 | -39.5 | -178 | -166.5 | 62.2 | 0 | 0 | 0 | 113.5 | S283 A287 V288 F289 F373 V374 F377 | S283-I285 PolarHBondContact OG-N 3.45Å; I285-A287 VanDerWaalsContact C-N 3.33Å; I285-A287 PolarHBondContact O-N 3.09Å; I285-V288 WeakPolarHBondContact O-CB 3.48Å; I285-V288 PolarHBondContact O-N 3.33Å; I285-F289 HydrophobicContact CD1-CD2 4.13Å; I285-F289 HydrophobicContact CD1-CE2 3.67Å; I285-F289 HydrophobicContact CD1-CZ 4.47Å; I285-F289 HydrophobicContact CG1-CD2 3.76Å; I285-F289 HydrophobicContact CG1-CE2 3.53Å; I285-F289 WeakPolarHBondContact O-CD2 3.45Å; I285-F289 PolarHBondContact O-N 3.35Å; I285-F373 HydrophobicContact CD1-CD1 4.18Å; I285-F373 HydrophobicContact CD1-CE1 3.89Å; I285-V374 HydrophobicContact CD1-CG2 4.14Å; I285-F377 HydrophobicContact CB-CD2 3.9Å; I285-F377 HydrophobicContact CB-CE2 3.83Å; I285-F377 HydrophobicContact CB-CG 4.29Å; I285-F377 HydrophobicContact CB-CZ 4.17Å; I285-F377 HydrophobicContact CD1-CB 3.93Å; I285-F377 HydrophobicContact CD1-CD1 3.87Å; I285-F377 HydrophobicContact CD1-CD2 4.19Å; I285-F377 HydrophobicContact CD1-CE1 4.45Å; I285-F377 HydrophobicContact CD1-CG 3.71Å; I285-F377 HydrophobicContact CG1-CB 4.49Å; I285-F377 HydrophobicContact CG1-CD1 3.71Å; I285-F377 HydrophobicContact CG1-CD2 3.86Å; I285-F377 HydrophobicContact CG1-CE1 3.79Å; I285-F377 HydrophobicContact CG1-CE2 3.94Å; I285-F377 HydrophobicContact CG1-CG 3.74Å; I285-F377 HydrophobicContact CG1-CZ 3.9Å; I285-F377 HydrophobicContact CG2-CD2 4.22Å; I285-F377 HydrophobicContact CG2-CE1 4.47Å; I285-F377 HydrophobicContact CG2-CE2 3.62Å; I285-F377 HydrophobicContact CG2-CZ 3.76Å |
| 286 | N | 80.2 | Confident | 84.5 | Confident | 14 Ų | 14 | 15.6 Ų | 15.6 | 8% | 0.075 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -72.7 | -29.1 | 177.4 | -56.5 | -66.9 | 0 | 0 | 0 | 112.2 | Q281 G284 V288 F289 Y290 N413 | Q281-N286 PolarHBondContact OE1-ND2 3.32Å; G284-N286 VanDerWaalsContact C-N 3.32Å; G284-N286 PolarHBondContact O-N 3.19Å; N286-V288 VanDerWaalsContact C-N 3.27Å; N286-V288 PolarHBondContact O-N 3.14Å; N286-F289 PolarHBondContact O-N 3.13Å; N286-Y290 HydrophobicContact CB-CD2 4.02Å; N286-Y290 HydrophobicContact CB-CE2 3.69Å; N286-Y290 VanDerWaalsContact O-CB 3.22Å; N286-Y290 WeakPolarHBondContact O-CB 3.38Å; N286-Y290 WeakPolarHBondContact O-CD2 3.46Å; N286-Y290 PolarHBondContact O-N 2.58Å; N286-N413 PolarHBondContact ND2-ND2 3.06Å; N286-N413 PolarHBondContact OD1-ND2 3.36Å |
| 287 | A | 79.7 | Confident | 83.7 | Confident | 1 Ų | 1 | 22.4 Ų | 22.4 | 1% | 0.008 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -63.8 | -40.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | G284 I285 Y291 V416 F420 F435 | G284-A287 WeakPolarHBondContact O-CB 3.23Å; G284-A287 PolarHBondContact O-N 3.25Å; I285-A287 VanDerWaalsContact C-N 3.33Å; I285-A287 PolarHBondContact O-N 3.09Å; A287-Y291 WeakPolarHBondContact O-CB 3.34Å; A287-Y291 WeakPolarHBondContact O-CD2 3.42Å; A287-Y291 PolarHBondContact O-N 3.24Å; A287-V416 HydrophobicContact CB-CG1 4.46Å; A287-F420 HydrophobicContact CB-CD1 4.02Å; A287-F420 HydrophobicContact CB-CD2 3.57Å; A287-F420 HydrophobicContact CB-CE1 4.01Å; A287-F420 HydrophobicContact CB-CE2 3.56Å; A287-F420 HydrophobicContact CB-CG 3.79Å; A287-F420 HydrophobicContact CB-CZ 3.78Å; A287-F435 HydrophobicContact CB-CE2 4.04Å; A287-F435 HydrophobicContact CB-CZ 3.92Å |
| 288 | V | 79.3 | Confident | 82.6 | Confident | 3 Ų | 3 | 27.6 Ų | 27.6 | 2% | 0.018 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.9 | -50.1 | 170.6 | 178.3 | 0 | 0 | 0 | 0 | 110.7 | G284 I285 N286 S292 M349 I370 F373 V374 | G284-V288 PolarHBondContact O-N 3.18Å; G284-V288 VanDerWaalsContact O-N 3.08Å; I285-V288 WeakPolarHBondContact O-CB 3.48Å; I285-V288 PolarHBondContact O-N 3.33Å; N286-V288 VanDerWaalsContact C-N 3.27Å; N286-V288 PolarHBondContact O-N 3.14Å; V288-S292 WeakPolarHBondContact O-CA 3.41Å; V288-S292 WeakPolarHBondContact O-CB 3.44Å; V288-S292 PolarHBondContact O-N 3.41Å; V288-S292 PolarHBondContact O-OG 2.93Å; V288-S292 VanDerWaalsContact O-OG 3.04Å; V288-M349 HydrophobicContact CG2-CE 4.19Å; V288-I370 HydrophobicContact CG1-CG2 3.75Å; V288-F373 HydrophobicContact CG2-CD1 4.17Å; V288-F373 HydrophobicContact CG2-CE1 3.9Å; V288-V374 HydrophobicContact CG1-CG2 4.22Å |
| 289 | F | 75.5 | Confident | 81.4 | Confident | 11 Ų | 11 | 25.4 Ų | 25.4 | 5% | 0.048 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -68.4 | -40.5 | -177.2 | -79.3 | -62 | 0 | 0 | 0 | 114.7 | N32 I166 I285 N286 S292 N315 V374 | N32-F289 PolarHBondContact ND2-O 2.95Å; I166-F289 HydrophobicContact CG2-CD1 4.46Å; I166-F289 HydrophobicContact CG2-CE1 4.43Å; I285-F289 HydrophobicContact CD1-CD2 4.13Å; I285-F289 HydrophobicContact CD1-CE2 3.67Å; I285-F289 HydrophobicContact CD1-CZ 4.47Å; I285-F289 HydrophobicContact CG1-CD2 3.76Å; I285-F289 HydrophobicContact CG1-CE2 3.53Å; I285-F289 WeakPolarHBondContact O-CD2 3.45Å; I285-F289 PolarHBondContact O-N 3.35Å; N286-F289 PolarHBondContact O-N 3.13Å; F289-S292 PolarHBondContact O-OG 2.86Å; F289-N315 HydrophobicContact CZ-CB 4.21Å; F289-V374 HydrophobicContact CZ-CG1 4.17Å |
| 290 | Y | 70.6 | Confident | 80.3 | Confident | 23 Ų | 23 | 28 Ų | 28 | 9% | 0.09 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -74.6 | -35.7 | -179.2 | -61 | -22.1 | 0 | 0 | 0 | 112.3 | T28 N286 | T28-Y290 HydrophobicContact CG2-CE1 4.06Å; N286-Y290 HydrophobicContact CB-CD2 4.02Å; N286-Y290 HydrophobicContact CB-CE2 3.69Å; N286-Y290 VanDerWaalsContact O-CB 3.22Å; N286-Y290 WeakPolarHBondContact O-CB 3.38Å; N286-Y290 WeakPolarHBondContact O-CD2 3.46Å; N286-Y290 PolarHBondContact O-N 2.58Å |
| 291 | Y | 70.2 | Confident | 79.5 | Confident | 72 Ų | 72 | 29.3 Ų | 29.3 | 28% | 0.282 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -115.1 | 3.6 | -172.6 | -53.3 | -77.4 | 0 | 0 | 0 | 114.4 | A287 T293 G294 I295 F420 P421 | A287-Y291 WeakPolarHBondContact O-CB 3.34Å; A287-Y291 WeakPolarHBondContact O-CD2 3.42Å; A287-Y291 PolarHBondContact O-N 3.24Å; Y291-T293 VanDerWaalsContact C-N 3.27Å; Y291-T293 PolarHBondContact O-N 3.11Å; Y291-G294 WeakPolarHBondContact O-CA 3.36Å; Y291-G294 PolarHBondContact O-N 3.31Å; Y291-I295 WeakPolarHBondContact O-CG1 2.99Å; Y291-I295 PolarHBondContact O-N 3.03Å; Y291-F420 AromaticContact CD2-CD1 3.32Å; Y291-F420 HydrophobicContact CD2-CD1 3.32Å; Y291-F420 AromaticContact CD2-CE1 3.32Å; Y291-F420 HydrophobicContact CD2-CE1 3.32Å; Y291-F420 HydrophobicContact CD2-CG 4.44Å; Y291-F420 HydrophobicContact CD2-CZ 4.45Å; Y291-F420 AromaticContact CE2-CD1 3.33Å; Y291-F420 HydrophobicContact CE2-CD1 3.33Å; Y291-F420 AromaticContact CE2-CE1 3.87Å; Y291-F420 HydrophobicContact CE2-CE1 3.87Å; Y291-F420 HydrophobicContact CE2-CG 4.29Å; Y291-F420 HydrophobicContact CG-CD1 4.12Å; Y291-F420 AromaticContact CG-CE1 3.78Å; Y291-F420 HydrophobicContact CG-CE1 3.78Å; Y291-P421 HydrophobicContact CE1-CG 4.32Å; Y291-P421 VanDerWaalsContact OH-CG 3.22Å; Y291-P421 WeakPolarHBondContact OH-CG 3.41Å |
| 292 | S | 75.4 | Confident | 78.7 | Confident | 2 Ų | 2 | 37.3 Ų | 37.3 | 1% | 0.014 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -50.2 | -44.8 | 178.2 | 40.7 | 0 | 0 | 0 | 0 | 112.7 | V288 F289 G294 I295 F296 T308 | V288-S292 WeakPolarHBondContact O-CA 3.41Å; V288-S292 WeakPolarHBondContact O-CB 3.44Å; V288-S292 PolarHBondContact O-N 3.41Å; V288-S292 PolarHBondContact O-OG 2.93Å; V288-S292 VanDerWaalsContact O-OG 3.04Å; F289-S292 PolarHBondContact O-OG 2.86Å; S292-G294 VanDerWaalsContact C-N 3.26Å; S292-G294 PolarHBondContact O-N 3.13Å; S292-I295 PolarHBondContact O-N 3.32Å; S292-F296 WeakPolarHBondContact O-CB 3.34Å; S292-F296 WeakPolarHBondContact O-CD2 3.24Å; S292-F296 VanDerWaalsContact O-CG 3.3Å; S292-F296 WeakPolarHBondContact O-CG 3.41Å; S292-F296 PolarHBondContact O-N 2.97Å; S292-T308 WeakPolarHBondContact OG-CG2 3.17Å; S292-T308 PolarHBondContact OG-OG1 2.81Å |
| 293 | T | 75.6 | Confident | 78.1 | Confident | 45 Ų | 45 | 41.4 Ų | 41.4 | 28% | 0.276 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -59 | -39.1 | 179.9 | -35.9 | 0 | 0 | 0 | 0 | 111.6 | Y291 K297 P304 T308 | Y291-T293 VanDerWaalsContact C-N 3.27Å; Y291-T293 PolarHBondContact O-N 3.11Å; T293-K297 WeakPolarHBondContact O-CB 3.44Å; T293-K297 PolarHBondContact O-N 3.2Å; T293-K297 VanDerWaalsContact O-N 3.13Å; T293-P304 HydrophobicContact CG2-CB 3.67Å; T293-P304 VanDerWaalsContact O-CB 3.26Å; T293-P304 WeakPolarHBondContact O-CB 3.48Å; T293-T308 PolarHBondContact OG1-OG1 3.31Å |
| 294 | G | 70.9 | Confident | 77.4 | Confident | 35 Ų | 35 | 42.3 Ų | 42.3 | 36% | 0.361 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -69.6 | -48.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | Y291 S292 F296 K297 D298 | Y291-G294 WeakPolarHBondContact O-CA 3.36Å; Y291-G294 PolarHBondContact O-N 3.31Å; S292-G294 VanDerWaalsContact C-N 3.26Å; S292-G294 PolarHBondContact O-N 3.13Å; G294-F296 VanDerWaalsContact C-N 3.33Å; G294-F296 PolarHBondContact O-N 2.92Å; G294-K297 WeakPolarHBondContact O-CB 3.43Å; G294-K297 PolarHBondContact O-N 2.91Å; G294-K297 VanDerWaalsContact O-N 3.12Å; G294-D298 VanDerWaalsContact O-CG 3.3Å; G294-D298 PolarHBondContact O-N 3.44Å |
| 295 | I | 74.3 | Confident | 77 | Confident | 21 Ų | 21 | 44.3 Ų | 44.3 | 11% | 0.108 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.3 | -43.6 | 179.3 | -63.1 | 161.4 | 0 | 0 | 0 | 111.3 | Y291 S292 D298 A299 I370 F432 | Y291-I295 WeakPolarHBondContact O-CG1 2.99Å; Y291-I295 PolarHBondContact O-N 3.03Å; S292-I295 PolarHBondContact O-N 3.32Å; I295-D298 PolarHBondContact O-N 3.46Å; I295-A299 WeakPolarHBondContact O-CB 3.18Å; I295-A299 PolarHBondContact O-N 2.9Å; I295-I370 HydrophobicContact CG2-CD1 3.82Å; I295-F432 HydrophobicContact CD1-CZ 4.01Å |
| 296 | F | 80.7 | Confident | 76.9 | Confident | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -65.9 | -39.2 | 176.8 | -72 | -44 | 0 | 0 | 0 | 111.8 | S292 G294 A299 G300 V301 P304 A307 I367 I370 | S292-F296 WeakPolarHBondContact O-CB 3.34Å; S292-F296 WeakPolarHBondContact O-CD2 3.24Å; S292-F296 VanDerWaalsContact O-CG 3.3Å; S292-F296 WeakPolarHBondContact O-CG 3.41Å; S292-F296 PolarHBondContact O-N 2.97Å; G294-F296 VanDerWaalsContact C-N 3.33Å; G294-F296 PolarHBondContact O-N 2.92Å; F296-A299 CarbonylContact O-C 3.56Å; F296-A299 PolarHBondContact O-N 2.72Å; F296-G300 PolarHBondContact O-N 3.12Å; F296-V301 HydrophobicContact CB-CB 4.08Å; F296-V301 HydrophobicContact CB-CG2 3.94Å; F296-V301 HydrophobicContact CD1-CG2 4.36Å; F296-V301 HydrophobicContact CG-CG2 4.48Å; F296-V301 VanDerWaalsContact O-CB 3.24Å; F296-V301 WeakPolarHBondContact O-CB 3.24Å; F296-V301 VanDerWaalsContact O-CG2 3.31Å; F296-V301 WeakPolarHBondContact O-CG2 3.3Å; F296-V301 PolarHBondContact O-N 3.42Å; F296-P304 HydrophobicContact CB-CB 3.96Å; F296-A307 HydrophobicContact CB-CB 4.47Å; F296-A307 HydrophobicContact CD1-CB 4.14Å; F296-A307 HydrophobicContact CD2-CB 3.53Å; F296-A307 HydrophobicContact CE1-CB 4.21Å; F296-A307 HydrophobicContact CE2-CB 3.63Å; F296-A307 HydrophobicContact CG-CB 3.82Å; F296-A307 HydrophobicContact CZ-CB 3.97Å; F296-I367 HydrophobicContact CD1-CG1 3.94Å; F296-I367 HydrophobicContact CE1-CB 4.31Å; F296-I367 HydrophobicContact CE1-CG1 4.1Å; F296-I367 HydrophobicContact CE1-CG2 4.05Å; F296-I370 HydrophobicContact CD1-CD1 3.83Å; F296-I370 HydrophobicContact CE1-CB 4.13Å; F296-I370 HydrophobicContact CE1-CD1 3.33Å; F296-I370 HydrophobicContact CE1-CG1 4.29Å; F296-I370 HydrophobicContact CE1-CG2 4.09Å; F296-I370 HydrophobicContact CZ-CB 4.2Å; F296-I370 HydrophobicContact CZ-CD1 3.96Å; F296-I370 HydrophobicContact CZ-CG2 3.67Å |
| 297 | K | 79.9 | Confident | 77.1 | Confident | 145 Ų | 145 | 50 Ų | 50 | 63% | 0.63 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -62.4 | -45.1 | 174.1 | -169 | 176 | 179 | -180 | 0 | 111.5 | T293 G294 A299 G300 P304 | T293-K297 WeakPolarHBondContact O-CB 3.44Å; T293-K297 PolarHBondContact O-N 3.2Å; T293-K297 VanDerWaalsContact O-N 3.13Å; G294-K297 WeakPolarHBondContact O-CB 3.43Å; G294-K297 PolarHBondContact O-N 2.91Å; G294-K297 VanDerWaalsContact O-N 3.12Å; K297-A299 PolarHBondContact O-N 3.26Å; K297-G300 WeakPolarHBondContact O-CA 3.31Å; K297-G300 PolarHBondContact O-N 3.11Å; K297-P304 HydrophobicContact CB-CG 3.74Å; K297-P304 HydrophobicContact CG-CG 4.26Å |
| 298 | D | 72.8 | Confident | 77.3 | Confident | 111 Ų | 111 | 50.1 Ų | 50.1 | 59% | 0.594 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -67.8 | -26.4 | 178.3 | -66.7 | -15.5 | 0 | 0 | 0 | 112.4 | G294 I295 G300 K356 | G294-D298 VanDerWaalsContact O-CG 3.3Å; G294-D298 PolarHBondContact O-N 3.44Å; I295-D298 PolarHBondContact O-N 3.46Å; D298-G300 VanDerWaalsContact C-N 3.25Å; D298-K356 VanDerWaalsContact O-CE 3.31Å; D298-K356 WeakPolarHBondContact O-CE 3.39Å; D298-K356 PolarHBondContact O-NZ 3.01Å |
| 299 | A | 71.8 | Confident | 77.7 | Confident | 3 Ų | 3 | 51.1 Ų | 51.1 | 3% | 0.025 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -3.7 | 169.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | I295 F296 K297 S363 | I295-A299 WeakPolarHBondContact O-CB 3.18Å; I295-A299 PolarHBondContact O-N 2.9Å; F296-A299 CarbonylContact O-C 3.56Å; F296-A299 PolarHBondContact O-N 2.72Å; K297-A299 PolarHBondContact O-N 3.26Å; A299-S363 WeakPolarHBondContact O-CB 3.33Å; A299-S363 PolarHBondContact O-OG 2.98Å |
| 300 | G | 73.7 | Confident | 78.3 | Confident | 55 Ų | 55 | 51.9 Ų | 51.9 | 57% | 0.567 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.7 | 17.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | F296 K297 D298 Q302 | F296-G300 PolarHBondContact O-N 3.12Å; K297-G300 WeakPolarHBondContact O-CA 3.31Å; K297-G300 PolarHBondContact O-N 3.11Å; D298-G300 VanDerWaalsContact C-N 3.25Å; G300-Q302 PolarHBondContact O-N 3.33Å |
| 301 | V | 79.6 | Confident | 79.2 | Confident | 30 Ų | 30 | 50.9 Ų | 50.9 | 18% | 0.182 | 28% | 0.278 | C | S | . | . | trans | -70.8 | 122.2 | 170.9 | -178.7 | 0 | 0 | 0 | 0 | 109.3 | F296 E303 P304 A307 I367 | F296-V301 HydrophobicContact CB-CB 4.08Å; F296-V301 HydrophobicContact CB-CG2 3.94Å; F296-V301 HydrophobicContact CD1-CG2 4.36Å; F296-V301 HydrophobicContact CG-CG2 4.48Å; F296-V301 VanDerWaalsContact O-CB 3.24Å; F296-V301 WeakPolarHBondContact O-CB 3.24Å; F296-V301 VanDerWaalsContact O-CG2 3.31Å; F296-V301 WeakPolarHBondContact O-CG2 3.3Å; F296-V301 PolarHBondContact O-N 3.42Å; V301-E303 PolarHBondContact O-N 3.48Å; V301-P304 WeakPolarHBondContact O-CD 3.24Å; V301-P304 WeakPolarHBondContact O-CG 3.5Å; V301-A307 HydrophobicContact CG1-CB 4.28Å; V301-I367 HydrophobicContact CG2-CD1 3.35Å; V301-I367 HydrophobicContact CG2-CG1 3.95Å | ||
| 302 | Q | 76.8 | Confident | 80.1 | Confident | 177 Ų | 177 | 47.5 Ų | 47.5 | 83% | 0.827 | 26% | 0.264 | S | S | * | . | S | Bend | trans | -63.2 | -40.3 | -178.5 | -63.8 | -62.3 | -28.6 | 0 | 0 | 112.5 | G300 P304 | G300-Q302 PolarHBondContact O-N 3.33Å; Q302-P304 WeakPolarHBondContact O-CD 3.32Å |
| 303 | E | 81.7 | Confident | 80.9 | Confident | 119 Ų | 119 | 50.2 Ų | 50.2 | 56% | 0.556 | 28% | 0.281 | S | S | * | . | S | Bend | trans | -124.6 | 78 | 180 | -61.5 | 178.9 | 151.6 | 0 | 0 | 110.9 | V301 I305 Y306 | V301-E303 PolarHBondContact O-N 3.48Å; E303-I305 PolarHBondContact O-N 2.95Å; E303-I305 VanDerWaalsContact O-N 3.08Å; E303-Y306 HydrophobicContact CB-CD2 3.52Å; E303-Y306 HydrophobicContact CB-CE2 3.99Å; E303-Y306 HydrophobicContact CG-CD2 4.28Å; E303-Y306 HydrophobicContact CG-CE2 4.32Å; E303-Y306 PolarHBondContact O-N 3.44Å; E303-Y306 WeakPolarHBondContact OE2-CD2 3.42Å; E303-Y306 WeakPolarHBondContact OE2-CE2 3.35Å |
| 304 | P | 80.1 | Confident | 81.8 | Confident | 19 Ų | 19 | 49.5 Ų | 49.5 | 12% | 0.123 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -57.6 | -27.9 | -173.1 | -27.7 | 36 | 0 | 0 | 0 | 114.6 | T293 F296 K297 V301 Q302 Y306 A307 T308 | T293-P304 HydrophobicContact CG2-CB 3.67Å; T293-P304 VanDerWaalsContact O-CB 3.26Å; T293-P304 WeakPolarHBondContact O-CB 3.48Å; F296-P304 HydrophobicContact CB-CB 3.96Å; K297-P304 HydrophobicContact CB-CG 3.74Å; K297-P304 HydrophobicContact CG-CG 4.26Å; V301-P304 WeakPolarHBondContact O-CD 3.24Å; V301-P304 WeakPolarHBondContact O-CG 3.5Å; Q302-P304 WeakPolarHBondContact O-CD 3.32Å; P304-Y306 VanDerWaalsContact C-N 3.32Å; P304-Y306 PolarHBondContact O-N 2.93Å; P304-A307 PolarHBondContact O-N 2.81Å; P304-T308 PolarHBondContact O-N 3.42Å; P304-T308 PolarHBondContact O-OG1 2.98Å |
| 305 | I | 80.8 | Confident | 82.8 | Confident | 42 Ų | 42 | 47.8 Ų | 47.8 | 22% | 0.215 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.3 | -37.5 | -178.8 | -165.1 | 64.6 | 0 | 0 | 0 | 112.2 | A33 L174 E303 T308 I309 | A33-I305 HydrophobicContact CB-CD1 4.1Å; L174-I305 HydrophobicContact CD2-CG1 3.84Å; L174-I305 HydrophobicContact CD2-CG2 4.08Å; E303-I305 PolarHBondContact O-N 2.95Å; E303-I305 VanDerWaalsContact O-N 3.08Å; I305-T308 WeakPolarHBondContact O-CB 3.39Å; I305-T308 PolarHBondContact O-N 2.89Å; I305-I309 WeakPolarHBondContact O-CG1 3.36Å; I305-I309 PolarHBondContact O-N 2.95Å |
| 306 | Y | 85 | Confident | 83.7 | Confident | 115 Ų | 115 | 48 Ų | 48 | 45% | 0.451 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -72.5 | -33.1 | 178.3 | -64 | -60.5 | 0 | 0 | 0 | 112 | L174 E303 P304 T308 I309 G310 | L174-Y306 HydrophobicContact CD2-CE1 4.15Å; E303-Y306 HydrophobicContact CB-CD2 3.52Å; E303-Y306 HydrophobicContact CB-CE2 3.99Å; E303-Y306 HydrophobicContact CG-CD2 4.28Å; E303-Y306 HydrophobicContact CG-CE2 4.32Å; E303-Y306 PolarHBondContact O-N 3.44Å; E303-Y306 WeakPolarHBondContact OE2-CD2 3.42Å; E303-Y306 WeakPolarHBondContact OE2-CE2 3.35Å; P304-Y306 VanDerWaalsContact C-N 3.32Å; P304-Y306 PolarHBondContact O-N 2.93Å; Y306-T308 VanDerWaalsContact C-N 3.35Å; Y306-I309 HydrophobicContact CD1-CD1 4.37Å; Y306-I309 PolarHBondContact O-N 3.36Å; Y306-G310 PolarHBondContact O-N 3.39Å |
| 307 | A | 84.1 | Confident | 84.4 | Confident | 21 Ų | 21 | 52.3 Ų | 52.3 | 17% | 0.174 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -66.1 | -39.5 | 172 | 0 | 0 | 0 | 0 | 0 | 111.3 | F296 V301 P304 G310 A311 | F296-A307 HydrophobicContact CB-CB 4.47Å; F296-A307 HydrophobicContact CD1-CB 4.14Å; F296-A307 HydrophobicContact CD2-CB 3.53Å; F296-A307 HydrophobicContact CE1-CB 4.21Å; F296-A307 HydrophobicContact CE2-CB 3.63Å; F296-A307 HydrophobicContact CG-CB 3.82Å; F296-A307 HydrophobicContact CZ-CB 3.97Å; V301-A307 HydrophobicContact CG1-CB 4.28Å; P304-A307 PolarHBondContact O-N 2.81Å; A307-G310 PolarHBondContact O-N 3.44Å; A307-A311 PolarHBondContact O-N 3.28Å |
| 308 | T | 84.6 | Confident | 85.1 | Confident | 4 Ų | 4 | 48.5 Ų | 48.5 | 3% | 0.025 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.3 | -42.3 | 173.6 | -60.9 | 0 | 0 | 0 | 0 | 112.1 | Q170 S292 T293 P304 I305 Y306 G310 A311 G312 | Q170-T308 HydrophobicContact CG-CG2 4.45Å; Q170-T308 PolarHBondContact NE2-O 3.05Å; Q170-T308 PolarHBondContact OE1-O 3.19Å; S292-T308 WeakPolarHBondContact OG-CG2 3.17Å; S292-T308 PolarHBondContact OG-OG1 2.81Å; T293-T308 PolarHBondContact OG1-OG1 3.31Å; P304-T308 PolarHBondContact O-N 3.42Å; P304-T308 PolarHBondContact O-OG1 2.98Å; I305-T308 WeakPolarHBondContact O-CB 3.39Å; I305-T308 PolarHBondContact O-N 2.89Å; Y306-T308 VanDerWaalsContact C-N 3.35Å; T308-G310 VanDerWaalsContact C-N 3.34Å; T308-A311 WeakPolarHBondContact O-CB 3.48Å; T308-A311 PolarHBondContact O-N 3.45Å; T308-G312 PolarHBondContact O-N 3.08Å |
| 309 | I | 87.9 | Confident | 86 | Confident | 24 Ų | 24 | 43.2 Ų | 43.2 | 12% | 0.123 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63 | -41.8 | 172 | -68.5 | 166.1 | 0 | 0 | 0 | 110.6 | L167 Q170 I171 L174 I305 Y306 A311 G312 V313 | L167-I309 HydrophobicContact CD1-CG2 4.11Å; Q170-I309 HydrophobicContact CB-CG1 3.98Å; I171-I309 HydrophobicContact CG1-CG2 4.43Å; L174-I309 HydrophobicContact CD1-CD1 3.94Å; L174-I309 HydrophobicContact CD2-CD1 3.87Å; L174-I309 HydrophobicContact CG-CD1 4.04Å; I305-I309 WeakPolarHBondContact O-CG1 3.36Å; I305-I309 PolarHBondContact O-N 2.95Å; Y306-I309 HydrophobicContact CD1-CD1 4.37Å; Y306-I309 PolarHBondContact O-N 3.36Å; I309-A311 VanDerWaalsContact C-N 3.29Å; I309-A311 PolarHBondContact O-N 3.22Å; I309-G312 CarbonylContact O-C 3.4Å; I309-G312 WeakPolarHBondContact O-CA 3.4Å; I309-G312 PolarHBondContact O-N 2.77Å; I309-V313 HydrophobicContact CG2-CG2 4.47Å; I309-V313 WeakPolarHBondContact O-CG2 3.46Å; I309-V313 PolarHBondContact O-N 2.92Å |
| 310 | G | 89.1 | Confident | 87 | Confident | 27 Ų | 27 | 45.8 Ų | 45.8 | 28% | 0.278 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -57 | -42.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y306 A307 T308 G312 V313 V314 | Y306-G310 PolarHBondContact O-N 3.39Å; A307-G310 PolarHBondContact O-N 3.44Å; T308-G310 VanDerWaalsContact C-N 3.34Å; G310-G312 PolarHBondContact O-N 3.24Å; G310-V313 PolarHBondContact O-N 2.92Å; G310-V314 WeakPolarHBondContact O-CG2 3.26Å; G310-V314 PolarHBondContact O-N 3.41Å |
| 311 | A | 87.9 | Confident | 87.9 | Confident | 2 Ų | 2 | 45.8 Ų | 45.8 | 2% | 0.017 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.9 | -41 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A307 T308 I309 V313 V314 N315 L371 | A307-A311 PolarHBondContact O-N 3.28Å; T308-A311 WeakPolarHBondContact O-CB 3.48Å; T308-A311 PolarHBondContact O-N 3.45Å; I309-A311 VanDerWaalsContact C-N 3.29Å; I309-A311 PolarHBondContact O-N 3.22Å; A311-V313 PolarHBondContact O-N 3.22Å; A311-V314 PolarHBondContact O-N 2.93Å; A311-N315 VanDerWaalsContact O-CB 3.23Å; A311-N315 WeakPolarHBondContact O-CB 3.3Å; A311-N315 PolarHBondContact O-N 3.48Å; A311-L371 HydrophobicContact CB-CD2 3.97Å |
| 312 | G | 89.3 | Confident | 88.3 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.3 | -35.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114 | T308 I309 G310 N315 T316 | T308-G312 PolarHBondContact O-N 3.08Å; I309-G312 CarbonylContact O-C 3.4Å; I309-G312 WeakPolarHBondContact O-CA 3.4Å; I309-G312 PolarHBondContact O-N 2.77Å; G310-G312 PolarHBondContact O-N 3.24Å; G312-N315 WeakPolarHBondContact O-CB 3.47Å; G312-N315 PolarHBondContact O-N 3.29Å; G312-T316 PolarHBondContact O-N 2.7Å; G312-T316 PolarHBondContact O-OG1 3.35Å |
| 313 | V | 93.6 | Very high | 88.7 | Confident | 60 Ų | 60 | 37.5 Ų | 37.5 | 36% | 0.364 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -67.7 | -47.3 | 173.6 | 172.4 | 0 | 0 | 0 | 0 | 110.6 | L167 I309 G310 A311 N315 T316 I317 | L167-V313 HydrophobicContact CD1-CG2 3.93Å; L167-V313 HydrophobicContact CD2-CG2 4.29Å; I309-V313 HydrophobicContact CG2-CG2 4.47Å; I309-V313 WeakPolarHBondContact O-CG2 3.46Å; I309-V313 PolarHBondContact O-N 2.92Å; G310-V313 PolarHBondContact O-N 2.92Å; A311-V313 PolarHBondContact O-N 3.22Å; V313-N315 VanDerWaalsContact C-N 3.28Å; V313-N315 PolarHBondContact O-N 3.37Å; V313-T316 PolarHBondContact O-N 3.11Å; V313-I317 HydrophobicContact CG1-CD1 3.77Å; V313-I317 HydrophobicContact CG1-CG1 4.4Å; V313-I317 WeakPolarHBondContact O-CG1 3.4Å; V313-I317 PolarHBondContact O-N 3.12Å |
| 314 | V | 93.9 | Very high | 88.9 | Confident | 29 Ų | 29 | 38.2 Ų | 38.2 | 18% | 0.176 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -58.5 | -44.5 | 174.9 | 171.5 | 0 | 0 | 0 | 0 | 110.4 | G310 A311 T316 I317 F318 L371 A375 | G310-V314 WeakPolarHBondContact O-CG2 3.26Å; G310-V314 PolarHBondContact O-N 3.41Å; A311-V314 PolarHBondContact O-N 2.93Å; V314-T316 VanDerWaalsContact C-N 3.35Å; V314-T316 PolarHBondContact O-N 3.23Å; V314-I317 PolarHBondContact O-N 2.91Å; V314-F318 HydrophobicContact CG1-CD2 3.76Å; V314-F318 HydrophobicContact CG1-CE2 4.03Å; V314-F318 WeakPolarHBondContact O-CD2 3.31Å; V314-F318 PolarHBondContact O-N 3.5Å; V314-L371 WeakPolarHBondContact CG1-O 3.39Å; V314-L371 HydrophobicContact CG2-CD2 4.18Å; V314-A375 HydrophobicContact CG1-CB 3.89Å |
| 315 | N | 91.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -52.9 | -53.2 | 174.8 | -166.2 | -130 | 0 | 0 | 0 | 110.5 | V163 F289 A311 G312 V313 I317 F318 T319 V374 E378 | V163-N315 WeakPolarHBondContact CB-OD1 2.89Å; V163-N315 WeakPolarHBondContact CG1-OD1 3.18Å; F289-N315 HydrophobicContact CZ-CB 4.21Å; A311-N315 VanDerWaalsContact O-CB 3.23Å; A311-N315 WeakPolarHBondContact O-CB 3.3Å; A311-N315 PolarHBondContact O-N 3.48Å; G312-N315 WeakPolarHBondContact O-CB 3.47Å; G312-N315 PolarHBondContact O-N 3.29Å; V313-N315 VanDerWaalsContact C-N 3.28Å; V313-N315 PolarHBondContact O-N 3.37Å; N315-I317 PolarHBondContact O-N 2.77Å; N315-F318 PolarHBondContact O-N 3.29Å; N315-T319 PolarHBondContact O-N 3.23Å; N315-T319 PolarHBondContact O-OG1 3.08Å; N315-V374 HydrophobicContact CB-CG1 3.58Å; N315-E378 WeakPolarHBondContact ND2-CG 3.46Å; N315-E378 PolarHBondContact ND2-OE1 3.5Å; N315-E378 WeakPolarHBondContact O-CG 3.1Å |
| 316 | T | 93.4 | Very high | 89.6 | Confident | 24 Ų | 24 | 38.3 Ų | 38.3 | 15% | 0.147 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.7 | -45.5 | 179.3 | -55.2 | 0 | 0 | 0 | 0 | 113 | L160 V163 V164 G312 V313 V314 F318 T319 V320 | L160-T316 HydrophobicContact CD1-CG2 4.31Å; V163-T316 HydrophobicContact CG2-CG2 4.44Å; V164-T316 HydrophobicContact CG2-CG2 4.07Å; G312-T316 PolarHBondContact O-N 2.7Å; G312-T316 PolarHBondContact O-OG1 3.35Å; V313-T316 PolarHBondContact O-N 3.11Å; V314-T316 VanDerWaalsContact C-N 3.35Å; V314-T316 PolarHBondContact O-N 3.23Å; T316-F318 PolarHBondContact O-N 3.33Å; T316-T319 PolarHBondContact O-N 2.8Å; T316-V320 WeakPolarHBondContact O-CG2 3.49Å; T316-V320 PolarHBondContact O-N 3.24Å |
| 317 | I | 95.6 | Very high | 89.3 | Confident | 92 Ų | 92 | 35.3 Ų | 35.3 | 47% | 0.472 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -60.9 | -48.3 | -179.8 | -69.5 | 168.2 | 0 | 0 | 0 | 110.5 | V313 V314 N315 T319 V320 V321 | V313-I317 HydrophobicContact CG1-CD1 3.77Å; V313-I317 HydrophobicContact CG1-CG1 4.4Å; V313-I317 WeakPolarHBondContact O-CG1 3.4Å; V313-I317 PolarHBondContact O-N 3.12Å; V314-I317 PolarHBondContact O-N 2.91Å; N315-I317 PolarHBondContact O-N 2.77Å; I317-T319 VanDerWaalsContact C-N 3.33Å; I317-T319 PolarHBondContact O-N 3.23Å; I317-V320 WeakPolarHBondContact O-CB 3.49Å; I317-V320 PolarHBondContact O-N 3.03Å; I317-V320 VanDerWaalsContact O-N 3.17Å; I317-V321 WeakPolarHBondContact O-CG2 3.42Å; I317-V321 PolarHBondContact O-N 3.21Å |
| 318 | F | 94.6 | Very high | 89.4 | Confident | 65 Ų | 65 | 43.8 Ų | 43.8 | 29% | 0.285 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -73.5 | -24.4 | -176.2 | -82.3 | -90.9 | 0 | 0 | 0 | 113 | V314 N315 T316 V321 S322 A375 E378 I379 | V314-F318 HydrophobicContact CG1-CD2 3.76Å; V314-F318 HydrophobicContact CG1-CE2 4.03Å; V314-F318 WeakPolarHBondContact O-CD2 3.31Å; V314-F318 PolarHBondContact O-N 3.5Å; N315-F318 PolarHBondContact O-N 3.29Å; T316-F318 PolarHBondContact O-N 3.33Å; F318-V321 PolarHBondContact O-N 2.73Å; F318-S322 WeakPolarHBondContact O-CB 3.38Å; F318-S322 PolarHBondContact O-N 2.95Å; F318-A375 HydrophobicContact CB-CB 4.42Å; F318-A375 HydrophobicContact CD1-CB 3.8Å; F318-A375 HydrophobicContact CD2-CB 3.45Å; F318-A375 VanDerWaalsContact CD2-CB 3.45Å; F318-A375 HydrophobicContact CE1-CB 3.81Å; F318-A375 HydrophobicContact CE2-CB 3.47Å; F318-A375 VanDerWaalsContact CE2-CB 3.47Å; F318-A375 HydrophobicContact CG-CB 3.61Å; F318-A375 HydrophobicContact CZ-CB 3.64Å; F318-E378 HydrophobicContact CB-CB 3.77Å; F318-I379 HydrophobicContact CD1-CD1 3.92Å; F318-I379 HydrophobicContact CD1-CG1 3.9Å; F318-I379 HydrophobicContact CE1-CD1 4.14Å |
| 319 | T | 91.7 | Very high | 89.6 | Confident | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.1 | -40.6 | 168.1 | -49.5 | 0 | 0 | 0 | 0 | 111.4 | T156 Q159 L160 V163 N315 T316 I317 S322 L323 E378 | T156-T319 HydrophobicContact CG2-CG2 4.36Å; Q159-T319 HydrophobicContact CB-CG2 4.02Å; Q159-T319 HydrophobicContact CG-CG2 3.73Å; L160-T319 HydrophobicContact CB-CG2 4.09Å; L160-T319 HydrophobicContact CD1-CG2 4.23Å; V163-T319 WeakPolarHBondContact CG1-OG1 3.46Å; V163-T319 HydrophobicContact CG2-CG2 4.23Å; N315-T319 PolarHBondContact O-N 3.23Å; N315-T319 PolarHBondContact O-OG1 3.08Å; T316-T319 PolarHBondContact O-N 2.8Å; I317-T319 VanDerWaalsContact C-N 3.33Å; I317-T319 PolarHBondContact O-N 3.23Å; T319-S322 WeakPolarHBondContact O-CB 3.42Å; T319-S322 PolarHBondContact O-N 2.9Å; T319-L323 PolarHBondContact O-N 3.36Å; T319-E378 WeakPolarHBondContact OG1-CG 3.45Å; T319-E378 PolarHBondContact OG1-OE2 2.78Å |
| 320 | V | 92.1 | Very high | 89.6 | Confident | 57 Ų | 57 | 44.1 Ų | 44.1 | 35% | 0.345 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -64.4 | -41.1 | 173.8 | 175.7 | 0 | 0 | 0 | 0 | 110.9 | L160 T316 I317 S322 L323 F324 | L160-V320 HydrophobicContact CD1-CG2 3.74Å; L160-V320 HydrophobicContact CD2-CG2 4.46Å; T316-V320 WeakPolarHBondContact O-CG2 3.49Å; T316-V320 PolarHBondContact O-N 3.24Å; I317-V320 WeakPolarHBondContact O-CB 3.49Å; I317-V320 PolarHBondContact O-N 3.03Å; I317-V320 VanDerWaalsContact O-N 3.17Å; V320-S322 VanDerWaalsContact C-N 3.34Å; V320-S322 PolarHBondContact O-N 3.2Å; V320-L323 WeakPolarHBondContact O-CB 3.5Å; V320-L323 PolarHBondContact O-N 2.95Å; V320-F324 HydrophobicContact CG1-CD2 4.26Å; V320-F324 HydrophobicContact CG1-CE2 3.78Å; V320-F324 WeakPolarHBondContact O-CD2 3.32Å; V320-F324 PolarHBondContact O-N 3.32Å |
| 321 | V | 92.3 | Very high | 89.6 | Confident | 55 Ų | 55 | 43.1 Ų | 43.1 | 33% | 0.333 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -59.3 | -45.9 | 173.9 | 172.6 | 0 | 0 | 0 | 0 | 110.9 | I317 F318 L323 F324 L325 | I317-V321 WeakPolarHBondContact O-CG2 3.42Å; I317-V321 PolarHBondContact O-N 3.21Å; F318-V321 PolarHBondContact O-N 2.73Å; V321-L323 VanDerWaalsContact C-N 3.31Å; V321-L323 PolarHBondContact O-N 3.09Å; V321-F324 PolarHBondContact O-N 3.47Å; V321-L325 HydrophobicContact CG1-CD1 3.63Å; V321-L325 HydrophobicContact CG1-CG 4.23Å; V321-L325 WeakPolarHBondContact O-CG 3.41Å; V321-L325 PolarHBondContact O-N 3.08Å; V321-L325 VanDerWaalsContact O-N 3.14Å |
| 322 | S | 88.2 | Confident | 89.9 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.007 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -59.3 | -40.3 | 178.3 | -168.6 | 0 | 0 | 0 | 0 | 112.5 | F318 T319 V320 F324 L325 V326 E378 I379 P383 | F318-S322 WeakPolarHBondContact O-CB 3.38Å; F318-S322 PolarHBondContact O-N 2.95Å; T319-S322 WeakPolarHBondContact O-CB 3.42Å; T319-S322 PolarHBondContact O-N 2.9Å; V320-S322 VanDerWaalsContact C-N 3.34Å; V320-S322 PolarHBondContact O-N 3.2Å; S322-F324 VanDerWaalsContact C-N 3.26Å; S322-F324 PolarHBondContact O-N 3.19Å; S322-L325 PolarHBondContact O-N 3.2Å; S322-V326 WeakPolarHBondContact O-CB 3.35Å; S322-V326 PolarHBondContact O-N 3.4Å; S322-E378 WeakPolarHBondContact CB-O 3.38Å; S322-E378 PolarHBondContact OG-O 3.37Å; S322-I379 PolarHBondContact OG-O 3.44Å; S322-P383 WeakPolarHBondContact OG-CG 3.28Å |
| 323 | L | 85.3 | Confident | 90.1 | Very high | 31 Ų | 31 | 48.6 Ų | 48.6 | 16% | 0.162 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -55.4 | -38.3 | 176.7 | -177.4 | 149.1 | 0 | 0 | 0 | 112.9 | T156 L157 T319 V320 V321 | T156-L323 HydrophobicContact CG2-CB 3.77Å; T156-L323 HydrophobicContact CG2-CD1 4.49Å; T156-L323 HydrophobicContact CG2-CG 4.42Å; L157-L323 HydrophobicContact CD2-CD1 3.51Å; L157-L323 HydrophobicContact CG-CD1 4.03Å; T319-L323 PolarHBondContact O-N 3.36Å; V320-L323 WeakPolarHBondContact O-CB 3.5Å; V320-L323 PolarHBondContact O-N 2.95Å; V321-L323 VanDerWaalsContact C-N 3.31Å; V321-L323 PolarHBondContact O-N 3.09Å |
| 324 | F | 86.8 | Confident | 90.2 | Very high | 134 Ų | 134 | 46 Ų | 46 | 59% | 0.588 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -82.9 | -25.5 | 177.7 | -67.4 | -69.9 | 0 | 0 | 0 | 113.6 | V320 V321 S322 | V320-F324 HydrophobicContact CG1-CD2 4.26Å; V320-F324 HydrophobicContact CG1-CE2 3.78Å; V320-F324 WeakPolarHBondContact O-CD2 3.32Å; V320-F324 PolarHBondContact O-N 3.32Å; V321-F324 PolarHBondContact O-N 3.47Å; S322-F324 VanDerWaalsContact C-N 3.26Å; S322-F324 PolarHBondContact O-N 3.19Å |
| 325 | L | 88.7 | Confident | 90.3 | Very high | 64 Ų | 64 | 44.7 Ų | 44.7 | 34% | 0.335 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -87.1 | -28.3 | -177.6 | -68.7 | -179.3 | 0 | 0 | 0 | 113.3 | V321 S322 E327 R328 A329 L334 | V321-L325 HydrophobicContact CG1-CD1 3.63Å; V321-L325 HydrophobicContact CG1-CG 4.23Å; V321-L325 WeakPolarHBondContact O-CG 3.41Å; V321-L325 PolarHBondContact O-N 3.08Å; V321-L325 VanDerWaalsContact O-N 3.14Å; S322-L325 PolarHBondContact O-N 3.2Å; L325-E327 VanDerWaalsContact C-N 3.28Å; L325-E327 PolarHBondContact O-N 3.5Å; L325-R328 PolarHBondContact O-N 3.27Å; L325-A329 PolarHBondContact O-N 2.89Å; L325-L334 HydrophobicContact CB-CD1 4.04Å; L325-L334 HydrophobicContact CB-CD2 4.21Å; L325-L334 HydrophobicContact CD1-CD2 4.5Å |
| 326 | V | 85.5 | Confident | 90.6 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.1 | -36.5 | -171.5 | 72.7 | 0 | 0 | 0 | 0 | 113.5 | S322 G330 R331 L334 F387 | S322-V326 WeakPolarHBondContact O-CB 3.35Å; S322-V326 PolarHBondContact O-N 3.4Å; V326-G330 PolarHBondContact O-N 3.29Å; V326-R331 HydrophobicContact CG2-CG 4.39Å; V326-R331 PolarHBondContact O-NH1 3Å; V326-L334 HydrophobicContact CB-CD1 4.2Å; V326-F387 HydrophobicContact CG2-CE2 4.44Å; V326-F387 HydrophobicContact CG2-CZ 3.71Å |
| 327 | E | 80.3 | Confident | 90.8 | Very high | 51 Ų | 51 | 49.2 Ų | 49.2 | 24% | 0.238 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -83.4 | -15.9 | 176.2 | -58.4 | -57.1 | 165.7 | 0 | 0 | 113 | G152 A153 L325 R331 R454 | G152-E327 WeakPolarHBondContact CA-OE1 3.31Å; G152-E327 PolarHBondContact N-OE1 3.3Å; A153-E327 HydrophobicContact CB-CG 4.26Å; A153-E327 PolarHBondContact N-OE1 3.34Å; A153-E327 VanDerWaalsContact N-OE1 3.11Å; L325-E327 VanDerWaalsContact C-N 3.28Å; L325-E327 PolarHBondContact O-N 3.5Å; E327-R331 IonicContact OE1-CZ 2.77Å; E327-R331 IonicContact OE1-NH1 3.61Å; E327-R331 IonicContact OE1-NH2 2.66Å; E327-R331 PolarHBondContact OE1-NH2 2.95Å; E327-R331 IonicContact OE2-CZ 2.7Å; E327-R331 IonicContact OE2-NH1 2.81Å; E327-R331 PolarHBondContact OE2-NH1 3.04Å; E327-R331 IonicContact OE2-NH2 3.86Å; E327-R331 PolarHBondContact OE2-NH2 3.01Å; E327-R454 WeakPolarHBondContact O-CD 3.45Å; E327-R454 PolarHBondContact O-NH1 2.92Å |
| 328 | R | 85.5 | Confident | 90.9 | Very high | 199 Ų | 199 | 44.9 Ų | 44.9 | 75% | 0.751 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -94.8 | -42 | -179 | -65.2 | -175.4 | -179.6 | -167.9 | 1.4 | 113.7 | L325 R454 | L325-R328 PolarHBondContact O-N 3.27Å; R328-R454 PolarHBondContact O-NH1 2.78Å |
| 329 | A | 88.6 | Confident | 91 | Very high | 36 Ų | 36 | 41.8 Ų | 41.8 | 30% | 0.298 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -96.8 | -21.4 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L325 T333 L334 | L325-A329 PolarHBondContact O-N 2.89Å; A329-T333 WeakPolarHBondContact O-CB 3.27Å; A329-T333 PolarHBondContact O-OG1 2.86Å; A329-L334 HydrophobicContact CB-CD1 4.39Å; A329-L334 HydrophobicContact CB-CD2 3.8Å; A329-L334 HydrophobicContact CB-CG 3.9Å |
| 330 | G | 87.3 | Confident | 91.3 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.215 | C | C | . | . | trans | 87.1 | 159.5 | -173.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | V326 L334 E452 | V326-G330 PolarHBondContact O-N 3.29Å; G330-L334 WeakPolarHBondContact O-CG 3.28Å; G330-L334 PolarHBondContact O-N 3.45Å; G330-E452 WeakPolarHBondContact CA-OE2 3.41Å | ||
| 331 | R | 90.4 | Very high | 91.6 | Very high | 6 Ų | 6 | 40.5 Ų | 40.5 | 2% | 0.023 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -71.3 | -43.6 | -173.7 | -69.8 | 72.7 | 169.3 | 142.5 | -0.9 | 110.3 | V326 E327 T333 L334 H335 I384 F387 I388 E391 E452 T453 | V326-R331 HydrophobicContact CG2-CG 4.39Å; V326-R331 PolarHBondContact O-NH1 3Å; E327-R331 IonicContact OE1-CZ 2.77Å; E327-R331 IonicContact OE1-NH1 3.61Å; E327-R331 IonicContact OE1-NH2 2.66Å; E327-R331 PolarHBondContact OE1-NH2 2.95Å; E327-R331 IonicContact OE2-CZ 2.7Å; E327-R331 IonicContact OE2-NH1 2.81Å; E327-R331 PolarHBondContact OE2-NH1 3.04Å; E327-R331 IonicContact OE2-NH2 3.86Å; E327-R331 PolarHBondContact OE2-NH2 3.01Å; R331-T333 PolarHBondContact O-N 3.32Å; R331-L334 PolarHBondContact O-N 3.13Å; R331-H335 WeakPolarHBondContact O-CB 3.3Å; R331-H335 PolarHBondContact O-N 2.92Å; R331-I384 HydrophobicContact CB-CG2 4.07Å; R331-I384 HydrophobicContact CG-CG2 4.38Å; R331-I384 VanDerWaalsContact O-CD1 3.28Å; R331-I384 WeakPolarHBondContact O-CD1 3.44Å; R331-F387 HydrophobicContact CG-CE2 3.73Å; R331-F387 HydrophobicContact CG-CZ 4.09Å; R331-I388 HydrophobicContact CB-CD1 4.38Å; R331-E391 IonicContact CZ-OE1 2.91Å; R331-E391 IonicContact NE-OE1 2.95Å; R331-E391 PolarHBondContact NE-OE1 3.01Å; R331-E391 IonicContact NE-OE2 3.19Å; R331-E391 PolarHBondContact NE-OE2 2.62Å; R331-E391 IonicContact NH2-OE1 3.86Å; R331-E391 PolarHBondContact NH2-OE1 3.34Å; R331-E452 WeakPolarHBondContact CD-OE1 3.34Å; R331-E452 PolarHBondContact N-OE1 3.4Å; R331-E452 PolarHBondContact N-OE2 2.89Å; R331-T453 WeakPolarHBondContact CD-OG1 3.43Å |
| 332 | R | 93.4 | Very high | 91.9 | Very high | 59 Ų | 59 | 37.9 Ų | 37.9 | 22% | 0.223 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -63.4 | -45.6 | -175.8 | -176 | -176.9 | 154.6 | 118.6 | -6.6 | 111.3 | H335 M336 T446 F447 V450 E452 | R332-H335 PolarHBondContact O-N 3.42Å; R332-M336 HydrophobicContact CG-CE 4.04Å; R332-M336 HydrophobicContact CG-SD 4.34Å; R332-M336 VanDerWaalsContact O-CG 3.29Å; R332-M336 WeakPolarHBondContact O-CG 3.48Å; R332-M336 PolarHBondContact O-N 3.19Å; R332-M336 VanDerWaalsContact O-N 3.1Å; R332-T446 HydrophobicContact CG-CG2 4.42Å; R332-T446 PolarHBondContact NH1-O 2.96Å; R332-F447 PolarHBondContact NH1-O 3.48Å; R332-F447 PolarHBondContact NH2-O 2.96Å; R332-V450 WeakPolarHBondContact CD-O 3.43Å; R332-V450 PolarHBondContact NH1-O 3.24Å; R332-E452 WeakPolarHBondContact CB-OE2 3.19Å; R332-E452 PolarHBondContact N-OE2 3.21Å |
| 333 | T | 94.4 | Very high | 92.3 | Very high | 58 Ų | 58 | 38.2 Ų | 38.2 | 36% | 0.356 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -60.2 | -50.3 | 179.9 | -49.7 | 0 | 0 | 0 | 0 | 111.6 | A329 R331 M336 I337 | A329-T333 WeakPolarHBondContact O-CB 3.27Å; A329-T333 PolarHBondContact O-OG1 2.86Å; R331-T333 PolarHBondContact O-N 3.32Å; T333-M336 PolarHBondContact O-N 2.86Å; T333-I337 HydrophobicContact CG2-CD1 3.89Å; T333-I337 VanDerWaalsContact O-CG1 3.32Å; T333-I337 WeakPolarHBondContact O-CG1 3.19Å; T333-I337 PolarHBondContact O-N 3.38Å |
| 334 | L | 94.7 | Very high | 92.9 | Very high | 5 Ų | 5 | 41.6 Ų | 41.6 | 3% | 0.026 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.8 | -39.1 | -177.8 | -68.4 | -178.9 | 0 | 0 | 0 | 112.6 | L325 V326 A329 G330 R331 M336 I337 G338 I379 I384 | L325-L334 HydrophobicContact CB-CD1 4.04Å; L325-L334 HydrophobicContact CB-CD2 4.21Å; L325-L334 HydrophobicContact CD1-CD2 4.5Å; V326-L334 HydrophobicContact CB-CD1 4.2Å; A329-L334 HydrophobicContact CB-CD1 4.39Å; A329-L334 HydrophobicContact CB-CD2 3.8Å; A329-L334 HydrophobicContact CB-CG 3.9Å; G330-L334 WeakPolarHBondContact O-CG 3.28Å; G330-L334 PolarHBondContact O-N 3.45Å; R331-L334 PolarHBondContact O-N 3.13Å; L334-M336 PolarHBondContact O-N 3.36Å; L334-I337 PolarHBondContact O-N 3.35Å; L334-G338 PolarHBondContact O-N 3.32Å; L334-I379 HydrophobicContact CB-CG2 4.48Å; L334-I379 HydrophobicContact CD2-CG2 3.96Å; L334-I384 HydrophobicContact CB-CD1 3.8Å |
| 335 | H | 96.4 | Very high | 93.4 | Very high | 2 Ų | 2 | 35.5 Ų | 35.5 | 1% | 0.009 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.9 | -44.1 | 175.9 | -159.1 | 74.3 | 0 | 0 | 0 | 111.5 | L276 S279 R331 R332 G338 L339 I384 T446 | L276-H335 WeakPolarHBondContact CD2-NE2 3.48Å; S279-H335 PolarHBondContact OG-CE1 2.66Å; S279-H335 PolarHBondContact OG-NE2 3.44Å; R331-H335 WeakPolarHBondContact O-CB 3.3Å; R331-H335 PolarHBondContact O-N 2.92Å; R332-H335 PolarHBondContact O-N 3.42Å; H335-G338 PolarHBondContact O-N 3.48Å; H335-L339 WeakPolarHBondContact O-CG 3.38Å; H335-L339 PolarHBondContact O-N 3.18Å; H335-I384 HydrophobicContact CB-CD1 3.96Å; H335-T446 HydrophobicContact CB-CG2 4.31Å; H335-T446 PolarHBondContact CD2-OG1 3.03Å |
| 336 | M | 97.8 | Very high | 93.6 | Very high | 38 Ų | 38 | 32.4 Ų | 32.4 | 19% | 0.187 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.3 | -43.2 | 177 | -69 | -175.4 | -53.7 | 0 | 0 | 112.6 | R332 T333 L334 G338 L339 G340 L443 T446 F447 | R332-M336 HydrophobicContact CG-CE 4.04Å; R332-M336 HydrophobicContact CG-SD 4.34Å; R332-M336 VanDerWaalsContact O-CG 3.29Å; R332-M336 WeakPolarHBondContact O-CG 3.48Å; R332-M336 PolarHBondContact O-N 3.19Å; R332-M336 VanDerWaalsContact O-N 3.1Å; T333-M336 PolarHBondContact O-N 2.86Å; L334-M336 PolarHBondContact O-N 3.36Å; M336-G338 VanDerWaalsContact C-N 3.32Å; M336-G338 PolarHBondContact O-N 3.49Å; M336-L339 PolarHBondContact O-N 3.46Å; M336-G340 PolarHBondContact O-N 3.04Å; M336-L443 HydrophobicContact CB-CD1 3.66Å; M336-L443 HydrophobicContact CG-CD1 3.91Å; M336-L443 WeakPolarHBondContact O-CD1 3.2Å; M336-T446 HydrophobicContact CG-CG2 3.58Å; M336-T446 HydrophobicContact SD-CG2 4.44Å; M336-F447 HydrophobicContact SD-CB 4.03Å; M336-F447 HydrophobicContact SD-CD2 3.91Å; M336-F447 HydrophobicContact SD-CG 4.48Å |
| 337 | I | 97.4 | Very high | 94.1 | Very high | 81 Ų | 81 | 34.9 Ų | 34.9 | 42% | 0.415 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -60.5 | -44.8 | 176.3 | -70.4 | 168.9 | 0 | 0 | 0 | 110.3 | T333 L334 G340 G341 F376 I379 | T333-I337 HydrophobicContact CG2-CD1 3.89Å; T333-I337 VanDerWaalsContact O-CG1 3.32Å; T333-I337 WeakPolarHBondContact O-CG1 3.19Å; T333-I337 PolarHBondContact O-N 3.38Å; L334-I337 PolarHBondContact O-N 3.35Å; I337-G340 PolarHBondContact O-N 3.36Å; I337-G341 PolarHBondContact O-N 2.92Å; I337-F376 HydrophobicContact CG2-CD1 4.22Å; I337-F376 HydrophobicContact CG2-CE1 4.01Å; I337-I379 HydrophobicContact CG2-CG2 4.37Å |
| 338 | G | 97.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -61.3 | -51.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L334 H335 M336 G340 G341 M342 F376 | L334-G338 PolarHBondContact O-N 3.32Å; H335-G338 PolarHBondContact O-N 3.48Å; M336-G338 VanDerWaalsContact C-N 3.32Å; M336-G338 PolarHBondContact O-N 3.49Å; G338-G340 PolarHBondContact O-N 2.79Å; G338-G341 PolarHBondContact O-N 3.35Å; G338-M342 WeakPolarHBondContact O-CB 3.45Å; G338-M342 WeakPolarHBondContact O-CG 3.36Å; G338-M342 PolarHBondContact O-N 3.12Å; G338-F376 WeakPolarHBondContact CA-O 3.42Å |
| 339 | L | 97.9 | Very high | 95.1 | Very high | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.1 | -43.4 | 178.3 | -68.1 | 175.7 | 0 | 0 | 0 | 112.5 | H335 M336 A343 P381 L439 F442 L443 | H335-L339 WeakPolarHBondContact O-CG 3.38Å; H335-L339 PolarHBondContact O-N 3.18Å; M336-L339 PolarHBondContact O-N 3.46Å; L339-A343 WeakPolarHBondContact O-CB 3.43Å; L339-A343 PolarHBondContact O-N 2.77Å; L339-P381 HydrophobicContact CD2-CB 4.41Å; L339-P381 HydrophobicContact CD2-CG 3.76Å; L339-P381 HydrophobicContact CG-CG 3.94Å; L339-L439 HydrophobicContact CD2-CD2 3.65Å; L339-F442 HydrophobicContact CD1-CB 3.85Å; L339-F442 HydrophobicContact CD2-CB 4.41Å; L339-L443 HydrophobicContact CB-CB 4.24Å; L339-L443 HydrophobicContact CB-CD1 4.36Å; L339-L443 HydrophobicContact CD1-CB 4.46Å |
| 340 | G | 97.9 | Very high | 95.3 | Very high | 21 Ų | 21 | 24.6 Ų | 24.6 | 22% | 0.216 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.9 | -46.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | M336 I337 G338 A343 V344 | M336-G340 PolarHBondContact O-N 3.04Å; I337-G340 PolarHBondContact O-N 3.36Å; G338-G340 PolarHBondContact O-N 2.79Å; G340-A343 PolarHBondContact O-N 3.19Å; G340-V344 PolarHBondContact O-N 3.31Å; G340-V344 VanDerWaalsContact O-N 3.16Å |
| 341 | G | 97.6 | Very high | 95.6 | Very high | 9 Ų | 9 | 28.3 Ų | 28.3 | 9% | 0.093 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64 | -40.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | I337 G338 A343 V344 C345 | I337-G341 PolarHBondContact O-N 2.92Å; G338-G341 PolarHBondContact O-N 3.35Å; G341-A343 VanDerWaalsContact C-N 3.34Å; G341-A343 PolarHBondContact O-N 3Å; G341-V344 PolarHBondContact O-N 2.96Å; G341-C345 PolarHBondContact O-N 3.48Å; G341-C345 PolarHBondContact O-SG 3.37Å |
| 342 | M | 97.6 | Very high | 95.7 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -61.2 | -40.8 | 173.3 | -71.1 | 177.2 | 81.4 | 0 | 0 | 111.9 | S283 G338 V344 C345 S346 F373 F376 F377 P381 L439 | S283-M342 VanDerWaalsContact CB-CE 3.47Å; G338-M342 WeakPolarHBondContact O-CB 3.45Å; G338-M342 WeakPolarHBondContact O-CG 3.36Å; G338-M342 PolarHBondContact O-N 3.12Å; M342-V344 PolarHBondContact O-N 2.82Å; M342-C345 PolarHBondContact O-N 3.25Å; M342-S346 WeakPolarHBondContact O-CB 3.44Å; M342-S346 PolarHBondContact O-N 3.49Å; M342-S346 PolarHBondContact O-OG 2.94Å; M342-S346 VanDerWaalsContact O-OG 3.13Å; M342-F373 HydrophobicContact CB-CD2 3.92Å; M342-F373 HydrophobicContact CB-CE2 3.78Å; M342-F373 HydrophobicContact CB-CZ 4.5Å; M342-F373 HydrophobicContact CE-CD1 4.01Å; M342-F373 HydrophobicContact CE-CD2 4.27Å; M342-F373 HydrophobicContact CE-CE1 3.33Å; M342-F373 HydrophobicContact CE-CE2 3.63Å; M342-F373 HydrophobicContact CE-CG 4.44Å; M342-F373 HydrophobicContact CE-CZ 3.12Å; M342-F373 HydrophobicContact CG-CD2 4.14Å; M342-F373 HydrophobicContact CG-CE2 4.15Å; M342-F373 HydrophobicContact CG-CG 4.49Å; M342-F373 WeakPolarHBondContact O-CD2 3.41Å; M342-F376 HydrophobicContact CG-CB 3.87Å; M342-F377 HydrophobicContact CE-CB 3.83Å; M342-F377 HydrophobicContact CE-CD2 3.76Å; M342-F377 HydrophobicContact CE-CG 4.24Å; M342-F377 VanDerWaalsContact SD-CA 3.57Å; M342-F377 HydrophobicContact SD-CB 3.74Å; M342-F377 HydrophobicContact SD-CD2 3.93Å; M342-F377 HydrophobicContact SD-CG 4.35Å; M342-P381 HydrophobicContact SD-CB 4.42Å; M342-P381 HydrophobicContact SD-CG 4.09Å; M342-L439 HydrophobicContact CB-CD1 3.81Å; M342-L439 HydrophobicContact CB-CD2 3.9Å; M342-L439 HydrophobicContact CE-CD2 4.45Å; M342-L439 HydrophobicContact SD-CD2 4.24Å |
| 343 | A | 97.8 | Very high | 95.4 | Very high | 9 Ų | 9 | 26.4 Ų | 26.4 | 7% | 0.074 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.7 | -38.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L339 G340 G341 S346 T347 T436 L439 I440 | L339-A343 WeakPolarHBondContact O-CB 3.43Å; L339-A343 PolarHBondContact O-N 2.77Å; G340-A343 PolarHBondContact O-N 3.19Å; G341-A343 VanDerWaalsContact C-N 3.34Å; G341-A343 PolarHBondContact O-N 3Å; A343-S346 WeakPolarHBondContact CA-OG 3.46Å; A343-S346 PolarHBondContact O-OG 2.87Å; A343-T347 PolarHBondContact O-N 3.27Å; A343-T347 VanDerWaalsContact O-N 3.14Å; A343-T347 PolarHBondContact O-OG1 2.7Å; A343-T436 HydrophobicContact CB-CG2 4.4Å; A343-L439 HydrophobicContact CB-CB 3.96Å; A343-L439 HydrophobicContact CB-CD1 4.34Å; A343-I440 HydrophobicContact CB-CG1 4.31Å |
| 344 | V | 97.9 | Very high | 95.3 | Very high | 101 Ų | 101 | 27 Ų | 27 | 61% | 0.612 | 16% | 0.155 | S | C | * | . | H | α-helix | trans | -64.7 | -45.9 | 173.5 | 174.7 | 0 | 0 | 0 | 0 | 110.2 | G340 G341 M342 T347 L348 | G340-V344 PolarHBondContact O-N 3.31Å; G340-V344 VanDerWaalsContact O-N 3.16Å; G341-V344 PolarHBondContact O-N 2.96Å; M342-V344 PolarHBondContact O-N 2.82Å; V344-T347 PolarHBondContact O-N 3.19Å; V344-L348 WeakPolarHBondContact O-CB 3.48Å; V344-L348 PolarHBondContact O-N 3.15Å |
| 345 | C | 96.1 | Very high | 95.2 | Very high | 6 Ų | 6 | 29.8 Ų | 29.8 | 4% | 0.041 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -66.8 | -39.4 | -179.5 | -63.2 | 0 | 0 | 0 | 0 | 112.5 | G341 M342 T347 L348 M349 F373 | G341-C345 PolarHBondContact O-N 3.48Å; G341-C345 PolarHBondContact O-SG 3.37Å; M342-C345 PolarHBondContact O-N 3.25Å; C345-T347 VanDerWaalsContact C-N 3.32Å; C345-T347 PolarHBondContact O-N 3.05Å; C345-L348 CarbonylContact O-C 3.56Å; C345-L348 WeakPolarHBondContact O-CB 3.3Å; C345-L348 PolarHBondContact O-N 3.04Å; C345-M349 VanDerWaalsContact O-CG 3.27Å; C345-M349 WeakPolarHBondContact O-CG 3.24Å; C345-M349 PolarHBondContact O-N 3.45Å; C345-F373 HydrophobicContact CB-CB 3.72Å; C345-F373 HydrophobicContact CB-CD2 3.97Å; C345-F373 HydrophobicContact CB-CG 4.37Å |
| 346 | S | 94.6 | Very high | 94.7 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -65.7 | -36.1 | 176.6 | 58.7 | 0 | 0 | 0 | 0 | 112.2 | M342 A343 M349 T350 T436 | M342-S346 WeakPolarHBondContact O-CB 3.44Å; M342-S346 PolarHBondContact O-N 3.49Å; M342-S346 PolarHBondContact O-OG 2.94Å; M342-S346 VanDerWaalsContact O-OG 3.13Å; A343-S346 WeakPolarHBondContact CA-OG 3.46Å; A343-S346 PolarHBondContact O-OG 2.87Å; S346-M349 WeakPolarHBondContact O-CB 3.48Å; S346-M349 PolarHBondContact O-N 3.11Å; S346-T350 PolarHBondContact O-N 2.85Å; S346-T436 WeakPolarHBondContact CB-OG1 3.11Å; S346-T436 PolarHBondContact OG-OG1 3.16Å |
| 347 | T | 96 | Very high | 94.1 | Very high | 52 Ų | 52 | 36.4 Ų | 36.4 | 32% | 0.319 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -65.1 | -44.1 | 171.8 | -53.6 | 0 | 0 | 0 | 0 | 110.7 | A343 V344 C345 M349 T350 I351 T436 | A343-T347 PolarHBondContact O-N 3.27Å; A343-T347 VanDerWaalsContact O-N 3.14Å; A343-T347 PolarHBondContact O-OG1 2.7Å; V344-T347 PolarHBondContact O-N 3.19Å; C345-T347 VanDerWaalsContact C-N 3.32Å; C345-T347 PolarHBondContact O-N 3.05Å; T347-M349 VanDerWaalsContact C-N 3.32Å; T347-M349 PolarHBondContact O-N 3.16Å; T347-T350 PolarHBondContact O-N 3.01Å; T347-I351 HydrophobicContact CG2-CD1 4.08Å; T347-I351 WeakPolarHBondContact O-CG1 3.36Å; T347-I351 PolarHBondContact O-N 3.24Å; T347-T436 WeakPolarHBondContact OG1-CG2 3.49Å |
| 348 | L | 95.1 | Very high | 93.7 | Very high | 64 Ų | 64 | 38.3 Ų | 38.3 | 34% | 0.335 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -63 | -37.3 | 177.1 | -175.2 | 61.1 | 0 | 0 | 0 | 112 | V344 C345 I351 S352 V365 A369 | V344-L348 WeakPolarHBondContact O-CB 3.48Å; V344-L348 PolarHBondContact O-N 3.15Å; C345-L348 CarbonylContact O-C 3.56Å; C345-L348 WeakPolarHBondContact O-CB 3.3Å; C345-L348 PolarHBondContact O-N 3.04Å; L348-I351 PolarHBondContact O-N 3.47Å; L348-S352 VanDerWaalsContact O-CB 3.25Å; L348-S352 WeakPolarHBondContact O-CB 3.45Å; L348-S352 PolarHBondContact O-N 2.98Å; L348-S352 PolarHBondContact O-OG 2.71Å; L348-V365 HydrophobicContact CD1-CG1 3.71Å; L348-V365 HydrophobicContact CD2-CG1 4.01Å; L348-V365 HydrophobicContact CG-CG1 3.88Å; L348-A369 HydrophobicContact CB-CB 4.26Å; L348-A369 HydrophobicContact CD2-CB 3.91Å; L348-A369 HydrophobicContact CG-CB 4.03Å |
| 349 | M | 91.6 | Very high | 93.3 | Very high | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.005 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58 | -51.6 | 172.4 | -71.9 | 161.9 | 140.8 | 0 | 0 | 111.3 | V288 C345 S346 T347 I351 S352 L353 A369 I370 F373 F432 | V288-M349 HydrophobicContact CG2-CE 4.19Å; C345-M349 VanDerWaalsContact O-CG 3.27Å; C345-M349 WeakPolarHBondContact O-CG 3.24Å; C345-M349 PolarHBondContact O-N 3.45Å; S346-M349 WeakPolarHBondContact O-CB 3.48Å; S346-M349 PolarHBondContact O-N 3.11Å; T347-M349 VanDerWaalsContact C-N 3.32Å; T347-M349 PolarHBondContact O-N 3.16Å; M349-I351 PolarHBondContact O-N 3.22Å; M349-S352 WeakPolarHBondContact CA-OG 3.5Å; M349-S352 PolarHBondContact O-N 3.35Å; M349-S352 PolarHBondContact O-OG 3.04Å; M349-L353 WeakPolarHBondContact O-CB 3.38Å; M349-L353 WeakPolarHBondContact O-CG 3.5Å; M349-L353 PolarHBondContact O-N 3.4Å; M349-A369 HydrophobicContact CG-CB 3.89Å; M349-I370 HydrophobicContact CE-CB 3.89Å; M349-I370 HydrophobicContact CE-CD1 4.33Å; M349-I370 HydrophobicContact CE-CG1 3.12Å; M349-F373 HydrophobicContact CE-CB 4.41Å; M349-F373 HydrophobicContact CE-CG 4.47Å; M349-F373 HydrophobicContact SD-CD2 4.46Å; M349-F432 HydrophobicContact CB-CD2 4.21Å; M349-F432 HydrophobicContact CB-CG 4.19Å; M349-F432 HydrophobicContact CE-CE1 4.34Å; M349-F432 HydrophobicContact SD-CD1 3.81Å; M349-F432 HydrophobicContact SD-CE1 3.96Å; M349-F432 HydrophobicContact SD-CG 4.35Å |
| 350 | T | 92.5 | Very high | 92.5 | Very high | 5 Ų | 5 | 52 Ų | 52 | 3% | 0.031 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -57.5 | -48 | 176.9 | -66.5 | 0 | 0 | 0 | 0 | 111.7 | S346 T347 S352 L353 L354 A429 Y430 F432 I433 | S346-T350 PolarHBondContact O-N 2.85Å; T347-T350 PolarHBondContact O-N 3.01Å; T350-S352 VanDerWaalsContact C-N 3.35Å; T350-S352 PolarHBondContact O-N 3.37Å; T350-L353 PolarHBondContact O-N 3.23Å; T350-L354 HydrophobicContact CG2-CD1 3.79Å; T350-L354 HydrophobicContact CG2-CG 4.38Å; T350-L354 WeakPolarHBondContact O-CB 3.42Å; T350-L354 VanDerWaalsContact O-CG 3.27Å; T350-L354 WeakPolarHBondContact O-CG 3.47Å; T350-L354 PolarHBondContact O-N 3.48Å; T350-A429 PolarHBondContact OG1-O 3.37Å; T350-Y430 HydrophobicContact CG2-CD1 4.23Å; T350-F432 WeakPolarHBondContact OG1-CB 3.41Å; T350-I433 HydrophobicContact CG2-CD1 4.02Å; T350-I433 HydrophobicContact CG2-CG1 3.96Å |
| 351 | I | 94 | Very high | 91.9 | Very high | 77 Ų | 77 | 53.2 Ų | 53.2 | 40% | 0.395 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.4 | -46.1 | 179.5 | -65.8 | 167.7 | 0 | 0 | 0 | 110.7 | T347 L348 M349 L354 L355 M362 | T347-I351 HydrophobicContact CG2-CD1 4.08Å; T347-I351 WeakPolarHBondContact O-CG1 3.36Å; T347-I351 PolarHBondContact O-N 3.24Å; L348-I351 PolarHBondContact O-N 3.47Å; M349-I351 PolarHBondContact O-N 3.22Å; I351-L354 PolarHBondContact O-N 3.38Å; I351-L355 HydrophobicContact CG2-CD1 3.85Å; I351-L355 WeakPolarHBondContact O-CB 3.28Å; I351-L355 WeakPolarHBondContact O-CG 3.29Å; I351-L355 PolarHBondContact O-N 3.36Å; I351-L355 VanDerWaalsContact O-N 3.11Å; I351-M362 HydrophobicContact CG2-CE 4.06Å |
| 352 | S | 91.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.9 | -43.6 | -178.7 | 66.9 | 0 | 0 | 0 | 0 | 112.8 | L348 M349 T350 L355 K356 C366 | L348-S352 VanDerWaalsContact O-CB 3.25Å; L348-S352 WeakPolarHBondContact O-CB 3.45Å; L348-S352 PolarHBondContact O-N 2.98Å; L348-S352 PolarHBondContact O-OG 2.71Å; M349-S352 WeakPolarHBondContact CA-OG 3.5Å; M349-S352 PolarHBondContact O-N 3.35Å; M349-S352 PolarHBondContact O-OG 3.04Å; T350-S352 VanDerWaalsContact C-N 3.35Å; T350-S352 PolarHBondContact O-N 3.37Å; S352-L355 PolarHBondContact O-N 2.97Å; S352-K356 WeakPolarHBondContact O-CB 3.4Å; S352-K356 PolarHBondContact O-N 3.03Å; S352-C366 WeakPolarHBondContact OG-CA 3.47Å; S352-C366 VanDerWaalsContact OG-CB 3.23Å; S352-C366 WeakPolarHBondContact OG-CB 3.3Å |
| 353 | L | 87.9 | Confident | 90.9 | Very high | 26 Ų | 26 | 55.1 Ų | 55.1 | 14% | 0.136 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68.2 | -34.8 | 178.4 | -71.8 | 171.9 | 0 | 0 | 0 | 112.8 | M349 T350 K356 A429 F432 | M349-L353 WeakPolarHBondContact O-CB 3.38Å; M349-L353 WeakPolarHBondContact O-CG 3.5Å; M349-L353 PolarHBondContact O-N 3.4Å; T350-L353 PolarHBondContact O-N 3.23Å; L353-K356 HydrophobicContact CD2-CD 4.28Å; L353-K356 WeakPolarHBondContact O-CG 3.43Å; L353-A429 HydrophobicContact CB-CB 3.62Å; L353-A429 HydrophobicContact CD1-CB 4.35Å; L353-F432 HydrophobicContact CD1-CD2 4.08Å; L353-F432 HydrophobicContact CD1-CE2 3.56Å |
| 354 | L | 91.3 | Very high | 90.3 | Very high | 69 Ų | 69 | 62 Ų | 62 | 36% | 0.361 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -71.4 | -30 | 175.9 | -70.8 | 173.3 | 0 | 0 | 0 | 112.9 | T350 I351 A429 Y430 | T350-L354 HydrophobicContact CG2-CD1 3.79Å; T350-L354 HydrophobicContact CG2-CG 4.38Å; T350-L354 WeakPolarHBondContact O-CB 3.42Å; T350-L354 VanDerWaalsContact O-CG 3.27Å; T350-L354 WeakPolarHBondContact O-CG 3.47Å; T350-L354 PolarHBondContact O-N 3.48Å; I351-L354 PolarHBondContact O-N 3.38Å; L354-A429 HydrophobicContact CD2-CB 3.84Å; L354-A429 HydrophobicContact CG-CB 3.9Å; L354-Y430 HydrophobicContact CD1-CE1 3.88Å; L354-Y430 HydrophobicContact CD1-CE2 4.22Å; L354-Y430 HydrophobicContact CD2-CD2 4.4Å; L354-Y430 HydrophobicContact CD2-CE2 3.76Å |
| 355 | L | 92.3 | Very high | 90 | Very high | 65 Ų | 65 | 59.8 Ų | 59.8 | 34% | 0.34 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -98.1 | -9.3 | -176.5 | -66.2 | 179.6 | 0 | 0 | 0 | 113.8 | I351 S352 D357 N358 Y359 M362 | I351-L355 HydrophobicContact CG2-CD1 3.85Å; I351-L355 WeakPolarHBondContact O-CB 3.28Å; I351-L355 WeakPolarHBondContact O-CG 3.29Å; I351-L355 PolarHBondContact O-N 3.36Å; I351-L355 VanDerWaalsContact O-N 3.11Å; S352-L355 PolarHBondContact O-N 2.97Å; L355-D357 VanDerWaalsContact C-N 3.27Å; L355-D357 PolarHBondContact O-N 3.23Å; L355-N358 PolarHBondContact O-N 3.39Å; L355-N358 VanDerWaalsContact O-N 3.12Å; L355-Y359 HydrophobicContact CB-CD2 4.41Å; L355-Y359 PolarHBondContact O-N 3.27Å; L355-M362 HydrophobicContact CB-CE 4.08Å; L355-M362 HydrophobicContact CB-CG 3.88Å; L355-M362 HydrophobicContact CD1-CE 3.89Å |
| 356 | K | 85.7 | Confident | 89.7 | Confident | 52 Ų | 52 | 59.6 Ų | 59.6 | 23% | 0.226 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -36.4 | -175.5 | 80.7 | -179.6 | -178.5 | 64.2 | 0 | 113.6 | D298 S352 L353 N358 Y359 M362 | D298-K356 VanDerWaalsContact O-CE 3.31Å; D298-K356 WeakPolarHBondContact O-CE 3.39Å; D298-K356 PolarHBondContact O-NZ 3.01Å; S352-K356 WeakPolarHBondContact O-CB 3.4Å; S352-K356 PolarHBondContact O-N 3.03Å; L353-K356 HydrophobicContact CD2-CD 4.28Å; L353-K356 WeakPolarHBondContact O-CG 3.43Å; K356-N358 PolarHBondContact O-N 3.24Å; K356-Y359 CarbonylContact O-C 3.19Å; K356-Y359 PolarHBondContact O-N 2.65Å; K356-M362 HydrophobicContact CB-CB 4.4Å |
| 357 | D | 85.8 | Confident | 89.3 | Confident | 127 Ų | 127 | 61.3 Ų | 61.3 | 68% | 0.679 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | -22.5 | -176.6 | -60.9 | -29.2 | 0 | 0 | 0 | 111.8 | L355 | L355-D357 VanDerWaalsContact C-N 3.27Å; L355-D357 PolarHBondContact O-N 3.23Å |
| 358 | N | 88.3 | Confident | 89.1 | Confident | 121 Ų | 121 | 60.2 Ų | 60.2 | 65% | 0.647 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.9 | -33.3 | 175.9 | -62.6 | -57.6 | 0 | 0 | 0 | 112.3 | L355 K356 | L355-N358 PolarHBondContact O-N 3.39Å; L355-N358 VanDerWaalsContact O-N 3.12Å; K356-N358 PolarHBondContact O-N 3.24Å |
| 359 | Y | 89.2 | Confident | 89 | Confident | 154 Ų | 154 | 57.3 Ų | 57.3 | 60% | 0.604 | 31% | 0.305 | S | S | * | . | trans | -133.4 | 102.3 | -175.2 | -59.4 | -80.3 | 0 | 0 | 0 | 110.5 | L355 K356 G361 M362 | L355-Y359 HydrophobicContact CB-CD2 4.41Å; L355-Y359 PolarHBondContact O-N 3.27Å; K356-Y359 CarbonylContact O-C 3.19Å; K356-Y359 PolarHBondContact O-N 2.65Å; Y359-G361 PolarHBondContact O-N 3.03Å; Y359-M362 WeakPolarHBondContact O-CB 3.27Å; Y359-M362 PolarHBondContact O-N 2.9Å | ||
| 360 | N | 81.4 | Confident | 88.9 | Confident | 134 Ų | 134 | 57.3 Ų | 57.3 | 72% | 0.717 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -23.7 | -177.3 | -157.7 | 23 | 0 | 0 | 0 | 113.5 | M362 S363 | N360-M362 VanDerWaalsContact C-N 3.26Å; N360-M362 PolarHBondContact O-N 2.94Å; N360-S363 PolarHBondContact O-N 2.85Å |
| 361 | G | 86.7 | Confident | 88.9 | Confident | 45 Ų | 45 | 59.4 Ų | 59.4 | 46% | 0.464 | 32% | 0.316 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -24.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y359 S363 F364 | Y359-G361 PolarHBondContact O-N 3.03Å; G361-S363 PolarHBondContact O-N 2.6Å; G361-F364 PolarHBondContact O-N 3.15Å |
| 362 | M | 88.4 | Confident | 89 | Confident | 36 Ų | 36 | 58.9 Ų | 58.9 | 18% | 0.177 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -70.1 | -20.6 | -177.9 | -61.9 | -63 | -75.9 | 0 | 0 | 112.6 | I351 L355 K356 Y359 N360 F364 V365 C366 | I351-M362 HydrophobicContact CG2-CE 4.06Å; L355-M362 HydrophobicContact CB-CE 4.08Å; L355-M362 HydrophobicContact CB-CG 3.88Å; L355-M362 HydrophobicContact CD1-CE 3.89Å; K356-M362 HydrophobicContact CB-CB 4.4Å; Y359-M362 WeakPolarHBondContact O-CB 3.27Å; Y359-M362 PolarHBondContact O-N 2.9Å; N360-M362 VanDerWaalsContact C-N 3.26Å; N360-M362 PolarHBondContact O-N 2.94Å; M362-F364 VanDerWaalsContact C-N 3.33Å; M362-F364 PolarHBondContact O-N 3.16Å; M362-V365 WeakPolarHBondContact O-CB 3.49Å; M362-V365 PolarHBondContact O-N 3.21Å; M362-V365 HydrophobicContact SD-CG2 4.26Å; M362-C366 PolarHBondContact O-N 3.1Å |
| 363 | S | 84.6 | Confident | 89.1 | Confident | 13 Ų | 13 | 59 Ų | 59 | 9% | 0.091 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -57.8 | -43.9 | 170.2 | -70.6 | 0 | 0 | 0 | 0 | 112.6 | A299 N360 G361 V365 C366 I367 | A299-S363 WeakPolarHBondContact O-CB 3.33Å; A299-S363 PolarHBondContact O-OG 2.98Å; N360-S363 PolarHBondContact O-N 2.85Å; G361-S363 PolarHBondContact O-N 2.6Å; S363-V365 VanDerWaalsContact C-N 3.32Å; S363-V365 PolarHBondContact O-N 3Å; S363-C366 WeakPolarHBondContact O-CB 3.5Å; S363-C366 PolarHBondContact O-N 3.05Å; S363-I367 WeakPolarHBondContact O-CG1 3.29Å; S363-I367 PolarHBondContact O-N 2.91Å; S363-I367 VanDerWaalsContact O-N 3.09Å |
| 364 | F | 86.6 | Confident | 89.4 | Confident | 155 Ų | 155 | 57.8 Ų | 57.8 | 68% | 0.68 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -67.1 | -35.5 | 176 | -63.1 | -75.3 | 0 | 0 | 0 | 112 | G361 M362 I367 G368 | G361-F364 PolarHBondContact O-N 3.15Å; M362-F364 VanDerWaalsContact C-N 3.33Å; M362-F364 PolarHBondContact O-N 3.16Å; F364-I367 PolarHBondContact O-N 3.32Å; F364-G368 PolarHBondContact O-N 2.85Å |
| 365 | V | 91.3 | Very high | 89.6 | Confident | 54 Ų | 54 | 54.8 Ų | 54.8 | 33% | 0.327 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64.1 | -42.1 | 174.6 | -179.2 | 0 | 0 | 0 | 0 | 110.6 | L348 M362 S363 I367 G368 A369 | L348-V365 HydrophobicContact CD1-CG1 3.71Å; L348-V365 HydrophobicContact CD2-CG1 4.01Å; L348-V365 HydrophobicContact CG-CG1 3.88Å; M362-V365 WeakPolarHBondContact O-CB 3.49Å; M362-V365 PolarHBondContact O-N 3.21Å; M362-V365 HydrophobicContact SD-CG2 4.26Å; S363-V365 VanDerWaalsContact C-N 3.32Å; S363-V365 PolarHBondContact O-N 3Å; V365-I367 PolarHBondContact O-N 3.25Å; V365-G368 PolarHBondContact O-N 2.89Å; V365-A369 VanDerWaalsContact O-CB 3.3Å; V365-A369 WeakPolarHBondContact O-CB 3.45Å; V365-A369 PolarHBondContact O-N 3.21Å |
| 366 | C | 88 | Confident | 89.9 | Confident | 2 Ų | 2 | 54.4 Ų | 54.4 | 1% | 0.014 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.6 | -45.4 | 175.9 | -172.4 | 0 | 0 | 0 | 0 | 111.5 | S352 M362 S363 A369 I370 | S352-C366 WeakPolarHBondContact OG-CA 3.47Å; S352-C366 VanDerWaalsContact OG-CB 3.23Å; S352-C366 WeakPolarHBondContact OG-CB 3.3Å; M362-C366 PolarHBondContact O-N 3.1Å; S363-C366 WeakPolarHBondContact O-CB 3.5Å; S363-C366 PolarHBondContact O-N 3.05Å; C366-A369 PolarHBondContact O-N 3.37Å; C366-I370 WeakPolarHBondContact O-CG1 3.37Å; C366-I370 PolarHBondContact O-N 2.71Å |
| 367 | I | 86.8 | Confident | 90.4 | Very high | 35 Ų | 35 | 52.4 Ų | 52.4 | 18% | 0.179 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.1 | -48.4 | 177.7 | -62.7 | 160.6 | 0 | 0 | 0 | 110.4 | F296 V301 S363 F364 V365 A369 I370 L371 | F296-I367 HydrophobicContact CD1-CG1 3.94Å; F296-I367 HydrophobicContact CE1-CB 4.31Å; F296-I367 HydrophobicContact CE1-CG1 4.1Å; F296-I367 HydrophobicContact CE1-CG2 4.05Å; V301-I367 HydrophobicContact CG2-CD1 3.35Å; V301-I367 HydrophobicContact CG2-CG1 3.95Å; S363-I367 WeakPolarHBondContact O-CG1 3.29Å; S363-I367 PolarHBondContact O-N 2.91Å; S363-I367 VanDerWaalsContact O-N 3.09Å; F364-I367 PolarHBondContact O-N 3.32Å; V365-I367 PolarHBondContact O-N 3.25Å; I367-A369 VanDerWaalsContact C-N 3.3Å; I367-A369 PolarHBondContact O-N 3.15Å; I367-I370 PolarHBondContact O-N 3.28Å; I367-L371 HydrophobicContact CG2-CD1 4.34Å; I367-L371 WeakPolarHBondContact O-CG 3.42Å; I367-L371 PolarHBondContact O-N 3.36Å |
| 368 | G | 91.4 | Very high | 90.8 | Very high | 30 Ų | 30 | 46.4 Ų | 46.4 | 31% | 0.309 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -58.3 | -42.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | F364 V365 I370 L371 V372 | F364-G368 PolarHBondContact O-N 2.85Å; V365-G368 PolarHBondContact O-N 2.89Å; G368-I370 PolarHBondContact O-N 3.13Å; G368-L371 PolarHBondContact O-N 3.44Å; G368-V372 WeakPolarHBondContact O-CB 3.36Å; G368-V372 VanDerWaalsContact O-CG2 3.29Å; G368-V372 WeakPolarHBondContact O-CG2 3.34Å; G368-V372 PolarHBondContact O-N 3.44Å |
| 369 | A | 93.1 | Very high | 91 | Very high | 3 Ų | 3 | 41.6 Ų | 41.6 | 3% | 0.025 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.9 | -40.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | L348 M349 V365 C366 I367 F373 | L348-A369 HydrophobicContact CB-CB 4.26Å; L348-A369 HydrophobicContact CD2-CB 3.91Å; L348-A369 HydrophobicContact CG-CB 4.03Å; M349-A369 HydrophobicContact CG-CB 3.89Å; V365-A369 VanDerWaalsContact O-CB 3.3Å; V365-A369 WeakPolarHBondContact O-CB 3.45Å; V365-A369 PolarHBondContact O-N 3.21Å; C366-A369 PolarHBondContact O-N 3.37Å; I367-A369 VanDerWaalsContact C-N 3.3Å; I367-A369 PolarHBondContact O-N 3.15Å; A369-F373 WeakPolarHBondContact O-CB 3.41Å; A369-F373 PolarHBondContact O-N 3.06Å |
| 370 | I | 90.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.1 | -48.7 | 173.9 | -68.5 | 159.5 | 0 | 0 | 0 | 111.3 | V288 I295 F296 M349 C366 I367 G368 V372 F373 V374 | V288-I370 HydrophobicContact CG1-CG2 3.75Å; I295-I370 HydrophobicContact CG2-CD1 3.82Å; F296-I370 HydrophobicContact CD1-CD1 3.83Å; F296-I370 HydrophobicContact CE1-CB 4.13Å; F296-I370 HydrophobicContact CE1-CD1 3.33Å; F296-I370 HydrophobicContact CE1-CG1 4.29Å; F296-I370 HydrophobicContact CE1-CG2 4.09Å; F296-I370 HydrophobicContact CZ-CB 4.2Å; F296-I370 HydrophobicContact CZ-CD1 3.96Å; F296-I370 HydrophobicContact CZ-CG2 3.67Å; M349-I370 HydrophobicContact CE-CB 3.89Å; M349-I370 HydrophobicContact CE-CD1 4.33Å; M349-I370 HydrophobicContact CE-CG1 3.12Å; C366-I370 WeakPolarHBondContact O-CG1 3.37Å; C366-I370 PolarHBondContact O-N 2.71Å; I367-I370 PolarHBondContact O-N 3.28Å; G368-I370 PolarHBondContact O-N 3.13Å; I370-V372 PolarHBondContact O-N 3.19Å; I370-F373 WeakPolarHBondContact O-CB 3.33Å; I370-F373 PolarHBondContact O-N 3.19Å; I370-V374 WeakPolarHBondContact O-CG2 3.31Å; I370-V374 PolarHBondContact O-N 3.37Å |
| 371 | L | 91.7 | Very high | 91.8 | Very high | 49 Ų | 49 | 27.9 Ų | 27.9 | 26% | 0.257 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -63.4 | -44.7 | -178.5 | -64 | 176.7 | 0 | 0 | 0 | 111.4 | A311 V314 I367 G368 V374 A375 | A311-L371 HydrophobicContact CB-CD2 3.97Å; V314-L371 WeakPolarHBondContact CG1-O 3.39Å; V314-L371 HydrophobicContact CG2-CD2 4.18Å; I367-L371 HydrophobicContact CG2-CD1 4.34Å; I367-L371 WeakPolarHBondContact O-CG 3.42Å; I367-L371 PolarHBondContact O-N 3.36Å; G368-L371 PolarHBondContact O-N 3.44Å; L371-V374 PolarHBondContact O-N 3.3Å; L371-A375 PolarHBondContact O-N 3.18Å |
| 372 | V | 95.8 | Very high | 92 | Very high | 67 Ų | 67 | 25.8 Ų | 25.8 | 41% | 0.406 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -69.7 | -33.9 | 178.7 | -180 | 0 | 0 | 0 | 0 | 111.5 | G368 I370 A375 F376 | G368-V372 WeakPolarHBondContact O-CB 3.36Å; G368-V372 VanDerWaalsContact O-CG2 3.29Å; G368-V372 WeakPolarHBondContact O-CG2 3.34Å; G368-V372 PolarHBondContact O-N 3.44Å; I370-V372 PolarHBondContact O-N 3.19Å; V372-A375 WeakPolarHBondContact O-CB 3.48Å; V372-A375 PolarHBondContact O-N 2.87Å; V372-F376 HydrophobicContact CG1-CD2 3.68Å; V372-F376 HydrophobicContact CG1-CE2 3.5Å; V372-F376 VanDerWaalsContact O-CD2 3.28Å; V372-F376 WeakPolarHBondContact O-CD2 3.22Å; V372-F376 PolarHBondContact O-N 3.02Å |
| 373 | F | 95 | Very high | 92 | Very high | 2 Ų | 2 | 24.1 Ų | 24.1 | 1% | 0.009 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -59.4 | -47.1 | 172.1 | 179.8 | -86.7 | 0 | 0 | 0 | 111.5 | S283 I285 V288 M342 C345 M349 A369 I370 A375 F376 F377 L439 | S283-F373 WeakPolarHBondContact O-CZ 3.4Å; I285-F373 HydrophobicContact CD1-CD1 4.18Å; I285-F373 HydrophobicContact CD1-CE1 3.89Å; V288-F373 HydrophobicContact CG2-CD1 4.17Å; V288-F373 HydrophobicContact CG2-CE1 3.9Å; M342-F373 HydrophobicContact CB-CD2 3.92Å; M342-F373 HydrophobicContact CB-CE2 3.78Å; M342-F373 HydrophobicContact CB-CZ 4.5Å; M342-F373 HydrophobicContact CE-CD1 4.01Å; M342-F373 HydrophobicContact CE-CD2 4.27Å; M342-F373 HydrophobicContact CE-CE1 3.33Å; M342-F373 HydrophobicContact CE-CE2 3.63Å; M342-F373 HydrophobicContact CE-CG 4.44Å; M342-F373 HydrophobicContact CE-CZ 3.12Å; M342-F373 HydrophobicContact CG-CD2 4.14Å; M342-F373 HydrophobicContact CG-CE2 4.15Å; M342-F373 HydrophobicContact CG-CG 4.49Å; M342-F373 WeakPolarHBondContact O-CD2 3.41Å; C345-F373 HydrophobicContact CB-CB 3.72Å; C345-F373 HydrophobicContact CB-CD2 3.97Å; C345-F373 HydrophobicContact CB-CG 4.37Å; M349-F373 HydrophobicContact CE-CB 4.41Å; M349-F373 HydrophobicContact CE-CG 4.47Å; M349-F373 HydrophobicContact SD-CD2 4.46Å; A369-F373 WeakPolarHBondContact O-CB 3.41Å; A369-F373 PolarHBondContact O-N 3.06Å; I370-F373 WeakPolarHBondContact O-CB 3.33Å; I370-F373 PolarHBondContact O-N 3.19Å; F373-A375 VanDerWaalsContact C-N 3.32Å; F373-A375 PolarHBondContact O-N 3.13Å; F373-F376 PolarHBondContact O-N 2.96Å; F373-F377 PolarHBondContact O-N 3.28Å; F373-L439 HydrophobicContact CE2-CD1 4.31Å |
| 374 | V | 93.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 23.5 Ų | 23.5 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -64.5 | -37.3 | 177 | 173.2 | 0 | 0 | 0 | 0 | 111.4 | I285 V288 F289 N315 I370 L371 F377 E378 | I285-V374 HydrophobicContact CD1-CG2 4.14Å; V288-V374 HydrophobicContact CG1-CG2 4.22Å; F289-V374 HydrophobicContact CZ-CG1 4.17Å; N315-V374 HydrophobicContact CB-CG1 3.58Å; I370-V374 WeakPolarHBondContact O-CG2 3.31Å; I370-V374 PolarHBondContact O-N 3.37Å; L371-V374 PolarHBondContact O-N 3.3Å; V374-F377 WeakPolarHBondContact O-CB 3.33Å; V374-F377 PolarHBondContact O-N 2.92Å; V374-E378 PolarHBondContact O-N 3.38Å |
| 375 | A | 95.6 | Very high | 92.5 | Very high | 6 Ų | 6 | 16.1 Ų | 16.1 | 5% | 0.05 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -61.2 | -48.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V314 F318 L371 V372 F373 F377 E378 I379 | V314-A375 HydrophobicContact CG1-CB 3.89Å; F318-A375 HydrophobicContact CB-CB 4.42Å; F318-A375 HydrophobicContact CD1-CB 3.8Å; F318-A375 HydrophobicContact CD2-CB 3.45Å; F318-A375 VanDerWaalsContact CD2-CB 3.45Å; F318-A375 HydrophobicContact CE1-CB 3.81Å; F318-A375 HydrophobicContact CE2-CB 3.47Å; F318-A375 VanDerWaalsContact CE2-CB 3.47Å; F318-A375 HydrophobicContact CG-CB 3.61Å; F318-A375 HydrophobicContact CZ-CB 3.64Å; L371-A375 PolarHBondContact O-N 3.18Å; V372-A375 WeakPolarHBondContact O-CB 3.48Å; V372-A375 PolarHBondContact O-N 2.87Å; F373-A375 VanDerWaalsContact C-N 3.32Å; F373-A375 PolarHBondContact O-N 3.13Å; A375-F377 VanDerWaalsContact C-N 3.32Å; A375-F377 PolarHBondContact O-N 3.12Å; A375-E378 PolarHBondContact O-N 3.18Å; A375-I379 WeakPolarHBondContact O-CG1 3.35Å; A375-I379 PolarHBondContact O-N 2.95Å |
| 376 | F | 97.3 | Very high | 92.1 | Very high | 57 Ų | 57 | 14.1 Ų | 14.1 | 25% | 0.25 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -65.6 | -34 | 177.9 | -82.7 | -65.2 | 0 | 0 | 0 | 113.3 | I337 G338 M342 V372 F373 E378 I379 | I337-F376 HydrophobicContact CG2-CD1 4.22Å; I337-F376 HydrophobicContact CG2-CE1 4.01Å; G338-F376 WeakPolarHBondContact CA-O 3.42Å; M342-F376 HydrophobicContact CG-CB 3.87Å; V372-F376 HydrophobicContact CG1-CD2 3.68Å; V372-F376 HydrophobicContact CG1-CE2 3.5Å; V372-F376 VanDerWaalsContact O-CD2 3.28Å; V372-F376 WeakPolarHBondContact O-CD2 3.22Å; V372-F376 PolarHBondContact O-N 3.02Å; F373-F376 PolarHBondContact O-N 2.96Å; F376-E378 VanDerWaalsContact C-N 3.33Å; F376-E378 PolarHBondContact O-N 3.28Å; F376-I379 HydrophobicContact CD1-CD1 4.07Å; F376-I379 HydrophobicContact CE1-CD1 4.44Å; F376-I379 PolarHBondContact O-N 2.93Å |
| 377 | F | 96.1 | Very high | 91.7 | Very high | 11 Ų | 11 | 14.5 Ų | 14.5 | 5% | 0.048 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -56.6 | -47.8 | 172.6 | 175.8 | -101.1 | 0 | 0 | 0 | 111.5 | Q280 I285 M342 F373 V374 A375 I379 G380 P381 G382 | Q280-F377 HydrophobicContact CG-CE2 3.82Å; Q280-F377 HydrophobicContact CG-CZ 3.83Å; I285-F377 HydrophobicContact CB-CD2 3.9Å; I285-F377 HydrophobicContact CB-CE2 3.83Å; I285-F377 HydrophobicContact CB-CG 4.29Å; I285-F377 HydrophobicContact CB-CZ 4.17Å; I285-F377 HydrophobicContact CD1-CB 3.93Å; I285-F377 HydrophobicContact CD1-CD1 3.87Å; I285-F377 HydrophobicContact CD1-CD2 4.19Å; I285-F377 HydrophobicContact CD1-CE1 4.45Å; I285-F377 HydrophobicContact CD1-CG 3.71Å; I285-F377 HydrophobicContact CG1-CB 4.49Å; I285-F377 HydrophobicContact CG1-CD1 3.71Å; I285-F377 HydrophobicContact CG1-CD2 3.86Å; I285-F377 HydrophobicContact CG1-CE1 3.79Å; I285-F377 HydrophobicContact CG1-CE2 3.94Å; I285-F377 HydrophobicContact CG1-CG 3.74Å; I285-F377 HydrophobicContact CG1-CZ 3.9Å; I285-F377 HydrophobicContact CG2-CD2 4.22Å; I285-F377 HydrophobicContact CG2-CE1 4.47Å; I285-F377 HydrophobicContact CG2-CE2 3.62Å; I285-F377 HydrophobicContact CG2-CZ 3.76Å; M342-F377 HydrophobicContact CE-CB 3.83Å; M342-F377 HydrophobicContact CE-CD2 3.76Å; M342-F377 HydrophobicContact CE-CG 4.24Å; M342-F377 VanDerWaalsContact SD-CA 3.57Å; M342-F377 HydrophobicContact SD-CB 3.74Å; M342-F377 HydrophobicContact SD-CD2 3.93Å; M342-F377 HydrophobicContact SD-CG 4.35Å; F373-F377 PolarHBondContact O-N 3.28Å; V374-F377 WeakPolarHBondContact O-CB 3.33Å; V374-F377 PolarHBondContact O-N 2.92Å; A375-F377 VanDerWaalsContact C-N 3.32Å; A375-F377 PolarHBondContact O-N 3.12Å; F377-I379 VanDerWaalsContact C-N 3.34Å; F377-I379 PolarHBondContact O-N 3.36Å; F377-G380 CarbonylContact O-C 3.34Å; F377-G380 PolarHBondContact O-N 2.95Å; F377-P381 HydrophobicContact CD2-CB 3.92Å; F377-P381 HydrophobicContact CE2-CB 4.13Å; F377-P381 VanDerWaalsContact O-CD 3.29Å; F377-P381 WeakPolarHBondContact O-CD 3.49Å; F377-P381 VanDerWaalsContact O-N 3.17Å; F377-G382 VanDerWaalsContact CZ-CA 3.46Å; F377-G382 PolarHBondContact O-N 3.48Å |
| 378 | E | 94.6 | Very high | 91.7 | Very high | 1 Ų | 1 | 12.9 Ų | 12.9 | 1% | 0.005 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -75 | -21.6 | -177.3 | -70.3 | -61.5 | 152.1 | 0 | 0 | 114.3 | Q159 V163 N315 F318 T319 S322 V374 A375 F376 G380 P383 | Q159-E378 VanDerWaalsContact CG-OE2 3.29Å; Q159-E378 WeakPolarHBondContact CG-OE2 3.3Å; Q159-E378 PolarHBondContact NE2-OE1 2.99Å; Q159-E378 PolarHBondContact NE2-OE2 3.23Å; V163-E378 WeakPolarHBondContact CG1-OE1 3.35Å; N315-E378 WeakPolarHBondContact ND2-CG 3.46Å; N315-E378 PolarHBondContact ND2-OE1 3.5Å; N315-E378 WeakPolarHBondContact O-CG 3.1Å; F318-E378 HydrophobicContact CB-CB 3.77Å; T319-E378 WeakPolarHBondContact OG1-CG 3.45Å; T319-E378 PolarHBondContact OG1-OE2 2.78Å; S322-E378 WeakPolarHBondContact CB-O 3.38Å; S322-E378 PolarHBondContact OG-O 3.37Å; V374-E378 PolarHBondContact O-N 3.38Å; A375-E378 PolarHBondContact O-N 3.18Å; F376-E378 VanDerWaalsContact C-N 3.33Å; F376-E378 PolarHBondContact O-N 3.28Å; E378-G380 PolarHBondContact O-N 3.48Å; E378-P383 VanDerWaalsContact O-CD 3.26Å; E378-P383 WeakPolarHBondContact O-CD 3.26Å; E378-P383 WeakPolarHBondContact O-CG 3.43Å |
| 379 | I | 93.6 | Very high | 91.5 | Very high | 20 Ų | 20 | 11.6 Ų | 11.6 | 10% | 0.103 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -61.4 | -34.2 | 173.2 | -72.9 | 170.1 | 0 | 0 | 0 | 111.3 | F318 S322 L334 I337 A375 F376 F377 | F318-I379 HydrophobicContact CD1-CD1 3.92Å; F318-I379 HydrophobicContact CD1-CG1 3.9Å; F318-I379 HydrophobicContact CE1-CD1 4.14Å; S322-I379 PolarHBondContact OG-O 3.44Å; L334-I379 HydrophobicContact CB-CG2 4.48Å; L334-I379 HydrophobicContact CD2-CG2 3.96Å; I337-I379 HydrophobicContact CG2-CG2 4.37Å; A375-I379 WeakPolarHBondContact O-CG1 3.35Å; A375-I379 PolarHBondContact O-N 2.95Å; F376-I379 HydrophobicContact CD1-CD1 4.07Å; F376-I379 HydrophobicContact CE1-CD1 4.44Å; F376-I379 PolarHBondContact O-N 2.93Å; F377-I379 VanDerWaalsContact C-N 3.34Å; F377-I379 PolarHBondContact O-N 3.36Å |
| 380 | G | 91.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 6% | 0.063 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -145.1 | -69.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | F377 E378 G382 P383 I384 | F377-G380 CarbonylContact O-C 3.34Å; F377-G380 PolarHBondContact O-N 2.95Å; E378-G380 PolarHBondContact O-N 3.48Å; G380-G382 PolarHBondContact O-N 3Å; G380-G382 VanDerWaalsContact O-N 3.1Å; G380-P383 VanDerWaalsContact O-CD 3.28Å; G380-P383 WeakPolarHBondContact O-CD 3.49Å; G380-I384 WeakPolarHBondContact O-CB 3.12Å; G380-I384 VanDerWaalsContact O-CG1 3.28Å; G380-I384 WeakPolarHBondContact O-CG1 3.31Å; G380-I384 PolarHBondContact O-N 2.68Å |
| 381 | P | 95.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 7% | 0.066 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -56.3 | -26.7 | -173.5 | -29.5 | 36.4 | 0 | 0 | 0 | 116.3 | Q280 L339 M342 F377 P385 | Q280-P381 WeakPolarHBondContact CG-O 3.45Å; Q280-P381 PolarHBondContact NE2-O 2.96Å; L339-P381 HydrophobicContact CD2-CB 4.41Å; L339-P381 HydrophobicContact CD2-CG 3.76Å; L339-P381 HydrophobicContact CG-CG 3.94Å; M342-P381 HydrophobicContact SD-CB 4.42Å; M342-P381 HydrophobicContact SD-CG 4.09Å; F377-P381 HydrophobicContact CD2-CB 3.92Å; F377-P381 HydrophobicContact CE2-CB 4.13Å; F377-P381 VanDerWaalsContact O-CD 3.29Å; F377-P381 WeakPolarHBondContact O-CD 3.49Å; F377-P381 VanDerWaalsContact O-N 3.17Å; P381-P385 WeakPolarHBondContact O-CD 3.38Å; P381-P385 VanDerWaalsContact O-CG 3.28Å; P381-P385 WeakPolarHBondContact O-CG 3.43Å |
| 382 | G | 91.3 | Very high | 90.3 | Very high | 0 Ų | 0 | 10.2 Ų | 10.2 | 0% | 0 | 5% | 0.054 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -70.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q280 F377 G380 | Q280-G382 PolarHBondContact NE2-O 2.84Å; F377-G382 VanDerWaalsContact CZ-CA 3.46Å; F377-G382 PolarHBondContact O-N 3.48Å; G380-G382 PolarHBondContact O-N 3Å; G380-G382 VanDerWaalsContact O-N 3.1Å |
| 383 | P | 88.4 | Confident | 89.7 | Confident | 1 Ų | 1 | 7.2 Ų | 7.2 | 1% | 0.006 | 4% | 0.035 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75 | -38.1 | -171.9 | 24.9 | -32.6 | 0 | 0 | 0 | 114.6 | T156 Q159 S322 E378 G380 W386 F387 | T156-P383 HydrophobicContact CG2-CB 4.01Å; Q159-P383 HydrophobicContact CB-CB 3.83Å; Q159-P383 HydrophobicContact CG-CB 3.98Å; S322-P383 WeakPolarHBondContact OG-CG 3.28Å; E378-P383 VanDerWaalsContact O-CD 3.26Å; E378-P383 WeakPolarHBondContact O-CD 3.26Å; E378-P383 WeakPolarHBondContact O-CG 3.43Å; G380-P383 VanDerWaalsContact O-CD 3.28Å; G380-P383 WeakPolarHBondContact O-CD 3.49Å; P383-W386 PolarHBondContact O-N 3.37Å; P383-F387 HydrophobicContact CB-CE1 4.26Å; P383-F387 WeakPolarHBondContact O-CD1 3.37Å; P383-F387 VanDerWaalsContact O-CE1 3.3Å; P383-F387 WeakPolarHBondContact O-CE1 2.94Å |
| 384 | I | 90.8 | Very high | 88.8 | Confident | 1 Ų | 1 | 7.9 Ų | 7.9 | 1% | 0.005 | 4% | 0.041 | C | C | . | . | H | α-helix | trans | -64.5 | -47 | -164.8 | -62.2 | 173.7 | 0 | 0 | 0 | 113.6 | R331 L334 H335 G380 W386 F387 I388 | R331-I384 HydrophobicContact CB-CG2 4.07Å; R331-I384 HydrophobicContact CG-CG2 4.38Å; R331-I384 VanDerWaalsContact O-CD1 3.28Å; R331-I384 WeakPolarHBondContact O-CD1 3.44Å; L334-I384 HydrophobicContact CB-CD1 3.8Å; H335-I384 HydrophobicContact CB-CD1 3.96Å; G380-I384 WeakPolarHBondContact O-CB 3.12Å; G380-I384 VanDerWaalsContact O-CG1 3.28Å; G380-I384 WeakPolarHBondContact O-CG1 3.31Å; G380-I384 PolarHBondContact O-N 2.68Å; I384-W386 PolarHBondContact O-N 3.38Å; I384-W386 VanDerWaalsContact O-N 3.12Å; I384-F387 HydrophobicContact CB-CE1 4.44Å; I384-F387 HydrophobicContact CB-CZ 4.23Å; I384-F387 HydrophobicContact CG1-CE1 4.26Å; I384-F387 HydrophobicContact CG1-CZ 3.94Å; I384-F387 HydrophobicContact CG2-CZ 4.4Å; I384-F387 PolarHBondContact O-N 3.01Å; I384-I388 HydrophobicContact CG2-CB 4.21Å; I384-I388 HydrophobicContact CG2-CD1 4.09Å; I384-I388 HydrophobicContact CG2-CG2 4.42Å; I384-I388 VanDerWaalsContact O-CB 3.31Å; I384-I388 WeakPolarHBondContact O-CB 3.41Å; I384-I388 VanDerWaalsContact O-CG2 3.22Å; I384-I388 WeakPolarHBondContact O-CG2 3.27Å; I384-I388 PolarHBondContact O-N 2.83Å |
| 385 | P | 91.8 | Very high | 87.6 | Confident | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -57.9 | -29.1 | -178.3 | -29.7 | 40.2 | 0 | 0 | 0 | 114.1 | L276 Q277 Q280 P381 V389 | L276-P385 HydrophobicContact CB-CB 4.25Å; L276-P385 HydrophobicContact CB-CG 4.35Å; Q277-P385 PolarHBondContact NE2-O 3.32Å; Q280-P385 HydrophobicContact CB-CG 4.22Å; P381-P385 WeakPolarHBondContact O-CD 3.38Å; P381-P385 VanDerWaalsContact O-CG 3.28Å; P381-P385 WeakPolarHBondContact O-CG 3.43Å; P385-V389 WeakPolarHBondContact O-CG2 3.27Å |
| 386 | W | 82.5 | Confident | 86.7 | Confident | 12 Ų | 12 | 8.6 Ų | 8.6 | 5% | 0.045 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -69.6 | -45.8 | -178.4 | -71.7 | 117.1 | 0 | 0 | 0 | 113.3 | F24 T135 P383 I384 N409 | F24-W386 HydrophobicContact CE1-CZ2 4.13Å; T135-W386 HydrophobicContact CG2-CH2 3.9Å; T135-W386 HydrophobicContact CG2-CZ2 4.46Å; T135-W386 HydrophobicContact CG2-CZ3 4.27Å; P383-W386 PolarHBondContact O-N 3.37Å; I384-W386 PolarHBondContact O-N 3.38Å; I384-W386 VanDerWaalsContact O-N 3.12Å; W386-N409 HydrophobicContact CH2-CB 4.26Å |
| 387 | F | 79.6 | Confident | 86 | Confident | 10 Ų | 10 | 6 Ų | 6 | 4% | 0.044 | 4% | 0.035 | C | C | . | . | H | α-helix | trans | -95.3 | -24.6 | -175 | 66.6 | -102 | 0 | 0 | 0 | 113.2 | V326 R331 P383 I384 V389 A390 E391 | V326-F387 HydrophobicContact CG2-CE2 4.44Å; V326-F387 HydrophobicContact CG2-CZ 3.71Å; R331-F387 HydrophobicContact CG-CE2 3.73Å; R331-F387 HydrophobicContact CG-CZ 4.09Å; P383-F387 HydrophobicContact CB-CE1 4.26Å; P383-F387 WeakPolarHBondContact O-CD1 3.37Å; P383-F387 VanDerWaalsContact O-CE1 3.3Å; P383-F387 WeakPolarHBondContact O-CE1 2.94Å; I384-F387 HydrophobicContact CB-CE1 4.44Å; I384-F387 HydrophobicContact CB-CZ 4.23Å; I384-F387 HydrophobicContact CG1-CE1 4.26Å; I384-F387 HydrophobicContact CG1-CZ 3.94Å; I384-F387 HydrophobicContact CG2-CZ 4.4Å; I384-F387 PolarHBondContact O-N 3.01Å; F387-V389 PolarHBondContact O-N 3.49Å; F387-A390 WeakPolarHBondContact O-CB 3.34Å; F387-A390 PolarHBondContact O-N 3.12Å; F387-E391 PolarHBondContact O-N 3.23Å |
| 388 | I | 86.4 | Confident | 85.3 | Confident | 1 Ų | 1 | 5.7 Ų | 5.7 | 1% | 0.005 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -63.2 | -30.6 | -179.4 | -161.5 | 168.5 | 0 | 0 | 0 | 112.1 | L276 R331 I384 A390 E391 L392 V450 T453 | L276-I388 HydrophobicContact CD1-CD1 3.91Å; L276-I388 HydrophobicContact CD1-CG2 3.6Å; R331-I388 HydrophobicContact CB-CD1 4.38Å; I384-I388 HydrophobicContact CG2-CB 4.21Å; I384-I388 HydrophobicContact CG2-CD1 4.09Å; I384-I388 HydrophobicContact CG2-CG2 4.42Å; I384-I388 VanDerWaalsContact O-CB 3.31Å; I384-I388 WeakPolarHBondContact O-CB 3.41Å; I384-I388 VanDerWaalsContact O-CG2 3.22Å; I384-I388 WeakPolarHBondContact O-CG2 3.27Å; I384-I388 PolarHBondContact O-N 2.83Å; I388-A390 VanDerWaalsContact C-N 3.26Å; I388-A390 PolarHBondContact O-N 3.1Å; I388-E391 CarbonylContact O-C 3.59Å; I388-E391 WeakPolarHBondContact O-CA 3.4Å; I388-E391 PolarHBondContact O-N 3.47Å; I388-L392 HydrophobicContact CG1-CD1 4.3Å; I388-L392 HydrophobicContact CG1-CG 4.24Å; I388-L392 VanDerWaalsContact O-CG 3.26Å; I388-L392 WeakPolarHBondContact O-CG 3.3Å; I388-L392 PolarHBondContact O-N 2.81Å; I388-V450 HydrophobicContact CD1-CG1 4.23Å; I388-T453 HydrophobicContact CG1-CG2 4.24Å |
| 389 | V | 87.1 | Confident | 84.6 | Confident | 2 Ų | 2 | 6.1 Ų | 6.1 | 1% | 0.012 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -63 | -36.1 | 174.9 | -177.2 | 0 | 0 | 0 | 0 | 111 | P385 F387 E391 F393 A401 M402 A405 | P385-V389 WeakPolarHBondContact O-CG2 3.27Å; F387-V389 PolarHBondContact O-N 3.49Å; V389-E391 VanDerWaalsContact C-N 3.32Å; V389-F393 HydrophobicContact CG1-CD2 4.38Å; V389-F393 WeakPolarHBondContact O-CD2 3.27Å; V389-A401 HydrophobicContact CG1-CB 4.34Å; V389-M402 HydrophobicContact CG1-CG 3.95Å; V389-A405 HydrophobicContact CB-CB 4.49Å; V389-A405 HydrophobicContact CG1-CB 3.95Å; V389-A405 HydrophobicContact CG2-CB 3.85Å |
| 390 | A | 80.5 | Confident | 84.2 | Confident | 10 Ų | 10 | 5.8 Ų | 5.8 | 8% | 0.083 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -69.7 | -32.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | F387 I388 R398 M402 F458 | F387-A390 WeakPolarHBondContact O-CB 3.34Å; F387-A390 PolarHBondContact O-N 3.12Å; I388-A390 VanDerWaalsContact C-N 3.26Å; I388-A390 PolarHBondContact O-N 3.1Å; A390-R398 PolarHBondContact O-NE 3.49Å; A390-M402 HydrophobicContact CB-SD 4.48Å; A390-F458 WeakPolarHBondContact O-CE1 3.08Å |
| 391 | E | 83.5 | Confident | 84 | Confident | 12 Ų | 12 | 5.8 Ų | 5.8 | 6% | 0.056 | 4% | 0.037 | C | C | . | . | H | α-helix | trans | -74.4 | -31.6 | 176.7 | -63.9 | -178.6 | 166.1 | 0 | 0 | 113.1 | R331 F387 I388 V389 T453 I461 | R331-E391 IonicContact CZ-OE1 2.91Å; R331-E391 IonicContact NE-OE1 2.95Å; R331-E391 PolarHBondContact NE-OE1 3.01Å; R331-E391 IonicContact NE-OE2 3.19Å; R331-E391 PolarHBondContact NE-OE2 2.62Å; R331-E391 IonicContact NH2-OE1 3.86Å; R331-E391 PolarHBondContact NH2-OE1 3.34Å; F387-E391 PolarHBondContact O-N 3.23Å; I388-E391 CarbonylContact O-C 3.59Å; I388-E391 WeakPolarHBondContact O-CA 3.4Å; I388-E391 PolarHBondContact O-N 3.47Å; V389-E391 VanDerWaalsContact C-N 3.32Å; E391-T453 HydrophobicContact CB-CG2 4.26Å; E391-T453 WeakPolarHBondContact OE2-CB 3.4Å; E391-T453 PolarHBondContact OE2-OG1 2.77Å; E391-I461 HydrophobicContact CB-CD1 4.49Å; E391-I461 VanDerWaalsContact O-CD1 3.22Å; E391-I461 WeakPolarHBondContact O-CD1 3.37Å |
| 392 | L | 86.7 | Confident | 83.6 | Confident | 2 Ų | 2 | 6.4 Ų | 6.4 | 1% | 0.01 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -77.1 | -17.1 | -176.7 | -72.2 | 172.2 | 0 | 0 | 0 | 114.9 | P269 I272 I388 P451 T453 I461 F465 | P269-L392 HydrophobicContact CB-CB 4.24Å; I272-L392 HydrophobicContact CB-CD1 4.3Å; I272-L392 HydrophobicContact CG2-CD1 3.66Å; I388-L392 HydrophobicContact CG1-CD1 4.3Å; I388-L392 HydrophobicContact CG1-CG 4.24Å; I388-L392 VanDerWaalsContact O-CG 3.26Å; I388-L392 WeakPolarHBondContact O-CG 3.3Å; I388-L392 PolarHBondContact O-N 2.81Å; L392-P451 HydrophobicContact CD2-CG 4.09Å; L392-T453 HydrophobicContact CD2-CG2 4.12Å; L392-I461 HydrophobicContact CD2-CG2 4.31Å; L392-F465 HydrophobicContact CD2-CE2 3.75Å; L392-F465 HydrophobicContact CD2-CZ 3.78Å |
| 393 | F | 82.3 | Confident | 83.4 | Confident | 3 Ų | 3 | 6.5 Ų | 6.5 | 1% | 0.013 | 4% | 0.041 | C | C | . | . | S | Bend | trans | -126.1 | 138.8 | -173.6 | -71.1 | -84.4 | 0 | 0 | 0 | 112.4 | L260 P269 I270 S273 V389 P397 R398 A401 | L260-F393 HydrophobicContact CD2-CE1 4.11Å; P269-F393 HydrophobicContact CB-CE1 3.99Å; P269-F393 HydrophobicContact CB-CE2 3.97Å; P269-F393 HydrophobicContact CB-CZ 3.65Å; P269-F393 HydrophobicContact CG-CE1 3.81Å; P269-F393 HydrophobicContact CG-CZ 3.9Å; I270-F393 HydrophobicContact CB-CZ 3.9Å; I270-F393 HydrophobicContact CD1-CE2 4.3Å; I270-F393 HydrophobicContact CD1-CZ 3.97Å; S273-F393 WeakPolarHBondContact OG-CE2 3.41Å; V389-F393 HydrophobicContact CG1-CD2 4.38Å; V389-F393 WeakPolarHBondContact O-CD2 3.27Å; F393-P397 HydrophobicContact CB-CG 4.28Å; F393-P397 HydrophobicContact CD1-CB 3.82Å; F393-P397 HydrophobicContact CD1-CG 3.81Å; F393-P397 HydrophobicContact CE1-CB 4.42Å; F393-R398 HydrophobicContact CB-CB 4Å; F393-R398 PolarHBondContact O-NE 3.38Å; F393-R398 PolarHBondContact O-NH2 3.22Å; F393-A401 HydrophobicContact CD1-CB 4.05Å; F393-A401 HydrophobicContact CD2-CB 3.42Å; F393-A401 VanDerWaalsContact CD2-CB 3.42Å; F393-A401 HydrophobicContact CE1-CB 4Å; F393-A401 HydrophobicContact CE2-CB 3.38Å; F393-A401 HydrophobicContact CG-CB 3.75Å; F393-A401 HydrophobicContact CZ-CB 3.66Å |
| 394 | S | 75.8 | Confident | 83.5 | Confident | 17 Ų | 17 | 7.1 Ų | 7.1 | 12% | 0.119 | 5% | 0.045 | C | C | . | . | trans | -66.1 | 167.2 | 164.2 | 67.5 | 0 | 0 | 0 | 0 | 111 | G396 P397 R398 | S394-G396 VanDerWaalsContact C-N 3.29Å; S394-G396 PolarHBondContact O-N 2.88Å; S394-P397 VanDerWaalsContact O-CD 3.31Å; S394-P397 WeakPolarHBondContact O-CD 3.49Å; S394-P397 VanDerWaalsContact OG-CD 3.31Å; S394-P397 WeakPolarHBondContact OG-CD 3.42Å; S394-R398 WeakPolarHBondContact O-CB 3.33Å; S394-R398 PolarHBondContact O-N 3.21Å | ||
| 395 | Q | 69.5 | Low | 83.5 | Confident | 6 Ų | 6 | 7.1 Ų | 7.1 | 3% | 0.028 | 5% | 0.045 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -29.7 | -171.4 | -73.8 | -79 | 24.9 | 0 | 0 | 115.5 | E144 R210 I214 E245 M249 P399 | E144-Q395 PolarHBondContact OE1-NE2 3.33Å; E144-Q395 PolarHBondContact OE1-OE1 3.44Å; R210-Q395 VanDerWaalsContact CD-NE2 3.35Å; I214-Q395 HydrophobicContact CD1-CG 4.25Å; E245-Q395 HydrophobicContact CG-CB 4.38Å; E245-Q395 HydrophobicContact CG-CG 4Å; E245-Q395 WeakPolarHBondContact OE1-CG 3.11Å; M249-Q395 HydrophobicContact CE-CB 3.22Å; M249-Q395 HydrophobicContact CE-CG 4.31Å; Q395-P399 WeakPolarHBondContact O-CD 3.47Å |
| 396 | G | 76.3 | Confident | 83.4 | Confident | 15 Ų | 15 | 7.4 Ų | 7.4 | 16% | 0.155 | 5% | 0.048 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.3 | -62.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S394 | S394-G396 VanDerWaalsContact C-N 3.29Å; S394-G396 PolarHBondContact O-N 2.88Å |
| 397 | P | 82 | Confident | 83.8 | Confident | 1 Ų | 1 | 8.2 Ų | 8.2 | 1% | 0.006 | 6% | 0.055 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.5 | -20.1 | 179.3 | 27.7 | -34.4 | 0 | 0 | 0 | 114.7 | V255 L260 Y266 F393 S394 A400 A401 | V255-P397 HydrophobicContact CB-CB 4.16Å; V255-P397 HydrophobicContact CG1-CB 4.25Å; V255-P397 HydrophobicContact CG2-CB 4.15Å; L260-P397 HydrophobicContact CD2-CB 3.77Å; Y266-P397 HydrophobicContact CD1-CG 4.43Å; Y266-P397 HydrophobicContact CE1-CB 4.37Å; Y266-P397 HydrophobicContact CE1-CG 3.97Å; F393-P397 HydrophobicContact CB-CG 4.28Å; F393-P397 HydrophobicContact CD1-CB 3.82Å; F393-P397 HydrophobicContact CD1-CG 3.81Å; F393-P397 HydrophobicContact CE1-CB 4.42Å; S394-P397 VanDerWaalsContact O-CD 3.31Å; S394-P397 WeakPolarHBondContact O-CD 3.49Å; S394-P397 VanDerWaalsContact OG-CD 3.31Å; S394-P397 WeakPolarHBondContact OG-CD 3.42Å; P397-A400 PolarHBondContact O-N 3.47Å; P397-A400 VanDerWaalsContact O-N 3.11Å; P397-A401 WeakPolarHBondContact O-CB 3.27Å; P397-A401 PolarHBondContact O-N 2.84Å |
| 398 | R | 81.3 | Confident | 84.4 | Confident | 5 Ų | 5 | 8.6 Ų | 8.6 | 2% | 0.019 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -53.8 | -46.9 | -172.6 | -178.6 | -173.7 | -55 | 153 | 4.8 | 114.6 | A390 F393 S394 A400 A401 M402 | A390-R398 PolarHBondContact O-NE 3.49Å; F393-R398 HydrophobicContact CB-CB 4Å; F393-R398 PolarHBondContact O-NE 3.38Å; F393-R398 PolarHBondContact O-NH2 3.22Å; S394-R398 WeakPolarHBondContact O-CB 3.33Å; S394-R398 PolarHBondContact O-N 3.21Å; R398-A400 VanDerWaalsContact C-N 3.33Å; R398-A400 PolarHBondContact O-N 3.48Å; R398-A401 PolarHBondContact O-N 3.25Å; R398-M402 HydrophobicContact CG-CG 4.23Å; R398-M402 HydrophobicContact CG-SD 4.02Å; R398-M402 WeakPolarHBondContact O-CB 3.41Å; R398-M402 WeakPolarHBondContact O-CG 3.4Å; R398-M402 PolarHBondContact O-N 3.17Å |
| 399 | P | 80.8 | Confident | 84.8 | Confident | 10 Ų | 10 | 8.6 Ų | 8.6 | 7% | 0.065 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -59.7 | -41.9 | 177.8 | -24.9 | 34.6 | 0 | 0 | 0 | 113 | M140 Q395 A403 | M140-P399 HydrophobicContact CE-CB 4.4Å; M140-P399 HydrophobicContact CE-CG 4.5Å; Q395-P399 WeakPolarHBondContact O-CD 3.47Å; P399-A403 WeakPolarHBondContact O-CB 3.44Å; P399-A403 PolarHBondContact O-N 2.85Å |
| 400 | A | 85.1 | Confident | 85 | Confident | 13 Ų | 13 | 8.6 Ų | 8.6 | 11% | 0.107 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -68.7 | -41.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | V257 L260 P397 R398 A403 V404 | V257-A400 HydrophobicContact CG2-CB 4.33Å; L260-A400 HydrophobicContact CD1-CB 3.76Å; L260-A400 HydrophobicContact CG-CB 4.41Å; P397-A400 PolarHBondContact O-N 3.47Å; P397-A400 VanDerWaalsContact O-N 3.11Å; R398-A400 VanDerWaalsContact C-N 3.33Å; R398-A400 PolarHBondContact O-N 3.48Å; A400-A403 PolarHBondContact O-N 3.27Å; A400-V404 WeakPolarHBondContact O-CG2 3.43Å; A400-V404 PolarHBondContact O-N 3.48Å |
| 401 | A | 88.4 | Confident | 85.6 | Confident | 0 Ų | 0 | 10.2 Ų | 10.2 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -64.9 | -43.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L260 I270 V389 F393 P397 R398 A403 V404 A405 | L260-A401 HydrophobicContact CD1-CB 4.31Å; I270-A401 HydrophobicContact CD1-CB 3.91Å; V389-A401 HydrophobicContact CG1-CB 4.34Å; F393-A401 HydrophobicContact CD1-CB 4.05Å; F393-A401 HydrophobicContact CD2-CB 3.42Å; F393-A401 VanDerWaalsContact CD2-CB 3.42Å; F393-A401 HydrophobicContact CE1-CB 4Å; F393-A401 HydrophobicContact CE2-CB 3.38Å; F393-A401 HydrophobicContact CG-CB 3.75Å; F393-A401 HydrophobicContact CZ-CB 3.66Å; P397-A401 WeakPolarHBondContact O-CB 3.27Å; P397-A401 PolarHBondContact O-N 2.84Å; R398-A401 PolarHBondContact O-N 3.25Å; A401-A403 VanDerWaalsContact C-N 3.33Å; A401-A403 PolarHBondContact O-N 2.74Å; A401-V404 PolarHBondContact O-N 3.15Å; A401-A405 VanDerWaalsContact O-CB 3.25Å; A401-A405 WeakPolarHBondContact O-CB 3.48Å; A401-A405 PolarHBondContact O-N 3.14Å |
| 402 | M | 85.3 | Confident | 86 | Confident | 13 Ų | 13 | 9.9 Ų | 9.9 | 6% | 0.064 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -64.8 | -36.7 | 174.8 | -71.4 | -173.3 | 75.4 | 0 | 0 | 112.1 | G136 P139 M140 V389 A390 R398 G406 | G136-M402 WeakPolarHBondContact O-CE 3.29Å; P139-M402 HydrophobicContact CB-CE 4.21Å; P139-M402 HydrophobicContact CG-CE 3.79Å; M140-M402 HydrophobicContact CB-CE 4.23Å; M140-M402 HydrophobicContact CB-SD 4.17Å; M140-M402 HydrophobicContact CE-SD 3.67Å; V389-M402 HydrophobicContact CG1-CG 3.95Å; A390-M402 HydrophobicContact CB-SD 4.48Å; R398-M402 HydrophobicContact CG-CG 4.23Å; R398-M402 HydrophobicContact CG-SD 4.02Å; R398-M402 WeakPolarHBondContact O-CB 3.41Å; R398-M402 WeakPolarHBondContact O-CG 3.4Å; R398-M402 PolarHBondContact O-N 3.17Å; M402-G406 PolarHBondContact O-N 3.16Å |
| 403 | A | 86.9 | Confident | 86.1 | Confident | 3 Ų | 3 | 10.2 Ų | 10.2 | 3% | 0.025 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -64.2 | -44.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | P399 A400 A401 C407 | P399-A403 WeakPolarHBondContact O-CB 3.44Å; P399-A403 PolarHBondContact O-N 2.85Å; A400-A403 PolarHBondContact O-N 3.27Å; A401-A403 VanDerWaalsContact C-N 3.33Å; A401-A403 PolarHBondContact O-N 2.74Å; A403-C407 WeakPolarHBondContact O-CB 3.38Å; A403-C407 PolarHBondContact O-N 3.43Å |
| 404 | V | 90.9 | Very high | 86.4 | Confident | 13 Ų | 13 | 12.5 Ų | 12.5 | 8% | 0.079 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -65.8 | -46.9 | 176.1 | 171 | 0 | 0 | 0 | 0 | 111.3 | V257 L260 F261 I270 I274 A400 A401 C407 S408 | V257-V404 HydrophobicContact CB-CG2 4.39Å; V257-V404 HydrophobicContact CG1-CG2 3.54Å; V257-V404 HydrophobicContact CG2-CG2 4.18Å; L260-V404 HydrophobicContact CD1-CG2 4.19Å; F261-V404 HydrophobicContact CE2-CG1 4.4Å; F261-V404 HydrophobicContact CE2-CG2 4.43Å; F261-V404 HydrophobicContact CZ-CG1 3.88Å; I270-V404 HydrophobicContact CD1-CB 4.1Å; I270-V404 HydrophobicContact CD1-CG1 3.97Å; I270-V404 HydrophobicContact CG1-CG1 4.15Å; I274-V404 HydrophobicContact CD1-CG1 3.82Å; I274-V404 HydrophobicContact CG1-CG1 3.94Å; A400-V404 WeakPolarHBondContact O-CG2 3.43Å; A400-V404 PolarHBondContact O-N 3.48Å; A401-V404 PolarHBondContact O-N 3.15Å; V404-C407 PolarHBondContact O-N 3.19Å; V404-S408 WeakPolarHBondContact O-CB 3.24Å; V404-S408 PolarHBondContact O-N 3.17Å; V404-S408 PolarHBondContact O-OG 3.12Å |
| 405 | A | 91.2 | Very high | 87 | Confident | 2 Ų | 2 | 15.3 Ų | 15.3 | 2% | 0.017 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -62.2 | -48.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q277 V389 A401 C407 S408 N409 | Q277-A405 HydrophobicContact CG-CB 3.93Å; Q277-A405 WeakPolarHBondContact CG-O 3.21Å; V389-A405 HydrophobicContact CB-CB 4.49Å; V389-A405 HydrophobicContact CG1-CB 3.95Å; V389-A405 HydrophobicContact CG2-CB 3.85Å; A401-A405 VanDerWaalsContact O-CB 3.25Å; A401-A405 WeakPolarHBondContact O-CB 3.48Å; A401-A405 PolarHBondContact O-N 3.14Å; A405-C407 PolarHBondContact O-N 3.38Å; A405-S408 WeakPolarHBondContact CA-OG 3.44Å; A405-S408 PolarHBondContact O-N 3.45Å; A405-S408 PolarHBondContact O-OG 3.24Å; A405-N409 PolarHBondContact O-N 2.93Å |
| 406 | G | 89 | Confident | 87.8 | Confident | 5 Ų | 5 | 15.5 Ų | 15.5 | 5% | 0.052 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -57.7 | -48 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | M402 S408 N409 W410 | M402-G406 PolarHBondContact O-N 3.16Å; G406-S408 VanDerWaalsContact C-N 3.32Å; G406-S408 PolarHBondContact O-N 2.94Å; G406-N409 VanDerWaalsContact O-CB 3.31Å; G406-N409 WeakPolarHBondContact O-CB 3.23Å; G406-N409 PolarHBondContact O-N 3.24Å; G406-N409 VanDerWaalsContact O-N 3.13Å; G406-W410 PolarHBondContact O-N 2.81Å |
| 407 | C | 90.6 | Very high | 87.9 | Confident | 30 Ų | 30 | 15.8 Ų | 15.8 | 20% | 0.203 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -60.5 | -40.8 | 176.7 | -175.7 | 0 | 0 | 0 | 0 | 111.9 | S78 F79 A403 V404 A405 N409 W410 T411 | S78-C407 PolarHBondContact OG-N 3.42Å; F79-C407 HydrophobicContact CB-CB 4.49Å; F79-C407 HydrophobicContact CD2-CB 4.3Å; A403-C407 WeakPolarHBondContact O-CB 3.38Å; A403-C407 PolarHBondContact O-N 3.43Å; V404-C407 PolarHBondContact O-N 3.19Å; A405-C407 PolarHBondContact O-N 3.38Å; C407-N409 VanDerWaalsContact C-N 3.33Å; C407-N409 PolarHBondContact O-N 3.11Å; C407-W410 PolarHBondContact O-N 3.43Å; C407-T411 VanDerWaalsContact O-CB 3.26Å; C407-T411 WeakPolarHBondContact O-CB 3.39Å; C407-T411 PolarHBondContact O-N 2.82Å; C407-T411 PolarHBondContact O-OG1 2.97Å |
| 408 | S | 93.7 | Very high | 87.9 | Confident | 17 Ų | 17 | 20.1 Ų | 20.1 | 12% | 0.119 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -64.4 | -36 | 175.9 | 73.4 | 0 | 0 | 0 | 0 | 112.8 | Q277 V404 A405 G406 S412 | Q277-S408 WeakPolarHBondContact CB-OG 3.38Å; V404-S408 WeakPolarHBondContact O-CB 3.24Å; V404-S408 PolarHBondContact O-N 3.17Å; V404-S408 PolarHBondContact O-OG 3.12Å; A405-S408 WeakPolarHBondContact CA-OG 3.44Å; A405-S408 PolarHBondContact O-N 3.45Å; A405-S408 PolarHBondContact O-OG 3.24Å; G406-S408 VanDerWaalsContact C-N 3.32Å; G406-S408 PolarHBondContact O-N 2.94Å; S408-S412 WeakPolarHBondContact O-CB 3.02Å; S408-S412 PolarHBondContact O-N 3.19Å; S408-S412 PolarHBondContact O-OG 3.4Å |
| 409 | N | 93.7 | Very high | 88.1 | Confident | 1 Ų | 1 | 24.7 Ų | 24.7 | 1% | 0.005 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.1 | -55.7 | 173.7 | -172.3 | -73.7 | 0 | 0 | 0 | 110.4 | Q277 Q280 Q281 W386 A405 G406 C407 T411 S412 N413 | Q277-N409 HydrophobicContact CB-CB 4.06Å; Q277-N409 HydrophobicContact CG-CB 4.37Å; Q277-N409 PolarHBondContact OE1-ND2 3.37Å; Q280-N409 PolarHBondContact OE1-ND2 3.33Å; Q281-N409 WeakPolarHBondContact CG-O 3.43Å; Q281-N409 PolarHBondContact NE2-ND2 3.34Å; Q281-N409 PolarHBondContact NE2-OD1 3.4Å; W386-N409 HydrophobicContact CH2-CB 4.26Å; A405-N409 PolarHBondContact O-N 2.93Å; G406-N409 VanDerWaalsContact O-CB 3.31Å; G406-N409 WeakPolarHBondContact O-CB 3.23Å; G406-N409 PolarHBondContact O-N 3.24Å; G406-N409 VanDerWaalsContact O-N 3.13Å; C407-N409 VanDerWaalsContact C-N 3.33Å; C407-N409 PolarHBondContact O-N 3.11Å; N409-T411 VanDerWaalsContact C-N 3.31Å; N409-T411 PolarHBondContact O-N 3.25Å; N409-S412 PolarHBondContact O-N 2.88Å; N409-S412 PolarHBondContact O-OG 3.26Å; N409-N413 WeakPolarHBondContact O-CB 3.31Å; N409-N413 PolarHBondContact O-N 2.82Å |
| 410 | W | 91.9 | Very high | 88.2 | Confident | 2 Ų | 2 | 25 Ų | 25 | 1% | 0.008 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -63.4 | -35.7 | -179.8 | -75 | 104 | 0 | 0 | 0 | 113.2 | F24 F70 M75 C131 T135 G406 C407 N413 F414 | F24-W410 AromaticContact CD2-CH2 3.72Å; F24-W410 HydrophobicContact CD2-CH2 3.72Å; F24-W410 AromaticContact CD2-CZ2 3.83Å; F24-W410 HydrophobicContact CD2-CZ2 3.83Å; F24-W410 AromaticContact CE2-CH2 3.29Å; F24-W410 HydrophobicContact CE2-CH2 3.29Å; F24-W410 AromaticContact CE2-CZ2 3.49Å; F24-W410 HydrophobicContact CE2-CZ2 3.49Å; F24-W410 VanDerWaalsContact CE2-CZ2 3.49Å; F24-W410 HydrophobicContact CE2-CZ3 4.13Å; F24-W410 HydrophobicContact CZ-CH2 4.25Å; F24-W410 HydrophobicContact CZ-CZ2 4.14Å; F70-W410 HydrophobicContact CD1-CH2 4.28Å; F70-W410 AromaticContact CD1-CZ3 3.85Å; F70-W410 HydrophobicContact CD1-CZ3 3.85Å; F70-W410 AromaticContact CE1-CH2 3.54Å; F70-W410 HydrophobicContact CE1-CH2 3.54Å; F70-W410 AromaticContact CE1-CZ3 3.51Å; F70-W410 HydrophobicContact CE1-CZ3 3.51Å; F70-W410 HydrophobicContact CE2-CH2 4.46Å; F70-W410 AromaticContact CZ-CH2 3.66Å; F70-W410 HydrophobicContact CZ-CH2 3.66Å; F70-W410 HydrophobicContact CZ-CZ3 4.09Å; M75-W410 HydrophobicContact CB-CB 4.3Å; M75-W410 HydrophobicContact CG-CB 3.54Å; C131-W410 HydrophobicContact CB-CH2 4.05Å; C131-W410 HydrophobicContact CB-CZ2 4.11Å; T135-W410 HydrophobicContact CG2-CZ2 4.04Å; T135-W410 PolarHBondContact OG1-NE1 2.89Å; G406-W410 PolarHBondContact O-N 2.81Å; C407-W410 PolarHBondContact O-N 3.43Å; W410-N413 WeakPolarHBondContact O-CB 3.22Å; W410-N413 PolarHBondContact O-N 2.88Å; W410-F414 WeakPolarHBondContact O-CB 3.44Å; W410-F414 PolarHBondContact O-N 2.91Å |
| 411 | T | 92.7 | Very high | 87.9 | Confident | 45 Ų | 45 | 27 Ų | 27 | 28% | 0.276 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -66.2 | -45.7 | 176.2 | -56.3 | 0 | 0 | 0 | 0 | 111.1 | M75 C407 N409 F414 L415 | M75-T411 HydrophobicContact CE-CG2 4.37Å; M75-T411 WeakPolarHBondContact CE-OG1 3.22Å; C407-T411 VanDerWaalsContact O-CB 3.26Å; C407-T411 WeakPolarHBondContact O-CB 3.39Å; C407-T411 PolarHBondContact O-N 2.82Å; C407-T411 PolarHBondContact O-OG1 2.97Å; N409-T411 VanDerWaalsContact C-N 3.31Å; N409-T411 PolarHBondContact O-N 3.25Å; T411-F414 PolarHBondContact O-N 3.45Å; T411-L415 HydrophobicContact CG2-CD1 4.3Å; T411-L415 VanDerWaalsContact O-CG 3.3Å; T411-L415 WeakPolarHBondContact O-CG 3.3Å; T411-L415 PolarHBondContact O-N 3.44Å |
| 412 | S | 92.8 | Very high | 87.6 | Confident | 4 Ų | 4 | 30.2 Ų | 30.2 | 3% | 0.028 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -68.6 | -35.6 | 177.3 | 50.7 | 0 | 0 | 0 | 0 | 112.3 | Q281 S408 N409 L415 V416 | Q281-S412 VanDerWaalsContact CB-OG 3.24Å; Q281-S412 WeakPolarHBondContact CB-OG 3.31Å; Q281-S412 WeakPolarHBondContact CG-OG 3.23Å; S408-S412 WeakPolarHBondContact O-CB 3.02Å; S408-S412 PolarHBondContact O-N 3.19Å; S408-S412 PolarHBondContact O-OG 3.4Å; N409-S412 PolarHBondContact O-N 2.88Å; N409-S412 PolarHBondContact O-OG 3.26Å; S412-L415 PolarHBondContact O-N 3.4Å; S412-V416 WeakPolarHBondContact O-CG2 3.31Å; S412-V416 PolarHBondContact O-N 2.8Å |
| 413 | N | 88.6 | Confident | 87.6 | Confident | 9 Ų | 9 | 30.9 Ų | 30.9 | 5% | 0.048 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -57 | -50.8 | 170 | -176.8 | -98.8 | 0 | 0 | 0 | 111.6 | S71 Q281 N286 N409 W410 L415 V416 G417 | S71-N413 PolarHBondContact OG-OD1 2.86Å; Q281-N413 HydrophobicContact CG-CB 4.43Å; Q281-N413 VanDerWaalsContact OE1-CB 3.23Å; Q281-N413 PolarHBondContact OE1-ND2 3.15Å; N286-N413 PolarHBondContact ND2-ND2 3.06Å; N286-N413 PolarHBondContact OD1-ND2 3.36Å; N409-N413 WeakPolarHBondContact O-CB 3.31Å; N409-N413 PolarHBondContact O-N 2.82Å; W410-N413 WeakPolarHBondContact O-CB 3.22Å; W410-N413 PolarHBondContact O-N 2.88Å; N413-L415 PolarHBondContact O-N 2.93Å; N413-V416 PolarHBondContact O-N 3.4Å; N413-G417 PolarHBondContact O-N 2.99Å |
| 414 | F | 87.9 | Confident | 87.5 | Confident | 52 Ų | 52 | 32.1 Ų | 32.1 | 23% | 0.228 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -57.6 | -46.6 | 176.9 | 174.1 | -101.2 | 0 | 0 | 0 | 111.9 | A68 V72 M75 W410 T411 V416 G417 L418 | A68-F414 HydrophobicContact CB-CD2 4.07Å; A68-F414 HydrophobicContact CB-CE2 3.83Å; V72-F414 HydrophobicContact CG2-CD2 4.12Å; V72-F414 HydrophobicContact CG2-CE2 3.9Å; M75-F414 HydrophobicContact SD-CB 4.42Å; W410-F414 WeakPolarHBondContact O-CB 3.44Å; W410-F414 PolarHBondContact O-N 2.91Å; T411-F414 PolarHBondContact O-N 3.45Å; F414-V416 PolarHBondContact O-N 3.49Å; F414-G417 PolarHBondContact O-N 2.98Å; F414-L418 HydrophobicContact CE1-CD2 3.99Å; F414-L418 HydrophobicContact CZ-CD2 4.11Å; F414-L418 VanDerWaalsContact O-CB 3.31Å; F414-L418 WeakPolarHBondContact O-CB 3.23Å; F414-L418 PolarHBondContact O-N 3.33Å |
| 415 | L | 88.5 | Confident | 87 | Confident | 76 Ų | 76 | 38.7 Ų | 38.7 | 40% | 0.398 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63.4 | -40.7 | 179.1 | -70.8 | 174.1 | 0 | 0 | 0 | 112.2 | T411 S412 N413 L418 L419 | T411-L415 HydrophobicContact CG2-CD1 4.3Å; T411-L415 VanDerWaalsContact O-CG 3.3Å; T411-L415 WeakPolarHBondContact O-CG 3.3Å; T411-L415 PolarHBondContact O-N 3.44Å; S412-L415 PolarHBondContact O-N 3.4Å; N413-L415 PolarHBondContact O-N 2.93Å; L415-L418 PolarHBondContact O-N 3.47Å; L415-L419 HydrophobicContact CB-CD1 4.46Å; L415-L419 VanDerWaalsContact O-CB 3.23Å; L415-L419 WeakPolarHBondContact O-CB 3.17Å; L415-L419 VanDerWaalsContact O-CG 3.22Å; L415-L419 WeakPolarHBondContact O-CG 3.43Å; L415-L419 PolarHBondContact O-N 2.93Å |
| 416 | V | 86.6 | Confident | 86.9 | Confident | 10 Ų | 10 | 47.9 Ų | 47.9 | 6% | 0.061 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.2 | -48.7 | 174.8 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | L282 A287 S412 N413 F414 L418 L419 F420 | L282-V416 HydrophobicContact CD2-CG2 3.64Å; A287-V416 HydrophobicContact CB-CG1 4.46Å; S412-V416 WeakPolarHBondContact O-CG2 3.31Å; S412-V416 PolarHBondContact O-N 2.8Å; N413-V416 PolarHBondContact O-N 3.4Å; F414-V416 PolarHBondContact O-N 3.49Å; V416-L418 VanDerWaalsContact C-N 3.28Å; V416-L418 PolarHBondContact O-N 3.18Å; V416-L419 PolarHBondContact O-N 3.44Å; V416-F420 WeakPolarHBondContact O-CB 3.39Å; V416-F420 PolarHBondContact O-N 2.9Å |
| 417 | G | 79.3 | Confident | 86.9 | Confident | 21 Ų | 21 | 51.2 Ų | 51.2 | 22% | 0.216 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.5 | -36.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | N413 F414 P421 | N413-G417 PolarHBondContact O-N 2.99Å; F414-G417 PolarHBondContact O-N 2.98Å; G417-P421 WeakPolarHBondContact O-CD 3.43Å |
| 418 | L | 81.3 | Confident | 86.8 | Confident | 91 Ų | 91 | 51.7 Ų | 51.7 | 48% | 0.476 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -76.1 | -44.7 | 179.4 | -178.9 | 63.7 | 0 | 0 | 0 | 112.9 | F414 L415 V416 | F414-L418 HydrophobicContact CE1-CD2 3.99Å; F414-L418 HydrophobicContact CZ-CD2 4.11Å; F414-L418 VanDerWaalsContact O-CB 3.31Å; F414-L418 WeakPolarHBondContact O-CB 3.23Å; F414-L418 PolarHBondContact O-N 3.33Å; L415-L418 PolarHBondContact O-N 3.47Å; V416-L418 VanDerWaalsContact C-N 3.28Å; V416-L418 PolarHBondContact O-N 3.18Å |
| 419 | L | 84.6 | Confident | 86.5 | Confident | 102 Ų | 102 | 51.7 Ų | 51.7 | 53% | 0.534 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -89.9 | -24.4 | -170 | -60.6 | 175 | 0 | 0 | 0 | 113.1 | L415 V416 S422 A423 | L415-L419 HydrophobicContact CB-CD1 4.46Å; L415-L419 VanDerWaalsContact O-CB 3.23Å; L415-L419 WeakPolarHBondContact O-CB 3.17Å; L415-L419 VanDerWaalsContact O-CG 3.22Å; L415-L419 WeakPolarHBondContact O-CG 3.43Å; L415-L419 PolarHBondContact O-N 2.93Å; V416-L419 PolarHBondContact O-N 3.44Å; L419-S422 PolarHBondContact O-N 3.46Å; L419-A423 WeakPolarHBondContact O-CB 3.44Å; L419-A423 PolarHBondContact O-N 3.45Å |
| 420 | F | 83.7 | Confident | 86.5 | Confident | 16 Ų | 16 | 58 Ų | 58 | 7% | 0.07 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.8 | -46.6 | -174.9 | 177.3 | -95.7 | 0 | 0 | 0 | 114 | A287 Y291 V416 S422 A423 A424 V431 F435 | A287-F420 HydrophobicContact CB-CD1 4.02Å; A287-F420 HydrophobicContact CB-CD2 3.57Å; A287-F420 HydrophobicContact CB-CE1 4.01Å; A287-F420 HydrophobicContact CB-CE2 3.56Å; A287-F420 HydrophobicContact CB-CG 3.79Å; A287-F420 HydrophobicContact CB-CZ 3.78Å; Y291-F420 AromaticContact CD2-CD1 3.32Å; Y291-F420 HydrophobicContact CD2-CD1 3.32Å; Y291-F420 AromaticContact CD2-CE1 3.32Å; Y291-F420 HydrophobicContact CD2-CE1 3.32Å; Y291-F420 HydrophobicContact CD2-CG 4.44Å; Y291-F420 HydrophobicContact CD2-CZ 4.45Å; Y291-F420 AromaticContact CE2-CD1 3.33Å; Y291-F420 HydrophobicContact CE2-CD1 3.33Å; Y291-F420 AromaticContact CE2-CE1 3.87Å; Y291-F420 HydrophobicContact CE2-CE1 3.87Å; Y291-F420 HydrophobicContact CE2-CG 4.29Å; Y291-F420 HydrophobicContact CG-CD1 4.12Å; Y291-F420 AromaticContact CG-CE1 3.78Å; Y291-F420 HydrophobicContact CG-CE1 3.78Å; V416-F420 WeakPolarHBondContact O-CB 3.39Å; V416-F420 PolarHBondContact O-N 2.9Å; F420-S422 VanDerWaalsContact C-N 3.31Å; F420-S422 PolarHBondContact O-N 3.34Å; F420-A423 PolarHBondContact O-N 2.9Å; F420-A424 HydrophobicContact CE1-CB 4.23Å; F420-A424 HydrophobicContact CZ-CB 4.2Å; F420-A424 VanDerWaalsContact O-CB 3.31Å; F420-A424 WeakPolarHBondContact O-CB 3.28Å; F420-A424 PolarHBondContact O-N 3.25Å; F420-V431 HydrophobicContact CD2-CG2 3.95Å; F420-V431 HydrophobicContact CE2-CG1 3.97Å; F420-V431 HydrophobicContact CE2-CG2 3.71Å; F420-V431 HydrophobicContact CZ-CG1 4.39Å; F420-F435 AromaticContact CD2-CE2 3.98Å; F420-F435 HydrophobicContact CD2-CE2 3.98Å; F420-F435 AromaticContact CD2-CZ 3.77Å; F420-F435 HydrophobicContact CD2-CZ 3.77Å; F420-F435 AromaticContact CE2-CE2 3.8Å; F420-F435 HydrophobicContact CE2-CE2 3.8Å; F420-F435 HydrophobicContact CE2-CZ 4.09Å |
| 421 | P | 79.5 | Confident | 86.5 | Confident | 54 Ų | 54 | 58.1 Ų | 58.1 | 35% | 0.351 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -56.8 | -44.3 | 179.1 | -28.1 | 37.2 | 0 | 0 | 0 | 113 | Y291 G417 A424 H425 | Y291-P421 HydrophobicContact CE1-CG 4.32Å; Y291-P421 VanDerWaalsContact OH-CG 3.22Å; Y291-P421 WeakPolarHBondContact OH-CG 3.41Å; G417-P421 WeakPolarHBondContact O-CD 3.43Å; P421-A424 PolarHBondContact O-N 2.84Å; P421-H425 WeakPolarHBondContact O-CB 3.44Å; P421-H425 PolarHBondContact O-N 3.38Å |
| 422 | S | 80.9 | Confident | 86.4 | Confident | 69 Ų | 69 | 56.3 Ų | 56.3 | 48% | 0.483 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.6 | -46.6 | 176.6 | -60 | 0 | 0 | 0 | 0 | 111.4 | L419 F420 A424 H425 Y426 | L419-S422 PolarHBondContact O-N 3.46Å; F420-S422 VanDerWaalsContact C-N 3.31Å; F420-S422 PolarHBondContact O-N 3.34Å; S422-A424 VanDerWaalsContact C-N 3.34Å; S422-A424 PolarHBondContact O-N 3.33Å; S422-H425 PolarHBondContact O-N 3.35Å; S422-Y426 WeakPolarHBondContact O-CD2 3.46Å; S422-Y426 PolarHBondContact O-N 3.01Å |
| 423 | A | 85.8 | Confident | 86.5 | Confident | 27 Ų | 27 | 59.8 Ų | 59.8 | 22% | 0.223 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61 | -43 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | L419 F420 H425 Y426 L427 V431 | L419-A423 WeakPolarHBondContact O-CB 3.44Å; L419-A423 PolarHBondContact O-N 3.45Å; F420-A423 PolarHBondContact O-N 2.9Å; A423-H425 VanDerWaalsContact C-N 3.34Å; A423-H425 PolarHBondContact O-N 3.32Å; A423-Y426 PolarHBondContact O-N 2.66Å; A423-L427 VanDerWaalsContact O-CB 3.23Å; A423-L427 WeakPolarHBondContact O-CB 3.32Å; A423-L427 WeakPolarHBondContact O-CG 3.4Å; A423-L427 PolarHBondContact O-N 3.32Å; A423-V431 HydrophobicContact CB-CG2 4.04Å |
| 424 | A | 83.9 | Confident | 86.8 | Confident | 29 Ų | 29 | 62.8 Ų | 62.8 | 24% | 0.24 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.6 | -36.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | F420 P421 S422 G428 V431 | F420-A424 HydrophobicContact CE1-CB 4.23Å; F420-A424 HydrophobicContact CZ-CB 4.2Å; F420-A424 VanDerWaalsContact O-CB 3.31Å; F420-A424 WeakPolarHBondContact O-CB 3.28Å; F420-A424 PolarHBondContact O-N 3.25Å; P421-A424 PolarHBondContact O-N 2.84Å; S422-A424 VanDerWaalsContact C-N 3.34Å; S422-A424 PolarHBondContact O-N 3.33Å; A424-G428 VanDerWaalsContact O-CA 3.24Å; A424-G428 WeakPolarHBondContact O-CA 3.49Å; A424-G428 PolarHBondContact O-N 3.28Å; A424-V431 HydrophobicContact CB-CG2 4.49Å |
| 425 | H | 82 | Confident | 87.1 | Confident | 150 Ų | 150 | 61 Ų | 61 | 69% | 0.694 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -62.7 | -45.8 | 175.7 | -178 | 70.7 | 0 | 0 | 0 | 112.4 | P421 S422 A423 | P421-H425 WeakPolarHBondContact O-CB 3.44Å; P421-H425 PolarHBondContact O-N 3.38Å; S422-H425 PolarHBondContact O-N 3.35Å; A423-H425 VanDerWaalsContact C-N 3.34Å; A423-H425 PolarHBondContact O-N 3.32Å |
| 426 | Y | 87.4 | Confident | 87.6 | Confident | 195 Ų | 195 | 58 Ų | 58 | 77% | 0.765 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -80.6 | -32 | -177.8 | -71.8 | -71.5 | 0 | 0 | 0 | 114 | S422 A423 | S422-Y426 WeakPolarHBondContact O-CD2 3.46Å; S422-Y426 PolarHBondContact O-N 3.01Å; A423-Y426 PolarHBondContact O-N 2.66Å |
| 427 | L | 90.3 | Very high | 88.1 | Confident | 75 Ų | 75 | 59.2 Ų | 59.2 | 39% | 0.393 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -102.4 | -16.3 | -173.5 | -62.6 | 169.2 | 0 | 0 | 0 | 113.5 | A423 A429 Y430 V431 I434 | A423-L427 VanDerWaalsContact O-CB 3.23Å; A423-L427 WeakPolarHBondContact O-CB 3.32Å; A423-L427 WeakPolarHBondContact O-CG 3.4Å; A423-L427 PolarHBondContact O-N 3.32Å; L427-A429 PolarHBondContact O-N 3.44Å; L427-Y430 WeakPolarHBondContact O-CB 3.3Å; L427-Y430 WeakPolarHBondContact O-CD2 3.48Å; L427-Y430 PolarHBondContact O-N 3.19Å; L427-V431 HydrophobicContact CB-CB 4.42Å; L427-I434 HydrophobicContact CD1-CD1 3.36Å; L427-I434 HydrophobicContact CD1-CG1 4.29Å |
| 428 | G | 87.8 | Confident | 89 | Confident | 40 Ų | 40 | 61.9 Ų | 61.9 | 41% | 0.412 | 33% | 0.333 | S | S | . | . | G | 310 helix | trans | 51.7 | -128.7 | -172.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A424 Y430 V431 | A424-G428 VanDerWaalsContact O-CA 3.24Å; A424-G428 WeakPolarHBondContact O-CA 3.49Å; A424-G428 PolarHBondContact O-N 3.28Å; G428-Y430 PolarHBondContact O-N 3.42Å; G428-Y430 VanDerWaalsContact O-N 3.15Å; G428-V431 WeakPolarHBondContact O-CB 3.3Å; G428-V431 VanDerWaalsContact O-CG1 3.29Å; G428-V431 WeakPolarHBondContact O-CG1 3.47Å; G428-V431 PolarHBondContact O-N 2.92Å |
| 429 | A | 87.8 | Confident | 89.8 | Confident | 18 Ų | 18 | 57.5 Ų | 57.5 | 15% | 0.149 | 31% | 0.31 | C | S | . | . | G | 310 helix | trans | -60.1 | -22.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | T350 L353 L354 L427 V431 | T350-A429 PolarHBondContact OG1-O 3.37Å; L353-A429 HydrophobicContact CB-CB 3.62Å; L353-A429 HydrophobicContact CD1-CB 4.35Å; L354-A429 HydrophobicContact CD2-CB 3.84Å; L354-A429 HydrophobicContact CG-CB 3.9Å; L427-A429 PolarHBondContact O-N 3.44Å; A429-V431 PolarHBondContact O-N 2.87Å |
| 430 | Y | 93.4 | Very high | 90.4 | Very high | 132 Ų | 132 | 57.2 Ų | 57.2 | 52% | 0.518 | 31% | 0.308 | S | S | . | . | G | 310 helix | trans | -72.5 | -9.7 | 179.6 | -67 | -82.3 | 0 | 0 | 0 | 113.2 | T350 L354 L427 G428 F432 I433 | T350-Y430 HydrophobicContact CG2-CD1 4.23Å; L354-Y430 HydrophobicContact CD1-CE1 3.88Å; L354-Y430 HydrophobicContact CD1-CE2 4.22Å; L354-Y430 HydrophobicContact CD2-CD2 4.4Å; L354-Y430 HydrophobicContact CD2-CE2 3.76Å; L427-Y430 WeakPolarHBondContact O-CB 3.3Å; L427-Y430 WeakPolarHBondContact O-CD2 3.48Å; L427-Y430 PolarHBondContact O-N 3.19Å; G428-Y430 PolarHBondContact O-N 3.42Å; G428-Y430 VanDerWaalsContact O-N 3.15Å; Y430-F432 PolarHBondContact O-N 3.28Å; Y430-I433 HydrophobicContact CD1-CG1 4.46Å; Y430-I433 WeakPolarHBondContact O-CB 3.32Å; Y430-I433 PolarHBondContact O-N 2.94Å |
| 431 | V | 90.9 | Very high | 91.1 | Very high | 6 Ų | 6 | 60.6 Ų | 60.6 | 4% | 0.036 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -56.8 | -33.5 | 177.8 | 72.9 | 0 | 0 | 0 | 0 | 112.5 | F420 A423 A424 L427 G428 A429 I433 I434 | F420-V431 HydrophobicContact CD2-CG2 3.95Å; F420-V431 HydrophobicContact CE2-CG1 3.97Å; F420-V431 HydrophobicContact CE2-CG2 3.71Å; F420-V431 HydrophobicContact CZ-CG1 4.39Å; A423-V431 HydrophobicContact CB-CG2 4.04Å; A424-V431 HydrophobicContact CB-CG2 4.49Å; L427-V431 HydrophobicContact CB-CB 4.42Å; G428-V431 WeakPolarHBondContact O-CB 3.3Å; G428-V431 VanDerWaalsContact O-CG1 3.29Å; G428-V431 WeakPolarHBondContact O-CG1 3.47Å; G428-V431 PolarHBondContact O-N 2.92Å; A429-V431 PolarHBondContact O-N 2.87Å; V431-I433 PolarHBondContact O-N 3.21Å; V431-I434 WeakPolarHBondContact O-CB 3.34Å; V431-I434 PolarHBondContact O-N 3.15Å |
| 432 | F | 91 | Very high | 92 | Very high | 7 Ų | 7 | 58.8 Ų | 58.8 | 3% | 0.031 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -71.9 | -15.5 | 178.5 | -59.6 | -81.4 | 0 | 0 | 0 | 113.8 | I295 M349 T350 L353 Y430 I434 F435 T436 | I295-F432 HydrophobicContact CD1-CZ 4.01Å; M349-F432 HydrophobicContact CB-CD2 4.21Å; M349-F432 HydrophobicContact CB-CG 4.19Å; M349-F432 HydrophobicContact CE-CE1 4.34Å; M349-F432 HydrophobicContact SD-CD1 3.81Å; M349-F432 HydrophobicContact SD-CE1 3.96Å; M349-F432 HydrophobicContact SD-CG 4.35Å; T350-F432 WeakPolarHBondContact OG1-CB 3.41Å; L353-F432 HydrophobicContact CD1-CD2 4.08Å; L353-F432 HydrophobicContact CD1-CE2 3.56Å; Y430-F432 PolarHBondContact O-N 3.28Å; F432-I434 VanDerWaalsContact C-N 3.32Å; F432-F435 HydrophobicContact CD1-CD2 4.04Å; F432-F435 HydrophobicContact CD1-CE2 4.46Å; F432-F435 PolarHBondContact O-N 3.37Å; F432-T436 PolarHBondContact O-N 2.88Å; F432-T436 PolarHBondContact O-OG1 3.3Å |
| 433 | I | 95.6 | Very high | 92.8 | Very high | 76 Ų | 76 | 57.9 Ų | 57.9 | 39% | 0.39 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -70.1 | -31.9 | 172.1 | -59.3 | -58 | 0 | 0 | 0 | 111 | T350 Y430 V431 F435 T436 G437 | T350-I433 HydrophobicContact CG2-CD1 4.02Å; T350-I433 HydrophobicContact CG2-CG1 3.96Å; Y430-I433 HydrophobicContact CD1-CG1 4.46Å; Y430-I433 WeakPolarHBondContact O-CB 3.32Å; Y430-I433 PolarHBondContact O-N 2.94Å; V431-I433 PolarHBondContact O-N 3.21Å; I433-F435 VanDerWaalsContact C-N 3.33Å; I433-F435 PolarHBondContact O-N 2.96Å; I433-T436 WeakPolarHBondContact O-CB 3.45Å; I433-T436 PolarHBondContact O-N 3.15Å; I433-G437 PolarHBondContact O-N 3.47Å |
| 434 | I | 95.3 | Very high | 93.4 | Very high | 72 Ų | 72 | 58.7 Ų | 58.7 | 37% | 0.369 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59 | -48.8 | 172.2 | -62.3 | 173.5 | 0 | 0 | 0 | 109.6 | L427 V431 F432 T436 G437 F438 | L427-I434 HydrophobicContact CD1-CD1 3.36Å; L427-I434 HydrophobicContact CD1-CG1 4.29Å; V431-I434 WeakPolarHBondContact O-CB 3.34Å; V431-I434 PolarHBondContact O-N 3.15Å; F432-I434 VanDerWaalsContact C-N 3.32Å; I434-T436 VanDerWaalsContact C-N 3.32Å; I434-T436 PolarHBondContact O-N 3.16Å; I434-G437 PolarHBondContact O-N 3.35Å; I434-F438 HydrophobicContact CG2-CD2 3.88Å; I434-F438 HydrophobicContact CG2-CE2 3.59Å; I434-F438 WeakPolarHBondContact O-CD2 3.3Å; I434-F438 PolarHBondContact O-N 3.01Å; I434-F438 VanDerWaalsContact O-N 3.08Å |
| 435 | F | 94.6 | Very high | 94 | Very high | 14 Ų | 14 | 59.5 Ų | 59.5 | 6% | 0.061 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 176.7 | -62.4 | -46.4 | 0 | 0 | 0 | 112 | L282 G284 A287 F420 F432 I433 G437 F438 L439 | L282-F435 WeakPolarHBondContact O-CD1 3.27Å; G284-F435 VanDerWaalsContact CA-CE1 3.4Å; A287-F435 HydrophobicContact CB-CE2 4.04Å; A287-F435 HydrophobicContact CB-CZ 3.92Å; F420-F435 AromaticContact CD2-CE2 3.98Å; F420-F435 HydrophobicContact CD2-CE2 3.98Å; F420-F435 AromaticContact CD2-CZ 3.77Å; F420-F435 HydrophobicContact CD2-CZ 3.77Å; F420-F435 AromaticContact CE2-CE2 3.8Å; F420-F435 HydrophobicContact CE2-CE2 3.8Å; F420-F435 HydrophobicContact CE2-CZ 4.09Å; F432-F435 HydrophobicContact CD1-CD2 4.04Å; F432-F435 HydrophobicContact CD1-CE2 4.46Å; F432-F435 PolarHBondContact O-N 3.37Å; I433-F435 VanDerWaalsContact C-N 3.33Å; I433-F435 PolarHBondContact O-N 2.96Å; F435-G437 VanDerWaalsContact C-N 3.32Å; F435-G437 PolarHBondContact O-N 2.84Å; F435-F438 PolarHBondContact O-N 3.33Å; F435-L439 WeakPolarHBondContact O-CB 3.39Å; F435-L439 WeakPolarHBondContact O-CD1 3.18Å; F435-L439 WeakPolarHBondContact O-CG 3.48Å; F435-L439 PolarHBondContact O-N 2.93Å |
| 436 | T | 97.2 | Very high | 94.7 | Very high | 13 Ų | 13 | 52.4 Ų | 52.4 | 8% | 0.08 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -57.3 | -45.2 | 174.6 | -52.4 | 0 | 0 | 0 | 0 | 111.6 | A343 S346 T347 F432 I433 I434 L439 I440 | A343-T436 HydrophobicContact CB-CG2 4.4Å; S346-T436 WeakPolarHBondContact CB-OG1 3.11Å; S346-T436 PolarHBondContact OG-OG1 3.16Å; T347-T436 WeakPolarHBondContact OG1-CG2 3.49Å; F432-T436 PolarHBondContact O-N 2.88Å; F432-T436 PolarHBondContact O-OG1 3.3Å; I433-T436 WeakPolarHBondContact O-CB 3.45Å; I433-T436 PolarHBondContact O-N 3.15Å; I434-T436 VanDerWaalsContact C-N 3.32Å; I434-T436 PolarHBondContact O-N 3.16Å; T436-L439 PolarHBondContact O-N 3.49Å; T436-I440 HydrophobicContact CG2-CD1 4.03Å; T436-I440 WeakPolarHBondContact O-CG1 3.32Å; T436-I440 PolarHBondContact O-N 2.97Å |
| 437 | G | 97.8 | Very high | 95.1 | Very high | 36 Ų | 36 | 48.4 Ų | 48.4 | 37% | 0.371 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | I433 I434 F435 T441 | I433-G437 PolarHBondContact O-N 3.47Å; I434-G437 PolarHBondContact O-N 3.35Å; F435-G437 VanDerWaalsContact C-N 3.32Å; F435-G437 PolarHBondContact O-N 2.84Å; G437-T441 WeakPolarHBondContact O-CB 3.33Å; G437-T441 PolarHBondContact O-N 3.39Å; G437-T441 PolarHBondContact O-OG1 3.46Å |
| 438 | F | 97.4 | Very high | 95.2 | Very high | 77 Ų | 77 | 51.7 Ų | 51.7 | 34% | 0.338 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -62.3 | -47.4 | 173.8 | -78.5 | -54.3 | 0 | 0 | 0 | 112.3 | L282 I434 F435 I440 T441 F442 | L282-F438 HydrophobicContact CB-CD2 4.33Å; L282-F438 HydrophobicContact CB-CG 4.3Å; L282-F438 HydrophobicContact CD1-CD1 4.39Å; L282-F438 HydrophobicContact CD1-CE1 4.22Å; L282-F438 HydrophobicContact CD1-CZ 4.42Å; I434-F438 HydrophobicContact CG2-CD2 3.88Å; I434-F438 HydrophobicContact CG2-CE2 3.59Å; I434-F438 WeakPolarHBondContact O-CD2 3.3Å; I434-F438 PolarHBondContact O-N 3.01Å; I434-F438 VanDerWaalsContact O-N 3.08Å; F435-F438 PolarHBondContact O-N 3.33Å; F438-I440 PolarHBondContact O-N 2.95Å; F438-T441 WeakPolarHBondContact O-CB 3.4Å; F438-T441 PolarHBondContact O-N 3.07Å; F438-T441 VanDerWaalsContact O-N 3.14Å; F438-F442 HydrophobicContact CB-CD2 4.22Å; F438-F442 HydrophobicContact CB-CE2 3.79Å; F438-F442 HydrophobicContact CD1-CE2 4.23Å; F438-F442 HydrophobicContact CD1-CZ 4.25Å; F438-F442 HydrophobicContact CG-CE2 4.32Å; F438-F442 WeakPolarHBondContact O-CD2 3.38Å; F438-F442 WeakPolarHBondContact O-CG 3.41Å; F438-F442 PolarHBondContact O-N 3.37Å |
| 439 | L | 98.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.6 | -44.8 | -179.6 | -72.4 | 163.7 | 0 | 0 | 0 | 111.8 | L339 M342 A343 F373 F435 T436 F442 L443 | L339-L439 HydrophobicContact CD2-CD2 3.65Å; M342-L439 HydrophobicContact CB-CD1 3.81Å; M342-L439 HydrophobicContact CB-CD2 3.9Å; M342-L439 HydrophobicContact CE-CD2 4.45Å; M342-L439 HydrophobicContact SD-CD2 4.24Å; A343-L439 HydrophobicContact CB-CB 3.96Å; A343-L439 HydrophobicContact CB-CD1 4.34Å; F373-L439 HydrophobicContact CE2-CD1 4.31Å; F435-L439 WeakPolarHBondContact O-CB 3.39Å; F435-L439 WeakPolarHBondContact O-CD1 3.18Å; F435-L439 WeakPolarHBondContact O-CG 3.48Å; F435-L439 PolarHBondContact O-N 2.93Å; T436-L439 PolarHBondContact O-N 3.49Å; L439-F442 PolarHBondContact O-N 3.23Å; L439-L443 VanDerWaalsContact O-CB 3.26Å; L439-L443 WeakPolarHBondContact O-CB 3.44Å; L439-L443 PolarHBondContact O-N 3.12Å |
| 440 | I | 98.1 | Very high | 95.7 | Very high | 95 Ų | 95 | 54.5 Ų | 54.5 | 49% | 0.487 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65 | -41.5 | 176.1 | -67.2 | 170.4 | 0 | 0 | 0 | 110.9 | A343 T436 F438 F442 L443 A444 | A343-I440 HydrophobicContact CB-CG1 4.31Å; T436-I440 HydrophobicContact CG2-CD1 4.03Å; T436-I440 WeakPolarHBondContact O-CG1 3.32Å; T436-I440 PolarHBondContact O-N 2.97Å; F438-I440 PolarHBondContact O-N 2.95Å; I440-F442 PolarHBondContact O-N 2.64Å; I440-L443 WeakPolarHBondContact O-CB 3.48Å; I440-L443 PolarHBondContact O-N 3.36Å; I440-A444 PolarHBondContact O-N 3.32Å |
| 441 | T | 98.2 | Very high | 95.6 | Very high | 88 Ų | 88 | 49.6 Ų | 49.6 | 54% | 0.54 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -61.4 | -45.5 | 177.4 | -58.1 | 0 | 0 | 0 | 0 | 111.3 | G437 F438 A444 F445 | G437-T441 WeakPolarHBondContact O-CB 3.33Å; G437-T441 PolarHBondContact O-N 3.39Å; G437-T441 PolarHBondContact O-OG1 3.46Å; F438-T441 WeakPolarHBondContact O-CB 3.4Å; F438-T441 PolarHBondContact O-N 3.07Å; F438-T441 VanDerWaalsContact O-N 3.14Å; T441-A444 PolarHBondContact O-N 2.97Å; T441-F445 PolarHBondContact O-N 3.26Å |
| 442 | F | 98.1 | Very high | 95.5 | Very high | 15 Ų | 15 | 51.3 Ų | 51.3 | 7% | 0.066 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -70.8 | -31.8 | 177.3 | -62.3 | -47.5 | 0 | 0 | 0 | 113 | V275 L278 S279 L282 L339 F438 L439 I440 F445 T446 | V275-F442 HydrophobicContact CG1-CD1 3.68Å; V275-F442 HydrophobicContact CG1-CE1 3.94Å; L278-F442 HydrophobicContact CB-CE1 4.15Å; L278-F442 HydrophobicContact CB-CZ 3.9Å; S279-F442 VanDerWaalsContact CA-CD2 3.44Å; S279-F442 VanDerWaalsContact CB-CG 3.46Å; L282-F442 HydrophobicContact CB-CE2 3.94Å; L282-F442 HydrophobicContact CB-CZ 4.32Å; L282-F442 HydrophobicContact CD1-CZ 4.09Å; L339-F442 HydrophobicContact CD1-CB 3.85Å; L339-F442 HydrophobicContact CD2-CB 4.41Å; F438-F442 HydrophobicContact CB-CD2 4.22Å; F438-F442 HydrophobicContact CB-CE2 3.79Å; F438-F442 HydrophobicContact CD1-CE2 4.23Å; F438-F442 HydrophobicContact CD1-CZ 4.25Å; F438-F442 HydrophobicContact CG-CE2 4.32Å; F438-F442 WeakPolarHBondContact O-CD2 3.38Å; F438-F442 WeakPolarHBondContact O-CG 3.41Å; F438-F442 PolarHBondContact O-N 3.37Å; L439-F442 PolarHBondContact O-N 3.23Å; I440-F442 PolarHBondContact O-N 2.64Å; F442-F445 PolarHBondContact O-N 3.06Å; F442-T446 WeakPolarHBondContact O-CB 3.41Å; F442-T446 PolarHBondContact O-N 2.98Å; F442-T446 PolarHBondContact O-OG1 3.47Å |
| 443 | L | 97.9 | Very high | 95.2 | Very high | 51 Ų | 51 | 51.1 Ų | 51.1 | 27% | 0.267 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.9 | -49 | 173.2 | 177.4 | 61.6 | 0 | 0 | 0 | 110.4 | M336 L339 L439 I440 F445 T446 F447 | M336-L443 HydrophobicContact CB-CD1 3.66Å; M336-L443 HydrophobicContact CG-CD1 3.91Å; M336-L443 WeakPolarHBondContact O-CD1 3.2Å; L339-L443 HydrophobicContact CB-CB 4.24Å; L339-L443 HydrophobicContact CB-CD1 4.36Å; L339-L443 HydrophobicContact CD1-CB 4.46Å; L439-L443 VanDerWaalsContact O-CB 3.26Å; L439-L443 WeakPolarHBondContact O-CB 3.44Å; L439-L443 PolarHBondContact O-N 3.12Å; I440-L443 WeakPolarHBondContact O-CB 3.48Å; I440-L443 PolarHBondContact O-N 3.36Å; L443-F445 PolarHBondContact O-N 3Å; L443-T446 PolarHBondContact O-N 2.71Å; L443-F447 PolarHBondContact O-N 3.31Å |
| 444 | A | 97.8 | Very high | 94.6 | Very high | 43 Ų | 43 | 52.4 Ų | 52.4 | 36% | 0.355 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | I440 T441 T446 F447 F448 | I440-A444 PolarHBondContact O-N 3.32Å; T441-A444 PolarHBondContact O-N 2.97Å; A444-T446 VanDerWaalsContact C-N 3.33Å; A444-T446 PolarHBondContact O-N 2.92Å; A444-F447 PolarHBondContact O-N 2.98Å; A444-F448 WeakPolarHBondContact O-CD2 3.41Å; A444-F448 PolarHBondContact O-N 3.2Å |
| 445 | F | 97.6 | Very high | 93.4 | Very high | 47 Ų | 47 | 52.7 Ų | 52.7 | 21% | 0.206 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -58.9 | -44.4 | 176.3 | -178.9 | -87.6 | 0 | 0 | 0 | 112 | I271 I272 V275 T441 F442 L443 F447 F448 K449 V450 | I271-F445 HydrophobicContact CG2-CE2 4.3Å; I271-F445 HydrophobicContact CG2-CZ 4.11Å; I272-F445 HydrophobicContact CG1-CE1 4.31Å; I272-F445 HydrophobicContact CG1-CZ 4.21Å; V275-F445 HydrophobicContact CB-CD1 4.08Å; V275-F445 HydrophobicContact CB-CE1 3.7Å; V275-F445 HydrophobicContact CB-CE2 4.45Å; V275-F445 HydrophobicContact CB-CZ 3.91Å; V275-F445 HydrophobicContact CG1-CB 4.41Å; V275-F445 HydrophobicContact CG1-CD1 3.4Å; V275-F445 VanDerWaalsContact CG1-CD1 3.4Å; V275-F445 HydrophobicContact CG1-CD2 4.18Å; V275-F445 HydrophobicContact CG1-CE1 3.59Å; V275-F445 HydrophobicContact CG1-CE2 4.32Å; V275-F445 HydrophobicContact CG1-CG 3.73Å; V275-F445 HydrophobicContact CG1-CZ 4.05Å; V275-F445 HydrophobicContact CG2-CE1 4.26Å; V275-F445 HydrophobicContact CG2-CE2 4.15Å; V275-F445 HydrophobicContact CG2-CZ 3.94Å; T441-F445 PolarHBondContact O-N 3.26Å; F442-F445 PolarHBondContact O-N 3.06Å; L443-F445 PolarHBondContact O-N 3Å; F445-F447 VanDerWaalsContact C-N 3.3Å; F445-F447 PolarHBondContact O-N 2.85Å; F445-F448 PolarHBondContact O-N 3.31Å; F445-K449 HydrophobicContact CD1-CB 4.37Å; F445-K449 HydrophobicContact CD2-CB 4.28Å; F445-K449 HydrophobicContact CD2-CG 4.06Å; F445-K449 HydrophobicContact CE1-CB 4.03Å; F445-K449 HydrophobicContact CE2-CB 3.94Å; F445-K449 HydrophobicContact CE2-CG 3.86Å; F445-K449 HydrophobicContact CG-CB 4.49Å; F445-K449 HydrophobicContact CZ-CB 3.8Å; F445-K449 HydrophobicContact CZ-CG 4.24Å; F445-K449 WeakPolarHBondContact O-CB 3.31Å; F445-K449 PolarHBondContact O-N 3.47Å; F445-V450 HydrophobicContact CD1-CG2 4.15Å; F445-V450 HydrophobicContact CE1-CG2 4Å |
| 446 | T | 96.1 | Very high | 92.5 | Very high | 1 Ų | 1 | 57.7 Ų | 57.7 | 1% | 0.006 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.6 | -42.1 | 178.8 | -56.6 | 0 | 0 | 0 | 0 | 110.8 | R332 H335 M336 F442 L443 A444 V450 | R332-T446 HydrophobicContact CG-CG2 4.42Å; R332-T446 PolarHBondContact NH1-O 2.96Å; H335-T446 HydrophobicContact CB-CG2 4.31Å; H335-T446 PolarHBondContact CD2-OG1 3.03Å; M336-T446 HydrophobicContact CG-CG2 3.58Å; M336-T446 HydrophobicContact SD-CG2 4.44Å; F442-T446 WeakPolarHBondContact O-CB 3.41Å; F442-T446 PolarHBondContact O-N 2.98Å; F442-T446 PolarHBondContact O-OG1 3.47Å; L443-T446 PolarHBondContact O-N 2.71Å; A444-T446 VanDerWaalsContact C-N 3.33Å; A444-T446 PolarHBondContact O-N 2.92Å; T446-V450 HydrophobicContact CG2-CB 4.1Å; T446-V450 HydrophobicContact CG2-CG2 4.15Å; T446-V450 WeakPolarHBondContact O-CB 3.4Å; T446-V450 PolarHBondContact O-N 3.33Å |
| 447 | F | 95.6 | Very high | 91.3 | Very high | 110 Ų | 110 | 59.3 Ų | 59.3 | 48% | 0.482 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -64.7 | -40.7 | 176.5 | -174.9 | -95.3 | 0 | 0 | 0 | 112.7 | R332 M336 L443 A444 F445 | R332-F447 PolarHBondContact NH1-O 3.48Å; R332-F447 PolarHBondContact NH2-O 2.96Å; M336-F447 HydrophobicContact SD-CB 4.03Å; M336-F447 HydrophobicContact SD-CD2 3.91Å; M336-F447 HydrophobicContact SD-CG 4.48Å; L443-F447 PolarHBondContact O-N 3.31Å; A444-F447 PolarHBondContact O-N 2.98Å; F445-F447 VanDerWaalsContact C-N 3.3Å; F445-F447 PolarHBondContact O-N 2.85Å |
| 448 | F | 94 | Very high | 90 | Very high | 145 Ų | 145 | 58.1 Ų | 58.1 | 64% | 0.636 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -89.8 | -29.3 | -176 | -68.3 | -65.7 | 0 | 0 | 0 | 115 | A444 F445 | A444-F448 WeakPolarHBondContact O-CD2 3.41Å; A444-F448 PolarHBondContact O-N 3.2Å; F445-F448 PolarHBondContact O-N 3.31Å |
| 449 | K | 92.6 | Very high | 88.6 | Confident | 114 Ų | 114 | 56.5 Ų | 56.5 | 50% | 0.496 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -119.2 | -24.8 | -165.1 | -62.2 | -62.4 | -174.4 | -179.4 | 0 | 115.1 | I272 F445 P451 | I272-K449 VanDerWaalsContact CD1-O 3.31Å; I272-K449 WeakPolarHBondContact CD1-O 3.49Å; F445-K449 HydrophobicContact CD1-CB 4.37Å; F445-K449 HydrophobicContact CD2-CB 4.28Å; F445-K449 HydrophobicContact CD2-CG 4.06Å; F445-K449 HydrophobicContact CE1-CB 4.03Å; F445-K449 HydrophobicContact CE2-CB 3.94Å; F445-K449 HydrophobicContact CE2-CG 3.86Å; F445-K449 HydrophobicContact CG-CB 4.49Å; F445-K449 HydrophobicContact CZ-CB 3.8Å; F445-K449 HydrophobicContact CZ-CG 4.24Å; F445-K449 WeakPolarHBondContact O-CB 3.31Å; F445-K449 PolarHBondContact O-N 3.47Å; K449-P451 WeakPolarHBondContact O-CD 3.4Å |
| 450 | V | 92.8 | Very high | 87.4 | Confident | 3 Ų | 3 | 60.1 Ų | 60.1 | 2% | 0.018 | 31% | 0.311 | C | S | . | . | P | Polyproline II helix | trans | -86.8 | 119.8 | -174.2 | -179.4 | 0 | 0 | 0 | 0 | 110.1 | I272 L276 R332 I388 F445 T446 | I272-V450 HydrophobicContact CG2-CG1 4.46Å; I272-V450 HydrophobicContact CG2-CG2 4Å; L276-V450 HydrophobicContact CD1-CG1 4.38Å; L276-V450 HydrophobicContact CD1-CG2 4.48Å; L276-V450 HydrophobicContact CD2-CG2 4.15Å; L276-V450 HydrophobicContact CG-CG2 4.47Å; R332-V450 WeakPolarHBondContact CD-O 3.43Å; R332-V450 PolarHBondContact NH1-O 3.24Å; I388-V450 HydrophobicContact CD1-CG1 4.23Å; F445-V450 HydrophobicContact CD1-CG2 4.15Å; F445-V450 HydrophobicContact CE1-CG2 4Å; T446-V450 HydrophobicContact CG2-CB 4.1Å; T446-V450 HydrophobicContact CG2-CG2 4.15Å; T446-V450 WeakPolarHBondContact O-CB 3.4Å; T446-V450 PolarHBondContact O-N 3.33Å |
| 451 | P | 90.6 | Very high | 86.5 | Confident | 28 Ų | 28 | 55.8 Ų | 55.8 | 18% | 0.182 | 29% | 0.29 | C | S | . | . | P | Polyproline II helix | trans | -77.4 | 158 | 175.2 | 33.1 | -35.2 | 0 | 0 | 0 | 111.3 | L392 K449 F465 | L392-P451 HydrophobicContact CD2-CG 4.09Å; K449-P451 WeakPolarHBondContact O-CD 3.4Å; P451-F465 HydrophobicContact CG-CE1 4.41Å; P451-F465 HydrophobicContact CG-CE2 4.44Å; P451-F465 HydrophobicContact CG-CZ 3.72Å |
| 452 | E | 90.1 | Very high | 85.4 | Confident | 42 Ų | 42 | 52.4 Ų | 52.4 | 20% | 0.196 | 27% | 0.269 | C | S | . | . | P | Polyproline II helix | trans | -79.2 | 128 | 167.8 | -176.3 | 55.7 | -113.5 | 0 | 0 | 109.9 | G330 R331 R332 R454 R456 | G330-E452 WeakPolarHBondContact CA-OE2 3.41Å; R331-E452 WeakPolarHBondContact CD-OE1 3.34Å; R331-E452 PolarHBondContact N-OE1 3.4Å; R331-E452 PolarHBondContact N-OE2 2.89Å; R332-E452 WeakPolarHBondContact CB-OE2 3.19Å; R332-E452 PolarHBondContact N-OE2 3.21Å; E452-R454 HydrophobicContact CG-CB 4.18Å; E452-R454 WeakPolarHBondContact OE1-CB 3.34Å; E452-R454 PolarHBondContact OE1-N 2.94Å; E452-R456 WeakPolarHBondContact O-CD 3.32Å; E452-R456 PolarHBondContact O-NE 3.35Å; E452-R456 PolarHBondContact O-NH1 3.06Å |
| 453 | T | 84.1 | Confident | 84.4 | Confident | 3 Ų | 3 | 58.1 Ų | 58.1 | 2% | 0.018 | 29% | 0.29 | C | S | . | . | trans | -104.9 | -12.1 | -177.6 | 53.5 | 0 | 0 | 0 | 0 | 112.8 | R331 I388 E391 L392 G455 R456 I461 | R331-T453 WeakPolarHBondContact CD-OG1 3.43Å; I388-T453 HydrophobicContact CG1-CG2 4.24Å; E391-T453 HydrophobicContact CB-CG2 4.26Å; E391-T453 WeakPolarHBondContact OE2-CB 3.4Å; E391-T453 PolarHBondContact OE2-OG1 2.77Å; L392-T453 HydrophobicContact CD2-CG2 4.12Å; T453-G455 PolarHBondContact O-N 2.87Å; T453-R456 PolarHBondContact O-N 3.38Å; T453-I461 HydrophobicContact CG2-CD1 3.86Å | ||
| 454 | R | 82.1 | Confident | 83.6 | Confident | 104 Ų | 104 | 57.8 Ų | 57.8 | 39% | 0.392 | 30% | 0.295 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.9 | 128.1 | -178.9 | 178.4 | 179 | 70.4 | 159.9 | -2.5 | 112.7 | E327 R328 E452 R456 | E327-R454 WeakPolarHBondContact O-CD 3.45Å; E327-R454 PolarHBondContact O-NH1 2.92Å; R328-R454 PolarHBondContact O-NH1 2.78Å; E452-R454 HydrophobicContact CG-CB 4.18Å; E452-R454 WeakPolarHBondContact OE1-CB 3.34Å; E452-R454 PolarHBondContact OE1-N 2.94Å; R454-R456 PolarHBondContact O-N 2.69Å |
| 455 | G | 70.6 | Confident | 82.8 | Confident | 78 Ų | 78 | 56.4 Ų | 56.4 | 80% | 0.804 | 28% | 0.28 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.1 | 10.4 | 172.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | T453 | T453-G455 PolarHBondContact O-N 2.87Š|
| 456 | R | 74.9 | Confident | 81.9 | Confident | 119 Ų | 119 | 57.7 Ų | 57.7 | 45% | 0.449 | 29% | 0.287 | S | S | . | . | trans | -98.9 | 146.5 | 177.6 | -64.2 | -177.2 | 177.5 | -171.9 | -4.4 | 110.2 | E452 T453 R454 D460 I461 | E452-R456 WeakPolarHBondContact O-CD 3.32Å; E452-R456 PolarHBondContact O-NE 3.35Å; E452-R456 PolarHBondContact O-NH1 3.06Å; T453-R456 PolarHBondContact O-N 3.38Å; R454-R456 PolarHBondContact O-N 2.69Å; R456-D460 HydrophobicContact CB-CB 4.36Å; R456-I461 HydrophobicContact CB-CD1 4.1Å; R456-I461 HydrophobicContact CB-CG1 3.92Å | ||
| 457 | T | 72.1 | Confident | 80.9 | Confident | 47 Ų | 47 | 59.9 Ų | 59.9 | 29% | 0.288 | 31% | 0.31 | S | S | . | . | trans | -74.2 | 159.4 | 171.5 | 68.8 | 0 | 0 | 0 | 0 | 109.9 | E459 D460 I461 | T457-E459 PolarHBondContact O-N 3.18Å; T457-D460 WeakPolarHBondContact CB-OD2 3.31Å; T457-D460 PolarHBondContact N-OD2 3.09Å; T457-D460 PolarHBondContact O-N 3.46Å; T457-D460 PolarHBondContact OG1-N 3Å; T457-D460 PolarHBondContact OG1-OD2 3.16Å; T457-I461 WeakPolarHBondContact O-CG1 3.45Å; T457-I461 PolarHBondContact O-N 2.95Å | ||
| 458 | F | 70.4 | Confident | 79.8 | Confident | 11 Ų | 11 | 58.3 Ų | 58.3 | 5% | 0.048 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -56.9 | -31.5 | 174 | -59.9 | -63.9 | 0 | 0 | 0 | 111.8 | R151 A390 T462 | R151-F458 VanDerWaalsContact CZ-CE2 3.44Å; A390-F458 WeakPolarHBondContact O-CE1 3.08Å; F458-T462 PolarHBondContact O-N 2.91Å; F458-T462 VanDerWaalsContact O-N 3.09Å; F458-T462 PolarHBondContact O-OG1 2.96Å |
| 459 | E | 68.3 | Low | 78.8 | Confident | 42 Ų | 42 | 51.9 Ų | 51.9 | 20% | 0.196 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -68.9 | -47.3 | 179.1 | 179.9 | 60.3 | -168.7 | 0 | 0 | 112.5 | R248 T457 I461 T462 R463 | R248-E459 VanDerWaalsContact CZ-CD 3.42Å; R248-E459 IonicContact CZ-OE1 3.57Å; R248-E459 IonicContact CZ-OE2 3.03Å; R248-E459 IonicContact NE-OE2 2.65Å; R248-E459 IonicContact NH1-OE1 3.35Å; R248-E459 PolarHBondContact NH1-OE1 3.13Å; R248-E459 IonicContact NH1-OE2 3.98Å; R248-E459 PolarHBondContact NH1-OE2 3.19Å; R248-E459 IonicContact NH2-OE1 3.16Å; R248-E459 PolarHBondContact NH2-OE1 3.49Å; R248-E459 IonicContact NH2-OE2 3.34Å; T457-E459 PolarHBondContact O-N 3.18Å; E459-I461 PolarHBondContact O-N 2.81Å; E459-T462 PolarHBondContact O-N 3.44Å; E459-T462 VanDerWaalsContact O-N 3.15Å; E459-R463 WeakPolarHBondContact O-CG 3.42Å; E459-R463 PolarHBondContact O-N 3.47Å; E459-R463 IonicContact OE1-CZ 3.69Å; E459-R463 IonicContact OE1-NE 3.44Å; E459-R463 PolarHBondContact OE1-NE 2.96Å; E459-R463 IonicContact OE1-NH2 3.3Å; E459-R463 PolarHBondContact OE1-NH2 3.42Å |
| 460 | D | 73.8 | Confident | 77.7 | Confident | 76 Ų | 76 | 52.6 Ų | 52.6 | 41% | 0.406 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59 | -38.9 | 179.1 | -59.8 | -40.9 | 0 | 0 | 0 | 111.2 | R456 T457 A464 | R456-D460 HydrophobicContact CB-CB 4.36Å; T457-D460 WeakPolarHBondContact CB-OD2 3.31Å; T457-D460 PolarHBondContact N-OD2 3.09Å; T457-D460 PolarHBondContact O-N 3.46Å; T457-D460 PolarHBondContact OG1-N 3Å; T457-D460 PolarHBondContact OG1-OD2 3.16Å; D460-A464 WeakPolarHBondContact O-CB 3.41Å; D460-A464 PolarHBondContact O-N 3.03Å; D460-A464 VanDerWaalsContact O-N 3.15Å |
| 461 | I | 78.9 | Confident | 76 | Confident | 5 Ų | 5 | 54.2 Ų | 54.2 | 3% | 0.026 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -68.1 | -44.2 | 178.4 | -63.6 | 167 | 0 | 0 | 0 | 110.4 | E391 L392 T453 R456 T457 E459 A464 F465 | E391-I461 HydrophobicContact CB-CD1 4.49Å; E391-I461 VanDerWaalsContact O-CD1 3.22Å; E391-I461 WeakPolarHBondContact O-CD1 3.37Å; L392-I461 HydrophobicContact CD2-CG2 4.31Å; T453-I461 HydrophobicContact CG2-CD1 3.86Å; R456-I461 HydrophobicContact CB-CD1 4.1Å; R456-I461 HydrophobicContact CB-CG1 3.92Å; T457-I461 WeakPolarHBondContact O-CG1 3.45Å; T457-I461 PolarHBondContact O-N 2.95Å; E459-I461 PolarHBondContact O-N 2.81Å; I461-A464 WeakPolarHBondContact O-CB 3.48Å; I461-A464 PolarHBondContact O-N 2.9Å; I461-F465 HydrophobicContact CG2-CD2 3.98Å; I461-F465 HydrophobicContact CG2-CE2 3.59Å; I461-F465 WeakPolarHBondContact O-CD2 3.2Å; I461-F465 PolarHBondContact O-N 2.91Å |
| 462 | T | 75.3 | Confident | 74.4 | Confident | 17 Ų | 17 | 55.3 Ų | 55.3 | 10% | 0.104 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.5 | -46.7 | -179.4 | -56.1 | 0 | 0 | 0 | 0 | 111 | F458 E459 A464 F465 E466 | F458-T462 PolarHBondContact O-N 2.91Å; F458-T462 VanDerWaalsContact O-N 3.09Å; F458-T462 PolarHBondContact O-OG1 2.96Å; E459-T462 PolarHBondContact O-N 3.44Å; E459-T462 VanDerWaalsContact O-N 3.15Å; T462-A464 VanDerWaalsContact C-N 3.27Å; T462-A464 PolarHBondContact O-N 3.48Å; T462-F465 PolarHBondContact O-N 3.49Å; T462-F465 VanDerWaalsContact O-N 3.08Å; T462-E466 WeakPolarHBondContact O-CG 3.47Å; T462-E466 PolarHBondContact O-N 2.72Å |
| 463 | R | 77.1 | Confident | 72.7 | Confident | 134 Ų | 134 | 59 Ų | 59 | 51% | 0.506 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -59.6 | -36.6 | 175.6 | -72 | -174.6 | -168.2 | 164.7 | 12.7 | 113 | E459 F465 E466 G467 | E459-R463 WeakPolarHBondContact O-CG 3.42Å; E459-R463 PolarHBondContact O-N 3.47Å; E459-R463 IonicContact OE1-CZ 3.69Å; E459-R463 IonicContact OE1-NE 3.44Å; E459-R463 PolarHBondContact OE1-NE 2.96Å; E459-R463 IonicContact OE1-NH2 3.3Å; E459-R463 PolarHBondContact OE1-NH2 3.42Å; R463-F465 VanDerWaalsContact C-N 3.31Å; R463-F465 PolarHBondContact O-N 3.36Å; R463-E466 PolarHBondContact O-N 3.25Å; R463-G467 PolarHBondContact O-N 3.46Å |
| 464 | A | 80.6 | Confident | 71 | Confident | 45 Ų | 45 | 68.7 Ų | 68.7 | 37% | 0.372 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | D460 I461 T462 Q468 | D460-A464 WeakPolarHBondContact O-CB 3.41Å; D460-A464 PolarHBondContact O-N 3.03Å; D460-A464 VanDerWaalsContact O-N 3.15Å; I461-A464 WeakPolarHBondContact O-CB 3.48Å; I461-A464 PolarHBondContact O-N 2.9Å; T462-A464 VanDerWaalsContact C-N 3.27Å; T462-A464 PolarHBondContact O-N 3.48Å; A464-Q468 WeakPolarHBondContact O-CG 3.36Å; A464-Q468 PolarHBondContact O-N 3.21Å; A464-Q468 VanDerWaalsContact O-N 3.13Å |
| 465 | F | 82.1 | Confident | 69.1 | Low | 13 Ų | 13 | 66.6 Ų | 66.6 | 6% | 0.057 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -72.3 | -38.7 | 175.9 | -73 | -62.1 | 0 | 0 | 0 | 113 | Q268 P269 I272 L392 P451 I461 T462 R463 Q468 A469 | Q268-F465 HydrophobicContact CB-CD1 4.23Å; Q268-F465 HydrophobicContact CB-CE1 4.43Å; Q268-F465 HydrophobicContact CG-CD1 4.25Å; Q268-F465 HydrophobicContact CG-CE1 4.1Å; P269-F465 HydrophobicContact CB-CD2 4.2Å; P269-F465 HydrophobicContact CB-CE1 4.49Å; P269-F465 HydrophobicContact CB-CE2 3.9Å; P269-F465 HydrophobicContact CB-CZ 4.05Å; P269-F465 HydrophobicContact CG-CD2 4.26Å; P269-F465 HydrophobicContact CG-CE2 4.45Å; P269-F465 HydrophobicContact CG-CG 4.35Å; I272-F465 HydrophobicContact CD1-CE1 3.88Å; I272-F465 HydrophobicContact CD1-CZ 3.94Å; L392-F465 HydrophobicContact CD2-CE2 3.75Å; L392-F465 HydrophobicContact CD2-CZ 3.78Å; P451-F465 HydrophobicContact CG-CE1 4.41Å; P451-F465 HydrophobicContact CG-CE2 4.44Å; P451-F465 HydrophobicContact CG-CZ 3.72Å; I461-F465 HydrophobicContact CG2-CD2 3.98Å; I461-F465 HydrophobicContact CG2-CE2 3.59Å; I461-F465 WeakPolarHBondContact O-CD2 3.2Å; I461-F465 PolarHBondContact O-N 2.91Å; T462-F465 PolarHBondContact O-N 3.49Å; T462-F465 VanDerWaalsContact O-N 3.08Å; R463-F465 VanDerWaalsContact C-N 3.31Å; R463-F465 PolarHBondContact O-N 3.36Å; F465-Q468 PolarHBondContact O-N 2.74Å; F465-A469 WeakPolarHBondContact O-CB 3.36Å; F465-A469 PolarHBondContact O-N 2.9Å |
| 466 | E | 78.3 | Confident | 67.7 | Low | 75 Ų | 75 | 66.2 Ų | 66.2 | 35% | 0.35 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 174.8 | -69.5 | 176.6 | 162.9 | 0 | 0 | 111.9 | T462 R463 Q468 A469 H470 | T462-E466 WeakPolarHBondContact O-CG 3.47Å; T462-E466 PolarHBondContact O-N 2.72Å; R463-E466 PolarHBondContact O-N 3.25Å; E466-Q468 VanDerWaalsContact C-N 3.33Å; E466-Q468 PolarHBondContact O-N 3.44Å; E466-A469 PolarHBondContact O-N 3.47Å; E466-H470 PolarHBondContact O-N 2.9Å |
| 467 | G | 75 | Confident | 66.2 | Low | 46 Ų | 46 | 69.3 Ų | 69.3 | 47% | 0.474 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -60.8 | -40.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | R463 G471 | R463-G467 PolarHBondContact O-N 3.46Å; G467-G471 PolarHBondContact O-N 3.5Å |
| 468 | Q | 71.8 | Confident | 64.4 | Low | 77 Ų | 77 | 73.7 Ų | 73.7 | 36% | 0.36 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -66.7 | -39.9 | 173.4 | -76.6 | -170.3 | 4.7 | 0 | 0 | 112.7 | A464 F465 E466 G471 A472 | A464-Q468 WeakPolarHBondContact O-CG 3.36Å; A464-Q468 PolarHBondContact O-N 3.21Å; A464-Q468 VanDerWaalsContact O-N 3.13Å; F465-Q468 PolarHBondContact O-N 2.74Å; E466-Q468 VanDerWaalsContact C-N 3.33Å; E466-Q468 PolarHBondContact O-N 3.44Å; Q468-G471 CarbonylContact O-C 3.45Å; Q468-G471 PolarHBondContact O-N 3.01Å; Q468-A472 WeakPolarHBondContact O-CB 3.42Å; Q468-A472 PolarHBondContact O-N 2.62Å |
| 469 | A | 73.3 | Confident | 62.6 | Low | 10 Ų | 10 | 76.6 Ų | 76.6 | 8% | 0.083 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -62.6 | -44.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | F465 E466 G471 A472 D473 | F465-A469 WeakPolarHBondContact O-CB 3.36Å; F465-A469 PolarHBondContact O-N 2.9Å; E466-A469 PolarHBondContact O-N 3.47Å; A469-G471 VanDerWaalsContact C-N 3.35Å; A469-G471 PolarHBondContact O-N 3.4Å; A469-A472 PolarHBondContact O-N 3.29Å; A469-D473 PolarHBondContact O-N 2.73Å |
| 470 | H | 69.1 | Low | 61.1 | Low | 130 Ų | 130 | 81.4 Ų | 81.4 | 60% | 0.602 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -66.2 | -34.4 | 173.9 | -73.2 | -22.4 | 0 | 0 | 0 | 113.2 | E466 R474 | E466-H470 PolarHBondContact O-N 2.9Å; H470-R474 WeakPolarHBondContact O-CB 3.43Å; H470-R474 VanDerWaalsContact O-CG 3.31Å; H470-R474 WeakPolarHBondContact O-CG 3.39Å; H470-R474 PolarHBondContact O-N 3.45Å; H470-R474 VanDerWaalsContact O-N 3.15Å |
| 471 | G | 58.1 | Low | 59.2 | Low | 36 Ų | 36 | 86.9 Ų | 86.9 | 37% | 0.371 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.9 | -39.8 | 172 | 0 | 0 | 0 | 0 | 0 | 112.9 | G467 Q468 A469 R474 S475 | G467-G471 PolarHBondContact O-N 3.5Å; Q468-G471 CarbonylContact O-C 3.45Å; Q468-G471 PolarHBondContact O-N 3.01Å; A469-G471 VanDerWaalsContact C-N 3.35Å; A469-G471 PolarHBondContact O-N 3.4Å; G471-R474 PolarHBondContact O-N 3.19Å; G471-S475 WeakPolarHBondContact O-CB 3.44Å; G471-S475 PolarHBondContact O-N 3.37Å; G471-S475 PolarHBondContact O-OG 3.31Å |
| 472 | A | 57.5 | Low | 57.1 | Low | 52 Ų | 52 | 95.7 Ų | 95.7 | 43% | 0.43 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -68 | -43.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q468 A469 R474 S475 G476 | Q468-A472 WeakPolarHBondContact O-CB 3.42Å; Q468-A472 PolarHBondContact O-N 2.62Å; A469-A472 PolarHBondContact O-N 3.29Å; A472-R474 PolarHBondContact O-N 3.2Å; A472-S475 PolarHBondContact O-N 3.25Å; A472-S475 PolarHBondContact O-OG 2.96Å; A472-S475 VanDerWaalsContact O-OG 3.1Å; A472-G476 PolarHBondContact O-N 3.04Å |
| 473 | D | 53.1 | Low | 55.8 | Low | 119 Ų | 119 | 101.7 Ų | 101.7 | 64% | 0.636 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.4 | -29.8 | 174.5 | -79.2 | -18.5 | 0 | 0 | 0 | 112.3 | A469 | A469-D473 PolarHBondContact O-N 2.73Å |
| 474 | R | 48.2 | Very low | 53.8 | Low | 206 Ų | 206 | 103 Ų | 103 | 78% | 0.777 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -79.8 | -36.9 | 172 | -74.3 | 179.1 | 179.6 | -172.7 | 1.2 | 112.9 | H470 G471 A472 G476 K477 | H470-R474 WeakPolarHBondContact O-CB 3.43Å; H470-R474 VanDerWaalsContact O-CG 3.31Å; H470-R474 WeakPolarHBondContact O-CG 3.39Å; H470-R474 PolarHBondContact O-N 3.45Å; H470-R474 VanDerWaalsContact O-N 3.15Å; G471-R474 PolarHBondContact O-N 3.19Å; A472-R474 PolarHBondContact O-N 3.2Å; R474-G476 PolarHBondContact O-N 2.86Å; R474-K477 PolarHBondContact O-N 3.18Å |
| 475 | S | 43.5 | Very low | 51.6 | Low | 60 Ų | 60 | 106 Ų | 106 | 42% | 0.42 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -74.6 | -13.3 | 179.4 | 78.7 | 0 | 0 | 0 | 0 | 114.1 | G471 A472 K477 D478 | G471-S475 WeakPolarHBondContact O-CB 3.44Å; G471-S475 PolarHBondContact O-N 3.37Å; G471-S475 PolarHBondContact O-OG 3.31Å; A472-S475 PolarHBondContact O-N 3.25Å; A472-S475 PolarHBondContact O-OG 2.96Å; A472-S475 VanDerWaalsContact O-OG 3.1Å; S475-K477 PolarHBondContact O-N 2.99Å; S475-D478 WeakPolarHBondContact CA-O 3.38Å; S475-D478 WeakPolarHBondContact CB-O 3.22Å; S475-D478 PolarHBondContact O-N 3.39Å |
| 476 | G | 40.8 | Very low | 49.5 | Very low | 71 Ų | 71 | 113.8 Ų | 113.8 | 73% | 0.732 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | -6.5 | 160.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | A472 R474 | A472-G476 PolarHBondContact O-N 3.04Å; R474-G476 PolarHBondContact O-N 2.86Å |
| 477 | K | 42.3 | Very low | 47.2 | Very low | 184 Ų | 184 | 118.6 Ų | 118.6 | 80% | 0.8 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -115.7 | -20.6 | 170 | -78.1 | -175.6 | 172.7 | -179.9 | 0 | 115.9 | R474 S475 | R474-K477 PolarHBondContact O-N 3.18Å; S475-K477 PolarHBondContact O-N 2.99Å |
| 478 | D | 35.6 | Very low | 45.3 | Very low | 138 Ų | 138 | 121.8 Ų | 121.8 | 74% | 0.738 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -158.5 | 145.7 | 175.3 | -81.4 | -50 | 0 | 0 | 0 | 112.3 | S475 | S475-D478 WeakPolarHBondContact CA-O 3.38Å; S475-D478 WeakPolarHBondContact CB-O 3.22Å; S475-D478 PolarHBondContact O-N 3.39Å |
| 479 | G | 33.1 | Very low | 43.4 | Very low | 72 Ų | 72 | 124.1 Ų | 124.1 | 74% | 0.742 | 70% | 0.697 | S | S | * | * | trans | -61.9 | 171.2 | -160.7 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 480 | V | 35.9 | Very low | 41.5 | Very low | 143 Ų | 143 | 133.3 Ų | 133.3 | 87% | 0.867 | 74% | 0.735 | S | S | * | * | trans | -55.4 | 131.9 | -170 | -178.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 481 | M | 32.8 | Very low | 39.8 | Very low | 191 Ų | 191 | 135.9 Ų | 135.9 | 94% | 0.941 | 75% | 0.747 | S | S | * | * | trans | -119.8 | 134.2 | 168.7 | -131.8 | 179.7 | -168.3 | 0 | 0 | 111 | ||||
| 482 | E | 35.8 | Very low | 38.5 | Very low | 191 Ų | 191 | 140.7 Ų | 140.7 | 89% | 0.893 | 77% | 0.77 | S | S | * | * | trans | -76.2 | 159.7 | -174 | -93 | -174.2 | 151.2 | 0 | 0 | 115.4 | N484 | E482-N484 PolarHBondContact O-N 3.45Š| ||
| 483 | M | 46.9 | Very low | 37.3 | Very low | 143 Ų | 143 | 143.8 Ų | 143.8 | 70% | 0.704 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -92 | 15 | -152.4 | -160.2 | 172.3 | 174.8 | 0 | 0 | 117 | ||
| 484 | N | 37.1 | Very low | 36.3 | Very low | 162 Ų | 162 | 144.9 Ų | 144.9 | 87% | 0.866 | 79% | 0.794 | S | S | * | * | trans | -117.1 | 32.1 | -161.3 | -89.1 | -4.2 | 0 | 0 | 0 | 118.3 | E482 | E482-N484 PolarHBondContact O-N 3.45Š| ||
| 485 | S | 33.2 | Very low | 35.5 | Very low | 108 Ų | 108 | 142.3 Ų | 142.3 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | trans | -151.3 | 72.5 | 177 | 61.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 486 | I | 37.5 | Very low | 35.2 | Very low | 175 Ų | 175 | 149.7 Ų | 149.7 | 90% | 0.897 | 84% | 0.838 | S | S | * | * | trans | -126.7 | 91.2 | 156.5 | -53.8 | 177.9 | 0 | 0 | 0 | 107.5 | ||||
| 487 | Q | 31.6 | Very low | 34.9 | Very low | 177 Ų | 177 | 153.7 Ų | 153.7 | 83% | 0.827 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 149.3 | 162.7 | -81.2 | -180 | -11.3 | 0 | 0 | 109.3 | ||
| 488 | P | 33.5 | Very low | 34.5 | Very low | 112 Ų | 112 | 152.1 Ų | 152.1 | 73% | 0.727 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 150.3 | 175.6 | 25.9 | -32.1 | 0 | 0 | 0 | 111.2 | K490 | P488-K490 PolarHBondContact O-N 3.33Š|
| 489 | P | 33.6 | Very low | 34.4 | Very low | 127 Ų | 127 | 152.8 Ų | 152.8 | 83% | 0.825 | 85% | 0.852 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 132 | 178.8 | -9.5 | 23 | 0 | 0 | 0 | 110.1 | E491 | P489-E491 PolarHBondContact O-N 3.23Š|
| 490 | K | 32 | Very low | 34.5 | Very low | 202 Ų | 202 | 157.6 Ų | 157.6 | 88% | 0.878 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 126.1 | 168.2 | -78.5 | -179.7 | 174.2 | 179 | 0 | 109.2 | P488 T492 | P488-K490 PolarHBondContact O-N 3.33Å; K490-T492 PolarHBondContact O-N 2.7Å; K490-T492 VanDerWaalsContact O-N 3.12Å |
| 491 | E | 32.9 | Very low | 34.4 | Very low | 185 Ų | 185 | 158.5 Ų | 158.5 | 86% | 0.864 | 86% | 0.858 | S | S | * | * | trans | -62.2 | 106.9 | 165 | -74.4 | 177.3 | 155.9 | 0 | 0 | 109.3 | P489 T493 | P489-E491 PolarHBondContact O-N 3.23Å; E491-T493 PolarHBondContact O-N 3.03Å | ||
| 492 | T | 31.5 | Very low | 34.5 | Very low | 137 Ų | 137 | 156.3 Ų | 156.3 | 84% | 0.84 | 85% | 0.852 | S | S | * | * | trans | -76.6 | 101.4 | 161.2 | 11.4 | 0 | 0 | 0 | 0 | 108.1 | K490 T494 | K490-T492 PolarHBondContact O-N 2.7Å; K490-T492 VanDerWaalsContact O-N 3.12Å; T492-T494 PolarHBondContact O-N 3.43Å | ||
| 493 | T | 32.8 | Very low | 34.4 | Very low | 117 Ų | 117 | 153.9 Ų | 153.9 | 72% | 0.718 | 85% | 0.849 | S | S | * | * | trans | -62.7 | 112.9 | 164.5 | 19.8 | 0 | 0 | 0 | 0 | 109.1 | E491 N495 | E491-T493 PolarHBondContact O-N 3.03Å; T493-N495 PolarHBondContact O-N 2.88Å | ||
| 494 | T | 32.6 | Very low | 33.5 | Very low | 142 Ų | 142 | 154.7 Ų | 154.7 | 87% | 0.871 | 86% | 0.861 | S | S | * | * | trans | -75.1 | 105.6 | 161.5 | 25.6 | 0 | 0 | 0 | 0 | 108.4 | T492 | T492-T494 PolarHBondContact O-N 3.43Š| ||
| 495 | N | 31.2 | Very low | 33.2 | Very low | 151 Ų | 151 | 154.1 Ų | 154.1 | 81% | 0.807 | 86% | 0.86 | S | S | * | * | trans | -93.7 | 138 | 161.4 | -79.1 | -18.7 | 0 | 0 | 0 | 109.1 | T493 | T493-N495 PolarHBondContact O-N 2.88Š| ||
| 496 | V | 35.8 | Very low | 33.2 | Very low | 216 Ų | 216 | 158.3 Ų | 158.3 | 100% | 1.309 | 87% | 0.87 | S | S | * | * | trans | -56.1 | 0 | 167.8 | 176.4 | 0 | 0 | 0 | 0 | 111 |
Retrieved 496 of 496 residues in 811.6 ms
(Link to these results)