| 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 | 37.2 | Very low | 39.9 | Very low | 231 Ų | 231 | 161.5 Ų | 161.5 | 100% | 1.138 | 78% | 0.784 | S | S | * | * | 0 | 85.4 | 0 | -76.7 | 170.6 | 176.1 | 0 | 0 | 104.6 | |||||
| 2 | D | 34.8 | Very low | 40.6 | Very low | 154 Ų | 154 | 150.8 Ų | 150.8 | 82% | 0.824 | 73% | 0.733 | S | S | * | * | trans | -97.8 | 92 | -179.5 | -71.6 | -67.9 | 0 | 0 | 0 | 107.5 | K4 | D2-K4 VanDerWaalsContact C-N 3.28Å; D2-K4 PolarHBondContact O-N 2.92Å | ||
| 3 | D | 38.1 | Very low | 41.3 | Very low | 159 Ų | 159 | 147.8 Ų | 147.8 | 85% | 0.85 | 71% | 0.709 | S | S | * | * | trans | -69.1 | 90.3 | 166.6 | -76.7 | -37.3 | 0 | 0 | 0 | 108 | E5 | D3-E5 PolarHBondContact O-N 3.49Š| ||
| 4 | K | 37.1 | Very low | 42 | Very low | 194 Ų | 194 | 143.9 Ų | 143.9 | 84% | 0.843 | 69% | 0.694 | S | S | * | * | trans | -70.7 | 95.2 | 165.8 | -76.8 | -177.1 | 178.3 | 176.3 | 0 | 108.1 | D2 | D2-K4 VanDerWaalsContact C-N 3.28Å; D2-K4 PolarHBondContact O-N 2.92Å | ||
| 5 | E | 31.6 | Very low | 42.6 | Very low | 179 Ų | 179 | 146 Ų | 146 | 84% | 0.836 | 69% | 0.692 | S | S | * | * | trans | -48.8 | 128.8 | 162.4 | -80.8 | -178.6 | 148.9 | 0 | 0 | 109.5 | D3 K7 | D3-E5 PolarHBondContact O-N 3.49Å; E5-K7 PolarHBondContact O-N 3.16Å | ||
| 6 | P | 37.9 | Very low | 43.1 | Very low | 120 Ų | 120 | 137.9 Ų | 137.9 | 78% | 0.779 | 65% | 0.654 | S | S | * | * | trans | -66.9 | 127.8 | 174.4 | 26.6 | -30.2 | 0 | 0 | 0 | 108.2 | R8 | P6-R8 PolarHBondContact O-N 3.46Š| ||
| 7 | K | 44.2 | Very low | 43.6 | Very low | 198 Ų | 198 | 133.9 Ų | 133.9 | 86% | 0.861 | 64% | 0.643 | S | S | * | * | trans | -45.4 | 103.1 | 179.1 | -71.2 | 175.6 | 177.9 | 178.1 | 0 | 109.9 | E5 | E5-K7 PolarHBondContact O-N 3.16Š| ||
| 8 | R | 39.4 | Very low | 44 | Very low | 230 Ų | 230 | 132.1 Ų | 132.1 | 87% | 0.868 | 65% | 0.647 | S | S | * | * | trans | -50.1 | 138.9 | 168.7 | -141.8 | 171 | -178.3 | -176.3 | -0.9 | 106.6 | P6 P10 | P6-R8 PolarHBondContact O-N 3.46Å; R8-P10 WeakPolarHBondContact O-CD 3.2Å | ||
| 9 | W | 43.7 | Very low | 44.4 | Very low | 135 Ų | 135 | 131.7 Ų | 131.7 | 51% | 0.511 | 65% | 0.648 | S | S | . | * | trans | -95.4 | 40.5 | -173.8 | -152.2 | -91 | 0 | 0 | 0 | 116.3 | T11 I157 | W9-T11 VanDerWaalsContact C-N 3.28Å; W9-T11 PolarHBondContact O-N 2.95Å; W9-T11 VanDerWaalsContact O-N 3.07Å; W9-I157 HydrophobicContact CH2-CD1 4.47Å; W9-I157 HydrophobicContact CH2-CG2 3.73Å; W9-I157 HydrophobicContact CZ2-CG2 3.94Å | ||
| 10 | P | 44.3 | Very low | 44.6 | Very low | 78 Ų | 78 | 127.8 Ų | 127.8 | 51% | 0.506 | 64% | 0.643 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.2 | 48.5 | -177.2 | 37.9 | -34.1 | 0 | 0 | 0 | 113.4 | R8 | R8-P10 WeakPolarHBondContact O-CD 3.2Š|
| 11 | T | 50.5 | Low | 45.2 | Very low | 98 Ų | 98 | 122.7 Ų | 122.7 | 60% | 0.601 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.9 | -30.2 | 177.3 | 47.1 | 0 | 0 | 0 | 0 | 114.3 | W9 R15 | W9-T11 VanDerWaalsContact C-N 3.28Å; W9-T11 PolarHBondContact O-N 2.95Å; W9-T11 VanDerWaalsContact O-N 3.07Å; T11-R15 WeakPolarHBondContact O-CB 3.29Å; T11-R15 WeakPolarHBondContact O-CD 3.3Å; T11-R15 VanDerWaalsContact O-CG 3.26Å; T11-R15 WeakPolarHBondContact O-CG 3.46Å; T11-R15 PolarHBondContact O-N 3.34Å |
| 12 | L | 47.9 | Very low | 45.7 | Very low | 34 Ų | 34 | 118.9 Ų | 118.9 | 18% | 0.178 | 60% | 0.6 | C | S | . | * | H | α-helix | trans | -81.1 | -39.8 | 179.6 | -169.6 | 59 | 0 | 0 | 0 | 112.1 | L16 V139 | L12-L16 HydrophobicContact CD1-CD1 4.45Å; L12-L16 HydrophobicContact CG-CD1 4.02Å; L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CD1 3.48Å; L12-L16 WeakPolarHBondContact O-CG 3.29Å; L12-L16 PolarHBondContact O-N 3.25Å; L12-V139 HydrophobicContact CB-CG1 4.18Å; L12-V139 HydrophobicContact CD2-CB 4.11Å; L12-V139 HydrophobicContact CD2-CG1 3.83Å; L12-V139 HydrophobicContact CD2-CG2 3.85Å; L12-V139 HydrophobicContact CG-CG1 3.98Å |
| 13 | R | 49.6 | Very low | 46.6 | Very low | 112 Ų | 112 | 114.5 Ų | 114.5 | 42% | 0.423 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.4 | -49.2 | 176.9 | 178.3 | -172.9 | 175.2 | 153 | 12 | 112.1 | R15 L16 C17 E142 | R13-R15 VanDerWaalsContact C-N 3.3Å; R13-R15 PolarHBondContact O-N 2.69Å; R13-L16 PolarHBondContact O-N 3.25Å; R13-C17 PolarHBondContact O-N 3.16Å; R13-E142 VanDerWaalsContact CZ-CD 3.44Å; R13-E142 IonicContact CZ-OE1 3.62Å; R13-E142 IonicContact CZ-OE2 2.61Å; R13-E142 IonicContact NE-OE1 3.29Å; R13-E142 IonicContact NH1-OE1 2.84Å; R13-E142 PolarHBondContact NH1-OE1 2.98Å; R13-E142 VanDerWaalsContact NH1-OE1 3.07Å; R13-E142 IonicContact NH1-OE2 3.28Å; R13-E142 PolarHBondContact NH1-OE2 2.69Å; R13-E142 IonicContact NH2-OE1 3.78Å; R13-E142 PolarHBondContact NH2-OE1 3.49Å; R13-E142 IonicContact NH2-OE2 3.66Å |
| 14 | D | 51.8 | Low | 47.3 | Very low | 92 Ų | 92 | 109.5 Ų | 109.5 | 49% | 0.492 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -67.8 | -33.8 | -176.6 | -64.8 | -27.6 | 0 | 0 | 0 | 111.4 | S18 | D14-S18 VanDerWaalsContact O-CB 3.31Å; D14-S18 WeakPolarHBondContact O-CB 3.49Å; D14-S18 PolarHBondContact O-N 2.83Å; D14-S18 VanDerWaalsContact O-N 3.1Å; D14-S18 PolarHBondContact O-OG 3.45Å |
| 15 | R | 50.2 | Low | 48.1 | Very low | 176 Ų | 176 | 108.7 Ų | 108.7 | 66% | 0.664 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -63.2 | -53.4 | 168.9 | -80.4 | 179.1 | 161 | -169.9 | -6.9 | 111.9 | T11 R13 C17 S18 D19 | T11-R15 WeakPolarHBondContact O-CB 3.29Å; T11-R15 WeakPolarHBondContact O-CD 3.3Å; T11-R15 VanDerWaalsContact O-CG 3.26Å; T11-R15 WeakPolarHBondContact O-CG 3.46Å; T11-R15 PolarHBondContact O-N 3.34Å; R13-R15 VanDerWaalsContact C-N 3.3Å; R13-R15 PolarHBondContact O-N 2.69Å; R15-C17 VanDerWaalsContact C-N 3.31Å; R15-C17 PolarHBondContact O-N 3.2Å; R15-S18 PolarHBondContact O-N 3.35Å; R15-D19 PolarHBondContact O-N 2.95Å |
| 16 | L | 51.6 | Low | 49.8 | Very low | 16 Ų | 16 | 102.1 Ų | 102.1 | 8% | 0.084 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -57.7 | -41.6 | -179.6 | -71.9 | 168.4 | 0 | 0 | 0 | 112.2 | L12 R13 F21 V139 Y140 | L12-L16 HydrophobicContact CD1-CD1 4.45Å; L12-L16 HydrophobicContact CG-CD1 4.02Å; L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 WeakPolarHBondContact O-CD1 3.48Å; L12-L16 WeakPolarHBondContact O-CG 3.29Å; L12-L16 PolarHBondContact O-N 3.25Å; R13-L16 PolarHBondContact O-N 3.25Å; L16-F21 HydrophobicContact CD2-CD2 4.11Å; L16-F21 HydrophobicContact CD2-CE2 4Å; L16-F21 WeakPolarHBondContact O-CB 3.28Å; L16-V139 HydrophobicContact CD1-CG1 4.3Å; L16-Y140 HydrophobicContact CB-CD2 4.41Å |
| 17 | C | 51.1 | Low | 51.1 | Low | 71 Ų | 71 | 99.9 Ų | 99.9 | 48% | 0.48 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -70.8 | -32.4 | 176.6 | -76.7 | 0 | 0 | 0 | 0 | 113.6 | R13 R15 D19 | R13-C17 PolarHBondContact O-N 3.16Å; R15-C17 VanDerWaalsContact C-N 3.31Å; R15-C17 PolarHBondContact O-N 3.2Å; C17-D19 VanDerWaalsContact C-N 3.34Å |
| 18 | S | 51 | Low | 52.4 | Low | 100 Ų | 100 | 92 Ų | 92 | 70% | 0.699 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -71 | -29.1 | -179.1 | -61.1 | 0 | 0 | 0 | 0 | 112.8 | D14 R15 G20 | D14-S18 VanDerWaalsContact O-CB 3.31Å; D14-S18 WeakPolarHBondContact O-CB 3.49Å; D14-S18 PolarHBondContact O-N 2.83Å; D14-S18 VanDerWaalsContact O-N 3.1Å; D14-S18 PolarHBondContact O-OG 3.45Å; R15-S18 PolarHBondContact O-N 3.35Å; S18-G20 PolarHBondContact O-N 3.26Å |
| 19 | D | 51.8 | Low | 54.2 | Low | 125 Ų | 125 | 85.3 Ų | 85.3 | 67% | 0.668 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | 11.5 | -178.7 | -65.3 | -26.1 | 0 | 0 | 0 | 114 | R15 C17 | R15-D19 PolarHBondContact O-N 2.95Å; C17-D19 VanDerWaalsContact C-N 3.34Å |
| 20 | G | 48.5 | Very low | 55.7 | Low | 54 Ų | 54 | 82.5 Ų | 82.5 | 56% | 0.557 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.8 | 32.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | S18 L22 | S18-G20 PolarHBondContact O-N 3.26Å; G20-L22 VanDerWaalsContact C-N 3.28Å; G20-L22 PolarHBondContact O-N 3.38Å |
| 21 | F | 56.1 | Low | 57.4 | Low | 21 Ų | 21 | 85 Ų | 85 | 9% | 0.092 | 45% | 0.446 | C | S | . | . | trans | -63.9 | 83.2 | 179.5 | -165.9 | -85 | 0 | 0 | 0 | 111.9 | L16 F23 Y137 Y140 | L16-F21 HydrophobicContact CD2-CD2 4.11Å; L16-F21 HydrophobicContact CD2-CE2 4Å; L16-F21 WeakPolarHBondContact O-CB 3.28Å; F21-F23 HydrophobicContact CD1-CD1 4.39Å; F21-F23 HydrophobicContact CD1-CE1 4.08Å; F21-F23 HydrophobicContact CD1-CZ 4.36Å; F21-F23 AromaticContact CE1-CD1 3.78Å; F21-F23 HydrophobicContact CE1-CD1 3.78Å; F21-F23 AromaticContact CE1-CE1 3.09Å; F21-F23 HydrophobicContact CE1-CE1 3.09Å; F21-F23 HydrophobicContact CE1-CE2 4.15Å; F21-F23 AromaticContact CE1-CZ 3.36Å; F21-F23 HydrophobicContact CE1-CZ 3.36Å; F21-F23 HydrophobicContact CZ-CD1 4.35Å; F21-F23 AromaticContact CZ-CE1 3.52Å; F21-F23 HydrophobicContact CZ-CE1 3.52Å; F21-F23 HydrophobicContact CZ-CZ 4.02Å; F21-Y137 HydrophobicContact CZ-CD1 4.26Å; F21-Y137 HydrophobicContact CZ-CE1 4.26Å; F21-Y140 HydrophobicContact CB-CE2 4.26Å; F21-Y140 HydrophobicContact CD1-CD1 4.11Å; F21-Y140 AromaticContact CD1-CD2 3.24Å; F21-Y140 HydrophobicContact CD1-CD2 3.24Å; F21-Y140 HydrophobicContact CD1-CE1 4.06Å; F21-Y140 AromaticContact CD1-CE2 3.18Å; F21-Y140 HydrophobicContact CD1-CE2 3.18Å; F21-Y140 AromaticContact CD1-CG 3.71Å; F21-Y140 HydrophobicContact CD1-CG 3.71Å; F21-Y140 AromaticContact CD1-CZ 3.6Å; F21-Y140 AromaticContact CE1-CD1 3.57Å; F21-Y140 HydrophobicContact CE1-CD1 3.57Å; F21-Y140 AromaticContact CE1-CD2 3.28Å; F21-Y140 HydrophobicContact CE1-CD2 3.28Å; F21-Y140 AromaticContact CE1-CE1 3.92Å; F21-Y140 HydrophobicContact CE1-CE1 3.92Å; F21-Y140 AromaticContact CE1-CE2 3.66Å; F21-Y140 HydrophobicContact CE1-CE2 3.66Å; F21-Y140 AromaticContact CE1-CG 3.21Å; F21-Y140 HydrophobicContact CE1-CG 3.21Å; F21-Y140 AromaticContact CE1-CZ 3.94Å; F21-Y140 HydrophobicContact CG-CD2 4.03Å; F21-Y140 HydrophobicContact CG-CE2 4.03Å; F21-Y140 HydrophobicContact CZ-CD2 4.13Å; F21-Y140 AromaticContact CZ-CG 3.96Å; F21-Y140 HydrophobicContact CZ-CG 3.96Å | ||
| 22 | L | 48.5 | Very low | 58.6 | Low | 150 Ų | 150 | 81.4 Ų | 81.4 | 79% | 0.785 | 42% | 0.423 | S | S | * | . | P | Polyproline II helix | trans | -94.2 | 121.6 | 168 | -79.9 | 156.2 | 0 | 0 | 0 | 107.8 | G20 P24 | G20-L22 VanDerWaalsContact C-N 3.28Å; G20-L22 PolarHBondContact O-N 3.38Å; L22-P24 VanDerWaalsContact O-CD 3.22Å; L22-P24 WeakPolarHBondContact O-CD 3.19Å |
| 23 | F | 54 | Low | 60.2 | Low | 63 Ų | 63 | 80.6 Ų | 80.6 | 28% | 0.276 | 42% | 0.418 | S | S | . | . | P | Polyproline II helix | trans | -66.8 | 118.8 | 169.9 | -72.3 | -49.2 | 0 | 0 | 0 | 109.1 | F21 Q25 Q107 Y137 Y140 | F21-F23 HydrophobicContact CD1-CD1 4.39Å; F21-F23 HydrophobicContact CD1-CE1 4.08Å; F21-F23 HydrophobicContact CD1-CZ 4.36Å; F21-F23 AromaticContact CE1-CD1 3.78Å; F21-F23 HydrophobicContact CE1-CD1 3.78Å; F21-F23 AromaticContact CE1-CE1 3.09Å; F21-F23 HydrophobicContact CE1-CE1 3.09Å; F21-F23 HydrophobicContact CE1-CE2 4.15Å; F21-F23 AromaticContact CE1-CZ 3.36Å; F21-F23 HydrophobicContact CE1-CZ 3.36Å; F21-F23 HydrophobicContact CZ-CD1 4.35Å; F21-F23 AromaticContact CZ-CE1 3.52Å; F21-F23 HydrophobicContact CZ-CE1 3.52Å; F21-F23 HydrophobicContact CZ-CZ 4.02Å; F23-Q25 PolarHBondContact O-N 3.09Å; F23-Q107 HydrophobicContact CD1-CG 4.08Å; F23-Q107 HydrophobicContact CE1-CG 3.96Å; F23-Q107 HydrophobicContact CZ-CG 4.43Å; F23-Y137 HydrophobicContact CD1-CD1 4.42Å; F23-Y137 HydrophobicContact CD1-CE1 4.12Å; F23-Y137 AromaticContact CE1-CD1 3.44Å; F23-Y137 HydrophobicContact CE1-CD1 3.44Å; F23-Y137 VanDerWaalsContact CE1-CD1 3.44Å; F23-Y137 AromaticContact CE1-CE1 3.51Å; F23-Y137 HydrophobicContact CE1-CE1 3.51Å; F23-Y137 HydrophobicContact CZ-CD1 4.04Å; F23-Y140 HydrophobicContact CD2-CD1 4.31Å; F23-Y140 AromaticContact CD2-CE1 3.78Å; F23-Y140 HydrophobicContact CD2-CE1 3.78Å; F23-Y140 HydrophobicContact CE1-CD1 4.29Å; F23-Y140 AromaticContact CE2-CD1 3.23Å; F23-Y140 HydrophobicContact CE2-CD1 3.23Å; F23-Y140 AromaticContact CE2-CE1 3.08Å; F23-Y140 HydrophobicContact CE2-CE1 3.08Å; F23-Y140 HydrophobicContact CE2-CG 4.37Å; F23-Y140 AromaticContact CZ-CD1 3.22Å; F23-Y140 HydrophobicContact CZ-CD1 3.22Å; F23-Y140 AromaticContact CZ-CE1 3.57Å; F23-Y140 HydrophobicContact CZ-CE1 3.57Å; F23-Y140 HydrophobicContact CZ-CG 4.02Å |
| 24 | P | 52 | Low | 61.7 | Low | 54 Ų | 54 | 79.1 Ų | 79.1 | 35% | 0.351 | 42% | 0.415 | S | S | . | . | P | Polyproline II helix | trans | -60.1 | 133.6 | 165.3 | 13.4 | -8.9 | 0 | 0 | 0 | 106.7 | L22 Y26 | L22-P24 VanDerWaalsContact O-CD 3.22Å; L22-P24 WeakPolarHBondContact O-CD 3.19Å; P24-Y26 PolarHBondContact O-N 3.02Å |
| 25 | Q | 55.3 | Low | 63.2 | Low | 177 Ų | 177 | 76.3 Ų | 76.3 | 83% | 0.827 | 41% | 0.408 | S | S | * | . | P | Polyproline II helix | trans | -49.1 | 146 | 165.4 | -63.3 | 175.2 | 24.7 | 0 | 0 | 107.4 | F23 P27 | F23-Q25 PolarHBondContact O-N 3.09Å; Q25-P27 WeakPolarHBondContact O-CD 3.39Å |
| 26 | Y | 65.6 | Low | 65.1 | Low | 40 Ų | 40 | 68 Ų | 68 | 16% | 0.157 | 38% | 0.376 | C | S | . | . | trans | -99.9 | 66.9 | 172.9 | -166 | -112.9 | 0 | 0 | 0 | 109.7 | P24 I28 R66 A74 K104 L108 | P24-Y26 PolarHBondContact O-N 3.02Å; Y26-I28 HydrophobicContact CD1-CD1 4.31Å; Y26-I28 HydrophobicContact CD1-CG1 4.01Å; Y26-I28 HydrophobicContact CE1-CD1 4.36Å; Y26-I28 HydrophobicContact CE1-CG1 4.14Å; Y26-I28 PolarHBondContact O-N 2.95Å; Y26-R66 WeakPolarHBondContact OH-CD 3.47Å; Y26-A74 HydrophobicContact CD1-CB 3.58Å; Y26-A74 HydrophobicContact CE1-CB 3.28Å; Y26-K104 HydrophobicContact CD2-CD 4.18Å; Y26-K104 HydrophobicContact CE2-CD 3.78Å; Y26-L108 HydrophobicContact CD1-CD1 4.35Å | ||
| 27 | P | 66.1 | Low | 66.8 | Low | 73 Ų | 73 | 67.2 Ų | 67.2 | 47% | 0.474 | 37% | 0.372 | S | S | . | . | trans | -69.7 | 109.9 | -174.5 | 30.3 | -35.6 | 0 | 0 | 0 | 109.3 | Q25 K29 | Q25-P27 WeakPolarHBondContact O-CD 3.39Å; P27-K29 PolarHBondContact O-N 3.37Å | ||
| 28 | I | 71.2 | Confident | 68.6 | Low | 34 Ų | 34 | 70 Ų | 70 | 17% | 0.174 | 37% | 0.373 | C | S | . | . | trans | -82.5 | 107.2 | 171.1 | -55.7 | 166.5 | 0 | 0 | 0 | 107.4 | Y26 L33 F41 L71 T75 | Y26-I28 HydrophobicContact CD1-CD1 4.31Å; Y26-I28 HydrophobicContact CD1-CG1 4.01Å; Y26-I28 HydrophobicContact CE1-CD1 4.36Å; Y26-I28 HydrophobicContact CE1-CG1 4.14Å; Y26-I28 PolarHBondContact O-N 2.95Å; I28-L33 HydrophobicContact CG2-CD1 4.47Å; I28-L33 HydrophobicContact CG2-CD2 3.83Å; I28-L33 HydrophobicContact CG2-CG 4.49Å; I28-F41 HydrophobicContact CB-CD2 4.18Å; I28-F41 HydrophobicContact CB-CE2 3.7Å; I28-F41 HydrophobicContact CD1-CD2 4.17Å; I28-F41 HydrophobicContact CD1-CE2 4.11Å; I28-F41 HydrophobicContact CG2-CD2 3.47Å; I28-F41 VanDerWaalsContact CG2-CD2 3.47Å; I28-F41 HydrophobicContact CG2-CE2 3.41Å; I28-F41 VanDerWaalsContact CG2-CE2 3.41Å; I28-F41 HydrophobicContact CG2-CG 4.4Å; I28-F41 HydrophobicContact CG2-CZ 4.31Å; I28-L71 HydrophobicContact CD1-CD2 4Å; I28-L71 HydrophobicContact CG1-CD2 4.1Å; I28-L71 HydrophobicContact CG2-CD2 4.12Å; I28-T75 HydrophobicContact CD1-CG2 3.71Å | ||
| 29 | K | 77.4 | Confident | 70.5 | Confident | 89 Ų | 89 | 65.3 Ų | 65.3 | 39% | 0.387 | 34% | 0.34 | S | S | . | . | trans | -97.8 | 130.5 | 177.4 | -59.5 | -173.8 | 177.9 | -173.9 | 0 | 110.1 | P27 Y31 H32 | P27-K29 PolarHBondContact O-N 3.37Å; K29-Y31 HydrophobicContact CB-CD1 3.93Å; K29-Y31 HydrophobicContact CB-CE1 3.53Å; K29-Y31 HydrophobicContact CB-CE2 4.45Å; K29-Y31 HydrophobicContact CD-CE1 3.56Å; K29-Y31 HydrophobicContact CD-CE2 4.49Å; K29-Y31 VanDerWaalsContact CD-CZ 3.43Å; K29-Y31 WeakPolarHBondContact CD-OH 3.36Å; K29-Y31 HydrophobicContact CG-CE1 4.12Å; K29-Y31 PolarHBondContact NZ-OH 3.35Å; K29-Y31 PolarHBondContact O-N 3.31Å; K29-Y31 VanDerWaalsContact O-N 3.12Å; K29-H32 WeakPolarHBondContact O-CB 3.34Å; K29-H32 PolarHBondContact O-N 2.87Å | ||
| 30 | P | 75.6 | Confident | 72.2 | Confident | 76 Ų | 76 | 59.3 Ų | 59.3 | 49% | 0.494 | 31% | 0.308 | S | S | . | . | G | 310 helix | trans | -54.9 | -34.7 | -174.9 | -29.8 | 35.5 | 0 | 0 | 0 | 114.6 | H32 L33 | P30-H32 PolarHBondContact O-N 3.43Å; P30-L33 WeakPolarHBondContact O-CB 3.38Å; P30-L33 PolarHBondContact O-N 2.87Å; P30-L33 VanDerWaalsContact O-N 3.09Å |
| 31 | Y | 78.8 | Confident | 74 | Confident | 130 Ų | 130 | 59.7 Ų | 59.7 | 51% | 0.51 | 29% | 0.294 | S | S | . | . | G | 310 helix | trans | -71.7 | -7.7 | 179.9 | 64.2 | -100.7 | 0 | 0 | 0 | 114.6 | K29 R63 | K29-Y31 HydrophobicContact CB-CD1 3.93Å; K29-Y31 HydrophobicContact CB-CE1 3.53Å; K29-Y31 HydrophobicContact CB-CE2 4.45Å; K29-Y31 HydrophobicContact CD-CE1 3.56Å; K29-Y31 HydrophobicContact CD-CE2 4.49Å; K29-Y31 VanDerWaalsContact CD-CZ 3.43Å; K29-Y31 WeakPolarHBondContact CD-OH 3.36Å; K29-Y31 HydrophobicContact CG-CE1 4.12Å; K29-Y31 PolarHBondContact NZ-OH 3.35Å; K29-Y31 PolarHBondContact O-N 3.31Å; K29-Y31 VanDerWaalsContact O-N 3.12Å; Y31-R63 PolarHBondContact O-NH1 3.22Å |
| 32 | H | 77.4 | Confident | 75.4 | Confident | 22 Ų | 22 | 65 Ų | 65 | 10% | 0.102 | 32% | 0.315 | C | S | . | . | G | 310 helix | trans | -84 | -26.1 | 169.5 | -64 | 152.5 | 0 | 0 | 0 | 112.5 | K29 P30 D62 R63 K64 | K29-H32 WeakPolarHBondContact O-CB 3.34Å; K29-H32 PolarHBondContact O-N 2.87Å; P30-H32 PolarHBondContact O-N 3.43Å; H32-D62 VanDerWaalsContact O-CB 3.28Å; H32-D62 WeakPolarHBondContact O-CB 3.26Å; H32-R63 HydrophobicContact CB-CB 4.23Å; H32-R63 PolarHBondContact O-N 3.46Å; H32-R63 VanDerWaalsContact O-N 3.15Å; H32-K64 VanDerWaalsContact CE1-CE 3.41Å; H32-K64 WeakPolarHBondContact CE1-CE 3.45Å |
| 33 | L | 79.7 | Confident | 77.2 | Confident | 17 Ų | 17 | 66.1 Ų | 66.1 | 9% | 0.089 | 31% | 0.308 | C | S | . | . | trans | -73.8 | 145.5 | -171.5 | -53 | 177.5 | 0 | 0 | 0 | 111.7 | I28 P30 H37 R38 F41 L71 | I28-L33 HydrophobicContact CG2-CD1 4.47Å; I28-L33 HydrophobicContact CG2-CD2 3.83Å; I28-L33 HydrophobicContact CG2-CG 4.49Å; P30-L33 WeakPolarHBondContact O-CB 3.38Å; P30-L33 PolarHBondContact O-N 2.87Å; P30-L33 VanDerWaalsContact O-N 3.09Å; L33-H37 HydrophobicContact CB-CB 3.95Å; L33-H37 HydrophobicContact CD2-CB 3.91Å; L33-R38 HydrophobicContact CB-CG 3.87Å; L33-R38 HydrophobicContact CD1-CG 4.37Å; L33-F41 HydrophobicContact CD1-CB 3.68Å; L33-F41 HydrophobicContact CD1-CD1 3.77Å; L33-F41 HydrophobicContact CD1-CD2 4.27Å; L33-F41 HydrophobicContact CD1-CE1 4.49Å; L33-F41 HydrophobicContact CD1-CG 3.63Å; L33-L71 HydrophobicContact CD2-CD1 3.49Å; L33-L71 VanDerWaalsContact CD2-CD1 3.49Å; L33-L71 HydrophobicContact CD2-CD2 4.4Å | ||
| 34 | K | 81.1 | Confident | 79 | Confident | 82 Ų | 82 | 66.3 Ų | 66.3 | 36% | 0.357 | 31% | 0.312 | S | S | . | . | trans | -131.7 | 135.7 | 174.8 | -62.4 | 179.6 | -175.3 | 165.1 | 0 | 110.6 | I36 H37 R61 | K34-I36 PolarHBondContact O-N 3.18Å; K34-H37 WeakPolarHBondContact O-CB 3.29Å; K34-H37 PolarHBondContact O-N 3.23Å; K34-H37 PolarHBondContact O-ND1 3.16Å; K34-R61 PolarHBondContact NZ-O 2.97Å | ||
| 35 | G | 84.6 | Confident | 80.8 | Confident | 33 Ų | 33 | 66.8 Ų | 66.8 | 34% | 0.34 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 38.2 | -103.9 | 169.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | H37 R38 | G35-H37 PolarHBondContact O-N 3.16Å; G35-H37 VanDerWaalsContact O-N 3.13Å; G35-R38 WeakPolarHBondContact O-CB 3.47Å; G35-R38 PolarHBondContact O-N 3.31Å |
| 36 | I | 89.3 | Confident | 82.5 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -52.1 | -32.8 | 179 | -161.2 | 169.7 | 0 | 0 | 0 | 115 | K34 R38 A39 V40 L48 V51 L52 Y56 I58 A68 L84 | K34-I36 PolarHBondContact O-N 3.18Å; I36-R38 VanDerWaalsContact C-N 3.31Å; I36-R38 PolarHBondContact O-N 3Å; I36-A39 PolarHBondContact O-N 3.09Å; I36-V40 PolarHBondContact O-N 3.44Å; I36-L48 HydrophobicContact CD1-CD1 3.92Å; I36-L48 HydrophobicContact CG1-CD1 3.46Å; I36-L48 VanDerWaalsContact CG1-CD1 3.46Å; I36-V51 HydrophobicContact CB-CG1 3.99Å; I36-V51 HydrophobicContact CD1-CG1 4.43Å; I36-V51 HydrophobicContact CG1-CG1 4.16Å; I36-L52 HydrophobicContact CD1-CD2 3.82Å; I36-L52 HydrophobicContact CD1-CG 4.48Å; I36-Y56 HydrophobicContact CB-CD1 4.1Å; I36-Y56 HydrophobicContact CB-CE1 3.63Å; I36-Y56 HydrophobicContact CD1-CD1 4.41Å; I36-Y56 HydrophobicContact CG2-CD1 4.35Å; I36-Y56 HydrophobicContact CG2-CE1 3.55Å; I36-I58 HydrophobicContact CD1-CG1 4.31Å; I36-A68 HydrophobicContact CD1-CB 4.1Å; I36-A68 HydrophobicContact CG1-CB 3.99Å; I36-A68 HydrophobicContact CG2-CB 4.09Å; I36-L84 HydrophobicContact CD1-CD2 4.2Å |
| 37 | H | 88.6 | Confident | 83.6 | Confident | 0 Ų | 0 | 65.5 Ų | 65.5 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -67.9 | -31.9 | 179.3 | -59.8 | 89.4 | 0 | 0 | 0 | 112.5 | L33 K34 G35 F41 K60 R66 A68 L71 | L33-H37 HydrophobicContact CB-CB 3.95Å; L33-H37 HydrophobicContact CD2-CB 3.91Å; K34-H37 WeakPolarHBondContact O-CB 3.29Å; K34-H37 PolarHBondContact O-N 3.23Å; K34-H37 PolarHBondContact O-ND1 3.16Å; G35-H37 PolarHBondContact O-N 3.16Å; G35-H37 VanDerWaalsContact O-N 3.13Å; H37-F41 VanDerWaalsContact O-CB 3.23Å; H37-F41 WeakPolarHBondContact O-CB 3.28Å; H37-F41 PolarHBondContact O-N 3.03Å; H37-K60 PolarHBondContact CE1-O 3.1Å; H37-K60 PolarHBondContact NE2-O 2.97Å; H37-K60 VanDerWaalsContact NE2-O 3.16Å; H37-R66 PolarHBondContact NE2-O 2.92Å; H37-A68 PolarHBondContact NE2-N 2.87Å; H37-L71 HydrophobicContact CB-CD1 3.56Å |
| 38 | R | 87.5 | Confident | 84.8 | Confident | 131 Ų | 131 | 62 Ų | 62 | 49% | 0.494 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -69.5 | -45.3 | 177.7 | -72.9 | 177.7 | 54.5 | 176.1 | -4.9 | 110.2 | L33 G35 I36 V40 F41 Y42 | L33-R38 HydrophobicContact CB-CG 3.87Å; L33-R38 HydrophobicContact CD1-CG 4.37Å; G35-R38 WeakPolarHBondContact O-CB 3.47Å; G35-R38 PolarHBondContact O-N 3.31Å; I36-R38 VanDerWaalsContact C-N 3.31Å; I36-R38 PolarHBondContact O-N 3Å; R38-V40 VanDerWaalsContact C-N 3.31Å; R38-V40 PolarHBondContact O-N 2.74Å; R38-F41 PolarHBondContact O-N 2.76Å; R38-F41 VanDerWaalsContact O-N 3.13Å; R38-Y42 HydrophobicContact CB-CD2 4.23Å; R38-Y42 HydrophobicContact CB-CE2 4.32Å; R38-Y42 WeakPolarHBondContact O-CD2 3.32Å; R38-Y42 PolarHBondContact O-N 2.84Å |
| 39 | A | 90.6 | Very high | 85.7 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -54.8 | -47.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | I36 R43 D44 E47 L48 | I36-A39 PolarHBondContact O-N 3.09Å; A39-R43 PolarHBondContact O-N 2.96Å; A39-R43 VanDerWaalsContact O-N 3.14Å; A39-D44 PolarHBondContact O-N 2.98Å; A39-E47 HydrophobicContact CB-CB 3.98Å; A39-E47 HydrophobicContact CB-CG 3.9Å; A39-L48 HydrophobicContact CB-CB 4.01Å |
| 40 | V | 89.1 | Confident | 86.4 | Confident | 0 Ų | 0 | 66.7 Ų | 66.7 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.7 | -46.1 | 175 | 176.6 | 0 | 0 | 0 | 0 | 112 | I36 R38 Y42 R43 L48 A68 L71 A72 Q77 L84 | I36-V40 PolarHBondContact O-N 3.44Å; R38-V40 VanDerWaalsContact C-N 3.31Å; R38-V40 PolarHBondContact O-N 2.74Å; V40-Y42 VanDerWaalsContact C-N 3.32Å; V40-Y42 PolarHBondContact O-N 3.18Å; V40-R43 PolarHBondContact O-N 3.16Å; V40-R43 VanDerWaalsContact O-N 3.13Å; V40-L48 HydrophobicContact CG2-CD1 4.15Å; V40-L48 HydrophobicContact CG2-CD2 4.01Å; V40-A68 HydrophobicContact CG2-CB 4.02Å; V40-L71 HydrophobicContact CG1-CB 3.89Å; V40-A72 HydrophobicContact CG1-CB 3.73Å; V40-Q77 PolarHBondContact O-NE2 2.81Å; V40-Q77 PolarHBondContact O-OE1 2.95Å; V40-L84 HydrophobicContact CG2-CD1 4.39Å |
| 41 | F | 86.1 | Confident | 86.9 | Confident | 62 Ų | 62 | 63.9 Ų | 63.9 | 27% | 0.272 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -60.8 | -40.7 | -178.1 | -177.5 | -104.2 | 0 | 0 | 0 | 112.6 | I28 L33 H37 R38 R43 | I28-F41 HydrophobicContact CB-CD2 4.18Å; I28-F41 HydrophobicContact CB-CE2 3.7Å; I28-F41 HydrophobicContact CD1-CD2 4.17Å; I28-F41 HydrophobicContact CD1-CE2 4.11Å; I28-F41 HydrophobicContact CG2-CD2 3.47Å; I28-F41 VanDerWaalsContact CG2-CD2 3.47Å; I28-F41 HydrophobicContact CG2-CE2 3.41Å; I28-F41 VanDerWaalsContact CG2-CE2 3.41Å; I28-F41 HydrophobicContact CG2-CG 4.4Å; I28-F41 HydrophobicContact CG2-CZ 4.31Å; L33-F41 HydrophobicContact CD1-CB 3.68Å; L33-F41 HydrophobicContact CD1-CD1 3.77Å; L33-F41 HydrophobicContact CD1-CD2 4.27Å; L33-F41 HydrophobicContact CD1-CE1 4.49Å; L33-F41 HydrophobicContact CD1-CG 3.63Å; H37-F41 VanDerWaalsContact O-CB 3.23Å; H37-F41 WeakPolarHBondContact O-CB 3.28Å; H37-F41 PolarHBondContact O-N 3.03Å; R38-F41 PolarHBondContact O-N 2.76Å; R38-F41 VanDerWaalsContact O-N 3.13Å; F41-R43 VanDerWaalsContact C-N 3.31Å |
| 42 | Y | 84.6 | Confident | 87.3 | Confident | 133 Ų | 133 | 58.6 Ų | 58.6 | 52% | 0.522 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | 3.7 | 178.6 | -66.7 | -63.7 | 0 | 0 | 0 | 114.2 | R38 V40 D44 | R38-Y42 HydrophobicContact CB-CD2 4.23Å; R38-Y42 HydrophobicContact CB-CE2 4.32Å; R38-Y42 WeakPolarHBondContact O-CD2 3.32Å; R38-Y42 PolarHBondContact O-N 2.84Å; V40-Y42 VanDerWaalsContact C-N 3.32Å; V40-Y42 PolarHBondContact O-N 3.18Å; Y42-D44 PolarHBondContact O-N 3.13Å |
| 43 | R | 87.4 | Confident | 87.7 | Confident | 173 Ų | 173 | 63.5 Ų | 63.5 | 65% | 0.653 | 29% | 0.292 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.5 | 28.5 | -178 | -60.3 | 177.4 | 69.4 | -177.6 | 1.9 | 113.6 | A39 V40 F41 L45 Q77 M80 | A39-R43 PolarHBondContact O-N 2.96Å; A39-R43 VanDerWaalsContact O-N 3.14Å; V40-R43 PolarHBondContact O-N 3.16Å; V40-R43 VanDerWaalsContact O-N 3.13Å; F41-R43 VanDerWaalsContact C-N 3.31Å; R43-L45 PolarHBondContact O-N 2.93Å; R43-Q77 VanDerWaalsContact CG-CD 3.42Å; R43-Q77 HydrophobicContact CG-CG 4.17Å; R43-M80 VanDerWaalsContact CA-CE 3.45Å; R43-M80 HydrophobicContact CB-CE 4.43Å |
| 44 | D | 90.3 | Very high | 87.9 | Confident | 67 Ų | 67 | 65.7 Ų | 65.7 | 36% | 0.358 | 31% | 0.306 | S | S | . | . | trans | -86.1 | 94.5 | 179.4 | -165.2 | -28 | 0 | 0 | 0 | 110.5 | A39 Y42 E46 E47 L48 | A39-D44 PolarHBondContact O-N 2.98Å; Y42-D44 PolarHBondContact O-N 3.13Å; D44-E46 VanDerWaalsContact C-N 3.3Å; D44-E46 PolarHBondContact O-N 2.82Å; D44-E46 PolarHBondContact OD1-N 3Å; D44-E46 VanDerWaalsContact OD1-N 3.11Å; D44-E47 HydrophobicContact CB-CB 3.87Å; D44-E47 VanDerWaalsContact CG-CB 3.4Å; D44-E47 PolarHBondContact OD1-N 3.21Å; D44-L48 WeakPolarHBondContact O-CB 3.45Å; D44-L48 PolarHBondContact O-N 3.35Å | ||
| 45 | L | 90.6 | Very high | 87.7 | Confident | 64 Ų | 64 | 74.4 Ų | 74.4 | 34% | 0.335 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.6 | -33.3 | -179.5 | -82.7 | 166.3 | 0 | 0 | 0 | 111.9 | R43 K49 E79 M80 | R43-L45 PolarHBondContact O-N 2.93Å; L45-K49 WeakPolarHBondContact O-CB 3.47Å; L45-K49 WeakPolarHBondContact O-CG 3.3Å; L45-K49 PolarHBondContact O-N 2.91Å; L45-E79 HydrophobicContact CD2-CB 4.41Å; L45-M80 HydrophobicContact CB-CE 4.36Å; L45-M80 HydrophobicContact CD2-CE 3.85Å; L45-M80 HydrophobicContact CD2-SD 3.32Å; L45-M80 WeakPolarHBondContact CD2-SD 3.3Å; L45-M80 HydrophobicContact CG-CE 3.71Å; L45-M80 HydrophobicContact CG-SD 3.91Å |
| 46 | E | 90.9 | Very high | 87.6 | Confident | 121 Ų | 121 | 76.6 Ų | 76.6 | 57% | 0.565 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -77.3 | -42 | -177.2 | -63.7 | -53 | 127.8 | 0 | 0 | 110.7 | D44 L48 K49 F50 | D44-E46 VanDerWaalsContact C-N 3.3Å; D44-E46 PolarHBondContact O-N 2.82Å; D44-E46 PolarHBondContact OD1-N 3Å; D44-E46 VanDerWaalsContact OD1-N 3.11Å; E46-L48 VanDerWaalsContact C-N 3.3Å; E46-L48 PolarHBondContact O-N 3.15Å; E46-K49 PolarHBondContact O-N 3.09Å; E46-K49 IonicContact OE1-NZ 3.53Å; E46-K49 PolarHBondContact OE1-NZ 3.2Å; E46-K49 IonicContact OE2-NZ 3.26Å; E46-F50 VanDerWaalsContact O-CB 3.3Å; E46-F50 WeakPolarHBondContact O-CB 3.41Å; E46-F50 PolarHBondContact O-N 2.97Å |
| 47 | E | 89 | Confident | 87.6 | Confident | 68 Ų | 68 | 80.6 Ų | 80.6 | 32% | 0.318 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.2 | -42.7 | 170.2 | -170.7 | -176.7 | -169.1 | 0 | 0 | 110.4 | A39 D44 F50 V51 | A39-E47 HydrophobicContact CB-CB 3.98Å; A39-E47 HydrophobicContact CB-CG 3.9Å; D44-E47 HydrophobicContact CB-CB 3.87Å; D44-E47 VanDerWaalsContact CG-CB 3.4Å; D44-E47 PolarHBondContact OD1-N 3.21Å; E47-F50 PolarHBondContact O-N 3.12Å; E47-V51 HydrophobicContact CG-CG2 4.37Å; E47-V51 WeakPolarHBondContact O-CB 3.45Å; E47-V51 VanDerWaalsContact O-CG2 3.26Å; E47-V51 WeakPolarHBondContact O-CG2 3.38Å; E47-V51 PolarHBondContact O-N 3.39Å |
| 48 | L | 90.9 | Very high | 87.7 | Confident | 0 Ų | 0 | 81.8 Ų | 81.8 | 0% | 0 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.3 | -48 | 177.6 | -177.9 | 58.8 | 0 | 0 | 0 | 111.6 | I36 A39 V40 D44 E46 F50 V51 L52 M80 L83 L84 | I36-L48 HydrophobicContact CD1-CD1 3.92Å; I36-L48 HydrophobicContact CG1-CD1 3.46Å; I36-L48 VanDerWaalsContact CG1-CD1 3.46Å; A39-L48 HydrophobicContact CB-CB 4.01Å; V40-L48 HydrophobicContact CG2-CD1 4.15Å; V40-L48 HydrophobicContact CG2-CD2 4.01Å; D44-L48 WeakPolarHBondContact O-CB 3.45Å; D44-L48 PolarHBondContact O-N 3.35Å; E46-L48 VanDerWaalsContact C-N 3.3Å; E46-L48 PolarHBondContact O-N 3.15Å; L48-F50 VanDerWaalsContact C-N 3.31Å; L48-F50 PolarHBondContact O-N 2.68Å; L48-V51 PolarHBondContact O-N 2.88Å; L48-L52 HydrophobicContact CD1-CD1 3.99Å; L48-L52 HydrophobicContact CD1-CG 4.12Å; L48-L52 HydrophobicContact CG-CD1 3.87Å; L48-L52 HydrophobicContact CG-CG 4.42Å; L48-L52 WeakPolarHBondContact O-CB 3.46Å; L48-L52 WeakPolarHBondContact O-CG 3.15Å; L48-L52 PolarHBondContact O-N 3.08Å; L48-M80 HydrophobicContact CB-SD 4.43Å; L48-M80 HydrophobicContact CD2-CB 4.39Å; L48-M80 HydrophobicContact CD2-CG 4.42Å; L48-M80 HydrophobicContact CD2-SD 3.3Å; L48-M80 WeakPolarHBondContact CD2-SD 3.26Å; L48-M80 HydrophobicContact CG-SD 4.48Å; L48-L83 HydrophobicContact CB-CD2 4.44Å; L48-L83 HydrophobicContact CD2-CD2 3.86Å; L48-L83 HydrophobicContact CG-CD2 3.92Å; L48-L84 HydrophobicContact CD1-CD2 4.18Å; L48-L84 HydrophobicContact CD2-CD2 4.46Å; L48-L84 HydrophobicContact CD2-CG 4.4Å |
| 49 | K | 91.3 | Very high | 88 | Confident | 82 Ų | 82 | 76.9 Ų | 76.9 | 36% | 0.357 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -58 | -45 | 175.3 | -75.3 | 169.8 | -170.8 | 168.3 | 0 | 111.4 | L45 E46 L52 L53 L83 | L45-K49 WeakPolarHBondContact O-CB 3.47Å; L45-K49 WeakPolarHBondContact O-CG 3.3Å; L45-K49 PolarHBondContact O-N 2.91Å; E46-K49 PolarHBondContact O-N 3.09Å; E46-K49 IonicContact OE1-NZ 3.53Å; E46-K49 PolarHBondContact OE1-NZ 3.2Å; E46-K49 IonicContact OE2-NZ 3.26Å; K49-L52 PolarHBondContact O-N 3.12Å; K49-L53 VanDerWaalsContact O-CG 3.3Å; K49-L53 WeakPolarHBondContact O-CG 3.29Å; K49-L53 PolarHBondContact O-N 2.91Å; K49-L83 HydrophobicContact CG-CD1 4.5Å; K49-L83 HydrophobicContact CG-CD2 3.7Å |
| 50 | F | 90.1 | Very high | 88.1 | Confident | 140 Ų | 140 | 81 Ų | 81 | 61% | 0.614 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -60.6 | -49.1 | 178.9 | -179.8 | -97.9 | 0 | 0 | 0 | 111.4 | E46 E47 L48 L52 L53 T54 | E46-F50 VanDerWaalsContact O-CB 3.3Å; E46-F50 WeakPolarHBondContact O-CB 3.41Å; E46-F50 PolarHBondContact O-N 2.97Å; E47-F50 PolarHBondContact O-N 3.12Å; L48-F50 VanDerWaalsContact C-N 3.31Å; L48-F50 PolarHBondContact O-N 2.68Å; F50-L52 VanDerWaalsContact C-N 3.3Å; F50-L52 PolarHBondContact O-N 3.39Å; F50-L53 WeakPolarHBondContact O-CB 3.33Å; F50-L53 PolarHBondContact O-N 3.39Å; F50-L53 VanDerWaalsContact O-N 3.09Å; F50-T54 HydrophobicContact CE1-CG2 4.26Å; F50-T54 HydrophobicContact CZ-CG2 4.41Å; F50-T54 PolarHBondContact O-N 3.39Å; F50-T54 VanDerWaalsContact O-N 3.16Å |
| 51 | V | 88.1 | Confident | 88.2 | Confident | 16 Ų | 16 | 85.2 Ų | 85.2 | 10% | 0.097 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -60 | -41.3 | 177.4 | 172.7 | 0 | 0 | 0 | 0 | 111.1 | I36 E47 L48 L53 T54 Y56 | I36-V51 HydrophobicContact CB-CG1 3.99Å; I36-V51 HydrophobicContact CD1-CG1 4.43Å; I36-V51 HydrophobicContact CG1-CG1 4.16Å; E47-V51 HydrophobicContact CG-CG2 4.37Å; E47-V51 WeakPolarHBondContact O-CB 3.45Å; E47-V51 VanDerWaalsContact O-CG2 3.26Å; E47-V51 WeakPolarHBondContact O-CG2 3.38Å; E47-V51 PolarHBondContact O-N 3.39Å; L48-V51 PolarHBondContact O-N 2.88Å; V51-L53 VanDerWaalsContact C-N 3.28Å; V51-L53 PolarHBondContact O-N 3.47Å; V51-T54 PolarHBondContact O-N 3.34Å; V51-T54 PolarHBondContact O-OG1 3.49Å; V51-Y56 HydrophobicContact CG1-CD1 3.65Å; V51-Y56 HydrophobicContact CG1-CD2 3.95Å; V51-Y56 HydrophobicContact CG1-CE1 4.24Å; V51-Y56 HydrophobicContact CG1-CE2 4.48Å; V51-Y56 HydrophobicContact CG1-CG 3.5Å; V51-Y56 VanDerWaalsContact CG1-CG 3.5Å; V51-Y56 VanDerWaalsContact O-CB 3.31Å; V51-Y56 WeakPolarHBondContact O-CB 3.45Å |
| 52 | L | 86.7 | Confident | 88.4 | Confident | 20 Ų | 20 | 82.5 Ų | 82.5 | 11% | 0.105 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -69.7 | -19.5 | 177.5 | -69.2 | 173.4 | 0 | 0 | 0 | 114.4 | I36 L48 K49 F50 I58 L83 L84 R87 | I36-L52 HydrophobicContact CD1-CD2 3.82Å; I36-L52 HydrophobicContact CD1-CG 4.48Å; L48-L52 HydrophobicContact CD1-CD1 3.99Å; L48-L52 HydrophobicContact CD1-CG 4.12Å; L48-L52 HydrophobicContact CG-CD1 3.87Å; L48-L52 HydrophobicContact CG-CG 4.42Å; L48-L52 WeakPolarHBondContact O-CB 3.46Å; L48-L52 WeakPolarHBondContact O-CG 3.15Å; L48-L52 PolarHBondContact O-N 3.08Å; K49-L52 PolarHBondContact O-N 3.12Å; F50-L52 VanDerWaalsContact C-N 3.3Å; F50-L52 PolarHBondContact O-N 3.39Å; L52-I58 HydrophobicContact CD2-CB 4.11Å; L52-I58 HydrophobicContact CD2-CD1 3.6Å; L52-I58 HydrophobicContact CD2-CG1 3.74Å; L52-L83 HydrophobicContact CD1-CD2 3.99Å; L52-L83 HydrophobicContact CD1-CG 3.85Å; L52-L84 HydrophobicContact CD1-CD2 4.42Å; L52-L84 HydrophobicContact CD2-CD2 4.46Å; L52-R87 HydrophobicContact CD1-CG 4.19Å |
| 53 | L | 86.4 | Confident | 88.5 | Confident | 125 Ų | 125 | 83.2 Ų | 83.2 | 65% | 0.654 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -82.9 | -29.4 | 172.8 | -73.2 | 169.3 | 0 | 0 | 0 | 112.2 | K49 F50 V51 | K49-L53 VanDerWaalsContact O-CG 3.3Å; K49-L53 WeakPolarHBondContact O-CG 3.29Å; K49-L53 PolarHBondContact O-N 2.91Å; F50-L53 WeakPolarHBondContact O-CB 3.33Å; F50-L53 PolarHBondContact O-N 3.39Å; F50-L53 VanDerWaalsContact O-N 3.09Å; V51-L53 VanDerWaalsContact C-N 3.28Å; V51-L53 PolarHBondContact O-N 3.47Å |
| 54 | T | 83.1 | Confident | 88.4 | Confident | 62 Ų | 62 | 78.9 Ų | 78.9 | 38% | 0.38 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | 159 | 169.4 | 68.5 | 0 | 0 | 0 | 0 | 109.8 | F50 V51 Y56 | F50-T54 HydrophobicContact CE1-CG2 4.26Å; F50-T54 HydrophobicContact CZ-CG2 4.41Å; F50-T54 PolarHBondContact O-N 3.39Å; F50-T54 VanDerWaalsContact O-N 3.16Å; V51-T54 PolarHBondContact O-N 3.34Å; V51-T54 PolarHBondContact O-OG1 3.49Å; T54-Y56 PolarHBondContact O-N 2.89Å |
| 55 | R | 76.3 | Confident | 88.5 | Confident | 266 Ų | 266 | 79.4 Ų | 79.4 | 100% | 1.004 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | 36.5 | 176.5 | -69.4 | -169.8 | 176 | -164.7 | -0 | 113.2 | ||
| 56 | Y | 83.9 | Confident | 88.6 | Confident | 79 Ų | 79 | 76.6 Ų | 76.6 | 31% | 0.31 | 34% | 0.341 | S | S | . | . | trans | -75.9 | 138.8 | 179.4 | -160 | -86.8 | 0 | 0 | 0 | 110.1 | I36 V51 T54 I58 K60 | I36-Y56 HydrophobicContact CB-CD1 4.1Å; I36-Y56 HydrophobicContact CB-CE1 3.63Å; I36-Y56 HydrophobicContact CD1-CD1 4.41Å; I36-Y56 HydrophobicContact CG2-CD1 4.35Å; I36-Y56 HydrophobicContact CG2-CE1 3.55Å; V51-Y56 HydrophobicContact CG1-CD1 3.65Å; V51-Y56 HydrophobicContact CG1-CD2 3.95Å; V51-Y56 HydrophobicContact CG1-CE1 4.24Å; V51-Y56 HydrophobicContact CG1-CE2 4.48Å; V51-Y56 HydrophobicContact CG1-CG 3.5Å; V51-Y56 VanDerWaalsContact CG1-CG 3.5Å; V51-Y56 VanDerWaalsContact O-CB 3.31Å; V51-Y56 WeakPolarHBondContact O-CB 3.45Å; T54-Y56 PolarHBondContact O-N 2.89Å; Y56-I58 PolarHBondContact O-N 3.23Å; Y56-K60 HydrophobicContact CE1-CB 3.98Å; Y56-K60 HydrophobicContact CE1-CG 4.38Å | ||
| 57 | D | 89.2 | Confident | 88.8 | Confident | 83 Ų | 83 | 70.9 Ų | 70.9 | 44% | 0.444 | 32% | 0.315 | S | S | . | . | trans | -72.8 | 110 | 175.9 | 175.2 | 11 | 0 | 0 | 0 | 110.3 | N59 K60 | D57-N59 PolarHBondContact O-N 2.94Å; D57-N59 PolarHBondContact OD1-N 2.68Å; D57-K60 HydrophobicContact CB-CB 4.37Å; D57-K60 WeakPolarHBondContact O-CB 3.28Å; D57-K60 PolarHBondContact O-N 2.84Å; D57-K60 VanDerWaalsContact O-N 3.16Å; D57-K60 PolarHBondContact OD1-N 2.88Å | ||
| 58 | I | 89.9 | Confident | 89 | Confident | 25 Ų | 25 | 67.7 Ų | 67.7 | 13% | 0.128 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -27.8 | 178.9 | -170 | 167.7 | 0 | 0 | 0 | 112.7 | I36 L52 Y56 K60 L84 R87 C89 | I36-I58 HydrophobicContact CD1-CG1 4.31Å; L52-I58 HydrophobicContact CD2-CB 4.11Å; L52-I58 HydrophobicContact CD2-CD1 3.6Å; L52-I58 HydrophobicContact CD2-CG1 3.74Å; Y56-I58 PolarHBondContact O-N 3.23Å; I58-K60 VanDerWaalsContact C-N 3.25Å; I58-K60 PolarHBondContact O-N 3.14Å; I58-L84 HydrophobicContact CD1-CD2 3.92Å; I58-L84 WeakPolarHBondContact CD1-O 3.45Å; I58-L84 HydrophobicContact CG1-CD2 3.87Å; I58-R87 HydrophobicContact CD1-CB 3.57Å; I58-C89 HydrophobicContact CD1-CB 3.67Å; I58-C89 HydrophobicContact CG1-CB 3.85Å; I58-C89 HydrophobicContact CG2-CB 4.22Å |
| 59 | N | 92.7 | Very high | 89.3 | Confident | 28 Ų | 28 | 67.8 Ų | 67.8 | 15% | 0.15 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.6 | 10.1 | -179.7 | -65.8 | -24.3 | 0 | 0 | 0 | 111.8 | D57 R61 E90 L93 | D57-N59 PolarHBondContact O-N 2.94Å; D57-N59 PolarHBondContact OD1-N 2.68Å; N59-R61 PolarHBondContact O-N 3Å; N59-E90 VanDerWaalsContact ND2-CD 3.28Å; N59-E90 VanDerWaalsContact ND2-CG 3.29Å; N59-E90 WeakPolarHBondContact ND2-CG 3.48Å; N59-E90 PolarHBondContact ND2-OE1 2.96Å; N59-E90 PolarHBondContact OD1-N 2.97Å; N59-L93 HydrophobicContact CB-CD1 3.71Å |
| 60 | K | 92.7 | Very high | 89.4 | Confident | 88 Ų | 88 | 63.9 Ų | 63.9 | 38% | 0.383 | 28% | 0.283 | S | S | . | . | trans | -54 | 131.4 | -179.9 | -168.8 | 63.5 | 166.4 | -172.5 | 0 | 110.3 | H37 Y56 D57 I58 | H37-K60 PolarHBondContact CE1-O 3.1Å; H37-K60 PolarHBondContact NE2-O 2.97Å; H37-K60 VanDerWaalsContact NE2-O 3.16Å; Y56-K60 HydrophobicContact CE1-CB 3.98Å; Y56-K60 HydrophobicContact CE1-CG 4.38Å; D57-K60 HydrophobicContact CB-CB 4.37Å; D57-K60 WeakPolarHBondContact O-CB 3.28Å; D57-K60 PolarHBondContact O-N 2.84Å; D57-K60 VanDerWaalsContact O-N 3.16Å; D57-K60 PolarHBondContact OD1-N 2.88Å; I58-K60 VanDerWaalsContact C-N 3.25Å; I58-K60 PolarHBondContact O-N 3.14Å | ||
| 61 | R | 92.6 | Very high | 89.5 | Confident | 87 Ų | 87 | 57.2 Ų | 57.2 | 33% | 0.328 | 25% | 0.254 | S | S | . | . | trans | -94.8 | 135.6 | 177.5 | -67.7 | -174 | -179.7 | -168.9 | 0.1 | 113 | K34 N59 E65 R66 T67 | K34-R61 PolarHBondContact NZ-O 2.97Å; N59-R61 PolarHBondContact O-N 3Å; R61-E65 IonicContact NH1-OE2 3.67Å; R61-R66 CarbonylContact C-O 3.52Å; R61-R66 WeakPolarHBondContact CA-O 3.48Å; R61-T67 HydrophobicContact CG-CG2 4.25Å | ||
| 62 | D | 89.6 | Confident | 89.8 | Confident | 6 Ų | 6 | 56.5 Ų | 56.5 | 3% | 0.032 | 25% | 0.25 | C | C | . | . | trans | -78 | -173.9 | 175.1 | 93.9 | -22.4 | 0 | 0 | 0 | 111.9 | H32 K64 E65 R66 | H32-D62 VanDerWaalsContact O-CB 3.28Å; H32-D62 WeakPolarHBondContact O-CB 3.26Å; D62-K64 PolarHBondContact O-N 3.32Å; D62-K64 VanDerWaalsContact OD1-CA 3.29Å; D62-K64 WeakPolarHBondContact OD1-CA 3.3Å; D62-K64 WeakPolarHBondContact OD1-CB 3.35Å; D62-K64 PolarHBondContact OD1-N 3.2Å; D62-E65 PolarHBondContact O-N 3.24Å; D62-E65 VanDerWaalsContact O-N 3.16Å; D62-E65 PolarHBondContact OD1-N 3.43Å; D62-R66 PolarHBondContact N-O 2.61Å; D62-R66 WeakPolarHBondContact OD1-CB 3.22Å; D62-R66 PolarHBondContact OD1-N 3.35Å; D62-R66 IonicContact OD1-NE 3.99Å; D62-R66 PolarHBondContact OD1-NE 2.95Å; D62-R66 IonicContact OD2-CZ 3.91Å; D62-R66 IonicContact OD2-NE 2.73Å; D62-R66 PolarHBondContact OD2-NE 2.84Å; D62-R66 IonicContact OD2-NH2 3.17Å; D62-R66 PolarHBondContact OD2-NH2 3.08Å | ||
| 63 | R | 87.6 | Confident | 90.1 | Very high | 148 Ų | 148 | 55.5 Ų | 55.5 | 56% | 0.558 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -69.1 | -6.5 | 179.6 | -69 | -172.6 | 177 | 170.8 | -1.6 | 114.5 | Y31 H32 R96 | Y31-R63 PolarHBondContact O-NH1 3.22Å; H32-R63 HydrophobicContact CB-CB 4.23Å; H32-R63 PolarHBondContact O-N 3.46Å; H32-R63 VanDerWaalsContact O-N 3.15Å; R63-R96 PolarHBondContact O-NE 3.28Å; R63-R96 PolarHBondContact O-NH1 3.31Å; R63-R96 PolarHBondContact O-NH2 3.32Å |
| 64 | K | 85.5 | Confident | 90.3 | Very high | 82 Ų | 82 | 50.2 Ų | 50.2 | 36% | 0.357 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -113.8 | 17.9 | 175.2 | -70.7 | -67.6 | -169.2 | 169.4 | 0 | 111.5 | H32 D62 R66 R96 | H32-K64 VanDerWaalsContact CE1-CE 3.41Å; H32-K64 WeakPolarHBondContact CE1-CE 3.45Å; D62-K64 PolarHBondContact O-N 3.32Å; D62-K64 VanDerWaalsContact OD1-CA 3.29Å; D62-K64 WeakPolarHBondContact OD1-CA 3.3Å; D62-K64 WeakPolarHBondContact OD1-CB 3.35Å; D62-K64 PolarHBondContact OD1-N 3.2Å; K64-R66 HydrophobicContact CB-CG 4.01Å; K64-R66 PolarHBondContact O-N 3.37Å; K64-R66 VanDerWaalsContact O-N 3.16Å; K64-R96 WeakPolarHBondContact O-CG 3.42Å; K64-R96 PolarHBondContact O-N 3.35Å |
| 65 | E | 91.9 | Very high | 90.4 | Very high | 78 Ų | 78 | 49.6 Ų | 49.6 | 36% | 0.364 | 22% | 0.215 | S | C | . | . | S | Bend | trans | 62.6 | 13.7 | -177.9 | -60 | -180 | -147.6 | 0 | 0 | 114.5 | R61 D62 R96 | R61-E65 IonicContact NH1-OE2 3.67Å; D62-E65 PolarHBondContact O-N 3.24Å; D62-E65 VanDerWaalsContact O-N 3.16Å; D62-E65 PolarHBondContact OD1-N 3.43Å; E65-R96 HydrophobicContact CB-CG 3.9Å; E65-R96 HydrophobicContact CG-CG 3.73Å; E65-R96 IonicContact OE1-NE 3.15Å |
| 66 | R | 91.6 | Very high | 91.1 | Very high | 4 Ų | 4 | 37.9 Ų | 37.9 | 2% | 0.015 | 18% | 0.177 | C | C | . | . | trans | -78.4 | 144.6 | 178 | -57.1 | 174.9 | -65.3 | 179.8 | 8.7 | 109.1 | Y26 H37 R61 D62 K64 H70 D95 | Y26-R66 WeakPolarHBondContact OH-CD 3.47Å; H37-R66 PolarHBondContact NE2-O 2.92Å; R61-R66 CarbonylContact C-O 3.52Å; R61-R66 WeakPolarHBondContact CA-O 3.48Å; D62-R66 PolarHBondContact N-O 2.61Å; D62-R66 WeakPolarHBondContact OD1-CB 3.22Å; D62-R66 PolarHBondContact OD1-N 3.35Å; D62-R66 IonicContact OD1-NE 3.99Å; D62-R66 PolarHBondContact OD1-NE 2.95Å; D62-R66 IonicContact OD2-CZ 3.91Å; D62-R66 IonicContact OD2-NE 2.73Å; D62-R66 PolarHBondContact OD2-NE 2.84Å; D62-R66 IonicContact OD2-NH2 3.17Å; D62-R66 PolarHBondContact OD2-NH2 3.08Å; K64-R66 HydrophobicContact CB-CG 4.01Å; K64-R66 PolarHBondContact O-N 3.37Å; K64-R66 VanDerWaalsContact O-N 3.16Å; R66-H70 HydrophobicContact CB-CB 4.01Å; R66-D95 HydrophobicContact CG-CB 3.8Å | ||
| 67 | T | 95.2 | Very high | 91.5 | Very high | 2 Ų | 2 | 34.4 Ų | 34.4 | 1% | 0.012 | 16% | 0.164 | C | C | . | . | trans | -91.3 | 170.6 | 167.2 | 65.8 | 0 | 0 | 0 | 0 | 110.7 | R61 L69 H70 L71 L93 | R61-T67 HydrophobicContact CG-CG2 4.25Å; T67-L69 PolarHBondContact O-N 3.24Å; T67-L69 PolarHBondContact OG1-N 3.28Å; T67-H70 PolarHBondContact N-ND1 3.42Å; T67-H70 WeakPolarHBondContact O-CB 2.86Å; T67-H70 PolarHBondContact O-N 3.24Å; T67-H70 PolarHBondContact OG1-N 3.37Å; T67-H70 PolarHBondContact OG1-ND1 3.43Å; T67-L71 PolarHBondContact O-N 3.01Å; T67-L93 HydrophobicContact CG2-CB 4.03Å; T67-L93 HydrophobicContact CG2-CD1 3.71Å | ||
| 68 | A | 94.1 | Very high | 91.7 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -53.1 | -36.6 | 169.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I36 H37 V40 L71 A72 L84 | I36-A68 HydrophobicContact CD1-CB 4.1Å; I36-A68 HydrophobicContact CG1-CB 3.99Å; I36-A68 HydrophobicContact CG2-CB 4.09Å; H37-A68 PolarHBondContact NE2-N 2.87Å; V40-A68 HydrophobicContact CG2-CB 4.02Å; A68-L71 PolarHBondContact O-N 3.45Å; A68-A72 PolarHBondContact O-N 3.15Å; A68-L84 HydrophobicContact CB-CD1 3.93Å; A68-L84 HydrophobicContact CB-CD2 4.02Å |
| 69 | L | 96.4 | Very high | 92 | Very high | 3 Ų | 3 | 36 Ų | 36 | 2% | 0.016 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -66 | -41.2 | -179.6 | -166.9 | 61.4 | 0 | 0 | 0 | 112.3 | T67 L71 A72 C73 V81 L84 V85 L91 P101 L117 | T67-L69 PolarHBondContact O-N 3.24Å; T67-L69 PolarHBondContact OG1-N 3.28Å; L69-L71 PolarHBondContact O-N 3.44Å; L69-A72 PolarHBondContact O-N 3.04Å; L69-C73 WeakPolarHBondContact O-CB 3.02Å; L69-C73 PolarHBondContact O-N 2.86Å; L69-C73 PolarHBondContact O-SG 3.13Å; L69-V81 HydrophobicContact CD1-CB 4.43Å; L69-V81 HydrophobicContact CD1-CG1 4.09Å; L69-V81 HydrophobicContact CD1-CG2 4.31Å; L69-L84 HydrophobicContact CB-CD1 4.31Å; L69-L84 HydrophobicContact CD1-CB 4.19Å; L69-L84 HydrophobicContact CD1-CD1 4.09Å; L69-V85 HydrophobicContact CD1-CG2 4.29Å; L69-L91 HydrophobicContact CD2-CD2 3.75Å; L69-P101 HydrophobicContact CB-CB 4.42Å; L69-P101 HydrophobicContact CB-CG 4.17Å; L69-P101 HydrophobicContact CD2-CB 4.07Å; L69-P101 HydrophobicContact CD2-CG 3.92Å; L69-P101 HydrophobicContact CG-CB 3.85Å; L69-P101 HydrophobicContact CG-CG 3.98Å; L69-L117 HydrophobicContact CD1-CD2 4.08Å; L69-L117 HydrophobicContact CD2-CD2 3.78Å; L69-L117 HydrophobicContact CG-CD2 4.13Å |
| 70 | H | 94.2 | Very high | 92.1 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -57.7 | -40.1 | 174.1 | -71.1 | 85.9 | 0 | 0 | 0 | 112.2 | R66 T67 A74 L93 D95 R99 | R66-H70 HydrophobicContact CB-CB 4.01Å; T67-H70 PolarHBondContact N-ND1 3.42Å; T67-H70 WeakPolarHBondContact O-CB 2.86Å; T67-H70 PolarHBondContact O-N 3.24Å; T67-H70 PolarHBondContact OG1-N 3.37Å; T67-H70 PolarHBondContact OG1-ND1 3.43Å; H70-A74 WeakPolarHBondContact O-CB 3.19Å; H70-A74 PolarHBondContact O-N 2.92Å; H70-L93 PolarHBondContact CE1-O 3.36Å; H70-L93 PolarHBondContact NE2-O 3.16Å; H70-D95 PolarHBondContact NE2-N 3.23Å; H70-R99 PolarHBondContact NE2-O 2.67Å |
| 71 | L | 91.3 | Very high | 92.3 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -69.7 | -46.8 | 179.3 | -63.6 | 179.6 | 0 | 0 | 0 | 110.8 | I28 L33 H37 V40 T67 A68 L69 C73 A74 T75 | I28-L71 HydrophobicContact CD1-CD2 4Å; I28-L71 HydrophobicContact CG1-CD2 4.1Å; I28-L71 HydrophobicContact CG2-CD2 4.12Å; L33-L71 HydrophobicContact CD2-CD1 3.49Å; L33-L71 VanDerWaalsContact CD2-CD1 3.49Å; L33-L71 HydrophobicContact CD2-CD2 4.4Å; H37-L71 HydrophobicContact CB-CD1 3.56Å; V40-L71 HydrophobicContact CG1-CB 3.89Å; T67-L71 PolarHBondContact O-N 3.01Å; A68-L71 PolarHBondContact O-N 3.45Å; L69-L71 PolarHBondContact O-N 3.44Å; L71-C73 VanDerWaalsContact C-N 3.28Å; L71-C73 PolarHBondContact O-N 3.11Å; L71-A74 PolarHBondContact O-N 2.88Å; L71-A74 VanDerWaalsContact O-N 3.09Å; L71-T75 WeakPolarHBondContact O-CG2 3.49Å; L71-T75 PolarHBondContact O-N 3.5Å; L71-T75 PolarHBondContact O-OG1 3.32Å |
| 72 | A | 94 | Very high | 92.4 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -57.8 | -42.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | V40 A68 L69 T75 G76 Q77 M80 V81 L84 | V40-A72 HydrophobicContact CG1-CB 3.73Å; A68-A72 PolarHBondContact O-N 3.15Å; L69-A72 PolarHBondContact O-N 3.04Å; A72-T75 PolarHBondContact O-OG1 3.35Å; A72-G76 PolarHBondContact O-N 2.87Å; A72-G76 VanDerWaalsContact O-N 3.16Å; A72-Q77 PolarHBondContact O-N 3.14Å; A72-M80 HydrophobicContact CB-CB 3.83Å; A72-V81 HydrophobicContact CB-CG2 3.71Å; A72-L84 HydrophobicContact CB-CD1 4.29Å |
| 73 | C | 94.5 | Very high | 92.6 | Very high | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -68.5 | -36.9 | 175.6 | -68 | 0 | 0 | 0 | 0 | 112.7 | L69 L71 P101 A105 Q110 L117 | L69-C73 WeakPolarHBondContact O-CB 3.02Å; L69-C73 PolarHBondContact O-N 2.86Å; L69-C73 PolarHBondContact O-SG 3.13Å; L71-C73 VanDerWaalsContact C-N 3.28Å; L71-C73 PolarHBondContact O-N 3.11Å; C73-P101 HydrophobicContact CB-CB 4.49Å; C73-P101 WeakPolarHBondContact CB-O 3.49Å; C73-A105 HydrophobicContact CB-CB 3.99Å; C73-Q110 VanDerWaalsContact O-CG 3.23Å; C73-Q110 WeakPolarHBondContact O-CG 2.78Å; C73-L117 VanDerWaalsContact SG-CD1 3.56Å |
| 74 | A | 89.4 | Confident | 93 | Very high | 13 Ų | 13 | 26.2 Ų | 26.2 | 11% | 0.107 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -76.4 | -28.3 | 180 | 0 | 0 | 0 | 0 | 0 | 113.8 | Y26 H70 L71 L108 | Y26-A74 HydrophobicContact CD1-CB 3.58Å; Y26-A74 HydrophobicContact CE1-CB 3.28Å; H70-A74 WeakPolarHBondContact O-CB 3.19Å; H70-A74 PolarHBondContact O-N 2.92Å; L71-A74 PolarHBondContact O-N 2.88Å; L71-A74 VanDerWaalsContact O-N 3.09Å; A74-L108 HydrophobicContact CB-CD1 3.58Å; A74-L108 WeakPolarHBondContact O-CD1 3.22Å |
| 75 | T | 86.4 | Confident | 93.4 | Very high | 49 Ų | 49 | 23 Ų | 23 | 30% | 0.301 | 12% | 0.123 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -94.5 | -0.2 | 178.6 | 56.5 | 0 | 0 | 0 | 0 | 113.2 | I28 L71 A72 Q77 | I28-T75 HydrophobicContact CD1-CG2 3.71Å; L71-T75 WeakPolarHBondContact O-CG2 3.49Å; L71-T75 PolarHBondContact O-N 3.5Å; L71-T75 PolarHBondContact O-OG1 3.32Å; A72-T75 PolarHBondContact O-OG1 3.35Å; T75-Q77 VanDerWaalsContact OG1-CG 3.32Å; T75-Q77 WeakPolarHBondContact OG1-CG 3.23Å; T75-Q77 PolarHBondContact OG1-NE2 3.27Å |
| 76 | G | 89.9 | Confident | 93.5 | Very high | 21 Ų | 21 | 22.6 Ų | 22.6 | 22% | 0.216 | 13% | 0.129 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 70.5 | 44.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114 | A72 P78 | A72-G76 PolarHBondContact O-N 2.87Å; A72-G76 VanDerWaalsContact O-N 3.16Å; G76-P78 WeakPolarHBondContact O-CD 2.97Å |
| 77 | Q | 92.1 | Very high | 93.4 | Very high | 6 Ų | 6 | 28 Ų | 28 | 3% | 0.028 | 15% | 0.149 | C | C | . | . | trans | -111.6 | 79.8 | -174.3 | -61.7 | 176.2 | 27.2 | 0 | 0 | 111.5 | V40 R43 A72 T75 E79 M80 V81 | V40-Q77 PolarHBondContact O-NE2 2.81Å; V40-Q77 PolarHBondContact O-OE1 2.95Å; R43-Q77 VanDerWaalsContact CG-CD 3.42Å; R43-Q77 HydrophobicContact CG-CG 4.17Å; A72-Q77 PolarHBondContact O-N 3.14Å; T75-Q77 VanDerWaalsContact OG1-CG 3.32Å; T75-Q77 WeakPolarHBondContact OG1-CG 3.23Å; T75-Q77 PolarHBondContact OG1-NE2 3.27Å; Q77-E79 VanDerWaalsContact C-N 3.26Å; Q77-E79 PolarHBondContact O-N 3.45Å; Q77-M80 HydrophobicContact CB-CB 4Å; Q77-M80 HydrophobicContact CB-CG 3.87Å; Q77-M80 WeakPolarHBondContact O-CB 3.12Å; Q77-M80 PolarHBondContact O-N 2.95Å; Q77-M80 VanDerWaalsContact O-N 3.12Å; Q77-V81 PolarHBondContact O-N 3.29Å; Q77-V81 VanDerWaalsContact O-N 3.09Å | ||
| 78 | P | 94.6 | Very high | 93.1 | Very high | 33 Ų | 33 | 38.9 Ų | 38.9 | 21% | 0.214 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.5 | -30.9 | -174.6 | 25.6 | -33.8 | 0 | 0 | 0 | 112.9 | G76 M80 V81 H82 A112 L116 | G76-P78 WeakPolarHBondContact O-CD 2.97Å; P78-M80 VanDerWaalsContact C-N 3.34Å; P78-M80 PolarHBondContact O-N 3.03Å; P78-V81 PolarHBondContact O-N 3.03Å; P78-H82 WeakPolarHBondContact O-CB 3.34Å; P78-H82 PolarHBondContact O-N 3.46Å; P78-A112 HydrophobicContact CB-CB 4.22Å; P78-A112 HydrophobicContact CG-CB 4.5Å; P78-L116 HydrophobicContact CB-CD1 3.79Å; P78-L116 WeakPolarHBondContact O-CD1 3.3Å |
| 79 | E | 95.6 | Very high | 93 | Very high | 109 Ų | 109 | 39.4 Ų | 39.4 | 51% | 0.509 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -65.3 | -38.8 | 177 | -59.3 | 76.6 | -166.7 | 0 | 0 | 111.6 | L45 Q77 L83 | L45-E79 HydrophobicContact CD2-CB 4.41Å; Q77-E79 VanDerWaalsContact C-N 3.26Å; Q77-E79 PolarHBondContact O-N 3.45Å; E79-L83 PolarHBondContact O-N 3.08Å |
| 80 | M | 94.7 | Very high | 93 | Very high | 4 Ų | 4 | 44.4 Ų | 44.4 | 2% | 0.02 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -69 | -42.2 | 175.2 | -64.6 | -57.5 | -169 | 0 | 0 | 111.2 | R43 L45 L48 A72 Q77 P78 H82 L83 L84 | R43-M80 VanDerWaalsContact CA-CE 3.45Å; R43-M80 HydrophobicContact CB-CE 4.43Å; L45-M80 HydrophobicContact CB-CE 4.36Å; L45-M80 HydrophobicContact CD2-CE 3.85Å; L45-M80 HydrophobicContact CD2-SD 3.32Å; L45-M80 WeakPolarHBondContact CD2-SD 3.3Å; L45-M80 HydrophobicContact CG-CE 3.71Å; L45-M80 HydrophobicContact CG-SD 3.91Å; L48-M80 HydrophobicContact CB-SD 4.43Å; L48-M80 HydrophobicContact CD2-CB 4.39Å; L48-M80 HydrophobicContact CD2-CG 4.42Å; L48-M80 HydrophobicContact CD2-SD 3.3Å; L48-M80 WeakPolarHBondContact CD2-SD 3.26Å; L48-M80 HydrophobicContact CG-SD 4.48Å; A72-M80 HydrophobicContact CB-CB 3.83Å; Q77-M80 HydrophobicContact CB-CB 4Å; Q77-M80 HydrophobicContact CB-CG 3.87Å; Q77-M80 WeakPolarHBondContact O-CB 3.12Å; Q77-M80 PolarHBondContact O-N 2.95Å; Q77-M80 VanDerWaalsContact O-N 3.12Å; P78-M80 VanDerWaalsContact C-N 3.34Å; P78-M80 PolarHBondContact O-N 3.03Å; M80-H82 VanDerWaalsContact C-N 3.35Å; M80-L83 PolarHBondContact O-N 2.79Å; M80-L84 WeakPolarHBondContact O-CB 3.36Å; M80-L84 VanDerWaalsContact O-CG 3.26Å; M80-L84 WeakPolarHBondContact O-CG 3.28Å; M80-L84 PolarHBondContact O-N 2.89Å |
| 81 | V | 96.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57.5 | -51.1 | 174.3 | 173.8 | 0 | 0 | 0 | 0 | 109.6 | L69 A72 Q77 P78 L83 L84 V85 C113 L116 L117 | L69-V81 HydrophobicContact CD1-CB 4.43Å; L69-V81 HydrophobicContact CD1-CG1 4.09Å; L69-V81 HydrophobicContact CD1-CG2 4.31Å; A72-V81 HydrophobicContact CB-CG2 3.71Å; Q77-V81 PolarHBondContact O-N 3.29Å; Q77-V81 VanDerWaalsContact O-N 3.09Å; P78-V81 PolarHBondContact O-N 3.03Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 3.33Å; V81-L84 PolarHBondContact O-N 3.39Å; V81-V85 HydrophobicContact CG1-CG2 4.04Å; V81-V85 WeakPolarHBondContact O-CB 3.25Å; V81-V85 WeakPolarHBondContact O-CG2 3.43Å; V81-V85 PolarHBondContact O-N 3.17Å; V81-C113 HydrophobicContact CG2-CB 4.15Å; V81-L116 HydrophobicContact CB-CD1 4.33Å; V81-L116 HydrophobicContact CG1-CB 3.97Å; V81-L116 HydrophobicContact CG1-CD1 4.19Å; V81-L117 HydrophobicContact CG1-CD2 4.23Å; V81-L117 HydrophobicContact CG1-CG 4.42Å |
| 82 | H | 95.6 | Very high | 93.3 | Very high | 120 Ų | 120 | 48.3 Ų | 48.3 | 56% | 0.556 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -57 | -45.6 | 179 | -176.6 | -84.8 | 0 | 0 | 0 | 112 | P78 M80 S86 | P78-H82 WeakPolarHBondContact O-CB 3.34Å; P78-H82 PolarHBondContact O-N 3.46Å; M80-H82 VanDerWaalsContact C-N 3.35Å; H82-S86 WeakPolarHBondContact O-CB 3.47Å; H82-S86 PolarHBondContact O-N 3.35Å |
| 83 | L | 94.4 | Very high | 93.4 | Very high | 26 Ų | 26 | 49.4 Ų | 49.4 | 14% | 0.136 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.3 | -46.3 | 177.8 | -177.9 | 61.4 | 0 | 0 | 0 | 112.3 | L48 K49 L52 E79 M80 V81 S86 R87 | L48-L83 HydrophobicContact CB-CD2 4.44Å; L48-L83 HydrophobicContact CD2-CD2 3.86Å; L48-L83 HydrophobicContact CG-CD2 3.92Å; K49-L83 HydrophobicContact CG-CD1 4.5Å; K49-L83 HydrophobicContact CG-CD2 3.7Å; L52-L83 HydrophobicContact CD1-CD2 3.99Å; L52-L83 HydrophobicContact CD1-CG 3.85Å; E79-L83 PolarHBondContact O-N 3.08Å; M80-L83 PolarHBondContact O-N 2.79Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 3.33Å; L83-S86 PolarHBondContact O-N 3.34Å; L83-S86 PolarHBondContact O-OG 3.14Å; L83-R87 PolarHBondContact O-N 3.02Å |
| 84 | L | 94.4 | Very high | 93.4 | Very high | 1 Ų | 1 | 50.7 Ų | 50.7 | 1% | 0.005 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.3 | -45.3 | 179.4 | -70.9 | 169 | 0 | 0 | 0 | 111.5 | I36 V40 L48 L52 I58 A68 L69 A72 M80 V81 R87 C89 | I36-L84 HydrophobicContact CD1-CD2 4.2Å; V40-L84 HydrophobicContact CG2-CD1 4.39Å; L48-L84 HydrophobicContact CD1-CD2 4.18Å; L48-L84 HydrophobicContact CD2-CD2 4.46Å; L48-L84 HydrophobicContact CD2-CG 4.4Å; L52-L84 HydrophobicContact CD1-CD2 4.42Å; L52-L84 HydrophobicContact CD2-CD2 4.46Å; I58-L84 HydrophobicContact CD1-CD2 3.92Å; I58-L84 WeakPolarHBondContact CD1-O 3.45Å; I58-L84 HydrophobicContact CG1-CD2 3.87Å; A68-L84 HydrophobicContact CB-CD1 3.93Å; A68-L84 HydrophobicContact CB-CD2 4.02Å; L69-L84 HydrophobicContact CB-CD1 4.31Å; L69-L84 HydrophobicContact CD1-CB 4.19Å; L69-L84 HydrophobicContact CD1-CD1 4.09Å; A72-L84 HydrophobicContact CB-CD1 4.29Å; M80-L84 WeakPolarHBondContact O-CB 3.36Å; M80-L84 VanDerWaalsContact O-CG 3.26Å; M80-L84 WeakPolarHBondContact O-CG 3.28Å; M80-L84 PolarHBondContact O-N 2.89Å; V81-L84 PolarHBondContact O-N 3.39Å; L84-R87 PolarHBondContact O-N 2.84Å; L84-R87 VanDerWaalsContact O-N 3.12Å; L84-C89 VanDerWaalsContact C-SG 3.5Å; L84-C89 PolarHBondContact O-N 3.47Å; L84-C89 PolarHBondContact O-SG 3.17Å; L84-C89 VanDerWaalsContact O-SG 3.34Å |
| 85 | V | 94.8 | Very high | 93.5 | Very high | 15 Ų | 15 | 50.3 Ų | 50.3 | 9% | 0.091 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.9 | -39 | 179.4 | 175.3 | 0 | 0 | 0 | 0 | 111.3 | L69 V81 R87 R88 L91 L117 N120 | L69-V85 HydrophobicContact CD1-CG2 4.29Å; V81-V85 HydrophobicContact CG1-CG2 4.04Å; V81-V85 WeakPolarHBondContact O-CB 3.25Å; V81-V85 WeakPolarHBondContact O-CG2 3.43Å; V81-V85 PolarHBondContact O-N 3.17Å; V85-R87 PolarHBondContact O-N 3.03Å; V85-R87 VanDerWaalsContact O-N 3.08Å; V85-R88 PolarHBondContact O-N 3.02Å; V85-L91 HydrophobicContact CG2-CD2 3.79Å; V85-L117 HydrophobicContact CG2-CD2 4.4Å; V85-N120 HydrophobicContact CG1-CB 3.51Å; V85-N120 VanDerWaalsContact CG1-OD1 3.25Å; V85-N120 WeakPolarHBondContact CG1-OD1 3.26Å |
| 86 | S | 93 | Very high | 93.7 | Very high | 69 Ų | 69 | 54.5 Ų | 54.5 | 48% | 0.483 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -59.5 | -22 | 174.5 | 77.8 | 0 | 0 | 0 | 0 | 113.5 | H82 L83 R88 | H82-S86 WeakPolarHBondContact O-CB 3.47Å; H82-S86 PolarHBondContact O-N 3.35Å; L83-S86 PolarHBondContact O-N 3.34Å; L83-S86 PolarHBondContact O-OG 3.14Å; S86-R88 VanDerWaalsContact C-N 3.35Å |
| 87 | R | 90.9 | Very high | 93.6 | Very high | 117 Ų | 117 | 56.4 Ų | 56.4 | 44% | 0.442 | 26% | 0.262 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.7 | 13.7 | 175.8 | -63.8 | -58.8 | -173.8 | 133 | -0 | 113.3 | L52 I58 L83 L84 V85 C89 | L52-R87 HydrophobicContact CD1-CG 4.19Å; I58-R87 HydrophobicContact CD1-CB 3.57Å; L83-R87 PolarHBondContact O-N 3.02Å; L84-R87 PolarHBondContact O-N 2.84Å; L84-R87 VanDerWaalsContact O-N 3.12Å; V85-R87 PolarHBondContact O-N 3.03Å; V85-R87 VanDerWaalsContact O-N 3.08Å; R87-C89 VanDerWaalsContact C-N 3.35Å; R87-C89 PolarHBondContact O-N 3.5Å |
| 88 | R | 88.6 | Confident | 93.6 | Very high | 230 Ų | 230 | 60 Ų | 60 | 87% | 0.868 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.1 | 44.4 | 178 | -56.7 | -175.1 | 177.1 | -175.1 | -1.8 | 112.8 | V85 S86 | V85-R88 PolarHBondContact O-N 3.02Å; S86-R88 VanDerWaalsContact C-N 3.35Å |
| 89 | C | 92.2 | Very high | 93.5 | Very high | 12 Ų | 12 | 58.6 Ų | 58.6 | 8% | 0.081 | 27% | 0.272 | C | S | . | . | trans | -61.8 | 157.1 | 168.1 | 61.9 | 0 | 0 | 0 | 0 | 111.2 | I58 L84 R87 L91 | I58-C89 HydrophobicContact CD1-CB 3.67Å; I58-C89 HydrophobicContact CG1-CB 3.85Å; I58-C89 HydrophobicContact CG2-CB 4.22Å; L84-C89 VanDerWaalsContact C-SG 3.5Å; L84-C89 PolarHBondContact O-N 3.47Å; L84-C89 PolarHBondContact O-SG 3.17Å; L84-C89 VanDerWaalsContact O-SG 3.34Å; R87-C89 VanDerWaalsContact C-N 3.35Å; R87-C89 PolarHBondContact O-N 3.5Å; C89-L91 PolarHBondContact O-N 3.02Å | ||
| 90 | E | 95.3 | Very high | 93.5 | Very high | 108 Ų | 108 | 53.4 Ų | 53.4 | 51% | 0.505 | 25% | 0.248 | S | C | . | . | trans | -76.5 | 118.8 | 173.2 | -74.1 | 169.8 | -134 | 0 | 0 | 109.8 | N59 L93 | N59-E90 VanDerWaalsContact ND2-CD 3.28Å; N59-E90 VanDerWaalsContact ND2-CG 3.29Å; N59-E90 WeakPolarHBondContact ND2-CG 3.48Å; N59-E90 PolarHBondContact ND2-OE1 2.96Å; N59-E90 PolarHBondContact OD1-N 2.97Å; E90-L93 HydrophobicContact CB-CD1 3.65Å; E90-L93 HydrophobicContact CB-CG 3.73Å; E90-L93 VanDerWaalsContact OE2-CD2 3.29Å; E90-L93 WeakPolarHBondContact OE2-CD2 3.42Å; E90-L93 WeakPolarHBondContact OE2-CG 3.28Å | ||
| 91 | L | 96.2 | Very high | 93.6 | Very high | 21 Ų | 21 | 53.2 Ų | 53.2 | 11% | 0.11 | 25% | 0.247 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.9 | -23.7 | -172.8 | -53 | -176.2 | 0 | 0 | 0 | 113.5 | L69 V85 C89 P101 L117 N120 A122 | L69-L91 HydrophobicContact CD2-CD2 3.75Å; V85-L91 HydrophobicContact CG2-CD2 3.79Å; C89-L91 PolarHBondContact O-N 3.02Å; L91-P101 VanDerWaalsContact O-CD 3.29Å; L91-P101 WeakPolarHBondContact O-CD 3.38Å; L91-L117 HydrophobicContact CD2-CD2 4.18Å; L91-N120 HydrophobicContact CD1-CB 3.91Å; L91-N120 WeakPolarHBondContact CD1-O 3.14Å; L91-A122 HydrophobicContact CB-CB 4.13Å; L91-A122 HydrophobicContact CD1-CB 4.27Å |
| 92 | N | 96.4 | Very high | 93.6 | Very high | 60 Ų | 60 | 53.2 Ų | 53.2 | 32% | 0.321 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107.6 | 10.2 | -167.8 | -66.2 | -17.5 | 0 | 0 | 0 | 113.2 | C94 D123 I126 | N92-C94 PolarHBondContact O-N 3.32Å; N92-D123 WeakPolarHBondContact ND2-CB 3.34Å; N92-D123 PolarHBondContact OD1-N 3.1Å; N92-I126 HydrophobicContact CB-CD1 3.55Å |
| 93 | L | 96 | Very high | 93.6 | Very high | 23 Ų | 23 | 47.6 Ų | 47.6 | 12% | 0.12 | 22% | 0.221 | C | C | . | . | trans | -63.9 | 136.5 | 173.5 | -72.8 | 169.6 | 0 | 0 | 0 | 109.6 | N59 T67 H70 E90 P101 | N59-L93 HydrophobicContact CB-CD1 3.71Å; T67-L93 HydrophobicContact CG2-CB 4.03Å; T67-L93 HydrophobicContact CG2-CD1 3.71Å; H70-L93 PolarHBondContact CE1-O 3.36Å; H70-L93 PolarHBondContact NE2-O 3.16Å; E90-L93 HydrophobicContact CB-CD1 3.65Å; E90-L93 HydrophobicContact CB-CG 3.73Å; E90-L93 VanDerWaalsContact OE2-CD2 3.29Å; E90-L93 WeakPolarHBondContact OE2-CD2 3.42Å; E90-L93 WeakPolarHBondContact OE2-CG 3.28Å; L93-P101 VanDerWaalsContact O-CD 3.28Å; L93-P101 WeakPolarHBondContact O-CD 3.36Å | ||
| 94 | C | 94.6 | Very high | 93.5 | Very high | 28 Ų | 28 | 46.3 Ų | 46.3 | 19% | 0.189 | 21% | 0.214 | C | C | . | . | trans | -96.8 | 150.6 | 179.1 | -51.9 | 0 | 0 | 0 | 0 | 112.8 | N92 D98 R99 | N92-C94 PolarHBondContact O-N 3.32Å; C94-D98 HydrophobicContact CB-CB 4.48Å; C94-R99 WeakPolarHBondContact CA-O 3.5Å | ||
| 95 | D | 92.1 | Very high | 93.5 | Very high | 5 Ų | 5 | 46.3 Ų | 46.3 | 3% | 0.027 | 21% | 0.214 | C | C | . | . | trans | -79.9 | -174.7 | 165.5 | 77.7 | 5.4 | 0 | 0 | 0 | 112 | R66 H70 E97 D98 R99 K104 | R66-D95 HydrophobicContact CG-CB 3.8Å; H70-D95 PolarHBondContact NE2-N 3.23Å; D95-E97 PolarHBondContact O-N 2.91Å; D95-E97 VanDerWaalsContact O-N 3.09Å; D95-E97 WeakPolarHBondContact OD1-CA 3.45Å; D95-E97 PolarHBondContact OD1-N 3.09Å; D95-D98 PolarHBondContact O-N 3.25Å; D95-R99 PolarHBondContact N-O 3.26Å; D95-R99 WeakPolarHBondContact OD1-CB 3.4Å; D95-R99 PolarHBondContact OD1-N 2.73Å; D95-R99 VanDerWaalsContact OD1-N 3.1Å; D95-K104 WeakPolarHBondContact OD2-CE 3.43Å; D95-K104 IonicContact OD2-NZ 3.2Å; D95-K104 PolarHBondContact OD2-NZ 2.96Å; D95-K104 VanDerWaalsContact OD2-NZ 3.15Å | ||
| 96 | R | 89.9 | Confident | 93.5 | Very high | 136 Ų | 136 | 45.7 Ų | 45.7 | 51% | 0.513 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -13.7 | 179.8 | -85.5 | -175.7 | -177.5 | -178.3 | -1.1 | 116.2 | R63 K64 E65 | R63-R96 PolarHBondContact O-NE 3.28Å; R63-R96 PolarHBondContact O-NH1 3.31Å; R63-R96 PolarHBondContact O-NH2 3.32Å; K64-R96 WeakPolarHBondContact O-CG 3.42Å; K64-R96 PolarHBondContact O-N 3.35Å; E65-R96 HydrophobicContact CB-CG 3.9Å; E65-R96 HydrophobicContact CG-CG 3.73Å; E65-R96 IonicContact OE1-NE 3.15Å |
| 97 | E | 87.6 | Confident | 93.4 | Very high | 62 Ų | 62 | 42.9 Ų | 42.9 | 29% | 0.29 | 19% | 0.19 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -105.1 | 19.2 | 177.3 | -61.1 | 172.2 | 148.1 | 0 | 0 | 110.4 | D95 R99 K104 D128 V129 | D95-E97 PolarHBondContact O-N 2.91Å; D95-E97 VanDerWaalsContact O-N 3.09Å; D95-E97 WeakPolarHBondContact OD1-CA 3.45Å; D95-E97 PolarHBondContact OD1-N 3.09Å; E97-R99 HydrophobicContact CB-CG 4.11Å; E97-R99 PolarHBondContact O-N 3.25Å; E97-R99 VanDerWaalsContact O-N 3.14Å; E97-R99 IonicContact OE1-NH1 2.91Å; E97-R99 IonicContact OE2-CZ 2.67Å; E97-R99 VanDerWaalsContact OE2-CZ 3.29Å; E97-R99 IonicContact OE2-NE 3.85Å; E97-R99 IonicContact OE2-NH1 3.05Å; E97-R99 PolarHBondContact OE2-NH1 3.48Å; E97-K104 IonicContact OE2-NZ 3.59Å; E97-K104 PolarHBondContact OE2-NZ 3.12Å; E97-D128 WeakPolarHBondContact O-CB 3.23Å; E97-V129 VanDerWaalsContact C-CG1 3.47Å; E97-V129 HydrophobicContact CB-CG2 4.36Å; E97-V129 WeakPolarHBondContact O-CG1 3.29Å; E97-V129 PolarHBondContact O-N 3.47Å |
| 98 | D | 92.3 | Very high | 93.2 | Very high | 82 Ų | 82 | 40 Ų | 40 | 44% | 0.439 | 18% | 0.183 | S | C | . | . | S | Bend | trans | 55.5 | 21.7 | -172.9 | -64.7 | -29.2 | 0 | 0 | 0 | 113.8 | C94 D95 V129 | C94-D98 HydrophobicContact CB-CB 4.48Å; D95-D98 PolarHBondContact O-N 3.25Å; D98-V129 HydrophobicContact CB-CG1 3.87Å; D98-V129 VanDerWaalsContact OD2-CG1 3.28Å; D98-V129 WeakPolarHBondContact OD2-CG1 3.44Å |
| 99 | R | 91.6 | Very high | 93.4 | Very high | 2 Ų | 2 | 35.8 Ų | 35.8 | 1% | 0.008 | 17% | 0.167 | C | C | . | . | trans | -87.4 | 131.4 | -179.6 | -66 | 171.4 | 175.5 | 167.1 | -4.3 | 110.1 | H70 C94 D95 E97 I103 K104 D128 Y137 | H70-R99 PolarHBondContact NE2-O 2.67Å; C94-R99 WeakPolarHBondContact CA-O 3.5Å; D95-R99 PolarHBondContact N-O 3.26Å; D95-R99 WeakPolarHBondContact OD1-CB 3.4Å; D95-R99 PolarHBondContact OD1-N 2.73Å; D95-R99 VanDerWaalsContact OD1-N 3.1Å; E97-R99 HydrophobicContact CB-CG 4.11Å; E97-R99 PolarHBondContact O-N 3.25Å; E97-R99 VanDerWaalsContact O-N 3.14Å; E97-R99 IonicContact OE1-NH1 2.91Å; E97-R99 IonicContact OE2-CZ 2.67Å; E97-R99 VanDerWaalsContact OE2-CZ 3.29Å; E97-R99 IonicContact OE2-NE 3.85Å; E97-R99 IonicContact OE2-NH1 3.05Å; E97-R99 PolarHBondContact OE2-NH1 3.48Å; R99-I103 HydrophobicContact CB-CB 4.31Å; R99-I103 HydrophobicContact CB-CG2 4.02Å; R99-I103 HydrophobicContact CG-CG2 3.93Å; R99-K104 HydrophobicContact CB-CD 4.4Å; R99-D128 HydrophobicContact CG-CB 3.5Å; R99-D128 VanDerWaalsContact CG-CB 3.5Å; R99-D128 IonicContact CZ-OD2 2.99Å; R99-D128 IonicContact NE-OD2 3.07Å; R99-D128 PolarHBondContact NE-OD2 3.15Å; R99-D128 IonicContact NH2-OD2 2.66Å; R99-Y137 PolarHBondContact NE-OH 2.96Å; R99-Y137 VanDerWaalsContact NE-OH 3.15Å; R99-Y137 PolarHBondContact NH2-OH 3.16Å | ||
| 100 | T | 96.5 | Very high | 93.5 | Very high | 1 Ų | 1 | 38.1 Ų | 38.1 | 1% | 0.006 | 18% | 0.177 | C | C | . | . | trans | -77.9 | 163.1 | 171.5 | 64.8 | 0 | 0 | 0 | 0 | 111.7 | L102 I103 K104 I126 | T100-L102 PolarHBondContact O-N 3.05Å; T100-I103 PolarHBondContact O-N 3.2Å; T100-I103 VanDerWaalsContact O-N 3.16Å; T100-I103 WeakPolarHBondContact OG1-CG1 3.32Å; T100-I103 PolarHBondContact OG1-N 2.82Å; T100-I103 VanDerWaalsContact OG1-N 3.17Å; T100-K104 PolarHBondContact O-N 2.98Å; T100-I126 HydrophobicContact CG2-CB 3.71Å; T100-I126 HydrophobicContact CG2-CD1 3.76Å; T100-I126 HydrophobicContact CG2-CG1 4.33Å; T100-I126 HydrophobicContact CG2-CG2 3.45Å; T100-I126 VanDerWaalsContact CG2-CG2 3.45Å | ||
| 101 | P | 96.5 | Very high | 93.4 | Very high | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -54 | -34.6 | 169.5 | -26.8 | 34.4 | 0 | 0 | 0 | 113.1 | L69 C73 L91 L93 K104 A105 L117 | L69-P101 HydrophobicContact CB-CB 4.42Å; L69-P101 HydrophobicContact CB-CG 4.17Å; L69-P101 HydrophobicContact CD2-CB 4.07Å; L69-P101 HydrophobicContact CD2-CG 3.92Å; L69-P101 HydrophobicContact CG-CB 3.85Å; L69-P101 HydrophobicContact CG-CG 3.98Å; C73-P101 HydrophobicContact CB-CB 4.49Å; C73-P101 WeakPolarHBondContact CB-O 3.49Å; L91-P101 VanDerWaalsContact O-CD 3.29Å; L91-P101 WeakPolarHBondContact O-CD 3.38Å; L93-P101 VanDerWaalsContact O-CD 3.28Å; L93-P101 WeakPolarHBondContact O-CD 3.36Å; P101-K104 PolarHBondContact O-N 3.09Å; P101-A105 PolarHBondContact O-N 3.23Å; P101-L117 HydrophobicContact CB-CD1 3.94Å |
| 102 | L | 97.3 | Very high | 93.4 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -66.1 | -47.8 | 176.3 | 178.4 | 61.2 | 0 | 0 | 0 | 111.3 | T100 K104 A105 V106 A114 L117 L118 A122 P124 A134 L150 | T100-L102 PolarHBondContact O-N 3.05Å; L102-K104 VanDerWaalsContact C-N 3.25Å; L102-K104 PolarHBondContact O-N 3.47Å; L102-A105 PolarHBondContact O-N 3.15Å; L102-V106 HydrophobicContact CD1-CG2 4.22Å; L102-V106 WeakPolarHBondContact O-CG2 3.32Å; L102-V106 PolarHBondContact O-N 3.16Å; L102-A114 HydrophobicContact CD1-CB 3.93Å; L102-L117 HydrophobicContact CB-CD1 4Å; L102-L117 HydrophobicContact CD1-CB 4.35Å; L102-L117 HydrophobicContact CD1-CD1 4.42Å; L102-L118 HydrophobicContact CD1-CD1 4.48Å; L102-L118 HydrophobicContact CD1-CD2 4.17Å; L102-L118 HydrophobicContact CD1-CG 3.99Å; L102-L118 HydrophobicContact CD2-CD2 3.64Å; L102-L118 HydrophobicContact CD2-CG 4.37Å; L102-A122 HydrophobicContact CD2-CB 4.33Å; L102-P124 HydrophobicContact CD2-CB 4.07Å; L102-A134 HydrophobicContact CD2-CB 4.35Å; L102-A134 HydrophobicContact CG-CB 4.12Å; L102-L150 HydrophobicContact CD2-CD2 4.33Å |
| 103 | I | 94.3 | Very high | 93.4 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.005 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -55.6 | -44.4 | 173.8 | -70.8 | 170.8 | 0 | 0 | 0 | 110.2 | R99 T100 V106 Q107 I126 D128 A134 Y137 | R99-I103 HydrophobicContact CB-CB 4.31Å; R99-I103 HydrophobicContact CB-CG2 4.02Å; R99-I103 HydrophobicContact CG-CG2 3.93Å; T100-I103 PolarHBondContact O-N 3.2Å; T100-I103 VanDerWaalsContact O-N 3.16Å; T100-I103 WeakPolarHBondContact OG1-CG1 3.32Å; T100-I103 PolarHBondContact OG1-N 2.82Å; T100-I103 VanDerWaalsContact OG1-N 3.17Å; I103-V106 PolarHBondContact O-N 2.88Å; I103-Q107 WeakPolarHBondContact O-CB 3.19Å; I103-Q107 PolarHBondContact O-N 3.13Å; I103-I126 WeakPolarHBondContact CD1-O 3.15Å; I103-D128 HydrophobicContact CD1-CB 4.39Å; I103-A134 HydrophobicContact CG1-CB 4.24Å; I103-Y137 HydrophobicContact CG2-CD2 3.72Å; I103-Y137 HydrophobicContact CG2-CE2 3.39Å; I103-Y137 HydrophobicContact CG2-CG 4.46Å |
| 104 | K | 92.2 | Very high | 93.5 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -63.6 | -42.9 | 178.1 | -67 | -61.2 | -179.7 | -177.8 | 0 | 113.2 | Y26 D95 E97 R99 T100 P101 L102 V106 L108 | Y26-K104 HydrophobicContact CD2-CD 4.18Å; Y26-K104 HydrophobicContact CE2-CD 3.78Å; D95-K104 WeakPolarHBondContact OD2-CE 3.43Å; D95-K104 IonicContact OD2-NZ 3.2Å; D95-K104 PolarHBondContact OD2-NZ 2.96Å; D95-K104 VanDerWaalsContact OD2-NZ 3.15Å; E97-K104 IonicContact OE2-NZ 3.59Å; E97-K104 PolarHBondContact OE2-NZ 3.12Å; R99-K104 HydrophobicContact CB-CD 4.4Å; T100-K104 PolarHBondContact O-N 2.98Å; P101-K104 PolarHBondContact O-N 3.09Å; L102-K104 VanDerWaalsContact C-N 3.25Å; L102-K104 PolarHBondContact O-N 3.47Å; K104-V106 VanDerWaalsContact C-N 3.34Å; K104-L108 WeakPolarHBondContact O-CB 3.47Å; K104-L108 PolarHBondContact O-N 3.34Å; K104-L108 VanDerWaalsContact O-N 3.09Å |
| 105 | A | 95.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.4 | -47.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | C73 P101 L102 L108 R109 Q110 C113 A114 | C73-A105 HydrophobicContact CB-CB 3.99Å; P101-A105 PolarHBondContact O-N 3.23Å; L102-A105 PolarHBondContact O-N 3.15Å; A105-L108 CarbonylContact O-C 3.57Å; A105-L108 PolarHBondContact O-N 2.83Å; A105-R109 PolarHBondContact O-N 2.79Å; A105-R109 VanDerWaalsContact O-N 3.15Å; A105-Q110 HydrophobicContact CB-CB 4.36Å; A105-Q110 PolarHBondContact O-N 2.94Å; A105-C113 HydrophobicContact CB-CB 4.14Å; A105-A114 HydrophobicContact CB-CB 3.81Å |
| 106 | V | 94.6 | Very high | 93.8 | Very high | 3 Ų | 3 | 35.1 Ų | 35.1 | 2% | 0.018 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -69.9 | -44.8 | -178.9 | 177.5 | 0 | 0 | 0 | 0 | 111.9 | L102 I103 K104 L108 R109 A114 A134 A138 N141 M146 L150 | L102-V106 HydrophobicContact CD1-CG2 4.22Å; L102-V106 WeakPolarHBondContact O-CG2 3.32Å; L102-V106 PolarHBondContact O-N 3.16Å; I103-V106 PolarHBondContact O-N 2.88Å; K104-V106 VanDerWaalsContact C-N 3.34Å; V106-L108 PolarHBondContact O-N 2.9Å; V106-R109 PolarHBondContact O-N 3Å; V106-R109 VanDerWaalsContact O-N 3.08Å; V106-A114 HydrophobicContact CG2-CB 3.96Å; V106-A134 WeakPolarHBondContact CG1-O 3.35Å; V106-A134 HydrophobicContact CG2-CB 4.23Å; V106-A138 HydrophobicContact CG1-CB 3.77Å; V106-N141 PolarHBondContact O-ND2 3.35Å; V106-M146 HydrophobicContact CB-CG 4.48Å; V106-M146 HydrophobicContact CG1-CG 3.88Å; V106-M146 HydrophobicContact CG2-CG 3.88Å; V106-M146 HydrophobicContact CG2-SD 3.84Å; V106-L150 HydrophobicContact CG2-CD1 4.39Å |
| 107 | Q | 90.1 | Very high | 94.1 | Very high | 9 Ų | 9 | 28.6 Ų | 28.6 | 4% | 0.042 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -53.4 | -42.4 | 176.5 | -179.6 | -178.3 | 10.2 | 0 | 0 | 111.4 | F23 I103 Y137 N141 | F23-Q107 HydrophobicContact CD1-CG 4.08Å; F23-Q107 HydrophobicContact CE1-CG 3.96Å; F23-Q107 HydrophobicContact CZ-CG 4.43Å; I103-Q107 WeakPolarHBondContact O-CB 3.19Å; I103-Q107 PolarHBondContact O-N 3.13Å; Q107-Y137 HydrophobicContact CB-CD1 3.64Å; Q107-Y137 HydrophobicContact CB-CE1 4.02Å; Q107-Y137 HydrophobicContact CB-CG 4.23Å; Q107-Y137 HydrophobicContact CG-CD1 3.69Å; Q107-Y137 HydrophobicContact CG-CE1 3.75Å; Q107-N141 PolarHBondContact O-ND2 3.23Å |
| 108 | L | 88.8 | Confident | 94.6 | Very high | 58 Ų | 58 | 25.9 Ų | 25.9 | 30% | 0.304 | 13% | 0.132 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | 15 | -176.8 | -61.7 | 173.3 | 0 | 0 | 0 | 113.5 | Y26 A74 K104 A105 V106 Q110 | Y26-L108 HydrophobicContact CD1-CD1 4.35Å; A74-L108 HydrophobicContact CB-CD1 3.58Å; A74-L108 WeakPolarHBondContact O-CD1 3.22Å; K104-L108 WeakPolarHBondContact O-CB 3.47Å; K104-L108 PolarHBondContact O-N 3.34Å; K104-L108 VanDerWaalsContact O-N 3.09Å; A105-L108 CarbonylContact O-C 3.57Å; A105-L108 PolarHBondContact O-N 2.83Å; V106-L108 PolarHBondContact O-N 2.9Å; L108-Q110 VanDerWaalsContact C-N 3.26Å; L108-Q110 HydrophobicContact CB-CG 4.17Å; L108-Q110 PolarHBondContact O-N 3.47Å; L108-Q110 PolarHBondContact O-NE2 3.04Å |
| 109 | R | 92.1 | Very high | 94.8 | Very high | 140 Ų | 140 | 27.3 Ų | 27.3 | 53% | 0.528 | 14% | 0.136 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.7 | 34.1 | 175.9 | -56 | 176.5 | 178.7 | -105.6 | 1.3 | 114 | A105 V106 E111 N141 | A105-R109 PolarHBondContact O-N 2.79Å; A105-R109 VanDerWaalsContact O-N 3.15Å; V106-R109 PolarHBondContact O-N 3Å; V106-R109 VanDerWaalsContact O-N 3.08Å; R109-E111 PolarHBondContact O-N 3.32Å; R109-N141 HydrophobicContact CG-CB 4.46Å; R109-N141 PolarHBondContact NE-OD1 3.49Å; R109-N141 PolarHBondContact NH1-O 3.46Å; R109-N141 VanDerWaalsContact NH2-CA 3.27Å; R109-N141 PolarHBondContact NH2-O 3Å; R109-N141 PolarHBondContact NH2-OD1 3.05Å |
| 110 | Q | 93.9 | Very high | 95 | Very high | 61 Ų | 61 | 31.2 Ų | 31.2 | 29% | 0.285 | 16% | 0.157 | S | C | . | . | trans | -92 | 69 | 178.8 | -55.4 | -55 | -34.2 | 0 | 0 | 110.6 | C73 A105 L108 A112 C113 A114 | C73-Q110 VanDerWaalsContact O-CG 3.23Å; C73-Q110 WeakPolarHBondContact O-CG 2.78Å; A105-Q110 HydrophobicContact CB-CB 4.36Å; A105-Q110 PolarHBondContact O-N 2.94Å; L108-Q110 VanDerWaalsContact C-N 3.26Å; L108-Q110 HydrophobicContact CB-CG 4.17Å; L108-Q110 PolarHBondContact O-N 3.47Å; L108-Q110 PolarHBondContact O-NE2 3.04Å; Q110-A112 VanDerWaalsContact C-N 3.33Å; Q110-A112 PolarHBondContact O-N 3.01Å; Q110-C113 HydrophobicContact CB-CB 4.11Å; Q110-C113 PolarHBondContact O-N 3.47Å; Q110-C113 VanDerWaalsContact O-N 3.1Å; Q110-A114 PolarHBondContact O-N 2.75Å | ||
| 111 | E | 94.1 | Very high | 94.9 | Very high | 67 Ų | 67 | 34 Ų | 34 | 31% | 0.313 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -56.5 | -41.7 | -172.1 | 178.2 | 175.8 | -173.3 | 0 | 0 | 113.7 | R109 C113 A114 T115 S145 M146 K149 | R109-E111 PolarHBondContact O-N 3.32Å; E111-C113 VanDerWaalsContact C-N 3.34Å; E111-C113 PolarHBondContact O-N 3.06Å; E111-A114 PolarHBondContact O-N 2.96Å; E111-T115 WeakPolarHBondContact O-CB 3.13Å; E111-T115 PolarHBondContact O-N 3Å; E111-T115 PolarHBondContact O-OG1 3.22Å; E111-S145 PolarHBondContact OE1-OG 3.29Å; E111-M146 HydrophobicContact CB-CE 3.91Å; E111-M146 HydrophobicContact CG-CE 3.68Å; E111-K149 WeakPolarHBondContact OE1-CE 3.32Å; E111-K149 IonicContact OE1-NZ 3.95Å; E111-K149 PolarHBondContact OE1-NZ 2.92Å |
| 112 | A | 96 | Very high | 94.9 | Very high | 57 Ų | 57 | 34.2 Ų | 34.2 | 47% | 0.471 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.5 | -42.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | P78 Q110 L116 | P78-A112 HydrophobicContact CB-CB 4.22Å; P78-A112 HydrophobicContact CG-CB 4.5Å; Q110-A112 VanDerWaalsContact C-N 3.33Å; Q110-A112 PolarHBondContact O-N 3.01Å; A112-L116 WeakPolarHBondContact O-CG 3.35Å; A112-L116 PolarHBondContact O-N 2.88Å; A112-L116 VanDerWaalsContact O-N 3.08Å |
| 113 | C | 96.8 | Very high | 94.8 | Very high | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.007 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -67.1 | -44.9 | 177.4 | -66.9 | 0 | 0 | 0 | 0 | 111.2 | V81 A105 Q110 E111 T115 L116 L117 | V81-C113 HydrophobicContact CG2-CB 4.15Å; A105-C113 HydrophobicContact CB-CB 4.14Å; Q110-C113 HydrophobicContact CB-CB 4.11Å; Q110-C113 PolarHBondContact O-N 3.47Å; Q110-C113 VanDerWaalsContact O-N 3.1Å; E111-C113 VanDerWaalsContact C-N 3.34Å; E111-C113 PolarHBondContact O-N 3.06Å; C113-T115 PolarHBondContact O-N 3.38Å; C113-L116 PolarHBondContact O-N 3.16Å; C113-L117 WeakPolarHBondContact O-CG 3.27Å; C113-L117 PolarHBondContact O-N 3.45Å |
| 114 | A | 96.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.3 | -43.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L102 A105 V106 Q110 E111 L116 L117 L118 M146 | L102-A114 HydrophobicContact CD1-CB 3.93Å; A105-A114 HydrophobicContact CB-CB 3.81Å; V106-A114 HydrophobicContact CG2-CB 3.96Å; Q110-A114 PolarHBondContact O-N 2.75Å; E111-A114 PolarHBondContact O-N 2.96Å; A114-L116 PolarHBondContact O-N 3.49Å; A114-L117 PolarHBondContact O-N 3Å; A114-L118 WeakPolarHBondContact O-CG 3.45Å; A114-L118 PolarHBondContact O-N 3.49Å; A114-M146 HydrophobicContact CB-CE 3.54Å; A114-M146 HydrophobicContact CB-SD 3.92Å |
| 115 | T | 96.5 | Very high | 94.9 | Very high | 23 Ų | 23 | 39 Ų | 39 | 14% | 0.141 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.9 | -44.7 | 177.5 | -54.6 | 0 | 0 | 0 | 0 | 111.2 | E111 C113 L117 L118 Q119 K149 | E111-T115 WeakPolarHBondContact O-CB 3.13Å; E111-T115 PolarHBondContact O-N 3Å; E111-T115 PolarHBondContact O-OG1 3.22Å; C113-T115 PolarHBondContact O-N 3.38Å; T115-L117 VanDerWaalsContact C-N 3.33Å; T115-L117 PolarHBondContact O-N 3.44Å; T115-L118 PolarHBondContact O-N 3.24Å; T115-Q119 HydrophobicContact CG2-CG 4.48Å; T115-Q119 WeakPolarHBondContact O-CB 3.36Å; T115-Q119 VanDerWaalsContact O-CG 3.3Å; T115-Q119 WeakPolarHBondContact O-CG 3.48Å; T115-Q119 PolarHBondContact O-N 3.46Å; T115-K149 PolarHBondContact OG1-NZ 3.46Å; T115-K149 VanDerWaalsContact OG1-NZ 3.08Å |
| 116 | L | 97.1 | Very high | 94.8 | Very high | 34 Ų | 34 | 40.9 Ų | 40.9 | 18% | 0.178 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.1 | -40.8 | 176.6 | -76.3 | 171.5 | 0 | 0 | 0 | 112.4 | P78 V81 A112 C113 A114 N120 | P78-L116 HydrophobicContact CB-CD1 3.79Å; P78-L116 WeakPolarHBondContact O-CD1 3.3Å; V81-L116 HydrophobicContact CB-CD1 4.33Å; V81-L116 HydrophobicContact CG1-CB 3.97Å; V81-L116 HydrophobicContact CG1-CD1 4.19Å; A112-L116 WeakPolarHBondContact O-CG 3.35Å; A112-L116 PolarHBondContact O-N 2.88Å; A112-L116 VanDerWaalsContact O-N 3.08Å; C113-L116 PolarHBondContact O-N 3.16Å; A114-L116 PolarHBondContact O-N 3.49Å; L116-N120 PolarHBondContact O-N 3.37Å; L116-N120 PolarHBondContact O-ND2 3.06Å |
| 117 | L | 96.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.4 | -47.7 | 177.3 | -72.1 | 177.6 | 0 | 0 | 0 | 112 | L69 C73 V81 V85 L91 P101 L102 C113 A114 T115 Q119 N120 G121 A122 | L69-L117 HydrophobicContact CD1-CD2 4.08Å; L69-L117 HydrophobicContact CD2-CD2 3.78Å; L69-L117 HydrophobicContact CG-CD2 4.13Å; C73-L117 VanDerWaalsContact SG-CD1 3.56Å; V81-L117 HydrophobicContact CG1-CD2 4.23Å; V81-L117 HydrophobicContact CG1-CG 4.42Å; V85-L117 HydrophobicContact CG2-CD2 4.4Å; L91-L117 HydrophobicContact CD2-CD2 4.18Å; P101-L117 HydrophobicContact CB-CD1 3.94Å; L102-L117 HydrophobicContact CB-CD1 4Å; L102-L117 HydrophobicContact CD1-CB 4.35Å; L102-L117 HydrophobicContact CD1-CD1 4.42Å; C113-L117 WeakPolarHBondContact O-CG 3.27Å; C113-L117 PolarHBondContact O-N 3.45Å; A114-L117 PolarHBondContact O-N 3Å; T115-L117 VanDerWaalsContact C-N 3.33Å; T115-L117 PolarHBondContact O-N 3.44Å; L117-Q119 PolarHBondContact O-N 3.14Å; L117-N120 CarbonylContact O-C 3.53Å; L117-N120 PolarHBondContact O-N 2.87Å; L117-N120 VanDerWaalsContact O-N 3.08Å; L117-G121 PolarHBondContact O-N 3.34Å; L117-A122 HydrophobicContact CB-CB 3.8Å; L117-A122 VanDerWaalsContact O-CB 3.28Å; L117-A122 WeakPolarHBondContact O-CB 3.5Å; L117-A122 PolarHBondContact O-N 3.28Å |
| 118 | L | 96.6 | Very high | 94.5 | Very high | 4 Ų | 4 | 43.2 Ų | 43.2 | 2% | 0.021 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.5 | -44.3 | 179 | -70.4 | 170.6 | 0 | 0 | 0 | 111.8 | L102 A114 T115 N120 G121 P124 L150 Y153 | L102-L118 HydrophobicContact CD1-CD1 4.48Å; L102-L118 HydrophobicContact CD1-CD2 4.17Å; L102-L118 HydrophobicContact CD1-CG 3.99Å; L102-L118 HydrophobicContact CD2-CD2 3.64Å; L102-L118 HydrophobicContact CD2-CG 4.37Å; A114-L118 WeakPolarHBondContact O-CG 3.45Å; A114-L118 PolarHBondContact O-N 3.49Å; T115-L118 PolarHBondContact O-N 3.24Å; L118-N120 PolarHBondContact O-N 3Å; L118-N120 VanDerWaalsContact O-N 3.14Å; L118-G121 PolarHBondContact O-N 3.08Å; L118-P124 HydrophobicContact CD2-CB 4.23Å; L118-L150 HydrophobicContact CD1-CD2 4Å; L118-L150 HydrophobicContact CD2-CD2 4.1Å; L118-Y153 HydrophobicContact CB-CD1 3.92Å; L118-Y153 HydrophobicContact CB-CD2 3.86Å; L118-Y153 HydrophobicContact CB-CE1 4.11Å; L118-Y153 HydrophobicContact CB-CE2 4.07Å; L118-Y153 HydrophobicContact CB-CG 3.81Å; L118-Y153 HydrophobicContact CD1-CD2 3.95Å; L118-Y153 HydrophobicContact CD1-CG 4.37Å; L118-Y153 HydrophobicContact CD2-CG 4.24Å; L118-Y153 HydrophobicContact CG-CD2 4.36Å; L118-Y153 HydrophobicContact CG-CG 4.36Å |
| 119 | Q | 96.4 | Very high | 94.4 | Very high | 112 Ų | 112 | 44.1 Ų | 44.1 | 52% | 0.523 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.5 | -25 | 175.8 | -76.8 | 176 | -19.8 | 0 | 0 | 113.6 | T115 L117 Y153 | T115-Q119 HydrophobicContact CG2-CG 4.48Å; T115-Q119 WeakPolarHBondContact O-CB 3.36Å; T115-Q119 VanDerWaalsContact O-CG 3.3Å; T115-Q119 WeakPolarHBondContact O-CG 3.48Å; T115-Q119 PolarHBondContact O-N 3.46Å; L117-Q119 PolarHBondContact O-N 3.14Å; Q119-Y153 VanDerWaalsContact CG-OH 3.27Å; Q119-Y153 WeakPolarHBondContact CG-OH 3.44Å |
| 120 | N | 96.6 | Very high | 94 | Very high | 85 Ų | 85 | 43.3 Ų | 43.3 | 46% | 0.455 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | 12.7 | 179.5 | -72.7 | -89.9 | 0 | 0 | 0 | 113.2 | V85 L91 L116 L117 L118 | V85-N120 HydrophobicContact CG1-CB 3.51Å; V85-N120 VanDerWaalsContact CG1-OD1 3.25Å; V85-N120 WeakPolarHBondContact CG1-OD1 3.26Å; L91-N120 HydrophobicContact CD1-CB 3.91Å; L91-N120 WeakPolarHBondContact CD1-O 3.14Å; L116-N120 PolarHBondContact O-N 3.37Å; L116-N120 PolarHBondContact O-ND2 3.06Å; L117-N120 CarbonylContact O-C 3.53Å; L117-N120 PolarHBondContact O-N 2.87Å; L117-N120 VanDerWaalsContact O-N 3.08Å; L118-N120 PolarHBondContact O-N 3Å; L118-N120 VanDerWaalsContact O-N 3.14Å |
| 121 | G | 94.7 | Very high | 93.7 | Very high | 58 Ų | 58 | 41.3 Ų | 41.3 | 60% | 0.598 | 24% | 0.242 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 84.3 | 26.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | L117 L118 | L117-G121 PolarHBondContact O-N 3.34Å; L118-G121 PolarHBondContact O-N 3.08Å |
| 122 | A | 96.3 | Very high | 93.3 | Very high | 6 Ų | 6 | 39.2 Ų | 39.2 | 5% | 0.05 | 23% | 0.232 | C | C | . | . | trans | -61.9 | 138.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | L91 L102 L117 P124 | L91-A122 HydrophobicContact CB-CB 4.13Å; L91-A122 HydrophobicContact CD1-CB 4.27Å; L102-A122 HydrophobicContact CD2-CB 4.33Å; L117-A122 HydrophobicContact CB-CB 3.8Å; L117-A122 VanDerWaalsContact O-CB 3.28Å; L117-A122 WeakPolarHBondContact O-CB 3.5Å; L117-A122 PolarHBondContact O-N 3.28Å; A122-P124 WeakPolarHBondContact O-CD 3.35Å | ||
| 123 | D | 95.7 | Very high | 93.1 | Very high | 62 Ų | 62 | 36.5 Ų | 36.5 | 33% | 0.332 | 21% | 0.209 | S | C | . | . | trans | -83.1 | 115.6 | -177.8 | -174.3 | -9.1 | 0 | 0 | 0 | 110.4 | N92 N125 I126 | N92-D123 WeakPolarHBondContact ND2-CB 3.34Å; N92-D123 PolarHBondContact OD1-N 3.1Å; D123-N125 VanDerWaalsContact C-N 3.27Å; D123-N125 PolarHBondContact O-N 3.05Å; D123-N125 WeakPolarHBondContact OD1-CB 3.43Å; D123-N125 PolarHBondContact OD1-N 2.81Å; D123-I126 HydrophobicContact CB-CD1 3.83Å; D123-I126 HydrophobicContact CB-CG1 4.01Å | ||
| 124 | P | 94.8 | Very high | 93 | Very high | 9 Ų | 9 | 36.5 Ų | 36.5 | 6% | 0.058 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.4 | -11.8 | -179.5 | 33.2 | -36.2 | 0 | 0 | 0 | 114.3 | L102 L118 A122 L150 A155 | L102-P124 HydrophobicContact CD2-CB 4.07Å; L118-P124 HydrophobicContact CD2-CB 4.23Å; A122-P124 WeakPolarHBondContact O-CD 3.35Å; P124-L150 HydrophobicContact CB-CD2 4Å; P124-A155 HydrophobicContact CB-CB 3.93Å; P124-A155 HydrophobicContact CG-CB 4.13Å |
| 125 | N | 93.3 | Very high | 92.7 | Very high | 31 Ų | 31 | 37 Ų | 37 | 17% | 0.166 | 21% | 0.211 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94 | -7.7 | -171.4 | -67.3 | -34.7 | 0 | 0 | 0 | 113.5 | D123 T127 G154 A155 N156 E159 | D123-N125 VanDerWaalsContact C-N 3.27Å; D123-N125 PolarHBondContact O-N 3.05Å; D123-N125 WeakPolarHBondContact OD1-CB 3.43Å; D123-N125 PolarHBondContact OD1-N 2.81Å; N125-T127 PolarHBondContact O-N 2.99Å; N125-G154 PolarHBondContact ND2-O 2.66Å; N125-A155 VanDerWaalsContact OD1-CA 3.3Å; N125-A155 WeakPolarHBondContact OD1-CA 3.15Å; N125-N156 PolarHBondContact OD1-N 3.37Å; N125-E159 WeakPolarHBondContact CB-OE2 2.85Å; N125-E159 PolarHBondContact OD1-OE2 2.84Å |
| 126 | I | 92.8 | Very high | 92.3 | Very high | 39 Ų | 39 | 36.3 Ų | 36.3 | 20% | 0.2 | 21% | 0.207 | C | C | . | . | trans | -62.9 | 135 | 174.4 | -61.5 | 171.2 | 0 | 0 | 0 | 109.4 | N92 T100 I103 D123 | N92-I126 HydrophobicContact CB-CD1 3.55Å; T100-I126 HydrophobicContact CG2-CB 3.71Å; T100-I126 HydrophobicContact CG2-CD1 3.76Å; T100-I126 HydrophobicContact CG2-CG1 4.33Å; T100-I126 HydrophobicContact CG2-CG2 3.45Å; T100-I126 VanDerWaalsContact CG2-CG2 3.45Å; I103-I126 WeakPolarHBondContact CD1-O 3.15Å; D123-I126 HydrophobicContact CB-CD1 3.83Å; D123-I126 HydrophobicContact CB-CG1 4.01Å | ||
| 127 | T | 90.1 | Very high | 91.9 | Very high | 56 Ų | 56 | 34.7 Ų | 34.7 | 34% | 0.344 | 20% | 0.198 | S | C | . | . | trans | -102.2 | 149.7 | -179.5 | 50.6 | 0 | 0 | 0 | 0 | 111.7 | N125 R132 T133 | N125-T127 PolarHBondContact O-N 2.99Å; T127-R132 WeakPolarHBondContact CA-O 2.99Å; T127-T133 HydrophobicContact CG2-CG2 3.6Å | ||
| 128 | D | 88.9 | Confident | 91.7 | Very high | 5 Ų | 5 | 34.7 Ų | 34.7 | 3% | 0.027 | 20% | 0.198 | C | C | . | . | trans | -80.8 | 179.2 | 168.4 | 88.1 | -22.3 | 0 | 0 | 0 | 112.2 | E97 R99 I103 F130 G131 R132 Y137 | E97-D128 WeakPolarHBondContact O-CB 3.23Å; R99-D128 HydrophobicContact CG-CB 3.5Å; R99-D128 VanDerWaalsContact CG-CB 3.5Å; R99-D128 IonicContact CZ-OD2 2.99Å; R99-D128 IonicContact NE-OD2 3.07Å; R99-D128 PolarHBondContact NE-OD2 3.15Å; R99-D128 IonicContact NH2-OD2 2.66Å; I103-D128 HydrophobicContact CD1-CB 4.39Å; D128-F130 PolarHBondContact O-N 3.19Å; D128-F130 WeakPolarHBondContact OD1-CA 3.45Å; D128-F130 WeakPolarHBondContact OD1-CB 3.42Å; D128-F130 PolarHBondContact OD1-N 3.1Å; D128-F130 WeakPolarHBondContact OD2-CD2 3.29Å; D128-G131 PolarHBondContact O-N 3.28Å; D128-G131 PolarHBondContact OD1-N 3.09Å; D128-R132 PolarHBondContact N-O 2.76Å; D128-R132 VanDerWaalsContact OD1-CB 3.28Å; D128-R132 WeakPolarHBondContact OD1-CB 3.37Å; D128-R132 IonicContact OD1-CZ 3.89Å; D128-R132 PolarHBondContact OD1-N 3.18Å; D128-R132 IonicContact OD1-NE 3.85Å; D128-R132 PolarHBondContact OD1-NE 2.77Å; D128-R132 VanDerWaalsContact OD1-NE 3.17Å; D128-R132 IonicContact OD1-NH2 2.69Å; D128-R132 IonicContact OD2-CZ 3.44Å; D128-R132 VanDerWaalsContact OD2-CZ 3.26Å; D128-R132 IonicContact OD2-NE 2.68Å; D128-R132 PolarHBondContact OD2-NE 3.18Å; D128-R132 IonicContact OD2-NH2 3.21Å; D128-R132 PolarHBondContact OD2-NH2 3.28Å; D128-Y137 PolarHBondContact OD2-OH 3.34Å | ||
| 129 | V | 86.6 | Confident | 91.3 | Very high | 76 Ų | 76 | 35.1 Ų | 35.1 | 46% | 0.461 | 20% | 0.201 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.6 | -10.5 | -180 | -67.7 | 0 | 0 | 0 | 0 | 114.7 | E97 D98 | E97-V129 VanDerWaalsContact C-CG1 3.47Å; E97-V129 HydrophobicContact CB-CG2 4.36Å; E97-V129 WeakPolarHBondContact O-CG1 3.29Å; E97-V129 PolarHBondContact O-N 3.47Å; D98-V129 HydrophobicContact CB-CG1 3.87Å; D98-V129 VanDerWaalsContact OD2-CG1 3.28Å; D98-V129 WeakPolarHBondContact OD2-CG1 3.44Å |
| 130 | F | 83.9 | Confident | 90.8 | Very high | 123 Ų | 123 | 33 Ų | 33 | 54% | 0.539 | 19% | 0.189 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -107.1 | 12.9 | 176.6 | -53.7 | -92.6 | 0 | 0 | 0 | 112.2 | D128 R132 | D128-F130 PolarHBondContact O-N 3.19Å; D128-F130 WeakPolarHBondContact OD1-CA 3.45Å; D128-F130 WeakPolarHBondContact OD1-CB 3.42Å; D128-F130 PolarHBondContact OD1-N 3.1Å; D128-F130 WeakPolarHBondContact OD2-CD2 3.29Å; F130-R132 VanDerWaalsContact C-N 3.34Å; F130-R132 HydrophobicContact CB-CG 4.19Å; F130-R132 VanDerWaalsContact CE2-NH2 3.26Å; F130-R132 PolarHBondContact O-N 3.25Å |
| 131 | G | 86.5 | Confident | 90.2 | Very high | 20 Ų | 20 | 29.3 Ų | 29.3 | 21% | 0.206 | 17% | 0.169 | C | C | . | . | S | Bend | trans | 75.1 | 18.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | D128 | D128-G131 PolarHBondContact O-N 3.28Å; D128-G131 PolarHBondContact OD1-N 3.09Å |
| 132 | R | 86.6 | Confident | 89.9 | Confident | 23 Ų | 23 | 32 Ų | 32 | 9% | 0.087 | 17% | 0.166 | C | C | . | . | trans | -99.2 | 123.9 | -174.3 | -56.3 | 174.4 | -69.2 | -159.2 | -4.5 | 112.1 | T127 D128 F130 H136 Y137 | T127-R132 WeakPolarHBondContact CA-O 2.99Å; D128-R132 PolarHBondContact N-O 2.76Å; D128-R132 VanDerWaalsContact OD1-CB 3.28Å; D128-R132 WeakPolarHBondContact OD1-CB 3.37Å; D128-R132 IonicContact OD1-CZ 3.89Å; D128-R132 PolarHBondContact OD1-N 3.18Å; D128-R132 IonicContact OD1-NE 3.85Å; D128-R132 PolarHBondContact OD1-NE 2.77Å; D128-R132 VanDerWaalsContact OD1-NE 3.17Å; D128-R132 IonicContact OD1-NH2 2.69Å; D128-R132 IonicContact OD2-CZ 3.44Å; D128-R132 VanDerWaalsContact OD2-CZ 3.26Å; D128-R132 IonicContact OD2-NE 2.68Å; D128-R132 PolarHBondContact OD2-NE 3.18Å; D128-R132 IonicContact OD2-NH2 3.21Å; D128-R132 PolarHBondContact OD2-NH2 3.28Å; F130-R132 VanDerWaalsContact C-N 3.34Å; F130-R132 HydrophobicContact CB-CG 4.19Å; F130-R132 VanDerWaalsContact CE2-NH2 3.26Å; F130-R132 PolarHBondContact O-N 3.25Å; R132-H136 HydrophobicContact CB-CB 4.2Å; R132-Y137 HydrophobicContact CB-CE2 3.8Å; R132-Y137 VanDerWaalsContact CZ-OH 3.31Å; R132-Y137 PolarHBondContact NE-OH 3.26Å; R132-Y137 PolarHBondContact NH2-OH 3.09Å | ||
| 133 | T | 92.1 | Very high | 89.5 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.171 | C | C | . | . | trans | -83.3 | 169.1 | 170.8 | 67.2 | 0 | 0 | 0 | 0 | 112.3 | T127 L135 H136 Y137 E159 | T127-T133 HydrophobicContact CG2-CG2 3.6Å; T133-L135 PolarHBondContact O-N 3.26Å; T133-L135 VanDerWaalsContact O-N 3.14Å; T133-L135 PolarHBondContact OG1-N 3.18Å; T133-H136 PolarHBondContact N-ND1 3.05Å; T133-H136 VanDerWaalsContact N-ND1 3.16Å; T133-H136 WeakPolarHBondContact O-CB 3.27Å; T133-H136 PolarHBondContact O-N 2.65Å; T133-H136 VanDerWaalsContact O-N 3.1Å; T133-H136 PolarHBondContact OG1-ND1 2.98Å; T133-Y137 VanDerWaalsContact O-CD2 3.26Å; T133-Y137 WeakPolarHBondContact O-CD2 3.48Å; T133-E159 HydrophobicContact CG2-CB 4.26Å | ||
| 134 | A | 93.3 | Very high | 89.3 | Confident | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -54.7 | -31.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | L102 I103 V106 Y137 A138 L150 | L102-A134 HydrophobicContact CD2-CB 4.35Å; L102-A134 HydrophobicContact CG-CB 4.12Å; I103-A134 HydrophobicContact CG1-CB 4.24Å; V106-A134 WeakPolarHBondContact CG1-O 3.35Å; V106-A134 HydrophobicContact CG2-CB 4.23Å; A134-Y137 WeakPolarHBondContact O-CB 3.41Å; A134-Y137 PolarHBondContact O-N 2.87Å; A134-A138 PolarHBondContact O-N 3.01Å; A134-L150 HydrophobicContact CB-CD1 4.12Å; A134-L150 HydrophobicContact CB-CD2 3.92Å |
| 135 | L | 92.2 | Very high | 89.2 | Confident | 10 Ų | 10 | 36.5 Ų | 36.5 | 5% | 0.052 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.6 | -40.4 | 178.3 | -172.6 | 64.1 | 0 | 0 | 0 | 112.3 | T133 Y137 A138 V139 I147 L150 L151 I157 | T133-L135 PolarHBondContact O-N 3.26Å; T133-L135 VanDerWaalsContact O-N 3.14Å; T133-L135 PolarHBondContact OG1-N 3.18Å; L135-Y137 VanDerWaalsContact C-N 3.26Å; L135-Y137 PolarHBondContact O-N 3.44Å; L135-A138 PolarHBondContact O-N 3.29Å; L135-A138 VanDerWaalsContact O-N 3.16Å; L135-V139 WeakPolarHBondContact O-CG2 3.26Å; L135-V139 PolarHBondContact O-N 3.38Å; L135-I147 HydrophobicContact CD1-CB 4.4Å; L135-I147 HydrophobicContact CD1-CG1 4.37Å; L135-I147 HydrophobicContact CD1-CG2 4.04Å; L135-L150 HydrophobicContact CB-CD1 4.44Å; L135-L150 HydrophobicContact CD1-CB 4.21Å; L135-L150 HydrophobicContact CD1-CD1 4.32Å; L135-L151 HydrophobicContact CD1-CD2 4.41Å; L135-L151 HydrophobicContact CD1-CG 4.4Å; L135-L151 HydrophobicContact CD2-CD2 4.04Å; L135-I157 HydrophobicContact CD2-CG1 4.33Å |
| 136 | H | 88.1 | Confident | 89.2 | Confident | 9 Ų | 9 | 35.1 Ų | 35.1 | 4% | 0.042 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.9 | -41.2 | 175.9 | -67.1 | 88.2 | 0 | 0 | 0 | 111.6 | R132 T133 V139 Y140 E159 | R132-H136 HydrophobicContact CB-CB 4.2Å; T133-H136 PolarHBondContact N-ND1 3.05Å; T133-H136 VanDerWaalsContact N-ND1 3.16Å; T133-H136 WeakPolarHBondContact O-CB 3.27Å; T133-H136 PolarHBondContact O-N 2.65Å; T133-H136 VanDerWaalsContact O-N 3.1Å; T133-H136 PolarHBondContact OG1-ND1 2.98Å; H136-V139 PolarHBondContact O-N 2.69Å; H136-Y140 PolarHBondContact O-N 3.46Å; H136-E159 PolarHBondContact CE1-O 3.31Å; H136-E159 VanDerWaalsContact CE1-O 3.22Å |
| 137 | Y | 88.6 | Confident | 89.2 | Confident | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.9 | -40.9 | 176.3 | -72.5 | -85.1 | 0 | 0 | 0 | 112.5 | F21 F23 R99 I103 Q107 D128 R132 T133 A134 L135 V139 Y140 N141 | F21-Y137 HydrophobicContact CZ-CD1 4.26Å; F21-Y137 HydrophobicContact CZ-CE1 4.26Å; F23-Y137 HydrophobicContact CD1-CD1 4.42Å; F23-Y137 HydrophobicContact CD1-CE1 4.12Å; F23-Y137 AromaticContact CE1-CD1 3.44Å; F23-Y137 HydrophobicContact CE1-CD1 3.44Å; F23-Y137 VanDerWaalsContact CE1-CD1 3.44Å; F23-Y137 AromaticContact CE1-CE1 3.51Å; F23-Y137 HydrophobicContact CE1-CE1 3.51Å; F23-Y137 HydrophobicContact CZ-CD1 4.04Å; R99-Y137 PolarHBondContact NE-OH 2.96Å; R99-Y137 VanDerWaalsContact NE-OH 3.15Å; R99-Y137 PolarHBondContact NH2-OH 3.16Å; I103-Y137 HydrophobicContact CG2-CD2 3.72Å; I103-Y137 HydrophobicContact CG2-CE2 3.39Å; I103-Y137 HydrophobicContact CG2-CG 4.46Å; Q107-Y137 HydrophobicContact CB-CD1 3.64Å; Q107-Y137 HydrophobicContact CB-CE1 4.02Å; Q107-Y137 HydrophobicContact CB-CG 4.23Å; Q107-Y137 HydrophobicContact CG-CD1 3.69Å; Q107-Y137 HydrophobicContact CG-CE1 3.75Å; D128-Y137 PolarHBondContact OD2-OH 3.34Å; R132-Y137 HydrophobicContact CB-CE2 3.8Å; R132-Y137 VanDerWaalsContact CZ-OH 3.31Å; R132-Y137 PolarHBondContact NE-OH 3.26Å; R132-Y137 PolarHBondContact NH2-OH 3.09Å; T133-Y137 VanDerWaalsContact O-CD2 3.26Å; T133-Y137 WeakPolarHBondContact O-CD2 3.48Å; A134-Y137 WeakPolarHBondContact O-CB 3.41Å; A134-Y137 PolarHBondContact O-N 2.87Å; L135-Y137 VanDerWaalsContact C-N 3.26Å; L135-Y137 PolarHBondContact O-N 3.44Å; Y137-V139 VanDerWaalsContact C-N 3.34Å; Y137-Y140 PolarHBondContact O-N 2.94Å; Y137-N141 VanDerWaalsContact O-CB 3.32Å; Y137-N141 WeakPolarHBondContact O-CB 3.38Å; Y137-N141 PolarHBondContact O-N 3.03Å; Y137-N141 PolarHBondContact O-ND2 3.38Å |
| 138 | A | 91.2 | Very high | 89.3 | Confident | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.1 | -41.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | V106 A134 L135 N141 E142 D143 M146 I147 L150 | V106-A138 HydrophobicContact CG1-CB 3.77Å; A134-A138 PolarHBondContact O-N 3.01Å; L135-A138 PolarHBondContact O-N 3.29Å; L135-A138 VanDerWaalsContact O-N 3.16Å; A138-N141 PolarHBondContact O-N 3.33Å; A138-E142 PolarHBondContact O-N 2.99Å; A138-E142 VanDerWaalsContact O-N 3.17Å; A138-D143 PolarHBondContact O-N 3.08Å; A138-M146 HydrophobicContact CB-CB 4.09Å; A138-M146 HydrophobicContact CB-CG 3.88Å; A138-I147 HydrophobicContact CB-CG1 3.7Å; A138-L150 HydrophobicContact CB-CD1 3.83Å |
| 139 | V | 88.7 | Confident | 89.5 | Confident | 14 Ų | 14 | 41.3 Ų | 41.3 | 9% | 0.085 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64.7 | -47.4 | 176.4 | 173.6 | 0 | 0 | 0 | 0 | 111.7 | L12 L16 L135 H136 Y137 N141 E142 I147 | L12-V139 HydrophobicContact CB-CG1 4.18Å; L12-V139 HydrophobicContact CD2-CB 4.11Å; L12-V139 HydrophobicContact CD2-CG1 3.83Å; L12-V139 HydrophobicContact CD2-CG2 3.85Å; L12-V139 HydrophobicContact CG-CG1 3.98Å; L16-V139 HydrophobicContact CD1-CG1 4.3Å; L135-V139 WeakPolarHBondContact O-CG2 3.26Å; L135-V139 PolarHBondContact O-N 3.38Å; H136-V139 PolarHBondContact O-N 2.69Å; Y137-V139 VanDerWaalsContact C-N 3.34Å; V139-N141 PolarHBondContact O-N 2.77Å; V139-E142 PolarHBondContact O-N 3.17Å; V139-I147 HydrophobicContact CB-CD1 4.46Å; V139-I147 HydrophobicContact CG2-CD1 3.81Å; V139-I147 HydrophobicContact CG2-CG1 4.07Å |
| 140 | Y | 85.1 | Confident | 89.8 | Confident | 68 Ų | 68 | 37.7 Ų | 37.7 | 27% | 0.267 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -59.3 | -37.5 | 175.7 | -179.4 | -87 | 0 | 0 | 0 | 111.8 | L16 F21 F23 H136 Y137 E142 | L16-Y140 HydrophobicContact CB-CD2 4.41Å; F21-Y140 HydrophobicContact CB-CE2 4.26Å; F21-Y140 HydrophobicContact CD1-CD1 4.11Å; F21-Y140 AromaticContact CD1-CD2 3.24Å; F21-Y140 HydrophobicContact CD1-CD2 3.24Å; F21-Y140 HydrophobicContact CD1-CE1 4.06Å; F21-Y140 AromaticContact CD1-CE2 3.18Å; F21-Y140 HydrophobicContact CD1-CE2 3.18Å; F21-Y140 AromaticContact CD1-CG 3.71Å; F21-Y140 HydrophobicContact CD1-CG 3.71Å; F21-Y140 AromaticContact CD1-CZ 3.6Å; F21-Y140 AromaticContact CE1-CD1 3.57Å; F21-Y140 HydrophobicContact CE1-CD1 3.57Å; F21-Y140 AromaticContact CE1-CD2 3.28Å; F21-Y140 HydrophobicContact CE1-CD2 3.28Å; F21-Y140 AromaticContact CE1-CE1 3.92Å; F21-Y140 HydrophobicContact CE1-CE1 3.92Å; F21-Y140 AromaticContact CE1-CE2 3.66Å; F21-Y140 HydrophobicContact CE1-CE2 3.66Å; F21-Y140 AromaticContact CE1-CG 3.21Å; F21-Y140 HydrophobicContact CE1-CG 3.21Å; F21-Y140 AromaticContact CE1-CZ 3.94Å; F21-Y140 HydrophobicContact CG-CD2 4.03Å; F21-Y140 HydrophobicContact CG-CE2 4.03Å; F21-Y140 HydrophobicContact CZ-CD2 4.13Å; F21-Y140 AromaticContact CZ-CG 3.96Å; F21-Y140 HydrophobicContact CZ-CG 3.96Å; F23-Y140 HydrophobicContact CD2-CD1 4.31Å; F23-Y140 AromaticContact CD2-CE1 3.78Å; F23-Y140 HydrophobicContact CD2-CE1 3.78Å; F23-Y140 HydrophobicContact CE1-CD1 4.29Å; F23-Y140 AromaticContact CE2-CD1 3.23Å; F23-Y140 HydrophobicContact CE2-CD1 3.23Å; F23-Y140 AromaticContact CE2-CE1 3.08Å; F23-Y140 HydrophobicContact CE2-CE1 3.08Å; F23-Y140 HydrophobicContact CE2-CG 4.37Å; F23-Y140 AromaticContact CZ-CD1 3.22Å; F23-Y140 HydrophobicContact CZ-CD1 3.22Å; F23-Y140 AromaticContact CZ-CE1 3.57Å; F23-Y140 HydrophobicContact CZ-CE1 3.57Å; F23-Y140 HydrophobicContact CZ-CG 4.02Å; H136-Y140 PolarHBondContact O-N 3.46Å; Y137-Y140 PolarHBondContact O-N 2.94Å; Y140-E142 PolarHBondContact O-N 3.28Å |
| 141 | N | 85.1 | Confident | 90.2 | Very high | 6 Ų | 6 | 35.1 Ų | 35.1 | 3% | 0.032 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.1 | -6.9 | 178.2 | -80.7 | -23.9 | 0 | 0 | 0 | 113.9 | V106 Q107 R109 Y137 A138 V139 D143 | V106-N141 PolarHBondContact O-ND2 3.35Å; Q107-N141 PolarHBondContact O-ND2 3.23Å; R109-N141 HydrophobicContact CG-CB 4.46Å; R109-N141 PolarHBondContact NE-OD1 3.49Å; R109-N141 PolarHBondContact NH1-O 3.46Å; R109-N141 VanDerWaalsContact NH2-CA 3.27Å; R109-N141 PolarHBondContact NH2-O 3Å; R109-N141 PolarHBondContact NH2-OD1 3.05Å; Y137-N141 VanDerWaalsContact O-CB 3.32Å; Y137-N141 WeakPolarHBondContact O-CB 3.38Å; Y137-N141 PolarHBondContact O-N 3.03Å; Y137-N141 PolarHBondContact O-ND2 3.38Å; A138-N141 PolarHBondContact O-N 3.33Å; V139-N141 PolarHBondContact O-N 2.77Å; N141-D143 HydrophobicContact CB-CB 4.31Å; N141-D143 PolarHBondContact O-N 2.97Å |
| 142 | E | 88.3 | Confident | 90.5 | Very high | 116 Ų | 116 | 38.4 Ų | 38.4 | 54% | 0.542 | 20% | 0.202 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.9 | 30.8 | -173.1 | -55.3 | 178.3 | -131.4 | 0 | 0 | 112.2 | R13 A138 V139 Y140 T144 | R13-E142 VanDerWaalsContact CZ-CD 3.44Å; R13-E142 IonicContact CZ-OE1 3.62Å; R13-E142 IonicContact CZ-OE2 2.61Å; R13-E142 IonicContact NE-OE1 3.29Å; R13-E142 IonicContact NH1-OE1 2.84Å; R13-E142 PolarHBondContact NH1-OE1 2.98Å; R13-E142 VanDerWaalsContact NH1-OE1 3.07Å; R13-E142 IonicContact NH1-OE2 3.28Å; R13-E142 PolarHBondContact NH1-OE2 2.69Å; R13-E142 IonicContact NH2-OE1 3.78Å; R13-E142 PolarHBondContact NH2-OE1 3.49Å; R13-E142 IonicContact NH2-OE2 3.66Å; A138-E142 PolarHBondContact O-N 2.99Å; A138-E142 VanDerWaalsContact O-N 3.17Å; V139-E142 PolarHBondContact O-N 3.17Å; Y140-E142 PolarHBondContact O-N 3.28Å; E142-T144 PolarHBondContact O-N 3.23Å |
| 143 | D | 88.6 | Confident | 90.8 | Very high | 27 Ų | 27 | 42 Ų | 42 | 14% | 0.144 | 22% | 0.216 | C | C | . | . | trans | -92.8 | 85.9 | -177.2 | -171.5 | -18.3 | 0 | 0 | 0 | 110.2 | A138 N141 S145 M146 I147 | A138-D143 PolarHBondContact O-N 3.08Å; N141-D143 HydrophobicContact CB-CB 4.31Å; N141-D143 PolarHBondContact O-N 2.97Å; D143-S145 VanDerWaalsContact C-N 3.29Å; D143-S145 PolarHBondContact O-N 3.08Å; D143-S145 PolarHBondContact OD1-N 3.24Å; D143-M146 HydrophobicContact CB-CB 4.01Å; D143-M146 VanDerWaalsContact CG-CB 3.41Å; D143-M146 PolarHBondContact O-N 2.65Å; D143-M146 PolarHBondContact OD1-N 3.2Å; D143-I147 VanDerWaalsContact O-CG1 3.26Å; D143-I147 WeakPolarHBondContact O-CG1 3.41Å; D143-I147 PolarHBondContact O-N 3.06Å | ||
| 144 | T | 90.6 | Very high | 90.7 | Very high | 100 Ų | 100 | 43.9 Ų | 43.9 | 61% | 0.613 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -61.7 | -36.2 | -177.9 | 56.8 | 0 | 0 | 0 | 0 | 112.7 | E142 I147 E148 | E142-T144 PolarHBondContact O-N 3.23Å; T144-I147 PolarHBondContact O-N 3.1Å; T144-E148 WeakPolarHBondContact O-CG 3.39Å; T144-E148 PolarHBondContact O-N 3.26Å |
| 145 | S | 92.7 | Very high | 90.4 | Very high | 43 Ų | 43 | 44.2 Ų | 44.2 | 30% | 0.301 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60.6 | -47.1 | 176 | -179.3 | 0 | 0 | 0 | 0 | 110.8 | E111 D143 E148 K149 | E111-S145 PolarHBondContact OE1-OG 3.29Å; D143-S145 VanDerWaalsContact C-N 3.29Å; D143-S145 PolarHBondContact O-N 3.08Å; D143-S145 PolarHBondContact OD1-N 3.24Å; S145-E148 PolarHBondContact O-N 3.45Å; S145-K149 WeakPolarHBondContact O-CG 3.17Å; S145-K149 PolarHBondContact O-N 3.22Å |
| 146 | M | 93.3 | Very high | 90 | Very high | 2 Ų | 2 | 47.6 Ų | 47.6 | 1% | 0.01 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -67.4 | -37.8 | 178.5 | -171.8 | 53.1 | 60.1 | 0 | 0 | 112.6 | V106 E111 A114 A138 D143 K149 L150 | V106-M146 HydrophobicContact CB-CG 4.48Å; V106-M146 HydrophobicContact CG1-CG 3.88Å; V106-M146 HydrophobicContact CG2-CG 3.88Å; V106-M146 HydrophobicContact CG2-SD 3.84Å; E111-M146 HydrophobicContact CB-CE 3.91Å; E111-M146 HydrophobicContact CG-CE 3.68Å; A114-M146 HydrophobicContact CB-CE 3.54Å; A114-M146 HydrophobicContact CB-SD 3.92Å; A138-M146 HydrophobicContact CB-CB 4.09Å; A138-M146 HydrophobicContact CB-CG 3.88Å; D143-M146 HydrophobicContact CB-CB 4.01Å; D143-M146 VanDerWaalsContact CG-CB 3.41Å; D143-M146 PolarHBondContact O-N 2.65Å; D143-M146 PolarHBondContact OD1-N 3.2Å; M146-K149 PolarHBondContact O-N 3.46Å; M146-L150 HydrophobicContact CG-CD1 3.87Å; M146-L150 HydrophobicContact CG-CG 4.25Å; M146-L150 WeakPolarHBondContact O-CB 3.31Å; M146-L150 VanDerWaalsContact O-CG 3.27Å; M146-L150 WeakPolarHBondContact O-CG 3.39Å; M146-L150 PolarHBondContact O-N 2.99Å; M146-L150 HydrophobicContact SD-CD1 4.29Å; M146-L150 HydrophobicContact SD-CG 4.07Å |
| 147 | I | 92.6 | Very high | 89.2 | Confident | 39 Ų | 39 | 50.8 Ų | 50.8 | 20% | 0.2 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.5 | -52.5 | 175 | -68.7 | 165 | 0 | 0 | 0 | 110.1 | L135 A138 V139 D143 T144 K149 L150 L151 | L135-I147 HydrophobicContact CD1-CB 4.4Å; L135-I147 HydrophobicContact CD1-CG1 4.37Å; L135-I147 HydrophobicContact CD1-CG2 4.04Å; A138-I147 HydrophobicContact CB-CG1 3.7Å; V139-I147 HydrophobicContact CB-CD1 4.46Å; V139-I147 HydrophobicContact CG2-CD1 3.81Å; V139-I147 HydrophobicContact CG2-CG1 4.07Å; D143-I147 VanDerWaalsContact O-CG1 3.26Å; D143-I147 WeakPolarHBondContact O-CG1 3.41Å; D143-I147 PolarHBondContact O-N 3.06Å; T144-I147 PolarHBondContact O-N 3.1Å; I147-K149 VanDerWaalsContact C-N 3.31Å; I147-K149 PolarHBondContact O-N 3.29Å; I147-L150 PolarHBondContact O-N 2.92Å; I147-L151 HydrophobicContact CG2-CD1 3.95Å; I147-L151 HydrophobicContact CG2-CG 4.49Å; I147-L151 VanDerWaalsContact O-CG 3.29Å; I147-L151 WeakPolarHBondContact O-CG 3.26Å; I147-L151 PolarHBondContact O-N 2.98Å |
| 148 | E | 91.9 | Very high | 87.9 | Confident | 136 Ų | 136 | 58.5 Ų | 58.5 | 64% | 0.636 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -58.4 | -44.2 | 179.1 | -72.7 | 175.4 | -175.8 | 0 | 0 | 111.6 | T144 S145 L151 S152 | T144-E148 WeakPolarHBondContact O-CG 3.39Å; T144-E148 PolarHBondContact O-N 3.26Å; S145-E148 PolarHBondContact O-N 3.45Å; E148-L151 PolarHBondContact O-N 3.38Å; E148-S152 PolarHBondContact O-N 2.81Å |
| 149 | K | 93.7 | Very high | 86.3 | Confident | 56 Ų | 56 | 61.8 Ų | 61.8 | 24% | 0.243 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -58.8 | -55.8 | 175.2 | -76.6 | 176.2 | 178.5 | -178.6 | 0 | 111.4 | E111 T115 S145 M146 I147 L151 S152 Y153 | E111-K149 WeakPolarHBondContact OE1-CE 3.32Å; E111-K149 IonicContact OE1-NZ 3.95Å; E111-K149 PolarHBondContact OE1-NZ 2.92Å; T115-K149 PolarHBondContact OG1-NZ 3.46Å; T115-K149 VanDerWaalsContact OG1-NZ 3.08Å; S145-K149 WeakPolarHBondContact O-CG 3.17Å; S145-K149 PolarHBondContact O-N 3.22Å; M146-K149 PolarHBondContact O-N 3.46Å; I147-K149 VanDerWaalsContact C-N 3.31Å; I147-K149 PolarHBondContact O-N 3.29Å; K149-L151 VanDerWaalsContact C-N 3.26Å; K149-L151 PolarHBondContact O-N 3.38Å; K149-S152 PolarHBondContact O-N 3.43Å; K149-S152 PolarHBondContact O-OG 3.07Å; K149-Y153 VanDerWaalsContact O-CD2 3.29Å; K149-Y153 WeakPolarHBondContact O-CD2 3.49Å; K149-Y153 PolarHBondContact O-N 3.3Å; K149-Y153 VanDerWaalsContact O-N 3.09Å |
| 150 | L | 93.6 | Very high | 84.4 | Confident | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -54.8 | -43.9 | -179.1 | -73.4 | 167.8 | 0 | 0 | 0 | 111.8 | L102 V106 L118 P124 A134 L135 A138 M146 I147 S152 Y153 G154 A155 | L102-L150 HydrophobicContact CD2-CD2 4.33Å; V106-L150 HydrophobicContact CG2-CD1 4.39Å; L118-L150 HydrophobicContact CD1-CD2 4Å; L118-L150 HydrophobicContact CD2-CD2 4.1Å; P124-L150 HydrophobicContact CB-CD2 4Å; A134-L150 HydrophobicContact CB-CD1 4.12Å; A134-L150 HydrophobicContact CB-CD2 3.92Å; L135-L150 HydrophobicContact CB-CD1 4.44Å; L135-L150 HydrophobicContact CD1-CB 4.21Å; L135-L150 HydrophobicContact CD1-CD1 4.32Å; A138-L150 HydrophobicContact CB-CD1 3.83Å; M146-L150 HydrophobicContact CG-CD1 3.87Å; M146-L150 HydrophobicContact CG-CG 4.25Å; M146-L150 WeakPolarHBondContact O-CB 3.31Å; M146-L150 VanDerWaalsContact O-CG 3.27Å; M146-L150 WeakPolarHBondContact O-CG 3.39Å; M146-L150 PolarHBondContact O-N 2.99Å; M146-L150 HydrophobicContact SD-CD1 4.29Å; M146-L150 HydrophobicContact SD-CG 4.07Å; I147-L150 PolarHBondContact O-N 2.92Å; L150-S152 PolarHBondContact O-N 3.24Å; L150-Y153 CarbonylContact O-C 3.59Å; L150-Y153 PolarHBondContact O-N 3.01Å; L150-G154 PolarHBondContact O-N 3.31Å; L150-A155 VanDerWaalsContact C-CB 3.46Å; L150-A155 HydrophobicContact CB-CB 3.85Å; L150-A155 WeakPolarHBondContact O-CB 3.49Å; L150-A155 PolarHBondContact O-N 2.82Å |
| 151 | L | 91.8 | Very high | 82.7 | Confident | 68 Ų | 68 | 63.1 Ų | 63.1 | 36% | 0.356 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 176.6 | -67.3 | 174.5 | 0 | 0 | 0 | 112.3 | L135 I147 E148 K149 Y153 G154 I157 | L135-L151 HydrophobicContact CD1-CD2 4.41Å; L135-L151 HydrophobicContact CD1-CG 4.4Å; L135-L151 HydrophobicContact CD2-CD2 4.04Å; I147-L151 HydrophobicContact CG2-CD1 3.95Å; I147-L151 HydrophobicContact CG2-CG 4.49Å; I147-L151 VanDerWaalsContact O-CG 3.29Å; I147-L151 WeakPolarHBondContact O-CG 3.26Å; I147-L151 PolarHBondContact O-N 2.98Å; E148-L151 PolarHBondContact O-N 3.38Å; K149-L151 VanDerWaalsContact C-N 3.26Å; K149-L151 PolarHBondContact O-N 3.38Å; L151-Y153 PolarHBondContact O-N 3.33Å; L151-G154 PolarHBondContact O-N 3.31Å; L151-I157 HydrophobicContact CD2-CD1 3.94Å; L151-I157 HydrophobicContact CD2-CG1 3.54Å |
| 152 | S | 93.4 | Very high | 80.5 | Confident | 89 Ų | 89 | 72.3 Ų | 72.3 | 62% | 0.622 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -63.7 | -25.4 | 176.2 | 71.7 | 0 | 0 | 0 | 0 | 114.1 | E148 K149 L150 G154 | E148-S152 PolarHBondContact O-N 2.81Å; K149-S152 PolarHBondContact O-N 3.43Å; K149-S152 PolarHBondContact O-OG 3.07Å; L150-S152 PolarHBondContact O-N 3.24Å; S152-G154 VanDerWaalsContact C-N 3.34Å |
| 153 | Y | 92.8 | Very high | 78.2 | Confident | 98 Ų | 98 | 76 Ų | 76 | 38% | 0.384 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94 | 13.4 | 175.3 | -76.3 | -86.1 | 0 | 0 | 0 | 113 | L118 Q119 K149 L150 L151 | L118-Y153 HydrophobicContact CB-CD1 3.92Å; L118-Y153 HydrophobicContact CB-CD2 3.86Å; L118-Y153 HydrophobicContact CB-CE1 4.11Å; L118-Y153 HydrophobicContact CB-CE2 4.07Å; L118-Y153 HydrophobicContact CB-CG 3.81Å; L118-Y153 HydrophobicContact CD1-CD2 3.95Å; L118-Y153 HydrophobicContact CD1-CG 4.37Å; L118-Y153 HydrophobicContact CD2-CG 4.24Å; L118-Y153 HydrophobicContact CG-CD2 4.36Å; L118-Y153 HydrophobicContact CG-CG 4.36Å; Q119-Y153 VanDerWaalsContact CG-OH 3.27Å; Q119-Y153 WeakPolarHBondContact CG-OH 3.44Å; K149-Y153 VanDerWaalsContact O-CD2 3.29Å; K149-Y153 WeakPolarHBondContact O-CD2 3.49Å; K149-Y153 PolarHBondContact O-N 3.3Å; K149-Y153 VanDerWaalsContact O-N 3.09Å; L150-Y153 CarbonylContact O-C 3.59Å; L150-Y153 PolarHBondContact O-N 3.01Å; L151-Y153 PolarHBondContact O-N 3.33Å |
| 154 | G | 88.8 | Confident | 77.7 | Confident | 40 Ų | 40 | 78.4 Ų | 78.4 | 41% | 0.412 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.7 | 25.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 115 | N125 L150 L151 S152 N156 | N125-G154 PolarHBondContact ND2-O 2.66Å; L150-G154 PolarHBondContact O-N 3.31Å; L151-G154 PolarHBondContact O-N 3.31Å; S152-G154 VanDerWaalsContact C-N 3.34Å; G154-N156 PolarHBondContact O-N 3.07Å |
| 155 | A | 87.4 | Confident | 77 | Confident | 8 Ų | 8 | 77.3 Ų | 77.3 | 7% | 0.066 | 42% | 0.42 | C | S | . | . | trans | -65.5 | 129.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111 | P124 N125 L150 | P124-A155 HydrophobicContact CB-CB 3.93Å; P124-A155 HydrophobicContact CG-CB 4.13Å; N125-A155 VanDerWaalsContact OD1-CA 3.3Å; N125-A155 WeakPolarHBondContact OD1-CA 3.15Å; L150-A155 VanDerWaalsContact C-CB 3.46Å; L150-A155 HydrophobicContact CB-CB 3.85Å; L150-A155 WeakPolarHBondContact O-CB 3.49Å; L150-A155 PolarHBondContact O-N 2.82Å | ||
| 156 | N | 83.8 | Confident | 76.1 | Confident | 81 Ų | 81 | 79.2 Ų | 79.2 | 43% | 0.433 | 43% | 0.427 | S | S | . | . | trans | -80.2 | 132 | 177.2 | -69.2 | -32.8 | 0 | 0 | 0 | 110.8 | N125 G154 E159 | N125-N156 PolarHBondContact OD1-N 3.37Å; G154-N156 PolarHBondContact O-N 3.07Å; N156-E159 HydrophobicContact CB-CB 3.99Å; N156-E159 PolarHBondContact ND2-OE2 3.06Å | ||
| 157 | I | 71.3 | Confident | 75.1 | Confident | 75 Ų | 75 | 83.7 Ų | 83.7 | 39% | 0.385 | 45% | 0.451 | S | S | . | . | S | Bend | trans | -76 | -33.7 | 176.4 | -60.2 | 171.7 | 0 | 0 | 0 | 110.9 | W9 L135 L151 | W9-I157 HydrophobicContact CH2-CD1 4.47Å; W9-I157 HydrophobicContact CH2-CG2 3.73Å; W9-I157 HydrophobicContact CZ2-CG2 3.94Å; L135-I157 HydrophobicContact CD2-CG1 4.33Å; L151-I157 HydrophobicContact CD2-CD1 3.94Å; L151-I157 HydrophobicContact CD2-CG1 3.54Å |
| 158 | E | 62.1 | Low | 74 | Confident | 163 Ų | 163 | 86.5 Ų | 86.5 | 76% | 0.762 | 47% | 0.467 | S | S | * | . | trans | -94.6 | 4.9 | -170.9 | -60.4 | -63 | 152.1 | 0 | 0 | 113.5 | C160 | E158-C160 PolarHBondContact O-N 2.83Š| ||
| 159 | E | 57.8 | Low | 72.9 | Confident | 69 Ų | 69 | 83.2 Ų | 83.2 | 32% | 0.322 | 46% | 0.455 | S | S | . | . | trans | -76.2 | 55.8 | 172.5 | -140.3 | 158.7 | -161.4 | 0 | 0 | 108.7 | N125 T133 H136 N156 | N125-E159 WeakPolarHBondContact CB-OE2 2.85Å; N125-E159 PolarHBondContact OD1-OE2 2.84Å; T133-E159 HydrophobicContact CG2-CB 4.26Å; H136-E159 PolarHBondContact CE1-O 3.31Å; H136-E159 VanDerWaalsContact CE1-O 3.22Å; N156-E159 HydrophobicContact CB-CB 3.99Å; N156-E159 PolarHBondContact ND2-OE2 3.06Å | ||
| 160 | C | 48.6 | Very low | 71.4 | Confident | 65 Ų | 65 | 85.1 Ų | 85.1 | 44% | 0.439 | 47% | 0.471 | S | S | . | . | trans | -65.3 | 141.9 | 175.1 | -83.6 | 0 | 0 | 0 | 0 | 108.7 | E158 E162 | E158-C160 PolarHBondContact O-N 2.83Å; C160-E162 PolarHBondContact O-N 2.82Å | ||
| 161 | S | 49.2 | Very low | 69.7 | Low | 44 Ų | 44 | 91.7 Ų | 91.7 | 31% | 0.308 | 51% | 0.507 | S | S | . | . | trans | -51.3 | 101.9 | 158.4 | 56.6 | 0 | 0 | 0 | 0 | 108.6 | V163 | S161-V163 PolarHBondContact O-N 2.98Š| ||
| 162 | E | 38.8 | Very low | 67.8 | Low | 200 Ų | 200 | 93.7 Ų | 93.7 | 94% | 0.935 | 52% | 0.519 | S | S | * | . | trans | -61.4 | 106.9 | 158.6 | -72.9 | -172.9 | 169.9 | 0 | 0 | 106.2 | C160 | C160-E162 PolarHBondContact O-N 2.82Š| ||
| 163 | V | 39.9 | Very low | 65.5 | Low | 192 Ų | 192 | 94.1 Ų | 94.1 | 100% | 1.164 | 51% | 0.51 | S | S | * | . | trans | -122.5 | 0 | 165.6 | -73.4 | 0 | 0 | 0 | 0 | 109 | S161 | S161-V163 PolarHBondContact O-N 2.98Š|
Retrieved 163 of 163 residues in 1230.2 ms
(Link to these results)