| 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 | 54.4 | Low | 50.8 | Low | 249 Ų | 249 | 137.2 Ų | 137.2 | 100% | 1.227 | 86% | 0.855 | S | S | * | * | 0 | 113.6 | 0 | -66.5 | -178.3 | 177.9 | 0 | 0 | 107.7 | |||||
| 2 | T | 48.4 | Very low | 52 | Low | 149 Ų | 149 | 135.7 Ų | 135.7 | 91% | 0.914 | 85% | 0.848 | S | S | * | * | trans | -102.5 | 139.6 | -163.7 | 38.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 3 | G | 48.5 | Very low | 53 | Low | 71 Ų | 71 | 130.5 Ų | 130.5 | 73% | 0.732 | 81% | 0.81 | S | S | * | * | trans | 118.7 | 113.7 | 151.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 4 | Q | 47.7 | Very low | 54.6 | Low | 186 Ų | 186 | 128.6 Ų | 128.6 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | 173.1 | 93.9 | 104.8 | -89 | 178.4 | -5.8 | 0 | 0 | 109.2 | S6 | Q4-S6 PolarHBondContact O-N 2.92Š| |||
| 5 | S | 51.2 | Low | 56.2 | Low | 123 Ų | 123 | 132 Ų | 132 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | trans | -74 | 105 | 161 | -81.5 | 0 | 0 | 0 | 0 | 108.4 | S7 | S5-S7 PolarHBondContact O-N 2.89Å; S5-S7 VanDerWaalsContact O-N 3.13Å | ||
| 6 | S | 50.3 | Low | 57.9 | Low | 107 Ų | 107 | 132.8 Ų | 132.8 | 75% | 0.748 | 77% | 0.766 | S | S | * | * | trans | -74 | 95.5 | 171.1 | -44.7 | 0 | 0 | 0 | 0 | 109.6 | Q4 Q8 | Q4-S6 PolarHBondContact O-N 2.92Å; S6-Q8 PolarHBondContact O-N 3.16Å | ||
| 7 | S | 51.3 | Low | 59.4 | Low | 116 Ų | 116 | 129.5 Ų | 129.5 | 81% | 0.811 | 74% | 0.74 | S | S | * | * | trans | -64.7 | 102 | 165.7 | -67.7 | 0 | 0 | 0 | 0 | 108.9 | S5 A9 | S5-S7 PolarHBondContact O-N 2.89Å; S5-S7 VanDerWaalsContact O-N 3.13Å; S7-A9 PolarHBondContact O-N 3.17Å | ||
| 8 | Q | 46.9 | Very low | 60.7 | Low | 190 Ų | 190 | 122.6 Ų | 122.6 | 89% | 0.888 | 70% | 0.701 | S | S | * | * | trans | -61.5 | 104.6 | 167.4 | -78.6 | -175.8 | -17.9 | 0 | 0 | 108.5 | S6 A10 | S6-Q8 PolarHBondContact O-N 3.16Å; Q8-A10 PolarHBondContact O-N 2.98Å | ||
| 9 | A | 46.7 | Very low | 61.9 | Low | 95 Ų | 95 | 119.2 Ų | 119.2 | 79% | 0.785 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 116.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | S7 T11 | S7-A9 PolarHBondContact O-N 3.17Å; A9-T11 PolarHBondContact O-N 2.94Å |
| 10 | A | 54.7 | Low | 63.2 | Low | 97 Ų | 97 | 116.9 Ų | 116.9 | 80% | 0.802 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 120.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109 | Q8 | Q8-A10 PolarHBondContact O-N 2.98Š|
| 11 | T | 59.3 | Low | 64.3 | Low | 126 Ų | 126 | 112.1 Ų | 112.1 | 77% | 0.773 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 134.2 | 174.6 | 34.8 | 0 | 0 | 0 | 0 | 109.7 | A9 I13 | A9-T11 PolarHBondContact O-N 2.94Å; T11-I13 PolarHBondContact O-N 3.03Å |
| 12 | P | 64.2 | Low | 65.8 | Low | 119 Ų | 119 | 103.3 Ų | 103.3 | 77% | 0.773 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 132.7 | -179.6 | 25.3 | -32.9 | 0 | 0 | 0 | 109.6 | Q14 | P12-Q14 PolarHBondContact O-N 3.05Š|
| 13 | I | 65.7 | Low | 67.7 | Low | 68 Ų | 68 | 101.3 Ų | 101.3 | 35% | 0.349 | 58% | 0.583 | S | S | . | * | P | Polyproline II helix | trans | -56.3 | 116 | 175.6 | -67.5 | 169.2 | 0 | 0 | 0 | 108.2 | T11 W15 | T11-I13 PolarHBondContact O-N 3.03Å; I13-W15 VanDerWaalsContact C-N 3.34Å; I13-W15 HydrophobicContact CG2-CG 4.45Å; I13-W15 PolarHBondContact O-N 3.01Å |
| 14 | Q | 75.5 | Confident | 69.6 | Low | 105 Ų | 105 | 100 Ų | 100 | 49% | 0.491 | 56% | 0.561 | S | S | . | * | trans | -73.7 | 84.6 | 177.7 | -115 | -173.8 | -21.8 | 0 | 0 | 110 | P12 W16 K17 P18 | P12-Q14 PolarHBondContact O-N 3.05Å; Q14-W16 VanDerWaalsContact CG-NE1 3.27Å; Q14-W16 PolarHBondContact O-N 2.8Å; Q14-W16 VanDerWaalsContact O-N 3.11Å; Q14-K17 HydrophobicContact CB-CD 4.49Å; Q14-K17 HydrophobicContact CB-CG 4.47Å; Q14-K17 PolarHBondContact O-N 2.86Å; Q14-P18 VanDerWaalsContact O-CD 3.3Å; Q14-P18 WeakPolarHBondContact O-CD 3.28Å | ||
| 15 | W | 78.6 | Confident | 71.5 | Confident | 179 Ų | 179 | 92.2 Ų | 92.2 | 68% | 0.678 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -20.6 | -176.4 | -77.4 | 88.2 | 0 | 0 | 0 | 115.2 | I13 K17 P18 A19 | I13-W15 VanDerWaalsContact C-N 3.34Å; I13-W15 HydrophobicContact CG2-CG 4.45Å; I13-W15 PolarHBondContact O-N 3.01Å; W15-K17 VanDerWaalsContact C-N 3.29Å; W15-K17 PolarHBondContact O-N 3.22Å; W15-P18 VanDerWaalsContact O-CD 3.27Å; W15-P18 WeakPolarHBondContact O-CD 3.31Å; W15-P18 VanDerWaalsContact O-CG 3.3Å; W15-P18 WeakPolarHBondContact O-CG 3.48Å; W15-A19 WeakPolarHBondContact O-CB 3.28Å; W15-A19 PolarHBondContact O-N 2.83Å; W15-A19 VanDerWaalsContact O-N 3.16Å |
| 16 | W | 82.7 | Confident | 73.3 | Confident | 145 Ų | 145 | 91.7 Ų | 91.7 | 55% | 0.549 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.9 | -29.4 | 176.8 | 75.6 | -78.6 | 0 | 0 | 0 | 113.1 | Q14 A19 L20 | Q14-W16 VanDerWaalsContact CG-NE1 3.27Å; Q14-W16 PolarHBondContact O-N 2.8Å; Q14-W16 VanDerWaalsContact O-N 3.11Å; W16-A19 PolarHBondContact O-N 2.96Å; W16-L20 HydrophobicContact CZ3-CD2 4.26Å; W16-L20 VanDerWaalsContact O-CB 3.31Å; W16-L20 WeakPolarHBondContact O-CB 3.26Å; W16-L20 PolarHBondContact O-N 3.08Å |
| 17 | K | 83.3 | Confident | 75 | Confident | 77 Ų | 77 | 89.1 Ų | 89.1 | 34% | 0.335 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.8 | -51.2 | 179.7 | -61 | -178.1 | 169.6 | 170 | 0 | 112.9 | Q14 W15 A19 L20 F21 L94 | Q14-K17 HydrophobicContact CB-CD 4.49Å; Q14-K17 HydrophobicContact CB-CG 4.47Å; Q14-K17 PolarHBondContact O-N 2.86Å; W15-K17 VanDerWaalsContact C-N 3.29Å; W15-K17 PolarHBondContact O-N 3.22Å; K17-A19 VanDerWaalsContact C-N 3.3Å; K17-A19 PolarHBondContact O-N 3.22Å; K17-L20 PolarHBondContact O-N 3.04Å; K17-F21 PolarHBondContact O-N 3.13Å; K17-F21 VanDerWaalsContact O-N 3.07Å; K17-L94 WeakPolarHBondContact CB-O 3.39Å |
| 18 | P | 82.9 | Confident | 76.6 | Confident | 5 Ų | 5 | 84.3 Ų | 84.3 | 3% | 0.032 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -65 | -34.5 | 172.4 | 24.4 | -32.3 | 0 | 0 | 0 | 111.7 | Q14 W15 L20 F21 F22 | Q14-P18 VanDerWaalsContact O-CD 3.3Å; Q14-P18 WeakPolarHBondContact O-CD 3.28Å; W15-P18 VanDerWaalsContact O-CD 3.27Å; W15-P18 WeakPolarHBondContact O-CD 3.31Å; W15-P18 VanDerWaalsContact O-CG 3.3Å; W15-P18 WeakPolarHBondContact O-CG 3.48Å; P18-L20 PolarHBondContact O-N 3.05Å; P18-F21 WeakPolarHBondContact O-CB 3.4Å; P18-F21 PolarHBondContact O-N 2.89Å; P18-F22 WeakPolarHBondContact O-CD2 3.44Å; P18-F22 PolarHBondContact O-N 3.05Å |
| 19 | A | 84.2 | Confident | 78.5 | Confident | 58 Ų | 58 | 75.8 Ų | 75.8 | 48% | 0.479 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60.6 | -43.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | W15 W16 K17 F21 F22 L23 | W15-A19 WeakPolarHBondContact O-CB 3.28Å; W15-A19 PolarHBondContact O-N 2.83Å; W15-A19 VanDerWaalsContact O-N 3.16Å; W16-A19 PolarHBondContact O-N 2.96Å; K17-A19 VanDerWaalsContact C-N 3.3Å; K17-A19 PolarHBondContact O-N 3.22Å; A19-F21 VanDerWaalsContact C-N 3.32Å; A19-F21 PolarHBondContact O-N 3.16Å; A19-F22 PolarHBondContact O-N 3.37Å; A19-L23 WeakPolarHBondContact O-CB 3.4Å; A19-L23 PolarHBondContact O-N 3.42Å |
| 20 | L | 87.4 | Confident | 80.2 | Confident | 73 Ų | 73 | 78.3 Ų | 78.3 | 38% | 0.382 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.1 | -41.9 | 174.5 | -179.1 | 65.2 | 0 | 0 | 0 | 111.4 | W16 K17 P18 L23 V24 L94 | W16-L20 HydrophobicContact CZ3-CD2 4.26Å; W16-L20 VanDerWaalsContact O-CB 3.31Å; W16-L20 WeakPolarHBondContact O-CB 3.26Å; W16-L20 PolarHBondContact O-N 3.08Å; K17-L20 PolarHBondContact O-N 3.04Å; P18-L20 PolarHBondContact O-N 3.05Å; L20-L23 PolarHBondContact O-N 3.29Å; L20-V24 WeakPolarHBondContact O-CG2 3.25Å; L20-V24 PolarHBondContact O-N 3.41Å; L20-L94 HydrophobicContact CB-CD2 4.06Å; L20-L94 HydrophobicContact CD2-CD2 3.78Å; L20-L94 HydrophobicContact CD2-CG 4.45Å; L20-L94 HydrophobicContact CG-CD2 3.8Å |
| 21 | F | 87.4 | Confident | 81.5 | Confident | 16 Ų | 16 | 81 Ų | 81 | 7% | 0.07 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -59.6 | -51 | 175.3 | 173.1 | -97.9 | 0 | 0 | 0 | 111.6 | K17 P18 A19 L23 V24 V25 L87 L90 I91 L94 I95 | K17-F21 PolarHBondContact O-N 3.13Å; K17-F21 VanDerWaalsContact O-N 3.07Å; P18-F21 WeakPolarHBondContact O-CB 3.4Å; P18-F21 PolarHBondContact O-N 2.89Å; A19-F21 VanDerWaalsContact C-N 3.32Å; A19-F21 PolarHBondContact O-N 3.16Å; F21-L23 VanDerWaalsContact C-N 3.28Å; F21-L23 PolarHBondContact O-N 2.99Å; F21-V24 PolarHBondContact O-N 2.86Å; F21-V25 HydrophobicContact CD1-CG2 4.06Å; F21-V25 HydrophobicContact CD2-CG2 4.33Å; F21-V25 HydrophobicContact CE1-CG2 3.56Å; F21-V25 HydrophobicContact CE2-CG2 3.86Å; F21-V25 HydrophobicContact CG-CG2 4.43Å; F21-V25 HydrophobicContact CZ-CG2 3.45Å; F21-V25 VanDerWaalsContact CZ-CG2 3.45Å; F21-V25 VanDerWaalsContact O-CG2 3.3Å; F21-V25 WeakPolarHBondContact O-CG2 3.23Å; F21-V25 PolarHBondContact O-N 2.94Å; F21-L87 HydrophobicContact CE2-CD2 4.07Å; F21-L90 HydrophobicContact CD2-CB 4.01Å; F21-L90 HydrophobicContact CE2-CB 4.28Å; F21-I91 HydrophobicContact CD2-CG1 4.37Å; F21-I91 HydrophobicContact CE1-CG1 4.39Å; F21-I91 HydrophobicContact CE2-CB 4.48Å; F21-I91 HydrophobicContact CE2-CD1 4.32Å; F21-I91 HydrophobicContact CE2-CG1 3.4Å; F21-I91 VanDerWaalsContact CE2-CG1 3.4Å; F21-I91 HydrophobicContact CZ-CD1 3.93Å; F21-I91 HydrophobicContact CZ-CG1 3.4Å; F21-I91 VanDerWaalsContact CZ-CG1 3.4Å; F21-L94 HydrophobicContact CB-CB 4.11Å; F21-L94 HydrophobicContact CB-CD2 4.01Å; F21-I95 HydrophobicContact CB-CG1 4.31Å; F21-I95 HydrophobicContact CD1-CD1 3.61Å; F21-I95 HydrophobicContact CD1-CG1 4.09Å; F21-I95 HydrophobicContact CD2-CD1 4.26Å; F21-I95 HydrophobicContact CD2-CG1 4.35Å; F21-I95 HydrophobicContact CE1-CD1 3.64Å; F21-I95 HydrophobicContact CE2-CD1 4.3Å; F21-I95 HydrophobicContact CG-CD1 3.93Å; F21-I95 HydrophobicContact CG-CG1 3.96Å; F21-I95 HydrophobicContact CZ-CD1 3.99Å |
| 22 | F | 86.1 | Confident | 82.4 | Confident | 65 Ų | 65 | 76.5 Ų | 76.5 | 29% | 0.285 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.4 | -34.7 | 178.7 | -78.6 | -67.6 | 0 | 0 | 0 | 112.4 | P18 A19 V25 I26 W99 F118 | P18-F22 WeakPolarHBondContact O-CD2 3.44Å; P18-F22 PolarHBondContact O-N 3.05Å; A19-F22 PolarHBondContact O-N 3.37Å; F22-V25 PolarHBondContact O-N 3.33Å; F22-I26 WeakPolarHBondContact O-CB 3.44Å; F22-I26 WeakPolarHBondContact O-CD1 3.37Å; F22-I26 WeakPolarHBondContact O-CG1 3.14Å; F22-I26 PolarHBondContact O-N 3.03Å; F22-W99 AromaticContact CE2-CH2 3.69Å; F22-W99 HydrophobicContact CE2-CH2 3.69Å; F22-W99 HydrophobicContact CE2-CZ2 4.18Å; F22-W99 HydrophobicContact CE2-CZ3 4.29Å; F22-W99 AromaticContact CZ-CH2 3.67Å; F22-W99 HydrophobicContact CZ-CH2 3.67Å; F22-W99 HydrophobicContact CZ-CZ2 4.47Å; F22-W99 HydrophobicContact CZ-CZ3 4.28Å; F22-F118 HydrophobicContact CE1-CE1 4.34Å; F22-F118 HydrophobicContact CZ-CE1 4.33Å |
| 23 | L | 87.6 | Confident | 83.2 | Confident | 107 Ų | 107 | 71.7 Ų | 71.7 | 56% | 0.56 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -61.2 | -49.8 | 173.1 | -172.9 | 161.2 | 0 | 0 | 0 | 110.8 | A19 L20 F21 V25 I26 A27 | A19-L23 WeakPolarHBondContact O-CB 3.4Å; A19-L23 PolarHBondContact O-N 3.42Å; L20-L23 PolarHBondContact O-N 3.29Å; F21-L23 VanDerWaalsContact C-N 3.28Å; F21-L23 PolarHBondContact O-N 2.99Å; L23-V25 VanDerWaalsContact C-N 3.33Å; L23-V25 PolarHBondContact O-N 3.04Å; L23-I26 PolarHBondContact O-N 3.41Å; L23-A27 VanDerWaalsContact O-CB 3.22Å; L23-A27 WeakPolarHBondContact O-CB 3.16Å; L23-A27 PolarHBondContact O-N 3.46Å |
| 24 | V | 88.7 | Confident | 83.8 | Confident | 43 Ų | 43 | 72.9 Ų | 72.9 | 26% | 0.261 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 178 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | L20 F21 G28 L87 L90 | L20-V24 WeakPolarHBondContact O-CG2 3.25Å; L20-V24 PolarHBondContact O-N 3.41Å; F21-V24 PolarHBondContact O-N 2.86Å; V24-G28 WeakPolarHBondContact O-CA 3.26Å; V24-G28 PolarHBondContact O-N 2.98Å; V24-L87 HydrophobicContact CG1-CD2 4.1Å; V24-L90 HydrophobicContact CB-CD2 4.21Å; V24-L90 HydrophobicContact CG1-CD2 3.91Å; V24-L90 HydrophobicContact CG2-CD2 4.23Å |
| 25 | V | 87.6 | Confident | 84 | Confident | 23 Ų | 23 | 73.2 Ų | 73.2 | 14% | 0.139 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -59.6 | -55.4 | 174.8 | 171.1 | 0 | 0 | 0 | 0 | 110.4 | F21 F22 L23 A27 G28 L29 L87 | F21-V25 HydrophobicContact CD1-CG2 4.06Å; F21-V25 HydrophobicContact CD2-CG2 4.33Å; F21-V25 HydrophobicContact CE1-CG2 3.56Å; F21-V25 HydrophobicContact CE2-CG2 3.86Å; F21-V25 HydrophobicContact CG-CG2 4.43Å; F21-V25 HydrophobicContact CZ-CG2 3.45Å; F21-V25 VanDerWaalsContact CZ-CG2 3.45Å; F21-V25 VanDerWaalsContact O-CG2 3.3Å; F21-V25 WeakPolarHBondContact O-CG2 3.23Å; F21-V25 PolarHBondContact O-N 2.94Å; F22-V25 PolarHBondContact O-N 3.33Å; L23-V25 VanDerWaalsContact C-N 3.33Å; L23-V25 PolarHBondContact O-N 3.04Å; V25-A27 PolarHBondContact O-N 3.48Å; V25-G28 PolarHBondContact O-N 2.9Å; V25-L29 HydrophobicContact CG1-CD1 3.46Å; V25-L29 VanDerWaalsContact CG1-CD1 3.46Å; V25-L29 HydrophobicContact CG1-CG 4.08Å; V25-L29 WeakPolarHBondContact O-CB 3.31Å; V25-L29 WeakPolarHBondContact O-CG 3.24Å; V25-L29 PolarHBondContact O-N 2.67Å; V25-L87 HydrophobicContact CB-CD2 4.39Å; V25-L87 HydrophobicContact CG2-CD1 4.11Å; V25-L87 HydrophobicContact CG2-CD2 3.42Å; V25-L87 VanDerWaalsContact CG2-CD2 3.42Å; V25-L87 HydrophobicContact CG2-CG 4.37Å |
| 26 | I | 87.3 | Confident | 83.8 | Confident | 112 Ų | 112 | 67.4 Ų | 67.4 | 57% | 0.574 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -61.9 | -49.4 | -176.2 | -69 | 165.1 | 0 | 0 | 0 | 110.2 | F22 L23 W30 | F22-I26 WeakPolarHBondContact O-CB 3.44Å; F22-I26 WeakPolarHBondContact O-CD1 3.37Å; F22-I26 WeakPolarHBondContact O-CG1 3.14Å; F22-I26 PolarHBondContact O-N 3.03Å; L23-I26 PolarHBondContact O-N 3.41Å; I26-W30 WeakPolarHBondContact O-CB 3.18Å; I26-W30 PolarHBondContact O-N 2.96Å |
| 27 | A | 87.1 | Confident | 83.4 | Confident | 52 Ų | 52 | 65 Ų | 65 | 43% | 0.43 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.4 | -45 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112 | L23 V25 W30 Y31 | L23-A27 VanDerWaalsContact O-CB 3.22Å; L23-A27 WeakPolarHBondContact O-CB 3.16Å; L23-A27 PolarHBondContact O-N 3.46Å; V25-A27 PolarHBondContact O-N 3.48Å; A27-W30 PolarHBondContact O-N 3.03Å; A27-Y31 WeakPolarHBondContact O-CB 3.09Å; A27-Y31 PolarHBondContact O-N 2.67Å |
| 28 | G | 85.3 | Confident | 83 | Confident | 15 Ų | 15 | 68.2 Ų | 68.2 | 16% | 0.155 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -66.2 | -46.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V24 V25 W30 V32 L83 | V24-G28 WeakPolarHBondContact O-CA 3.26Å; V24-G28 PolarHBondContact O-N 2.98Å; V25-G28 PolarHBondContact O-N 2.9Å; G28-W30 VanDerWaalsContact C-N 3.32Å; G28-V32 VanDerWaalsContact O-CB 3.3Å; G28-V32 WeakPolarHBondContact O-CB 3.11Å; G28-V32 VanDerWaalsContact O-CG2 3.27Å; G28-V32 WeakPolarHBondContact O-CG2 3.08Å; G28-V32 PolarHBondContact O-N 2.94Å; G28-L83 VanDerWaalsContact C-CD2 3.44Å |
| 29 | L | 85.7 | Confident | 82.5 | Confident | 11 Ų | 11 | 69.8 Ų | 69.8 | 6% | 0.058 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63 | -41.2 | 175.2 | -69.6 | -180 | 0 | 0 | 0 | 111.5 | V25 K33 W34 L83 G122 M124 | V25-L29 HydrophobicContact CG1-CD1 3.46Å; V25-L29 VanDerWaalsContact CG1-CD1 3.46Å; V25-L29 HydrophobicContact CG1-CG 4.08Å; V25-L29 WeakPolarHBondContact O-CB 3.31Å; V25-L29 WeakPolarHBondContact O-CG 3.24Å; V25-L29 PolarHBondContact O-N 2.67Å; L29-K33 WeakPolarHBondContact O-CA 3.43Å; L29-K33 WeakPolarHBondContact O-CB 3.48Å; L29-K33 PolarHBondContact O-N 3.37Å; L29-W34 PolarHBondContact O-N 3.33Å; L29-W34 VanDerWaalsContact O-N 3.1Å; L29-L83 HydrophobicContact CD2-CD2 4.43Å; L29-G122 WeakPolarHBondContact CD2-O 3.46Å; L29-M124 HydrophobicContact CD2-CE 2.96Å; L29-M124 HydrophobicContact CG-CE 4.41Å |
| 30 | W | 83.6 | Confident | 81.9 | Confident | 149 Ų | 149 | 72.9 Ų | 72.9 | 56% | 0.564 | 36% | 0.355 | S | S | * | . | I | π-helix | trans | -61.3 | -53.3 | 179.3 | -176.8 | -94.8 | 0 | 0 | 0 | 111.1 | I26 A27 G28 W34 Q35 | I26-W30 WeakPolarHBondContact O-CB 3.18Å; I26-W30 PolarHBondContact O-N 2.96Å; A27-W30 PolarHBondContact O-N 3.03Å; G28-W30 VanDerWaalsContact C-N 3.32Å; W30-W34 HydrophobicContact CD2-CB 4.15Å; W30-W34 HydrophobicContact CE3-CB 3.67Å; W30-W34 HydrophobicContact CE3-CG 4.09Å; W30-W34 HydrophobicContact CZ3-CB 4.09Å; W30-W34 PolarHBondContact O-N 2.81Å; W30-Q35 WeakPolarHBondContact O-CB 3.21Å; W30-Q35 PolarHBondContact O-N 3.21Å |
| 31 | Y | 81.7 | Confident | 80.9 | Confident | 154 Ų | 154 | 70.4 Ų | 70.4 | 60% | 0.604 | 35% | 0.346 | S | S | * | . | I | π-helix | trans | -64.1 | -46.7 | -178.3 | -179.3 | -103.6 | 0 | 0 | 0 | 112.7 | A27 | A27-Y31 WeakPolarHBondContact O-CB 3.09Å; A27-Y31 PolarHBondContact O-N 2.67Å |
| 32 | V | 78.4 | Confident | 80.2 | Confident | 30 Ų | 30 | 74.6 Ų | 74.6 | 18% | 0.182 | 36% | 0.364 | C | S | . | . | I | π-helix | trans | -80.2 | -30.8 | -173.1 | 178.8 | 0 | 0 | 0 | 0 | 112.2 | G28 P36 K79 A80 L83 | G28-V32 VanDerWaalsContact O-CB 3.3Å; G28-V32 WeakPolarHBondContact O-CB 3.11Å; G28-V32 VanDerWaalsContact O-CG2 3.27Å; G28-V32 WeakPolarHBondContact O-CG2 3.08Å; G28-V32 PolarHBondContact O-N 2.94Å; V32-P36 WeakPolarHBondContact O-CG 3.2Å; V32-K79 HydrophobicContact CG1-CB 4.17Å; V32-K79 HydrophobicContact CG2-CB 4.47Å; V32-A80 HydrophobicContact CG1-CB 3.89Å; V32-L83 HydrophobicContact CG2-CD2 4.29Å |
| 33 | K | 80.4 | Confident | 79.2 | Confident | 18 Ų | 18 | 75.1 Ų | 75.1 | 8% | 0.078 | 37% | 0.372 | C | S | . | . | I | π-helix | trans | -125.1 | -59.4 | -169.7 | -61.7 | -161.5 | 166.9 | -174.4 | 0 | 114 | L29 Q35 P36 Y37 M123 M124 | L29-K33 WeakPolarHBondContact O-CA 3.43Å; L29-K33 WeakPolarHBondContact O-CB 3.48Å; L29-K33 PolarHBondContact O-N 3.37Å; K33-Q35 VanDerWaalsContact C-N 3.33Å; K33-Q35 PolarHBondContact O-N 3.45Å; K33-P36 WeakPolarHBondContact O-CD 3.28Å; K33-P36 VanDerWaalsContact O-CG 3.27Å; K33-P36 WeakPolarHBondContact O-CG 3.32Å; K33-Y37 HydrophobicContact CB-CD2 4.1Å; K33-Y37 HydrophobicContact CB-CE2 4.34Å; K33-Y37 WeakPolarHBondContact O-CB 3.32Å; K33-Y37 WeakPolarHBondContact O-CD2 3.4Å; K33-Y37 PolarHBondContact O-N 3.43Å; K33-M123 HydrophobicContact CB-CE 4.09Å; K33-M123 HydrophobicContact CD-CB 4.1Å; K33-M123 PolarHBondContact NZ-O 3.19Å; K33-M124 HydrophobicContact CD-CE 3.92Å; K33-M124 HydrophobicContact CD-SD 4.39Å; K33-M124 VanDerWaalsContact NZ-CA 3.34Å; K33-M124 PolarHBondContact NZ-SD 3.15Å |
| 34 | W | 78.1 | Confident | 77.9 | Confident | 93 Ų | 93 | 70.1 Ų | 70.1 | 35% | 0.352 | 35% | 0.347 | S | S | . | . | I | π-helix | trans | -62.5 | -43.7 | -171.8 | -73.6 | 84.9 | 0 | 0 | 0 | 112 | L29 W30 Y37 Y38 M123 | L29-W34 PolarHBondContact O-N 3.33Å; L29-W34 VanDerWaalsContact O-N 3.1Å; W30-W34 HydrophobicContact CD2-CB 4.15Å; W30-W34 HydrophobicContact CE3-CB 3.67Å; W30-W34 HydrophobicContact CE3-CG 4.09Å; W30-W34 HydrophobicContact CZ3-CB 4.09Å; W30-W34 PolarHBondContact O-N 2.81Å; W34-Y37 PolarHBondContact O-N 3Å; W34-Y38 WeakPolarHBondContact O-CB 3.04Å; W34-Y38 PolarHBondContact O-N 3.27Å; W34-M123 HydrophobicContact CD2-CE 3.63Å; W34-M123 HydrophobicContact CE3-CE 4.4Å; W34-M123 HydrophobicContact CG-CE 3.79Å; W34-M123 HydrophobicContact CZ2-CE 3.77Å; W34-M123 HydrophobicContact CZ2-SD 4.45Å |
| 35 | Q | 79.7 | Confident | 76.8 | Confident | 112 Ų | 112 | 69.9 Ų | 69.9 | 52% | 0.523 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -57.7 | -52.2 | 179.9 | -172.4 | 172.6 | -5.8 | 0 | 0 | 113.3 | W30 K33 | W30-Q35 WeakPolarHBondContact O-CB 3.21Å; W30-Q35 PolarHBondContact O-N 3.21Å; K33-Q35 VanDerWaalsContact C-N 3.33Å; K33-Q35 PolarHBondContact O-N 3.45Å |
| 36 | P | 75.3 | Confident | 75.9 | Confident | 58 Ų | 58 | 76.3 Ų | 76.3 | 38% | 0.377 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -70.2 | -34.7 | 177.4 | 24.8 | -33.7 | 0 | 0 | 0 | 113.6 | V32 K33 K40 | V32-P36 WeakPolarHBondContact O-CG 3.2Å; K33-P36 WeakPolarHBondContact O-CD 3.28Å; K33-P36 VanDerWaalsContact O-CG 3.27Å; K33-P36 WeakPolarHBondContact O-CG 3.32Å; P36-K40 WeakPolarHBondContact O-CG 3.4Å; P36-K40 PolarHBondContact O-N 3.48Å |
| 37 | Y | 74 | Confident | 74.8 | Confident | 94 Ų | 94 | 75 Ų | 75 | 37% | 0.369 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -73.8 | -35.2 | -179.9 | -78.6 | -63.9 | 0 | 0 | 0 | 112.9 | K33 W34 K40 A41 A159 F163 | K33-Y37 HydrophobicContact CB-CD2 4.1Å; K33-Y37 HydrophobicContact CB-CE2 4.34Å; K33-Y37 WeakPolarHBondContact O-CB 3.32Å; K33-Y37 WeakPolarHBondContact O-CD2 3.4Å; K33-Y37 PolarHBondContact O-N 3.43Å; W34-Y37 PolarHBondContact O-N 3Å; Y37-K40 CarbonylContact O-C 3.34Å; Y37-K40 PolarHBondContact O-N 3.36Å; Y37-A41 WeakPolarHBondContact O-CB 3.25Å; Y37-A41 PolarHBondContact O-N 3.28Å; Y37-A159 HydrophobicContact CD1-CB 4.12Å; Y37-A159 HydrophobicContact CG-CB 4.12Å; Y37-F163 AromaticContact CD1-CE2 3.64Å; Y37-F163 HydrophobicContact CD1-CE2 3.64Å; Y37-F163 AromaticContact CD1-CZ 3.98Å; Y37-F163 HydrophobicContact CD1-CZ 3.98Å; Y37-F163 HydrophobicContact CE1-CE2 4.04Å |
| 38 | Y | 73.6 | Confident | 73.6 | Confident | 144 Ų | 144 | 78.7 Ų | 78.7 | 57% | 0.565 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -59.5 | -51.5 | 176.5 | -171.1 | -103.5 | 0 | 0 | 0 | 109.9 | W34 K40 A41 F42 | W34-Y38 WeakPolarHBondContact O-CB 3.04Å; W34-Y38 PolarHBondContact O-N 3.27Å; Y38-K40 VanDerWaalsContact C-N 3.31Å; Y38-K40 PolarHBondContact O-N 3.05Å; Y38-A41 WeakPolarHBondContact O-CB 3.27Å; Y38-A41 PolarHBondContact O-N 3.41Å; Y38-F42 HydrophobicContact CD1-CD2 4.11Å; Y38-F42 AromaticContact CD1-CE2 3.46Å; Y38-F42 HydrophobicContact CD1-CE2 3.46Å; Y38-F42 VanDerWaalsContact CD1-CE2 3.46Å; Y38-F42 HydrophobicContact CD1-CZ 4.42Å; Y38-F42 AromaticContact CD2-CE2 3.78Å; Y38-F42 HydrophobicContact CD2-CE2 3.78Å; Y38-F42 HydrophobicContact CD2-CZ 4.39Å; Y38-F42 HydrophobicContact CE1-CD2 4.08Å; Y38-F42 AromaticContact CE1-CE2 3.16Å; Y38-F42 HydrophobicContact CE1-CE2 3.16Å; Y38-F42 AromaticContact CE1-CZ 3.74Å; Y38-F42 HydrophobicContact CE1-CZ 3.74Å; Y38-F42 AromaticContact CE2-CE2 3.5Å; Y38-F42 HydrophobicContact CE2-CE2 3.5Å; Y38-F42 AromaticContact CE2-CZ 3.7Å; Y38-F42 HydrophobicContact CE2-CZ 3.7Å; Y38-F42 HydrophobicContact CG-CD2 4.49Å; Y38-F42 AromaticContact CG-CE2 3.75Å; Y38-F42 HydrophobicContact CG-CE2 3.75Å; Y38-F42 AromaticContact CZ-CE2 3.18Å; Y38-F42 AromaticContact CZ-CZ 3.32Å; Y38-F42 WeakPolarHBondContact O-CD2 3.48Å; Y38-F42 WeakPolarHBondContact O-CE2 3.47Å; Y38-F42 PolarHBondContact O-N 3.28Å; Y38-F42 VanDerWaalsContact OH-CZ 3.3Å; Y38-F42 WeakPolarHBondContact OH-CZ 3.4Å |
| 39 | G | 72.7 | Confident | 72.6 | Confident | 39 Ų | 39 | 80.8 Ų | 80.8 | 40% | 0.402 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.4 | -38.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | A41 T43 | G39-A41 VanDerWaalsContact C-N 3.34Å; G39-A41 PolarHBondContact O-N 2.95Å; G39-T43 PolarHBondContact O-N 3.46Å; G39-T43 PolarHBondContact O-OG1 3.12Å |
| 40 | K | 71.3 | Confident | 71.3 | Confident | 122 Ų | 122 | 86 Ų | 86 | 53% | 0.53 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -67.9 | -31.3 | 174.7 | -73.5 | 177.7 | -176.2 | -72.2 | 0 | 112.9 | P36 Y37 Y38 T43 A44 F163 | P36-K40 WeakPolarHBondContact O-CG 3.4Å; P36-K40 PolarHBondContact O-N 3.48Å; Y37-K40 CarbonylContact O-C 3.34Å; Y37-K40 PolarHBondContact O-N 3.36Å; Y38-K40 VanDerWaalsContact C-N 3.31Å; Y38-K40 PolarHBondContact O-N 3.05Å; K40-T43 WeakPolarHBondContact CA-OG1 2.93Å; K40-T43 PolarHBondContact O-OG1 3.08Å; K40-A44 VanDerWaalsContact O-CB 3.27Å; K40-A44 WeakPolarHBondContact O-CB 3.03Å; K40-A44 PolarHBondContact O-N 3.35Å; K40-F163 HydrophobicContact CB-CE1 4.22Å; K40-F163 HydrophobicContact CB-CZ 3.88Å |
| 41 | A | 67.4 | Low | 70.4 | Confident | 22 Ų | 22 | 81 Ų | 81 | 18% | 0.182 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -67 | -40.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | Y37 Y38 G39 A44 A45 V162 F163 | Y37-A41 WeakPolarHBondContact O-CB 3.25Å; Y37-A41 PolarHBondContact O-N 3.28Å; Y38-A41 WeakPolarHBondContact O-CB 3.27Å; Y38-A41 PolarHBondContact O-N 3.41Å; G39-A41 VanDerWaalsContact C-N 3.34Å; G39-A41 PolarHBondContact O-N 2.95Å; A41-A44 PolarHBondContact O-N 3.35Å; A41-A45 WeakPolarHBondContact O-CB 3.09Å; A41-A45 PolarHBondContact O-N 2.82Å; A41-V162 HydrophobicContact CB-CG1 4.39Å; A41-F163 HydrophobicContact CB-CE1 4.42Å |
| 42 | F | 71.5 | Confident | 69.4 | Low | 104 Ų | 104 | 83.3 Ų | 83.3 | 46% | 0.456 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -66.9 | -45.2 | 175.3 | -67.7 | -78.2 | 0 | 0 | 0 | 112.1 | Y38 A44 A45 E46 | Y38-F42 HydrophobicContact CD1-CD2 4.11Å; Y38-F42 AromaticContact CD1-CE2 3.46Å; Y38-F42 HydrophobicContact CD1-CE2 3.46Å; Y38-F42 VanDerWaalsContact CD1-CE2 3.46Å; Y38-F42 HydrophobicContact CD1-CZ 4.42Å; Y38-F42 AromaticContact CD2-CE2 3.78Å; Y38-F42 HydrophobicContact CD2-CE2 3.78Å; Y38-F42 HydrophobicContact CD2-CZ 4.39Å; Y38-F42 HydrophobicContact CE1-CD2 4.08Å; Y38-F42 AromaticContact CE1-CE2 3.16Å; Y38-F42 HydrophobicContact CE1-CE2 3.16Å; Y38-F42 AromaticContact CE1-CZ 3.74Å; Y38-F42 HydrophobicContact CE1-CZ 3.74Å; Y38-F42 AromaticContact CE2-CE2 3.5Å; Y38-F42 HydrophobicContact CE2-CE2 3.5Å; Y38-F42 AromaticContact CE2-CZ 3.7Å; Y38-F42 HydrophobicContact CE2-CZ 3.7Å; Y38-F42 HydrophobicContact CG-CD2 4.49Å; Y38-F42 AromaticContact CG-CE2 3.75Å; Y38-F42 HydrophobicContact CG-CE2 3.75Å; Y38-F42 AromaticContact CZ-CE2 3.18Å; Y38-F42 AromaticContact CZ-CZ 3.32Å; Y38-F42 WeakPolarHBondContact O-CD2 3.48Å; Y38-F42 WeakPolarHBondContact O-CE2 3.47Å; Y38-F42 PolarHBondContact O-N 3.28Å; Y38-F42 VanDerWaalsContact OH-CZ 3.3Å; Y38-F42 WeakPolarHBondContact OH-CZ 3.4Å; F42-A44 VanDerWaalsContact C-N 3.3Å; F42-A44 PolarHBondContact O-N 2.95Å; F42-A45 WeakPolarHBondContact O-CB 3.21Å; F42-A45 PolarHBondContact O-N 3.42Å; F42-A45 VanDerWaalsContact O-N 3.13Å; F42-E46 PolarHBondContact O-N 2.98Å; F42-E46 VanDerWaalsContact O-N 3.07Å |
| 43 | T | 65.5 | Low | 68.7 | Low | 75 Ų | 75 | 85.9 Ų | 85.9 | 46% | 0.46 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.8 | -37.9 | 177 | 49.3 | 0 | 0 | 0 | 0 | 112.1 | G39 K40 E46 T47 | G39-T43 PolarHBondContact O-N 3.46Å; G39-T43 PolarHBondContact O-OG1 3.12Å; K40-T43 WeakPolarHBondContact CA-OG1 2.93Å; K40-T43 PolarHBondContact O-OG1 3.08Å; T43-E46 PolarHBondContact O-N 2.6Å; T43-T47 WeakPolarHBondContact O-CB 3.45Å; T43-T47 PolarHBondContact O-N 3.26Å; T43-T47 PolarHBondContact O-OG1 3.46Å |
| 44 | A | 60.6 | Low | 67.7 | Low | 2 Ų | 2 | 88.4 Ų | 88.4 | 2% | 0.017 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -68.3 | -34.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112.8 | K40 A41 F42 E46 H48 F163 | K40-A44 VanDerWaalsContact O-CB 3.27Å; K40-A44 WeakPolarHBondContact O-CB 3.03Å; K40-A44 PolarHBondContact O-N 3.35Å; A41-A44 PolarHBondContact O-N 3.35Å; F42-A44 VanDerWaalsContact C-N 3.3Å; F42-A44 PolarHBondContact O-N 2.95Å; A44-E46 VanDerWaalsContact C-N 3.32Å; A44-H48 WeakPolarHBondContact O-CA 3.4Å; A44-H48 PolarHBondContact O-N 2.97Å; A44-F163 HydrophobicContact CB-CD1 3.92Å; A44-F163 HydrophobicContact CB-CE1 3.97Å |
| 45 | A | 65.5 | Low | 66.9 | Low | 38 Ų | 38 | 89.7 Ų | 89.7 | 31% | 0.314 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.6 | -35 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A41 F42 F166 | A41-A45 WeakPolarHBondContact O-CB 3.09Å; A41-A45 PolarHBondContact O-N 2.82Å; F42-A45 WeakPolarHBondContact O-CB 3.21Å; F42-A45 PolarHBondContact O-N 3.42Å; F42-A45 VanDerWaalsContact O-N 3.13Å; A45-F166 HydrophobicContact CB-CD1 4.5Å; A45-F166 HydrophobicContact CB-CE1 4.03Å; A45-F166 HydrophobicContact CB-CE2 4.13Å; A45-F166 HydrophobicContact CB-CZ 3.83Å |
| 46 | E | 68.4 | Low | 66 | Low | 158 Ų | 158 | 87.8 Ų | 87.8 | 74% | 0.738 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -82 | -40.8 | 179.2 | -69.7 | 176.9 | 175.5 | 0 | 0 | 113.2 | F42 T43 A44 | F42-E46 PolarHBondContact O-N 2.98Å; F42-E46 VanDerWaalsContact O-N 3.07Å; T43-E46 PolarHBondContact O-N 2.6Å; A44-E46 VanDerWaalsContact C-N 3.32Å |
| 47 | T | 64 | Low | 65.1 | Low | 86 Ų | 86 | 91.4 Ų | 91.4 | 53% | 0.528 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -97.1 | -8.6 | -170.1 | 60.4 | 0 | 0 | 0 | 0 | 114 | T43 S49 | T43-T47 WeakPolarHBondContact O-CB 3.45Å; T43-T47 PolarHBondContact O-N 3.26Å; T43-T47 PolarHBondContact O-OG1 3.46Å; T47-S49 PolarHBondContact O-N 3.2Å; T47-S49 PolarHBondContact OG1-N 3.35Å; T47-S49 PolarHBondContact OG1-O 2.92Å; T47-S49 VanDerWaalsContact OG1-O 3.08Å |
| 48 | H | 63.9 | Low | 64.6 | Low | 129 Ų | 129 | 88.4 Ų | 88.4 | 60% | 0.597 | 49% | 0.486 | S | S | * | . | S | Bend | trans | 47.1 | 20.9 | -167.4 | -74.8 | -90.1 | 0 | 0 | 0 | 113.5 | A44 F166 | A44-H48 WeakPolarHBondContact O-CA 3.4Å; A44-H48 PolarHBondContact O-N 2.97Å; H48-F166 PolarHBondContact ND1-O 3.42Å |
| 49 | S | 62.5 | Low | 64.2 | Low | 58 Ų | 58 | 89.2 Ų | 89.2 | 41% | 0.406 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -132.6 | 135.7 | -174.4 | 179.7 | 0 | 0 | 0 | 0 | 109.5 | T47 G51 | T47-S49 PolarHBondContact O-N 3.2Å; T47-S49 PolarHBondContact OG1-N 3.35Å; T47-S49 PolarHBondContact OG1-O 2.92Å; T47-S49 VanDerWaalsContact OG1-O 3.08Å; S49-G51 PolarHBondContact O-N 3.46Å; S49-G51 PolarHBondContact OG-N 2.84Å |
| 50 | I | 60.2 | Low | 64.1 | Low | 120 Ų | 120 | 91.9 Ų | 91.9 | 62% | 0.615 | 52% | 0.518 | S | S | * | . | trans | -81.1 | 7.6 | 179.9 | -68.6 | 170.7 | 0 | 0 | 0 | 111.4 | F163 V167 | I50-F163 HydrophobicContact CD1-CB 4.29Å; I50-V167 HydrophobicContact CD1-CG2 3.61Å; I50-V167 HydrophobicContact CG1-CG2 3.82Å | ||
| 51 | G | 62.8 | Low | 64.5 | Low | 45 Ų | 45 | 88.9 Ų | 88.9 | 46% | 0.464 | 51% | 0.508 | S | S | . | . | S | Bend | trans | 102.8 | 176.6 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112 | S49 S53 | S49-G51 PolarHBondContact O-N 3.46Å; S49-G51 PolarHBondContact OG-N 2.84Å; G51-S53 PolarHBondContact O-N 3.2Å |
| 52 | K | 61.4 | Low | 65.2 | Low | 202 Ų | 202 | 91.8 Ų | 91.8 | 88% | 0.878 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -61.1 | 122.2 | 178.2 | -69.2 | -176.4 | 179.6 | 179.5 | 0 | 109.6 | I54 | K52-I54 PolarHBondContact O-N 3.3Å; K52-I54 VanDerWaalsContact O-N 3.16Å |
| 53 | S | 63.4 | Low | 65.8 | Low | 85 Ų | 85 | 96.6 Ų | 96.6 | 59% | 0.594 | 54% | 0.54 | S | S | * | . | trans | -56.8 | 118.2 | 172.8 | -58.3 | 0 | 0 | 0 | 0 | 109.3 | G51 L55 A56 | G51-S53 PolarHBondContact O-N 3.2Å; S53-L55 PolarHBondContact O-N 2.78Å; S53-L55 VanDerWaalsContact O-N 3.07Å; S53-A56 VanDerWaalsContact O-CB 3.23Å; S53-A56 WeakPolarHBondContact O-CB 3.3Å; S53-A56 PolarHBondContact O-N 3.16Å | ||
| 54 | I | 60.7 | Low | 66.6 | Low | 70 Ų | 70 | 98.5 Ų | 98.5 | 36% | 0.359 | 54% | 0.544 | S | S | . | . | G | 310 helix | trans | -59.3 | -20.2 | 175.1 | -61.1 | -49.3 | 0 | 0 | 0 | 111.7 | K52 A56 I72 | K52-I54 PolarHBondContact O-N 3.3Å; K52-I54 VanDerWaalsContact O-N 3.16Å; I54-A56 VanDerWaalsContact C-N 3.32Å; I54-I72 HydrophobicContact CD1-CD1 4.42Å; I54-I72 HydrophobicContact CG1-CD1 4.48Å |
| 55 | L | 61.1 | Low | 67.7 | Low | 120 Ų | 120 | 99.2 Ų | 99.2 | 63% | 0.628 | 55% | 0.55 | S | S | * | * | G | 310 helix | trans | -79.3 | -6.7 | 174 | -80.3 | 76.9 | 0 | 0 | 0 | 114.2 | S53 Q57 A58 | S53-L55 PolarHBondContact O-N 2.78Å; S53-L55 VanDerWaalsContact O-N 3.07Å; L55-Q57 PolarHBondContact O-N 3.42Å; L55-Q57 VanDerWaalsContact O-N 3.1Å; L55-A58 WeakPolarHBondContact O-CB 3.38Å; L55-A58 PolarHBondContact O-N 3.27Å |
| 56 | A | 59.7 | Low | 68.6 | Low | 72 Ų | 72 | 99.9 Ų | 99.9 | 60% | 0.595 | 56% | 0.556 | S | S | * | * | G | 310 helix | trans | -65.1 | -14.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | S53 I54 | S53-A56 VanDerWaalsContact O-CB 3.23Å; S53-A56 WeakPolarHBondContact O-CB 3.3Å; S53-A56 PolarHBondContact O-N 3.16Å; I54-A56 VanDerWaalsContact C-N 3.32Å |
| 57 | Q | 58 | Low | 69.5 | Low | 134 Ų | 134 | 98 Ų | 98 | 63% | 0.626 | 55% | 0.55 | S | S | * | * | G | 310 helix | trans | -106.1 | 6.6 | 173.7 | -69.8 | 124.3 | -6.4 | 0 | 0 | 113.6 | L55 D59 A60 | L55-Q57 PolarHBondContact O-N 3.42Å; L55-Q57 VanDerWaalsContact O-N 3.1Å; Q57-D59 PolarHBondContact O-N 3.38Å; Q57-D59 VanDerWaalsContact O-N 3.15Å; Q57-A60 PolarHBondContact O-N 3.31Å |
| 58 | A | 61.7 | Low | 70.5 | Confident | 31 Ų | 31 | 98.4 Ų | 98.4 | 26% | 0.256 | 55% | 0.549 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -28.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L55 A60 | L55-A58 WeakPolarHBondContact O-CB 3.38Å; L55-A58 PolarHBondContact O-N 3.27Å; A58-A60 VanDerWaalsContact C-N 3.31Å; A58-A60 PolarHBondContact O-N 2.88Å |
| 59 | D | 65.3 | Low | 71.6 | Confident | 162 Ų | 162 | 98.2 Ų | 98.2 | 87% | 0.866 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.9 | -24 | -177.4 | -56.6 | -34.9 | 0 | 0 | 0 | 113.4 | Q57 | Q57-D59 PolarHBondContact O-N 3.38Å; Q57-D59 VanDerWaalsContact O-N 3.15Å |
| 60 | A | 71.4 | Confident | 72.9 | Confident | 94 Ų | 94 | 97.9 Ų | 97.9 | 78% | 0.777 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.9 | -39.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q57 A58 | Q57-A60 PolarHBondContact O-N 3.31Å; A58-A60 VanDerWaalsContact C-N 3.31Å; A58-A60 PolarHBondContact O-N 2.88Å |
| 61 | N | 79.3 | Confident | 74.2 | Confident | 59 Ų | 59 | 97.5 Ų | 97.5 | 32% | 0.316 | 54% | 0.542 | S | S | . | . | trans | -154.7 | 94.1 | 176.3 | -163.1 | -25.7 | 0 | 0 | 0 | 111.3 | W63 Q64 A65 | N61-W63 VanDerWaalsContact C-N 3.3Å; N61-W63 PolarHBondContact O-N 2.97Å; N61-Q64 HydrophobicContact CB-CB 4.15Å; N61-Q64 HydrophobicContact CB-CG 4.35Å; N61-Q64 PolarHBondContact ND2-NE2 2.93Å; N61-Q64 PolarHBondContact ND2-OE1 2.93Å; N61-Q64 PolarHBondContact O-N 3.45Å; N61-A65 PolarHBondContact O-N 3.3Å; N61-A65 VanDerWaalsContact O-N 3.11Å | ||
| 62 | P | 82 | Confident | 75.3 | Confident | 83 Ų | 83 | 100 Ų | 100 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.2 | -32.6 | -171.2 | 24.6 | -34.3 | 0 | 0 | 0 | 113 | A66 | P62-A66 WeakPolarHBondContact O-CB 3.03Å; P62-A66 PolarHBondContact O-N 3.44Å |
| 63 | W | 85.1 | Confident | 76.5 | Confident | 205 Ų | 205 | 96 Ų | 96 | 78% | 0.777 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -70.1 | -40.2 | 179.8 | -73.6 | 107.4 | 0 | 0 | 0 | 112.3 | N61 A66 L67 | N61-W63 VanDerWaalsContact C-N 3.3Å; N61-W63 PolarHBondContact O-N 2.97Å; W63-A66 PolarHBondContact O-N 3.34Å; W63-L67 WeakPolarHBondContact O-CG 3.27Å; W63-L67 PolarHBondContact O-N 3.25Å |
| 64 | Q | 82.2 | Confident | 77.8 | Confident | 115 Ų | 115 | 98.2 Ų | 98.2 | 54% | 0.537 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.5 | -45.8 | 176 | -72 | 177.6 | -14.4 | 0 | 0 | 110.8 | N61 A66 L67 D68 | N61-Q64 HydrophobicContact CB-CB 4.15Å; N61-Q64 HydrophobicContact CB-CG 4.35Å; N61-Q64 PolarHBondContact ND2-NE2 2.93Å; N61-Q64 PolarHBondContact ND2-OE1 2.93Å; N61-Q64 PolarHBondContact O-N 3.45Å; Q64-A66 VanDerWaalsContact C-N 3.26Å; Q64-A66 PolarHBondContact O-N 3.34Å; Q64-L67 PolarHBondContact O-N 2.99Å; Q64-L67 VanDerWaalsContact O-N 3.11Å; Q64-D68 WeakPolarHBondContact O-CB 3.28Å; Q64-D68 VanDerWaalsContact O-CG 3.28Å; Q64-D68 PolarHBondContact O-N 2.99Å |
| 65 | A | 82.2 | Confident | 78.9 | Confident | 17 Ų | 17 | 99.5 Ų | 99.5 | 14% | 0.14 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -58.1 | -38.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | N61 Y69 | N61-A65 PolarHBondContact O-N 3.3Å; N61-A65 VanDerWaalsContact O-N 3.11Å; A65-Y69 VanDerWaalsContact O-CB 3.29Å; A65-Y69 WeakPolarHBondContact O-CB 3.36Å; A65-Y69 PolarHBondContact O-N 2.82Å |
| 66 | A | 85.8 | Confident | 80 | Confident | 53 Ų | 53 | 96.9 Ų | 96.9 | 44% | 0.438 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.1 | -43.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | P62 W63 Q64 A70 | P62-A66 WeakPolarHBondContact O-CB 3.03Å; P62-A66 PolarHBondContact O-N 3.44Å; W63-A66 PolarHBondContact O-N 3.34Å; Q64-A66 VanDerWaalsContact C-N 3.26Å; Q64-A66 PolarHBondContact O-N 3.34Å; A66-A70 VanDerWaalsContact O-CB 3.29Å; A66-A70 WeakPolarHBondContact O-CB 3.48Å; A66-A70 PolarHBondContact O-N 2.89Å |
| 67 | L | 87.7 | Confident | 81.3 | Confident | 119 Ų | 119 | 95 Ų | 95 | 62% | 0.623 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -66.9 | -40.4 | 176.9 | -72.3 | 174.1 | 0 | 0 | 0 | 112 | W63 Q64 A70 M71 | W63-L67 WeakPolarHBondContact O-CG 3.27Å; W63-L67 PolarHBondContact O-N 3.25Å; Q64-L67 PolarHBondContact O-N 2.99Å; Q64-L67 VanDerWaalsContact O-N 3.11Å; L67-A70 PolarHBondContact O-N 2.91Å; L67-M71 WeakPolarHBondContact O-CB 3.42Å; L67-M71 PolarHBondContact O-N 2.79Å |
| 68 | D | 84.7 | Confident | 82.7 | Confident | 94 Ų | 94 | 93.9 Ų | 93.9 | 50% | 0.503 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.4 | -45.4 | 176.2 | -70.2 | -28.7 | 0 | 0 | 0 | 110.9 | Q64 M71 I72 | Q64-D68 WeakPolarHBondContact O-CB 3.28Å; Q64-D68 VanDerWaalsContact O-CG 3.28Å; Q64-D68 PolarHBondContact O-N 2.99Å; D68-M71 PolarHBondContact O-N 3.36Å; D68-I72 WeakPolarHBondContact O-CB 3.44Å; D68-I72 WeakPolarHBondContact O-CD1 3.43Å; D68-I72 VanDerWaalsContact O-CG1 3.23Å; D68-I72 WeakPolarHBondContact O-CG1 3.4Å; D68-I72 PolarHBondContact O-N 2.99Å |
| 69 | Y | 86.4 | Confident | 83.9 | Confident | 125 Ų | 125 | 97 Ų | 97 | 49% | 0.49 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.6 | -47.6 | 173.8 | 178.8 | -95.9 | 0 | 0 | 0 | 111.5 | A65 M71 I72 Y73 | A65-Y69 VanDerWaalsContact O-CB 3.29Å; A65-Y69 WeakPolarHBondContact O-CB 3.36Å; A65-Y69 PolarHBondContact O-N 2.82Å; Y69-M71 VanDerWaalsContact C-N 3.35Å; Y69-M71 PolarHBondContact O-N 2.85Å; Y69-I72 PolarHBondContact O-N 2.89Å; Y69-Y73 VanDerWaalsContact O-CB 3.23Å; Y69-Y73 WeakPolarHBondContact O-CB 3.37Å; Y69-Y73 PolarHBondContact O-N 3.19Å |
| 70 | A | 89.1 | Confident | 85 | Confident | 51 Ų | 51 | 89.5 Ų | 89.5 | 42% | 0.421 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | A66 L67 F74 | A66-A70 VanDerWaalsContact O-CB 3.29Å; A66-A70 WeakPolarHBondContact O-CB 3.48Å; A66-A70 PolarHBondContact O-N 2.89Å; L67-A70 PolarHBondContact O-N 2.91Å; A70-F74 WeakPolarHBondContact O-CB 3.48Å; A70-F74 PolarHBondContact O-N 3.18Å |
| 71 | M | 89 | Confident | 85.8 | Confident | 112 Ų | 112 | 86.7 Ų | 86.7 | 55% | 0.552 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.6 | -48 | 178.2 | -174.7 | 64.8 | 73.5 | 0 | 0 | 111.6 | L67 D68 Y69 Y73 F74 L75 | L67-M71 WeakPolarHBondContact O-CB 3.42Å; L67-M71 PolarHBondContact O-N 2.79Å; D68-M71 PolarHBondContact O-N 3.36Å; Y69-M71 VanDerWaalsContact C-N 3.35Å; Y69-M71 PolarHBondContact O-N 2.85Å; M71-Y73 VanDerWaalsContact C-N 3.33Å; M71-Y73 PolarHBondContact O-N 3.38Å; M71-F74 PolarHBondContact O-N 2.94Å; M71-L75 HydrophobicContact CG-CD1 4.06Å; M71-L75 HydrophobicContact CG-CG 4.47Å; M71-L75 VanDerWaalsContact O-CB 3.32Å; M71-L75 WeakPolarHBondContact O-CB 3.42Å; M71-L75 VanDerWaalsContact O-CG 3.28Å; M71-L75 WeakPolarHBondContact O-CG 3.18Å; M71-L75 PolarHBondContact O-N 3.03Å; M71-L75 HydrophobicContact SD-CD1 4.33Å; M71-L75 HydrophobicContact SD-CG 4.32Å |
| 72 | I | 85.7 | Confident | 86.4 | Confident | 96 Ų | 96 | 87.6 Ų | 87.6 | 49% | 0.492 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61 | -45.4 | 177.9 | -68.6 | 166 | 0 | 0 | 0 | 110.2 | I54 D68 Y69 L75 A76 | I54-I72 HydrophobicContact CD1-CD1 4.42Å; I54-I72 HydrophobicContact CG1-CD1 4.48Å; D68-I72 WeakPolarHBondContact O-CB 3.44Å; D68-I72 WeakPolarHBondContact O-CD1 3.43Å; D68-I72 VanDerWaalsContact O-CG1 3.23Å; D68-I72 WeakPolarHBondContact O-CG1 3.4Å; D68-I72 PolarHBondContact O-N 2.99Å; Y69-I72 PolarHBondContact O-N 2.89Å; I72-L75 PolarHBondContact O-N 3.23Å; I72-A76 WeakPolarHBondContact O-CB 3.41Å; I72-A76 PolarHBondContact O-N 3.47Å |
| 73 | Y | 85.9 | Confident | 86.7 | Confident | 120 Ų | 120 | 84.5 Ų | 84.5 | 47% | 0.471 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.4 | -44.2 | 178.6 | -168.6 | -103.1 | 0 | 0 | 0 | 111.5 | Y69 M71 A76 V77 | Y69-Y73 VanDerWaalsContact O-CB 3.23Å; Y69-Y73 WeakPolarHBondContact O-CB 3.37Å; Y69-Y73 PolarHBondContact O-N 3.19Å; M71-Y73 VanDerWaalsContact C-N 3.33Å; M71-Y73 PolarHBondContact O-N 3.38Å; Y73-A76 PolarHBondContact O-N 2.88Å; Y73-V77 HydrophobicContact CD1-CG2 3.96Å; Y73-V77 HydrophobicContact CD2-CG2 4.38Å; Y73-V77 HydrophobicContact CE1-CG2 3.62Å; Y73-V77 HydrophobicContact CE2-CG2 4.07Å; Y73-V77 HydrophobicContact CG-CG2 4.33Å; Y73-V77 WeakPolarHBondContact O-CB 3.44Å; Y73-V77 VanDerWaalsContact O-CG2 3.29Å; Y73-V77 WeakPolarHBondContact O-CG2 3.35Å; Y73-V77 PolarHBondContact O-N 3.24Å |
| 74 | F | 90.1 | Very high | 86.9 | Confident | 131 Ų | 131 | 74.8 Ų | 74.8 | 58% | 0.575 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -59.3 | -49.7 | 176.3 | 179.4 | -100.3 | 0 | 0 | 0 | 111.2 | A70 M71 A76 V77 W78 | A70-F74 WeakPolarHBondContact O-CB 3.48Å; A70-F74 PolarHBondContact O-N 3.18Å; M71-F74 PolarHBondContact O-N 2.94Å; F74-A76 PolarHBondContact O-N 3.46Å; F74-V77 PolarHBondContact O-N 2.88Å; F74-V77 VanDerWaalsContact O-N 3.07Å; F74-W78 HydrophobicContact CE1-CB 4.48Å; F74-W78 HydrophobicContact CZ-CB 4.31Å; F74-W78 PolarHBondContact O-N 3.09Å |
| 75 | L | 85.6 | Confident | 87.3 | Confident | 96 Ų | 96 | 73.6 Ų | 73.6 | 50% | 0.503 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.1 | -29 | 177.8 | -74.7 | 176.2 | 0 | 0 | 0 | 113.2 | M71 I72 W78 | M71-L75 HydrophobicContact CG-CD1 4.06Å; M71-L75 HydrophobicContact CG-CG 4.47Å; M71-L75 VanDerWaalsContact O-CB 3.32Å; M71-L75 WeakPolarHBondContact O-CB 3.42Å; M71-L75 VanDerWaalsContact O-CG 3.28Å; M71-L75 WeakPolarHBondContact O-CG 3.18Å; M71-L75 PolarHBondContact O-N 3.03Å; M71-L75 HydrophobicContact SD-CD1 4.33Å; M71-L75 HydrophobicContact SD-CG 4.32Å; I72-L75 PolarHBondContact O-N 3.23Å; L75-W78 VanDerWaalsContact C-CD1 3.42Å; L75-W78 VanDerWaalsContact CA-CD1 3.42Å; L75-W78 PolarHBondContact O-NE1 2.77Å |
| 76 | A | 82.6 | Confident | 87.7 | Confident | 65 Ų | 65 | 76.3 Ų | 76.3 | 54% | 0.537 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -78.8 | -39.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | I72 Y73 F74 | I72-A76 WeakPolarHBondContact O-CB 3.41Å; I72-A76 PolarHBondContact O-N 3.47Å; Y73-A76 PolarHBondContact O-N 2.88Å; F74-A76 PolarHBondContact O-N 3.46Å |
| 77 | V | 87 | Confident | 87.9 | Confident | 32 Ų | 32 | 74.3 Ų | 74.3 | 19% | 0.194 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -84.3 | -35.2 | -171.3 | 173.6 | 0 | 0 | 0 | 0 | 113.2 | Y73 F74 K79 A80 A81 | Y73-V77 HydrophobicContact CD1-CG2 3.96Å; Y73-V77 HydrophobicContact CD2-CG2 4.38Å; Y73-V77 HydrophobicContact CE1-CG2 3.62Å; Y73-V77 HydrophobicContact CE2-CG2 4.07Å; Y73-V77 HydrophobicContact CG-CG2 4.33Å; Y73-V77 WeakPolarHBondContact O-CB 3.44Å; Y73-V77 VanDerWaalsContact O-CG2 3.29Å; Y73-V77 WeakPolarHBondContact O-CG2 3.35Å; Y73-V77 PolarHBondContact O-N 3.24Å; F74-V77 PolarHBondContact O-N 2.88Å; F74-V77 VanDerWaalsContact O-N 3.07Å; V77-K79 VanDerWaalsContact C-N 3.31Å; V77-K79 PolarHBondContact O-N 3Å; V77-A80 CarbonylContact O-C 3.4Å; V77-A80 WeakPolarHBondContact O-CA 3.16Å; V77-A80 WeakPolarHBondContact O-CB 3.26Å; V77-A80 PolarHBondContact O-N 3.22Å; V77-A81 PolarHBondContact O-N 2.88Å |
| 78 | W | 88.8 | Confident | 88 | Confident | 112 Ų | 112 | 68.7 Ų | 68.7 | 42% | 0.424 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -58 | -40.6 | -172.5 | 75.7 | -80.2 | 0 | 0 | 0 | 113.1 | F74 L75 A80 A81 V82 | F74-W78 HydrophobicContact CE1-CB 4.48Å; F74-W78 HydrophobicContact CZ-CB 4.31Å; F74-W78 PolarHBondContact O-N 3.09Å; L75-W78 VanDerWaalsContact C-CD1 3.42Å; L75-W78 VanDerWaalsContact CA-CD1 3.42Å; L75-W78 PolarHBondContact O-NE1 2.77Å; W78-A80 VanDerWaalsContact C-N 3.31Å; W78-A80 PolarHBondContact O-N 3.47Å; W78-A81 PolarHBondContact O-N 3.33Å; W78-V82 HydrophobicContact CE3-CG2 4.4Å; W78-V82 WeakPolarHBondContact O-CG2 3.5Å; W78-V82 PolarHBondContact O-N 2.9Å |
| 79 | K | 87 | Confident | 88.1 | Confident | 96 Ų | 96 | 67 Ų | 67 | 42% | 0.417 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 176.1 | -61.7 | -176.8 | -177.9 | 178.2 | 0 | 111.4 | V32 V77 L83 | V32-K79 HydrophobicContact CG1-CB 4.17Å; V32-K79 HydrophobicContact CG2-CB 4.47Å; V77-K79 VanDerWaalsContact C-N 3.31Å; V77-K79 PolarHBondContact O-N 3Å; K79-L83 PolarHBondContact O-N 3.44Å; K79-L83 VanDerWaalsContact O-N 3.12Å |
| 80 | A | 87.1 | Confident | 88.2 | Confident | 4 Ų | 4 | 62.7 Ų | 62.7 | 3% | 0.033 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -70 | -35.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V32 V77 W78 L83 G84 C128 | V32-A80 HydrophobicContact CG1-CB 3.89Å; V77-A80 CarbonylContact O-C 3.4Å; V77-A80 WeakPolarHBondContact O-CA 3.16Å; V77-A80 WeakPolarHBondContact O-CB 3.26Å; V77-A80 PolarHBondContact O-N 3.22Å; W78-A80 VanDerWaalsContact C-N 3.31Å; W78-A80 PolarHBondContact O-N 3.47Å; A80-L83 PolarHBondContact O-N 3.26Å; A80-G84 PolarHBondContact O-N 3.49Å; A80-C128 PolarHBondContact O-SG 3.43Å; A80-C128 VanDerWaalsContact O-SG 3.35Å |
| 81 | A | 88.7 | Confident | 88.1 | Confident | 35 Ų | 35 | 60.5 Ų | 60.5 | 29% | 0.289 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.4 | -47 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | V77 W78 L83 G84 V85 C128 | V77-A81 PolarHBondContact O-N 2.88Å; W78-A81 PolarHBondContact O-N 3.33Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 3.15Å; A81-G84 PolarHBondContact O-N 3.02Å; A81-G84 VanDerWaalsContact O-N 3.15Å; A81-V85 WeakPolarHBondContact O-CG2 3.47Å; A81-V85 PolarHBondContact O-N 2.93Å; A81-C128 WeakPolarHBondContact CA-SG 3.38Å; A81-C128 PolarHBondContact N-SG 3.29Å; A81-C128 VanDerWaalsContact N-SG 3.4Å |
| 82 | V | 91.1 | Very high | 87.8 | Confident | 78 Ų | 78 | 58 Ų | 58 | 47% | 0.473 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -57.7 | -47.6 | 173.9 | 172.1 | 0 | 0 | 0 | 0 | 110.4 | W78 G84 V85 I86 | W78-V82 HydrophobicContact CE3-CG2 4.4Å; W78-V82 WeakPolarHBondContact O-CG2 3.5Å; W78-V82 PolarHBondContact O-N 2.9Å; V82-G84 VanDerWaalsContact C-N 3.34Å; V82-G84 PolarHBondContact O-N 2.82Å; V82-V85 PolarHBondContact O-N 3.34Å; V82-I86 HydrophobicContact CG1-CD1 3.74Å; V82-I86 HydrophobicContact CG1-CG1 4.45Å; V82-I86 VanDerWaalsContact O-CG1 3.29Å; V82-I86 WeakPolarHBondContact O-CG1 3.32Å; V82-I86 PolarHBondContact O-N 3.19Å |
| 83 | L | 89.2 | Confident | 87.7 | Confident | 18 Ų | 18 | 58.6 Ų | 58.6 | 9% | 0.094 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -58.7 | -44.5 | 175.2 | -179.1 | 64.4 | 0 | 0 | 0 | 111.7 | G28 L29 V32 K79 A80 A81 V85 I86 L87 M124 | G28-L83 VanDerWaalsContact C-CD2 3.44Å; L29-L83 HydrophobicContact CD2-CD2 4.43Å; V32-L83 HydrophobicContact CG2-CD2 4.29Å; K79-L83 PolarHBondContact O-N 3.44Å; K79-L83 VanDerWaalsContact O-N 3.12Å; A80-L83 PolarHBondContact O-N 3.26Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 3.15Å; L83-V85 PolarHBondContact O-N 3.05Å; L83-I86 PolarHBondContact O-N 3.49Å; L83-L87 HydrophobicContact CD1-CD1 4.2Å; L83-L87 HydrophobicContact CD1-CD2 4.41Å; L83-L87 HydrophobicContact CD1-CG 4.03Å; L83-L87 HydrophobicContact CG-CD1 3.97Å; L83-L87 HydrophobicContact CG-CG 4.19Å; L83-L87 WeakPolarHBondContact O-CB 3.31Å; L83-L87 VanDerWaalsContact O-CG 3.24Å; L83-L87 WeakPolarHBondContact O-CG 3.4Å; L83-L87 PolarHBondContact O-N 2.85Å; L83-M124 HydrophobicContact CD2-CE 4.31Å |
| 84 | G | 89.6 | Confident | 87.5 | Confident | 1 Ų | 1 | 54.1 Ų | 54.1 | 1% | 0.01 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | A80 A81 V82 L87 G88 V132 | A80-G84 PolarHBondContact O-N 3.49Å; A81-G84 PolarHBondContact O-N 3.02Å; A81-G84 VanDerWaalsContact O-N 3.15Å; V82-G84 VanDerWaalsContact C-N 3.34Å; V82-G84 PolarHBondContact O-N 2.82Å; G84-L87 PolarHBondContact O-N 3.46Å; G84-G88 PolarHBondContact O-N 3.46Å; G84-V132 WeakPolarHBondContact O-CG2 3.43Å |
| 85 | V | 90.5 | Very high | 87 | Confident | 91 Ų | 91 | 48.3 Ų | 48.3 | 55% | 0.552 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -65.6 | -46.1 | 175.4 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | A81 V82 L83 L87 G88 S89 P131 | A81-V85 WeakPolarHBondContact O-CG2 3.47Å; A81-V85 PolarHBondContact O-N 2.93Å; V82-V85 PolarHBondContact O-N 3.34Å; L83-V85 PolarHBondContact O-N 3.05Å; V85-L87 PolarHBondContact O-N 3.47Å; V85-G88 PolarHBondContact O-N 2.86Å; V85-S89 PolarHBondContact O-N 3.44Å; V85-P131 HydrophobicContact CG2-CG 4.33Å |
| 86 | I | 91.1 | Very high | 86.7 | Confident | 73 Ų | 73 | 45.7 Ų | 45.7 | 37% | 0.374 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60.1 | -46.1 | 176.1 | -69 | 170.3 | 0 | 0 | 0 | 110.4 | V82 L83 G88 S89 L90 | V82-I86 HydrophobicContact CG1-CD1 3.74Å; V82-I86 HydrophobicContact CG1-CG1 4.45Å; V82-I86 VanDerWaalsContact O-CG1 3.29Å; V82-I86 WeakPolarHBondContact O-CG1 3.32Å; V82-I86 PolarHBondContact O-N 3.19Å; L83-I86 PolarHBondContact O-N 3.49Å; I86-G88 VanDerWaalsContact C-N 3.34Å; I86-G88 PolarHBondContact O-N 2.93Å; I86-S89 PolarHBondContact O-N 3.36Å; I86-S89 PolarHBondContact O-OG 2.92Å; I86-L90 HydrophobicContact CG2-CD1 3.8Å; I86-L90 HydrophobicContact CG2-CD2 4.36Å; I86-L90 WeakPolarHBondContact O-CB 3.26Å; I86-L90 WeakPolarHBondContact O-CD1 3.37Å; I86-L90 PolarHBondContact O-N 3.01Å |
| 87 | L | 90 | Very high | 86.4 | Confident | 11 Ų | 11 | 47.6 Ų | 47.6 | 6% | 0.058 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.6 | -40.4 | 178.1 | -70.1 | -178.6 | 0 | 0 | 0 | 111.5 | F21 V24 V25 L83 G84 V85 S89 L90 I91 V132 | F21-L87 HydrophobicContact CE2-CD2 4.07Å; V24-L87 HydrophobicContact CG1-CD2 4.1Å; V25-L87 HydrophobicContact CB-CD2 4.39Å; V25-L87 HydrophobicContact CG2-CD1 4.11Å; V25-L87 HydrophobicContact CG2-CD2 3.42Å; V25-L87 VanDerWaalsContact CG2-CD2 3.42Å; V25-L87 HydrophobicContact CG2-CG 4.37Å; L83-L87 HydrophobicContact CD1-CD1 4.2Å; L83-L87 HydrophobicContact CD1-CD2 4.41Å; L83-L87 HydrophobicContact CD1-CG 4.03Å; L83-L87 HydrophobicContact CG-CD1 3.97Å; L83-L87 HydrophobicContact CG-CG 4.19Å; L83-L87 WeakPolarHBondContact O-CB 3.31Å; L83-L87 VanDerWaalsContact O-CG 3.24Å; L83-L87 WeakPolarHBondContact O-CG 3.4Å; L83-L87 PolarHBondContact O-N 2.85Å; G84-L87 PolarHBondContact O-N 3.46Å; V85-L87 PolarHBondContact O-N 3.47Å; L87-S89 VanDerWaalsContact C-N 3.32Å; L87-S89 PolarHBondContact O-N 2.81Å; L87-L90 PolarHBondContact O-N 3.39Å; L87-I91 VanDerWaalsContact O-CG1 3.29Å; L87-I91 WeakPolarHBondContact O-CG1 3Å; L87-I91 PolarHBondContact O-N 2.93Å; L87-V132 HydrophobicContact CB-CG2 3.93Å |
| 88 | G | 88.1 | Confident | 85.9 | Confident | 2 Ų | 2 | 51 Ų | 51 | 2% | 0.021 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.1 | -34.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.9 | G84 V85 I86 Q92 | G84-G88 PolarHBondContact O-N 3.46Å; V85-G88 PolarHBondContact O-N 2.86Å; I86-G88 VanDerWaalsContact C-N 3.34Å; I86-G88 PolarHBondContact O-N 2.93Å; G88-Q92 PolarHBondContact O-NE2 3.43Å |
| 89 | S | 88.5 | Confident | 85.5 | Confident | 57 Ų | 57 | 48 Ų | 48 | 40% | 0.399 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -76.6 | -43.7 | 173.2 | 69.1 | 0 | 0 | 0 | 0 | 111.9 | V85 I86 L87 I91 Q92 V93 | V85-S89 PolarHBondContact O-N 3.44Å; I86-S89 PolarHBondContact O-N 3.36Å; I86-S89 PolarHBondContact O-OG 2.92Å; L87-S89 VanDerWaalsContact C-N 3.32Å; L87-S89 PolarHBondContact O-N 2.81Å; S89-I91 VanDerWaalsContact C-N 3.33Å; S89-I91 PolarHBondContact O-N 3.01Å; S89-Q92 WeakPolarHBondContact O-CB 3.43Å; S89-Q92 PolarHBondContact O-N 3.36Å; S89-V93 PolarHBondContact O-N 3.27Å |
| 90 | L | 88 | Confident | 85 | Confident | 36 Ų | 36 | 43.7 Ų | 43.7 | 19% | 0.188 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.7 | -37.1 | 178.5 | -99.3 | 63.4 | 0 | 0 | 0 | 112.6 | F21 V24 I86 L87 Q92 V93 L94 | F21-L90 HydrophobicContact CD2-CB 4.01Å; F21-L90 HydrophobicContact CE2-CB 4.28Å; V24-L90 HydrophobicContact CB-CD2 4.21Å; V24-L90 HydrophobicContact CG1-CD2 3.91Å; V24-L90 HydrophobicContact CG2-CD2 4.23Å; I86-L90 HydrophobicContact CG2-CD1 3.8Å; I86-L90 HydrophobicContact CG2-CD2 4.36Å; I86-L90 WeakPolarHBondContact O-CB 3.26Å; I86-L90 WeakPolarHBondContact O-CD1 3.37Å; I86-L90 PolarHBondContact O-N 3.01Å; L87-L90 PolarHBondContact O-N 3.39Å; L90-Q92 PolarHBondContact O-N 3.19Å; L90-Q92 VanDerWaalsContact O-N 3.15Å; L90-V93 PolarHBondContact O-N 3.23Å; L90-L94 HydrophobicContact CD2-CD2 4.09Å; L90-L94 HydrophobicContact CG-CD1 4.08Å; L90-L94 HydrophobicContact CG-CD2 4.18Å; L90-L94 WeakPolarHBondContact O-CB 3.48Å; L90-L94 PolarHBondContact O-N 3.03Å |
| 91 | I | 85.9 | Confident | 84.5 | Confident | 5 Ų | 5 | 46.6 Ų | 46.6 | 3% | 0.026 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -53.7 | -35.4 | 173.4 | -77.2 | 178.3 | 0 | 0 | 0 | 110.9 | F21 L87 S89 I95 L100 V132 M136 Q139 | F21-I91 HydrophobicContact CD2-CG1 4.37Å; F21-I91 HydrophobicContact CE1-CG1 4.39Å; F21-I91 HydrophobicContact CE2-CB 4.48Å; F21-I91 HydrophobicContact CE2-CD1 4.32Å; F21-I91 HydrophobicContact CE2-CG1 3.4Å; F21-I91 VanDerWaalsContact CE2-CG1 3.4Å; F21-I91 HydrophobicContact CZ-CD1 3.93Å; F21-I91 HydrophobicContact CZ-CG1 3.4Å; F21-I91 VanDerWaalsContact CZ-CG1 3.4Å; L87-I91 VanDerWaalsContact O-CG1 3.29Å; L87-I91 WeakPolarHBondContact O-CG1 3Å; L87-I91 PolarHBondContact O-N 2.93Å; S89-I91 VanDerWaalsContact C-N 3.33Å; S89-I91 PolarHBondContact O-N 3.01Å; I91-I95 HydrophobicContact CB-CD1 4.39Å; I91-I95 HydrophobicContact CG1-CD1 3.94Å; I91-I95 HydrophobicContact CG2-CD1 4.4Å; I91-L100 HydrophobicContact CG2-CD2 4.48Å; I91-V132 HydrophobicContact CD1-CB 4.5Å; I91-V132 HydrophobicContact CD1-CG1 3.38Å; I91-M136 HydrophobicContact CD1-CG 3.79Å; I91-M136 HydrophobicContact CG2-CG 4.17Å; I91-Q139 HydrophobicContact CG2-CG 4.16Å |
| 92 | Q | 83 | Confident | 83.9 | Confident | 59 Ų | 59 | 52.7 Ų | 52.7 | 28% | 0.276 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -77.3 | -25.5 | -177.5 | -66.3 | 165.9 | 72.7 | 0 | 0 | 113.5 | G88 S89 L90 R138 Q139 | G88-Q92 PolarHBondContact O-NE2 3.43Å; S89-Q92 WeakPolarHBondContact O-CB 3.43Å; S89-Q92 PolarHBondContact O-N 3.36Å; L90-Q92 PolarHBondContact O-N 3.19Å; L90-Q92 VanDerWaalsContact O-N 3.15Å; Q92-R138 HydrophobicContact CG-CB 4.49Å; Q92-Q139 HydrophobicContact CG-CG 4.38Å; Q92-Q139 PolarHBondContact O-NE2 3.17Å |
| 93 | V | 84.3 | Confident | 83.2 | Confident | 109 Ų | 109 | 50.4 Ų | 50.4 | 66% | 0.661 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -103.2 | -44.2 | -172.4 | -177.2 | 0 | 0 | 0 | 0 | 112.3 | S89 L90 | S89-V93 PolarHBondContact O-N 3.27Å; L90-V93 PolarHBondContact O-N 3.23Å |
| 94 | L | 81.8 | Confident | 82.5 | Confident | 26 Ų | 26 | 49.8 Ų | 49.8 | 14% | 0.136 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -89.2 | -32.3 | -172.5 | -85.7 | 61.9 | 0 | 0 | 0 | 112.8 | K17 L20 F21 L90 P96 | K17-L94 WeakPolarHBondContact CB-O 3.39Å; L20-L94 HydrophobicContact CB-CD2 4.06Å; L20-L94 HydrophobicContact CD2-CD2 3.78Å; L20-L94 HydrophobicContact CD2-CG 4.45Å; L20-L94 HydrophobicContact CG-CD2 3.8Å; F21-L94 HydrophobicContact CB-CB 4.11Å; F21-L94 HydrophobicContact CB-CD2 4.01Å; L90-L94 HydrophobicContact CD2-CD2 4.09Å; L90-L94 HydrophobicContact CG-CD1 4.08Å; L90-L94 HydrophobicContact CG-CD2 4.18Å; L90-L94 WeakPolarHBondContact O-CB 3.48Å; L90-L94 PolarHBondContact O-N 3.03Å; L94-P96 WeakPolarHBondContact O-CD 3.33Å |
| 95 | I | 80.1 | Confident | 81.4 | Confident | 8 Ų | 8 | 51.3 Ų | 51.3 | 4% | 0.041 | 27% | 0.27 | C | S | . | . | S | Bend | trans | -90.3 | 118.6 | -174.6 | -52.5 | -176.2 | 0 | 0 | 0 | 110 | F21 I91 R97 W99 L100 | F21-I95 HydrophobicContact CB-CG1 4.31Å; F21-I95 HydrophobicContact CD1-CD1 3.61Å; F21-I95 HydrophobicContact CD1-CG1 4.09Å; F21-I95 HydrophobicContact CD2-CD1 4.26Å; F21-I95 HydrophobicContact CD2-CG1 4.35Å; F21-I95 HydrophobicContact CE1-CD1 3.64Å; F21-I95 HydrophobicContact CE2-CD1 4.3Å; F21-I95 HydrophobicContact CG-CD1 3.93Å; F21-I95 HydrophobicContact CG-CG1 3.96Å; F21-I95 HydrophobicContact CZ-CD1 3.99Å; I91-I95 HydrophobicContact CB-CD1 4.39Å; I91-I95 HydrophobicContact CG1-CD1 3.94Å; I91-I95 HydrophobicContact CG2-CD1 4.4Å; I95-R97 PolarHBondContact O-N 3.26Å; I95-W99 HydrophobicContact CG2-CE3 3.76Å; I95-W99 HydrophobicContact CG2-CZ3 4.33Å; I95-L100 HydrophobicContact CG2-CB 3.95Å; I95-L100 HydrophobicContact CG2-CD1 4.22Å |
| 96 | P | 78.6 | Confident | 80.4 | Confident | 42 Ų | 42 | 50.7 Ų | 50.7 | 27% | 0.273 | 26% | 0.261 | S | S | . | . | trans | -65.2 | 133.3 | 174.5 | 24.3 | -29.5 | 0 | 0 | 0 | 110.5 | L94 D98 W99 L100 | L94-P96 WeakPolarHBondContact O-CD 3.33Å; P96-D98 PolarHBondContact O-N 3.38Å; P96-D98 VanDerWaalsContact O-N 3.16Å; P96-W99 HydrophobicContact CG-CB 3.86Å; P96-W99 PolarHBondContact O-N 2.83Å; P96-L100 PolarHBondContact O-N 2.9Å | ||
| 97 | R | 76.5 | Confident | 79.2 | Confident | 105 Ų | 105 | 50.6 Ų | 50.6 | 40% | 0.396 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -47.7 | -44.4 | 179.5 | -77.4 | 175.9 | -176.6 | -179.8 | 4.3 | 112.4 | I95 W99 L100 L101 Q139 | I95-R97 PolarHBondContact O-N 3.26Å; R97-W99 VanDerWaalsContact C-N 3.33Å; R97-W99 PolarHBondContact O-N 2.86Å; R97-L100 PolarHBondContact O-N 2.79Å; R97-L101 VanDerWaalsContact O-CB 3.32Å; R97-L101 WeakPolarHBondContact O-CB 3.4Å; R97-L101 WeakPolarHBondContact O-CG 3.21Å; R97-L101 PolarHBondContact O-N 3.06Å; R97-Q139 VanDerWaalsContact NE-OE1 3.15Å |
| 98 | D | 76.8 | Confident | 78.4 | Confident | 104 Ų | 104 | 56.6 Ų | 56.6 | 56% | 0.556 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -63.1 | -38.1 | -177.4 | -58.3 | -58 | 0 | 0 | 0 | 112.7 | P96 R102 | P96-D98 PolarHBondContact O-N 3.38Å; P96-D98 VanDerWaalsContact O-N 3.16Å; D98-R102 WeakPolarHBondContact O-CB 3.17Å; D98-R102 WeakPolarHBondContact O-CD 3.35Å; D98-R102 WeakPolarHBondContact O-CG 3.26Å; D98-R102 PolarHBondContact O-N 3.36Å |
| 99 | W | 79.9 | Confident | 78.2 | Confident | 48 Ų | 48 | 61.7 Ų | 61.7 | 18% | 0.182 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -69.6 | -42.4 | 178.1 | -174.5 | 91 | 0 | 0 | 0 | 111.1 | F22 I95 P96 R97 R102 T103 | F22-W99 AromaticContact CE2-CH2 3.69Å; F22-W99 HydrophobicContact CE2-CH2 3.69Å; F22-W99 HydrophobicContact CE2-CZ2 4.18Å; F22-W99 HydrophobicContact CE2-CZ3 4.29Å; F22-W99 AromaticContact CZ-CH2 3.67Å; F22-W99 HydrophobicContact CZ-CH2 3.67Å; F22-W99 HydrophobicContact CZ-CZ2 4.47Å; F22-W99 HydrophobicContact CZ-CZ3 4.28Å; I95-W99 HydrophobicContact CG2-CE3 3.76Å; I95-W99 HydrophobicContact CG2-CZ3 4.33Å; P96-W99 HydrophobicContact CG-CB 3.86Å; P96-W99 PolarHBondContact O-N 2.83Å; R97-W99 VanDerWaalsContact C-N 3.33Å; R97-W99 PolarHBondContact O-N 2.86Å; W99-R102 PolarHBondContact O-N 3.13Å; W99-T103 HydrophobicContact CD2-CG2 4.24Å; W99-T103 HydrophobicContact CE3-CG2 4.45Å; W99-T103 HydrophobicContact CH2-CG2 4.17Å; W99-T103 HydrophobicContact CZ2-CG2 3.96Å; W99-T103 HydrophobicContact CZ3-CG2 4.42Å; W99-T103 WeakPolarHBondContact O-CG2 3.32Å; W99-T103 PolarHBondContact O-N 2.85Å; W99-T103 PolarHBondContact O-OG1 3.34Å |
| 100 | L | 76.1 | Confident | 78.1 | Confident | 6 Ų | 6 | 66.5 Ų | 66.5 | 3% | 0.031 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -69.2 | -37.5 | 179.7 | -162.6 | 69.9 | 0 | 0 | 0 | 111.9 | I91 I95 P96 R97 T103 L104 G105 Q139 V141 | I91-L100 HydrophobicContact CG2-CD2 4.48Å; I95-L100 HydrophobicContact CG2-CB 3.95Å; I95-L100 HydrophobicContact CG2-CD1 4.22Å; P96-L100 PolarHBondContact O-N 2.9Å; R97-L100 PolarHBondContact O-N 2.79Å; L100-T103 WeakPolarHBondContact CA-OG1 3.26Å; L100-T103 PolarHBondContact O-N 2.87Å; L100-T103 PolarHBondContact O-OG1 3.11Å; L100-L104 HydrophobicContact CD1-CD1 3.85Å; L100-L104 HydrophobicContact CD1-CD2 4.45Å; L100-L104 PolarHBondContact O-N 2.9Å; L100-G105 PolarHBondContact O-N 2.8Å; L100-Q139 HydrophobicContact CD2-CB 3.37Å; L100-Q139 HydrophobicContact CD2-CG 4.22Å; L100-V141 HydrophobicContact CD1-CG2 4.1Å; L100-V141 HydrophobicContact CD2-CG2 3.32Å; L100-V141 HydrophobicContact CG-CG2 3.44Å; L100-V141 VanDerWaalsContact CG-CG2 3.44Å |
| 101 | L | 75.8 | Confident | 78.1 | Confident | 65 Ų | 65 | 64.8 Ų | 64.8 | 34% | 0.34 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -66.7 | -41.7 | 172 | -76.9 | 175 | 0 | 0 | 0 | 111.9 | R97 T103 G105 Q106 Q140 | R97-L101 VanDerWaalsContact O-CB 3.32Å; R97-L101 WeakPolarHBondContact O-CB 3.4Å; R97-L101 WeakPolarHBondContact O-CG 3.21Å; R97-L101 PolarHBondContact O-N 3.06Å; L101-T103 PolarHBondContact O-N 3.37Å; L101-G105 CarbonylContact O-C 3.41Å; L101-G105 VanDerWaalsContact O-C 3.27Å; L101-G105 WeakPolarHBondContact O-CA 3.39Å; L101-G105 PolarHBondContact O-N 3.27Å; L101-Q106 PolarHBondContact O-N 2.92Å; L101-Q140 HydrophobicContact CD2-CB 3.68Å; L101-Q140 VanDerWaalsContact CD2-O 3.28Å; L101-Q140 WeakPolarHBondContact CD2-O 3.33Å; L101-Q140 HydrophobicContact CG-CB 4.39Å |
| 102 | R | 77.1 | Confident | 78.3 | Confident | 163 Ų | 163 | 64.6 Ų | 64.6 | 62% | 0.615 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -65.6 | -27.4 | 176.6 | -77.7 | 170.7 | -176.1 | -161.9 | 2.1 | 113 | D98 W99 Q106 | D98-R102 WeakPolarHBondContact O-CB 3.17Å; D98-R102 WeakPolarHBondContact O-CD 3.35Å; D98-R102 WeakPolarHBondContact O-CG 3.26Å; D98-R102 PolarHBondContact O-N 3.36Å; W99-R102 PolarHBondContact O-N 3.13Å; R102-Q106 WeakPolarHBondContact O-CG 3.43Å; R102-Q106 PolarHBondContact O-NE2 3.08Å |
| 103 | T | 76.4 | Confident | 78.7 | Confident | 30 Ų | 30 | 65.3 Ų | 65.3 | 18% | 0.184 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -93.9 | -69.4 | 178.4 | 51 | 0 | 0 | 0 | 0 | 110.4 | W99 L100 L101 L114 | W99-T103 HydrophobicContact CD2-CG2 4.24Å; W99-T103 HydrophobicContact CE3-CG2 4.45Å; W99-T103 HydrophobicContact CH2-CG2 4.17Å; W99-T103 HydrophobicContact CZ2-CG2 3.96Å; W99-T103 HydrophobicContact CZ3-CG2 4.42Å; W99-T103 WeakPolarHBondContact O-CG2 3.32Å; W99-T103 PolarHBondContact O-N 2.85Å; W99-T103 PolarHBondContact O-OG1 3.34Å; L100-T103 WeakPolarHBondContact CA-OG1 3.26Å; L100-T103 PolarHBondContact O-N 2.87Å; L100-T103 PolarHBondContact O-OG1 3.11Å; L101-T103 PolarHBondContact O-N 3.37Å; T103-L114 WeakPolarHBondContact O-CD1 3.31Å |
| 104 | L | 75.4 | Confident | 79.1 | Confident | 4 Ų | 4 | 62.7 Ų | 62.7 | 2% | 0.021 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -91 | -10.8 | -173.8 | -69.4 | 74.9 | 0 | 0 | 0 | 114.9 | L100 G111 F118 M136 V141 S142 | L100-L104 HydrophobicContact CD1-CD1 3.85Å; L100-L104 HydrophobicContact CD1-CD2 4.45Å; L100-L104 PolarHBondContact O-N 2.9Å; L104-G111 WeakPolarHBondContact O-CA 3.34Å; L104-F118 HydrophobicContact CD1-CD2 3.81Å; L104-F118 HydrophobicContact CD1-CE2 3.42Å; L104-F118 VanDerWaalsContact CD1-CE2 3.42Å; L104-F118 HydrophobicContact CD1-CZ 4.29Å; L104-F118 HydrophobicContact CD2-CD2 4.24Å; L104-F118 HydrophobicContact CG-CD2 4.14Å; L104-F118 HydrophobicContact CG-CE2 4.15Å; L104-M136 HydrophobicContact CD2-SD 3.78Å; L104-V141 HydrophobicContact CB-CB 4.38Å; L104-V141 HydrophobicContact CB-CG1 3.71Å; L104-V141 HydrophobicContact CB-CG2 3.94Å; L104-V141 HydrophobicContact CD2-CG1 3.88Å; L104-V141 HydrophobicContact CD2-CG2 4.16Å; L104-V141 HydrophobicContact CG-CG1 4.47Å; L104-S142 PolarHBondContact O-OG 3.38Å |
| 105 | G | 64.9 | Low | 79.5 | Confident | 34 Ų | 34 | 61.4 Ų | 61.4 | 35% | 0.351 | 29% | 0.291 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | 3.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | L100 L101 | L100-G105 PolarHBondContact O-N 2.8Å; L101-G105 CarbonylContact O-C 3.41Å; L101-G105 VanDerWaalsContact O-C 3.27Å; L101-G105 WeakPolarHBondContact O-CA 3.39Å; L101-G105 PolarHBondContact O-N 3.27Å |
| 106 | Q | 69.8 | Low | 80.2 | Confident | 77 Ų | 77 | 61.2 Ų | 61.2 | 36% | 0.36 | 29% | 0.29 | S | S | . | . | S | Bend | trans | -67.8 | 164.6 | 178.9 | -66.1 | -66.1 | -26.9 | 0 | 0 | 112.5 | L101 R102 R110 | L101-Q106 PolarHBondContact O-N 2.92Å; R102-Q106 WeakPolarHBondContact O-CG 3.43Å; R102-Q106 PolarHBondContact O-NE2 3.08Å; Q106-R110 HydrophobicContact CB-CB 4.03Å |
| 107 | S | 65.9 | Low | 80.8 | Confident | 71 Ų | 71 | 64.2 Ų | 64.2 | 50% | 0.497 | 30% | 0.303 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -31.2 | 141.8 | 178.8 | 63.5 | 0 | 0 | 0 | 0 | 114.2 | F109 R110 G111 | S107-F109 VanDerWaalsContact C-N 3.34Å; S107-F109 PolarHBondContact O-N 3.27Å; S107-R110 PolarHBondContact O-N 3.44Å; S107-G111 PolarHBondContact O-N 2.97Å |
| 108 | R | 73.1 | Confident | 81.5 | Confident | 137 Ų | 137 | 62.4 Ų | 62.4 | 52% | 0.517 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -30.2 | -62.2 | -165.6 | -68.5 | -165.1 | 166.5 | 105.2 | -2.3 | 114.6 | R110 T112 Q192 | R108-R110 PolarHBondContact O-N 3.37Å; R108-T112 PolarHBondContact O-N 3.36Å; R108-T112 PolarHBondContact O-OG1 2.81Å; R108-Q192 VanDerWaalsContact CA-CD 3.47Å; R108-Q192 HydrophobicContact CB-CG 4.12Å; R108-Q192 HydrophobicContact CG-CG 3.83Å; R108-Q192 PolarHBondContact NE-O 2.96Å; R108-Q192 VanDerWaalsContact NE-O 3.08Å; R108-Q192 PolarHBondContact O-OE1 3.42Å |
| 109 | F | 85 | Confident | 82.2 | Confident | 110 Ų | 110 | 57.5 Ų | 57.5 | 48% | 0.482 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -66.9 | -38.6 | -176.2 | -167.7 | -104.1 | 0 | 0 | 0 | 114.9 | S107 T112 L113 T189 | S107-F109 VanDerWaalsContact C-N 3.34Å; S107-F109 PolarHBondContact O-N 3.27Å; F109-T112 WeakPolarHBondContact O-CB 3.44Å; F109-T112 PolarHBondContact O-N 3.3Å; F109-L113 WeakPolarHBondContact O-CB 3.31Å; F109-L113 PolarHBondContact O-N 3.06Å; F109-T189 HydrophobicContact CD2-CG2 3.63Å; F109-T189 HydrophobicContact CE2-CG2 4.08Å |
| 110 | R | 86.2 | Confident | 82.7 | Confident | 158 Ų | 158 | 58.3 Ų | 58.3 | 60% | 0.596 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -65.2 | -42.4 | -178.9 | -71.5 | -174.2 | -177.9 | 170.3 | 0.9 | 112.1 | Q106 S107 R108 T112 L113 L114 | Q106-R110 HydrophobicContact CB-CB 4.03Å; S107-R110 PolarHBondContact O-N 3.44Å; R108-R110 PolarHBondContact O-N 3.37Å; R110-T112 VanDerWaalsContact C-N 3.3Å; R110-T112 PolarHBondContact O-N 2.92Å; R110-L113 PolarHBondContact O-N 3.15Å; R110-L114 WeakPolarHBondContact O-CB 3.29Å; R110-L114 WeakPolarHBondContact O-CG 3.49Å; R110-L114 PolarHBondContact O-N 3.36Å |
| 111 | G | 86.5 | Confident | 83.2 | Confident | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60.3 | -42.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | L104 S107 G115 G145 | L104-G111 WeakPolarHBondContact O-CA 3.34Å; S107-G111 PolarHBondContact O-N 2.97Å; G111-G115 PolarHBondContact O-N 2.78Å; G111-G145 WeakPolarHBondContact O-CA 3.45Å |
| 112 | T | 90.8 | Very high | 83.7 | Confident | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63 | -45.9 | 174.9 | -66 | 0 | 0 | 0 | 0 | 112.5 | R108 F109 R110 G115 T116 G144 A148 L185 A188 T189 Q192 | R108-T112 PolarHBondContact O-N 3.36Å; R108-T112 PolarHBondContact O-OG1 2.81Å; F109-T112 WeakPolarHBondContact O-CB 3.44Å; F109-T112 PolarHBondContact O-N 3.3Å; R110-T112 VanDerWaalsContact C-N 3.3Å; R110-T112 PolarHBondContact O-N 2.92Å; T112-G115 PolarHBondContact O-N 3.1Å; T112-T116 PolarHBondContact O-N 3.37Å; T112-T116 PolarHBondContact O-OG1 3.38Å; T112-G144 WeakPolarHBondContact OG1-CA 3.34Å; T112-A148 HydrophobicContact CG2-CB 4.02Å; T112-A148 WeakPolarHBondContact O-CB 3.39Å; T112-L185 HydrophobicContact CG2-CD2 3.87Å; T112-A188 HydrophobicContact CG2-CB 3.52Å; T112-T189 HydrophobicContact CG2-CG2 4.02Å; T112-Q192 PolarHBondContact OG1-OE1 2.83Å |
| 113 | L | 92.1 | Very high | 84.1 | Confident | 74 Ų | 74 | 50.6 Ų | 50.6 | 39% | 0.387 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63 | -45.2 | 179 | -175.5 | 63.9 | 0 | 0 | 0 | 111.5 | F109 R110 T116 L117 L185 | F109-L113 WeakPolarHBondContact O-CB 3.31Å; F109-L113 PolarHBondContact O-N 3.06Å; R110-L113 PolarHBondContact O-N 3.15Å; L113-T116 WeakPolarHBondContact O-CB 3.3Å; L113-T116 PolarHBondContact O-N 3.44Å; L113-L117 PolarHBondContact O-N 2.82Å; L113-L185 HydrophobicContact CD1-CD2 4.49Å |
| 114 | L | 91.4 | Very high | 84.6 | Confident | 54 Ų | 54 | 49.6 Ų | 49.6 | 28% | 0.283 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -65.2 | -43.3 | 177.6 | -72.5 | 169.1 | 0 | 0 | 0 | 111.4 | T103 R110 T116 L117 F118 | T103-L114 WeakPolarHBondContact O-CD1 3.31Å; R110-L114 WeakPolarHBondContact O-CB 3.29Å; R110-L114 WeakPolarHBondContact O-CG 3.49Å; R110-L114 PolarHBondContact O-N 3.36Å; L114-T116 VanDerWaalsContact C-N 3.28Å; L114-T116 PolarHBondContact O-N 3.4Å; L114-L117 WeakPolarHBondContact O-CB 3.46Å; L114-L117 PolarHBondContact O-N 2.61Å; L114-L117 VanDerWaalsContact O-N 3.11Å; L114-F118 HydrophobicContact CB-CD2 4.35Å; L114-F118 HydrophobicContact CB-CE2 4.18Å; L114-F118 WeakPolarHBondContact O-CD2 3.31Å; L114-F118 PolarHBondContact O-N 3.25Å |
| 115 | G | 91.6 | Very high | 85.2 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -56.8 | -41.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | G111 T112 S119 G145 F149 | G111-G115 PolarHBondContact O-N 2.78Å; T112-G115 PolarHBondContact O-N 3.1Å; G115-S119 PolarHBondContact O-N 2.92Å; G115-G145 WeakPolarHBondContact CA-O 3.3Å; G115-F149 VanDerWaalsContact O-CA 3.31Å; G115-F149 WeakPolarHBondContact O-CA 3.15Å |
| 116 | T | 93.6 | Very high | 86.4 | Confident | 4 Ų | 4 | 52.4 Ų | 52.4 | 3% | 0.025 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62 | -46.5 | 173.6 | -52.3 | 0 | 0 | 0 | 0 | 111 | T112 L113 L114 F118 S119 L156 L181 V184 | T112-T116 PolarHBondContact O-N 3.37Å; T112-T116 PolarHBondContact O-OG1 3.38Å; L113-T116 WeakPolarHBondContact O-CB 3.3Å; L113-T116 PolarHBondContact O-N 3.44Å; L114-T116 VanDerWaalsContact C-N 3.28Å; L114-T116 PolarHBondContact O-N 3.4Å; T116-F118 PolarHBondContact O-N 3.45Å; T116-S119 VanDerWaalsContact O-CB 3.3Å; T116-S119 WeakPolarHBondContact O-CB 3.37Å; T116-S119 PolarHBondContact O-N 3.03Å; T116-S119 VanDerWaalsContact O-N 3.1Å; T116-S119 PolarHBondContact O-OG 3.22Å; T116-L156 HydrophobicContact CG2-CD1 3.39Å; T116-L181 HydrophobicContact CG2-CD1 3.91Å; T116-V184 HydrophobicContact CG2-CG1 4.2Å |
| 117 | L | 92.7 | Very high | 87.4 | Confident | 104 Ų | 104 | 51.9 Ų | 51.9 | 55% | 0.545 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.8 | -43.5 | -179.7 | -140.6 | 80 | 0 | 0 | 0 | 112.1 | L113 L114 S119 L120 P121 | L113-L117 PolarHBondContact O-N 2.82Å; L114-L117 WeakPolarHBondContact O-CB 3.46Å; L114-L117 PolarHBondContact O-N 2.61Å; L114-L117 VanDerWaalsContact O-N 3.11Å; L117-S119 PolarHBondContact O-N 2.89Å; L117-L120 HydrophobicContact CD1-CD1 4.31Å; L117-L120 WeakPolarHBondContact O-CB 3.38Å; L117-L120 PolarHBondContact O-N 2.92Å; L117-P121 VanDerWaalsContact O-CD 3.3Å; L117-P121 WeakPolarHBondContact O-CD 3.1Å |
| 118 | F | 90.5 | Very high | 88.5 | Confident | 67 Ų | 67 | 48.6 Ų | 48.6 | 29% | 0.294 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -66.2 | -19.1 | 176.2 | -74.5 | -62.5 | 0 | 0 | 0 | 113 | F22 L104 L114 T116 F149 | F22-F118 HydrophobicContact CE1-CE1 4.34Å; F22-F118 HydrophobicContact CZ-CE1 4.33Å; L104-F118 HydrophobicContact CD1-CD2 3.81Å; L104-F118 HydrophobicContact CD1-CE2 3.42Å; L104-F118 VanDerWaalsContact CD1-CE2 3.42Å; L104-F118 HydrophobicContact CD1-CZ 4.29Å; L104-F118 HydrophobicContact CD2-CD2 4.24Å; L104-F118 HydrophobicContact CG-CD2 4.14Å; L104-F118 HydrophobicContact CG-CE2 4.15Å; L114-F118 HydrophobicContact CB-CD2 4.35Å; L114-F118 HydrophobicContact CB-CE2 4.18Å; L114-F118 WeakPolarHBondContact O-CD2 3.31Å; L114-F118 PolarHBondContact O-N 3.25Å; T116-F118 PolarHBondContact O-N 3.45Å; F118-F149 HydrophobicContact CB-CD2 4.12Å |
| 119 | S | 92.1 | Very high | 89.4 | Confident | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.007 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -76.8 | -29.5 | 176.8 | 84.6 | 0 | 0 | 0 | 0 | 113.6 | G115 T116 L117 G122 F149 G152 N153 | G115-S119 PolarHBondContact O-N 2.92Å; T116-S119 VanDerWaalsContact O-CB 3.3Å; T116-S119 WeakPolarHBondContact O-CB 3.37Å; T116-S119 PolarHBondContact O-N 3.03Å; T116-S119 VanDerWaalsContact O-N 3.1Å; T116-S119 PolarHBondContact O-OG 3.22Å; L117-S119 PolarHBondContact O-N 2.89Å; S119-G122 PolarHBondContact O-N 3.48Å; S119-G122 VanDerWaalsContact O-N 3.15Å; S119-F149 WeakPolarHBondContact CB-O 3.42Å; S119-G152 VanDerWaalsContact OG-C 3.24Å; S119-G152 VanDerWaalsContact OG-CA 3.31Å; S119-G152 WeakPolarHBondContact OG-CA 3.24Å; S119-N153 PolarHBondContact O-OD1 3.4Å |
| 120 | L | 90.6 | Very high | 89.8 | Confident | 65 Ų | 65 | 38.8 Ų | 38.8 | 34% | 0.34 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -57.8 | -50.2 | -175.8 | -64.2 | 174.8 | 0 | 0 | 0 | 113.4 | L117 G122 L156 P158 | L117-L120 HydrophobicContact CD1-CD1 4.31Å; L117-L120 WeakPolarHBondContact O-CB 3.38Å; L117-L120 PolarHBondContact O-N 2.92Å; L120-G122 VanDerWaalsContact C-N 3.27Å; L120-G122 PolarHBondContact O-N 3.27Å; L120-L156 HydrophobicContact CD2-CB 3.6Å; L120-L156 HydrophobicContact CD2-CD1 4.11Å; L120-L156 HydrophobicContact CD2-CG 4.46Å; L120-P158 WeakPolarHBondContact O-CD 3.31Å |
| 121 | P | 86.7 | Confident | 90.1 | Very high | 61 Ų | 61 | 33.1 Ų | 33.1 | 40% | 0.396 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | -21.2 | 178.7 | 28.9 | -35.8 | 0 | 0 | 0 | 113 | L117 M123 | L117-P121 VanDerWaalsContact O-CD 3.3Å; L117-P121 WeakPolarHBondContact O-CD 3.1Å; P121-M123 PolarHBondContact O-N 2.92Å |
| 122 | G | 85 | Confident | 90.3 | Very high | 7 Ų | 7 | 33.6 Ų | 33.6 | 7% | 0.072 | 20% | 0.197 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -38 | -174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L29 S119 L120 M124 N153 | L29-G122 WeakPolarHBondContact CD2-O 3.46Å; S119-G122 PolarHBondContact O-N 3.48Å; S119-G122 VanDerWaalsContact O-N 3.15Å; L120-G122 VanDerWaalsContact C-N 3.27Å; L120-G122 PolarHBondContact O-N 3.27Å; G122-M124 VanDerWaalsContact O-CE 3.29Å; G122-M124 WeakPolarHBondContact O-CE 3.3Å; G122-M124 WeakPolarHBondContact O-CG 3.37Å; G122-M124 PolarHBondContact O-N 3.11Å; G122-N153 WeakPolarHBondContact CA-OD1 3.47Å |
| 123 | M | 86.1 | Confident | 90.4 | Very high | 5 Ų | 5 | 34.1 Ų | 34.1 | 3% | 0.025 | 20% | 0.202 | C | C | . | . | trans | 45.8 | 31.4 | -176.7 | -70.3 | -171.3 | -66 | 0 | 0 | 113.2 | K33 W34 P121 N153 P158 A159 | K33-M123 HydrophobicContact CB-CE 4.09Å; K33-M123 HydrophobicContact CD-CB 4.1Å; K33-M123 PolarHBondContact NZ-O 3.19Å; W34-M123 HydrophobicContact CD2-CE 3.63Å; W34-M123 HydrophobicContact CE3-CE 4.4Å; W34-M123 HydrophobicContact CG-CE 3.79Å; W34-M123 HydrophobicContact CZ2-CE 3.77Å; W34-M123 HydrophobicContact CZ2-SD 4.45Å; P121-M123 PolarHBondContact O-N 2.92Å; M123-N153 PolarHBondContact N-OD1 2.98Å; M123-P158 HydrophobicContact CG-CG 3.79Å; M123-P158 HydrophobicContact SD-CG 3.78Å; M123-A159 HydrophobicContact SD-CB 3.79Å | ||
| 124 | M | 85.7 | Confident | 90.3 | Very high | 9 Ų | 9 | 32.8 Ų | 32.8 | 4% | 0.044 | 20% | 0.201 | C | C | . | . | trans | -80.9 | 150.3 | -173 | -69 | -61.7 | 155 | 0 | 0 | 113.3 | L29 K33 L83 G122 C128 A129 N153 | L29-M124 HydrophobicContact CD2-CE 2.96Å; L29-M124 HydrophobicContact CG-CE 4.41Å; K33-M124 HydrophobicContact CD-CE 3.92Å; K33-M124 HydrophobicContact CD-SD 4.39Å; K33-M124 VanDerWaalsContact NZ-CA 3.34Å; K33-M124 PolarHBondContact NZ-SD 3.15Å; L83-M124 HydrophobicContact CD2-CE 4.31Å; G122-M124 VanDerWaalsContact O-CE 3.29Å; G122-M124 WeakPolarHBondContact O-CE 3.3Å; G122-M124 WeakPolarHBondContact O-CG 3.37Å; G122-M124 PolarHBondContact O-N 3.11Å; M124-C128 HydrophobicContact CB-CB 4.07Å; M124-C128 HydrophobicContact CG-CB 4.17Å; M124-C128 HydrophobicContact SD-CB 3.63Å; M124-A129 HydrophobicContact CB-CB 4.14Å; M124-N153 HydrophobicContact CB-CB 4.06Å; M124-N153 VanDerWaalsContact CB-OD1 3.28Å; M124-N153 WeakPolarHBondContact CB-OD1 3.18Å; M124-N153 PolarHBondContact N-OD1 2.06Å; M124-N153 CarbonylContact O-C 3.55Å | ||
| 125 | C | 89.2 | Confident | 90.2 | Very high | 28 Ų | 28 | 30.2 Ų | 30.2 | 19% | 0.189 | 19% | 0.188 | C | C | . | . | trans | -69.6 | 159.6 | 160.5 | 64 | 0 | 0 | 0 | 0 | 109 | C127 C128 A129 | C125-C127 HydrophobicContact CB-CB 4.47Å; C125-C127 WeakPolarHBondContact CB-SG 3.3Å; C125-C127 PolarHBondContact O-N 3.4Å; C125-C127 VanDerWaalsContact O-N 3.15Å; C125-C127 WeakPolarHBondContact SG-CB 3.27Å; C125-C127 CovalentContact SG-SG 2.06Å; C125-C127 PolarHBondContact SG-SG 3.35Å; C125-C128 PolarHBondContact O-N 3.22Å; C125-C128 PolarHBondContact SG-N 2.96Å; C125-C128 PolarHBondContact SG-SG 3.07Å; C125-A129 WeakPolarHBondContact O-CB 3.5Å; C125-A129 PolarHBondContact O-N 3.2Å | ||
| 126 | T | 90.7 | Very high | 90.1 | Very high | 68 Ų | 68 | 30.7 Ų | 30.7 | 42% | 0.417 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -51.2 | -36.4 | 170.6 | 51.6 | 0 | 0 | 0 | 0 | 111.9 | A130 W150 P154 | T126-A130 WeakPolarHBondContact O-CB 3.44Å; T126-A130 PolarHBondContact O-N 3.49Å; T126-A130 VanDerWaalsContact O-N 3.08Å; T126-W150 HydrophobicContact CG2-CZ2 4.28Å; T126-W150 PolarHBondContact O-NE1 3.19Å; T126-W150 VanDerWaalsContact O-NE1 3.13Å; T126-P154 HydrophobicContact CG2-CB 4.35Å; T126-P154 HydrophobicContact CG2-CG 3.77Å |
| 127 | C | 89.9 | Confident | 89.9 | Confident | 67 Ų | 67 | 32.9 Ų | 32.9 | 45% | 0.453 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -58.9 | -45.5 | 176 | 37.7 | 0 | 0 | 0 | 0 | 114.3 | C125 P131 | C125-C127 HydrophobicContact CB-CB 4.47Å; C125-C127 WeakPolarHBondContact CB-SG 3.3Å; C125-C127 PolarHBondContact O-N 3.4Å; C125-C127 VanDerWaalsContact O-N 3.15Å; C125-C127 WeakPolarHBondContact SG-CB 3.27Å; C125-C127 CovalentContact SG-SG 2.06Å; C125-C127 PolarHBondContact SG-SG 3.35Å; C127-P131 VanDerWaalsContact O-CD 3.26Å; C127-P131 WeakPolarHBondContact O-CD 3.13Å |
| 128 | C | 89.6 | Confident | 89.6 | Confident | 1 Ų | 1 | 33.9 Ų | 33.9 | 1% | 0.007 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -83 | -31.2 | -178.3 | -61.1 | 0 | 0 | 0 | 0 | 111.8 | A80 A81 M124 C125 A130 P131 | A80-C128 PolarHBondContact O-SG 3.43Å; A80-C128 VanDerWaalsContact O-SG 3.35Å; A81-C128 WeakPolarHBondContact CA-SG 3.38Å; A81-C128 PolarHBondContact N-SG 3.29Å; A81-C128 VanDerWaalsContact N-SG 3.4Å; M124-C128 HydrophobicContact CB-CB 4.07Å; M124-C128 HydrophobicContact CG-CB 4.17Å; M124-C128 HydrophobicContact SD-CB 3.63Å; C125-C128 PolarHBondContact O-N 3.22Å; C125-C128 PolarHBondContact SG-N 2.96Å; C125-C128 PolarHBondContact SG-SG 3.07Å; C128-A130 VanDerWaalsContact C-N 3.31Å; C128-P131 WeakPolarHBondContact O-CD 3.49Å; C128-P131 WeakPolarHBondContact O-CG 3.3Å |
| 129 | A | 92 | Very high | 89.3 | Confident | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -72.3 | -26.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | M124 C125 V132 A133 F149 N153 | M124-A129 HydrophobicContact CB-CB 4.14Å; C125-A129 WeakPolarHBondContact O-CB 3.5Å; C125-A129 PolarHBondContact O-N 3.2Å; A129-V132 PolarHBondContact O-N 2.96Å; A129-A133 WeakPolarHBondContact O-CB 3.3Å; A129-A133 PolarHBondContact O-N 2.93Å; A129-F149 HydrophobicContact CB-CE1 4.24Å; A129-N153 HydrophobicContact CB-CB 4.19Å |
| 130 | A | 93.1 | Very high | 88.8 | Confident | 42 Ų | 42 | 33.9 Ų | 33.9 | 35% | 0.347 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -58 | -54.2 | -179 | 0 | 0 | 0 | 0 | 0 | 114.2 | T126 C128 V132 A133 A134 | T126-A130 WeakPolarHBondContact O-CB 3.44Å; T126-A130 PolarHBondContact O-N 3.49Å; T126-A130 VanDerWaalsContact O-N 3.08Å; C128-A130 VanDerWaalsContact C-N 3.31Å; A130-V132 VanDerWaalsContact C-N 3.27Å; A130-V132 PolarHBondContact O-N 3.02Å; A130-A133 PolarHBondContact O-N 3.27Å; A130-A134 WeakPolarHBondContact O-CB 3.46Å; A130-A134 PolarHBondContact O-N 3.26Å |
| 131 | P | 91.5 | Very high | 88.6 | Confident | 39 Ų | 39 | 30.8 Ų | 30.8 | 25% | 0.253 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -63.3 | -33.4 | 178.3 | 23.5 | -34.5 | 0 | 0 | 0 | 112.7 | V85 C127 C128 A134 G135 | V85-P131 HydrophobicContact CG2-CG 4.33Å; C127-P131 VanDerWaalsContact O-CD 3.26Å; C127-P131 WeakPolarHBondContact O-CD 3.13Å; C128-P131 WeakPolarHBondContact O-CD 3.49Å; C128-P131 WeakPolarHBondContact O-CG 3.3Å; P131-A134 PolarHBondContact O-N 3.49Å; P131-G135 PolarHBondContact O-N 3.29Å |
| 132 | V | 91.8 | Very high | 88.7 | Confident | 10 Ų | 10 | 28.4 Ų | 28.4 | 6% | 0.061 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -66.7 | -47.2 | 175.9 | -175.8 | 0 | 0 | 0 | 0 | 110.7 | G84 L87 I91 A129 A130 A134 G135 M136 F149 | G84-V132 WeakPolarHBondContact O-CG2 3.43Å; L87-V132 HydrophobicContact CB-CG2 3.93Å; I91-V132 HydrophobicContact CD1-CB 4.5Å; I91-V132 HydrophobicContact CD1-CG1 3.38Å; A129-V132 PolarHBondContact O-N 2.96Å; A130-V132 VanDerWaalsContact C-N 3.27Å; A130-V132 PolarHBondContact O-N 3.02Å; V132-A134 VanDerWaalsContact C-N 3.34Å; V132-A134 PolarHBondContact O-N 2.8Å; V132-G135 PolarHBondContact O-N 2.96Å; V132-M136 WeakPolarHBondContact O-CG 3.35Å; V132-M136 PolarHBondContact O-N 2.95Å; V132-F149 HydrophobicContact CB-CE1 3.83Å; V132-F149 HydrophobicContact CB-CZ 4.27Å; V132-F149 HydrophobicContact CG1-CE1 3.54Å; V132-F149 HydrophobicContact CG1-CZ 3.64Å |
| 133 | A | 92.6 | Very high | 88.9 | Confident | 11 Ų | 11 | 30.6 Ų | 30.6 | 9% | 0.091 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.6 | -40.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A129 A130 M136 R137 F149 W150 | A129-A133 WeakPolarHBondContact O-CB 3.3Å; A129-A133 PolarHBondContact O-N 2.93Å; A130-A133 PolarHBondContact O-N 3.27Å; A133-M136 HydrophobicContact CB-CE 4.28Å; A133-M136 PolarHBondContact O-N 3.42Å; A133-R137 WeakPolarHBondContact O-CG 3.5Å; A133-R137 PolarHBondContact O-N 3.44Å; A133-F149 HydrophobicContact CB-CD1 4.44Å; A133-W150 HydrophobicContact CB-CB 4.05Å; A133-W150 HydrophobicContact CB-CG 4.46Å |
| 134 | A | 90.8 | Very high | 89.1 | Confident | 46 Ų | 46 | 30.4 Ų | 30.4 | 38% | 0.38 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62.8 | -43.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A130 P131 V132 M136 R137 R138 | A130-A134 WeakPolarHBondContact O-CB 3.46Å; A130-A134 PolarHBondContact O-N 3.26Å; P131-A134 PolarHBondContact O-N 3.49Å; V132-A134 VanDerWaalsContact C-N 3.34Å; V132-A134 PolarHBondContact O-N 2.8Å; A134-M136 PolarHBondContact O-N 2.83Å; A134-R137 PolarHBondContact O-N 2.88Å; A134-R138 WeakPolarHBondContact O-CG 3.28Å; A134-R138 PolarHBondContact O-N 3.38Å |
| 135 | G | 88.6 | Confident | 89.4 | Confident | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59 | -44.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | P131 V132 R137 R138 Q139 | P131-G135 PolarHBondContact O-N 3.29Å; V132-G135 PolarHBondContact O-N 2.96Å; G135-R137 PolarHBondContact O-N 2.97Å; G135-R138 PolarHBondContact O-N 3.12Å; G135-Q139 WeakPolarHBondContact O-CG 3.39Å; G135-Q139 PolarHBondContact O-N 3.09Å |
| 136 | M | 89.2 | Confident | 89.5 | Confident | 9 Ų | 9 | 28.8 Ų | 28.8 | 4% | 0.044 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -61.6 | -42.5 | 174.6 | -73.7 | -167.9 | -63.3 | 0 | 0 | 112.5 | I91 L104 V132 A133 A134 R138 Q139 Q140 V141 F149 | I91-M136 HydrophobicContact CD1-CG 3.79Å; I91-M136 HydrophobicContact CG2-CG 4.17Å; L104-M136 HydrophobicContact CD2-SD 3.78Å; V132-M136 WeakPolarHBondContact O-CG 3.35Å; V132-M136 PolarHBondContact O-N 2.95Å; A133-M136 HydrophobicContact CB-CE 4.28Å; A133-M136 PolarHBondContact O-N 3.42Å; A134-M136 PolarHBondContact O-N 2.83Å; M136-R138 VanDerWaalsContact C-N 3.35Å; M136-R138 PolarHBondContact O-N 3.37Å; M136-Q139 CarbonylContact O-C 3.27Å; M136-Q139 WeakPolarHBondContact O-CA 3.39Å; M136-Q139 PolarHBondContact O-N 3.3Å; M136-Q140 PolarHBondContact O-N 3.5Å; M136-V141 HydrophobicContact CB-CB 4Å; M136-V141 HydrophobicContact CB-CG1 4.42Å; M136-V141 HydrophobicContact CB-CG2 3.8Å; M136-V141 HydrophobicContact CG-CG2 4.33Å; M136-V141 WeakPolarHBondContact O-CB 3.32Å; M136-V141 WeakPolarHBondContact O-CG2 3.34Å; M136-V141 PolarHBondContact O-N 3.41Å; M136-V141 VanDerWaalsContact O-N 3.12Å; M136-F149 HydrophobicContact CE-CB 3.66Å; M136-F149 HydrophobicContact CE-CD1 3.24Å; M136-F149 HydrophobicContact CE-CD2 4.24Å; M136-F149 HydrophobicContact CE-CE1 3.92Å; M136-F149 HydrophobicContact CE-CG 3.44Å; M136-F149 VanDerWaalsContact CE-CG 3.44Å |
| 137 | R | 89.2 | Confident | 89.6 | Confident | 50 Ų | 50 | 27.4 Ų | 27.4 | 19% | 0.189 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -63.4 | -38.3 | 177.1 | -76.6 | -57.3 | -50.2 | 176.1 | -5.5 | 112.8 | A133 A134 G135 Q139 Q140 V141 M143 A146 | A133-R137 WeakPolarHBondContact O-CG 3.5Å; A133-R137 PolarHBondContact O-N 3.44Å; A134-R137 PolarHBondContact O-N 2.88Å; G135-R137 PolarHBondContact O-N 2.97Å; R137-Q139 PolarHBondContact O-N 3.33Å; R137-Q140 PolarHBondContact O-N 3.15Å; R137-Q140 VanDerWaalsContact O-N 3.08Å; R137-V141 PolarHBondContact NH1-O 2.92Å; R137-M143 PolarHBondContact NE-SD 3.46Å; R137-M143 VanDerWaalsContact NH1-CA 3.3Å; R137-M143 VanDerWaalsContact NH1-CG 3.3Å; R137-M143 PolarHBondContact NH1-SD 3.2Å; R137-M143 VanDerWaalsContact NH1-SD 3.36Å; R137-M143 PolarHBondContact NH2-SD 3.34Å; R137-A146 VanDerWaalsContact CD-CB 3.42Å; R137-A146 HydrophobicContact CG-CB 3.67Å |
| 138 | R | 86.3 | Confident | 89.8 | Confident | 126 Ų | 126 | 24.2 Ų | 24.2 | 48% | 0.475 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -63.3 | -28.8 | 172.2 | -69.9 | 175.3 | -178.4 | -176.5 | 0.9 | 112.5 | Q92 A134 G135 M136 Q140 | Q92-R138 HydrophobicContact CG-CB 4.49Å; A134-R138 WeakPolarHBondContact O-CG 3.28Å; A134-R138 PolarHBondContact O-N 3.38Å; G135-R138 PolarHBondContact O-N 3.12Å; M136-R138 VanDerWaalsContact C-N 3.35Å; M136-R138 PolarHBondContact O-N 3.37Å; R138-Q140 VanDerWaalsContact C-N 3.27Å; R138-Q140 PolarHBondContact O-N 2.71Å |
| 139 | Q | 83.8 | Confident | 90 | Very high | 9 Ų | 9 | 25.1 Ų | 25.1 | 4% | 0.042 | 13% | 0.134 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | 20 | 174.8 | -62.2 | -63.4 | -22.1 | 0 | 0 | 113.3 | I91 Q92 R97 L100 G135 M136 R137 V141 | I91-Q139 HydrophobicContact CG2-CG 4.16Å; Q92-Q139 HydrophobicContact CG-CG 4.38Å; Q92-Q139 PolarHBondContact O-NE2 3.17Å; R97-Q139 VanDerWaalsContact NE-OE1 3.15Å; L100-Q139 HydrophobicContact CD2-CB 3.37Å; L100-Q139 HydrophobicContact CD2-CG 4.22Å; G135-Q139 WeakPolarHBondContact O-CG 3.39Å; G135-Q139 PolarHBondContact O-N 3.09Å; M136-Q139 CarbonylContact O-C 3.27Å; M136-Q139 WeakPolarHBondContact O-CA 3.39Å; M136-Q139 PolarHBondContact O-N 3.3Å; R137-Q139 PolarHBondContact O-N 3.33Å; Q139-V141 VanDerWaalsContact C-N 3.26Å; Q139-V141 PolarHBondContact O-N 3.32Å |
| 140 | Q | 83.4 | Confident | 90.1 | Very high | 59 Ų | 59 | 29.5 Ų | 29.5 | 28% | 0.276 | 15% | 0.151 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 64.8 | 18.9 | 174.2 | -52.6 | -69.9 | -52.4 | 0 | 0 | 115.4 | L101 M136 R137 R138 S142 Q200 | L101-Q140 HydrophobicContact CD2-CB 3.68Å; L101-Q140 VanDerWaalsContact CD2-O 3.28Å; L101-Q140 WeakPolarHBondContact CD2-O 3.33Å; L101-Q140 HydrophobicContact CG-CB 4.39Å; M136-Q140 PolarHBondContact O-N 3.5Å; R137-Q140 PolarHBondContact O-N 3.15Å; R137-Q140 VanDerWaalsContact O-N 3.08Å; R138-Q140 VanDerWaalsContact C-N 3.27Å; R138-Q140 PolarHBondContact O-N 2.71Å; Q140-S142 PolarHBondContact O-N 2.89Å; Q140-Q200 VanDerWaalsContact NE2-CB 3.33Å; Q140-Q200 PolarHBondContact NE2-O 2.92Å |
| 141 | V | 85.7 | Confident | 90.2 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 14% | 0.141 | C | C | . | . | trans | -56.9 | 139.2 | 169.1 | 169.2 | 0 | 0 | 0 | 0 | 109.8 | L100 L104 M136 R137 Q139 A146 | L100-V141 HydrophobicContact CD1-CG2 4.1Å; L100-V141 HydrophobicContact CD2-CG2 3.32Å; L100-V141 HydrophobicContact CG-CG2 3.44Å; L100-V141 VanDerWaalsContact CG-CG2 3.44Å; L104-V141 HydrophobicContact CB-CB 4.38Å; L104-V141 HydrophobicContact CB-CG1 3.71Å; L104-V141 HydrophobicContact CB-CG2 3.94Å; L104-V141 HydrophobicContact CD2-CG1 3.88Å; L104-V141 HydrophobicContact CD2-CG2 4.16Å; L104-V141 HydrophobicContact CG-CG1 4.47Å; M136-V141 HydrophobicContact CB-CB 4Å; M136-V141 HydrophobicContact CB-CG1 4.42Å; M136-V141 HydrophobicContact CB-CG2 3.8Å; M136-V141 HydrophobicContact CG-CG2 4.33Å; M136-V141 WeakPolarHBondContact O-CB 3.32Å; M136-V141 WeakPolarHBondContact O-CG2 3.34Å; M136-V141 PolarHBondContact O-N 3.41Å; M136-V141 VanDerWaalsContact O-N 3.12Å; R137-V141 PolarHBondContact NH1-O 2.92Å; Q139-V141 VanDerWaalsContact C-N 3.26Å; Q139-V141 PolarHBondContact O-N 3.32Å; V141-A146 HydrophobicContact CG1-CB 4.13Å | ||
| 142 | S | 88.2 | Confident | 90.3 | Very high | 11 Ų | 11 | 27.1 Ų | 27.1 | 8% | 0.077 | 13% | 0.129 | C | C | . | . | trans | -53.3 | 152.3 | 178.2 | 65.7 | 0 | 0 | 0 | 0 | 113.7 | L104 Q140 G144 G145 A146 Q192 | L104-S142 PolarHBondContact O-OG 3.38Å; Q140-S142 PolarHBondContact O-N 2.89Å; S142-G144 VanDerWaalsContact C-N 3.29Å; S142-G144 PolarHBondContact O-N 3.47Å; S142-G145 PolarHBondContact O-N 3.2Å; S142-G145 PolarHBondContact OG-N 3.49Å; S142-A146 PolarHBondContact O-N 3.34Å; S142-Q192 VanDerWaalsContact CB-NE2 3.3Å | ||
| 143 | M | 89.4 | Confident | 90.4 | Very high | 53 Ų | 53 | 26.6 Ų | 26.6 | 26% | 0.261 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -63.8 | -42.3 | -176.1 | -81.9 | -62.3 | -72.6 | 0 | 0 | 110.4 | R137 A146 L147 V195 E197 | R137-M143 PolarHBondContact NE-SD 3.46Å; R137-M143 VanDerWaalsContact NH1-CA 3.3Å; R137-M143 VanDerWaalsContact NH1-CG 3.3Å; R137-M143 PolarHBondContact NH1-SD 3.2Å; R137-M143 VanDerWaalsContact NH1-SD 3.36Å; R137-M143 PolarHBondContact NH2-SD 3.34Å; M143-A146 PolarHBondContact O-N 2.92Å; M143-L147 VanDerWaalsContact O-CB 3.24Å; M143-L147 WeakPolarHBondContact O-CB 3.41Å; M143-L147 PolarHBondContact O-N 3.07Å; M143-V195 HydrophobicContact CG-CB 4.38Å; M143-V195 HydrophobicContact CG-CG1 3.93Å; M143-E197 HydrophobicContact CG-CG 4.32Å; M143-E197 PolarHBondContact N-OE1 3.15Å |
| 144 | G | 90.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -59.8 | -46.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | T112 S142 L147 A148 | T112-G144 WeakPolarHBondContact OG1-CA 3.34Å; S142-G144 VanDerWaalsContact C-N 3.29Å; S142-G144 PolarHBondContact O-N 3.47Å; G144-L147 PolarHBondContact O-N 3.45Å; G144-A148 WeakPolarHBondContact O-CB 3.14Å; G144-A148 PolarHBondContact O-N 2.83Å |
| 145 | G | 91.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -62.6 | -45.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | G111 G115 S142 F149 | G111-G145 WeakPolarHBondContact O-CA 3.45Å; G115-G145 WeakPolarHBondContact CA-O 3.3Å; S142-G145 PolarHBondContact O-N 3.2Å; S142-G145 PolarHBondContact OG-N 3.49Å; G145-F149 WeakPolarHBondContact O-CB 3.34Å; G145-F149 PolarHBondContact O-N 3.16Å |
| 146 | A | 92.1 | Very high | 90.7 | Very high | 4 Ų | 4 | 27.6 Ų | 27.6 | 3% | 0.033 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -67.3 | -41.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | R137 V141 S142 M143 F149 W150 | R137-A146 VanDerWaalsContact CD-CB 3.42Å; R137-A146 HydrophobicContact CG-CB 3.67Å; V141-A146 HydrophobicContact CG1-CB 4.13Å; S142-A146 PolarHBondContact O-N 3.34Å; M143-A146 PolarHBondContact O-N 2.92Å; A146-F149 PolarHBondContact O-N 3.34Å; A146-W150 WeakPolarHBondContact O-CB 3.39Å; A146-W150 PolarHBondContact O-N 2.94Å |
| 147 | L | 93.3 | Very high | 90.8 | Very high | 39 Ų | 39 | 28 Ų | 28 | 20% | 0.204 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -68.2 | -42.1 | 177.9 | -175.6 | 61.7 | 0 | 0 | 0 | 111.5 | M143 G144 F149 W150 M151 I187 V191 | M143-L147 VanDerWaalsContact O-CB 3.24Å; M143-L147 WeakPolarHBondContact O-CB 3.41Å; M143-L147 PolarHBondContact O-N 3.07Å; G144-L147 PolarHBondContact O-N 3.45Å; L147-F149 VanDerWaalsContact C-N 3.31Å; L147-F149 PolarHBondContact O-N 3.28Å; L147-W150 HydrophobicContact CD1-CE3 3.99Å; L147-W150 PolarHBondContact O-N 3.46Å; L147-W150 VanDerWaalsContact O-N 3.15Å; L147-M151 HydrophobicContact CD1-CG 3.99Å; L147-M151 HydrophobicContact CD1-SD 3.87Å; L147-M151 HydrophobicContact CD2-SD 4.36Å; L147-M151 HydrophobicContact CG-CG 4.31Å; L147-M151 HydrophobicContact CG-SD 3.87Å; L147-M151 WeakPolarHBondContact O-CG 3.45Å; L147-M151 PolarHBondContact O-N 3.42Å; L147-I187 HydrophobicContact CD2-CG2 4.18Å; L147-V191 HydrophobicContact CD2-CB 3.9Å; L147-V191 HydrophobicContact CD2-CG1 4Å; L147-V191 HydrophobicContact CD2-CG2 3.76Å |
| 148 | A | 94.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.2 | -40.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | T112 G144 G152 V184 A188 | T112-A148 HydrophobicContact CG2-CB 4.02Å; T112-A148 WeakPolarHBondContact O-CB 3.39Å; G144-A148 WeakPolarHBondContact O-CB 3.14Å; G144-A148 PolarHBondContact O-N 2.83Å; A148-G152 VanDerWaalsContact O-CA 3.32Å; A148-G152 WeakPolarHBondContact O-CA 3.43Å; A148-G152 PolarHBondContact O-N 3.44Å; A148-V184 HydrophobicContact CB-CG1 4Å; A148-A188 HydrophobicContact CB-CB 3.83Å |
| 149 | F | 93.6 | Very high | 90.8 | Very high | 19 Ų | 19 | 22 Ų | 22 | 8% | 0.083 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -61.5 | -47.7 | 171.8 | 174 | -93.2 | 0 | 0 | 0 | 111.9 | G115 F118 S119 A129 V132 A133 M136 G145 A146 L147 N153 | G115-F149 VanDerWaalsContact O-CA 3.31Å; G115-F149 WeakPolarHBondContact O-CA 3.15Å; F118-F149 HydrophobicContact CB-CD2 4.12Å; S119-F149 WeakPolarHBondContact CB-O 3.42Å; A129-F149 HydrophobicContact CB-CE1 4.24Å; V132-F149 HydrophobicContact CB-CE1 3.83Å; V132-F149 HydrophobicContact CB-CZ 4.27Å; V132-F149 HydrophobicContact CG1-CE1 3.54Å; V132-F149 HydrophobicContact CG1-CZ 3.64Å; A133-F149 HydrophobicContact CB-CD1 4.44Å; M136-F149 HydrophobicContact CE-CB 3.66Å; M136-F149 HydrophobicContact CE-CD1 3.24Å; M136-F149 HydrophobicContact CE-CD2 4.24Å; M136-F149 HydrophobicContact CE-CE1 3.92Å; M136-F149 HydrophobicContact CE-CG 3.44Å; M136-F149 VanDerWaalsContact CE-CG 3.44Å; G145-F149 WeakPolarHBondContact O-CB 3.34Å; G145-F149 PolarHBondContact O-N 3.16Å; A146-F149 PolarHBondContact O-N 3.34Å; L147-F149 VanDerWaalsContact C-N 3.31Å; L147-F149 PolarHBondContact O-N 3.28Å; F149-N153 WeakPolarHBondContact CE2-ND2 3.29Å; F149-N153 VanDerWaalsContact CZ-ND2 3.34Å; F149-N153 WeakPolarHBondContact CZ-ND2 3.29Å; F149-N153 PolarHBondContact O-N 3.39Å; F149-N153 PolarHBondContact O-ND2 2.83Å |
| 150 | W | 94.6 | Very high | 91 | Very high | 92 Ų | 92 | 24 Ų | 24 | 35% | 0.348 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -63.3 | -46.3 | -176.6 | -176.5 | 71.8 | 0 | 0 | 0 | 112.6 | T126 A133 A146 L147 P154 | T126-W150 HydrophobicContact CG2-CZ2 4.28Å; T126-W150 PolarHBondContact O-NE1 3.19Å; T126-W150 VanDerWaalsContact O-NE1 3.13Å; A133-W150 HydrophobicContact CB-CB 4.05Å; A133-W150 HydrophobicContact CB-CG 4.46Å; A146-W150 WeakPolarHBondContact O-CB 3.39Å; A146-W150 PolarHBondContact O-N 2.94Å; L147-W150 HydrophobicContact CD1-CE3 3.99Å; L147-W150 PolarHBondContact O-N 3.46Å; L147-W150 VanDerWaalsContact O-N 3.15Å; W150-P154 VanDerWaalsContact O-CD 3.26Å; W150-P154 WeakPolarHBondContact O-CD 3.44Å |
| 151 | M | 94.3 | Very high | 91.4 | Very high | 31 Ų | 31 | 22.2 Ų | 22.2 | 15% | 0.153 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -77.4 | -36.1 | 179.1 | -63.7 | -177.1 | 63.1 | 0 | 0 | 112.8 | L147 N153 P154 V155 V184 I187 | L147-M151 HydrophobicContact CD1-CG 3.99Å; L147-M151 HydrophobicContact CD1-SD 3.87Å; L147-M151 HydrophobicContact CD2-SD 4.36Å; L147-M151 HydrophobicContact CG-CG 4.31Å; L147-M151 HydrophobicContact CG-SD 3.87Å; L147-M151 WeakPolarHBondContact O-CG 3.45Å; L147-M151 PolarHBondContact O-N 3.42Å; M151-N153 VanDerWaalsContact C-N 3.28Å; M151-N153 PolarHBondContact O-N 2.82Å; M151-P154 WeakPolarHBondContact O-CD 3.34Å; M151-P154 VanDerWaalsContact O-CG 3.31Å; M151-P154 WeakPolarHBondContact O-CG 2.97Å; M151-V155 VanDerWaalsContact O-CB 3.32Å; M151-V155 WeakPolarHBondContact O-CB 3.43Å; M151-V155 WeakPolarHBondContact O-CG2 3.07Å; M151-V155 PolarHBondContact O-N 3.23Å; M151-V184 HydrophobicContact CB-CG2 4.14Å; M151-I187 HydrophobicContact CE-CB 4.33Å; M151-I187 HydrophobicContact CE-CD1 3.7Å; M151-I187 HydrophobicContact CE-CG2 4.17Å; M151-I187 HydrophobicContact SD-CB 4.36Å; M151-I187 HydrophobicContact SD-CG2 3.83Å |
| 152 | G | 94.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.9 | -33 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | S119 A148 V155 L156 | S119-G152 VanDerWaalsContact OG-C 3.24Å; S119-G152 VanDerWaalsContact OG-CA 3.31Å; S119-G152 WeakPolarHBondContact OG-CA 3.24Å; A148-G152 VanDerWaalsContact O-CA 3.32Å; A148-G152 WeakPolarHBondContact O-CA 3.43Å; A148-G152 PolarHBondContact O-N 3.44Å; G152-V155 PolarHBondContact O-N 3.42Å; G152-L156 WeakPolarHBondContact O-CA 3.16Å; G152-L156 VanDerWaalsContact O-CB 3.31Å; G152-L156 WeakPolarHBondContact O-CB 3.22Å; G152-L156 PolarHBondContact O-N 3.15Å |
| 153 | N | 93.4 | Very high | 91.4 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -56.7 | -51.7 | -179.7 | -94.9 | -84.4 | 0 | 0 | 0 | 114.2 | S119 G122 M123 M124 A129 F149 M151 N157 | S119-N153 PolarHBondContact O-OD1 3.4Å; G122-N153 WeakPolarHBondContact CA-OD1 3.47Å; M123-N153 PolarHBondContact N-OD1 2.98Å; M124-N153 HydrophobicContact CB-CB 4.06Å; M124-N153 VanDerWaalsContact CB-OD1 3.28Å; M124-N153 WeakPolarHBondContact CB-OD1 3.18Å; M124-N153 PolarHBondContact N-OD1 2.06Å; M124-N153 CarbonylContact O-C 3.55Å; A129-N153 HydrophobicContact CB-CB 4.19Å; F149-N153 WeakPolarHBondContact CE2-ND2 3.29Å; F149-N153 VanDerWaalsContact CZ-ND2 3.34Å; F149-N153 WeakPolarHBondContact CZ-ND2 3.29Å; F149-N153 PolarHBondContact O-N 3.39Å; F149-N153 PolarHBondContact O-ND2 2.83Å; M151-N153 VanDerWaalsContact C-N 3.28Å; M151-N153 PolarHBondContact O-N 2.82Å; N153-N157 WeakPolarHBondContact O-CB 3.39Å |
| 154 | P | 92 | Very high | 91.3 | Very high | 41 Ų | 41 | 25.3 Ų | 25.3 | 27% | 0.266 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -77.8 | -33.4 | 175 | 28.9 | -37.4 | 0 | 0 | 0 | 113.6 | T126 W150 M151 | T126-P154 HydrophobicContact CG2-CB 4.35Å; T126-P154 HydrophobicContact CG2-CG 3.77Å; W150-P154 VanDerWaalsContact O-CD 3.26Å; W150-P154 WeakPolarHBondContact O-CD 3.44Å; M151-P154 WeakPolarHBondContact O-CD 3.34Å; M151-P154 VanDerWaalsContact O-CG 3.31Å; M151-P154 WeakPolarHBondContact O-CG 2.97Å |
| 155 | V | 93.3 | Very high | 91.1 | Very high | 33 Ų | 33 | 25.5 Ų | 25.5 | 20% | 0.2 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -79.3 | -41.9 | -171.3 | 173.7 | 0 | 0 | 0 | 0 | 112.1 | M151 G152 V184 | M151-V155 VanDerWaalsContact O-CB 3.32Å; M151-V155 WeakPolarHBondContact O-CB 3.43Å; M151-V155 WeakPolarHBondContact O-CG2 3.07Å; M151-V155 PolarHBondContact O-N 3.23Å; G152-V155 PolarHBondContact O-N 3.42Å; V155-V184 HydrophobicContact CB-CG2 4.13Å; V155-V184 HydrophobicContact CG1-CG2 4.06Å |
| 156 | L | 93 | Very high | 90.8 | Very high | 3 Ų | 3 | 28.2 Ų | 28.2 | 2% | 0.016 | 15% | 0.15 | C | C | . | . | S | Bend | trans | -102.2 | 23.7 | -175.2 | -57.3 | 174.5 | 0 | 0 | 0 | 112.4 | T116 L120 G152 P158 L177 L181 | T116-L156 HydrophobicContact CG2-CD1 3.39Å; L120-L156 HydrophobicContact CD2-CB 3.6Å; L120-L156 HydrophobicContact CD2-CD1 4.11Å; L120-L156 HydrophobicContact CD2-CG 4.46Å; G152-L156 WeakPolarHBondContact O-CA 3.16Å; G152-L156 VanDerWaalsContact O-CB 3.31Å; G152-L156 WeakPolarHBondContact O-CB 3.22Å; G152-L156 PolarHBondContact O-N 3.15Å; L156-P158 WeakPolarHBondContact O-CD 3.35Å; L156-P158 VanDerWaalsContact O-N 3.15Å; L156-L177 HydrophobicContact CD2-CD1 3.99Å; L156-L181 HydrophobicContact CD1-CD1 4.15Å; L156-L181 HydrophobicContact CD2-CB 4.08Å |
| 157 | N | 92.2 | Very high | 90.4 | Very high | 17 Ų | 17 | 31.8 Ų | 31.8 | 9% | 0.091 | 17% | 0.171 | C | C | . | . | trans | -65 | 112.4 | -174.8 | -177.4 | -45.5 | 0 | 0 | 0 | 111.1 | N153 A159 T160 L161 | N153-N157 WeakPolarHBondContact O-CB 3.39Å; N157-A159 VanDerWaalsContact C-N 3.32Å; N157-A159 PolarHBondContact O-N 3.45Å; N157-A159 WeakPolarHBondContact OD1-CB 3.2Å; N157-A159 PolarHBondContact OD1-N 2.89Å; N157-T160 HydrophobicContact CB-CG2 3.86Å; N157-T160 PolarHBondContact O-N 3.12Å; N157-T160 VanDerWaalsContact O-N 3.09Å; N157-T160 PolarHBondContact O-OG1 2.92Å; N157-T160 PolarHBondContact OD1-N 3.33Å; N157-L161 PolarHBondContact O-N 2.64Å | ||
| 158 | P | 89.1 | Confident | 90 | Very high | 39 Ų | 39 | 34.6 Ų | 34.6 | 25% | 0.253 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -60.5 | -36 | -177.2 | 21 | -33.9 | 0 | 0 | 0 | 113.6 | L120 M123 L156 T160 L161 V162 | L120-P158 WeakPolarHBondContact O-CD 3.31Å; M123-P158 HydrophobicContact CG-CG 3.79Å; M123-P158 HydrophobicContact SD-CG 3.78Å; L156-P158 WeakPolarHBondContact O-CD 3.35Å; L156-P158 VanDerWaalsContact O-N 3.15Å; P158-T160 VanDerWaalsContact C-N 3.31Å; P158-T160 PolarHBondContact O-N 3.49Å; P158-L161 PolarHBondContact O-N 3.42Å; P158-V162 VanDerWaalsContact O-CG2 3.31Å; P158-V162 WeakPolarHBondContact O-CG2 3.32Å; P158-V162 PolarHBondContact O-N 3.01Å |
| 159 | A | 86.5 | Confident | 89.7 | Confident | 12 Ų | 12 | 35.9 Ų | 35.9 | 10% | 0.099 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61 | -42.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y37 M123 N157 L161 V162 F163 | Y37-A159 HydrophobicContact CD1-CB 4.12Å; Y37-A159 HydrophobicContact CG-CB 4.12Å; M123-A159 HydrophobicContact SD-CB 3.79Å; N157-A159 VanDerWaalsContact C-N 3.32Å; N157-A159 PolarHBondContact O-N 3.45Å; N157-A159 WeakPolarHBondContact OD1-CB 3.2Å; N157-A159 PolarHBondContact OD1-N 2.89Å; A159-L161 VanDerWaalsContact C-N 3.34Å; A159-L161 PolarHBondContact O-N 3.48Å; A159-V162 PolarHBondContact O-N 3.03Å; A159-F163 HydrophobicContact CB-CE2 4.19Å; A159-F163 WeakPolarHBondContact O-CD2 3.31Å; A159-F163 WeakPolarHBondContact O-CG 3.2Å; A159-F163 PolarHBondContact O-N 3.45Å |
| 160 | T | 88.1 | Confident | 89.6 | Confident | 51 Ų | 51 | 42.6 Ų | 42.6 | 31% | 0.313 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65.4 | -37.1 | 177.4 | 68.5 | 0 | 0 | 0 | 0 | 112.6 | N157 P158 M164 | N157-T160 HydrophobicContact CB-CG2 3.86Å; N157-T160 PolarHBondContact O-N 3.12Å; N157-T160 VanDerWaalsContact O-N 3.09Å; N157-T160 PolarHBondContact O-OG1 2.92Å; N157-T160 PolarHBondContact OD1-N 3.33Å; P158-T160 VanDerWaalsContact C-N 3.31Å; P158-T160 PolarHBondContact O-N 3.49Å; T160-M164 WeakPolarHBondContact O-CB 3.39Å; T160-M164 PolarHBondContact O-N 2.96Å |
| 161 | L | 90.2 | Very high | 89.5 | Confident | 22 Ų | 22 | 40.7 Ų | 40.7 | 12% | 0.115 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -67.5 | -40.7 | 178.2 | -66.9 | 171.2 | 0 | 0 | 0 | 111.4 | N157 P158 A159 M164 G165 R176 L177 | N157-L161 PolarHBondContact O-N 2.64Å; P158-L161 PolarHBondContact O-N 3.42Å; A159-L161 VanDerWaalsContact C-N 3.34Å; A159-L161 PolarHBondContact O-N 3.48Å; L161-M164 PolarHBondContact O-N 2.82Å; L161-G165 PolarHBondContact O-N 3.49Å; L161-R176 HydrophobicContact CD2-CB 4.25Å; L161-R176 HydrophobicContact CD2-CG 4.1Å; L161-L177 HydrophobicContact CD1-CB 4.18Å; L161-L177 HydrophobicContact CD1-CD1 3.76Å; L161-L177 HydrophobicContact CD1-CG 4.37Å; L161-L177 HydrophobicContact CD2-CB 4Å |
| 162 | V | 88.1 | Confident | 89.4 | Confident | 49 Ų | 49 | 44.8 Ų | 44.8 | 30% | 0.297 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -64.1 | -49.7 | 176.2 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | A41 P158 A159 M164 G165 F166 | A41-V162 HydrophobicContact CB-CG1 4.39Å; P158-V162 VanDerWaalsContact O-CG2 3.31Å; P158-V162 WeakPolarHBondContact O-CG2 3.32Å; P158-V162 PolarHBondContact O-N 3.01Å; A159-V162 PolarHBondContact O-N 3.03Å; V162-M164 VanDerWaalsContact C-N 3.33Å; V162-M164 PolarHBondContact O-N 2.81Å; V162-G165 PolarHBondContact O-N 3.44Å; V162-F166 HydrophobicContact CG1-CD2 3.85Å; V162-F166 HydrophobicContact CG1-CE2 3.41Å; V162-F166 VanDerWaalsContact CG1-CE2 3.41Å; V162-F166 HydrophobicContact CG1-CZ 4.42Å; V162-F166 WeakPolarHBondContact O-CD2 3.17Å; V162-F166 PolarHBondContact O-N 3.22Å; V162-F166 VanDerWaalsContact O-N 3.13Å |
| 163 | F | 85.5 | Confident | 89.3 | Confident | 31 Ų | 31 | 45 Ų | 45 | 14% | 0.136 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.3 | -40.3 | 177.2 | -67.1 | -52.3 | 0 | 0 | 0 | 112.7 | Y37 K40 A41 A44 I50 A159 G165 F166 V167 | Y37-F163 AromaticContact CD1-CE2 3.64Å; Y37-F163 HydrophobicContact CD1-CE2 3.64Å; Y37-F163 AromaticContact CD1-CZ 3.98Å; Y37-F163 HydrophobicContact CD1-CZ 3.98Å; Y37-F163 HydrophobicContact CE1-CE2 4.04Å; K40-F163 HydrophobicContact CB-CE1 4.22Å; K40-F163 HydrophobicContact CB-CZ 3.88Å; A41-F163 HydrophobicContact CB-CE1 4.42Å; A44-F163 HydrophobicContact CB-CD1 3.92Å; A44-F163 HydrophobicContact CB-CE1 3.97Å; I50-F163 HydrophobicContact CD1-CB 4.29Å; A159-F163 HydrophobicContact CB-CE2 4.19Å; A159-F163 WeakPolarHBondContact O-CD2 3.31Å; A159-F163 WeakPolarHBondContact O-CG 3.2Å; A159-F163 PolarHBondContact O-N 3.45Å; F163-G165 VanDerWaalsContact C-N 3.31Å; F163-G165 PolarHBondContact O-N 3.22Å; F163-F166 PolarHBondContact O-N 3.4Å; F163-V167 WeakPolarHBondContact O-CG2 3.45Å; F163-V167 PolarHBondContact O-N 3.38Å |
| 164 | M | 87.4 | Confident | 89.3 | Confident | 48 Ų | 48 | 47.4 Ų | 47.4 | 24% | 0.236 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.6 | -37.9 | 176 | -169.5 | 178 | -167.6 | 0 | 0 | 111.7 | T160 L161 V162 F166 V167 L168 G169 F172 A173 R176 | T160-M164 WeakPolarHBondContact O-CB 3.39Å; T160-M164 PolarHBondContact O-N 2.96Å; L161-M164 PolarHBondContact O-N 2.82Å; V162-M164 VanDerWaalsContact C-N 3.33Å; V162-M164 PolarHBondContact O-N 2.81Å; M164-F166 VanDerWaalsContact C-N 3.34Å; M164-F166 PolarHBondContact O-N 3.34Å; M164-V167 PolarHBondContact O-N 3.42Å; M164-L168 HydrophobicContact CE-CD2 3.83Å; M164-L168 HydrophobicContact CG-CB 4.32Å; M164-L168 PolarHBondContact O-N 2.86Å; M164-G169 PolarHBondContact O-N 2.98Å; M164-F172 HydrophobicContact CE-CB 3.78Å; M164-A173 HydrophobicContact CB-CB 4.36Å; M164-A173 HydrophobicContact CG-CB 4.4Å; M164-R176 HydrophobicContact CE-CB 4.39Å; M164-R176 HydrophobicContact SD-CB 3.89Å; M164-R176 WeakPolarHBondContact SD-CD 3.37Å; M164-R176 HydrophobicContact SD-CG 4.24Å |
| 165 | G | 88 | Confident | 89.5 | Confident | 4 Ų | 4 | 50.8 Ų | 50.8 | 4% | 0.041 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60 | -41.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L161 V162 F163 G169 | L161-G165 PolarHBondContact O-N 3.49Å; V162-G165 PolarHBondContact O-N 3.44Å; F163-G165 VanDerWaalsContact C-N 3.31Å; F163-G165 PolarHBondContact O-N 3.22Å; G165-G169 CarbonylContact O-C 3.59Å; G165-G169 WeakPolarHBondContact O-CA 3.38Å; G165-G169 PolarHBondContact O-N 2.84Å |
| 166 | F | 84.2 | Confident | 89.5 | Confident | 58 Ų | 58 | 54.4 Ų | 54.4 | 25% | 0.254 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -77.1 | -34.4 | 179.1 | -68.6 | -55.5 | 0 | 0 | 0 | 114.6 | A45 H48 V162 F163 M164 W170 | A45-F166 HydrophobicContact CB-CD1 4.5Å; A45-F166 HydrophobicContact CB-CE1 4.03Å; A45-F166 HydrophobicContact CB-CE2 4.13Å; A45-F166 HydrophobicContact CB-CZ 3.83Å; H48-F166 PolarHBondContact ND1-O 3.42Å; V162-F166 HydrophobicContact CG1-CD2 3.85Å; V162-F166 HydrophobicContact CG1-CE2 3.41Å; V162-F166 VanDerWaalsContact CG1-CE2 3.41Å; V162-F166 HydrophobicContact CG1-CZ 4.42Å; V162-F166 WeakPolarHBondContact O-CD2 3.17Å; V162-F166 PolarHBondContact O-N 3.22Å; V162-F166 VanDerWaalsContact O-N 3.13Å; F163-F166 PolarHBondContact O-N 3.4Å; M164-F166 VanDerWaalsContact C-N 3.34Å; M164-F166 PolarHBondContact O-N 3.34Å; F166-W170 HydrophobicContact CE1-CZ2 4.48Å |
| 167 | V | 83.6 | Confident | 89.6 | Confident | 79 Ų | 79 | 57.7 Ų | 57.7 | 48% | 0.479 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -91 | -46.6 | -175.3 | 175.4 | 0 | 0 | 0 | 0 | 113.1 | I50 F163 M164 | I50-V167 HydrophobicContact CD1-CG2 3.61Å; I50-V167 HydrophobicContact CG1-CG2 3.82Å; F163-V167 WeakPolarHBondContact O-CG2 3.45Å; F163-V167 PolarHBondContact O-N 3.38Å; M164-V167 PolarHBondContact O-N 3.42Å |
| 168 | L | 85.1 | Confident | 89.8 | Confident | 97 Ų | 97 | 61.2 Ų | 61.2 | 51% | 0.508 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.2 | -15.3 | -174.8 | -155.4 | 67.5 | 0 | 0 | 0 | 112.7 | M164 F172 | M164-L168 HydrophobicContact CE-CD2 3.83Å; M164-L168 HydrophobicContact CG-CB 4.32Å; M164-L168 PolarHBondContact O-N 2.86Å; L168-F172 HydrophobicContact CB-CB 4.5Å; L168-F172 HydrophobicContact CD2-CB 3.82Å; L168-F172 HydrophobicContact CD2-CD1 4.02Å; L168-F172 HydrophobicContact CD2-CD2 4.03Å; L168-F172 HydrophobicContact CD2-CG 3.71Å; L168-F172 HydrophobicContact CG-CB 4.23Å; L168-F172 HydrophobicContact CG-CD2 3.8Å; L168-F172 HydrophobicContact CG-CE2 4.29Å; L168-F172 HydrophobicContact CG-CG 4Å; L168-F172 WeakPolarHBondContact O-CD2 3.22Å |
| 169 | G | 87.7 | Confident | 90.1 | Very high | 28 Ų | 28 | 61.8 Ų | 61.8 | 29% | 0.289 | 34% | 0.344 | S | S | . | . | trans | 103.9 | 152.4 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | M164 G165 G171 F172 A173 | M164-G169 PolarHBondContact O-N 2.98Å; G165-G169 CarbonylContact O-C 3.59Å; G165-G169 WeakPolarHBondContact O-CA 3.38Å; G165-G169 PolarHBondContact O-N 2.84Å; G169-G171 PolarHBondContact O-N 3.34Å; G169-F172 PolarHBondContact O-N 3.22Å; G169-A173 PolarHBondContact O-N 3.29Å | ||
| 170 | W | 90.9 | Very high | 90.5 | Very high | 160 Ų | 160 | 61.5 Ų | 61.5 | 61% | 0.606 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -63.5 | -25.3 | -175.4 | -72.1 | 104.1 | 0 | 0 | 0 | 114.5 | F166 A173 A174 | F166-W170 HydrophobicContact CE1-CZ2 4.48Å; W170-A173 HydrophobicContact CE3-CB 4.44Å; W170-A173 PolarHBondContact O-N 3.23Å; W170-A174 WeakPolarHBondContact O-CB 3.29Å; W170-A174 PolarHBondContact O-N 3.18Å |
| 171 | G | 92.9 | Very high | 90.9 | Very high | 52 Ų | 52 | 62.3 Ų | 62.3 | 54% | 0.536 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.2 | -47.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | G169 A174 I175 | G169-G171 PolarHBondContact O-N 3.34Å; G171-A174 PolarHBondContact O-N 2.87Å; G171-I175 WeakPolarHBondContact O-CG1 3.13Å; G171-I175 PolarHBondContact O-N 3.48Å |
| 172 | F | 92.1 | Very high | 91.2 | Very high | 117 Ų | 117 | 64.7 Ų | 64.7 | 51% | 0.513 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -68.7 | -36.8 | 177.6 | -71.8 | -83.2 | 0 | 0 | 0 | 112.4 | M164 L168 G169 A174 I175 R176 | M164-F172 HydrophobicContact CE-CB 3.78Å; L168-F172 HydrophobicContact CB-CB 4.5Å; L168-F172 HydrophobicContact CD2-CB 3.82Å; L168-F172 HydrophobicContact CD2-CD1 4.02Å; L168-F172 HydrophobicContact CD2-CD2 4.03Å; L168-F172 HydrophobicContact CD2-CG 3.71Å; L168-F172 HydrophobicContact CG-CB 4.23Å; L168-F172 HydrophobicContact CG-CD2 3.8Å; L168-F172 HydrophobicContact CG-CE2 4.29Å; L168-F172 HydrophobicContact CG-CG 4Å; L168-F172 WeakPolarHBondContact O-CD2 3.22Å; G169-F172 PolarHBondContact O-N 3.22Å; F172-A174 VanDerWaalsContact C-N 3.33Å; F172-A174 PolarHBondContact O-N 3.5Å; F172-I175 PolarHBondContact O-N 3.13Å; F172-R176 WeakPolarHBondContact O-CB 3.23Å; F172-R176 PolarHBondContact O-N 3.29Å |
| 173 | A | 92.4 | Very high | 91.5 | Very high | 4 Ų | 4 | 67 Ų | 67 | 3% | 0.033 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -61.4 | -42 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | M164 G169 W170 R176 L177 | M164-A173 HydrophobicContact CB-CB 4.36Å; M164-A173 HydrophobicContact CG-CB 4.4Å; G169-A173 PolarHBondContact O-N 3.29Å; W170-A173 HydrophobicContact CE3-CB 4.44Å; W170-A173 PolarHBondContact O-N 3.23Å; A173-R176 PolarHBondContact O-N 3.01Å; A173-L177 WeakPolarHBondContact O-CB 3.29Å; A173-L177 PolarHBondContact O-N 3.11Å |
| 174 | A | 94.4 | Very high | 92 | Very high | 51 Ų | 51 | 65.5 Ų | 65.5 | 42% | 0.421 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.8 | -44.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | W170 G171 F172 R176 L177 V178 | W170-A174 WeakPolarHBondContact O-CB 3.29Å; W170-A174 PolarHBondContact O-N 3.18Å; G171-A174 PolarHBondContact O-N 2.87Å; F172-A174 VanDerWaalsContact C-N 3.33Å; F172-A174 PolarHBondContact O-N 3.5Å; A174-R176 VanDerWaalsContact C-N 3.32Å; A174-R176 PolarHBondContact O-N 3.04Å; A174-L177 PolarHBondContact O-N 3.44Å; A174-V178 WeakPolarHBondContact O-CG2 3.29Å; A174-V178 PolarHBondContact O-N 2.9Å |
| 175 | I | 95 | Very high | 92.3 | Very high | 111 Ų | 111 | 64.7 Ų | 64.7 | 57% | 0.569 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -58.9 | -46 | 174.9 | -67.8 | 165.9 | 0 | 0 | 0 | 110.3 | G171 F172 L177 V178 A179 | G171-I175 WeakPolarHBondContact O-CG1 3.13Å; G171-I175 PolarHBondContact O-N 3.48Å; F172-I175 PolarHBondContact O-N 3.13Å; I175-L177 VanDerWaalsContact C-N 3.35Å; I175-L177 PolarHBondContact O-N 2.97Å; I175-V178 PolarHBondContact O-N 2.88Å; I175-A179 WeakPolarHBondContact O-CB 3.47Å; I175-A179 PolarHBondContact O-N 3.37Å |
| 176 | R | 93.8 | Very high | 92.6 | Very high | 109 Ų | 109 | 69 Ų | 69 | 41% | 0.411 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -59.3 | -44.9 | 176.5 | 179.9 | 178.4 | -179.4 | 88.8 | 2.2 | 111.7 | L161 M164 F172 A173 A174 G180 | L161-R176 HydrophobicContact CD2-CB 4.25Å; L161-R176 HydrophobicContact CD2-CG 4.1Å; M164-R176 HydrophobicContact CE-CB 4.39Å; M164-R176 HydrophobicContact SD-CB 3.89Å; M164-R176 WeakPolarHBondContact SD-CD 3.37Å; M164-R176 HydrophobicContact SD-CG 4.24Å; F172-R176 WeakPolarHBondContact O-CB 3.23Å; F172-R176 PolarHBondContact O-N 3.29Å; A173-R176 PolarHBondContact O-N 3.01Å; A174-R176 VanDerWaalsContact C-N 3.32Å; A174-R176 PolarHBondContact O-N 3.04Å; R176-G180 WeakPolarHBondContact O-CA 3.41Å; R176-G180 PolarHBondContact O-N 3.46Å |
| 177 | L | 95.2 | Very high | 93.1 | Very high | 73 Ų | 73 | 69.4 Ų | 69.4 | 38% | 0.382 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.6 | -49.4 | 178.6 | 174.5 | 60.4 | 0 | 0 | 0 | 111.4 | L156 L161 A173 A174 I175 G180 L181 | L156-L177 HydrophobicContact CD2-CD1 3.99Å; L161-L177 HydrophobicContact CD1-CB 4.18Å; L161-L177 HydrophobicContact CD1-CD1 3.76Å; L161-L177 HydrophobicContact CD1-CG 4.37Å; L161-L177 HydrophobicContact CD2-CB 4Å; A173-L177 WeakPolarHBondContact O-CB 3.29Å; A173-L177 PolarHBondContact O-N 3.11Å; A174-L177 PolarHBondContact O-N 3.44Å; I175-L177 VanDerWaalsContact C-N 3.35Å; I175-L177 PolarHBondContact O-N 2.97Å; L177-G180 PolarHBondContact O-N 2.8Å; L177-L181 VanDerWaalsContact O-CB 3.26Å; L177-L181 WeakPolarHBondContact O-CB 3.3Å; L177-L181 PolarHBondContact O-N 2.89Å |
| 178 | V | 95.8 | Very high | 93.5 | Very high | 90 Ų | 90 | 65.6 Ų | 65.6 | 55% | 0.545 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -66 | -50.5 | -178.9 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | A174 I175 G180 L181 V182 | A174-V178 WeakPolarHBondContact O-CG2 3.29Å; A174-V178 PolarHBondContact O-N 2.9Å; I175-V178 PolarHBondContact O-N 2.88Å; V178-G180 VanDerWaalsContact C-N 3.29Å; V178-G180 PolarHBondContact O-N 3.35Å; V178-L181 PolarHBondContact O-N 3.27Å; V178-V182 HydrophobicContact CG1-CG2 4.38Å; V178-V182 WeakPolarHBondContact O-CB 3.27Å; V178-V182 VanDerWaalsContact O-CG2 3.25Å; V178-V182 WeakPolarHBondContact O-CG2 3.46Å; V178-V182 PolarHBondContact O-N 2.94Å |
| 179 | A | 95.8 | Very high | 93.7 | Very high | 52 Ų | 52 | 62.7 Ų | 62.7 | 43% | 0.43 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60.7 | -40.8 | 178 | 0 | 0 | 0 | 0 | 0 | 111.5 | I175 M183 | I175-A179 WeakPolarHBondContact O-CB 3.47Å; I175-A179 PolarHBondContact O-N 3.37Å; A179-M183 WeakPolarHBondContact O-CB 3.42Å; A179-M183 PolarHBondContact O-N 2.84Å |
| 180 | G | 95.4 | Very high | 93.9 | Very high | 5 Ų | 5 | 65.2 Ų | 65.2 | 5% | 0.052 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.8 | -45 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | R176 L177 V178 M183 V184 | R176-G180 WeakPolarHBondContact O-CA 3.41Å; R176-G180 PolarHBondContact O-N 3.46Å; L177-G180 PolarHBondContact O-N 2.8Å; V178-G180 VanDerWaalsContact C-N 3.29Å; V178-G180 PolarHBondContact O-N 3.35Å; G180-M183 PolarHBondContact O-N 3.44Å; G180-V184 VanDerWaalsContact O-CG2 3.26Å; G180-V184 WeakPolarHBondContact O-CG2 3.06Å; G180-V184 PolarHBondContact O-N 3.25Å |
| 181 | L | 95.7 | Very high | 93.8 | Very high | 69 Ų | 69 | 59.3 Ų | 59.3 | 36% | 0.361 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -65.1 | -45.7 | 178.9 | -177.9 | 63.1 | 0 | 0 | 0 | 111 | T116 L156 L177 V178 V184 L185 | T116-L181 HydrophobicContact CG2-CD1 3.91Å; L156-L181 HydrophobicContact CD1-CD1 4.15Å; L156-L181 HydrophobicContact CD2-CB 4.08Å; L177-L181 VanDerWaalsContact O-CB 3.26Å; L177-L181 WeakPolarHBondContact O-CB 3.3Å; L177-L181 PolarHBondContact O-N 2.89Å; V178-L181 PolarHBondContact O-N 3.27Å; L181-V184 PolarHBondContact O-N 3.22Å; L181-L185 HydrophobicContact CD1-CD1 3.92Å; L181-L185 HydrophobicContact CD1-CG 4.16Å; L181-L185 HydrophobicContact CG-CD1 3.97Å; L181-L185 WeakPolarHBondContact O-CB 3.34Å; L181-L185 VanDerWaalsContact O-CG 3.27Å; L181-L185 WeakPolarHBondContact O-CG 3.16Å; L181-L185 PolarHBondContact O-N 3.05Å |
| 182 | V | 95.7 | Very high | 93.5 | Very high | 72 Ų | 72 | 57 Ų | 57 | 44% | 0.436 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -59.1 | -48.5 | 174.8 | 170.5 | 0 | 0 | 0 | 0 | 110.2 | V178 V184 L185 L186 | V178-V182 HydrophobicContact CG1-CG2 4.38Å; V178-V182 WeakPolarHBondContact O-CB 3.27Å; V178-V182 VanDerWaalsContact O-CG2 3.25Å; V178-V182 WeakPolarHBondContact O-CG2 3.46Å; V178-V182 PolarHBondContact O-N 2.94Å; V182-V184 PolarHBondContact O-N 3.45Å; V182-L185 PolarHBondContact O-N 3.49Å; V182-L186 HydrophobicContact CG1-CD1 3.45Å; V182-L186 VanDerWaalsContact CG1-CD1 3.45Å; V182-L186 HydrophobicContact CG1-CG 3.97Å; V182-L186 WeakPolarHBondContact O-CB 3.37Å; V182-L186 WeakPolarHBondContact O-CG 3.44Å; V182-L186 PolarHBondContact O-N 2.85Å |
| 183 | M | 95.4 | Very high | 93.2 | Very high | 97 Ų | 97 | 58.3 Ų | 58.3 | 48% | 0.478 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -58.6 | -48.6 | 179.2 | -179.5 | -179.1 | -65.1 | 0 | 0 | 112.2 | A179 G180 I187 | A179-M183 WeakPolarHBondContact O-CB 3.42Å; A179-M183 PolarHBondContact O-N 2.84Å; G180-M183 PolarHBondContact O-N 3.44Å; M183-I187 HydrophobicContact CG-CD1 3.56Å; M183-I187 HydrophobicContact CG-CG1 4.46Å; M183-I187 VanDerWaalsContact O-CB 3.31Å; M183-I187 WeakPolarHBondContact O-CB 3.39Å; M183-I187 VanDerWaalsContact O-CG1 3.26Å; M183-I187 WeakPolarHBondContact O-CG1 3.32Å; M183-I187 PolarHBondContact O-N 3Å |
| 184 | V | 95.2 | Very high | 93 | Very high | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.8 | -49 | -179.8 | 172.2 | 0 | 0 | 0 | 0 | 110.7 | T116 A148 M151 V155 G180 L181 V182 A188 | T116-V184 HydrophobicContact CG2-CG1 4.2Å; A148-V184 HydrophobicContact CB-CG1 4Å; M151-V184 HydrophobicContact CB-CG2 4.14Å; V155-V184 HydrophobicContact CB-CG2 4.13Å; V155-V184 HydrophobicContact CG1-CG2 4.06Å; G180-V184 VanDerWaalsContact O-CG2 3.26Å; G180-V184 WeakPolarHBondContact O-CG2 3.06Å; G180-V184 PolarHBondContact O-N 3.25Å; L181-V184 PolarHBondContact O-N 3.22Å; V182-V184 PolarHBondContact O-N 3.45Å; V184-A188 WeakPolarHBondContact O-CB 3.06Å; V184-A188 PolarHBondContact O-N 2.82Å |
| 185 | L | 94.5 | Very high | 92.4 | Very high | 30 Ų | 30 | 67.7 Ų | 67.7 | 16% | 0.157 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -66.8 | -43.6 | -178.8 | -66.5 | 177.4 | 0 | 0 | 0 | 111.8 | T112 L113 L181 V182 T189 | T112-L185 HydrophobicContact CG2-CD2 3.87Å; L113-L185 HydrophobicContact CD1-CD2 4.49Å; L181-L185 HydrophobicContact CD1-CD1 3.92Å; L181-L185 HydrophobicContact CD1-CG 4.16Å; L181-L185 HydrophobicContact CG-CD1 3.97Å; L181-L185 WeakPolarHBondContact O-CB 3.34Å; L181-L185 VanDerWaalsContact O-CG 3.27Å; L181-L185 WeakPolarHBondContact O-CG 3.16Å; L181-L185 PolarHBondContact O-N 3.05Å; V182-L185 PolarHBondContact O-N 3.49Å; L185-T189 VanDerWaalsContact O-CB 3.25Å; L185-T189 WeakPolarHBondContact O-CB 3.44Å; L185-T189 WeakPolarHBondContact O-CG2 3.11Å; L185-T189 PolarHBondContact O-N 3.25Å; L185-T189 PolarHBondContact O-OG1 2.79Å |
| 186 | L | 93.9 | Very high | 91.1 | Very high | 96 Ų | 96 | 73.1 Ų | 73.1 | 50% | 0.503 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -63.6 | -51.7 | 178.3 | -72.3 | -178.9 | 0 | 0 | 0 | 111.3 | V182 A188 T189 L190 | V182-L186 HydrophobicContact CG1-CD1 3.45Å; V182-L186 VanDerWaalsContact CG1-CD1 3.45Å; V182-L186 HydrophobicContact CG1-CG 3.97Å; V182-L186 WeakPolarHBondContact O-CB 3.37Å; V182-L186 WeakPolarHBondContact O-CG 3.44Å; V182-L186 PolarHBondContact O-N 2.85Å; L186-A188 PolarHBondContact O-N 3.07Å; L186-T189 PolarHBondContact O-N 2.89Å; L186-T189 PolarHBondContact O-OG1 3.34Å; L186-L190 VanDerWaalsContact O-CB 3.28Å; L186-L190 WeakPolarHBondContact O-CB 3.32Å; L186-L190 WeakPolarHBondContact O-CG 3.23Å; L186-L190 PolarHBondContact O-N 2.89Å |
| 187 | I | 94.1 | Very high | 89.8 | Confident | 65 Ų | 65 | 71.5 Ų | 71.5 | 33% | 0.333 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -64.5 | -46.1 | -177.3 | -66.8 | 172 | 0 | 0 | 0 | 110.4 | L147 M151 M183 T189 L190 V191 | L147-I187 HydrophobicContact CD2-CG2 4.18Å; M151-I187 HydrophobicContact CE-CB 4.33Å; M151-I187 HydrophobicContact CE-CD1 3.7Å; M151-I187 HydrophobicContact CE-CG2 4.17Å; M151-I187 HydrophobicContact SD-CB 4.36Å; M151-I187 HydrophobicContact SD-CG2 3.83Å; M183-I187 HydrophobicContact CG-CD1 3.56Å; M183-I187 HydrophobicContact CG-CG1 4.46Å; M183-I187 VanDerWaalsContact O-CB 3.31Å; M183-I187 WeakPolarHBondContact O-CB 3.39Å; M183-I187 VanDerWaalsContact O-CG1 3.26Å; M183-I187 WeakPolarHBondContact O-CG1 3.32Å; M183-I187 PolarHBondContact O-N 3Å; I187-T189 PolarHBondContact O-N 2.93Å; I187-L190 PolarHBondContact O-N 2.96Å; I187-V191 HydrophobicContact CG2-CG2 4.33Å; I187-V191 WeakPolarHBondContact O-CB 3.42Å; I187-V191 VanDerWaalsContact O-CG2 3.26Å; I187-V191 WeakPolarHBondContact O-CG2 3.23Å; I187-V191 PolarHBondContact O-N 3.36Å |
| 188 | A | 92.2 | Very high | 88 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.1 | -42.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | T112 A148 V184 L186 Q192 | T112-A188 HydrophobicContact CG2-CB 3.52Å; A148-A188 HydrophobicContact CB-CB 3.83Å; V184-A188 WeakPolarHBondContact O-CB 3.06Å; V184-A188 PolarHBondContact O-N 2.82Å; L186-A188 PolarHBondContact O-N 3.07Å; A188-Q192 VanDerWaalsContact O-CB 3.23Å; A188-Q192 WeakPolarHBondContact O-CB 3.41Å; A188-Q192 PolarHBondContact O-N 3.23Å |
| 189 | T | 89.9 | Confident | 86 | Confident | 36 Ų | 36 | 73.9 Ų | 73.9 | 22% | 0.221 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -70.1 | -38.6 | 178 | 55.3 | 0 | 0 | 0 | 0 | 112.9 | F109 T112 L185 L186 I187 Q192 K193 | F109-T189 HydrophobicContact CD2-CG2 3.63Å; F109-T189 HydrophobicContact CE2-CG2 4.08Å; T112-T189 HydrophobicContact CG2-CG2 4.02Å; L185-T189 VanDerWaalsContact O-CB 3.25Å; L185-T189 WeakPolarHBondContact O-CB 3.44Å; L185-T189 WeakPolarHBondContact O-CG2 3.11Å; L185-T189 PolarHBondContact O-N 3.25Å; L185-T189 PolarHBondContact O-OG1 2.79Å; L186-T189 PolarHBondContact O-N 2.89Å; L186-T189 PolarHBondContact O-OG1 3.34Å; I187-T189 PolarHBondContact O-N 2.93Å; T189-Q192 PolarHBondContact O-N 3.1Å; T189-K193 WeakPolarHBondContact O-CB 3.28Å; T189-K193 PolarHBondContact O-N 3.25Å |
| 190 | L | 91.5 | Very high | 84 | Confident | 80 Ų | 80 | 76.6 Ų | 76.6 | 42% | 0.419 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.7 | -48.7 | 175.4 | -74 | 173.3 | 0 | 0 | 0 | 111.1 | L186 I187 Q192 K193 W194 | L186-L190 VanDerWaalsContact O-CB 3.28Å; L186-L190 WeakPolarHBondContact O-CB 3.32Å; L186-L190 WeakPolarHBondContact O-CG 3.23Å; L186-L190 PolarHBondContact O-N 2.89Å; I187-L190 PolarHBondContact O-N 2.96Å; L190-Q192 VanDerWaalsContact C-N 3.28Å; L190-Q192 PolarHBondContact O-N 3.35Å; L190-K193 WeakPolarHBondContact O-CB 3.49Å; L190-K193 PolarHBondContact O-N 3.01Å; L190-W194 PolarHBondContact O-N 3.05Å |
| 191 | V | 90 | Very high | 81.5 | Confident | 37 Ų | 37 | 82.8 Ų | 82.8 | 22% | 0.224 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -59.4 | -43.1 | 176.5 | 170.5 | 0 | 0 | 0 | 0 | 110.5 | L147 I187 K193 W194 V195 | L147-V191 HydrophobicContact CD2-CB 3.9Å; L147-V191 HydrophobicContact CD2-CG1 4Å; L147-V191 HydrophobicContact CD2-CG2 3.76Å; I187-V191 HydrophobicContact CG2-CG2 4.33Å; I187-V191 WeakPolarHBondContact O-CB 3.42Å; I187-V191 VanDerWaalsContact O-CG2 3.26Å; I187-V191 WeakPolarHBondContact O-CG2 3.23Å; I187-V191 PolarHBondContact O-N 3.36Å; V191-K193 VanDerWaalsContact C-N 3.26Å; V191-K193 PolarHBondContact O-N 2.88Å; V191-W194 PolarHBondContact O-N 3.35Å; V191-V195 HydrophobicContact CG1-CG2 3.89Å; V191-V195 WeakPolarHBondContact O-CB 3.32Å; V191-V195 VanDerWaalsContact O-CG2 3.31Å; V191-V195 WeakPolarHBondContact O-CG2 3.27Å; V191-V195 PolarHBondContact O-N 3.11Å |
| 192 | Q | 86 | Confident | 79 | Confident | 2 Ų | 2 | 86.1 Ų | 86.1 | 1% | 0.009 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -66.8 | -25.5 | 177.3 | -172.7 | 167.9 | 29.1 | 0 | 0 | 114.1 | R108 T112 S142 A188 T189 L190 | R108-Q192 VanDerWaalsContact CA-CD 3.47Å; R108-Q192 HydrophobicContact CB-CG 4.12Å; R108-Q192 HydrophobicContact CG-CG 3.83Å; R108-Q192 PolarHBondContact NE-O 2.96Å; R108-Q192 VanDerWaalsContact NE-O 3.08Å; R108-Q192 PolarHBondContact O-OE1 3.42Å; T112-Q192 PolarHBondContact OG1-OE1 2.83Å; S142-Q192 VanDerWaalsContact CB-NE2 3.3Å; A188-Q192 VanDerWaalsContact O-CB 3.23Å; A188-Q192 WeakPolarHBondContact O-CB 3.41Å; A188-Q192 PolarHBondContact O-N 3.23Å; T189-Q192 PolarHBondContact O-N 3.1Å; L190-Q192 VanDerWaalsContact C-N 3.28Å; L190-Q192 PolarHBondContact O-N 3.35Å |
| 193 | K | 86 | Confident | 76.8 | Confident | 146 Ų | 146 | 86.6 Ų | 86.6 | 64% | 0.635 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -75.9 | -37.8 | 173.4 | -172.8 | 177.2 | 177 | -177.5 | 0 | 111.4 | T189 L190 V191 | T189-K193 WeakPolarHBondContact O-CB 3.28Å; T189-K193 PolarHBondContact O-N 3.25Å; L190-K193 WeakPolarHBondContact O-CB 3.49Å; L190-K193 PolarHBondContact O-N 3.01Å; V191-K193 VanDerWaalsContact C-N 3.26Å; V191-K193 PolarHBondContact O-N 2.88Å |
| 194 | W | 86.7 | Confident | 74.5 | Confident | 197 Ų | 197 | 86.8 Ų | 86.8 | 75% | 0.746 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -82.6 | -36.8 | -177.3 | -66.6 | -12.4 | 0 | 0 | 0 | 113.6 | L190 V191 R196 | L190-W194 PolarHBondContact O-N 3.05Å; V191-W194 PolarHBondContact O-N 3.35Å; W194-R196 PolarHBondContact O-N 3.41Å |
| 195 | V | 82.6 | Confident | 72.4 | Confident | 55 Ų | 55 | 90.9 Ų | 90.9 | 33% | 0.333 | 48% | 0.476 | S | S | . | . | S | Bend | trans | -77.1 | 110.5 | 177.6 | -178.9 | 0 | 0 | 0 | 0 | 108.5 | M143 V191 E197 | M143-V195 HydrophobicContact CG-CB 4.38Å; M143-V195 HydrophobicContact CG-CG1 3.93Å; V191-V195 HydrophobicContact CG1-CG2 3.89Å; V191-V195 WeakPolarHBondContact O-CB 3.32Å; V191-V195 VanDerWaalsContact O-CG2 3.31Å; V191-V195 WeakPolarHBondContact O-CG2 3.27Å; V191-V195 PolarHBondContact O-N 3.11Å; V195-E197 PolarHBondContact O-N 3.3Å |
| 196 | R | 67.3 | Low | 70.4 | Confident | 224 Ų | 224 | 95.6 Ų | 95.6 | 85% | 0.845 | 50% | 0.501 | S | S | * | . | trans | -64.4 | 107.3 | 164 | -67.5 | -180 | -177.5 | -103.8 | 0.9 | 106.6 | W194 T198 | W194-R196 PolarHBondContact O-N 3.41Å; R196-T198 PolarHBondContact O-N 3.19Å | ||
| 197 | E | 67 | Low | 68.4 | Low | 76 Ų | 76 | 93.3 Ų | 93.3 | 36% | 0.355 | 50% | 0.501 | S | S | . | . | trans | -68.2 | 85 | 173 | -76.6 | 141.3 | 157.8 | 0 | 0 | 108.3 | M143 V195 | M143-E197 HydrophobicContact CG-CG 4.32Å; M143-E197 PolarHBondContact N-OE1 3.15Å; V195-E197 PolarHBondContact O-N 3.3Å | ||
| 198 | T | 57.5 | Low | 66.1 | Low | 106 Ų | 106 | 96.6 Ų | 96.6 | 65% | 0.65 | 52% | 0.515 | S | S | * | . | trans | -61.1 | 128.8 | 162 | -44.6 | 0 | 0 | 0 | 0 | 106.2 | R196 Q200 | R196-T198 PolarHBondContact O-N 3.19Å; T198-Q200 PolarHBondContact O-N 2.82Å | ||
| 199 | P | 54.7 | Low | 63.9 | Low | 106 Ų | 106 | 98.3 Ų | 98.3 | 69% | 0.688 | 53% | 0.533 | S | S | * | . | trans | -50.4 | 113 | 171.2 | -22 | 31.2 | 0 | 0 | 0 | 106.9 | T201 | P199-T201 VanDerWaalsContact C-N 3.34Å; P199-T201 PolarHBondContact O-N 3Å | ||
| 200 | Q | 52.6 | Low | 61.9 | Low | 110 Ų | 110 | 99.3 Ų | 99.3 | 51% | 0.514 | 55% | 0.545 | S | S | . | . | trans | -69.8 | 101.8 | -175.9 | -74.5 | -113.3 | -45.6 | 0 | 0 | 105.8 | Q140 T198 Q202 | Q140-Q200 VanDerWaalsContact NE2-CB 3.33Å; Q140-Q200 PolarHBondContact NE2-O 2.92Å; T198-Q200 PolarHBondContact O-N 2.82Å; Q200-Q202 PolarHBondContact O-N 2.9Å; Q200-Q202 VanDerWaalsContact O-N 3.16Å | ||
| 201 | T | 43.7 | Very low | 60 | Low | 134 Ų | 134 | 102 Ų | 102 | 82% | 0.822 | 56% | 0.557 | S | S | * | * | trans | -45.9 | 123.6 | 170.8 | -53.6 | 0 | 0 | 0 | 0 | 107.2 | P199 A203 | P199-T201 VanDerWaalsContact C-N 3.34Å; P199-T201 PolarHBondContact O-N 3Å; T201-A203 PolarHBondContact O-N 3.1Å | ||
| 202 | Q | 43.5 | Very low | 58.2 | Low | 139 Ų | 139 | 104.7 Ų | 104.7 | 65% | 0.65 | 57% | 0.57 | S | S | * | * | trans | -42 | 114.1 | -176.4 | -62 | 173.9 | -14.9 | 0 | 0 | 109.3 | Q200 | Q200-Q202 PolarHBondContact O-N 2.9Å; Q200-Q202 VanDerWaalsContact O-N 3.16Å | ||
| 203 | A | 49.2 | Very low | 56.6 | Low | 82 Ų | 82 | 107.6 Ų | 107.6 | 68% | 0.678 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 129.1 | 161 | 0 | 0 | 0 | 0 | 0 | 105.8 | T201 | T201-A203 PolarHBondContact O-N 3.1Š|
| 204 | P | 46.5 | Very low | 55.1 | Low | 102 Ų | 102 | 108.6 Ų | 108.6 | 66% | 0.662 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -53 | 145.3 | -179.9 | 20.1 | -30.1 | 0 | 0 | 0 | 109.2 | L206 | P204-L206 PolarHBondContact O-N 3.07Š|
| 205 | P | 50.4 | Low | 53.8 | Low | 86 Ų | 86 | 106.1 Ų | 106.1 | 56% | 0.558 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 117.2 | -176.3 | 17.9 | -29.7 | 0 | 0 | 0 | 110.3 | G207 Q208 | P205-G207 PolarHBondContact O-N 3.16Å; P205-Q208 PolarHBondContact O-N 3.22Å |
| 206 | L | 53.6 | Low | 52.6 | Low | 128 Ų | 128 | 111.5 Ų | 111.5 | 67% | 0.67 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | 67.6 | 179.8 | -154.1 | -167.6 | 0 | 0 | 0 | 109 | P204 A210 | P204-L206 PolarHBondContact O-N 3.07Å; L206-A210 HydrophobicContact CD2-CB 4.3Å |
| 207 | G | 50.9 | Low | 52.1 | Low | 49 Ų | 49 | 108.8 Ų | 108.8 | 51% | 0.505 | 61% | 0.612 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -178.2 | -18.2 | -174 | 0 | 0 | 0 | 0 | 0 | 113.5 | P205 | P205-G207 PolarHBondContact O-N 3.16Š|
| 208 | Q | 47.1 | Very low | 51.5 | Low | 133 Ų | 133 | 110 Ų | 110 | 62% | 0.621 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.7 | -58.1 | 168.9 | -74.5 | 169.5 | -13.4 | 0 | 0 | 109.3 | P205 A210 M211 D212 | P205-Q208 PolarHBondContact O-N 3.22Å; Q208-A210 VanDerWaalsContact C-N 3.28Å; Q208-A210 PolarHBondContact O-N 3.44Å; Q208-M211 PolarHBondContact O-N 3.25Å; Q208-M211 VanDerWaalsContact O-N 3.09Å; Q208-D212 WeakPolarHBondContact O-CB 3.32Å; Q208-D212 PolarHBondContact O-N 3.08Å |
| 209 | G | 44.3 | Very low | 51.6 | Low | 37 Ų | 37 | 110.1 Ų | 110.1 | 38% | 0.381 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -63.9 | -19.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | A213 | G209-A213 WeakPolarHBondContact O-CB 3.45Å; G209-A213 PolarHBondContact O-N 3.43Å |
| 210 | A | 49.1 | Very low | 51.7 | Low | 57 Ų | 57 | 107.8 Ų | 107.8 | 47% | 0.471 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -86.3 | -29.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | L206 Q208 F214 | L206-A210 HydrophobicContact CD2-CB 4.3Å; Q208-A210 VanDerWaalsContact C-N 3.28Å; Q208-A210 PolarHBondContact O-N 3.44Å; A210-F214 VanDerWaalsContact O-CB 3.27Å; A210-F214 WeakPolarHBondContact O-CB 3.38Å; A210-F214 PolarHBondContact O-N 2.69Å |
| 211 | M | 51.1 | Low | 51.6 | Low | 136 Ų | 136 | 109.2 Ų | 109.2 | 67% | 0.67 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -77.2 | -40.4 | 169.5 | -78.4 | -174.2 | 149.4 | 0 | 0 | 109.9 | Q208 F214 L215 | Q208-M211 PolarHBondContact O-N 3.25Å; Q208-M211 VanDerWaalsContact O-N 3.09Å; M211-F214 PolarHBondContact O-N 3.39Å; M211-L215 WeakPolarHBondContact O-CB 3.34Å; M211-L215 VanDerWaalsContact O-CG 3.28Å; M211-L215 WeakPolarHBondContact O-CG 3.27Å; M211-L215 PolarHBondContact O-N 2.95Å |
| 212 | D | 51.8 | Low | 51.8 | Low | 93 Ų | 93 | 110.4 Ų | 110.4 | 50% | 0.497 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -63 | -44.6 | 174.5 | -56 | -29.1 | 0 | 0 | 0 | 110.5 | Q208 F214 L215 E216 | Q208-D212 WeakPolarHBondContact O-CB 3.32Å; Q208-D212 PolarHBondContact O-N 3.08Å; D212-F214 VanDerWaalsContact C-N 3.32Å; D212-F214 PolarHBondContact O-N 3.47Å; D212-L215 PolarHBondContact O-N 2.96Å; D212-E216 WeakPolarHBondContact O-CB 3.44Å; D212-E216 PolarHBondContact O-N 3.2Å |
| 213 | A | 53.8 | Low | 51.9 | Low | 63 Ų | 63 | 110 Ų | 110 | 52% | 0.521 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -71 | -21.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | G209 Y217 | G209-A213 WeakPolarHBondContact O-CB 3.45Å; G209-A213 PolarHBondContact O-N 3.43Å; A213-Y217 WeakPolarHBondContact O-CB 3.39Å; A213-Y217 PolarHBondContact O-N 2.9Å |
| 214 | F | 53.5 | Low | 51.8 | Low | 167 Ų | 167 | 112 Ų | 112 | 73% | 0.732 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -85.6 | -30 | 174.4 | -161.8 | 75.2 | 0 | 0 | 0 | 111.9 | A210 M211 D212 | A210-F214 VanDerWaalsContact O-CB 3.27Å; A210-F214 WeakPolarHBondContact O-CB 3.38Å; A210-F214 PolarHBondContact O-N 2.69Å; M211-F214 PolarHBondContact O-N 3.39Å; D212-F214 VanDerWaalsContact C-N 3.32Å; D212-F214 PolarHBondContact O-N 3.47Å |
| 215 | L | 58.7 | Low | 51.9 | Low | 146 Ų | 146 | 112.1 Ų | 112.1 | 76% | 0.764 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -76.9 | -30.4 | 170.5 | -70.3 | 172.9 | 0 | 0 | 0 | 112.1 | M211 D212 Y217 | M211-L215 WeakPolarHBondContact O-CB 3.34Å; M211-L215 VanDerWaalsContact O-CG 3.28Å; M211-L215 WeakPolarHBondContact O-CG 3.27Å; M211-L215 PolarHBondContact O-N 2.95Å; D212-L215 PolarHBondContact O-N 2.96Å; L215-Y217 VanDerWaalsContact C-N 3.35Å |
| 216 | E | 59 | Low | 51.6 | Low | 168 Ų | 168 | 113.9 Ų | 113.9 | 79% | 0.785 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -87.1 | -4.3 | 175.1 | -153 | 114.5 | 133.8 | 0 | 0 | 112.8 | D212 D218 | D212-E216 WeakPolarHBondContact O-CB 3.44Å; D212-E216 PolarHBondContact O-N 3.2Å; E216-D218 PolarHBondContact O-N 3.41Å |
| 217 | Y | 56.1 | Low | 50.9 | Low | 166 Ų | 166 | 112 Ų | 112 | 65% | 0.651 | 67% | 0.667 | S | S | * | * | trans | -76.4 | 77.1 | 170 | -170.6 | -99.5 | 0 | 0 | 0 | 109.3 | A213 L215 P219 | A213-Y217 WeakPolarHBondContact O-CB 3.39Å; A213-Y217 PolarHBondContact O-N 2.9Å; L215-Y217 VanDerWaalsContact C-N 3.35Å; Y217-P219 HydrophobicContact CE1-CB 4.22Å; Y217-P219 VanDerWaalsContact O-CD 3.3Å; Y217-P219 WeakPolarHBondContact O-CD 3.47Å | ||
| 218 | D | 54.3 | Low | 50.5 | Low | 103 Ų | 103 | 116.2 Ų | 116.2 | 55% | 0.551 | 68% | 0.682 | S | S | * | * | trans | -82.9 | 109.3 | 162.6 | -166.2 | -47.7 | 0 | 0 | 0 | 108.1 | E216 G220 L221 | E216-D218 PolarHBondContact O-N 3.41Å; D218-G220 PolarHBondContact O-N 2.99Å; D218-G220 WeakPolarHBondContact OD1-CA 3.04Å; D218-G220 PolarHBondContact OD1-N 3.5Å; D218-L221 PolarHBondContact O-N 3.06Å | ||
| 219 | P | 60.1 | Low | 50 | Low | 108 Ų | 108 | 113.2 Ų | 113.2 | 70% | 0.701 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | -1.7 | -179.4 | 26.7 | -33.2 | 0 | 0 | 0 | 113.6 | Y217 | Y217-P219 HydrophobicContact CE1-CB 4.22Å; Y217-P219 VanDerWaalsContact O-CD 3.3Å; Y217-P219 WeakPolarHBondContact O-CD 3.47Å |
| 220 | G | 57.2 | Low | 49.7 | Very low | 57 Ų | 57 | 118.2 Ų | 118.2 | 59% | 0.588 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.8 | -7.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | D218 | D218-G220 PolarHBondContact O-N 2.99Å; D218-G220 WeakPolarHBondContact OD1-CA 3.04Å; D218-G220 PolarHBondContact OD1-N 3.5Å |
| 221 | L | 49.1 | Very low | 49.2 | Very low | 140 Ų | 140 | 126.9 Ų | 126.9 | 73% | 0.733 | 74% | 0.735 | S | S | * | * | trans | -105.4 | 83.6 | -174.9 | -120 | 84.7 | 0 | 0 | 0 | 112.6 | D218 P223 | D218-L221 PolarHBondContact O-N 3.06Å; L221-P223 VanDerWaalsContact O-CD 3.28Å; L221-P223 WeakPolarHBondContact O-CD 3.3Å | ||
| 222 | H | 48.1 | Very low | 48.9 | Very low | 159 Ų | 159 | 126.6 Ų | 126.6 | 74% | 0.736 | 74% | 0.741 | S | S | * | * | trans | -68.8 | 116 | 161.5 | -93.3 | -108.4 | 0 | 0 | 0 | 109.7 | C224 | H222-C224 PolarHBondContact O-N 3.33Š| ||
| 223 | P | 46.6 | Very low | 48.1 | Very low | 129 Ų | 129 | 133.3 Ų | 133.3 | 84% | 0.838 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.3 | 41.2 | -176.1 | 34.4 | -34.4 | 0 | 0 | 0 | 113.1 | L221 | L221-P223 VanDerWaalsContact O-CD 3.28Å; L221-P223 WeakPolarHBondContact O-CD 3.3Å |
| 224 | C | 46.9 | Very low | 47.5 | Very low | 125 Ų | 125 | 137.2 Ų | 137.2 | 85% | 0.845 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.3 | 0.3 | -177 | -110.6 | 0 | 0 | 0 | 0 | 115.8 | H222 | H222-C224 PolarHBondContact O-N 3.33Š|
| 225 | S | 47.8 | Very low | 47.2 | Very low | 105 Ų | 105 | 135.6 Ų | 135.6 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -111.4 | -7 | -170.4 | 71.3 | 0 | 0 | 0 | 0 | 116.8 | ||
| 226 | T | 43.8 | Very low | 46.8 | Very low | 123 Ų | 123 | 134.5 Ų | 134.5 | 76% | 0.755 | 77% | 0.768 | S | S | * | * | trans | -124.3 | 98.7 | -178.1 | 53.3 | 0 | 0 | 0 | 0 | 112 | V228 | T226-V228 VanDerWaalsContact C-N 3.26Å; T226-V228 PolarHBondContact O-N 3.21Å | ||
| 227 | G | 38.7 | Very low | 46.3 | Very low | 89 Ų | 89 | 131.3 Ų | 131.3 | 92% | 0.918 | 76% | 0.762 | S | S | * | * | trans | -71.2 | 64.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 228 | V | 43.2 | Very low | 46 | Very low | 136 Ų | 136 | 129.1 Ų | 129.1 | 82% | 0.824 | 77% | 0.768 | S | S | * | * | trans | -137 | 103 | 173.9 | -170.7 | 0 | 0 | 0 | 0 | 110.3 | T226 | T226-V228 VanDerWaalsContact C-N 3.26Å; T226-V228 PolarHBondContact O-N 3.21Å | ||
| 229 | G | 37.4 | Very low | 45.3 | Very low | 70 Ų | 70 | 129.9 Ų | 129.9 | 72% | 0.722 | 78% | 0.78 | S | S | * | * | trans | 81.2 | 66 | 148.5 | 0 | 0 | 0 | 0 | 0 | 119.1 | R231 | G229-R231 VanDerWaalsContact C-N 3.29Å; G229-R231 PolarHBondContact O-N 3.31Å | ||
| 230 | C | 38.2 | Very low | 44.7 | Very low | 143 Ų | 143 | 136 Ų | 136 | 97% | 0.966 | 79% | 0.789 | S | S | * | * | trans | -70.8 | 81.8 | 158.8 | -91.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 231 | R | 38.3 | Very low | 44.1 | Very low | 239 Ų | 239 | 145.2 Ų | 145.2 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | trans | -128.7 | 54.5 | 163.9 | -95.7 | -166.8 | -165.3 | -141.8 | 5.3 | 111.1 | G229 | G229-R231 VanDerWaalsContact C-N 3.29Å; G229-R231 PolarHBondContact O-N 3.31Å | ||
| 232 | T | 45.2 | Very low | 43.9 | Very low | 130 Ų | 130 | 144.1 Ų | 144.1 | 80% | 0.798 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -149.2 | 88.2 | 165.6 | -6.5 | 0 | 0 | 0 | 0 | 110.9 | L234 | T232-L234 PolarHBondContact O-N 3.05Š|
| 233 | R | 34.8 | Very low | 43.4 | Very low | 234 Ų | 234 | 142.8 Ų | 142.8 | 88% | 0.883 | 82% | 0.816 | S | S | * | * | trans | 17.1 | 77.6 | 139.8 | -160.2 | 179.2 | -84.8 | -137.1 | -0.3 | 116.2 | V235 | R233-V235 HydrophobicContact CG-CG2 4.46Š| ||
| 234 | L | 41.5 | Very low | 43.1 | Very low | 145 Ų | 145 | 151.6 Ų | 151.6 | 76% | 0.759 | 83% | 0.832 | S | S | * | * | trans | -109.3 | 98.1 | 154.6 | -134.6 | 90.1 | 0 | 0 | 0 | 108 | T232 I236 | T232-L234 PolarHBondContact O-N 3.05Å; L234-I236 VanDerWaalsContact C-N 3.27Å; L234-I236 HydrophobicContact CD2-CD1 3.96Å; L234-I236 HydrophobicContact CD2-CG1 3.85Å; L234-I236 PolarHBondContact O-N 3.07Å | ||
| 235 | V | 45.6 | Very low | 43 | Very low | 132 Ų | 132 | 152.9 Ų | 152.9 | 80% | 0.8 | 83% | 0.832 | S | S | * | * | trans | -78.7 | 83.5 | 172.2 | -178.7 | 0 | 0 | 0 | 0 | 107 | R233 | R233-V235 HydrophobicContact CG-CG2 4.46Š| ||
| 236 | I | 51.4 | Low | 42.7 | Very low | 124 Ų | 124 | 155.4 Ų | 155.4 | 64% | 0.636 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 119.6 | 164.8 | -60.9 | 167 | 0 | 0 | 0 | 106.2 | L234 | L234-I236 VanDerWaalsContact C-N 3.27Å; L234-I236 HydrophobicContact CD2-CD1 3.96Å; L234-I236 HydrophobicContact CD2-CG1 3.85Å; L234-I236 PolarHBondContact O-N 3.07Å |
| 237 | P | 49 | Very low | 42.6 | Very low | 101 Ų | 101 | 157.2 Ų | 157.2 | 66% | 0.656 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 133.9 | 173.2 | 26.4 | -31.7 | 0 | 0 | 0 | 109 | C239 | P237-C239 PolarHBondContact O-N 3.13Š|
| 238 | P | 48.7 | Very low | 42.9 | Very low | 120 Ų | 120 | 161.2 Ų | 161.2 | 78% | 0.779 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 121.6 | -176.2 | 24.1 | -32 | 0 | 0 | 0 | 110.4 | R240 | P238-R240 PolarHBondContact O-N 2.94Š|
| 239 | C | 40.3 | Very low | 42.9 | Very low | 119 Ų | 119 | 162.8 Ų | 162.8 | 80% | 0.804 | 84% | 0.838 | S | S | * | * | trans | -58.4 | 103.2 | 164.6 | -90.4 | 0 | 0 | 0 | 0 | 109.2 | P237 W241 | P237-C239 PolarHBondContact O-N 3.13Å; C239-W241 PolarHBondContact O-N 3.32Å; C239-W241 VanDerWaalsContact O-N 3.16Å | ||
| 240 | R | 47.7 | Very low | 43.2 | Very low | 237 Ų | 237 | 169 Ų | 169 | 89% | 0.894 | 85% | 0.846 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | 14.8 | -178.2 | -135.4 | 173 | -169.2 | -109.9 | 3.1 | 114.2 | P238 | P238-R240 PolarHBondContact O-N 2.94Š|
| 241 | W | 44.8 | Very low | 43.6 | Very low | 249 Ų | 249 | 170.9 Ų | 170.9 | 94% | 0.943 | 84% | 0.837 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.9 | -0.1 | -175.8 | -82.1 | 92.6 | 0 | 0 | 0 | 114.9 | C239 | C239-W241 PolarHBondContact O-N 3.32Å; C239-W241 VanDerWaalsContact O-N 3.16Å |
| 242 | C | 44.8 | Very low | 44 | Very low | 117 Ų | 117 | 165.6 Ų | 165.6 | 79% | 0.791 | 83% | 0.832 | S | S | * | * | S | Bend | trans | -99 | 5 | 178.7 | -131.9 | 0 | 0 | 0 | 0 | 114.5 | ||
| 243 | C | 36 | Very low | 43.9 | Very low | 132 Ų | 132 | 168.6 Ų | 168.6 | 89% | 0.892 | 84% | 0.835 | S | S | * | * | trans | -115 | 67.8 | 173.1 | -76 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 244 | R | 42.1 | Very low | 44.7 | Very low | 313 Ų | 313 | 162.6 Ų | 162.6 | 100% | 1.181 | 83% | 0.83 | S | S | * | * | trans | -160.4 | 0 | 150.7 | -139.2 | -177.9 | -131 | -114.8 | 1.3 | 108.3 |
Retrieved 244 of 244 residues in 1710.8 ms
(Link to these results)