| 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 | 37.8 | Very low | 36.2 | Very low | 231 Ų | 231 | 137.9 Ų | 137.9 | 100% | 1.138 | 80% | 0.8 | S | S | * | * | 0 | 121.1 | 0 | -77 | 165 | 100 | 0 | 0 | 107.9 | |||||
| 2 | M | 34.8 | Very low | 36.3 | Very low | 182 Ų | 182 | 137.6 Ų | 137.6 | 90% | 0.897 | 80% | 0.802 | S | S | * | * | trans | 49.8 | 114.2 | 158.8 | -68.8 | 151.9 | 130 | 0 | 0 | 118.6 | ||||
| 3 | S | 33.4 | Very low | 36.4 | Very low | 92 Ų | 92 | 139.3 Ų | 139.3 | 64% | 0.643 | 81% | 0.805 | S | S | * | * | 93.5 | 118 | 55.8 | 175.7 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 4 | N | 36.1 | Very low | 36.2 | Very low | 148 Ų | 148 | 137.3 Ų | 137.3 | 79% | 0.791 | 80% | 0.803 | S | S | * | * | trans | 68.4 | 153.2 | 144.4 | -68.7 | 4.9 | 0 | 0 | 0 | 118.8 | ||||
| 5 | S | 35.6 | Very low | 36.4 | Very low | 104 Ų | 104 | 141.9 Ų | 141.9 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | cis | -172.5 | 163.6 | -4.9 | -88.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 6 | S | 40 | Very low | 36.3 | Very low | 112 Ų | 112 | 136.7 Ų | 136.7 | 78% | 0.783 | 80% | 0.797 | S | S | * | * | trans | -53.1 | 151.6 | 176.6 | -39 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 7 | T | 36.4 | Very low | 36.4 | Very low | 148 Ų | 148 | 135.6 Ų | 135.6 | 91% | 0.908 | 80% | 0.798 | S | S | * | * | trans | -159.4 | 128.5 | 135 | 2 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 8 | S | 36.8 | Very low | 36.7 | Very low | 104 Ų | 104 | 134.6 Ų | 134.6 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | trans | -59.9 | 155 | 164.6 | 173.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 9 | M | 34.1 | Very low | 37.2 | Very low | 161 Ų | 161 | 139.8 Ų | 139.8 | 79% | 0.793 | 80% | 0.798 | S | S | * | * | trans | -166.5 | 110.7 | 133 | -88 | -104.2 | -103 | 0 | 0 | 109.8 | ||||
| 10 | A | 39.5 | Very low | 37.6 | Very low | 85 Ų | 85 | 141.7 Ų | 141.7 | 70% | 0.702 | 80% | 0.8 | S | S | * | * | trans | -74.4 | 131.2 | 163.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 11 | H | 33.8 | Very low | 38.2 | Very low | 150 Ų | 150 | 140 Ų | 140 | 69% | 0.694 | 80% | 0.797 | S | S | * | * | trans | -136.7 | 102.9 | 159.3 | -87 | -80.3 | 0 | 0 | 0 | 109.6 | L13 | H11-L13 PolarHBondContact O-N 3Š| ||
| 12 | T | 37.5 | Very low | 38.9 | Very low | 134 Ų | 134 | 132.5 Ų | 132.5 | 82% | 0.822 | 77% | 0.765 | S | S | * | * | trans | -58.8 | 112.7 | 162.5 | 42.5 | 0 | 0 | 0 | 0 | 109.8 | S14 | T12-S14 PolarHBondContact O-N 3.46Š| ||
| 13 | L | 36.7 | Very low | 40.1 | Very low | 160 Ų | 160 | 127.9 Ų | 127.9 | 84% | 0.838 | 75% | 0.749 | S | S | * | * | trans | -85.1 | 96.9 | 165.5 | -73.4 | 172 | 0 | 0 | 0 | 108.7 | H11 F15 | H11-L13 PolarHBondContact O-N 3Å; L13-F15 PolarHBondContact O-N 2.95Å | ||
| 14 | S | 33.8 | Very low | 41.3 | Very low | 111 Ų | 111 | 128.8 Ų | 128.8 | 78% | 0.776 | 75% | 0.746 | S | S | * | * | trans | -63.8 | 114.2 | 164.1 | 165.9 | 0 | 0 | 0 | 0 | 109.4 | T12 G16 | T12-S14 PolarHBondContact O-N 3.46Å; S14-G16 VanDerWaalsContact C-N 3.31Å; S14-G16 PolarHBondContact O-N 3.41Å | ||
| 15 | F | 39.8 | Very low | 42.6 | Very low | 207 Ų | 207 | 127 Ų | 127 | 91% | 0.908 | 74% | 0.741 | S | S | * | * | trans | -70.8 | 88.4 | 164.7 | -90 | -88.5 | 0 | 0 | 0 | 109.2 | L13 S17 | L13-F15 PolarHBondContact O-N 2.95Å; F15-S17 PolarHBondContact O-N 3.15Å | ||
| 16 | G | 34 | Very low | 44.2 | Very low | 58 Ų | 58 | 124.7 Ų | 124.7 | 60% | 0.598 | 72% | 0.724 | S | S | * | * | trans | -73.6 | 107.7 | 162 | 0 | 0 | 0 | 0 | 0 | 109 | S14 V18 | S14-G16 VanDerWaalsContact C-N 3.31Å; S14-G16 PolarHBondContact O-N 3.41Å; G16-V18 PolarHBondContact O-N 3.16Å | ||
| 17 | S | 39.4 | Very low | 45.9 | Very low | 118 Ų | 118 | 121 Ų | 121 | 83% | 0.825 | 70% | 0.696 | S | S | * | * | trans | -66.2 | 96.5 | 169.3 | -176.9 | 0 | 0 | 0 | 0 | 108.8 | F15 R19 | F15-S17 PolarHBondContact O-N 3.15Å; S17-R19 PolarHBondContact O-N 3.15Å | ||
| 18 | V | 41.8 | Very low | 48.1 | Very low | 117 Ų | 117 | 116.5 Ų | 116.5 | 71% | 0.709 | 66% | 0.664 | S | S | * | * | trans | -73.4 | 105.3 | 168.7 | 177.7 | 0 | 0 | 0 | 0 | 106.7 | G16 Q20 | G16-V18 PolarHBondContact O-N 3.16Å; V18-Q20 VanDerWaalsContact C-N 3.32Å; V18-Q20 HydrophobicContact CG1-CG 4.26Å; V18-Q20 PolarHBondContact O-N 2.95Å | ||
| 19 | R | 44.5 | Very low | 50.4 | Low | 235 Ų | 235 | 114.5 Ų | 114.5 | 89% | 0.887 | 65% | 0.654 | S | S | * | * | trans | -60 | 97.8 | 163.2 | -85.4 | -177.6 | 169.8 | -169.4 | -3.1 | 107.5 | S17 S21 | S17-R19 PolarHBondContact O-N 3.15Å; R19-S21 PolarHBondContact O-N 2.9Å | ||
| 20 | Q | 45.3 | Very low | 52.9 | Low | 177 Ų | 177 | 111.5 Ų | 111.5 | 83% | 0.827 | 64% | 0.641 | S | S | * | * | trans | -74.2 | 111.1 | 171.4 | -72.4 | 178.3 | -9.3 | 0 | 0 | 108.1 | V18 | V18-Q20 VanDerWaalsContact C-N 3.32Å; V18-Q20 HydrophobicContact CG1-CG 4.26Å; V18-Q20 PolarHBondContact O-N 2.95Å | ||
| 21 | S | 50.6 | Low | 55.2 | Low | 106 Ų | 106 | 107.5 Ų | 107.5 | 74% | 0.741 | 61% | 0.607 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 135.7 | 164.8 | -50.3 | 0 | 0 | 0 | 0 | 108.7 | R19 | R19-S21 PolarHBondContact O-N 2.9Š|
| 22 | P | 53.2 | Low | 57.9 | Low | 73 Ų | 73 | 104.2 Ų | 104.2 | 47% | 0.474 | 59% | 0.592 | S | S | . | * | P | Polyproline II helix | trans | -60.9 | 147.3 | 176.7 | 25.4 | -32.3 | 0 | 0 | 0 | 110.1 | N27 | P22-N27 WeakPolarHBondContact CG-OD1 3.26Š|
| 23 | P | 59.3 | Low | 60.6 | Low | 85 Ų | 85 | 99.6 Ų | 99.6 | 55% | 0.552 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 140.5 | 179.3 | 24.4 | -31.6 | 0 | 0 | 0 | 110.5 | T25 S26 N27 | P23-T25 PolarHBondContact O-N 2.96Å; P23-S26 WeakPolarHBondContact O-CA 3.47Å; P23-S26 VanDerWaalsContact O-CB 3.23Å; P23-S26 WeakPolarHBondContact O-CB 3.48Å; P23-S26 PolarHBondContact O-N 2.64Å; P23-N27 PolarHBondContact O-N 3.06Å |
| 24 | L | 59.6 | Low | 63.4 | Low | 111 Ų | 111 | 92.9 Ų | 92.9 | 58% | 0.581 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -49.1 | -33.6 | -177.7 | -72.8 | 161.3 | 0 | 0 | 0 | 113.9 | N27 F28 | L24-N27 PolarHBondContact O-N 3.31Å; L24-F28 PolarHBondContact O-N 3.01Å |
| 25 | T | 62.3 | Low | 66.4 | Low | 112 Ų | 112 | 89 Ų | 89 | 69% | 0.687 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -67.1 | -32.9 | 176.6 | 46.7 | 0 | 0 | 0 | 0 | 113.2 | P23 A29 | P23-T25 PolarHBondContact O-N 2.96Å; T25-A29 PolarHBondContact O-N 3.21Å |
| 26 | S | 69.4 | Low | 69.2 | Low | 54 Ų | 54 | 83.3 Ų | 83.3 | 38% | 0.378 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.7 | -43.1 | 175.5 | -175.2 | 0 | 0 | 0 | 0 | 111.1 | P23 A29 L30 | P23-S26 WeakPolarHBondContact O-CA 3.47Å; P23-S26 VanDerWaalsContact O-CB 3.23Å; P23-S26 WeakPolarHBondContact O-CB 3.48Å; P23-S26 PolarHBondContact O-N 2.64Å; S26-A29 PolarHBondContact O-N 2.78Å; S26-L30 VanDerWaalsContact O-CB 3.29Å; S26-L30 WeakPolarHBondContact O-CB 3.5Å; S26-L30 PolarHBondContact O-N 3.08Å |
| 27 | N | 76.8 | Confident | 72.2 | Confident | 34 Ų | 34 | 82.8 Ų | 82.8 | 18% | 0.182 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -68.2 | -38.1 | -179.5 | -74.3 | 1.2 | 0 | 0 | 0 | 112.2 | P22 P23 L24 T31 | P22-N27 WeakPolarHBondContact CG-OD1 3.26Å; P23-N27 PolarHBondContact O-N 3.06Å; L24-N27 PolarHBondContact O-N 3.31Å; N27-T31 WeakPolarHBondContact O-CB 3.37Å; N27-T31 PolarHBondContact O-N 2.94Å; N27-T31 PolarHBondContact O-OG1 3.45Å |
| 28 | F | 81.2 | Confident | 75 | Confident | 54 Ų | 54 | 77.1 Ų | 77.1 | 24% | 0.237 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -62.2 | -49.6 | 174.5 | -174.5 | -93.5 | 0 | 0 | 0 | 111.7 | L24 L30 T31 H32 R71 F72 L75 | L24-F28 PolarHBondContact O-N 3.01Å; F28-L30 VanDerWaalsContact C-N 3.33Å; F28-L30 PolarHBondContact O-N 3.34Å; F28-T31 PolarHBondContact O-N 3.18Å; F28-H32 WeakPolarHBondContact O-CB 3.25Å; F28-H32 PolarHBondContact O-N 3.2Å; F28-R71 HydrophobicContact CD2-CB 4.5Å; F28-R71 HydrophobicContact CE2-CB 3.66Å; F28-R71 HydrophobicContact CZ-CB 4.14Å; F28-F72 HydrophobicContact CB-CE1 3.81Å; F28-F72 HydrophobicContact CB-CZ 3.92Å; F28-F72 AromaticContact CD2-CD1 3.86Å; F28-F72 HydrophobicContact CD2-CD1 3.86Å; F28-F72 AromaticContact CD2-CE1 3.69Å; F28-F72 HydrophobicContact CD2-CE1 3.69Å; F28-F72 HydrophobicContact CD2-CG 4.46Å; F28-F72 HydrophobicContact CD2-CZ 4.07Å; F28-F72 HydrophobicContact CG-CE1 4.26Å; F28-F72 HydrophobicContact CG-CZ 4.48Å; F28-L75 HydrophobicContact CD2-CD2 4.26Å; F28-L75 HydrophobicContact CE2-CD2 4.14Å |
| 29 | A | 85.4 | Confident | 77.6 | Confident | 63 Ų | 63 | 73.3 Ų | 73.3 | 52% | 0.521 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.2 | -40.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T25 S26 H32 G33 | T25-A29 PolarHBondContact O-N 3.21Å; S26-A29 PolarHBondContact O-N 2.78Å; A29-H32 PolarHBondContact O-N 3.46Å; A29-G33 PolarHBondContact O-N 3.17Å |
| 30 | L | 87.3 | Confident | 80.1 | Confident | 98 Ų | 98 | 65.5 Ų | 65.5 | 51% | 0.513 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -63.6 | -46 | 177.4 | -150.3 | 169 | 0 | 0 | 0 | 110.6 | S26 F28 H32 G33 L34 | S26-L30 VanDerWaalsContact O-CB 3.29Å; S26-L30 WeakPolarHBondContact O-CB 3.5Å; S26-L30 PolarHBondContact O-N 3.08Å; F28-L30 VanDerWaalsContact C-N 3.33Å; F28-L30 PolarHBondContact O-N 3.34Å; L30-H32 PolarHBondContact O-N 3.43Å; L30-G33 PolarHBondContact O-N 3.46Å; L30-L34 HydrophobicContact CD2-CD1 4.04Å; L30-L34 HydrophobicContact CD2-CG 4.16Å; L30-L34 WeakPolarHBondContact O-CG 3.42Å; L30-L34 PolarHBondContact O-N 3.12Å |
| 31 | T | 88.4 | Confident | 82.7 | Confident | 1 Ų | 1 | 58.4 Ų | 58.4 | 1% | 0.006 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -68 | -35.5 | 179.3 | -51.1 | 0 | 0 | 0 | 0 | 112.2 | N27 F28 L34 L35 L62 L75 L79 | N27-T31 WeakPolarHBondContact O-CB 3.37Å; N27-T31 PolarHBondContact O-N 2.94Å; N27-T31 PolarHBondContact O-OG1 3.45Å; F28-T31 PolarHBondContact O-N 3.18Å; T31-L34 WeakPolarHBondContact O-CB 3.48Å; T31-L34 PolarHBondContact O-N 3.13Å; T31-L35 PolarHBondContact O-N 3.24Å; T31-L62 HydrophobicContact CG2-CD1 3.96Å; T31-L62 HydrophobicContact CG2-CD2 3.87Å; T31-L62 HydrophobicContact CG2-CG 3.76Å; T31-L75 HydrophobicContact CG2-CD2 3.38Å; T31-L75 HydrophobicContact CG2-CG 3.83Å; T31-L79 HydrophobicContact CG2-CD1 3.75Å |
| 32 | H | 90.8 | Very high | 84.9 | Confident | 81 Ų | 81 | 53.5 Ų | 53.5 | 38% | 0.375 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 171.8 | -170 | -68 | 0 | 0 | 0 | 111.1 | F28 A29 L30 L34 L35 D36 | F28-H32 WeakPolarHBondContact O-CB 3.25Å; F28-H32 PolarHBondContact O-N 3.2Å; A29-H32 PolarHBondContact O-N 3.46Å; L30-H32 PolarHBondContact O-N 3.43Å; H32-L34 VanDerWaalsContact C-N 3.26Å; H32-L34 PolarHBondContact O-N 3.43Å; H32-L35 WeakPolarHBondContact O-CB 3.43Å; H32-L35 PolarHBondContact O-N 3.42Å; H32-L35 VanDerWaalsContact O-N 3.09Å; H32-D36 IonicContact CE1-OD1 3.29Å; H32-D36 IonicContact CE1-OD2 3.88Å; H32-D36 PolarHBondContact CE1-OD2 2.93Å; H32-D36 IonicContact ND1-OD1 3.42Å; H32-D36 IonicContact ND1-OD2 2.62Å; H32-D36 PolarHBondContact ND1-OD2 3.44Å; H32-D36 PolarHBondContact O-N 3.03Å |
| 33 | G | 93.9 | Very high | 86.9 | Confident | 37 Ų | 37 | 54.6 Ų | 54.6 | 38% | 0.381 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.3 | -33.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | A29 L30 S37 | A29-G33 PolarHBondContact O-N 3.17Å; L30-G33 PolarHBondContact O-N 3.46Å; G33-S37 WeakPolarHBondContact O-CB 3.27Å; G33-S37 PolarHBondContact O-N 3.28Å |
| 34 | L | 95.6 | Very high | 88.6 | Confident | 18 Ų | 18 | 55.2 Ų | 55.2 | 9% | 0.094 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.5 | -40.9 | 172.2 | -68.1 | 173.7 | 0 | 0 | 0 | 112 | L30 T31 H32 S37 A38 T54 | L30-L34 HydrophobicContact CD2-CD1 4.04Å; L30-L34 HydrophobicContact CD2-CG 4.16Å; L30-L34 WeakPolarHBondContact O-CG 3.42Å; L30-L34 PolarHBondContact O-N 3.12Å; T31-L34 WeakPolarHBondContact O-CB 3.48Å; T31-L34 PolarHBondContact O-N 3.13Å; H32-L34 VanDerWaalsContact C-N 3.26Å; H32-L34 PolarHBondContact O-N 3.43Å; L34-S37 PolarHBondContact O-N 2.96Å; L34-A38 WeakPolarHBondContact O-CB 3.35Å; L34-A38 PolarHBondContact O-N 3.16Å; L34-T54 HydrophobicContact CB-CG2 4.24Å; L34-T54 HydrophobicContact CD2-CG2 4.01Å; L34-T54 VanDerWaalsContact O-CG2 3.28Å; L34-T54 WeakPolarHBondContact O-CG2 3.47Å |
| 35 | L | 96.9 | Very high | 90.3 | Very high | 29 Ų | 29 | 55.2 Ų | 55.2 | 15% | 0.152 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.3 | -46.2 | 174.7 | 177.4 | 64.6 | 0 | 0 | 0 | 111.4 | T31 H32 S37 A38 A39 L75 A78 L79 V82 | T31-L35 PolarHBondContact O-N 3.24Å; H32-L35 WeakPolarHBondContact O-CB 3.43Å; H32-L35 PolarHBondContact O-N 3.42Å; H32-L35 VanDerWaalsContact O-N 3.09Å; L35-S37 VanDerWaalsContact C-N 3.31Å; L35-S37 PolarHBondContact O-N 3.41Å; L35-A38 PolarHBondContact O-N 3.44Å; L35-A39 WeakPolarHBondContact O-CB 3.13Å; L35-A39 PolarHBondContact O-N 3.46Å; L35-L75 HydrophobicContact CB-CD1 4Å; L35-L75 HydrophobicContact CD2-CD1 3.64Å; L35-L75 HydrophobicContact CG-CD1 4.44Å; L35-A78 HydrophobicContact CD1-CB 4.05Å; L35-A78 HydrophobicContact CD2-CB 3.6Å; L35-L79 HydrophobicContact CB-CD2 3.96Å; L35-L79 HydrophobicContact CB-CG 4.48Å; L35-L79 HydrophobicContact CD1-CD2 3.95Å; L35-L79 HydrophobicContact CD1-CG 4.23Å; L35-V82 HydrophobicContact CD1-CG2 3.96Å |
| 36 | D | 96.9 | Very high | 91.8 | Very high | 88 Ų | 88 | 55.7 Ų | 55.7 | 47% | 0.471 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60 | -43.3 | 177.7 | -67.7 | -35.7 | 0 | 0 | 0 | 111.1 | H32 A39 D40 | H32-D36 IonicContact CE1-OD1 3.29Å; H32-D36 IonicContact CE1-OD2 3.88Å; H32-D36 PolarHBondContact CE1-OD2 2.93Å; H32-D36 IonicContact ND1-OD1 3.42Å; H32-D36 IonicContact ND1-OD2 2.62Å; H32-D36 PolarHBondContact ND1-OD2 3.44Å; H32-D36 PolarHBondContact O-N 3.03Å; D36-A39 PolarHBondContact O-N 3.38Å; D36-D40 PolarHBondContact O-N 3.07Å |
| 37 | S | 97.4 | Very high | 93.2 | Very high | 47 Ų | 47 | 56.6 Ų | 56.6 | 33% | 0.329 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.7 | -45.2 | 175.3 | -177.6 | 0 | 0 | 0 | 0 | 112.1 | G33 L34 L35 A39 D40 Q41 | G33-S37 WeakPolarHBondContact O-CB 3.27Å; G33-S37 PolarHBondContact O-N 3.28Å; L34-S37 PolarHBondContact O-N 2.96Å; L35-S37 VanDerWaalsContact C-N 3.31Å; L35-S37 PolarHBondContact O-N 3.41Å; S37-A39 VanDerWaalsContact C-N 3.31Å; S37-A39 PolarHBondContact O-N 3.29Å; S37-D40 PolarHBondContact O-N 3.37Å; S37-Q41 WeakPolarHBondContact O-CB 3.38Å; S37-Q41 VanDerWaalsContact O-CG 3.28Å; S37-Q41 WeakPolarHBondContact O-CG 3.49Å; S37-Q41 PolarHBondContact O-N 3.11Å; S37-Q41 PolarHBondContact O-OE1 3.07Å |
| 38 | A | 98.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.3 | -38.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L34 L35 Q41 L42 T54 V82 | L34-A38 WeakPolarHBondContact O-CB 3.35Å; L34-A38 PolarHBondContact O-N 3.16Å; L35-A38 PolarHBondContact O-N 3.44Å; A38-Q41 PolarHBondContact O-N 2.82Å; A38-L42 VanDerWaalsContact O-CB 3.24Å; A38-L42 WeakPolarHBondContact O-CB 3.33Å; A38-L42 PolarHBondContact O-N 3.22Å; A38-T54 HydrophobicContact CB-CG2 3.93Å; A38-V82 HydrophobicContact CB-CG1 3.93Å |
| 39 | A | 97.5 | Very high | 95 | Very high | 37 Ų | 37 | 58.4 Ų | 58.4 | 31% | 0.306 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -64.9 | -42.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L35 D36 S37 L42 M43 | L35-A39 WeakPolarHBondContact O-CB 3.13Å; L35-A39 PolarHBondContact O-N 3.46Å; D36-A39 PolarHBondContact O-N 3.38Å; S37-A39 VanDerWaalsContact C-N 3.31Å; S37-A39 PolarHBondContact O-N 3.29Å; A39-L42 PolarHBondContact O-N 2.9Å; A39-M43 VanDerWaalsContact O-CB 3.29Å; A39-M43 WeakPolarHBondContact O-CB 3.25Å; A39-M43 WeakPolarHBondContact O-CG 3.19Å; A39-M43 PolarHBondContact O-N 3.08Å |
| 40 | D | 97.1 | Very high | 95.6 | Very high | 70 Ų | 70 | 56.3 Ų | 56.3 | 37% | 0.374 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64 | -44.8 | 175.4 | -174.2 | 64.4 | 0 | 0 | 0 | 111.7 | D36 S37 L42 V44 Q45 | D36-D40 PolarHBondContact O-N 3.07Å; S37-D40 PolarHBondContact O-N 3.37Å; D40-L42 PolarHBondContact O-N 2.98Å; D40-V44 WeakPolarHBondContact O-CA 3.25Å; D40-V44 VanDerWaalsContact O-CB 3.3Å; D40-V44 WeakPolarHBondContact O-CB 3.48Å; D40-V44 PolarHBondContact O-N 3.41Å; D40-V44 WeakPolarHBondContact OD1-CB 3.39Å; D40-V44 VanDerWaalsContact OD1-CG2 3.27Å; D40-V44 WeakPolarHBondContact OD1-CG2 3.4Å; D40-Q45 PolarHBondContact O-N 3.49Å; D40-Q45 PolarHBondContact OD2-NE2 3.13Å |
| 41 | Q | 98.3 | Very high | 96.2 | Very high | 28 Ų | 28 | 51.6 Ų | 51.6 | 13% | 0.131 | 28% | 0.276 | C | S | . | . | I | π-helix | trans | -60 | -45.4 | 176 | -73.5 | 167.8 | -37.1 | 0 | 0 | 111.8 | S37 A38 Q45 R46 D47 A50 A51 T54 | S37-Q41 WeakPolarHBondContact O-CB 3.38Å; S37-Q41 VanDerWaalsContact O-CG 3.28Å; S37-Q41 WeakPolarHBondContact O-CG 3.49Å; S37-Q41 PolarHBondContact O-N 3.11Å; S37-Q41 PolarHBondContact O-OE1 3.07Å; A38-Q41 PolarHBondContact O-N 2.82Å; Q41-Q45 CarbonylContact O-C 3.51Å; Q41-R46 WeakPolarHBondContact O-CA 3.46Å; Q41-R46 PolarHBondContact O-N 3.03Å; Q41-D47 PolarHBondContact O-N 3.17Å; Q41-A50 HydrophobicContact CG-CB 4.49Å; Q41-A50 PolarHBondContact OE1-O 3.44Å; Q41-A51 HydrophobicContact CB-CB 3.84Å; Q41-T54 PolarHBondContact OE1-OG1 2.78Å |
| 42 | L | 97 | Very high | 96.7 | Very high | 4 Ų | 4 | 52.8 Ų | 52.8 | 2% | 0.021 | 28% | 0.281 | C | S | . | . | I | π-helix | trans | -67.1 | -49.9 | 179.9 | -176.9 | 66.3 | 0 | 0 | 0 | 112 | A38 A39 D40 F48 A51 V82 Q85 A86 | A38-L42 VanDerWaalsContact O-CB 3.24Å; A38-L42 WeakPolarHBondContact O-CB 3.33Å; A38-L42 PolarHBondContact O-N 3.22Å; A39-L42 PolarHBondContact O-N 2.9Å; D40-L42 PolarHBondContact O-N 2.98Å; L42-F48 HydrophobicContact CD1-CD1 3.69Å; L42-F48 HydrophobicContact CD1-CE1 4.13Å; L42-A51 HydrophobicContact CB-CB 3.93Å; L42-V82 HydrophobicContact CB-CG1 4.32Å; L42-V82 HydrophobicContact CD2-CB 4.44Å; L42-V82 HydrophobicContact CD2-CG1 3.73Å; L42-Q85 HydrophobicContact CD1-CB 4.46Å; L42-Q85 HydrophobicContact CD2-CB 3.79Å; L42-A86 HydrophobicContact CD1-CB 4.12Å |
| 43 | M | 95.1 | Very high | 97 | Very high | 96 Ų | 96 | 52.4 Ų | 52.4 | 47% | 0.473 | 28% | 0.282 | S | S | . | . | I | π-helix | trans | -92.4 | -37.2 | -167.7 | -66.6 | -73.5 | 103.5 | 0 | 0 | 114 | A39 F280 | A39-M43 VanDerWaalsContact O-CB 3.29Å; A39-M43 WeakPolarHBondContact O-CB 3.25Å; A39-M43 WeakPolarHBondContact O-CG 3.19Å; A39-M43 PolarHBondContact O-N 3.08Å; M43-F280 WeakPolarHBondContact O-CE1 3.18Å |
| 44 | V | 94.7 | Very high | 97.2 | Very high | 98 Ų | 98 | 50.7 Ų | 50.7 | 59% | 0.594 | 26% | 0.264 | S | S | * | . | I | π-helix | trans | -97.7 | -51.7 | -174.4 | -177.9 | 0 | 0 | 0 | 0 | 110.4 | D40 | D40-V44 WeakPolarHBondContact O-CA 3.25Å; D40-V44 VanDerWaalsContact O-CB 3.3Å; D40-V44 WeakPolarHBondContact O-CB 3.48Å; D40-V44 PolarHBondContact O-N 3.41Å; D40-V44 WeakPolarHBondContact OD1-CB 3.39Å; D40-V44 VanDerWaalsContact OD1-CG2 3.27Å; D40-V44 WeakPolarHBondContact OD1-CG2 3.4Å |
| 45 | Q | 95.3 | Very high | 97.3 | Very high | 111 Ų | 111 | 49.9 Ų | 49.9 | 52% | 0.519 | 26% | 0.26 | S | S | . | . | I | π-helix | trans | -82.6 | -24.3 | -174.6 | -50.7 | -178 | 25.7 | 0 | 0 | 112.3 | D40 Q41 D47 | D40-Q45 PolarHBondContact O-N 3.49Å; D40-Q45 PolarHBondContact OD2-NE2 3.13Å; Q41-Q45 CarbonylContact O-C 3.51Å; Q45-D47 HydrophobicContact CB-CB 4.4Å; Q45-D47 PolarHBondContact O-N 3.44Å |
| 46 | R | 95.8 | Very high | 97.3 | Very high | 122 Ų | 122 | 50.9 Ų | 50.9 | 46% | 0.46 | 26% | 0.264 | S | S | . | . | trans | 57.1 | 30 | -171.4 | -56.6 | 178.4 | 169.9 | -162.4 | -10.4 | 112.7 | Q41 F48 | Q41-R46 WeakPolarHBondContact O-CA 3.46Å; Q41-R46 PolarHBondContact O-N 3.03Å; R46-F48 HydrophobicContact CB-CE1 4.13Å; R46-F48 HydrophobicContact CB-CZ 3.97Å; R46-F48 PolarHBondContact O-N 3.37Å | ||
| 47 | D | 97.6 | Very high | 97.2 | Very high | 72 Ų | 72 | 53 Ų | 53 | 39% | 0.385 | 27% | 0.265 | S | S | . | . | trans | -91.2 | 84.8 | 172.3 | -168.6 | -20.6 | 0 | 0 | 0 | 108.4 | Q41 Q45 Q49 A50 A51 | Q41-D47 PolarHBondContact O-N 3.17Å; Q45-D47 HydrophobicContact CB-CB 4.4Å; Q45-D47 PolarHBondContact O-N 3.44Å; D47-Q49 VanDerWaalsContact C-N 3.34Å; D47-A50 HydrophobicContact CB-CB 4.06Å; D47-A50 PolarHBondContact O-N 3.09Å; D47-A50 VanDerWaalsContact OD1-CB 3.31Å; D47-A50 WeakPolarHBondContact OD1-CB 3.43Å; D47-A50 PolarHBondContact OD1-N 2.85Å; D47-A50 WeakPolarHBondContact OD2-CB 3.44Å; D47-A51 WeakPolarHBondContact O-CB 3.39Å; D47-A51 PolarHBondContact O-N 3.35Å | ||
| 48 | F | 97.9 | Very high | 97 | Very high | 49 Ų | 49 | 50.7 Ų | 50.7 | 22% | 0.215 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.4 | -34.4 | -174.2 | -50.5 | -49.7 | 0 | 0 | 0 | 112.4 | L42 R46 F52 E89 L90 | L42-F48 HydrophobicContact CD1-CD1 3.69Å; L42-F48 HydrophobicContact CD1-CE1 4.13Å; R46-F48 HydrophobicContact CB-CE1 4.13Å; R46-F48 HydrophobicContact CB-CZ 3.97Å; R46-F48 PolarHBondContact O-N 3.37Å; F48-F52 WeakPolarHBondContact O-CB 3.22Å; F48-F52 PolarHBondContact O-N 3.39Å; F48-E89 HydrophobicContact CB-CB 4.33Å; F48-E89 HydrophobicContact CD1-CB 3.79Å; F48-E89 HydrophobicContact CD1-CG 4.09Å; F48-E89 HydrophobicContact CD2-CB 3.67Å; F48-E89 HydrophobicContact CE1-CB 3.91Å; F48-E89 HydrophobicContact CE1-CG 3.85Å; F48-E89 HydrophobicContact CE2-CB 3.8Å; F48-E89 HydrophobicContact CE2-CG 4.4Å; F48-E89 HydrophobicContact CG-CB 3.65Å; F48-E89 HydrophobicContact CG-CG 4.45Å; F48-E89 HydrophobicContact CZ-CB 3.9Å; F48-E89 HydrophobicContact CZ-CG 4Å; F48-L90 HydrophobicContact CB-CD1 4.35Å; F48-L90 HydrophobicContact CB-CD2 3.85Å; F48-L90 HydrophobicContact CB-CG 3.77Å |
| 49 | Q | 98.4 | Very high | 96.8 | Very high | 77 Ų | 77 | 50.8 Ų | 50.8 | 36% | 0.36 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -67.8 | -48.2 | 176.5 | -172.2 | 63.4 | 53.6 | 0 | 0 | 110.2 | D47 A51 F52 D53 | D47-Q49 VanDerWaalsContact C-N 3.34Å; Q49-A51 VanDerWaalsContact C-N 3.3Å; Q49-A51 PolarHBondContact O-N 3.08Å; Q49-F52 PolarHBondContact O-N 3.08Å; Q49-D53 PolarHBondContact NE2-OD1 3.27Å; Q49-D53 PolarHBondContact O-N 2.88Å |
| 50 | A | 98.4 | Very high | 96.4 | Very high | 19 Ų | 19 | 52.5 Ų | 52.5 | 16% | 0.157 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.8 | -35.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q41 D47 T54 | Q41-A50 HydrophobicContact CG-CB 4.49Å; Q41-A50 PolarHBondContact OE1-O 3.44Å; D47-A50 HydrophobicContact CB-CB 4.06Å; D47-A50 PolarHBondContact O-N 3.09Å; D47-A50 VanDerWaalsContact OD1-CB 3.31Å; D47-A50 WeakPolarHBondContact OD1-CB 3.43Å; D47-A50 PolarHBondContact OD1-N 2.85Å; D47-A50 WeakPolarHBondContact OD2-CB 3.44Å; A50-T54 VanDerWaalsContact O-CB 3.27Å; A50-T54 WeakPolarHBondContact O-CB 3.26Å; A50-T54 PolarHBondContact O-N 3.1Å; A50-T54 PolarHBondContact O-OG1 3.48Å |
| 51 | A | 98.6 | Very high | 95.9 | Very high | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -61.1 | -48.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q41 L42 D47 Q49 T54 C55 A86 | Q41-A51 HydrophobicContact CB-CB 3.84Å; L42-A51 HydrophobicContact CB-CB 3.93Å; D47-A51 WeakPolarHBondContact O-CB 3.39Å; D47-A51 PolarHBondContact O-N 3.35Å; Q49-A51 VanDerWaalsContact C-N 3.3Å; Q49-A51 PolarHBondContact O-N 3.08Å; A51-T54 PolarHBondContact O-N 3.17Å; A51-C55 PolarHBondContact O-N 3.49Å; A51-C55 PolarHBondContact O-SG 2.75Å; A51-C55 VanDerWaalsContact O-SG 3.35Å; A51-A86 HydrophobicContact CB-CB 4.38Å |
| 52 | F | 98.5 | Very high | 95.4 | Very high | 25 Ų | 25 | 50.7 Ų | 50.7 | 11% | 0.11 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.1 | -47.6 | 177.8 | -177.8 | -105.9 | 0 | 0 | 0 | 112.2 | F48 Q49 T54 C55 E56 A86 L87 W99 | F48-F52 WeakPolarHBondContact O-CB 3.22Å; F48-F52 PolarHBondContact O-N 3.39Å; Q49-F52 PolarHBondContact O-N 3.08Å; F52-T54 PolarHBondContact O-N 3.02Å; F52-C55 WeakPolarHBondContact O-CA 3.48Å; F52-C55 WeakPolarHBondContact O-CB 3.38Å; F52-C55 PolarHBondContact O-N 3.24Å; F52-C55 VanDerWaalsContact O-N 3.08Å; F52-E56 HydrophobicContact CD1-CG 4.36Å; F52-E56 HydrophobicContact CE1-CG 3.84Å; F52-E56 HydrophobicContact CE2-CG 4.36Å; F52-E56 HydrophobicContact CZ-CG 3.84Å; F52-E56 PolarHBondContact O-N 3.5Å; F52-A86 HydrophobicContact CB-CB 3.91Å; F52-L87 HydrophobicContact CD1-CD2 4.48Å; F52-L87 HydrophobicContact CD2-CD1 4.19Å; F52-L87 HydrophobicContact CD2-CD2 3.93Å; F52-L87 HydrophobicContact CD2-CG 3.68Å; F52-L87 HydrophobicContact CE1-CD2 4.27Å; F52-L87 HydrophobicContact CE2-CD1 3.54Å; F52-L87 HydrophobicContact CE2-CD2 3.71Å; F52-L87 HydrophobicContact CE2-CG 3.51Å; F52-L87 HydrophobicContact CG-CD2 4.32Å; F52-L87 HydrophobicContact CG-CG 4.47Å; F52-L87 HydrophobicContact CZ-CD1 4.13Å; F52-L87 HydrophobicContact CZ-CD2 3.89Å; F52-L87 HydrophobicContact CZ-CG 4.18Å; F52-W99 HydrophobicContact CD2-CZ2 4.46Å; F52-W99 HydrophobicContact CE2-CD2 4.02Å; F52-W99 AromaticContact CE2-CE2 3.53Å; F52-W99 HydrophobicContact CE2-CH2 4.17Å; F52-W99 AromaticContact CE2-CZ2 3.62Å; F52-W99 HydrophobicContact CE2-CZ2 3.62Å; F52-W99 AromaticContact CE2-NE1 3.8Å; F52-W99 HydrophobicContact CZ-CD2 4.36Å; F52-W99 AromaticContact CZ-CE2 3.85Å; F52-W99 HydrophobicContact CZ-CG 4.44Å; F52-W99 HydrophobicContact CZ-CZ2 4.29Å; F52-W99 AromaticContact CZ-NE1 3.6Å |
| 53 | D | 98.4 | Very high | 94.4 | Very high | 73 Ų | 73 | 55.4 Ų | 55.4 | 39% | 0.39 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.7 | -35.2 | 178.2 | -64.6 | -15.4 | 0 | 0 | 0 | 111.6 | Q49 R57 | Q49-D53 PolarHBondContact NE2-OD1 3.27Å; Q49-D53 PolarHBondContact O-N 2.88Å; D53-R57 WeakPolarHBondContact O-CG 3.43Å; D53-R57 PolarHBondContact O-N 3.09Å; D53-R57 VanDerWaalsContact O-N 3.09Å |
| 54 | T | 98.2 | Very high | 93.1 | Very high | 2 Ų | 2 | 57 Ų | 57 | 1% | 0.012 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -71.1 | -39.2 | 175.7 | -60.2 | 0 | 0 | 0 | 0 | 111.6 | L34 A38 Q41 A50 A51 F52 R57 G58 | L34-T54 HydrophobicContact CB-CG2 4.24Å; L34-T54 HydrophobicContact CD2-CG2 4.01Å; L34-T54 VanDerWaalsContact O-CG2 3.28Å; L34-T54 WeakPolarHBondContact O-CG2 3.47Å; A38-T54 HydrophobicContact CB-CG2 3.93Å; Q41-T54 PolarHBondContact OE1-OG1 2.78Å; A50-T54 VanDerWaalsContact O-CB 3.27Å; A50-T54 WeakPolarHBondContact O-CB 3.26Å; A50-T54 PolarHBondContact O-N 3.1Å; A50-T54 PolarHBondContact O-OG1 3.48Å; A51-T54 PolarHBondContact O-N 3.17Å; F52-T54 PolarHBondContact O-N 3.02Å; T54-R57 PolarHBondContact O-N 2.82Å; T54-G58 PolarHBondContact O-N 3.33Å |
| 55 | C | 97.8 | Very high | 91.6 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -59.2 | -47.6 | 171.4 | -72.7 | 0 | 0 | 0 | 0 | 111.7 | A51 F52 R57 G58 L59 L79 V82 | A51-C55 PolarHBondContact O-N 3.49Å; A51-C55 PolarHBondContact O-SG 2.75Å; A51-C55 VanDerWaalsContact O-SG 3.35Å; F52-C55 WeakPolarHBondContact O-CA 3.48Å; F52-C55 WeakPolarHBondContact O-CB 3.38Å; F52-C55 PolarHBondContact O-N 3.24Å; F52-C55 VanDerWaalsContact O-N 3.08Å; C55-R57 PolarHBondContact O-N 3.2Å; C55-G58 WeakPolarHBondContact O-CA 3.31Å; C55-G58 PolarHBondContact O-N 2.98Å; C55-G58 VanDerWaalsContact O-N 3.08Å; C55-L59 WeakPolarHBondContact O-CG 3.26Å; C55-L59 PolarHBondContact O-N 2.86Å; C55-L79 PolarHBondContact SG-O 3.39Å; C55-L79 VanDerWaalsContact SG-O 3.39Å; C55-V82 VanDerWaalsContact SG-CG1 3.54Å |
| 56 | E | 96.3 | Very high | 89.6 | Confident | 50 Ų | 50 | 56.7 Ų | 56.7 | 23% | 0.234 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.6 | -46.8 | 178 | -81.3 | -69.6 | 93.8 | 0 | 0 | 112 | F52 G58 L59 V60 W99 H103 | F52-E56 HydrophobicContact CD1-CG 4.36Å; F52-E56 HydrophobicContact CE1-CG 3.84Å; F52-E56 HydrophobicContact CE2-CG 4.36Å; F52-E56 HydrophobicContact CZ-CG 3.84Å; F52-E56 PolarHBondContact O-N 3.5Å; E56-G58 VanDerWaalsContact C-N 3.27Å; E56-G58 PolarHBondContact O-N 2.96Å; E56-L59 PolarHBondContact O-N 3.36Å; E56-V60 WeakPolarHBondContact O-CG2 3.48Å; E56-V60 PolarHBondContact O-N 3.46Å; E56-W99 VanDerWaalsContact CD-NE1 3.3Å; E56-W99 WeakPolarHBondContact OE1-CZ2 3.2Å; E56-W99 PolarHBondContact OE1-NE1 2.98Å; E56-H103 IonicContact OE1-CE1 2.75Å; E56-H103 IonicContact OE1-NE2 3.74Å; E56-H103 PolarHBondContact OE1-NE2 3.21Å; E56-H103 VanDerWaalsContact OE1-NE2 3.1Å |
| 57 | R | 94.7 | Very high | 87.9 | Confident | 132 Ų | 132 | 59.7 Ų | 59.7 | 50% | 0.498 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -58.8 | -40.5 | 174.1 | -74.9 | 173.4 | 7.9 | -141.8 | -6.9 | 112.2 | D53 T54 C55 S61 | D53-R57 WeakPolarHBondContact O-CG 3.43Å; D53-R57 PolarHBondContact O-N 3.09Å; D53-R57 VanDerWaalsContact O-N 3.09Å; T54-R57 PolarHBondContact O-N 2.82Å; C55-R57 PolarHBondContact O-N 3.2Å; R57-S61 WeakPolarHBondContact O-CB 3.43Å; R57-S61 PolarHBondContact O-N 2.92Å; R57-S61 PolarHBondContact O-OG 3.18Å |
| 58 | G | 93.8 | Very high | 85.9 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62 | -46.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | T54 C55 E56 S61 L62 | T54-G58 PolarHBondContact O-N 3.33Å; C55-G58 WeakPolarHBondContact O-CA 3.31Å; C55-G58 PolarHBondContact O-N 2.98Å; C55-G58 VanDerWaalsContact O-N 3.08Å; E56-G58 VanDerWaalsContact C-N 3.27Å; E56-G58 PolarHBondContact O-N 2.96Å; G58-S61 WeakPolarHBondContact O-CB 3.33Å; G58-S61 PolarHBondContact O-N 3Å; G58-L62 WeakPolarHBondContact O-CG 3.33Å; G58-L62 PolarHBondContact O-N 3.36Å; G58-L62 VanDerWaalsContact O-N 3.12Å |
| 59 | L | 92.9 | Very high | 84.5 | Confident | 2 Ų | 2 | 65.4 Ų | 65.4 | 1% | 0.01 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -65.7 | -42.4 | 179.7 | -68 | 167.9 | 0 | 0 | 0 | 112.1 | C55 E56 S61 L62 L63 K76 L79 W99 H103 | C55-L59 WeakPolarHBondContact O-CG 3.26Å; C55-L59 PolarHBondContact O-N 2.86Å; E56-L59 PolarHBondContact O-N 3.36Å; L59-S61 VanDerWaalsContact C-N 3.29Å; L59-S61 PolarHBondContact O-N 2.72Å; L59-L62 WeakPolarHBondContact O-CB 3.19Å; L59-L62 PolarHBondContact O-N 3.25Å; L59-L62 VanDerWaalsContact O-N 3.11Å; L59-L63 WeakPolarHBondContact O-CG 3.27Å; L59-L63 PolarHBondContact O-N 3.17Å; L59-K76 HydrophobicContact CD2-CB 4.44Å; L59-K76 HydrophobicContact CD2-CG 3.69Å; L59-L79 HydrophobicContact CD2-CB 3.89Å; L59-L79 HydrophobicContact CD2-CD1 4.22Å; L59-L79 HydrophobicContact CG-CB 4.03Å; L59-L79 HydrophobicContact CG-CD1 4.32Å; L59-W99 HydrophobicContact CD1-CH2 4.05Å; L59-W99 HydrophobicContact CD1-CZ2 3.58Å; L59-H103 WeakPolarHBondContact CD1-NE2 3.29Å |
| 60 | V | 90.2 | Very high | 83.3 | Confident | 73 Ų | 73 | 66.1 Ų | 66.1 | 44% | 0.442 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.3 | -37.1 | 173.7 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | E56 L62 L63 N64 | E56-V60 WeakPolarHBondContact O-CG2 3.48Å; E56-V60 PolarHBondContact O-N 3.46Å; V60-L62 PolarHBondContact O-N 3.22Å; V60-L63 PolarHBondContact O-N 3.47Å; V60-N64 PolarHBondContact O-ND2 3.03Å |
| 61 | S | 87.1 | Confident | 82.5 | Confident | 42 Ų | 42 | 71.6 Ų | 71.6 | 29% | 0.294 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.6 | -32 | 176.1 | -58.2 | 0 | 0 | 0 | 0 | 112 | R57 G58 L59 | R57-S61 WeakPolarHBondContact O-CB 3.43Å; R57-S61 PolarHBondContact O-N 2.92Å; R57-S61 PolarHBondContact O-OG 3.18Å; G58-S61 WeakPolarHBondContact O-CB 3.33Å; G58-S61 PolarHBondContact O-N 3Å; L59-S61 VanDerWaalsContact C-N 3.29Å; L59-S61 PolarHBondContact O-N 2.72Å |
| 62 | L | 86.1 | Confident | 81.9 | Confident | 18 Ų | 18 | 73.2 Ų | 73.2 | 9% | 0.094 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -76.2 | -36.6 | 176.9 | -68.3 | 173.4 | 0 | 0 | 0 | 113.3 | T31 G58 L59 V60 N64 A65 F72 L75 K76 L79 | T31-L62 HydrophobicContact CG2-CD1 3.96Å; T31-L62 HydrophobicContact CG2-CD2 3.87Å; T31-L62 HydrophobicContact CG2-CG 3.76Å; G58-L62 WeakPolarHBondContact O-CG 3.33Å; G58-L62 PolarHBondContact O-N 3.36Å; G58-L62 VanDerWaalsContact O-N 3.12Å; L59-L62 WeakPolarHBondContact O-CB 3.19Å; L59-L62 PolarHBondContact O-N 3.25Å; L59-L62 VanDerWaalsContact O-N 3.11Å; V60-L62 PolarHBondContact O-N 3.22Å; L62-N64 PolarHBondContact O-N 3.16Å; L62-A65 PolarHBondContact O-N 3.37Å; L62-A65 VanDerWaalsContact O-N 3.11Å; L62-F72 HydrophobicContact CD2-CB 4.3Å; L62-F72 HydrophobicContact CD2-CD1 3.37Å; L62-F72 HydrophobicContact CD2-CE1 4.11Å; L62-F72 HydrophobicContact CD2-CG 4.26Å; L62-L75 HydrophobicContact CD2-CD2 4.38Å; L62-K76 HydrophobicContact CD1-CB 3.84Å; L62-K76 HydrophobicContact CD1-CG 4.46Å; L62-L79 HydrophobicContact CD1-CD1 3.75Å |
| 63 | L | 77.3 | Confident | 81.4 | Confident | 103 Ų | 103 | 73.9 Ų | 73.9 | 54% | 0.539 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.5 | -28.9 | 177.8 | -71.1 | 170.5 | 0 | 0 | 0 | 112.6 | L59 V60 | L59-L63 WeakPolarHBondContact O-CG 3.27Å; L59-L63 PolarHBondContact O-N 3.17Å; V60-L63 PolarHBondContact O-N 3.47Å |
| 64 | N | 66.7 | Low | 81.1 | Confident | 128 Ų | 128 | 76.6 Ų | 76.6 | 68% | 0.684 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -4.7 | 179.1 | -65.4 | -49.8 | 0 | 0 | 0 | 113.8 | V60 L62 | V60-N64 PolarHBondContact O-ND2 3.03Å; L62-N64 PolarHBondContact O-N 3.16Å |
| 65 | A | 64.1 | Low | 80.8 | Confident | 15 Ų | 15 | 77 Ų | 77 | 12% | 0.124 | 39% | 0.39 | C | S | . | . | S | Bend | trans | -104.2 | 105 | 177.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | L62 Q67 | L62-A65 PolarHBondContact O-N 3.37Å; L62-A65 VanDerWaalsContact O-N 3.11Å; A65-Q67 PolarHBondContact O-N 2.94Å |
| 66 | E | 52 | Low | 80.7 | Confident | 188 Ų | 188 | 79 Ų | 79 | 88% | 0.879 | 40% | 0.399 | S | S | * | . | trans | -53.7 | 110.1 | -176.8 | -69.9 | 177.9 | 160.9 | 0 | 0 | 112.7 | ||||
| 67 | Q | 61.7 | Low | 80.6 | Confident | 186 Ų | 186 | 76.7 Ų | 76.7 | 87% | 0.869 | 39% | 0.388 | S | S | * | . | S | Bend | trans | 7.5 | 131.3 | 151.2 | -150.5 | 140.9 | -10.5 | 0 | 0 | 121.5 | A65 | A65-Q67 PolarHBondContact O-N 2.94Š|
| 68 | E | 54.5 | Low | 80.7 | Confident | 188 Ų | 188 | 71.6 Ų | 71.6 | 88% | 0.879 | 37% | 0.374 | S | S | * | . | trans | 132.5 | -3 | 149.6 | -76.2 | -161.3 | 172.1 | 0 | 0 | 115.9 | ||||
| 69 | D | 68.1 | Low | 80.9 | Confident | 53 Ų | 53 | 71.6 Ų | 71.6 | 28% | 0.283 | 37% | 0.374 | S | S | . | . | trans | -87.7 | 120.7 | 172.7 | -179.9 | -7.4 | 0 | 0 | 0 | 110.6 | R71 F72 | D69-R71 PolarHBondContact O-N 3.28Å; D69-R71 WeakPolarHBondContact OD1-CB 3.33Å; D69-R71 WeakPolarHBondContact OD1-CG 3.36Å; D69-R71 PolarHBondContact OD1-N 2.9Å; D69-R71 VanDerWaalsContact OD1-N 3.12Å; D69-R71 IonicContact OD1-NE 3.61Å; D69-R71 PolarHBondContact OD1-NE 3.5Å; D69-R71 VanDerWaalsContact OD1-NE 3.13Å; D69-R71 IonicContact OD2-CZ 2.88Å; D69-R71 VanDerWaalsContact OD2-CZ 3.22Å; D69-R71 IonicContact OD2-NE 3.57Å; D69-R71 PolarHBondContact OD2-NE 3.37Å; D69-R71 IonicContact OD2-NH2 3.85Å; D69-R71 PolarHBondContact OD2-NH2 3.35Å; D69-F72 HydrophobicContact CB-CD2 3.77Å; D69-F72 HydrophobicContact CB-CE2 4.12Å; D69-F72 PolarHBondContact O-N 2.89Å | ||
| 70 | S | 74.9 | Confident | 81.1 | Confident | 91 Ų | 91 | 71.5 Ų | 71.5 | 64% | 0.636 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -52.1 | -29.8 | -177.4 | 57.5 | 0 | 0 | 0 | 0 | 112.7 | F72 G73 E74 | S70-F72 PolarHBondContact O-N 2.94Å; S70-G73 PolarHBondContact O-N 3.17Å; S70-E74 PolarHBondContact O-N 2.93Å |
| 71 | R | 81.6 | Confident | 81.5 | Confident | 134 Ų | 134 | 69.8 Ų | 69.8 | 51% | 0.506 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -65.4 | -36.1 | 178.5 | -60.4 | -179.9 | -68.2 | 172.8 | -0.8 | 112.8 | F28 D69 G73 E74 L75 | F28-R71 HydrophobicContact CD2-CB 4.5Å; F28-R71 HydrophobicContact CE2-CB 3.66Å; F28-R71 HydrophobicContact CZ-CB 4.14Å; D69-R71 PolarHBondContact O-N 3.28Å; D69-R71 WeakPolarHBondContact OD1-CB 3.33Å; D69-R71 WeakPolarHBondContact OD1-CG 3.36Å; D69-R71 PolarHBondContact OD1-N 2.9Å; D69-R71 VanDerWaalsContact OD1-N 3.12Å; D69-R71 IonicContact OD1-NE 3.61Å; D69-R71 PolarHBondContact OD1-NE 3.5Å; D69-R71 VanDerWaalsContact OD1-NE 3.13Å; D69-R71 IonicContact OD2-CZ 2.88Å; D69-R71 VanDerWaalsContact OD2-CZ 3.22Å; D69-R71 IonicContact OD2-NE 3.57Å; D69-R71 PolarHBondContact OD2-NE 3.37Å; D69-R71 IonicContact OD2-NH2 3.85Å; D69-R71 PolarHBondContact OD2-NH2 3.35Å; R71-G73 VanDerWaalsContact C-N 3.34Å; R71-E74 PolarHBondContact O-N 3.12Å; R71-L75 WeakPolarHBondContact O-CB 3.47Å; R71-L75 PolarHBondContact O-N 3.28Å |
| 72 | F | 85.3 | Confident | 82 | Confident | 35 Ų | 35 | 68.5 Ų | 68.5 | 15% | 0.154 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -70.8 | -33.7 | 175 | -68.9 | -73.1 | 0 | 0 | 0 | 111.4 | F28 L62 D69 S70 L75 K76 | F28-F72 HydrophobicContact CB-CE1 3.81Å; F28-F72 HydrophobicContact CB-CZ 3.92Å; F28-F72 AromaticContact CD2-CD1 3.86Å; F28-F72 HydrophobicContact CD2-CD1 3.86Å; F28-F72 AromaticContact CD2-CE1 3.69Å; F28-F72 HydrophobicContact CD2-CE1 3.69Å; F28-F72 HydrophobicContact CD2-CG 4.46Å; F28-F72 HydrophobicContact CD2-CZ 4.07Å; F28-F72 HydrophobicContact CG-CE1 4.26Å; F28-F72 HydrophobicContact CG-CZ 4.48Å; L62-F72 HydrophobicContact CD2-CB 4.3Å; L62-F72 HydrophobicContact CD2-CD1 3.37Å; L62-F72 HydrophobicContact CD2-CE1 4.11Å; L62-F72 HydrophobicContact CD2-CG 4.26Å; D69-F72 HydrophobicContact CB-CD2 3.77Å; D69-F72 HydrophobicContact CB-CE2 4.12Å; D69-F72 PolarHBondContact O-N 2.89Å; S70-F72 PolarHBondContact O-N 2.94Å; F72-L75 PolarHBondContact O-N 3.47Å; F72-K76 VanDerWaalsContact O-CB 3.26Å; F72-K76 WeakPolarHBondContact O-CB 3.37Å; F72-K76 PolarHBondContact O-N 2.9Å |
| 73 | G | 88.7 | Confident | 82.6 | Confident | 39 Ų | 39 | 67.7 Ų | 67.7 | 40% | 0.402 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.3 | -42.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | S70 R71 A77 | S70-G73 PolarHBondContact O-N 3.17Å; R71-G73 VanDerWaalsContact C-N 3.34Å; G73-A77 WeakPolarHBondContact O-CB 3.45Å; G73-A77 PolarHBondContact O-N 3.45Å |
| 74 | E | 90.9 | Very high | 83.6 | Confident | 129 Ų | 129 | 63 Ų | 63 | 60% | 0.603 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -64.2 | -43.4 | 174.9 | -72.3 | -176.8 | 176.2 | 0 | 0 | 112.5 | S70 R71 A77 A78 | S70-E74 PolarHBondContact O-N 2.93Å; R71-E74 PolarHBondContact O-N 3.12Å; E74-A77 PolarHBondContact O-N 3.32Å; E74-A78 WeakPolarHBondContact O-CB 3.42Å; E74-A78 PolarHBondContact O-N 3.46Å |
| 75 | L | 92.8 | Very high | 85.1 | Confident | 10 Ų | 10 | 60.6 Ų | 60.6 | 5% | 0.052 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -66.6 | -44.3 | 179.2 | -171.3 | 59.7 | 0 | 0 | 0 | 112 | F28 T31 L35 L62 R71 F72 A77 A78 L79 | F28-L75 HydrophobicContact CD2-CD2 4.26Å; F28-L75 HydrophobicContact CE2-CD2 4.14Å; T31-L75 HydrophobicContact CG2-CD2 3.38Å; T31-L75 HydrophobicContact CG2-CG 3.83Å; L35-L75 HydrophobicContact CB-CD1 4Å; L35-L75 HydrophobicContact CD2-CD1 3.64Å; L35-L75 HydrophobicContact CG-CD1 4.44Å; L62-L75 HydrophobicContact CD2-CD2 4.38Å; R71-L75 WeakPolarHBondContact O-CB 3.47Å; R71-L75 PolarHBondContact O-N 3.28Å; F72-L75 PolarHBondContact O-N 3.47Å; L75-A77 VanDerWaalsContact C-N 3.27Å; L75-A77 PolarHBondContact O-N 3Å; L75-A78 PolarHBondContact O-N 3.42Å; L75-L79 HydrophobicContact CG-CD1 4.5Å; L75-L79 WeakPolarHBondContact O-CG 3.48Å; L75-L79 PolarHBondContact O-N 3.29Å |
| 76 | K | 94.3 | Very high | 86.7 | Confident | 43 Ų | 43 | 59.9 Ų | 59.9 | 19% | 0.187 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -53.8 | -48.7 | 171.1 | -174.3 | 177.8 | -178.2 | 170.2 | 0 | 110.3 | L59 L62 F72 A78 L79 C80 H103 Y104 | L59-K76 HydrophobicContact CD2-CB 4.44Å; L59-K76 HydrophobicContact CD2-CG 3.69Å; L62-K76 HydrophobicContact CD1-CB 3.84Å; L62-K76 HydrophobicContact CD1-CG 4.46Å; F72-K76 VanDerWaalsContact O-CB 3.26Å; F72-K76 WeakPolarHBondContact O-CB 3.37Å; F72-K76 PolarHBondContact O-N 2.9Å; K76-A78 VanDerWaalsContact C-N 3.33Å; K76-A78 PolarHBondContact O-N 3Å; K76-L79 PolarHBondContact O-N 3.25Å; K76-C80 PolarHBondContact O-N 3.12Å; K76-C80 PolarHBondContact O-SG 3.45Å; K76-H103 WeakPolarHBondContact CE-O 3.46Å; K76-H103 PolarHBondContact NZ-O 3.41Å; K76-Y104 HydrophobicContact CD-CE1 4.2Å |
| 77 | A | 95.1 | Very high | 88.9 | Confident | 1 Ų | 1 | 51.2 Ų | 51.2 | 1% | 0.008 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -68.4 | -33.6 | -178 | 0 | 0 | 0 | 0 | 0 | 112.7 | G73 E74 L75 I81 P111 I114 | G73-A77 WeakPolarHBondContact O-CB 3.45Å; G73-A77 PolarHBondContact O-N 3.45Å; E74-A77 PolarHBondContact O-N 3.32Å; L75-A77 VanDerWaalsContact C-N 3.27Å; L75-A77 PolarHBondContact O-N 3Å; A77-I81 WeakPolarHBondContact O-CD1 3.37Å; A77-I81 VanDerWaalsContact O-CG1 3.27Å; A77-I81 WeakPolarHBondContact O-CG1 3.37Å; A77-I81 PolarHBondContact O-N 2.92Å; A77-P111 HydrophobicContact CB-CB 4.47Å; A77-P111 HydrophobicContact CB-CG 4.04Å; A77-I114 HydrophobicContact CB-CD1 4Å |
| 78 | A | 96.4 | Very high | 90.6 | Very high | 25 Ų | 25 | 43.8 Ų | 43.8 | 21% | 0.207 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -67.4 | -44.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L35 E74 L75 K76 C80 I81 V82 | L35-A78 HydrophobicContact CD1-CB 4.05Å; L35-A78 HydrophobicContact CD2-CB 3.6Å; E74-A78 WeakPolarHBondContact O-CB 3.42Å; E74-A78 PolarHBondContact O-N 3.46Å; L75-A78 PolarHBondContact O-N 3.42Å; K76-A78 VanDerWaalsContact C-N 3.33Å; K76-A78 PolarHBondContact O-N 3Å; A78-C80 VanDerWaalsContact C-N 3.31Å; A78-C80 PolarHBondContact O-N 2.93Å; A78-I81 PolarHBondContact O-N 3.37Å; A78-V82 WeakPolarHBondContact O-CG2 3.28Å; A78-V82 PolarHBondContact O-N 3.39Å; A78-V82 VanDerWaalsContact O-N 3.09Å |
| 79 | L | 97.5 | Very high | 92.7 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.5 | -43.1 | 173.7 | -71.8 | 165.1 | 0 | 0 | 0 | 111.4 | T31 L35 C55 L59 L62 L75 K76 I81 V82 G83 | T31-L79 HydrophobicContact CG2-CD1 3.75Å; L35-L79 HydrophobicContact CB-CD2 3.96Å; L35-L79 HydrophobicContact CB-CG 4.48Å; L35-L79 HydrophobicContact CD1-CD2 3.95Å; L35-L79 HydrophobicContact CD1-CG 4.23Å; C55-L79 PolarHBondContact SG-O 3.39Å; C55-L79 VanDerWaalsContact SG-O 3.39Å; L59-L79 HydrophobicContact CD2-CB 3.89Å; L59-L79 HydrophobicContact CD2-CD1 4.22Å; L59-L79 HydrophobicContact CG-CB 4.03Å; L59-L79 HydrophobicContact CG-CD1 4.32Å; L62-L79 HydrophobicContact CD1-CD1 3.75Å; L75-L79 HydrophobicContact CG-CD1 4.5Å; L75-L79 WeakPolarHBondContact O-CG 3.48Å; L75-L79 PolarHBondContact O-N 3.29Å; K76-L79 PolarHBondContact O-N 3.25Å; L79-I81 PolarHBondContact O-N 3.48Å; L79-V82 PolarHBondContact O-N 3.12Å; L79-G83 PolarHBondContact O-N 3.41Å |
| 80 | C | 98 | Very high | 94.1 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.2 | -42.1 | 174.8 | -72.3 | 0 | 0 | 0 | 0 | 112.3 | K76 A78 G83 I84 I114 | K76-C80 PolarHBondContact O-N 3.12Å; K76-C80 PolarHBondContact O-SG 3.45Å; A78-C80 VanDerWaalsContact C-N 3.31Å; A78-C80 PolarHBondContact O-N 2.93Å; C80-G83 PolarHBondContact O-N 3.4Å; C80-I84 WeakPolarHBondContact O-CD1 3.04Å; C80-I84 WeakPolarHBondContact O-CG1 3.25Å; C80-I84 PolarHBondContact O-N 2.95Å; C80-I114 HydrophobicContact CB-CD1 3.51Å; C80-I114 HydrophobicContact CB-CG1 4.31Å |
| 81 | I | 97.9 | Very high | 95.1 | Very high | 38 Ų | 38 | 41.5 Ų | 41.5 | 20% | 0.195 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62 | -47.7 | 177.9 | -71.2 | 162.7 | 0 | 0 | 0 | 111.2 | A77 A78 L79 G83 I84 Q85 K113 I114 | A77-I81 WeakPolarHBondContact O-CD1 3.37Å; A77-I81 VanDerWaalsContact O-CG1 3.27Å; A77-I81 WeakPolarHBondContact O-CG1 3.37Å; A77-I81 PolarHBondContact O-N 2.92Å; A78-I81 PolarHBondContact O-N 3.37Å; L79-I81 PolarHBondContact O-N 3.48Å; I81-G83 VanDerWaalsContact C-N 3.31Å; I81-G83 PolarHBondContact O-N 3.45Å; I81-I84 PolarHBondContact O-N 3.39Å; I81-Q85 WeakPolarHBondContact O-CG 3.45Å; I81-Q85 PolarHBondContact O-N 2.95Å; I81-K113 HydrophobicContact CD1-CB 4.48Å; I81-K113 HydrophobicContact CD1-CD 3.77Å; I81-K113 HydrophobicContact CD1-CG 3.98Å; I81-I114 HydrophobicContact CG1-CG1 4.12Å |
| 82 | V | 98.3 | Very high | 95.8 | Very high | 15 Ų | 15 | 39.6 Ų | 39.6 | 9% | 0.091 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.8 | -41 | 177.7 | 176.7 | 0 | 0 | 0 | 0 | 110.5 | L35 A38 L42 C55 A78 L79 Q85 A86 | L35-V82 HydrophobicContact CD1-CG2 3.96Å; A38-V82 HydrophobicContact CB-CG1 3.93Å; L42-V82 HydrophobicContact CB-CG1 4.32Å; L42-V82 HydrophobicContact CD2-CB 4.44Å; L42-V82 HydrophobicContact CD2-CG1 3.73Å; C55-V82 VanDerWaalsContact SG-CG1 3.54Å; A78-V82 WeakPolarHBondContact O-CG2 3.28Å; A78-V82 PolarHBondContact O-N 3.39Å; A78-V82 VanDerWaalsContact O-N 3.09Å; L79-V82 PolarHBondContact O-N 3.12Å; V82-Q85 PolarHBondContact O-N 2.85Å; V82-A86 WeakPolarHBondContact O-CB 3.46Å; V82-A86 PolarHBondContact O-N 3.48Å |
| 83 | G | 98.4 | Very high | 96.4 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -65.7 | -40 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L79 C80 I81 Q85 A86 L87 | L79-G83 PolarHBondContact O-N 3.41Å; C80-G83 PolarHBondContact O-N 3.4Å; I81-G83 VanDerWaalsContact C-N 3.31Å; I81-G83 PolarHBondContact O-N 3.45Å; G83-Q85 VanDerWaalsContact C-N 3.31Å; G83-Q85 PolarHBondContact O-N 2.95Å; G83-A86 PolarHBondContact O-N 3.33Å; G83-L87 WeakPolarHBondContact O-CB 3.38Å; G83-L87 WeakPolarHBondContact O-CG 3.4Å; G83-L87 PolarHBondContact O-N 3.38Å |
| 84 | I | 98.4 | Very high | 96.7 | Very high | 6 Ų | 6 | 41.9 Ų | 41.9 | 3% | 0.031 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58.1 | -46.8 | 172.3 | -70.8 | 162.1 | 0 | 0 | 0 | 110.2 | C80 I81 L87 A88 V96 W99 I100 I114 M117 L121 | C80-I84 WeakPolarHBondContact O-CD1 3.04Å; C80-I84 WeakPolarHBondContact O-CG1 3.25Å; C80-I84 PolarHBondContact O-N 2.95Å; I81-I84 PolarHBondContact O-N 3.39Å; I84-L87 PolarHBondContact O-N 3.02Å; I84-A88 WeakPolarHBondContact O-CB 3.3Å; I84-A88 PolarHBondContact O-N 3.44Å; I84-V96 HydrophobicContact CB-CG1 4.47Å; I84-V96 HydrophobicContact CG1-CG1 3.86Å; I84-V96 HydrophobicContact CG2-CG1 4.15Å; I84-W99 HydrophobicContact CG1-CZ3 4.05Å; I84-I100 HydrophobicContact CD1-CD1 3.63Å; I84-I100 HydrophobicContact CD1-CG1 4.28Å; I84-I100 HydrophobicContact CG1-CD1 3.89Å; I84-I100 HydrophobicContact CG1-CG1 4.33Å; I84-I114 HydrophobicContact CD1-CG2 3.84Å; I84-M117 HydrophobicContact CD1-CB 4.4Å; I84-L121 HydrophobicContact CG2-CD2 4.14Å |
| 85 | Q | 97.9 | Very high | 97 | Very high | 76 Ų | 76 | 37.4 Ų | 37.4 | 36% | 0.355 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -62.9 | -44.8 | 178.9 | -70.1 | 175.3 | -40.2 | 0 | 0 | 111.1 | L42 I81 V82 G83 A88 E89 | L42-Q85 HydrophobicContact CD1-CB 4.46Å; L42-Q85 HydrophobicContact CD2-CB 3.79Å; I81-Q85 WeakPolarHBondContact O-CG 3.45Å; I81-Q85 PolarHBondContact O-N 2.95Å; V82-Q85 PolarHBondContact O-N 2.85Å; G83-Q85 VanDerWaalsContact C-N 3.31Å; G83-Q85 PolarHBondContact O-N 2.95Å; Q85-A88 WeakPolarHBondContact O-CB 3.27Å; Q85-A88 PolarHBondContact O-N 3.3Å; Q85-E89 WeakPolarHBondContact O-CG 3.45Å; Q85-E89 PolarHBondContact O-N 3.28Å |
| 86 | A | 98.5 | Very high | 97.2 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.5 | -46.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L42 A51 F52 V82 G83 A88 E89 L90 | L42-A86 HydrophobicContact CD1-CB 4.12Å; A51-A86 HydrophobicContact CB-CB 4.38Å; F52-A86 HydrophobicContact CB-CB 3.91Å; V82-A86 WeakPolarHBondContact O-CB 3.46Å; V82-A86 PolarHBondContact O-N 3.48Å; G83-A86 PolarHBondContact O-N 3.33Å; A86-A88 VanDerWaalsContact C-N 3.3Å; A86-A88 PolarHBondContact O-N 3.03Å; A86-E89 PolarHBondContact O-N 2.94Å; A86-L90 WeakPolarHBondContact O-CB 3.35Å; A86-L90 VanDerWaalsContact O-CG 3.28Å; A86-L90 WeakPolarHBondContact O-CG 3.25Å; A86-L90 PolarHBondContact O-N 2.75Å |
| 87 | L | 98.4 | Very high | 97.4 | Very high | 7 Ų | 7 | 36.2 Ų | 36.2 | 4% | 0.037 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -62 | -37.7 | 175.6 | -73.6 | 173.7 | 0 | 0 | 0 | 112.3 | F52 G83 I84 L90 N91 Q92 V96 W99 | F52-L87 HydrophobicContact CD1-CD2 4.48Å; F52-L87 HydrophobicContact CD2-CD1 4.19Å; F52-L87 HydrophobicContact CD2-CD2 3.93Å; F52-L87 HydrophobicContact CD2-CG 3.68Å; F52-L87 HydrophobicContact CE1-CD2 4.27Å; F52-L87 HydrophobicContact CE2-CD1 3.54Å; F52-L87 HydrophobicContact CE2-CD2 3.71Å; F52-L87 HydrophobicContact CE2-CG 3.51Å; F52-L87 HydrophobicContact CG-CD2 4.32Å; F52-L87 HydrophobicContact CG-CG 4.47Å; F52-L87 HydrophobicContact CZ-CD1 4.13Å; F52-L87 HydrophobicContact CZ-CD2 3.89Å; F52-L87 HydrophobicContact CZ-CG 4.18Å; G83-L87 WeakPolarHBondContact O-CB 3.38Å; G83-L87 WeakPolarHBondContact O-CG 3.4Å; G83-L87 PolarHBondContact O-N 3.38Å; I84-L87 PolarHBondContact O-N 3.02Å; L87-L90 PolarHBondContact O-N 3.24Å; L87-N91 PolarHBondContact O-N 2.89Å; L87-Q92 HydrophobicContact CD2-CB 3.87Å; L87-Q92 CarbonylContact O-C 3.57Å; L87-Q92 WeakPolarHBondContact O-CA 3.44Å; L87-Q92 PolarHBondContact O-N 2.89Å; L87-V96 HydrophobicContact CB-CG2 3.68Å; L87-V96 HydrophobicContact CD1-CG2 3.76Å; L87-V96 HydrophobicContact CG-CG2 4.39Å; L87-W99 HydrophobicContact CD1-CB 4.42Å; L87-W99 HydrophobicContact CD1-CD2 3.92Å; L87-W99 HydrophobicContact CD1-CE3 3.75Å; L87-W99 HydrophobicContact CD1-CG 4.22Å; L87-W99 HydrophobicContact CD1-CZ3 4.37Å |
| 88 | A | 97.4 | Very high | 97.5 | Very high | 30 Ų | 30 | 38.9 Ų | 38.9 | 25% | 0.248 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.4 | -45.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | I84 Q85 A86 L90 N91 L121 | I84-A88 WeakPolarHBondContact O-CB 3.3Å; I84-A88 PolarHBondContact O-N 3.44Å; Q85-A88 WeakPolarHBondContact O-CB 3.27Å; Q85-A88 PolarHBondContact O-N 3.3Å; A86-A88 VanDerWaalsContact C-N 3.3Å; A86-A88 PolarHBondContact O-N 3.03Å; A88-L90 VanDerWaalsContact C-N 3.32Å; A88-L90 PolarHBondContact O-N 2.86Å; A88-N91 PolarHBondContact O-N 3.31Å; A88-N91 VanDerWaalsContact O-N 3.09Å; A88-L121 HydrophobicContact CB-CD1 3.64Å; A88-L121 HydrophobicContact CB-CD2 4.32Å |
| 89 | E | 97.4 | Very high | 97.6 | Very high | 113 Ų | 113 | 38.4 Ų | 38.4 | 53% | 0.528 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -67.9 | -30.1 | 177.1 | -65.9 | -62 | 145.3 | 0 | 0 | 112.7 | F48 Q85 A86 N91 | F48-E89 HydrophobicContact CB-CB 4.33Å; F48-E89 HydrophobicContact CD1-CB 3.79Å; F48-E89 HydrophobicContact CD1-CG 4.09Å; F48-E89 HydrophobicContact CD2-CB 3.67Å; F48-E89 HydrophobicContact CE1-CB 3.91Å; F48-E89 HydrophobicContact CE1-CG 3.85Å; F48-E89 HydrophobicContact CE2-CB 3.8Å; F48-E89 HydrophobicContact CE2-CG 4.4Å; F48-E89 HydrophobicContact CG-CB 3.65Å; F48-E89 HydrophobicContact CG-CG 4.45Å; F48-E89 HydrophobicContact CZ-CB 3.9Å; F48-E89 HydrophobicContact CZ-CG 4Å; Q85-E89 WeakPolarHBondContact O-CG 3.45Å; Q85-E89 PolarHBondContact O-N 3.28Å; A86-E89 PolarHBondContact O-N 2.94Å; E89-N91 PolarHBondContact O-N 3.05Å |
| 90 | L | 97.4 | Very high | 97.6 | Very high | 52 Ų | 52 | 38.4 Ų | 38.4 | 27% | 0.272 | 22% | 0.216 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76.9 | 0.5 | 172.2 | -68.8 | 170.2 | 0 | 0 | 0 | 113.5 | F48 A86 L87 A88 Q92 | F48-L90 HydrophobicContact CB-CD1 4.35Å; F48-L90 HydrophobicContact CB-CD2 3.85Å; F48-L90 HydrophobicContact CB-CG 3.77Å; A86-L90 WeakPolarHBondContact O-CB 3.35Å; A86-L90 VanDerWaalsContact O-CG 3.28Å; A86-L90 WeakPolarHBondContact O-CG 3.25Å; A86-L90 PolarHBondContact O-N 2.75Å; L87-L90 PolarHBondContact O-N 3.24Å; A88-L90 VanDerWaalsContact C-N 3.32Å; A88-L90 PolarHBondContact O-N 2.86Å; L90-Q92 HydrophobicContact CB-CB 4.46Å; L90-Q92 HydrophobicContact CB-CG 4.09Å; L90-Q92 PolarHBondContact O-N 3.09Å |
| 91 | N | 96.1 | Very high | 97.5 | Very high | 119 Ų | 119 | 40.7 Ų | 40.7 | 64% | 0.636 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 55 | 28.3 | -172.1 | -166 | 47 | 0 | 0 | 0 | 113.4 | L87 A88 E89 W93 | L87-N91 PolarHBondContact O-N 2.89Å; A88-N91 PolarHBondContact O-N 3.31Å; A88-N91 VanDerWaalsContact O-N 3.09Å; E89-N91 PolarHBondContact O-N 3.05Å; N91-W93 VanDerWaalsContact C-N 3.32Å; N91-W93 VanDerWaalsContact OD1-CD1 3.32Å; N91-W93 PolarHBondContact OD1-NE1 3.3Å |
| 92 | Q | 97.5 | Very high | 97.3 | Very high | 93 Ų | 93 | 45.4 Ų | 45.4 | 44% | 0.435 | 25% | 0.249 | S | C | . | . | trans | -99.2 | 26.4 | 174.1 | -64.6 | -175.8 | 4.8 | 0 | 0 | 111.5 | L87 L90 P94 G95 | L87-Q92 HydrophobicContact CD2-CB 3.87Å; L87-Q92 CarbonylContact O-C 3.57Å; L87-Q92 WeakPolarHBondContact O-CA 3.44Å; L87-Q92 PolarHBondContact O-N 2.89Å; L90-Q92 HydrophobicContact CB-CB 4.46Å; L90-Q92 HydrophobicContact CB-CG 4.09Å; L90-Q92 PolarHBondContact O-N 3.09Å; Q92-P94 VanDerWaalsContact C-N 3.29Å; Q92-P94 WeakPolarHBondContact O-CD 3.22Å; Q92-G95 PolarHBondContact O-N 3.17Å; Q92-G95 VanDerWaalsContact O-N 3.16Å | ||
| 93 | W | 96.2 | Very high | 97 | Very high | 51 Ų | 51 | 45.3 Ų | 45.3 | 19% | 0.193 | 25% | 0.247 | C | C | . | . | G | 310 helix | trans | -52.4 | -33.2 | 177.1 | 63.6 | -97.3 | 0 | 0 | 0 | 115 | N91 G95 V96 L121 Y122 V125 E127 | N91-W93 VanDerWaalsContact C-N 3.32Å; N91-W93 VanDerWaalsContact OD1-CD1 3.32Å; N91-W93 PolarHBondContact OD1-NE1 3.3Å; W93-G95 PolarHBondContact O-N 3.37Å; W93-G95 VanDerWaalsContact O-N 3.17Å; W93-V96 WeakPolarHBondContact O-CB 3.34Å; W93-V96 WeakPolarHBondContact O-CG2 3.44Å; W93-V96 PolarHBondContact O-N 3Å; W93-V96 VanDerWaalsContact O-N 3.1Å; W93-L121 HydrophobicContact CB-CD1 4.22Å; W93-L121 HydrophobicContact CB-CD2 4.08Å; W93-L121 HydrophobicContact CB-CG 4.3Å; W93-Y122 HydrophobicContact CE3-CD1 4.39Å; W93-Y122 AromaticContact CE3-CE1 4Å; W93-Y122 HydrophobicContact CE3-CE1 4Å; W93-Y122 HydrophobicContact CZ3-CD1 4.47Å; W93-Y122 HydrophobicContact CZ3-CE1 4.11Å; W93-Y122 PolarHBondContact O-OH 3.43Å; W93-V125 HydrophobicContact CD2-CB 4.35Å; W93-V125 HydrophobicContact CD2-CG1 4.27Å; W93-V125 HydrophobicContact CD2-CG2 3.89Å; W93-V125 HydrophobicContact CE3-CG2 3.85Å; W93-V125 HydrophobicContact CG-CG1 4.08Å; W93-V125 HydrophobicContact CG-CG2 4.44Å; W93-V125 HydrophobicContact CZ3-CG2 4.2Å; W93-E127 HydrophobicContact CH2-CB 4.24Å; W93-E127 HydrophobicContact CH2-CG 3.64Å; W93-E127 HydrophobicContact CZ2-CG 4.45Å; W93-E127 HydrophobicContact CZ3-CB 4.01Å; W93-E127 HydrophobicContact CZ3-CG 3.95Å |
| 94 | P | 96.8 | Very high | 96.8 | Very high | 71 Ų | 71 | 46.2 Ų | 46.2 | 46% | 0.461 | 25% | 0.251 | S | S | . | . | G | 310 helix | trans | -63.7 | -26.3 | -178.6 | -19.1 | 31.2 | 0 | 0 | 0 | 112.8 | Q92 Y122 | Q92-P94 VanDerWaalsContact C-N 3.29Å; Q92-P94 WeakPolarHBondContact O-CD 3.22Å; P94-Y122 PolarHBondContact O-OH 3.4Å |
| 95 | G | 96.2 | Very high | 96.5 | Very high | 36 Ų | 36 | 52.8 Ų | 52.8 | 37% | 0.371 | 28% | 0.282 | S | S | . | . | G | 310 helix | trans | -83.5 | -10.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q92 W93 L97 A98 W99 | Q92-G95 PolarHBondContact O-N 3.17Å; Q92-G95 VanDerWaalsContact O-N 3.16Å; W93-G95 PolarHBondContact O-N 3.37Å; W93-G95 VanDerWaalsContact O-N 3.17Å; G95-L97 PolarHBondContact O-N 3.37Å; G95-A98 PolarHBondContact O-N 3.45Å; G95-W99 VanDerWaalsContact O-CB 3.29Å; G95-W99 WeakPolarHBondContact O-CB 3.43Å; G95-W99 PolarHBondContact O-N 3.44Å |
| 96 | V | 98 | Very high | 96.4 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.6 | -47.8 | -168.8 | 167.6 | 0 | 0 | 0 | 0 | 112.7 | I84 L87 W93 W99 I100 L121 Y122 | I84-V96 HydrophobicContact CB-CG1 4.47Å; I84-V96 HydrophobicContact CG1-CG1 3.86Å; I84-V96 HydrophobicContact CG2-CG1 4.15Å; L87-V96 HydrophobicContact CB-CG2 3.68Å; L87-V96 HydrophobicContact CD1-CG2 3.76Å; L87-V96 HydrophobicContact CG-CG2 4.39Å; W93-V96 WeakPolarHBondContact O-CB 3.34Å; W93-V96 WeakPolarHBondContact O-CG2 3.44Å; W93-V96 PolarHBondContact O-N 3Å; W93-V96 VanDerWaalsContact O-N 3.1Å; V96-W99 PolarHBondContact O-N 2.93Å; V96-I100 HydrophobicContact CG1-CD1 3.68Å; V96-I100 HydrophobicContact CG1-CG1 4.44Å; V96-I100 WeakPolarHBondContact O-CD1 3.08Å; V96-I100 VanDerWaalsContact O-CG1 3.28Å; V96-I100 WeakPolarHBondContact O-CG1 3.43Å; V96-I100 PolarHBondContact O-N 3.28Å; V96-L121 HydrophobicContact CB-CD2 4.25Å; V96-L121 HydrophobicContact CG1-CD2 4.18Å; V96-L121 HydrophobicContact CG2-CD2 3.91Å; V96-Y122 HydrophobicContact CB-CE2 4.48Å |
| 97 | L | 97.3 | Very high | 96.3 | Very high | 27 Ų | 27 | 52.1 Ų | 52.1 | 14% | 0.141 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -65 | -44.9 | -178.5 | 179.7 | 60.7 | 0 | 0 | 0 | 111.1 | G95 W99 I100 L101 M131 A134 | G95-L97 PolarHBondContact O-N 3.37Å; L97-W99 VanDerWaalsContact C-N 3.29Å; L97-W99 PolarHBondContact O-N 3.11Å; L97-I100 PolarHBondContact O-N 3.27Å; L97-L101 HydrophobicContact CD1-CD1 4.3Å; L97-L101 HydrophobicContact CD1-CG 4.38Å; L97-L101 HydrophobicContact CG-CD1 4.12Å; L97-L101 VanDerWaalsContact O-CG 3.3Å; L97-L101 WeakPolarHBondContact O-CG 3.24Å; L97-L101 PolarHBondContact O-N 3.3Å; L97-M131 HydrophobicContact CD1-SD 4.25Å; L97-M131 HydrophobicContact CD2-SD 4.09Å; L97-A134 HydrophobicContact CD1-CB 4.25Å; L97-A134 HydrophobicContact CD2-CB 4.14Å |
| 98 | A | 97.5 | Very high | 96.2 | Very high | 58 Ų | 58 | 54.9 Ų | 54.9 | 48% | 0.479 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -59.8 | -41.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G95 L101 Q102 | G95-A98 PolarHBondContact O-N 3.45Å; A98-L101 PolarHBondContact O-N 3.4Å; A98-Q102 WeakPolarHBondContact O-CG 3.3Å; A98-Q102 PolarHBondContact O-N 3.1Å |
| 99 | W | 97.8 | Very high | 96.2 | Very high | 14 Ų | 14 | 59 Ų | 59 | 5% | 0.053 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.6 | -45.1 | 176.4 | 175.4 | 67.3 | 0 | 0 | 0 | 112.5 | F52 E56 L59 I84 L87 G95 V96 L97 L101 Q102 H103 | F52-W99 HydrophobicContact CD2-CZ2 4.46Å; F52-W99 HydrophobicContact CE2-CD2 4.02Å; F52-W99 AromaticContact CE2-CE2 3.53Å; F52-W99 HydrophobicContact CE2-CH2 4.17Å; F52-W99 AromaticContact CE2-CZ2 3.62Å; F52-W99 HydrophobicContact CE2-CZ2 3.62Å; F52-W99 AromaticContact CE2-NE1 3.8Å; F52-W99 HydrophobicContact CZ-CD2 4.36Å; F52-W99 AromaticContact CZ-CE2 3.85Å; F52-W99 HydrophobicContact CZ-CG 4.44Å; F52-W99 HydrophobicContact CZ-CZ2 4.29Å; F52-W99 AromaticContact CZ-NE1 3.6Å; E56-W99 VanDerWaalsContact CD-NE1 3.3Å; E56-W99 WeakPolarHBondContact OE1-CZ2 3.2Å; E56-W99 PolarHBondContact OE1-NE1 2.98Å; L59-W99 HydrophobicContact CD1-CH2 4.05Å; L59-W99 HydrophobicContact CD1-CZ2 3.58Å; I84-W99 HydrophobicContact CG1-CZ3 4.05Å; L87-W99 HydrophobicContact CD1-CB 4.42Å; L87-W99 HydrophobicContact CD1-CD2 3.92Å; L87-W99 HydrophobicContact CD1-CE3 3.75Å; L87-W99 HydrophobicContact CD1-CG 4.22Å; L87-W99 HydrophobicContact CD1-CZ3 4.37Å; G95-W99 VanDerWaalsContact O-CB 3.29Å; G95-W99 WeakPolarHBondContact O-CB 3.43Å; G95-W99 PolarHBondContact O-N 3.44Å; V96-W99 PolarHBondContact O-N 2.93Å; L97-W99 VanDerWaalsContact C-N 3.29Å; L97-W99 PolarHBondContact O-N 3.11Å; W99-L101 VanDerWaalsContact C-N 3.29Å; W99-L101 PolarHBondContact O-N 3.19Å; W99-Q102 WeakPolarHBondContact O-CB 3.17Å; W99-Q102 PolarHBondContact O-N 3.41Å; W99-Q102 VanDerWaalsContact O-N 3.16Å; W99-H103 AromaticContact CE2-CD2 4Å; W99-H103 AromaticContact CE2-NE2 3.74Å; W99-H103 AromaticContact NE1-CD2 3.97Å; W99-H103 AromaticContact NE1-NE2 3.39Å; W99-H103 PolarHBondContact NE1-NE2 2.95Å; W99-H103 PolarHBondContact O-CD2 2.92Å; W99-H103 VanDerWaalsContact O-CD2 3.28Å |
| 100 | I | 97.6 | Very high | 96.1 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.5 | -40.5 | 176.3 | -67.4 | 162.1 | 0 | 0 | 0 | 111 | I84 V96 L97 Q102 H103 Y104 I110 I114 C118 | I84-I100 HydrophobicContact CD1-CD1 3.63Å; I84-I100 HydrophobicContact CD1-CG1 4.28Å; I84-I100 HydrophobicContact CG1-CD1 3.89Å; I84-I100 HydrophobicContact CG1-CG1 4.33Å; V96-I100 HydrophobicContact CG1-CD1 3.68Å; V96-I100 HydrophobicContact CG1-CG1 4.44Å; V96-I100 WeakPolarHBondContact O-CD1 3.08Å; V96-I100 VanDerWaalsContact O-CG1 3.28Å; V96-I100 WeakPolarHBondContact O-CG1 3.43Å; V96-I100 PolarHBondContact O-N 3.28Å; L97-I100 PolarHBondContact O-N 3.27Å; I100-Q102 PolarHBondContact O-N 2.9Å; I100-H103 PolarHBondContact O-N 3.24Å; I100-Y104 HydrophobicContact CG2-CD2 3.81Å; I100-Y104 HydrophobicContact CG2-CE2 4.42Å; I100-Y104 PolarHBondContact O-N 2.97Å; I100-I110 HydrophobicContact CG2-CD1 3.72Å; I100-I110 HydrophobicContact CG2-CG1 3.94Å; I100-I110 HydrophobicContact CG2-CG2 4.41Å; I100-I114 HydrophobicContact CD1-CG2 3.8Å; I100-I114 HydrophobicContact CG1-CG2 4.37Å; I100-I114 HydrophobicContact CG2-CG2 4.03Å; I100-C118 WeakPolarHBondContact CD1-SG 3.33Å |
| 101 | L | 96.2 | Very high | 96.1 | Very high | 49 Ų | 49 | 52.8 Ų | 52.8 | 26% | 0.257 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -66.6 | -24.6 | 179 | -70.9 | 171.8 | 0 | 0 | 0 | 112.9 | L97 A98 W99 H103 E105 P107 I110 | L97-L101 HydrophobicContact CD1-CD1 4.3Å; L97-L101 HydrophobicContact CD1-CG 4.38Å; L97-L101 HydrophobicContact CG-CD1 4.12Å; L97-L101 VanDerWaalsContact O-CG 3.3Å; L97-L101 WeakPolarHBondContact O-CG 3.24Å; L97-L101 PolarHBondContact O-N 3.3Å; A98-L101 PolarHBondContact O-N 3.4Å; W99-L101 VanDerWaalsContact C-N 3.29Å; W99-L101 PolarHBondContact O-N 3.19Å; L101-H103 PolarHBondContact O-N 2.84Å; L101-E105 WeakPolarHBondContact O-CA 3.32Å; L101-E105 PolarHBondContact O-N 3.28Å; L101-P107 HydrophobicContact CD2-CG 4.12Å; L101-I110 HydrophobicContact CD2-CD1 4.25Å |
| 102 | Q | 94.8 | Very high | 96.1 | Very high | 136 Ų | 136 | 47.5 Ų | 47.5 | 64% | 0.636 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -62.3 | -30.1 | 170 | -66.8 | 167.3 | 10.7 | 0 | 0 | 111.9 | A98 W99 I100 | A98-Q102 WeakPolarHBondContact O-CG 3.3Å; A98-Q102 PolarHBondContact O-N 3.1Å; W99-Q102 WeakPolarHBondContact O-CB 3.17Å; W99-Q102 PolarHBondContact O-N 3.41Å; W99-Q102 VanDerWaalsContact O-N 3.16Å; I100-Q102 PolarHBondContact O-N 2.9Å |
| 103 | H | 92.1 | Very high | 96.1 | Very high | 13 Ų | 13 | 47.2 Ų | 47.2 | 6% | 0.06 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -94.2 | -32.5 | -177.9 | -64 | -64.8 | 0 | 0 | 0 | 113.1 | E56 L59 K76 W99 I100 L101 | E56-H103 IonicContact OE1-CE1 2.75Å; E56-H103 IonicContact OE1-NE2 3.74Å; E56-H103 PolarHBondContact OE1-NE2 3.21Å; E56-H103 VanDerWaalsContact OE1-NE2 3.1Å; L59-H103 WeakPolarHBondContact CD1-NE2 3.29Å; K76-H103 WeakPolarHBondContact CE-O 3.46Å; K76-H103 PolarHBondContact NZ-O 3.41Å; W99-H103 AromaticContact CE2-CD2 4Å; W99-H103 AromaticContact CE2-NE2 3.74Å; W99-H103 AromaticContact NE1-CD2 3.97Å; W99-H103 AromaticContact NE1-NE2 3.39Å; W99-H103 PolarHBondContact NE1-NE2 2.95Å; W99-H103 PolarHBondContact O-CD2 2.92Å; W99-H103 VanDerWaalsContact O-CD2 3.28Å; I100-H103 PolarHBondContact O-N 3.24Å; L101-H103 PolarHBondContact O-N 2.84Å |
| 104 | Y | 93.4 | Very high | 96.2 | Very high | 20 Ų | 20 | 44.8 Ų | 44.8 | 8% | 0.078 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -107.9 | -3.7 | -177.1 | -71.2 | -82.1 | 0 | 0 | 0 | 114.4 | K76 I100 C106 K109 I110 P111 I114 | K76-Y104 HydrophobicContact CD-CE1 4.2Å; I100-Y104 HydrophobicContact CG2-CD2 3.81Å; I100-Y104 HydrophobicContact CG2-CE2 4.42Å; I100-Y104 PolarHBondContact O-N 2.97Å; Y104-C106 PolarHBondContact O-N 2.96Å; Y104-K109 HydrophobicContact CD1-CB 4.46Å; Y104-K109 VanDerWaalsContact CD1-O 3.24Å; Y104-K109 WeakPolarHBondContact CD1-O 3.49Å; Y104-K109 WeakPolarHBondContact O-CB 3.29Å; Y104-K109 VanDerWaalsContact O-CD 3.26Å; Y104-K109 WeakPolarHBondContact O-CD 3.38Å; Y104-I110 HydrophobicContact CD2-CG1 4.48Å; Y104-I110 HydrophobicContact CG-CG1 4.27Å; Y104-P111 HydrophobicContact CE1-CG 3.84Å; Y104-P111 VanDerWaalsContact CZ-CD 3.44Å; Y104-I114 HydrophobicContact CE2-CD1 3.8Å |
| 105 | E | 92.9 | Very high | 96.3 | Very high | 144 Ų | 144 | 41.4 Ų | 41.4 | 67% | 0.673 | 22% | 0.221 | S | C | * | . | S | Bend | trans | 67.7 | -50.9 | -179.2 | -53.4 | 166.5 | -177.1 | 0 | 0 | 114.4 | L101 K109 | L101-E105 WeakPolarHBondContact O-CA 3.32Å; L101-E105 PolarHBondContact O-N 3.28Å; E105-K109 IonicContact OE2-NZ 3.22Å; E105-K109 PolarHBondContact OE2-NZ 3.36Å |
| 106 | C | 94.6 | Very high | 96.3 | Very high | 36 Ų | 36 | 41 Ų | 41 | 24% | 0.243 | 21% | 0.21 | C | C | . | . | S | Bend | trans | -138.1 | 155.6 | -176.8 | 70 | 0 | 0 | 0 | 0 | 111.7 | Y104 E108 K109 | Y104-C106 PolarHBondContact O-N 2.96Å; C106-E108 VanDerWaalsContact C-N 3.27Å; C106-E108 WeakPolarHBondContact CB-OE2 3.28Å; C106-E108 PolarHBondContact O-N 2.94Å; C106-E108 PolarHBondContact SG-OE2 3.19Å; C106-K109 PolarHBondContact O-N 3.4Å |
| 107 | P | 97.1 | Very high | 96.3 | Very high | 26 Ų | 26 | 44.2 Ų | 44.2 | 17% | 0.169 | 23% | 0.226 | C | C | . | . | G | 310 helix | trans | -54.6 | -41.2 | -178 | -26.3 | 34.7 | 0 | 0 | 0 | 113.2 | L101 K109 I110 A134 V137 W138 | L101-P107 HydrophobicContact CD2-CG 4.12Å; P107-K109 PolarHBondContact O-N 3.3Å; P107-K109 VanDerWaalsContact O-N 3.12Å; P107-I110 WeakPolarHBondContact O-CB 3.2Å; P107-I110 VanDerWaalsContact O-CG1 3.27Å; P107-I110 WeakPolarHBondContact O-CG1 3.48Å; P107-I110 PolarHBondContact O-N 3.18Å; P107-A134 HydrophobicContact CB-CB 4.31Å; P107-A134 HydrophobicContact CG-CB 4.34Å; P107-V137 HydrophobicContact CB-CG1 4.21Å; P107-V137 HydrophobicContact CG-CG1 4.4Å; P107-W138 VanDerWaalsContact O-CD1 3.23Å |
| 108 | E | 96.9 | Very high | 96.3 | Very high | 65 Ų | 65 | 43 Ų | 43 | 30% | 0.304 | 22% | 0.22 | S | C | . | . | G | 310 helix | trans | -57.1 | -31.7 | -175.4 | -57.6 | 92.5 | 143.8 | 0 | 0 | 113.4 | C106 I110 V137 C141 N144 | C106-E108 VanDerWaalsContact C-N 3.27Å; C106-E108 WeakPolarHBondContact CB-OE2 3.28Å; C106-E108 PolarHBondContact O-N 2.94Å; C106-E108 PolarHBondContact SG-OE2 3.19Å; E108-I110 VanDerWaalsContact C-N 3.31Å; E108-V137 HydrophobicContact CG-CG1 3.71Å; E108-V137 WeakPolarHBondContact OE1-CG1 3.49Å; E108-C141 HydrophobicContact CB-CB 4.16Å; E108-C141 HydrophobicContact CG-CB 3.91Å; E108-N144 PolarHBondContact O-ND2 3.41Å; E108-N144 VanDerWaalsContact O-ND2 3.17Å; E108-N144 PolarHBondContact O-OD1 3.43Å |
| 109 | K | 95.8 | Very high | 96.3 | Very high | 115 Ų | 115 | 40.2 Ų | 40.2 | 50% | 0.5 | 20% | 0.197 | S | C | . | . | G | 310 helix | trans | -82.1 | -8.6 | -179.7 | -71 | 176.6 | -178.5 | -176.9 | 0 | 113.1 | Y104 E105 C106 P107 P111 | Y104-K109 HydrophobicContact CD1-CB 4.46Å; Y104-K109 VanDerWaalsContact CD1-O 3.24Å; Y104-K109 WeakPolarHBondContact CD1-O 3.49Å; Y104-K109 WeakPolarHBondContact O-CB 3.29Å; Y104-K109 VanDerWaalsContact O-CD 3.26Å; Y104-K109 WeakPolarHBondContact O-CD 3.38Å; E105-K109 IonicContact OE2-NZ 3.22Å; E105-K109 PolarHBondContact OE2-NZ 3.36Å; C106-K109 PolarHBondContact O-N 3.4Å; P107-K109 PolarHBondContact O-N 3.3Å; P107-K109 VanDerWaalsContact O-N 3.12Å; K109-P111 WeakPolarHBondContact O-CD 3.46Å |
| 110 | I | 97.1 | Very high | 96.2 | Very high | 2 Ų | 2 | 43.1 Ų | 43.1 | 1% | 0.01 | 21% | 0.213 | C | C | . | . | S | Bend | trans | -70.1 | 127.7 | -179 | -62 | 175.4 | 0 | 0 | 0 | 109.5 | I100 L101 Y104 P107 E108 I114 M115 W138 | I100-I110 HydrophobicContact CG2-CD1 3.72Å; I100-I110 HydrophobicContact CG2-CG1 3.94Å; I100-I110 HydrophobicContact CG2-CG2 4.41Å; L101-I110 HydrophobicContact CD2-CD1 4.25Å; Y104-I110 HydrophobicContact CD2-CG1 4.48Å; Y104-I110 HydrophobicContact CG-CG1 4.27Å; P107-I110 WeakPolarHBondContact O-CB 3.2Å; P107-I110 VanDerWaalsContact O-CG1 3.27Å; P107-I110 WeakPolarHBondContact O-CG1 3.48Å; P107-I110 PolarHBondContact O-N 3.18Å; E108-I110 VanDerWaalsContact C-N 3.31Å; I110-I114 HydrophobicContact CG2-CB 3.63Å; I110-I114 HydrophobicContact CG2-CG2 3.44Å; I110-I114 VanDerWaalsContact CG2-CG2 3.44Å; I110-M115 HydrophobicContact CB-CE 4.48Å; I110-M115 HydrophobicContact CD1-CE 4.2Å; I110-M115 HydrophobicContact CG2-CB 4.43Å; I110-W138 PolarHBondContact O-NE1 3.09Å |
| 111 | P | 96.6 | Very high | 96.2 | Very high | 34 Ų | 34 | 43.9 Ų | 43.9 | 22% | 0.221 | 22% | 0.217 | C | C | . | . | trans | -58.3 | 141.5 | 172.7 | -25.8 | 33 | 0 | 0 | 0 | 112.4 | A77 Y104 K109 K113 I114 M115 | A77-P111 HydrophobicContact CB-CB 4.47Å; A77-P111 HydrophobicContact CB-CG 4.04Å; Y104-P111 HydrophobicContact CE1-CG 3.84Å; Y104-P111 VanDerWaalsContact CZ-CD 3.44Å; K109-P111 WeakPolarHBondContact O-CD 3.46Å; P111-K113 VanDerWaalsContact C-N 3.26Å; P111-K113 HydrophobicContact CB-CG 4.27Å; P111-K113 PolarHBondContact O-N 2.98Å; P111-K113 VanDerWaalsContact O-N 3.1Å; P111-I114 HydrophobicContact CB-CD1 4.49Å; P111-I114 HydrophobicContact CG-CD1 4.14Å; P111-I114 WeakPolarHBondContact O-CB 3.46Å; P111-I114 PolarHBondContact O-N 2.84Å; P111-M115 PolarHBondContact O-N 3.25Å | ||
| 112 | A | 96.9 | Very high | 96.3 | Very high | 8 Ų | 8 | 41.7 Ų | 41.7 | 7% | 0.066 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -48.4 | -45.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113 | I114 M115 L116 W138 V153 | A112-I114 VanDerWaalsContact C-N 3.26Å; A112-I114 PolarHBondContact O-N 3.13Å; A112-M115 WeakPolarHBondContact O-CB 3.22Å; A112-M115 PolarHBondContact O-N 3.33Å; A112-M115 VanDerWaalsContact O-N 3.09Å; A112-L116 VanDerWaalsContact O-CG 3.29Å; A112-L116 WeakPolarHBondContact O-CG 3.4Å; A112-L116 PolarHBondContact O-N 3.09Å; A112-W138 HydrophobicContact CB-CH2 3.93Å; A112-W138 HydrophobicContact CB-CZ2 3.75Å; A112-V153 HydrophobicContact CB-CG2 4.16Å |
| 113 | K | 96.6 | Very high | 96.3 | Very high | 86 Ų | 86 | 36.8 Ų | 36.8 | 37% | 0.374 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -57.6 | -33.3 | 177.9 | 62.5 | -175 | -175.6 | -176.2 | 0 | 114.4 | I81 P111 M117 | I81-K113 HydrophobicContact CD1-CB 4.48Å; I81-K113 HydrophobicContact CD1-CD 3.77Å; I81-K113 HydrophobicContact CD1-CG 3.98Å; P111-K113 VanDerWaalsContact C-N 3.26Å; P111-K113 HydrophobicContact CB-CG 4.27Å; P111-K113 PolarHBondContact O-N 2.98Å; P111-K113 VanDerWaalsContact O-N 3.1Å; K113-M117 WeakPolarHBondContact O-CG 3.5Å; K113-M117 PolarHBondContact O-N 3.11Å |
| 114 | I | 98.2 | Very high | 96.3 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -76.1 | -42.2 | 176.1 | -71.1 | 171.2 | 0 | 0 | 0 | 110.1 | A77 C80 I81 I84 I100 Y104 I110 P111 A112 L116 M117 C118 | A77-I114 HydrophobicContact CB-CD1 4Å; C80-I114 HydrophobicContact CB-CD1 3.51Å; C80-I114 HydrophobicContact CB-CG1 4.31Å; I81-I114 HydrophobicContact CG1-CG1 4.12Å; I84-I114 HydrophobicContact CD1-CG2 3.84Å; I100-I114 HydrophobicContact CD1-CG2 3.8Å; I100-I114 HydrophobicContact CG1-CG2 4.37Å; I100-I114 HydrophobicContact CG2-CG2 4.03Å; Y104-I114 HydrophobicContact CE2-CD1 3.8Å; I110-I114 HydrophobicContact CG2-CB 3.63Å; I110-I114 HydrophobicContact CG2-CG2 3.44Å; I110-I114 VanDerWaalsContact CG2-CG2 3.44Å; P111-I114 HydrophobicContact CB-CD1 4.49Å; P111-I114 HydrophobicContact CG-CD1 4.14Å; P111-I114 WeakPolarHBondContact O-CB 3.46Å; P111-I114 PolarHBondContact O-N 2.84Å; A112-I114 VanDerWaalsContact C-N 3.26Å; A112-I114 PolarHBondContact O-N 3.13Å; I114-L116 VanDerWaalsContact C-N 3.32Å; I114-L116 PolarHBondContact O-N 3.47Å; I114-M117 PolarHBondContact O-N 3.44Å; I114-M117 VanDerWaalsContact O-N 3.17Å; I114-C118 PolarHBondContact O-N 2.96Å; I114-C118 PolarHBondContact O-SG 3.34Å |
| 115 | M | 98.3 | Very high | 96.4 | Very high | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -58.1 | -45.4 | 175.2 | -173.8 | 55.7 | 71.4 | 0 | 0 | 111.2 | I110 P111 A112 M117 C118 I119 M131 W138 V153 | I110-M115 HydrophobicContact CB-CE 4.48Å; I110-M115 HydrophobicContact CD1-CE 4.2Å; I110-M115 HydrophobicContact CG2-CB 4.43Å; P111-M115 PolarHBondContact O-N 3.25Å; A112-M115 WeakPolarHBondContact O-CB 3.22Å; A112-M115 PolarHBondContact O-N 3.33Å; A112-M115 VanDerWaalsContact O-N 3.09Å; M115-M117 PolarHBondContact O-N 3.34Å; M115-C118 PolarHBondContact O-N 2.92Å; M115-I119 HydrophobicContact CG-CD1 4.18Å; M115-I119 WeakPolarHBondContact O-CG1 3.45Å; M115-I119 PolarHBondContact O-N 2.98Å; M115-I119 HydrophobicContact SD-CD1 4.49Å; M115-I119 HydrophobicContact SD-CG1 4.45Å; M115-M131 HydrophobicContact CE-CE 4.38Å; M115-M131 HydrophobicContact SD-CE 3.38Å; M115-M131 WeakPolarHBondContact SD-CE 3.13Å; M115-W138 HydrophobicContact CE-CB 3.76Å; M115-W138 HydrophobicContact CE-CG 3.78Å; M115-W138 HydrophobicContact CG-CD2 4.38Å; M115-W138 HydrophobicContact CG-CG 4.31Å; M115-V153 HydrophobicContact CB-CG2 4.34Å; M115-V153 HydrophobicContact CG-CG1 3.71Å; M115-V153 HydrophobicContact CG-CG2 4.37Å |
| 116 | L | 97.1 | Very high | 96.3 | Very high | 29 Ų | 29 | 41.5 Ų | 41.5 | 15% | 0.152 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -55.6 | -48.7 | 173.7 | -65 | 174.7 | 0 | 0 | 0 | 111.8 | A112 I114 C118 I119 L120 T152 V153 L156 | A112-L116 VanDerWaalsContact O-CG 3.29Å; A112-L116 WeakPolarHBondContact O-CG 3.4Å; A112-L116 PolarHBondContact O-N 3.09Å; I114-L116 VanDerWaalsContact C-N 3.32Å; I114-L116 PolarHBondContact O-N 3.47Å; L116-C118 VanDerWaalsContact C-N 3.31Å; L116-C118 PolarHBondContact O-N 3.02Å; L116-I119 PolarHBondContact O-N 3.04Å; L116-L120 WeakPolarHBondContact O-CB 3.46Å; L116-L120 VanDerWaalsContact O-CG 3.28Å; L116-L120 WeakPolarHBondContact O-CG 3.28Å; L116-L120 PolarHBondContact O-N 2.96Å; L116-T152 HydrophobicContact CD1-CG2 4.19Å; L116-T152 HydrophobicContact CD2-CG2 3.74Å; L116-V153 HydrophobicContact CD2-CB 4.18Å; L116-V153 HydrophobicContact CD2-CG2 3.51Å; L116-V153 HydrophobicContact CG-CG2 3.79Å; L116-L156 HydrophobicContact CB-CD1 4.24Å; L116-L156 HydrophobicContact CD2-CD1 3.41Å; L116-L156 VanDerWaalsContact CD2-CD1 3.41Å; L116-L156 HydrophobicContact CD2-CG 4.1Å; L116-L156 HydrophobicContact CG-CD1 4.42Å |
| 117 | M | 97.3 | Very high | 96.4 | Very high | 67 Ų | 67 | 44.1 Ų | 44.1 | 33% | 0.33 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61.2 | -39 | 178.2 | -72.8 | -63 | 103.1 | 0 | 0 | 112.3 | I84 K113 I114 M115 L120 L121 | I84-M117 HydrophobicContact CD1-CB 4.4Å; K113-M117 WeakPolarHBondContact O-CG 3.5Å; K113-M117 PolarHBondContact O-N 3.11Å; I114-M117 PolarHBondContact O-N 3.44Å; I114-M117 VanDerWaalsContact O-N 3.17Å; M115-M117 PolarHBondContact O-N 3.34Å; M117-L120 HydrophobicContact CE-CD1 3.88Å; M117-L121 VanDerWaalsContact O-CB 3.3Å; M117-L121 WeakPolarHBondContact O-CB 3.5Å; M117-L121 PolarHBondContact O-N 3.35Å |
| 118 | C | 98 | Very high | 96.3 | Very high | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.007 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.9 | -49.3 | 177.6 | -63.4 | 0 | 0 | 0 | 0 | 111.4 | I100 I114 M115 L116 L120 L121 Y122 M131 | I100-C118 WeakPolarHBondContact CD1-SG 3.33Å; I114-C118 PolarHBondContact O-N 2.96Å; I114-C118 PolarHBondContact O-SG 3.34Å; M115-C118 PolarHBondContact O-N 2.92Å; L116-C118 VanDerWaalsContact C-N 3.31Å; L116-C118 PolarHBondContact O-N 3.02Å; C118-L120 VanDerWaalsContact C-N 3.31Å; C118-L120 PolarHBondContact O-N 3.48Å; C118-L121 PolarHBondContact O-N 3.43Å; C118-Y122 VanDerWaalsContact O-CD2 3.3Å; C118-Y122 WeakPolarHBondContact O-CD2 3.38Å; C118-Y122 PolarHBondContact O-N 2.86Å; C118-M131 HydrophobicContact CB-CE 3.64Å; C118-M131 HydrophobicContact CB-SD 3.78Å |
| 119 | I | 97.3 | Very high | 96.3 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -55.6 | -50.1 | 177.5 | -64.5 | 171.2 | 0 | 0 | 0 | 109.7 | M115 L116 L121 Y122 T123 M131 V153 L156 H160 I161 | M115-I119 HydrophobicContact CG-CD1 4.18Å; M115-I119 WeakPolarHBondContact O-CG1 3.45Å; M115-I119 PolarHBondContact O-N 2.98Å; M115-I119 HydrophobicContact SD-CD1 4.49Å; M115-I119 HydrophobicContact SD-CG1 4.45Å; L116-I119 PolarHBondContact O-N 3.04Å; I119-L121 PolarHBondContact O-N 3.48Å; I119-Y122 PolarHBondContact O-N 2.89Å; I119-T123 WeakPolarHBondContact O-CB 3.37Å; I119-T123 PolarHBondContact O-N 3.49Å; I119-T123 PolarHBondContact O-OG1 2.86Å; I119-M131 HydrophobicContact CG1-CE 4.35Å; I119-V153 HydrophobicContact CD1-CG1 4.16Å; I119-L156 HydrophobicContact CD1-CB 4.33Å; I119-L156 HydrophobicContact CG2-CB 3.99Å; I119-H160 HydrophobicContact CG2-CB 4.19Å; I119-I161 HydrophobicContact CD1-CD1 4.44Å; I119-I161 HydrophobicContact CG1-CD1 4.03Å; I119-I161 HydrophobicContact CG2-CD1 4.07Å; I119-I161 HydrophobicContact CG2-CG1 4.24Å |
| 120 | L | 96.6 | Very high | 96.3 | Very high | 74 Ų | 74 | 43.3 Ų | 43.3 | 39% | 0.387 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -62 | -40.4 | 180 | -67.6 | 173.8 | 0 | 0 | 0 | 113.1 | L116 M117 C118 K124 L156 | L116-L120 WeakPolarHBondContact O-CB 3.46Å; L116-L120 VanDerWaalsContact O-CG 3.28Å; L116-L120 WeakPolarHBondContact O-CG 3.28Å; L116-L120 PolarHBondContact O-N 2.96Å; M117-L120 HydrophobicContact CE-CD1 3.88Å; C118-L120 VanDerWaalsContact C-N 3.31Å; C118-L120 PolarHBondContact O-N 3.48Å; L120-K124 VanDerWaalsContact O-CB 3.27Å; L120-K124 WeakPolarHBondContact O-CB 3.3Å; L120-K124 PolarHBondContact O-N 3.29Å; L120-L156 HydrophobicContact CD1-CD1 4.39Å; L120-L156 HydrophobicContact CD2-CD1 4.04Å; L120-L156 HydrophobicContact CD2-CD2 4.18Å; L120-L156 HydrophobicContact CG-CD1 3.97Å |
| 121 | L | 97 | Very high | 96.3 | Very high | 17 Ų | 17 | 43.3 Ų | 43.3 | 9% | 0.089 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.7 | -51.9 | 177 | 174.2 | 61.1 | 0 | 0 | 0 | 111.3 | I84 A88 W93 V96 M117 C118 I119 T123 K124 V125 | I84-L121 HydrophobicContact CG2-CD2 4.14Å; A88-L121 HydrophobicContact CB-CD1 3.64Å; A88-L121 HydrophobicContact CB-CD2 4.32Å; W93-L121 HydrophobicContact CB-CD1 4.22Å; W93-L121 HydrophobicContact CB-CD2 4.08Å; W93-L121 HydrophobicContact CB-CG 4.3Å; V96-L121 HydrophobicContact CB-CD2 4.25Å; V96-L121 HydrophobicContact CG1-CD2 4.18Å; V96-L121 HydrophobicContact CG2-CD2 3.91Å; M117-L121 VanDerWaalsContact O-CB 3.3Å; M117-L121 WeakPolarHBondContact O-CB 3.5Å; M117-L121 PolarHBondContact O-N 3.35Å; C118-L121 PolarHBondContact O-N 3.43Å; I119-L121 PolarHBondContact O-N 3.48Å; L121-T123 VanDerWaalsContact C-N 3.33Å; L121-T123 PolarHBondContact O-N 3.14Å; L121-K124 WeakPolarHBondContact O-CB 3.42Å; L121-K124 PolarHBondContact O-N 3.3Å; L121-K124 VanDerWaalsContact O-N 3.12Å; L121-V125 PolarHBondContact O-N 2.81Å; L121-V125 VanDerWaalsContact O-N 3.12Å |
| 122 | Y | 97.5 | Very high | 96.3 | Very high | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.008 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.5 | -34.8 | -176.7 | -82.6 | -95.1 | 0 | 0 | 0 | 111.8 | W93 P94 V96 C118 I119 V125 G126 E127 Q128 M130 M131 | W93-Y122 HydrophobicContact CE3-CD1 4.39Å; W93-Y122 AromaticContact CE3-CE1 4Å; W93-Y122 HydrophobicContact CE3-CE1 4Å; W93-Y122 HydrophobicContact CZ3-CD1 4.47Å; W93-Y122 HydrophobicContact CZ3-CE1 4.11Å; W93-Y122 PolarHBondContact O-OH 3.43Å; P94-Y122 PolarHBondContact O-OH 3.4Å; V96-Y122 HydrophobicContact CB-CE2 4.48Å; C118-Y122 VanDerWaalsContact O-CD2 3.3Å; C118-Y122 WeakPolarHBondContact O-CD2 3.38Å; C118-Y122 PolarHBondContact O-N 2.86Å; I119-Y122 PolarHBondContact O-N 2.89Å; Y122-V125 WeakPolarHBondContact O-CG2 3.25Å; Y122-V125 PolarHBondContact O-N 2.84Å; Y122-G126 PolarHBondContact O-N 2.62Å; Y122-E127 HydrophobicContact CD1-CB 4.22Å; Y122-E127 WeakPolarHBondContact CD1-O 3.18Å; Y122-E127 CarbonylContact O-C 3.57Å; Y122-E127 PolarHBondContact O-N 2.99Å; Y122-Q128 PolarHBondContact O-N 3.37Å; Y122-M130 HydrophobicContact CD1-CB 3.53Å; Y122-M130 HydrophobicContact CD1-CG 4.07Å; Y122-M130 HydrophobicContact CE1-CB 3.52Å; Y122-M130 HydrophobicContact CE1-CG 3.95Å; Y122-M131 HydrophobicContact CD1-CG 4.45Å; Y122-M131 HydrophobicContact CD2-CG 3.73Å; Y122-M131 HydrophobicContact CD2-SD 4.04Å; Y122-M131 HydrophobicContact CE2-CG 4.48Å; Y122-M131 HydrophobicContact CE2-SD 4.28Å; Y122-M131 HydrophobicContact CG-CG 3.7Å |
| 123 | T | 94.4 | Very high | 96.4 | Very high | 34 Ų | 34 | 49.8 Ų | 49.8 | 21% | 0.209 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.5 | -42 | 169.4 | -59.9 | 0 | 0 | 0 | 0 | 112.1 | I119 L121 V125 G126 H160 | I119-T123 WeakPolarHBondContact O-CB 3.37Å; I119-T123 PolarHBondContact O-N 3.49Å; I119-T123 PolarHBondContact O-OG1 2.86Å; L121-T123 VanDerWaalsContact C-N 3.33Å; L121-T123 PolarHBondContact O-N 3.14Å; T123-V125 VanDerWaalsContact C-N 3.27Å; T123-V125 PolarHBondContact O-N 3.13Å; T123-G126 PolarHBondContact O-N 3.11Å; T123-G126 VanDerWaalsContact O-N 3.1Å; T123-H160 HydrophobicContact CG2-CB 4.02Å; T123-H160 WeakPolarHBondContact OG1-CB 3.44Å; T123-H160 PolarHBondContact OG1-O 3.28Å |
| 124 | K | 93.8 | Very high | 96.5 | Very high | 169 Ų | 169 | 46 Ų | 46 | 74% | 0.735 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -60.8 | -35.7 | 178.9 | -178.4 | -178 | 177 | -174.8 | 0 | 112.5 | L120 L121 | L120-K124 VanDerWaalsContact O-CB 3.27Å; L120-K124 WeakPolarHBondContact O-CB 3.3Å; L120-K124 PolarHBondContact O-N 3.29Å; L121-K124 WeakPolarHBondContact O-CB 3.42Å; L121-K124 PolarHBondContact O-N 3.3Å; L121-K124 VanDerWaalsContact O-N 3.12Å |
| 125 | V | 93.8 | Very high | 96.4 | Very high | 53 Ų | 53 | 46 Ų | 46 | 32% | 0.321 | 25% | 0.248 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -90 | -0.2 | 178.1 | -57.7 | 0 | 0 | 0 | 0 | 113.6 | W93 L121 Y122 T123 E127 | W93-V125 HydrophobicContact CD2-CB 4.35Å; W93-V125 HydrophobicContact CD2-CG1 4.27Å; W93-V125 HydrophobicContact CD2-CG2 3.89Å; W93-V125 HydrophobicContact CE3-CG2 3.85Å; W93-V125 HydrophobicContact CG-CG1 4.08Å; W93-V125 HydrophobicContact CG-CG2 4.44Å; W93-V125 HydrophobicContact CZ3-CG2 4.2Å; L121-V125 PolarHBondContact O-N 2.81Å; L121-V125 VanDerWaalsContact O-N 3.12Å; Y122-V125 WeakPolarHBondContact O-CG2 3.25Å; Y122-V125 PolarHBondContact O-N 2.84Å; T123-V125 VanDerWaalsContact C-N 3.27Å; T123-V125 PolarHBondContact O-N 3.13Å; V125-E127 VanDerWaalsContact C-N 3.34Å; V125-E127 HydrophobicContact CG2-CB 4.06Å; V125-E127 HydrophobicContact CG2-CG 4.34Å |
| 126 | G | 91.9 | Very high | 96.4 | Very high | 53 Ų | 53 | 50.3 Ų | 50.3 | 55% | 0.546 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81 | 6.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | Y122 T123 | Y122-G126 PolarHBondContact O-N 2.62Å; T123-G126 PolarHBondContact O-N 3.11Å; T123-G126 VanDerWaalsContact O-N 3.1Å |
| 127 | E | 96.4 | Very high | 96.5 | Very high | 92 Ų | 92 | 50.5 Ų | 50.5 | 43% | 0.43 | 27% | 0.27 | S | S | . | . | trans | -107.8 | 36.3 | -175 | -65.7 | -70.9 | 173 | 0 | 0 | 111.9 | W93 Y122 V125 A129 M130 | W93-E127 HydrophobicContact CH2-CB 4.24Å; W93-E127 HydrophobicContact CH2-CG 3.64Å; W93-E127 HydrophobicContact CZ2-CG 4.45Å; W93-E127 HydrophobicContact CZ3-CB 4.01Å; W93-E127 HydrophobicContact CZ3-CG 3.95Å; Y122-E127 HydrophobicContact CD1-CB 4.22Å; Y122-E127 WeakPolarHBondContact CD1-O 3.18Å; Y122-E127 CarbonylContact O-C 3.57Å; Y122-E127 PolarHBondContact O-N 2.99Å; V125-E127 VanDerWaalsContact C-N 3.34Å; V125-E127 HydrophobicContact CG2-CB 4.06Å; V125-E127 HydrophobicContact CG2-CG 4.34Å; E127-A129 PolarHBondContact O-N 3.36Å; E127-A129 VanDerWaalsContact O-N 3.08Å; E127-M130 HydrophobicContact CB-CG 4.32Å; E127-M130 WeakPolarHBondContact O-CB 3.32Å; E127-M130 WeakPolarHBondContact O-CG 3.44Å; E127-M130 PolarHBondContact O-N 3.16Å; E127-M130 VanDerWaalsContact O-N 3.08Å | ||
| 128 | Q | 95 | Very high | 96.5 | Very high | 33 Ų | 33 | 47.3 Ų | 47.3 | 15% | 0.154 | 25% | 0.254 | C | S | . | . | G | 310 helix | trans | -59.2 | -21.9 | -176 | 69.7 | -149.5 | -14.7 | 0 | 0 | 114.3 | Y122 M130 M131 H160 I161 L165 | Y122-Q128 PolarHBondContact O-N 3.37Å; Q128-M130 PolarHBondContact O-N 3.29Å; Q128-M131 PolarHBondContact O-N 2.97Å; Q128-M131 VanDerWaalsContact O-N 3.09Å; Q128-H160 WeakPolarHBondContact CB-O 3.46Å; Q128-H160 VanDerWaalsContact CD-O 3.24Å; Q128-H160 WeakPolarHBondContact CG-O 3.25Å; Q128-H160 PolarHBondContact OE1-O 2.97Å; Q128-I161 HydrophobicContact CB-CG1 4.45Å; Q128-L165 HydrophobicContact CG-CD1 4.4Å; Q128-L165 HydrophobicContact CG-CD2 4.04Å; Q128-L165 HydrophobicContact CG-CG 4.15Å |
| 129 | A | 96.3 | Very high | 96.5 | Very high | 51 Ų | 51 | 47.5 Ų | 47.5 | 42% | 0.421 | 26% | 0.255 | S | S | . | . | G | 310 helix | trans | -58.9 | -31.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | E127 M131 Q132 L165 | E127-A129 PolarHBondContact O-N 3.36Å; E127-A129 VanDerWaalsContact O-N 3.08Å; A129-M131 PolarHBondContact O-N 3.28Å; A129-Q132 WeakPolarHBondContact O-CB 3.3Å; A129-Q132 PolarHBondContact O-N 3.12Å; A129-Q132 VanDerWaalsContact O-N 3.13Å; A129-L165 HydrophobicContact CB-CD1 4.19Å; A129-L165 HydrophobicContact CB-CD2 4.13Å |
| 130 | M | 95.7 | Very high | 96.5 | Very high | 105 Ų | 105 | 50.8 Ų | 50.8 | 52% | 0.517 | 28% | 0.277 | S | S | . | . | G | 310 helix | trans | -63.7 | -21.5 | 177.9 | -63.9 | -67.7 | -71.5 | 0 | 0 | 113.1 | Y122 E127 Q128 | Y122-M130 HydrophobicContact CD1-CB 3.53Å; Y122-M130 HydrophobicContact CD1-CG 4.07Å; Y122-M130 HydrophobicContact CE1-CB 3.52Å; Y122-M130 HydrophobicContact CE1-CG 3.95Å; E127-M130 HydrophobicContact CB-CG 4.32Å; E127-M130 WeakPolarHBondContact O-CB 3.32Å; E127-M130 WeakPolarHBondContact O-CG 3.44Å; E127-M130 PolarHBondContact O-N 3.16Å; E127-M130 VanDerWaalsContact O-N 3.08Å; Q128-M130 PolarHBondContact O-N 3.29Å |
| 131 | M | 97.8 | Very high | 96.5 | Very high | 1 Ų | 1 | 48.3 Ų | 48.3 | 1% | 0.005 | 27% | 0.266 | C | S | . | . | G | 310 helix | trans | -97.5 | -0.8 | 179.2 | -73.4 | -56.9 | -53 | 0 | 0 | 113.7 | L97 M115 C118 I119 Y122 Q128 A129 A134 G135 I161 | L97-M131 HydrophobicContact CD1-SD 4.25Å; L97-M131 HydrophobicContact CD2-SD 4.09Å; M115-M131 HydrophobicContact CE-CE 4.38Å; M115-M131 HydrophobicContact SD-CE 3.38Å; M115-M131 WeakPolarHBondContact SD-CE 3.13Å; C118-M131 HydrophobicContact CB-CE 3.64Å; C118-M131 HydrophobicContact CB-SD 3.78Å; I119-M131 HydrophobicContact CG1-CE 4.35Å; Y122-M131 HydrophobicContact CD1-CG 4.45Å; Y122-M131 HydrophobicContact CD2-CG 3.73Å; Y122-M131 HydrophobicContact CD2-SD 4.04Å; Y122-M131 HydrophobicContact CE2-CG 4.48Å; Y122-M131 HydrophobicContact CE2-SD 4.28Å; Y122-M131 HydrophobicContact CG-CG 3.7Å; Q128-M131 PolarHBondContact O-N 2.97Å; Q128-M131 VanDerWaalsContact O-N 3.09Å; A129-M131 PolarHBondContact O-N 3.28Å; M131-A134 HydrophobicContact CE-CB 3.95Å; M131-G135 PolarHBondContact O-N 2.98Å; M131-I161 HydrophobicContact CB-CD1 3.62Å |
| 132 | Q | 97.4 | Very high | 96.4 | Very high | 49 Ų | 49 | 53 Ų | 53 | 23% | 0.229 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.1 | -56.1 | -177.8 | -173.9 | -176.3 | -22.1 | 0 | 0 | 111.6 | A129 A134 G135 H136 Y157 I161 H167 E170 | A129-Q132 WeakPolarHBondContact O-CB 3.3Å; A129-Q132 PolarHBondContact O-N 3.12Å; A129-Q132 VanDerWaalsContact O-N 3.13Å; Q132-A134 PolarHBondContact O-N 2.77Å; Q132-G135 PolarHBondContact O-N 2.91Å; Q132-H136 WeakPolarHBondContact O-CB 3.26Å; Q132-H136 PolarHBondContact O-N 2.91Å; Q132-Y157 WeakPolarHBondContact CG-OH 3.39Å; Q132-Y157 WeakPolarHBondContact O-CE2 3.36Å; Q132-Y157 PolarHBondContact O-OH 3.36Å; Q132-I161 HydrophobicContact CB-CG2 3.97Å; Q132-I161 HydrophobicContact CG-CG2 4.23Å; Q132-H167 VanDerWaalsContact CD-CE1 3.5Å; Q132-H167 PolarHBondContact NE2-CE1 2.94Å; Q132-H167 PolarHBondContact NE2-ND1 3.17Å; Q132-H167 VanDerWaalsContact NE2-ND1 3.2Å; Q132-H167 PolarHBondContact OE1-CE1 3.13Å; Q132-E170 PolarHBondContact NE2-OE2 3.15Å |
| 133 | E | 97.9 | Very high | 96.2 | Very high | 130 Ų | 130 | 56.6 Ų | 56.6 | 61% | 0.607 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -63 | -48.2 | -177.7 | -178 | 59.2 | -159.6 | 0 | 0 | 111.8 | G135 H136 V137 | E133-G135 VanDerWaalsContact C-N 3.31Å; E133-G135 PolarHBondContact O-N 3.39Å; E133-H136 PolarHBondContact O-N 3.24Å; E133-V137 HydrophobicContact CG-CG2 4.44Å; E133-V137 WeakPolarHBondContact O-CB 3.22Å; E133-V137 WeakPolarHBondContact O-CG2 3.35Å; E133-V137 PolarHBondContact O-N 2.9Å; E133-V137 VanDerWaalsContact OE1-CG2 3.25Å; E133-V137 WeakPolarHBondContact OE1-CG2 3.27Å |
| 134 | A | 97.9 | Very high | 96.4 | Very high | 6 Ų | 6 | 55.3 Ų | 55.3 | 5% | 0.05 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62.7 | -38.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L97 P107 M131 Q132 W138 | L97-A134 HydrophobicContact CD1-CB 4.25Å; L97-A134 HydrophobicContact CD2-CB 4.14Å; P107-A134 HydrophobicContact CB-CB 4.31Å; P107-A134 HydrophobicContact CG-CB 4.34Å; M131-A134 HydrophobicContact CE-CB 3.95Å; Q132-A134 PolarHBondContact O-N 2.77Å; A134-W138 WeakPolarHBondContact O-CB 3.1Å; A134-W138 PolarHBondContact O-N 3.38Å; A134-W138 VanDerWaalsContact O-N 3.11Å |
| 135 | G | 97.8 | Very high | 96.4 | Very high | 0 Ų | 0 | 48.1 Ų | 48.1 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -68.2 | -43.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | M131 Q132 E133 W138 L139 | M131-G135 PolarHBondContact O-N 2.98Å; Q132-G135 PolarHBondContact O-N 2.91Å; E133-G135 VanDerWaalsContact C-N 3.31Å; E133-G135 PolarHBondContact O-N 3.39Å; G135-W138 PolarHBondContact O-N 3.41Å; G135-L139 WeakPolarHBondContact O-CB 3.32Å; G135-L139 VanDerWaalsContact O-CG 3.28Å; G135-L139 WeakPolarHBondContact O-CG 3.19Å; G135-L139 PolarHBondContact O-N 2.88Å |
| 136 | H | 97.9 | Very high | 96.4 | Very high | 90 Ų | 90 | 56.7 Ų | 56.7 | 42% | 0.417 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.3 | -55 | 176.9 | -179.9 | 68.9 | 0 | 0 | 0 | 111.6 | Q132 E133 W138 L139 C140 | Q132-H136 WeakPolarHBondContact O-CB 3.26Å; Q132-H136 PolarHBondContact O-N 2.91Å; E133-H136 PolarHBondContact O-N 3.24Å; H136-W138 VanDerWaalsContact C-N 3.26Å; H136-W138 PolarHBondContact O-N 3.34Å; H136-L139 PolarHBondContact O-N 2.83Å; H136-L139 VanDerWaalsContact O-N 3.12Å; H136-C140 PolarHBondContact CE1-SG 3.43Å; H136-C140 WeakPolarHBondContact O-CB 3.28Å; H136-C140 PolarHBondContact O-N 3.29Å; H136-C140 PolarHBondContact O-SG 3.45Å |
| 137 | V | 97.9 | Very high | 96.4 | Very high | 34 Ų | 34 | 57.7 Ų | 57.7 | 21% | 0.206 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -57.1 | -41.2 | 179 | 169.6 | 0 | 0 | 0 | 0 | 111.2 | P107 E108 E133 C141 | P107-V137 HydrophobicContact CB-CG1 4.21Å; P107-V137 HydrophobicContact CG-CG1 4.4Å; E108-V137 HydrophobicContact CG-CG1 3.71Å; E108-V137 WeakPolarHBondContact OE1-CG1 3.49Å; E133-V137 HydrophobicContact CG-CG2 4.44Å; E133-V137 WeakPolarHBondContact O-CB 3.22Å; E133-V137 WeakPolarHBondContact O-CG2 3.35Å; E133-V137 PolarHBondContact O-N 2.9Å; E133-V137 VanDerWaalsContact OE1-CG2 3.25Å; E133-V137 WeakPolarHBondContact OE1-CG2 3.27Å; V137-C141 PolarHBondContact O-N 3.17Å |
| 138 | W | 98.5 | Very high | 96.2 | Very high | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 177.7 | -170.6 | 97.7 | 0 | 0 | 0 | 113 | P107 I110 A112 M115 A134 G135 H136 C141 N144 L147 F150 V153 | P107-W138 VanDerWaalsContact O-CD1 3.23Å; I110-W138 PolarHBondContact O-NE1 3.09Å; A112-W138 HydrophobicContact CB-CH2 3.93Å; A112-W138 HydrophobicContact CB-CZ2 3.75Å; M115-W138 HydrophobicContact CE-CB 3.76Å; M115-W138 HydrophobicContact CE-CG 3.78Å; M115-W138 HydrophobicContact CG-CD2 4.38Å; M115-W138 HydrophobicContact CG-CG 4.31Å; A134-W138 WeakPolarHBondContact O-CB 3.1Å; A134-W138 PolarHBondContact O-N 3.38Å; A134-W138 VanDerWaalsContact O-N 3.11Å; G135-W138 PolarHBondContact O-N 3.41Å; H136-W138 VanDerWaalsContact C-N 3.26Å; H136-W138 PolarHBondContact O-N 3.34Å; W138-C141 WeakPolarHBondContact O-CB 3.48Å; W138-C141 PolarHBondContact O-N 3.22Å; W138-N144 HydrophobicContact CD2-CB 4.34Å; W138-N144 HydrophobicContact CE3-CB 4.36Å; W138-N144 HydrophobicContact CH2-CB 4.08Å; W138-N144 HydrophobicContact CZ2-CB 4.04Å; W138-N144 HydrophobicContact CZ3-CB 4.25Å; W138-N144 PolarHBondContact NE1-ND2 3.18Å; W138-N144 PolarHBondContact O-ND2 2.88Å; W138-L147 HydrophobicContact CH2-CD1 4.48Å; W138-L147 HydrophobicContact CZ2-CD1 3.9Å; W138-F150 HydrophobicContact CE3-CD2 4.33Å; W138-F150 HydrophobicContact CE3-CE2 4.48Å; W138-F150 HydrophobicContact CH2-CB 4.38Å; W138-F150 AromaticContact CH2-CD2 3.79Å; W138-F150 HydrophobicContact CH2-CD2 3.79Å; W138-F150 AromaticContact CZ3-CD2 3.39Å; W138-F150 HydrophobicContact CZ3-CD2 3.39Å; W138-F150 AromaticContact CZ3-CE2 3.92Å; W138-F150 HydrophobicContact CZ3-CE2 3.92Å; W138-F150 HydrophobicContact CZ3-CG 4.29Å; W138-V153 HydrophobicContact CD2-CG1 4.33Å; W138-V153 HydrophobicContact CE3-CB 4.11Å; W138-V153 HydrophobicContact CE3-CG1 3.58Å; W138-V153 HydrophobicContact CE3-CG2 4.45Å; W138-V153 HydrophobicContact CH2-CB 4.13Å; W138-V153 HydrophobicContact CH2-CG1 4.43Å; W138-V153 HydrophobicContact CH2-CG2 3.86Å; W138-V153 HydrophobicContact CZ2-CG2 4.44Å; W138-V153 HydrophobicContact CZ3-CB 3.6Å; W138-V153 HydrophobicContact CZ3-CG1 3.64Å; W138-V153 HydrophobicContact CZ3-CG2 3.85Å |
| 139 | L | 98.3 | Very high | 96.1 | Very high | 5 Ų | 5 | 57.8 Ų | 57.8 | 3% | 0.026 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -72.4 | -35.6 | -178.7 | -75.3 | 168.4 | 0 | 0 | 0 | 112.8 | G135 H136 C141 F150 V153 A154 Y157 L174 V179 | G135-L139 WeakPolarHBondContact O-CB 3.32Å; G135-L139 VanDerWaalsContact O-CG 3.28Å; G135-L139 WeakPolarHBondContact O-CG 3.19Å; G135-L139 PolarHBondContact O-N 2.88Å; H136-L139 PolarHBondContact O-N 2.83Å; H136-L139 VanDerWaalsContact O-N 3.12Å; L139-C141 PolarHBondContact O-N 2.87Å; L139-F150 HydrophobicContact CD2-CD2 4.44Å; L139-F150 HydrophobicContact CD2-CE2 3.94Å; L139-F150 HydrophobicContact CD2-CZ 4.1Å; L139-V153 HydrophobicContact CD2-CB 4.45Å; L139-V153 HydrophobicContact CD2-CG1 4.09Å; L139-V153 HydrophobicContact CG-CG1 4.38Å; L139-A154 HydrophobicContact CD2-CB 3.77Å; L139-Y157 HydrophobicContact CD1-CD1 3.56Å; L139-Y157 HydrophobicContact CD1-CD2 4.16Å; L139-Y157 HydrophobicContact CD1-CE1 4.27Å; L139-Y157 HydrophobicContact CD1-CG 3.52Å; L139-L174 HydrophobicContact CD1-CD1 4.06Å; L139-V179 HydrophobicContact CB-CG1 4.27Å; L139-V179 HydrophobicContact CD2-CG1 4.18Å |
| 140 | C | 96.9 | Very high | 96.2 | Very high | 68 Ų | 68 | 55.8 Ų | 55.8 | 46% | 0.459 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -76 | -8.8 | 177.2 | -69.5 | 0 | 0 | 0 | 0 | 113.3 | H136 P142 | H136-C140 PolarHBondContact CE1-SG 3.43Å; H136-C140 WeakPolarHBondContact O-CB 3.28Å; H136-C140 PolarHBondContact O-N 3.29Å; H136-C140 PolarHBondContact O-SG 3.45Å; C140-P142 VanDerWaalsContact O-CD 3.29Å; C140-P142 WeakPolarHBondContact O-CD 3.48Å |
| 141 | C | 96.8 | Very high | 96.2 | Very high | 23 Ų | 23 | 51.8 Ų | 51.8 | 16% | 0.155 | 30% | 0.3 | C | S | . | . | trans | -75.6 | 117.4 | 178 | -169.3 | 0 | 0 | 0 | 0 | 111.5 | E108 V137 W138 L139 S143 N144 | E108-C141 HydrophobicContact CB-CB 4.16Å; E108-C141 HydrophobicContact CG-CB 3.91Å; V137-C141 PolarHBondContact O-N 3.17Å; W138-C141 WeakPolarHBondContact O-CB 3.48Å; W138-C141 PolarHBondContact O-N 3.22Å; L139-C141 PolarHBondContact O-N 2.87Å; C141-S143 PolarHBondContact O-N 3.1Å; C141-S143 VanDerWaalsContact O-N 3.13Å; C141-S143 PolarHBondContact SG-OG 3.09Å; C141-N144 HydrophobicContact CB-CB 4.38Å; C141-N144 WeakPolarHBondContact O-CB 3.39Å; C141-N144 PolarHBondContact O-N 3.23Å | ||
| 142 | P | 94.3 | Very high | 96.1 | Very high | 114 Ų | 114 | 54.9 Ų | 54.9 | 74% | 0.74 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.3 | -27 | -174.5 | -25.3 | 35.4 | 0 | 0 | 0 | 114.5 | C140 N144 | C140-P142 VanDerWaalsContact O-CD 3.29Å; C140-P142 WeakPolarHBondContact O-CD 3.48Å; P142-N144 PolarHBondContact O-N 3.15Å |
| 143 | S | 94.6 | Very high | 96.1 | Very high | 78 Ų | 78 | 52.6 Ų | 52.6 | 55% | 0.545 | 31% | 0.308 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -25.7 | 176.4 | 53.8 | 0 | 0 | 0 | 0 | 112.7 | C141 | C141-S143 PolarHBondContact O-N 3.1Å; C141-S143 VanDerWaalsContact O-N 3.13Å; C141-S143 PolarHBondContact SG-OG 3.09Å |
| 144 | N | 96.8 | Very high | 96.1 | Very high | 8 Ų | 8 | 46.4 Ų | 46.4 | 4% | 0.043 | 28% | 0.279 | C | S | . | . | G | 310 helix | trans | -81.1 | -25.1 | -175.4 | -68.3 | -12.3 | 0 | 0 | 0 | 112.7 | E108 W138 C141 P142 R146 L147 F150 | E108-N144 PolarHBondContact O-ND2 3.41Å; E108-N144 VanDerWaalsContact O-ND2 3.17Å; E108-N144 PolarHBondContact O-OD1 3.43Å; W138-N144 HydrophobicContact CD2-CB 4.34Å; W138-N144 HydrophobicContact CE3-CB 4.36Å; W138-N144 HydrophobicContact CH2-CB 4.08Å; W138-N144 HydrophobicContact CZ2-CB 4.04Å; W138-N144 HydrophobicContact CZ3-CB 4.25Å; W138-N144 PolarHBondContact NE1-ND2 3.18Å; W138-N144 PolarHBondContact O-ND2 2.88Å; C141-N144 HydrophobicContact CB-CB 4.38Å; C141-N144 WeakPolarHBondContact O-CB 3.39Å; C141-N144 PolarHBondContact O-N 3.23Å; P142-N144 PolarHBondContact O-N 3.15Å; N144-R146 PolarHBondContact O-N 3.34Å; N144-L147 HydrophobicContact CB-CD1 4.05Å; N144-L147 WeakPolarHBondContact O-CB 3.36Å; N144-L147 PolarHBondContact O-N 3.45Å; N144-L147 WeakPolarHBondContact OD1-CD1 3.18Å; N144-F150 HydrophobicContact CB-CD2 4.11Å; N144-F150 HydrophobicContact CB-CE2 4.22Å; N144-F150 WeakPolarHBondContact O-CD2 3.48Å |
| 145 | G | 94.4 | Very high | 96 | Very high | 17 Ų | 17 | 50.1 Ų | 50.1 | 18% | 0.175 | 30% | 0.296 | C | S | . | . | G | 310 helix | trans | -57.6 | -18.9 | 179 | 0 | 0 | 0 | 0 | 0 | 114.8 | I182 | G145-I182 WeakPolarHBondContact O-CG2 3.48Š|
| 146 | R | 93.1 | Very high | 96 | Very high | 234 Ų | 234 | 51.3 Ų | 51.3 | 88% | 0.883 | 30% | 0.302 | S | S | * | . | G | 310 helix | trans | -98.4 | -5 | 178.1 | -58.4 | -177.7 | -174 | -179.2 | 2.1 | 113.6 | N144 | N144-R146 PolarHBondContact O-N 3.34Š|
| 147 | L | 93.7 | Very high | 96 | Very high | 74 Ų | 74 | 47.2 Ų | 47.2 | 39% | 0.387 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -74.8 | 140.9 | -176.8 | -64.5 | 177 | 0 | 0 | 0 | 111 | W138 N144 G149 F150 | W138-L147 HydrophobicContact CH2-CD1 4.48Å; W138-L147 HydrophobicContact CZ2-CD1 3.9Å; N144-L147 HydrophobicContact CB-CD1 4.05Å; N144-L147 WeakPolarHBondContact O-CB 3.36Å; N144-L147 PolarHBondContact O-N 3.45Å; N144-L147 WeakPolarHBondContact OD1-CD1 3.18Å; L147-G149 PolarHBondContact O-N 3.05Å; L147-F150 WeakPolarHBondContact O-CB 3.34Å; L147-F150 PolarHBondContact O-N 2.8Å; L147-F150 VanDerWaalsContact O-N 3.09Å |
| 148 | A | 91.9 | Very high | 95.9 | Very high | 100 Ų | 100 | 45.8 Ų | 45.8 | 83% | 0.826 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | 124.4 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||
| 149 | G | 92.8 | Very high | 95.7 | Very high | 27 Ų | 27 | 48.3 Ų | 48.3 | 28% | 0.278 | 29% | 0.287 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 94.3 | 0.7 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | L147 G151 T152 V153 | L147-G149 PolarHBondContact O-N 3.05Å; G149-G151 PolarHBondContact O-N 3.01Å; G149-T152 WeakPolarHBondContact O-CB 3.39Å; G149-T152 PolarHBondContact O-N 3.05Å; G149-T152 VanDerWaalsContact O-N 3.15Å; G149-V153 WeakPolarHBondContact O-CG2 3.34Å; G149-V153 PolarHBondContact O-N 3.43Å |
| 150 | F | 97 | Very high | 95.6 | Very high | 8 Ų | 8 | 51 Ų | 51 | 4% | 0.035 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -54.2 | -50.5 | 174.5 | -179.4 | -98 | 0 | 0 | 0 | 112.4 | W138 L139 N144 L147 T152 V153 A154 V179 I182 A183 | W138-F150 HydrophobicContact CE3-CD2 4.33Å; W138-F150 HydrophobicContact CE3-CE2 4.48Å; W138-F150 HydrophobicContact CH2-CB 4.38Å; W138-F150 AromaticContact CH2-CD2 3.79Å; W138-F150 HydrophobicContact CH2-CD2 3.79Å; W138-F150 AromaticContact CZ3-CD2 3.39Å; W138-F150 HydrophobicContact CZ3-CD2 3.39Å; W138-F150 AromaticContact CZ3-CE2 3.92Å; W138-F150 HydrophobicContact CZ3-CE2 3.92Å; W138-F150 HydrophobicContact CZ3-CG 4.29Å; L139-F150 HydrophobicContact CD2-CD2 4.44Å; L139-F150 HydrophobicContact CD2-CE2 3.94Å; L139-F150 HydrophobicContact CD2-CZ 4.1Å; N144-F150 HydrophobicContact CB-CD2 4.11Å; N144-F150 HydrophobicContact CB-CE2 4.22Å; N144-F150 WeakPolarHBondContact O-CD2 3.48Å; L147-F150 WeakPolarHBondContact O-CB 3.34Å; L147-F150 PolarHBondContact O-N 2.8Å; L147-F150 VanDerWaalsContact O-N 3.09Å; F150-T152 VanDerWaalsContact C-N 3.27Å; F150-T152 PolarHBondContact O-N 3.46Å; F150-V153 PolarHBondContact O-N 2.74Å; F150-V153 VanDerWaalsContact O-N 3.11Å; F150-A154 PolarHBondContact O-N 3.4Å; F150-V179 HydrophobicContact CE1-CG1 4.19Å; F150-V179 HydrophobicContact CZ-CG1 3.93Å; F150-I182 HydrophobicContact CD1-CG2 3.96Å; F150-I182 HydrophobicContact CE1-CB 4.03Å; F150-I182 HydrophobicContact CE1-CG2 3.84Å; F150-A183 HydrophobicContact CD1-CB 4.12Å; F150-A183 HydrophobicContact CE1-CB 3.95Å |
| 151 | G | 96 | Very high | 95.6 | Very high | 22 Ų | 22 | 47.7 Ų | 47.7 | 23% | 0.227 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.2 | -37.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113 | G149 A154 E155 | G149-G151 PolarHBondContact O-N 3.01Å; G151-A154 PolarHBondContact O-N 3.02Å; G151-E155 WeakPolarHBondContact O-CB 3.29Å; G151-E155 PolarHBondContact O-N 3.39Å |
| 152 | T | 96.4 | Very high | 95.6 | Very high | 66 Ų | 66 | 46.7 Ų | 46.7 | 41% | 0.405 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -68.1 | -37.8 | 176.4 | -47.6 | 0 | 0 | 0 | 0 | 112 | L116 G149 F150 E155 L156 | L116-T152 HydrophobicContact CD1-CG2 4.19Å; L116-T152 HydrophobicContact CD2-CG2 3.74Å; G149-T152 WeakPolarHBondContact O-CB 3.39Å; G149-T152 PolarHBondContact O-N 3.05Å; G149-T152 VanDerWaalsContact O-N 3.15Å; F150-T152 VanDerWaalsContact C-N 3.27Å; F150-T152 PolarHBondContact O-N 3.46Å; T152-E155 PolarHBondContact O-N 2.95Å; T152-L156 WeakPolarHBondContact O-CG 3.02Å; T152-L156 PolarHBondContact O-N 2.91Å |
| 153 | V | 98 | Very high | 95.6 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.8 | -43.5 | 174.3 | 176.4 | 0 | 0 | 0 | 0 | 110 | A112 M115 L116 I119 W138 L139 G149 F150 E155 L156 Y157 | A112-V153 HydrophobicContact CB-CG2 4.16Å; M115-V153 HydrophobicContact CB-CG2 4.34Å; M115-V153 HydrophobicContact CG-CG1 3.71Å; M115-V153 HydrophobicContact CG-CG2 4.37Å; L116-V153 HydrophobicContact CD2-CB 4.18Å; L116-V153 HydrophobicContact CD2-CG2 3.51Å; L116-V153 HydrophobicContact CG-CG2 3.79Å; I119-V153 HydrophobicContact CD1-CG1 4.16Å; W138-V153 HydrophobicContact CD2-CG1 4.33Å; W138-V153 HydrophobicContact CE3-CB 4.11Å; W138-V153 HydrophobicContact CE3-CG1 3.58Å; W138-V153 HydrophobicContact CE3-CG2 4.45Å; W138-V153 HydrophobicContact CH2-CB 4.13Å; W138-V153 HydrophobicContact CH2-CG1 4.43Å; W138-V153 HydrophobicContact CH2-CG2 3.86Å; W138-V153 HydrophobicContact CZ2-CG2 4.44Å; W138-V153 HydrophobicContact CZ3-CB 3.6Å; W138-V153 HydrophobicContact CZ3-CG1 3.64Å; W138-V153 HydrophobicContact CZ3-CG2 3.85Å; L139-V153 HydrophobicContact CD2-CB 4.45Å; L139-V153 HydrophobicContact CD2-CG1 4.09Å; L139-V153 HydrophobicContact CG-CG1 4.38Å; G149-V153 WeakPolarHBondContact O-CG2 3.34Å; G149-V153 PolarHBondContact O-N 3.43Å; F150-V153 PolarHBondContact O-N 2.74Å; F150-V153 VanDerWaalsContact O-N 3.11Å; V153-E155 VanDerWaalsContact C-N 3.35Å; V153-E155 PolarHBondContact O-N 3.44Å; V153-L156 PolarHBondContact O-N 3.37Å; V153-Y157 VanDerWaalsContact O-CB 3.25Å; V153-Y157 WeakPolarHBondContact O-CB 3.42Å; V153-Y157 PolarHBondContact O-N 3.39Å |
| 154 | A | 97.9 | Very high | 95.4 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.8 | -42.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L139 F150 G151 Y157 L158 V179 A183 F184 | L139-A154 HydrophobicContact CD2-CB 3.77Å; F150-A154 PolarHBondContact O-N 3.4Å; G151-A154 PolarHBondContact O-N 3.02Å; A154-Y157 PolarHBondContact O-N 2.69Å; A154-L158 WeakPolarHBondContact O-CB 3.03Å; A154-L158 PolarHBondContact O-N 2.91Å; A154-V179 HydrophobicContact CB-CG1 4.44Å; A154-A183 HydrophobicContact CB-CB 3.55Å; A154-F184 HydrophobicContact CB-CE1 4.24Å; A154-F184 HydrophobicContact CB-CE2 4.35Å; A154-F184 HydrophobicContact CB-CZ 3.72Å |
| 155 | E | 96.2 | Very high | 95.2 | Very high | 85 Ų | 85 | 42.3 Ų | 42.3 | 40% | 0.397 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.6 | -49.1 | 175.9 | -172.9 | 178.3 | -177.9 | 0 | 0 | 111.6 | G151 T152 V153 Y157 L158 L159 F184 | G151-E155 WeakPolarHBondContact O-CB 3.29Å; G151-E155 PolarHBondContact O-N 3.39Å; T152-E155 PolarHBondContact O-N 2.95Å; V153-E155 VanDerWaalsContact C-N 3.35Å; V153-E155 PolarHBondContact O-N 3.44Å; E155-Y157 VanDerWaalsContact C-N 3.35Å; E155-Y157 PolarHBondContact O-N 2.67Å; E155-L158 PolarHBondContact O-N 2.9Å; E155-L159 HydrophobicContact CG-CD1 3.87Å; E155-L159 HydrophobicContact CG-CG 4.49Å; E155-L159 WeakPolarHBondContact O-CB 3.39Å; E155-L159 WeakPolarHBondContact O-CG 3.5Å; E155-L159 PolarHBondContact O-N 3.08Å; E155-F184 HydrophobicContact CB-CE1 4.09Å |
| 156 | L | 96.6 | Very high | 95.1 | Very high | 25 Ų | 25 | 43.6 Ų | 43.6 | 13% | 0.131 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -64.8 | -40 | 177.4 | -68.1 | -172.4 | 0 | 0 | 0 | 111.8 | L116 I119 L120 T152 V153 L158 L159 H160 | L116-L156 HydrophobicContact CB-CD1 4.24Å; L116-L156 HydrophobicContact CD2-CD1 3.41Å; L116-L156 VanDerWaalsContact CD2-CD1 3.41Å; L116-L156 HydrophobicContact CD2-CG 4.1Å; L116-L156 HydrophobicContact CG-CD1 4.42Å; I119-L156 HydrophobicContact CD1-CB 4.33Å; I119-L156 HydrophobicContact CG2-CB 3.99Å; L120-L156 HydrophobicContact CD1-CD1 4.39Å; L120-L156 HydrophobicContact CD2-CD1 4.04Å; L120-L156 HydrophobicContact CD2-CD2 4.18Å; L120-L156 HydrophobicContact CG-CD1 3.97Å; T152-L156 WeakPolarHBondContact O-CG 3.02Å; T152-L156 PolarHBondContact O-N 2.91Å; V153-L156 PolarHBondContact O-N 3.37Å; L156-L158 VanDerWaalsContact C-N 3.31Å; L156-L158 PolarHBondContact O-N 2.62Å; L156-L159 PolarHBondContact O-N 3.1Å; L156-H160 VanDerWaalsContact CD2-CD2 3.43Å; L156-H160 WeakPolarHBondContact CD2-CD2 3.36Å; L156-H160 WeakPolarHBondContact O-CA 3.45Å; L156-H160 VanDerWaalsContact O-CB 3.25Å; L156-H160 WeakPolarHBondContact O-CB 3.37Å; L156-H160 PolarHBondContact O-N 3.27Å |
| 157 | Y | 98.1 | Very high | 95.2 | Very high | 4 Ų | 4 | 35 Ų | 35 | 2% | 0.016 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.9 | -44 | 176.9 | -172.9 | -101.2 | 0 | 0 | 0 | 111.1 | Q132 L139 V153 A154 E155 I161 L162 L174 | Q132-Y157 WeakPolarHBondContact CG-OH 3.39Å; Q132-Y157 WeakPolarHBondContact O-CE2 3.36Å; Q132-Y157 PolarHBondContact O-OH 3.36Å; L139-Y157 HydrophobicContact CD1-CD1 3.56Å; L139-Y157 HydrophobicContact CD1-CD2 4.16Å; L139-Y157 HydrophobicContact CD1-CE1 4.27Å; L139-Y157 HydrophobicContact CD1-CG 3.52Å; V153-Y157 VanDerWaalsContact O-CB 3.25Å; V153-Y157 WeakPolarHBondContact O-CB 3.42Å; V153-Y157 PolarHBondContact O-N 3.39Å; A154-Y157 PolarHBondContact O-N 2.69Å; E155-Y157 VanDerWaalsContact C-N 3.35Å; E155-Y157 PolarHBondContact O-N 2.67Å; Y157-I161 HydrophobicContact CD2-CB 4.22Å; Y157-I161 HydrophobicContact CD2-CD1 3.68Å; Y157-I161 HydrophobicContact CD2-CG1 4.39Å; Y157-I161 HydrophobicContact CD2-CG2 4.46Å; Y157-I161 HydrophobicContact CE2-CB 4.3Å; Y157-I161 HydrophobicContact CE2-CD1 3.99Å; Y157-I161 HydrophobicContact CE2-CG2 4.05Å; Y157-I161 WeakPolarHBondContact O-CA 3.4Å; Y157-I161 VanDerWaalsContact O-CB 3.26Å; Y157-I161 WeakPolarHBondContact O-CB 3.5Å; Y157-I161 PolarHBondContact O-N 3.44Å; Y157-I161 VanDerWaalsContact O-N 3.09Å; Y157-L162 HydrophobicContact CD1-CD1 3.82Å; Y157-L162 HydrophobicContact CD1-CD2 4.4Å; Y157-L162 HydrophobicContact CD1-CG 3.82Å; Y157-L162 HydrophobicContact CE1-CD1 3.59Å; Y157-L162 HydrophobicContact CE1-CD2 3.58Å; Y157-L162 HydrophobicContact CE1-CG 3.49Å; Y157-L162 VanDerWaalsContact CE1-CG 3.49Å; Y157-L162 PolarHBondContact O-N 2.97Å; Y157-L174 HydrophobicContact CD1-CD1 4.35Å; Y157-L174 HydrophobicContact CD1-CD2 3.97Å |
| 158 | L | 96.1 | Very high | 95.1 | Very high | 4 Ų | 4 | 32.2 Ų | 32.2 | 2% | 0.021 | 21% | 0.205 | C | C | . | . | I | π-helix | trans | -61.5 | -55.9 | 174.8 | -177.7 | 64 | 0 | 0 | 0 | 111.8 | A154 E155 L156 L162 V163 A171 L174 V175 A192 V196 | A154-L158 WeakPolarHBondContact O-CB 3.03Å; A154-L158 PolarHBondContact O-N 2.91Å; E155-L158 PolarHBondContact O-N 2.9Å; L156-L158 VanDerWaalsContact C-N 3.31Å; L156-L158 PolarHBondContact O-N 2.62Å; L158-L162 HydrophobicContact CD1-CD1 4.39Å; L158-V163 HydrophobicContact CD1-CG2 4.07Å; L158-V163 HydrophobicContact CG-CG2 4.3Å; L158-V163 WeakPolarHBondContact O-CB 3.13Å; L158-V163 VanDerWaalsContact O-CG2 3.31Å; L158-V163 WeakPolarHBondContact O-CG2 3.24Å; L158-V163 PolarHBondContact O-N 3.47Å; L158-A171 HydrophobicContact CD1-CB 3.59Å; L158-L174 HydrophobicContact CB-CD2 3.84Å; L158-L174 HydrophobicContact CD1-CD2 4.22Å; L158-V175 HydrophobicContact CD1-CG2 4.34Å; L158-V175 HydrophobicContact CD2-CG2 3.84Å; L158-A192 HydrophobicContact CD2-CB 3.67Å; L158-V196 HydrophobicContact CD1-CG2 4.24Å |
| 159 | L | 95.1 | Very high | 95.2 | Very high | 52 Ų | 52 | 32.8 Ų | 32.8 | 27% | 0.272 | 20% | 0.198 | S | C | . | . | I | π-helix | trans | -77.1 | -29.5 | -168.3 | -66 | 179.6 | 0 | 0 | 0 | 113.9 | E155 L156 P164 I195 | E155-L159 HydrophobicContact CG-CD1 3.87Å; E155-L159 HydrophobicContact CG-CG 4.49Å; E155-L159 WeakPolarHBondContact O-CB 3.39Å; E155-L159 WeakPolarHBondContact O-CG 3.5Å; E155-L159 PolarHBondContact O-N 3.08Å; L156-L159 PolarHBondContact O-N 3.1Å; L159-P164 WeakPolarHBondContact O-CD 3.43Å; L159-P164 WeakPolarHBondContact O-CG 3.37Å; L159-I195 HydrophobicContact CD2-CD1 3.92Å; L159-I195 HydrophobicContact CD2-CG2 4.11Å |
| 160 | H | 95 | Very high | 95.3 | Very high | 61 Ų | 61 | 34.8 Ų | 34.8 | 28% | 0.282 | 20% | 0.2 | S | C | . | . | I | π-helix | trans | -115.7 | -4.8 | -172.4 | -62.2 | -65.2 | 0 | 0 | 0 | 114.1 | I119 T123 Q128 L156 | I119-H160 HydrophobicContact CG2-CB 4.19Å; T123-H160 HydrophobicContact CG2-CB 4.02Å; T123-H160 WeakPolarHBondContact OG1-CB 3.44Å; T123-H160 PolarHBondContact OG1-O 3.28Å; Q128-H160 WeakPolarHBondContact CB-O 3.46Å; Q128-H160 VanDerWaalsContact CD-O 3.24Å; Q128-H160 WeakPolarHBondContact CG-O 3.25Å; Q128-H160 PolarHBondContact OE1-O 2.97Å; L156-H160 VanDerWaalsContact CD2-CD2 3.43Å; L156-H160 WeakPolarHBondContact CD2-CD2 3.36Å; L156-H160 WeakPolarHBondContact O-CA 3.45Å; L156-H160 VanDerWaalsContact O-CB 3.25Å; L156-H160 WeakPolarHBondContact O-CB 3.37Å; L156-H160 PolarHBondContact O-N 3.27Å |
| 161 | I | 97 | Very high | 95.2 | Very high | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 20% | 0.199 | C | C | . | . | I | π-helix | trans | -123.6 | -69 | 175.3 | -56.9 | -177.1 | 0 | 0 | 0 | 109.6 | I119 Q128 M131 Q132 Y157 V163 P164 L165 | I119-I161 HydrophobicContact CD1-CD1 4.44Å; I119-I161 HydrophobicContact CG1-CD1 4.03Å; I119-I161 HydrophobicContact CG2-CD1 4.07Å; I119-I161 HydrophobicContact CG2-CG1 4.24Å; Q128-I161 HydrophobicContact CB-CG1 4.45Å; M131-I161 HydrophobicContact CB-CD1 3.62Å; Q132-I161 HydrophobicContact CB-CG2 3.97Å; Q132-I161 HydrophobicContact CG-CG2 4.23Å; Y157-I161 HydrophobicContact CD2-CB 4.22Å; Y157-I161 HydrophobicContact CD2-CD1 3.68Å; Y157-I161 HydrophobicContact CD2-CG1 4.39Å; Y157-I161 HydrophobicContact CD2-CG2 4.46Å; Y157-I161 HydrophobicContact CE2-CB 4.3Å; Y157-I161 HydrophobicContact CE2-CD1 3.99Å; Y157-I161 HydrophobicContact CE2-CG2 4.05Å; Y157-I161 WeakPolarHBondContact O-CA 3.4Å; Y157-I161 VanDerWaalsContact O-CB 3.26Å; Y157-I161 WeakPolarHBondContact O-CB 3.5Å; Y157-I161 PolarHBondContact O-N 3.44Å; Y157-I161 VanDerWaalsContact O-N 3.09Å; I161-V163 PolarHBondContact O-N 3.22Å; I161-P164 WeakPolarHBondContact O-CD 3.49Å; I161-L165 HydrophobicContact CG2-CD1 3.75Å; I161-L165 VanDerWaalsContact O-CB 3.27Å; I161-L165 WeakPolarHBondContact O-CB 3.35Å; I161-L165 WeakPolarHBondContact O-CD1 3.31Å; I161-L165 WeakPolarHBondContact O-CG 3.36Å; I161-L165 PolarHBondContact O-N 3.38Å; I161-L165 VanDerWaalsContact O-N 3.08Å |
| 162 | L | 96.8 | Very high | 95.2 | Very high | 2 Ų | 2 | 36.6 Ų | 36.6 | 1% | 0.01 | 20% | 0.2 | C | C | . | . | I | π-helix | trans | -62.7 | -51.9 | -172.2 | -62.3 | -177.6 | 0 | 0 | 0 | 112.9 | Y157 L158 L165 G166 H167 E170 A171 L174 | Y157-L162 HydrophobicContact CD1-CD1 3.82Å; Y157-L162 HydrophobicContact CD1-CD2 4.4Å; Y157-L162 HydrophobicContact CD1-CG 3.82Å; Y157-L162 HydrophobicContact CE1-CD1 3.59Å; Y157-L162 HydrophobicContact CE1-CD2 3.58Å; Y157-L162 HydrophobicContact CE1-CG 3.49Å; Y157-L162 VanDerWaalsContact CE1-CG 3.49Å; Y157-L162 PolarHBondContact O-N 2.97Å; L158-L162 HydrophobicContact CD1-CD1 4.39Å; L162-L165 PolarHBondContact O-N 2.98Å; L162-G166 PolarHBondContact O-N 2.94Å; L162-G166 VanDerWaalsContact O-N 3.16Å; L162-H167 HydrophobicContact CB-CB 4.47Å; L162-H167 HydrophobicContact CD2-CB 4.06Å; L162-H167 PolarHBondContact O-N 3.33Å; L162-E170 HydrophobicContact CD1-CB 4.28Å; L162-E170 HydrophobicContact CD2-CB 3.99Å; L162-E170 WeakPolarHBondContact CD2-OE2 3.32Å; L162-A171 HydrophobicContact CB-CB 4.11Å; L162-A171 HydrophobicContact CD1-CB 4.22Å; L162-L174 HydrophobicContact CD1-CB 4.17Å; L162-L174 HydrophobicContact CD1-CD2 3.94Å |
| 163 | V | 93.3 | Very high | 95.1 | Very high | 6 Ų | 6 | 40.2 Ų | 40.2 | 4% | 0.036 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -65.1 | -47.9 | -176 | 169.2 | 0 | 0 | 0 | 0 | 111.7 | L158 I161 L165 G166 M168 A171 I195 V196 K199 | L158-V163 HydrophobicContact CD1-CG2 4.07Å; L158-V163 HydrophobicContact CG-CG2 4.3Å; L158-V163 WeakPolarHBondContact O-CB 3.13Å; L158-V163 VanDerWaalsContact O-CG2 3.31Å; L158-V163 WeakPolarHBondContact O-CG2 3.24Å; L158-V163 PolarHBondContact O-N 3.47Å; I161-V163 PolarHBondContact O-N 3.22Å; V163-L165 VanDerWaalsContact C-N 3.34Å; V163-L165 PolarHBondContact O-N 3.35Å; V163-G166 PolarHBondContact O-N 2.88Å; V163-M168 HydrophobicContact CB-CE 4.46Å; V163-M168 HydrophobicContact CG1-CE 4.39Å; V163-M168 WeakPolarHBondContact O-CE 3.48Å; V163-A171 HydrophobicContact CG2-CB 4.48Å; V163-I195 HydrophobicContact CG1-CG2 4.46Å; V163-V196 HydrophobicContact CG2-CG2 3.91Å; V163-K199 HydrophobicContact CG1-CB 4.14Å; V163-K199 HydrophobicContact CG1-CD 3.48Å; V163-K199 VanDerWaalsContact CG1-CD 3.48Å; V163-K199 HydrophobicContact CG1-CG 3.79Å; V163-K199 VanDerWaalsContact O-CE 3.25Å; V163-K199 WeakPolarHBondContact O-CE 3.42Å |
| 164 | P | 91.6 | Very high | 95.1 | Very high | 44 Ų | 44 | 41.1 Ų | 41.1 | 29% | 0.286 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63.6 | -32.1 | 175.9 | -28 | 39.1 | 0 | 0 | 0 | 115.2 | L159 I161 G166 | L159-P164 WeakPolarHBondContact O-CD 3.43Å; L159-P164 WeakPolarHBondContact O-CG 3.37Å; I161-P164 WeakPolarHBondContact O-CD 3.49Å; P164-G166 VanDerWaalsContact C-N 3.28Å |
| 165 | L | 92.8 | Very high | 94.9 | Very high | 57 Ų | 57 | 41.1 Ų | 41.1 | 30% | 0.298 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -81.8 | -6.3 | 178.3 | -64.7 | 173.6 | 0 | 0 | 0 | 113.2 | Q128 A129 I161 L162 V163 H167 | Q128-L165 HydrophobicContact CG-CD1 4.4Å; Q128-L165 HydrophobicContact CG-CD2 4.04Å; Q128-L165 HydrophobicContact CG-CG 4.15Å; A129-L165 HydrophobicContact CB-CD1 4.19Å; A129-L165 HydrophobicContact CB-CD2 4.13Å; I161-L165 HydrophobicContact CG2-CD1 3.75Å; I161-L165 VanDerWaalsContact O-CB 3.27Å; I161-L165 WeakPolarHBondContact O-CB 3.35Å; I161-L165 WeakPolarHBondContact O-CD1 3.31Å; I161-L165 WeakPolarHBondContact O-CG 3.36Å; I161-L165 PolarHBondContact O-N 3.38Å; I161-L165 VanDerWaalsContact O-N 3.08Å; L162-L165 PolarHBondContact O-N 2.98Å; V163-L165 VanDerWaalsContact C-N 3.34Å; V163-L165 PolarHBondContact O-N 3.35Å; L165-H167 PolarHBondContact O-CD2 3.38Å |
| 166 | G | 91.8 | Very high | 94.8 | Very high | 45 Ų | 45 | 43.4 Ų | 43.4 | 46% | 0.464 | 23% | 0.226 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 83.7 | 11.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | L162 V163 P164 M168 | L162-G166 PolarHBondContact O-N 2.94Å; L162-G166 VanDerWaalsContact O-N 3.16Å; V163-G166 PolarHBondContact O-N 2.88Å; P164-G166 VanDerWaalsContact C-N 3.28Å; G166-M168 PolarHBondContact O-N 3.46Å |
| 167 | H | 94.8 | Very high | 94.6 | Very high | 53 Ų | 53 | 43.6 Ų | 43.6 | 25% | 0.245 | 23% | 0.234 | C | C | . | . | trans | -81.9 | 63.7 | -177.9 | -63.4 | -171.3 | 0 | 0 | 0 | 110.8 | Q132 L162 L165 T169 E170 A171 | Q132-H167 VanDerWaalsContact CD-CE1 3.5Å; Q132-H167 PolarHBondContact NE2-CE1 2.94Å; Q132-H167 PolarHBondContact NE2-ND1 3.17Å; Q132-H167 VanDerWaalsContact NE2-ND1 3.2Å; Q132-H167 PolarHBondContact OE1-CE1 3.13Å; L162-H167 HydrophobicContact CB-CB 4.47Å; L162-H167 HydrophobicContact CD2-CB 4.06Å; L162-H167 PolarHBondContact O-N 3.33Å; L165-H167 PolarHBondContact O-CD2 3.38Å; H167-T169 VanDerWaalsContact C-N 3.34Å; H167-T169 PolarHBondContact O-N 2.89Å; H167-E170 HydrophobicContact CB-CB 4.22Å; H167-E170 HydrophobicContact CB-CG 4.49Å; H167-E170 IonicContact ND1-OE1 3.1Å; H167-E170 IonicContact ND1-OE2 3.84Å; H167-E170 PolarHBondContact ND1-OE2 3.06Å; H167-E170 PolarHBondContact O-N 3.29Å; H167-A171 WeakPolarHBondContact O-CB 3.42Å; H167-A171 PolarHBondContact O-N 3.39Å | ||
| 168 | M | 92.8 | Very high | 94.4 | Very high | 15 Ų | 15 | 51.2 Ų | 51.2 | 7% | 0.074 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -67.9 | -31.5 | -172.1 | -61.3 | -59.8 | 128.7 | 0 | 0 | 113.4 | V163 G166 A171 R172 V196 K199 E200 | V163-M168 HydrophobicContact CB-CE 4.46Å; V163-M168 HydrophobicContact CG1-CE 4.39Å; V163-M168 WeakPolarHBondContact O-CE 3.48Å; G166-M168 PolarHBondContact O-N 3.46Å; M168-A171 PolarHBondContact O-N 3.05Å; M168-R172 PolarHBondContact O-N 3.23Å; M168-R172 VanDerWaalsContact O-N 3.07Å; M168-V196 HydrophobicContact CB-CG1 4.39Å; M168-V196 HydrophobicContact SD-CG1 3.81Å; M168-K199 HydrophobicContact CE-CB 4.44Å; M168-K199 HydrophobicContact CE-CG 3.93Å; M168-K199 HydrophobicContact SD-CB 4.45Å; M168-E200 HydrophobicContact CG-CB 4.32Å |
| 169 | T | 93.3 | Very high | 94.4 | Very high | 112 Ų | 112 | 52.1 Ų | 52.1 | 69% | 0.687 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -66.6 | -49.8 | 176.3 | 48.8 | 0 | 0 | 0 | 0 | 111 | H167 A171 R172 E173 | H167-T169 VanDerWaalsContact C-N 3.34Å; H167-T169 PolarHBondContact O-N 2.89Å; T169-A171 VanDerWaalsContact C-N 3.27Å; T169-A171 PolarHBondContact O-N 3.18Å; T169-R172 PolarHBondContact O-N 3.46Å; T169-E173 PolarHBondContact O-N 3.09Å |
| 170 | E | 95.2 | Very high | 94.4 | Very high | 69 Ų | 69 | 49.6 Ų | 49.6 | 32% | 0.322 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -62 | -36.9 | 174.9 | -66.4 | 173.7 | -151.2 | 0 | 0 | 111 | Q132 L162 H167 E173 L174 | Q132-E170 PolarHBondContact NE2-OE2 3.15Å; L162-E170 HydrophobicContact CD1-CB 4.28Å; L162-E170 HydrophobicContact CD2-CB 3.99Å; L162-E170 WeakPolarHBondContact CD2-OE2 3.32Å; H167-E170 HydrophobicContact CB-CB 4.22Å; H167-E170 HydrophobicContact CB-CG 4.49Å; H167-E170 IonicContact ND1-OE1 3.1Å; H167-E170 IonicContact ND1-OE2 3.84Å; H167-E170 PolarHBondContact ND1-OE2 3.06Å; H167-E170 PolarHBondContact O-N 3.29Å; E170-E173 PolarHBondContact O-N 2.85Å; E170-L174 WeakPolarHBondContact O-CB 3.35Å; E170-L174 PolarHBondContact O-N 3.34Å |
| 171 | A | 95.5 | Very high | 94.3 | Very high | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.9 | -43.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | L158 L162 V163 H167 M168 T169 L174 V175 V196 | L158-A171 HydrophobicContact CD1-CB 3.59Å; L162-A171 HydrophobicContact CB-CB 4.11Å; L162-A171 HydrophobicContact CD1-CB 4.22Å; V163-A171 HydrophobicContact CG2-CB 4.48Å; H167-A171 WeakPolarHBondContact O-CB 3.42Å; H167-A171 PolarHBondContact O-N 3.39Å; M168-A171 PolarHBondContact O-N 3.05Å; T169-A171 VanDerWaalsContact C-N 3.27Å; T169-A171 PolarHBondContact O-N 3.18Å; A171-L174 PolarHBondContact O-N 3.24Å; A171-V175 WeakPolarHBondContact O-CG2 3.41Å; A171-V175 PolarHBondContact O-N 3.46Å; A171-V196 HydrophobicContact CB-CG1 4.34Å; A171-V196 HydrophobicContact CB-CG2 3.85Å |
| 172 | R | 94.8 | Very high | 94.2 | Very high | 69 Ų | 69 | 53.5 Ų | 53.5 | 26% | 0.26 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -67.7 | -40.9 | 175.5 | -73.8 | -172.8 | -117.1 | -111.8 | 2.2 | 112.3 | M168 T169 L174 V175 F176 L193 V196 E200 | M168-R172 PolarHBondContact O-N 3.23Å; M168-R172 VanDerWaalsContact O-N 3.07Å; T169-R172 PolarHBondContact O-N 3.46Å; R172-L174 VanDerWaalsContact C-N 3.31Å; R172-L174 PolarHBondContact O-N 3.46Å; R172-V175 PolarHBondContact O-N 3.32Å; R172-F176 PolarHBondContact O-N 2.94Å; R172-L193 HydrophobicContact CG-CD2 4.39Å; R172-V196 HydrophobicContact CG-CG1 4.07Å; R172-E200 IonicContact CZ-OE2 2.96Å; R172-E200 IonicContact NH1-OE2 2.64Å; R172-E200 IonicContact NH2-OE1 2.62Å; R172-E200 PolarHBondContact NH2-OE1 3.19Å; R172-E200 IonicContact NH2-OE2 3.53Å; R172-E200 PolarHBondContact NH2-OE2 3.34Å |
| 173 | E | 95.6 | Very high | 94.1 | Very high | 142 Ų | 142 | 54 Ų | 54 | 66% | 0.664 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -60.9 | -42 | 175.4 | -174.3 | -178.5 | -178.7 | 0 | 0 | 111.3 | T169 E170 V175 G177 | T169-E173 PolarHBondContact O-N 3.09Å; E170-E173 PolarHBondContact O-N 2.85Å; E173-V175 VanDerWaalsContact C-N 3.32Å; E173-V175 PolarHBondContact O-N 3.2Å; E173-G177 VanDerWaalsContact O-CA 3.22Å; E173-G177 WeakPolarHBondContact O-CA 3.27Å; E173-G177 PolarHBondContact O-N 2.83Å |
| 174 | L | 96.4 | Very high | 94.1 | Very high | 18 Ų | 18 | 54.6 Ų | 54.6 | 9% | 0.094 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -60 | -41.8 | 176 | -173.4 | 79.4 | 0 | 0 | 0 | 111.9 | L139 Y157 L158 L162 E170 A171 R172 V179 G180 | L139-L174 HydrophobicContact CD1-CD1 4.06Å; Y157-L174 HydrophobicContact CD1-CD1 4.35Å; Y157-L174 HydrophobicContact CD1-CD2 3.97Å; L158-L174 HydrophobicContact CB-CD2 3.84Å; L158-L174 HydrophobicContact CD1-CD2 4.22Å; L162-L174 HydrophobicContact CD1-CB 4.17Å; L162-L174 HydrophobicContact CD1-CD2 3.94Å; E170-L174 WeakPolarHBondContact O-CB 3.35Å; E170-L174 PolarHBondContact O-N 3.34Å; A171-L174 PolarHBondContact O-N 3.24Å; R172-L174 VanDerWaalsContact C-N 3.31Å; R172-L174 PolarHBondContact O-N 3.46Å; L174-V179 HydrophobicContact CD1-CB 4.08Å; L174-V179 HydrophobicContact CD1-CG1 3.6Å; L174-V179 HydrophobicContact CG-CG1 4.45Å; L174-G180 WeakPolarHBondContact O-CA 3.48Å; L174-G180 PolarHBondContact O-N 3.23Å |
| 175 | V | 95.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -73.3 | -41.2 | -176.6 | 173.7 | 0 | 0 | 0 | 0 | 112.5 | L158 A171 R172 E173 G180 K189 A192 L193 | L158-V175 HydrophobicContact CD1-CG2 4.34Å; L158-V175 HydrophobicContact CD2-CG2 3.84Å; A171-V175 WeakPolarHBondContact O-CG2 3.41Å; A171-V175 PolarHBondContact O-N 3.46Å; R172-V175 PolarHBondContact O-N 3.32Å; E173-V175 VanDerWaalsContact C-N 3.32Å; E173-V175 PolarHBondContact O-N 3.2Å; V175-G180 WeakPolarHBondContact O-CA 3.36Å; V175-K189 HydrophobicContact CG1-CB 3.81Å; V175-K189 HydrophobicContact CG1-CG 3.96Å; V175-A192 HydrophobicContact CG1-CB 4.29Å; V175-A192 HydrophobicContact CG2-CB 3.77Å; V175-L193 HydrophobicContact CG1-CD2 4.27Å; V175-L193 HydrophobicContact CG1-CG 4.15Å |
| 176 | F | 92.6 | Very high | 94.1 | Very high | 133 Ų | 133 | 59.7 Ų | 59.7 | 58% | 0.583 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -100.8 | -15.8 | -174.6 | -72.6 | -62.9 | 0 | 0 | 0 | 115.2 | R172 L193 | R172-F176 PolarHBondContact O-N 2.94Å; F176-L193 HydrophobicContact CD2-CD2 3.99Å; F176-L193 HydrophobicContact CE1-CD1 3.85Å; F176-L193 HydrophobicContact CE2-CD1 3.6Å; F176-L193 HydrophobicContact CE2-CD2 3.24Å; F176-L193 HydrophobicContact CE2-CG 3.98Å; F176-L193 HydrophobicContact CZ-CD1 3.1Å; F176-L193 HydrophobicContact CZ-CD2 3.78Å; F176-L193 HydrophobicContact CZ-CG 3.99Å |
| 177 | G | 93.8 | Very high | 94 | Very high | 29 Ų | 29 | 63.8 Ų | 63.8 | 30% | 0.299 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -75.7 | -168.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | E173 V179 G180 G181 | E173-G177 VanDerWaalsContact O-CA 3.22Å; E173-G177 WeakPolarHBondContact O-CA 3.27Å; E173-G177 PolarHBondContact O-N 2.83Å; G177-V179 VanDerWaalsContact C-N 3.33Å; G177-V179 PolarHBondContact O-N 3.16Å; G177-G180 PolarHBondContact O-N 3.47Å; G177-G181 PolarHBondContact O-N 3.35Å |
| 178 | E | 94.3 | Very high | 93.7 | Very high | 165 Ų | 165 | 65.1 Ų | 65.1 | 77% | 0.771 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -59.6 | -43 | -178.2 | -174.2 | 174.2 | -170.9 | 0 | 0 | 112.2 | G180 G181 I182 | E178-G180 PolarHBondContact O-N 2.76Å; E178-G181 PolarHBondContact O-N 3.48Å; E178-I182 HydrophobicContact CG-CD1 4.36Å; E178-I182 WeakPolarHBondContact O-CG1 3.12Å; E178-I182 PolarHBondContact O-N 3.29Å |
| 179 | V | 95.6 | Very high | 93.6 | Very high | 22 Ų | 22 | 65.5 Ų | 65.5 | 13% | 0.133 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.3 | -48.8 | 178.9 | 175.5 | 0 | 0 | 0 | 0 | 110.9 | L139 F150 A154 L174 G177 G181 I182 A183 | L139-V179 HydrophobicContact CB-CG1 4.27Å; L139-V179 HydrophobicContact CD2-CG1 4.18Å; F150-V179 HydrophobicContact CE1-CG1 4.19Å; F150-V179 HydrophobicContact CZ-CG1 3.93Å; A154-V179 HydrophobicContact CB-CG1 4.44Å; L174-V179 HydrophobicContact CD1-CB 4.08Å; L174-V179 HydrophobicContact CD1-CG1 3.6Å; L174-V179 HydrophobicContact CG-CG1 4.45Å; G177-V179 VanDerWaalsContact C-N 3.33Å; G177-V179 PolarHBondContact O-N 3.16Å; V179-G181 VanDerWaalsContact C-N 3.32Å; V179-G181 PolarHBondContact O-N 2.75Å; V179-I182 PolarHBondContact O-N 3.36Å; V179-I182 VanDerWaalsContact O-N 3.13Å; V179-A183 VanDerWaalsContact O-CB 3.22Å; V179-A183 WeakPolarHBondContact O-CB 3.24Å; V179-A183 PolarHBondContact O-N 2.81Å |
| 180 | G | 93.9 | Very high | 93.3 | Very high | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67.4 | -31.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L174 V175 G177 E178 I182 A183 F184 K189 | L174-G180 WeakPolarHBondContact O-CA 3.48Å; L174-G180 PolarHBondContact O-N 3.23Å; V175-G180 WeakPolarHBondContact O-CA 3.36Å; G177-G180 PolarHBondContact O-N 3.47Å; E178-G180 PolarHBondContact O-N 2.76Å; G180-I182 PolarHBondContact O-N 3.05Å; G180-A183 PolarHBondContact O-N 2.94Å; G180-F184 PolarHBondContact O-N 3.5Å; G180-K189 VanDerWaalsContact O-CE 3.22Å; G180-K189 WeakPolarHBondContact O-CE 3.12Å |
| 181 | G | 94.2 | Very high | 93 | Very high | 49 Ų | 49 | 65.9 Ų | 65.9 | 51% | 0.505 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -59.7 | -31 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | G177 E178 V179 | G177-G181 PolarHBondContact O-N 3.35Å; E178-G181 PolarHBondContact O-N 3.48Å; V179-G181 VanDerWaalsContact C-N 3.32Å; V179-G181 PolarHBondContact O-N 2.75Å |
| 182 | I | 94.8 | Very high | 92.5 | Very high | 94 Ų | 94 | 66.3 Ų | 66.3 | 48% | 0.482 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -90.7 | -40 | 177.7 | -59.1 | 165 | 0 | 0 | 0 | 111.1 | G145 F150 E178 V179 G180 | G145-I182 WeakPolarHBondContact O-CG2 3.48Å; F150-I182 HydrophobicContact CD1-CG2 3.96Å; F150-I182 HydrophobicContact CE1-CB 4.03Å; F150-I182 HydrophobicContact CE1-CG2 3.84Å; E178-I182 HydrophobicContact CG-CD1 4.36Å; E178-I182 WeakPolarHBondContact O-CG1 3.12Å; E178-I182 PolarHBondContact O-N 3.29Å; V179-I182 PolarHBondContact O-N 3.36Å; V179-I182 VanDerWaalsContact O-N 3.13Å; G180-I182 PolarHBondContact O-N 3.05Å |
| 183 | A | 94.3 | Very high | 92.1 | Very high | 13 Ų | 13 | 63.6 Ų | 63.6 | 11% | 0.107 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -80.8 | -32.1 | -169.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | F150 A154 V179 G180 | F150-A183 HydrophobicContact CD1-CB 4.12Å; F150-A183 HydrophobicContact CE1-CB 3.95Å; A154-A183 HydrophobicContact CB-CB 3.55Å; V179-A183 VanDerWaalsContact O-CB 3.22Å; V179-A183 WeakPolarHBondContact O-CB 3.24Å; V179-A183 PolarHBondContact O-N 2.81Å; G180-A183 PolarHBondContact O-N 2.94Å |
| 184 | F | 93.3 | Very high | 91.7 | Very high | 17 Ų | 17 | 60.2 Ų | 60.2 | 8% | 0.075 | 33% | 0.326 | C | S | . | . | trans | -125.8 | 141.8 | -165.6 | -54.9 | -55.1 | 0 | 0 | 0 | 113 | A154 E155 G180 Q188 K189 | A154-F184 HydrophobicContact CB-CE1 4.24Å; A154-F184 HydrophobicContact CB-CE2 4.35Å; A154-F184 HydrophobicContact CB-CZ 3.72Å; E155-F184 HydrophobicContact CB-CE1 4.09Å; G180-F184 PolarHBondContact O-N 3.5Å; F184-Q188 HydrophobicContact CB-CB 4.03Å; F184-Q188 HydrophobicContact CD1-CB 4.42Å; F184-K189 HydrophobicContact CB-CG 3.7Å | ||
| 185 | T | 92.6 | Very high | 91.2 | Very high | 79 Ų | 79 | 62.4 Ų | 62.4 | 49% | 0.485 | 34% | 0.337 | S | S | . | . | trans | -72.4 | 161.6 | 163.7 | 69.5 | 0 | 0 | 0 | 0 | 110.8 | D187 Q188 K189 | T185-D187 VanDerWaalsContact C-N 3.26Å; T185-D187 PolarHBondContact O-N 3.44Å; T185-Q188 WeakPolarHBondContact O-CB 3.37Å; T185-Q188 PolarHBondContact O-N 2.92Å; T185-Q188 WeakPolarHBondContact OG1-CG 3.36Å; T185-Q188 PolarHBondContact OG1-N 2.95Å; T185-Q188 PolarHBondContact OG1-OE1 3.04Å; T185-K189 WeakPolarHBondContact O-CG 3.38Å; T185-K189 PolarHBondContact O-N 3.46Å | ||
| 186 | E | 90.9 | Very high | 90.8 | Very high | 130 Ų | 130 | 62.4 Ų | 62.4 | 61% | 0.607 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -56.9 | -39.5 | 177.7 | -65.1 | -55.8 | 121.6 | 0 | 0 | 112.6 | Q188 K189 Q190 | E186-Q188 VanDerWaalsContact C-N 3.34Å; E186-Q188 PolarHBondContact O-N 3.38Å; E186-K189 PolarHBondContact O-N 3.09Å; E186-K189 IonicContact OE1-NZ 3.54Å; E186-K189 PolarHBondContact OE1-NZ 3.4Å; E186-Q190 PolarHBondContact O-N 3.22Å |
| 187 | D | 90.3 | Very high | 90.5 | Very high | 131 Ų | 131 | 60.3 Ų | 60.3 | 70% | 0.701 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -63.4 | -39.1 | 175.2 | -62.4 | -22.5 | 0 | 0 | 0 | 112.3 | T185 T191 | T185-D187 VanDerWaalsContact C-N 3.26Å; T185-D187 PolarHBondContact O-N 3.44Å; D187-T191 PolarHBondContact O-N 3.01Å; D187-T191 VanDerWaalsContact O-N 3.09Å; D187-T191 PolarHBondContact O-OG1 2.9Å |
| 188 | Q | 89.5 | Confident | 90.1 | Very high | 81 Ų | 81 | 63.6 Ų | 63.6 | 38% | 0.379 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -68.5 | -37.6 | 176 | -74.1 | 176.6 | -42.9 | 0 | 0 | 111.6 | F184 T185 E186 T191 A192 | F184-Q188 HydrophobicContact CB-CB 4.03Å; F184-Q188 HydrophobicContact CD1-CB 4.42Å; T185-Q188 WeakPolarHBondContact O-CB 3.37Å; T185-Q188 PolarHBondContact O-N 2.92Å; T185-Q188 WeakPolarHBondContact OG1-CG 3.36Å; T185-Q188 PolarHBondContact OG1-N 2.95Å; T185-Q188 PolarHBondContact OG1-OE1 3.04Å; E186-Q188 VanDerWaalsContact C-N 3.34Å; E186-Q188 PolarHBondContact O-N 3.38Å; Q188-T191 PolarHBondContact O-N 3.39Å; Q188-A192 VanDerWaalsContact O-CB 3.26Å; Q188-A192 WeakPolarHBondContact O-CB 3.27Å; Q188-A192 PolarHBondContact O-N 3.11Å |
| 189 | K | 88.9 | Confident | 89.6 | Confident | 23 Ų | 23 | 59.5 Ų | 59.5 | 10% | 0.1 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.3 | -45.8 | 175.1 | -67.9 | 177.7 | -172.6 | 166.4 | 0 | 111.2 | V175 G180 F184 T185 E186 T191 A192 L193 | V175-K189 HydrophobicContact CG1-CB 3.81Å; V175-K189 HydrophobicContact CG1-CG 3.96Å; G180-K189 VanDerWaalsContact O-CE 3.22Å; G180-K189 WeakPolarHBondContact O-CE 3.12Å; F184-K189 HydrophobicContact CB-CG 3.7Å; T185-K189 WeakPolarHBondContact O-CG 3.38Å; T185-K189 PolarHBondContact O-N 3.46Å; E186-K189 PolarHBondContact O-N 3.09Å; E186-K189 IonicContact OE1-NZ 3.54Å; E186-K189 PolarHBondContact OE1-NZ 3.4Å; K189-T191 VanDerWaalsContact C-N 3.35Å; K189-T191 PolarHBondContact O-N 3.46Å; K189-A192 WeakPolarHBondContact O-CB 3.36Å; K189-A192 PolarHBondContact O-N 3.2Å; K189-L193 VanDerWaalsContact O-CG 3.27Å; K189-L193 WeakPolarHBondContact O-CG 3.48Å; K189-L193 PolarHBondContact O-N 2.72Å |
| 190 | Q | 88.4 | Confident | 89 | Confident | 106 Ų | 106 | 61 Ų | 61 | 50% | 0.495 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -60.9 | -46.2 | 176.7 | -172.1 | 59.6 | 53.5 | 0 | 0 | 111.3 | E186 A192 L193 D194 | E186-Q190 PolarHBondContact O-N 3.22Å; Q190-A192 VanDerWaalsContact C-N 3.3Å; Q190-A192 PolarHBondContact O-N 2.87Å; Q190-L193 PolarHBondContact O-N 3.34Å; Q190-D194 PolarHBondContact NE2-OD1 2.97Å; Q190-D194 VanDerWaalsContact O-CG 3.27Å; Q190-D194 PolarHBondContact O-N 3.01Å |
| 191 | T | 88.9 | Confident | 88.5 | Confident | 83 Ų | 83 | 64.6 Ų | 64.6 | 51% | 0.509 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59.8 | -41.7 | 177.2 | -54.5 | 0 | 0 | 0 | 0 | 111.8 | D187 Q188 K189 L193 D194 I195 | D187-T191 PolarHBondContact O-N 3.01Å; D187-T191 VanDerWaalsContact O-N 3.09Å; D187-T191 PolarHBondContact O-OG1 2.9Å; Q188-T191 PolarHBondContact O-N 3.39Å; K189-T191 VanDerWaalsContact C-N 3.35Å; K189-T191 PolarHBondContact O-N 3.46Å; T191-L193 VanDerWaalsContact C-N 3.35Å; T191-D194 PolarHBondContact O-N 3.29Å; T191-I195 HydrophobicContact CG2-CD1 4.35Å; T191-I195 WeakPolarHBondContact O-CG1 3.35Å; T191-I195 PolarHBondContact O-N 3.08Å |
| 192 | A | 85 | Confident | 87.8 | Confident | 9 Ų | 9 | 68 Ų | 68 | 7% | 0.074 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L158 V175 Q188 K189 Q190 I195 V196 | L158-A192 HydrophobicContact CD2-CB 3.67Å; V175-A192 HydrophobicContact CG1-CB 4.29Å; V175-A192 HydrophobicContact CG2-CB 3.77Å; Q188-A192 VanDerWaalsContact O-CB 3.26Å; Q188-A192 WeakPolarHBondContact O-CB 3.27Å; Q188-A192 PolarHBondContact O-N 3.11Å; K189-A192 WeakPolarHBondContact O-CB 3.36Å; K189-A192 PolarHBondContact O-N 3.2Å; Q190-A192 VanDerWaalsContact C-N 3.3Å; Q190-A192 PolarHBondContact O-N 2.87Å; A192-I195 PolarHBondContact O-N 3.12Å; A192-V196 WeakPolarHBondContact O-CG2 3.48Å; A192-V196 PolarHBondContact O-N 3.43Å; A192-V196 VanDerWaalsContact O-N 3.07Å |
| 193 | L | 86.6 | Confident | 86.9 | Confident | 12 Ų | 12 | 67 Ų | 67 | 6% | 0.063 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -67.1 | -44.4 | 177.2 | -67.9 | 162.3 | 0 | 0 | 0 | 112.3 | R172 V175 F176 K189 Q190 T191 I195 V196 E197 | R172-L193 HydrophobicContact CG-CD2 4.39Å; V175-L193 HydrophobicContact CG1-CD2 4.27Å; V175-L193 HydrophobicContact CG1-CG 4.15Å; F176-L193 HydrophobicContact CD2-CD2 3.99Å; F176-L193 HydrophobicContact CE1-CD1 3.85Å; F176-L193 HydrophobicContact CE2-CD1 3.6Å; F176-L193 HydrophobicContact CE2-CD2 3.24Å; F176-L193 HydrophobicContact CE2-CG 3.98Å; F176-L193 HydrophobicContact CZ-CD1 3.1Å; F176-L193 HydrophobicContact CZ-CD2 3.78Å; F176-L193 HydrophobicContact CZ-CG 3.99Å; K189-L193 VanDerWaalsContact O-CG 3.27Å; K189-L193 WeakPolarHBondContact O-CG 3.48Å; K189-L193 PolarHBondContact O-N 2.72Å; Q190-L193 PolarHBondContact O-N 3.34Å; T191-L193 VanDerWaalsContact C-N 3.35Å; L193-I195 PolarHBondContact O-N 2.92Å; L193-V196 PolarHBondContact O-N 2.83Å; L193-E197 WeakPolarHBondContact O-CB 3.35Å; L193-E197 WeakPolarHBondContact O-CG 3.35Å; L193-E197 PolarHBondContact O-N 3.2Å |
| 194 | D | 87.1 | Confident | 85.5 | Confident | 70 Ų | 70 | 73 Ų | 73 | 37% | 0.374 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -56.6 | -38.8 | 176.9 | -62.5 | -9.5 | 0 | 0 | 0 | 110.2 | Q190 T191 N198 | Q190-D194 PolarHBondContact NE2-OD1 2.97Å; Q190-D194 VanDerWaalsContact O-CG 3.27Å; Q190-D194 PolarHBondContact O-N 3.01Å; T191-D194 PolarHBondContact O-N 3.29Å; D194-N198 WeakPolarHBondContact O-CB 3.41Å; D194-N198 PolarHBondContact O-N 3.29Å; D194-N198 PolarHBondContact O-ND2 3.38Å |
| 195 | I | 86 | Confident | 84.1 | Confident | 65 Ų | 65 | 80 Ų | 80 | 33% | 0.333 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.3 | -46.4 | 175.6 | -67 | 166.3 | 0 | 0 | 0 | 111.5 | L159 V163 T191 A192 L193 K199 | L159-I195 HydrophobicContact CD2-CD1 3.92Å; L159-I195 HydrophobicContact CD2-CG2 4.11Å; V163-I195 HydrophobicContact CG1-CG2 4.46Å; T191-I195 HydrophobicContact CG2-CD1 4.35Å; T191-I195 WeakPolarHBondContact O-CG1 3.35Å; T191-I195 PolarHBondContact O-N 3.08Å; A192-I195 PolarHBondContact O-N 3.12Å; L193-I195 PolarHBondContact O-N 2.92Å; I195-K199 WeakPolarHBondContact O-CB 3.41Å; I195-K199 PolarHBondContact O-N 3.38Å; I195-K199 VanDerWaalsContact O-N 3.11Å |
| 196 | V | 85.9 | Confident | 82 | Confident | 0 Ų | 0 | 83.4 Ų | 83.4 | 0% | 0 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -63.3 | -46.8 | 179.9 | 171 | 0 | 0 | 0 | 0 | 111 | L158 V163 M168 A171 R172 A192 L193 K199 E200 | L158-V196 HydrophobicContact CD1-CG2 4.24Å; V163-V196 HydrophobicContact CG2-CG2 3.91Å; M168-V196 HydrophobicContact CB-CG1 4.39Å; M168-V196 HydrophobicContact SD-CG1 3.81Å; A171-V196 HydrophobicContact CB-CG1 4.34Å; A171-V196 HydrophobicContact CB-CG2 3.85Å; R172-V196 HydrophobicContact CG-CG1 4.07Å; A192-V196 WeakPolarHBondContact O-CG2 3.48Å; A192-V196 PolarHBondContact O-N 3.43Å; A192-V196 VanDerWaalsContact O-N 3.07Å; L193-V196 PolarHBondContact O-N 2.83Å; V196-K199 PolarHBondContact O-N 2.92Å; V196-E200 PolarHBondContact O-N 3.05Å |
| 197 | E | 86.5 | Confident | 79.9 | Confident | 88 Ų | 88 | 82.1 Ų | 82.1 | 41% | 0.411 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66.4 | -44.6 | 179.9 | -71.2 | -178.1 | -179.5 | 0 | 0 | 112 | L193 K199 E200 N201 | L193-E197 WeakPolarHBondContact O-CB 3.35Å; L193-E197 WeakPolarHBondContact O-CG 3.35Å; L193-E197 PolarHBondContact O-N 3.2Å; E197-K199 VanDerWaalsContact C-N 3.27Å; E197-K199 PolarHBondContact O-N 3.39Å; E197-E200 PolarHBondContact O-N 3.44Å; E197-N201 VanDerWaalsContact O-CG 3.24Å; E197-N201 PolarHBondContact O-N 2.77Å; E197-N201 PolarHBondContact O-ND2 3Å |
| 198 | N | 85.7 | Confident | 77.8 | Confident | 98 Ų | 98 | 82 Ų | 82 | 52% | 0.524 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -59.8 | -40 | 176.7 | -74.1 | -29.8 | 0 | 0 | 0 | 111.8 | D194 L202 | D194-N198 WeakPolarHBondContact O-CB 3.41Å; D194-N198 PolarHBondContact O-N 3.29Å; D194-N198 PolarHBondContact O-ND2 3.38Å; N198-L202 WeakPolarHBondContact O-CB 3.37Å; N198-L202 WeakPolarHBondContact O-CD1 3.43Å; N198-L202 VanDerWaalsContact O-CG 3.25Å; N198-L202 WeakPolarHBondContact O-CG 3.42Å; N198-L202 PolarHBondContact O-N 3.14Å; N198-L202 VanDerWaalsContact O-N 3.12Å |
| 199 | K | 84 | Confident | 75.6 | Confident | 79 Ų | 79 | 83.2 Ų | 83.2 | 34% | 0.343 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -67.4 | -40.5 | 177.4 | -169 | 101.5 | 169.8 | -166.8 | 0 | 112.1 | V163 M168 I195 V196 E197 S203 | V163-K199 HydrophobicContact CG1-CB 4.14Å; V163-K199 HydrophobicContact CG1-CD 3.48Å; V163-K199 VanDerWaalsContact CG1-CD 3.48Å; V163-K199 HydrophobicContact CG1-CG 3.79Å; V163-K199 VanDerWaalsContact O-CE 3.25Å; V163-K199 WeakPolarHBondContact O-CE 3.42Å; M168-K199 HydrophobicContact CE-CB 4.44Å; M168-K199 HydrophobicContact CE-CG 3.93Å; M168-K199 HydrophobicContact SD-CB 4.45Å; I195-K199 WeakPolarHBondContact O-CB 3.41Å; I195-K199 PolarHBondContact O-N 3.38Å; I195-K199 VanDerWaalsContact O-N 3.11Å; V196-K199 PolarHBondContact O-N 2.92Å; E197-K199 VanDerWaalsContact C-N 3.27Å; E197-K199 PolarHBondContact O-N 3.39Å; K199-S203 WeakPolarHBondContact O-CB 3.45Å; K199-S203 PolarHBondContact O-N 2.95Å; K199-S203 PolarHBondContact O-OG 3.23Å |
| 200 | E | 82.4 | Confident | 73.6 | Confident | 53 Ų | 53 | 88 Ų | 88 | 25% | 0.248 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -65.2 | -45.2 | 177.6 | -174.7 | 176.4 | -135.7 | 0 | 0 | 111.7 | M168 R172 V196 E197 L202 S203 Q204 | M168-E200 HydrophobicContact CG-CB 4.32Å; R172-E200 IonicContact CZ-OE2 2.96Å; R172-E200 IonicContact NH1-OE2 2.64Å; R172-E200 IonicContact NH2-OE1 2.62Å; R172-E200 PolarHBondContact NH2-OE1 3.19Å; R172-E200 IonicContact NH2-OE2 3.53Å; R172-E200 PolarHBondContact NH2-OE2 3.34Å; V196-E200 PolarHBondContact O-N 3.05Å; E197-E200 PolarHBondContact O-N 3.44Å; E200-L202 PolarHBondContact O-N 3.07Å; E200-S203 WeakPolarHBondContact O-CB 3.26Å; E200-S203 PolarHBondContact O-N 3.38Å; E200-S203 VanDerWaalsContact O-N 3.08Å; E200-Q204 WeakPolarHBondContact O-CG 3.35Å; E200-Q204 PolarHBondContact O-N 2.91Å |
| 201 | N | 82.4 | Confident | 71.2 | Confident | 77 Ų | 77 | 90.3 Ų | 90.3 | 41% | 0.412 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.4 | -45.7 | 176.3 | -68 | -29.5 | 0 | 0 | 0 | 111.5 | E197 S203 Q204 E205 | E197-N201 VanDerWaalsContact O-CG 3.24Å; E197-N201 PolarHBondContact O-N 2.77Å; E197-N201 PolarHBondContact O-ND2 3Å; N201-S203 VanDerWaalsContact C-N 3.25Å; N201-S203 PolarHBondContact O-N 2.86Å; N201-Q204 PolarHBondContact O-N 3.43Å; N201-Q204 VanDerWaalsContact O-N 3.16Å; N201-E205 PolarHBondContact O-N 3.46Å |
| 202 | L | 80.9 | Confident | 69.1 | Low | 120 Ų | 120 | 91.2 Ų | 91.2 | 63% | 0.628 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.6 | -35.4 | 174.7 | -75.5 | 164.2 | 0 | 0 | 0 | 112.7 | N198 E200 | N198-L202 WeakPolarHBondContact O-CB 3.37Å; N198-L202 WeakPolarHBondContact O-CD1 3.43Å; N198-L202 VanDerWaalsContact O-CG 3.25Å; N198-L202 WeakPolarHBondContact O-CG 3.42Å; N198-L202 PolarHBondContact O-N 3.14Å; N198-L202 VanDerWaalsContact O-N 3.12Å; E200-L202 PolarHBondContact O-N 3.07Å |
| 203 | S | 74.4 | Confident | 66.7 | Low | 74 Ų | 74 | 98.3 Ų | 98.3 | 52% | 0.517 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -75.4 | -29.8 | 178.9 | -54.5 | 0 | 0 | 0 | 0 | 112.2 | K199 E200 N201 | K199-S203 WeakPolarHBondContact O-CB 3.45Å; K199-S203 PolarHBondContact O-N 2.95Å; K199-S203 PolarHBondContact O-OG 3.23Å; E200-S203 WeakPolarHBondContact O-CB 3.26Å; E200-S203 PolarHBondContact O-N 3.38Å; E200-S203 VanDerWaalsContact O-N 3.08Å; N201-S203 VanDerWaalsContact C-N 3.25Å; N201-S203 PolarHBondContact O-N 2.86Å |
| 204 | Q | 66.7 | Low | 64.1 | Low | 139 Ų | 139 | 104.4 Ų | 104.4 | 65% | 0.65 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -80.2 | -31 | 176.2 | -71.5 | -177.9 | 10.6 | 0 | 0 | 113.3 | E200 N201 Q206 | E200-Q204 WeakPolarHBondContact O-CG 3.35Å; E200-Q204 PolarHBondContact O-N 2.91Å; N201-Q204 PolarHBondContact O-N 3.43Å; N201-Q204 VanDerWaalsContact O-N 3.16Å; Q204-Q206 PolarHBondContact O-N 2.88Å |
| 205 | E | 63.1 | Low | 61.5 | Low | 164 Ų | 164 | 106.1 Ų | 106.1 | 77% | 0.766 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -74.3 | -10.6 | 175.5 | -93.7 | 179.8 | 96.9 | 0 | 0 | 113.8 | N201 P207 | N201-E205 PolarHBondContact O-N 3.46Å; E205-P207 VanDerWaalsContact O-CD 3.26Å; E205-P207 WeakPolarHBondContact O-CD 3.27Å |
| 206 | Q | 48.3 | Very low | 59.2 | Low | 150 Ų | 150 | 109 Ų | 109 | 70% | 0.701 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -80.5 | 111.9 | 175.2 | -164.6 | 163.6 | -18.3 | 0 | 0 | 109.9 | Q204 | Q204-Q206 PolarHBondContact O-N 2.88Š|
| 207 | P | 46.1 | Very low | 56.6 | Low | 102 Ų | 102 | 115.2 Ų | 115.2 | 66% | 0.662 | 66% | 0.656 | S | S | * | * | trans | -64.6 | 150.5 | -179 | 25.2 | -32.4 | 0 | 0 | 0 | 111.1 | E205 S209 | E205-P207 VanDerWaalsContact O-CD 3.26Å; E205-P207 WeakPolarHBondContact O-CD 3.27Å; P207-S209 PolarHBondContact O-N 2.92Å | ||
| 208 | P | 46 | Very low | 54.2 | Low | 129 Ų | 129 | 116.8 Ų | 116.8 | 84% | 0.838 | 67% | 0.672 | S | S | * | * | trans | -64.6 | 109 | 175.5 | 26.4 | -31.3 | 0 | 0 | 0 | 108.6 | ||||
| 209 | S | 44 | Very low | 51.5 | Low | 107 Ų | 107 | 118.1 Ų | 118.1 | 75% | 0.748 | 68% | 0.683 | S | S | * | * | trans | -70.9 | 138.3 | 176.1 | 59.3 | 0 | 0 | 0 | 0 | 110.1 | P207 N211 | P207-S209 PolarHBondContact O-N 2.92Å; S209-N211 PolarHBondContact O-N 3.46Å | ||
| 210 | P | 48 | Very low | 49.4 | Very low | 122 Ų | 122 | 120.6 Ų | 120.6 | 79% | 0.792 | 71% | 0.705 | S | S | * | * | trans | -81.4 | 118.2 | 174.4 | 30.8 | -29.8 | 0 | 0 | 0 | 110.6 | ||||
| 211 | N | 36.7 | Very low | 46.8 | Very low | 155 Ų | 155 | 122.1 Ų | 122.1 | 83% | 0.829 | 73% | 0.726 | S | S | * | * | trans | 68 | 144.6 | 160.1 | -81.8 | -14.6 | 0 | 0 | 0 | 121.6 | S209 | S209-N211 PolarHBondContact O-N 3.46Š| ||
| 212 | P | 45.7 | Very low | 44.6 | Very low | 103 Ų | 103 | 121.6 Ų | 121.6 | 67% | 0.669 | 74% | 0.739 | S | S | * | * | trans | -87.7 | 123 | -178.1 | 35.5 | -28.1 | 0 | 0 | 0 | 109 | ||||
| 213 | N | 34 | Very low | 42.1 | Very low | 157 Ų | 157 | 123.8 Ų | 123.8 | 84% | 0.84 | 75% | 0.75 | S | S | * | * | trans | 164.7 | 85 | 151.3 | -84.4 | -19.6 | 0 | 0 | 0 | 107.6 | ||||
| 214 | T | 31.7 | Very low | 40.1 | Very low | 141 Ų | 141 | 127.7 Ų | 127.7 | 87% | 0.865 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -168.8 | 127.9 | 144.8 | -66 | 0 | 0 | 0 | 0 | 106.7 | ||
| 215 | S | 33.7 | Very low | 38.6 | Very low | 106 Ų | 106 | 126.1 Ų | 126.1 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | trans | -49 | 143 | 179 | -62.2 | 0 | 0 | 0 | 0 | 112.8 | V217 | S215-V217 PolarHBondContact O-N 3.47Å; S215-V217 VanDerWaalsContact O-N 3.15Å | ||
| 216 | P | 37.4 | Very low | 37.5 | Very low | 124 Ų | 124 | 123.4 Ų | 123.4 | 81% | 0.805 | 76% | 0.762 | S | S | * | * | trans | -76 | 110.1 | 178.8 | 29.5 | -30.8 | 0 | 0 | 0 | 110.1 | V218 | P216-V218 PolarHBondContact O-N 2.93Š| ||
| 217 | V | 30.1 | Very low | 37.3 | Very low | 131 Ų | 131 | 122.7 Ų | 122.7 | 79% | 0.794 | 76% | 0.759 | S | S | * | * | trans | -70 | 118.1 | 153.1 | 169 | 0 | 0 | 0 | 0 | 106.6 | S215 V219 | S215-V217 PolarHBondContact O-N 3.47Å; S215-V217 VanDerWaalsContact O-N 3.15Å; V217-V219 PolarHBondContact O-N 3.31Å; V217-V219 VanDerWaalsContact O-N 3.15Å | ||
| 218 | V | 36.2 | Very low | 37.2 | Very low | 122 Ų | 122 | 120 Ų | 120 | 74% | 0.739 | 75% | 0.749 | S | S | * | * | trans | -59.4 | 110.5 | 177.2 | 174.5 | 0 | 0 | 0 | 0 | 109.5 | P216 V220 | P216-V218 PolarHBondContact O-N 2.93Å; V218-V220 HydrophobicContact CG1-CG2 3.79Å | ||
| 219 | V | 30.6 | Very low | 37.1 | Very low | 125 Ų | 125 | 117 Ų | 117 | 76% | 0.758 | 74% | 0.736 | S | S | * | * | trans | -106.7 | 99.4 | 163 | -179 | 0 | 0 | 0 | 0 | 107.1 | V217 A221 | V217-V219 PolarHBondContact O-N 3.31Å; V217-V219 VanDerWaalsContact O-N 3.15Å; V219-A221 PolarHBondContact O-N 3Å | ||
| 220 | V | 38.4 | Very low | 37.5 | Very low | 131 Ų | 131 | 116.9 Ų | 116.9 | 79% | 0.794 | 73% | 0.73 | S | S | * | * | trans | -69.6 | 103.5 | 167.5 | 176.9 | 0 | 0 | 0 | 0 | 107.3 | V218 | V218-V220 HydrophobicContact CG1-CG2 3.79Š| ||
| 221 | A | 28.8 | Very low | 37.9 | Very low | 85 Ų | 85 | 115.6 Ų | 115.6 | 70% | 0.702 | 72% | 0.716 | S | S | * | * | trans | -110.9 | 123.1 | 166.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | V219 L223 | V219-A221 PolarHBondContact O-N 3Å; A221-L223 PolarHBondContact O-N 3.46Å | ||
| 222 | G | 35.2 | Very low | 38.7 | Very low | 66 Ų | 66 | 114.9 Ų | 114.9 | 68% | 0.68 | 71% | 0.707 | S | S | * | * | trans | -53.4 | 123.6 | -164.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | N224 | G222-N224 PolarHBondContact O-N 2.89Š| ||
| 223 | L | 28.4 | Very low | 39.1 | Very low | 166 Ų | 166 | 117.7 Ų | 117.7 | 87% | 0.869 | 71% | 0.709 | S | S | * | * | trans | -85.3 | 104.1 | 158.6 | -166.2 | 70.6 | 0 | 0 | 0 | 107.1 | A221 T225 | A221-L223 PolarHBondContact O-N 3.46Å; L223-T225 PolarHBondContact O-N 3.42Å | ||
| 224 | N | 33.1 | Very low | 40.1 | Very low | 157 Ų | 157 | 113.1 Ų | 113.1 | 84% | 0.84 | 69% | 0.685 | S | S | * | * | trans | -61.4 | 107 | 176.5 | -65.6 | -31.8 | 0 | 0 | 0 | 109.1 | G222 | G222-N224 PolarHBondContact O-N 2.89Š| ||
| 225 | T | 34.2 | Very low | 41.5 | Very low | 106 Ų | 106 | 110.7 Ų | 110.7 | 65% | 0.65 | 66% | 0.663 | S | S | * | * | trans | -64.1 | 151.9 | 171.7 | -2.3 | 0 | 0 | 0 | 0 | 108.9 | L223 Q227 | L223-T225 PolarHBondContact O-N 3.42Å; T225-Q227 PolarHBondContact O-N 3.05Å | ||
| 226 | P | 41.7 | Very low | 42.9 | Very low | 106 Ų | 106 | 107.9 Ų | 107.9 | 69% | 0.688 | 65% | 0.646 | S | S | * | * | trans | -72.9 | 71.7 | 178.1 | 31.4 | -34.1 | 0 | 0 | 0 | 110.5 | G228 | P226-G228 PolarHBondContact O-N 2.86Š| ||
| 227 | Q | 43.4 | Very low | 44.2 | Very low | 135 Ų | 135 | 107 Ų | 107 | 63% | 0.631 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -65.1 | -22.9 | 177 | -103.6 | 172.8 | -8.6 | 0 | 0 | 112 | T225 I231 | T225-Q227 PolarHBondContact O-N 3.05Å; Q227-I231 HydrophobicContact CB-CD1 4.02Å; Q227-I231 HydrophobicContact CG-CD1 4.47Å; Q227-I231 WeakPolarHBondContact O-CB 3.37Å; Q227-I231 VanDerWaalsContact O-CD1 3.24Å; Q227-I231 WeakPolarHBondContact O-CD1 3.36Å; Q227-I231 WeakPolarHBondContact O-CG1 3.28Å; Q227-I231 PolarHBondContact O-N 3.16Å |
| 228 | G | 44 | Very low | 45.9 | Very low | 45 Ų | 45 | 104.9 Ų | 104.9 | 46% | 0.464 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -65.5 | -42.3 | -175.7 | 0 | 0 | 0 | 0 | 0 | 115 | P226 Q232 | P226-G228 PolarHBondContact O-N 2.86Å; G228-Q232 VanDerWaalsContact O-CG 3.3Å; G228-Q232 WeakPolarHBondContact O-CG 3.44Å; G228-Q232 PolarHBondContact O-N 3.37Å; G228-Q232 VanDerWaalsContact O-N 3.13Å |
| 229 | A | 44.4 | Very low | 47.3 | Very low | 67 Ų | 67 | 106.4 Ų | 106.4 | 55% | 0.554 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -74.3 | -33.6 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | K233 | A229-K233 PolarHBondContact O-N 2.9Å; A229-K233 VanDerWaalsContact O-N 3.14Å |
| 230 | V | 52.1 | Low | 48.9 | Very low | 104 Ų | 104 | 105.5 Ų | 105.5 | 63% | 0.63 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -73.1 | -41.1 | 177.4 | -177.4 | 0 | 0 | 0 | 0 | 110.5 | Q232 K233 L234 | V230-Q232 PolarHBondContact O-N 2.77Å; V230-K233 PolarHBondContact O-N 3.23Å; V230-L234 WeakPolarHBondContact O-CB 3.5Å; V230-L234 PolarHBondContact O-N 2.84Å |
| 231 | I | 56.2 | Low | 50 | Low | 96 Ų | 96 | 104.3 Ų | 104.3 | 49% | 0.492 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.4 | -39.7 | 177 | -68.3 | 166.2 | 0 | 0 | 0 | 110.9 | Q227 L234 E235 | Q227-I231 HydrophobicContact CB-CD1 4.02Å; Q227-I231 HydrophobicContact CG-CD1 4.47Å; Q227-I231 WeakPolarHBondContact O-CB 3.37Å; Q227-I231 VanDerWaalsContact O-CD1 3.24Å; Q227-I231 WeakPolarHBondContact O-CD1 3.36Å; Q227-I231 WeakPolarHBondContact O-CG1 3.28Å; Q227-I231 PolarHBondContact O-N 3.16Å; I231-L234 PolarHBondContact O-N 2.79Å; I231-E235 WeakPolarHBondContact O-CB 3.47Å; I231-E235 PolarHBondContact O-N 2.8Å |
| 232 | Q | 52.8 | Low | 51.4 | Low | 139 Ų | 139 | 104.4 Ų | 104.4 | 65% | 0.65 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -69.2 | -40.4 | 177.6 | -73.9 | 179.5 | 1.9 | 0 | 0 | 113.2 | G228 V230 L234 E235 A236 | G228-Q232 VanDerWaalsContact O-CG 3.3Å; G228-Q232 WeakPolarHBondContact O-CG 3.44Å; G228-Q232 PolarHBondContact O-N 3.37Å; G228-Q232 VanDerWaalsContact O-N 3.13Å; V230-Q232 PolarHBondContact O-N 2.77Å; Q232-L234 VanDerWaalsContact C-N 3.35Å; Q232-E235 PolarHBondContact O-N 3.48Å; Q232-A236 WeakPolarHBondContact O-CB 3.28Å; Q232-A236 PolarHBondContact O-N 3.43Å |
| 233 | K | 53.9 | Low | 52.7 | Low | 163 Ų | 163 | 110.1 Ų | 110.1 | 71% | 0.709 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66.9 | -36.8 | 172.8 | -87.4 | -160.5 | 173.2 | -178.2 | 0 | 112.3 | A229 V230 A236 L237 | A229-K233 PolarHBondContact O-N 2.9Å; A229-K233 VanDerWaalsContact O-N 3.14Å; V230-K233 PolarHBondContact O-N 3.23Å; K233-A236 PolarHBondContact O-N 3.37Å; K233-L237 WeakPolarHBondContact O-CG 3.46Å; K233-L237 PolarHBondContact O-N 3.36Å |
| 234 | L | 56.2 | Low | 54 | Low | 61 Ų | 61 | 104.7 Ų | 104.7 | 32% | 0.319 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.9 | -41.3 | 175.9 | -175.5 | 65.7 | 0 | 0 | 0 | 111.3 | V230 I231 Q232 L237 L238 F269 | V230-L234 WeakPolarHBondContact O-CB 3.5Å; V230-L234 PolarHBondContact O-N 2.84Å; I231-L234 PolarHBondContact O-N 2.79Å; Q232-L234 VanDerWaalsContact C-N 3.35Å; L234-L237 PolarHBondContact O-N 2.79Å; L234-L238 HydrophobicContact CG-CD1 4.24Å; L234-L238 WeakPolarHBondContact O-CB 3.29Å; L234-L238 PolarHBondContact O-N 3.39Å; L234-F269 HydrophobicContact CD1-CE2 4.34Å; L234-F269 HydrophobicContact CD1-CZ 3.86Å; L234-F269 HydrophobicContact CD2-CE1 4.4Å; L234-F269 HydrophobicContact CD2-CZ 3.74Å; L234-F269 HydrophobicContact CG-CZ 4.47Å |
| 235 | E | 61.1 | Low | 55 | Low | 89 Ų | 89 | 99.6 Ų | 99.6 | 42% | 0.416 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.7 | -39.7 | 176.4 | -164.8 | -178.4 | -167.7 | 0 | 0 | 111.8 | I231 Q232 L238 R239 | I231-E235 WeakPolarHBondContact O-CB 3.47Å; I231-E235 PolarHBondContact O-N 2.8Å; Q232-E235 PolarHBondContact O-N 3.48Å; E235-L238 PolarHBondContact O-N 3.46Å; E235-R239 WeakPolarHBondContact O-CG 3.48Å; E235-R239 PolarHBondContact O-N 3.27Å; E235-R239 IonicContact OE1-CZ 2.65Å; E235-R239 IonicContact OE1-NE 3.21Å; E235-R239 IonicContact OE1-NH2 3.13Å; E235-R239 PolarHBondContact OE1-NH2 2.77Å; E235-R239 IonicContact OE2-CZ 3.62Å; E235-R239 IonicContact OE2-NH2 2.98Å; E235-R239 PolarHBondContact OE2-NH2 2.82Å |
| 236 | A | 63 | Low | 55.9 | Low | 47 Ų | 47 | 99.6 Ų | 99.6 | 39% | 0.388 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q232 K233 R239 L240 | Q232-A236 WeakPolarHBondContact O-CB 3.28Å; Q232-A236 PolarHBondContact O-N 3.43Å; K233-A236 PolarHBondContact O-N 3.37Å; A236-R239 PolarHBondContact O-N 3.42Å; A236-L240 PolarHBondContact O-N 3.05Å |
| 237 | L | 63.5 | Low | 56.5 | Low | 106 Ų | 106 | 100.4 Ų | 100.4 | 56% | 0.555 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.2 | -40.2 | 175.3 | -76.6 | 167.9 | 0 | 0 | 0 | 112.2 | K233 L234 R239 L240 L241 | K233-L237 WeakPolarHBondContact O-CG 3.46Å; K233-L237 PolarHBondContact O-N 3.36Å; L234-L237 PolarHBondContact O-N 2.79Å; L237-R239 PolarHBondContact O-N 2.96Å; L237-L240 PolarHBondContact O-N 3.3Å; L237-L241 WeakPolarHBondContact O-CB 3.27Å; L237-L241 WeakPolarHBondContact O-CG 3.3Å; L237-L241 PolarHBondContact O-N 3.09Å |
| 238 | L | 65.7 | Low | 56.6 | Low | 87 Ų | 87 | 96 Ų | 96 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.1 | -40.9 | 174.4 | -102.9 | 149.4 | 0 | 0 | 0 | 112.1 | L234 E235 L241 N242 | L234-L238 HydrophobicContact CG-CD1 4.24Å; L234-L238 WeakPolarHBondContact O-CB 3.29Å; L234-L238 PolarHBondContact O-N 3.39Å; E235-L238 PolarHBondContact O-N 3.46Å; L238-L241 PolarHBondContact O-N 3.26Å; L238-N242 WeakPolarHBondContact O-CB 3.4Å; L238-N242 PolarHBondContact O-N 3.29Å |
| 239 | R | 66.9 | Low | 56.9 | Low | 154 Ų | 154 | 99.3 Ų | 99.3 | 58% | 0.581 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -67.1 | -38.2 | 175.5 | -72.7 | 179.8 | -165.7 | 144.9 | -3.9 | 112.1 | E235 A236 L237 R243 | E235-R239 WeakPolarHBondContact O-CG 3.48Å; E235-R239 PolarHBondContact O-N 3.27Å; E235-R239 IonicContact OE1-CZ 2.65Å; E235-R239 IonicContact OE1-NE 3.21Å; E235-R239 IonicContact OE1-NH2 3.13Å; E235-R239 PolarHBondContact OE1-NH2 2.77Å; E235-R239 IonicContact OE2-CZ 3.62Å; E235-R239 IonicContact OE2-NH2 2.98Å; E235-R239 PolarHBondContact OE2-NH2 2.82Å; A236-R239 PolarHBondContact O-N 3.42Å; L237-R239 PolarHBondContact O-N 2.96Å; R239-R243 VanDerWaalsContact O-CB 3.26Å; R239-R243 WeakPolarHBondContact O-CB 3.41Å; R239-R243 PolarHBondContact O-N 3.48Å |
| 240 | L | 63.5 | Low | 57.2 | Low | 105 Ų | 105 | 97.8 Ų | 97.8 | 55% | 0.55 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.3 | -42.1 | 175.2 | -98.4 | 144.8 | 0 | 0 | 0 | 112.3 | A236 L237 R243 G244 | A236-L240 PolarHBondContact O-N 3.05Å; L237-L240 PolarHBondContact O-N 3.3Å; L240-R243 PolarHBondContact O-N 3.43Å; L240-G244 PolarHBondContact O-N 3.11Å |
| 241 | L | 61.6 | Low | 57.5 | Low | 107 Ų | 107 | 95.4 Ų | 95.4 | 56% | 0.56 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -67.4 | -44.1 | 176.9 | -73.8 | 167.3 | 0 | 0 | 0 | 112.1 | L237 L238 R243 G244 L245 | L237-L241 WeakPolarHBondContact O-CB 3.27Å; L237-L241 WeakPolarHBondContact O-CG 3.3Å; L237-L241 PolarHBondContact O-N 3.09Å; L238-L241 PolarHBondContact O-N 3.26Å; L241-R243 VanDerWaalsContact C-N 3.31Å; L241-R243 PolarHBondContact O-N 2.87Å; L241-G244 PolarHBondContact O-N 3Å; L241-L245 PolarHBondContact O-N 3.04Å; L241-L245 VanDerWaalsContact O-N 3.09Å |
| 242 | N | 59.2 | Low | 57.4 | Low | 87 Ų | 87 | 98.1 Ų | 98.1 | 47% | 0.465 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64 | -36.4 | 175.6 | -80.8 | -17.9 | 0 | 0 | 0 | 112 | L238 L245 S246 | L238-N242 WeakPolarHBondContact O-CB 3.4Å; L238-N242 PolarHBondContact O-N 3.29Å; N242-L245 PolarHBondContact O-N 2.97Å; N242-S246 PolarHBondContact O-N 2.97Å |
| 243 | R | 61.9 | Low | 57.4 | Low | 186 Ų | 186 | 98.6 Ų | 98.6 | 70% | 0.702 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -69.1 | -34.6 | 176.7 | -161.4 | 169.3 | 78.5 | -172.1 | 5.4 | 112.7 | R239 L240 L241 L245 | R239-R243 VanDerWaalsContact O-CB 3.26Å; R239-R243 WeakPolarHBondContact O-CB 3.41Å; R239-R243 PolarHBondContact O-N 3.48Å; L240-R243 PolarHBondContact O-N 3.43Å; L241-R243 VanDerWaalsContact C-N 3.31Å; L241-R243 PolarHBondContact O-N 2.87Å; R243-L245 VanDerWaalsContact C-N 3.32Å |
| 244 | G | 55.9 | Low | 57.5 | Low | 51 Ų | 51 | 95.6 Ų | 95.6 | 53% | 0.526 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70.1 | -27.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | L240 L241 | L240-G244 PolarHBondContact O-N 3.11Å; L241-G244 PolarHBondContact O-N 3Å |
| 245 | L | 54.5 | Low | 57.6 | Low | 50 Ų | 50 | 99 Ų | 99 | 26% | 0.262 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -78.3 | -28 | -179.9 | -124 | 76.3 | 0 | 0 | 0 | 114 | L241 N242 R243 V247 F258 | L241-L245 PolarHBondContact O-N 3.04Å; L241-L245 VanDerWaalsContact O-N 3.09Å; N242-L245 PolarHBondContact O-N 2.97Å; R243-L245 VanDerWaalsContact C-N 3.32Å; L245-V247 VanDerWaalsContact C-N 3.26Å; L245-V247 PolarHBondContact O-N 3.22Å; L245-F258 HydrophobicContact CD2-CD2 3.73Å; L245-F258 HydrophobicContact CD2-CE1 4.37Å; L245-F258 HydrophobicContact CD2-CE2 3.02Å; L245-F258 HydrophobicContact CD2-CZ 3.39Å; L245-F258 HydrophobicContact CG-CE2 4.46Å |
| 246 | S | 52.9 | Low | 57.5 | Low | 106 Ų | 106 | 101.4 Ų | 101.4 | 74% | 0.741 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | -16.6 | 177.1 | -68 | 0 | 0 | 0 | 0 | 113.7 | N242 | N242-S246 PolarHBondContact O-N 2.97Š|
| 247 | V | 53.3 | Low | 57.7 | Low | 124 Ų | 124 | 106.6 Ų | 106.6 | 75% | 0.752 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.5 | -11.1 | -175.6 | 179.5 | 0 | 0 | 0 | 0 | 113.1 | L245 | L245-V247 VanDerWaalsContact C-N 3.26Å; L245-V247 PolarHBondContact O-N 3.22Å |
| 248 | A | 46.5 | Very low | 58.3 | Low | 43 Ų | 43 | 107 Ų | 107 | 36% | 0.355 | 57% | 0.568 | S | S | . | * | trans | -112.7 | 88.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | G250 | A248-G250 PolarHBondContact O-N 3.47Š| ||
| 249 | S | 48.6 | Very low | 58.8 | Low | 114 Ų | 114 | 110 Ų | 110 | 80% | 0.797 | 58% | 0.578 | S | S | * | * | trans | -75.1 | 88.6 | 171 | 49.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 250 | G | 51.5 | Low | 59.2 | Low | 34 Ų | 34 | 107.5 Ų | 107.5 | 35% | 0.351 | 58% | 0.575 | S | S | . | * | trans | -152.1 | 116.7 | 167.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | A248 L252 R254 | A248-G250 PolarHBondContact O-N 3.47Å; G250-L252 PolarHBondContact O-N 3.12Å; G250-R254 PolarHBondContact O-NE 3.4Å | ||
| 251 | G | 57.8 | Low | 60 | Low | 55 Ų | 55 | 104.6 Ų | 104.6 | 57% | 0.567 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | -23.7 | -163.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 252 | L | 54.4 | Low | 60.8 | Low | 153 Ų | 153 | 102.2 Ų | 102.2 | 80% | 0.801 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.2 | -31.3 | -173.6 | -122.7 | 69 | 0 | 0 | 0 | 114.3 | G250 R254 | G250-L252 PolarHBondContact O-N 3.12Å; L252-R254 PolarHBondContact O-N 2.99Å |
| 253 | F | 52.5 | Low | 61.5 | Low | 149 Ų | 149 | 100.8 Ų | 100.8 | 65% | 0.654 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -73.7 | -13.7 | 177.7 | -79.8 | -83.9 | 0 | 0 | 0 | 113.8 | R257 | F253-R257 WeakPolarHBondContact O-CG 3.29Å; F253-R257 PolarHBondContact O-N 2.96Å |
| 254 | R | 56.1 | Low | 62 | Low | 99 Ų | 99 | 96.7 Ų | 96.7 | 37% | 0.374 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -77.3 | -38.1 | -179.3 | -82.8 | -176.8 | -79.4 | -170.8 | 0.2 | 113.3 | G250 L252 R257 F258 | G250-R254 PolarHBondContact O-NE 3.4Å; L252-R254 PolarHBondContact O-N 2.99Å; R254-R257 PolarHBondContact O-N 3.09Å; R254-F258 WeakPolarHBondContact O-CB 3.27Å; R254-F258 PolarHBondContact O-N 2.76Å |
| 255 | L | 58.1 | Low | 63 | Low | 133 Ų | 133 | 98.3 Ų | 98.3 | 70% | 0.696 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -68.2 | -41.6 | 178.4 | -92.7 | 130.1 | 0 | 0 | 0 | 112.2 | R257 F258 F259 | L255-R257 VanDerWaalsContact C-N 3.33Å; L255-R257 PolarHBondContact O-N 3.33Å; L255-F258 PolarHBondContact O-N 2.89Å; L255-F259 WeakPolarHBondContact O-CB 3.4Å; L255-F259 PolarHBondContact O-N 3.35Å |
| 256 | Q | 61 | Low | 64 | Low | 139 Ų | 139 | 102.1 Ų | 102.1 | 65% | 0.65 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -66 | -36.7 | 177.3 | -166.9 | 178.1 | 3.6 | 0 | 0 | 111.9 | L260 | Q256-L260 VanDerWaalsContact O-CB 3.25Å; Q256-L260 WeakPolarHBondContact O-CB 3.41Å; Q256-L260 PolarHBondContact O-N 3.44Å |
| 257 | R | 65.8 | Low | 64.7 | Low | 156 Ų | 156 | 100.6 Ų | 100.6 | 59% | 0.589 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -71.2 | -37.8 | 174.3 | -75.6 | -178.3 | 178.5 | -178.2 | 1 | 112.7 | F253 R254 L255 A261 | F253-R257 WeakPolarHBondContact O-CG 3.29Å; F253-R257 PolarHBondContact O-N 2.96Å; R254-R257 PolarHBondContact O-N 3.09Å; L255-R257 VanDerWaalsContact C-N 3.33Å; L255-R257 PolarHBondContact O-N 3.33Å; R257-A261 WeakPolarHBondContact O-CB 3.08Å; R257-A261 PolarHBondContact O-N 2.83Å |
| 258 | F | 77.3 | Confident | 65.2 | Low | 116 Ų | 116 | 99.7 Ų | 99.7 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.4 | -42.9 | 172.6 | -103.4 | -70.8 | 0 | 0 | 0 | 111.8 | L245 R254 L255 A261 A262 | L245-F258 HydrophobicContact CD2-CD2 3.73Å; L245-F258 HydrophobicContact CD2-CE1 4.37Å; L245-F258 HydrophobicContact CD2-CE2 3.02Å; L245-F258 HydrophobicContact CD2-CZ 3.39Å; L245-F258 HydrophobicContact CG-CE2 4.46Å; R254-F258 WeakPolarHBondContact O-CB 3.27Å; R254-F258 PolarHBondContact O-N 2.76Å; L255-F258 PolarHBondContact O-N 2.89Å; F258-A261 PolarHBondContact O-N 2.84Å; F258-A262 WeakPolarHBondContact O-CB 3.23Å; F258-A262 PolarHBondContact O-N 3.47Å |
| 259 | F | 75.6 | Confident | 65.9 | Low | 150 Ų | 150 | 103.5 Ų | 103.5 | 66% | 0.658 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63 | -46.8 | 175.5 | -178.8 | -99.2 | 0 | 0 | 0 | 110.8 | L255 A261 A262 V263 | L255-F259 WeakPolarHBondContact O-CB 3.4Å; L255-F259 PolarHBondContact O-N 3.35Å; F259-A261 PolarHBondContact O-N 3.36Å; F259-A262 PolarHBondContact O-N 2.86Å; F259-V263 HydrophobicContact CD1-CG2 4.12Å; F259-V263 HydrophobicContact CE1-CG2 3.75Å; F259-V263 HydrophobicContact CE2-CG2 4.21Å; F259-V263 HydrophobicContact CZ-CG2 3.8Å; F259-V263 WeakPolarHBondContact O-CB 3.34Å; F259-V263 VanDerWaalsContact O-CG2 3.26Å; F259-V263 WeakPolarHBondContact O-CG2 3.26Å; F259-V263 PolarHBondContact O-N 2.9Å |
| 260 | L | 75.1 | Confident | 66.3 | Low | 100 Ų | 100 | 101.6 Ų | 101.6 | 52% | 0.524 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 175.9 | -174.3 | 67.2 | 0 | 0 | 0 | 111.6 | Q256 V263 L264 | Q256-L260 VanDerWaalsContact O-CB 3.25Å; Q256-L260 WeakPolarHBondContact O-CB 3.41Å; Q256-L260 PolarHBondContact O-N 3.44Å; L260-V263 PolarHBondContact O-N 3.32Å; L260-L264 HydrophobicContact CG-CD1 4.14Å; L260-L264 HydrophobicContact CG-CG 4.49Å; L260-L264 WeakPolarHBondContact O-CB 3.41Å; L260-L264 VanDerWaalsContact O-CG 3.23Å; L260-L264 WeakPolarHBondContact O-CG 3.19Å; L260-L264 PolarHBondContact O-N 3.4Å |
| 261 | A | 79.6 | Confident | 66.3 | Low | 45 Ų | 45 | 104 Ų | 104 | 37% | 0.372 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.9 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | R257 F258 F259 L264 L265 | R257-A261 WeakPolarHBondContact O-CB 3.08Å; R257-A261 PolarHBondContact O-N 2.83Å; F258-A261 PolarHBondContact O-N 2.84Å; F259-A261 PolarHBondContact O-N 3.36Å; A261-L264 PolarHBondContact O-N 3.45Å; A261-L265 VanDerWaalsContact O-CB 3.27Å; A261-L265 WeakPolarHBondContact O-CB 3.26Å; A261-L265 PolarHBondContact O-N 3.46Å |
| 262 | A | 78.4 | Confident | 65.7 | Low | 57 Ų | 57 | 108 Ų | 108 | 47% | 0.471 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67 | -38.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F258 F259 L265 Y266 | F258-A262 WeakPolarHBondContact O-CB 3.23Å; F258-A262 PolarHBondContact O-N 3.47Å; F259-A262 PolarHBondContact O-N 2.86Å; A262-L265 PolarHBondContact O-N 2.87Å; A262-Y266 WeakPolarHBondContact O-CB 3.44Å; A262-Y266 PolarHBondContact O-N 3.27Å |
| 263 | V | 73.9 | Confident | 65.1 | Low | 57 Ų | 57 | 104.7 Ų | 104.7 | 35% | 0.345 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.5 | -44 | 173 | 169 | 0 | 0 | 0 | 0 | 110.5 | F259 L260 Y266 M267 | F259-V263 HydrophobicContact CD1-CG2 4.12Å; F259-V263 HydrophobicContact CE1-CG2 3.75Å; F259-V263 HydrophobicContact CE2-CG2 4.21Å; F259-V263 HydrophobicContact CZ-CG2 3.8Å; F259-V263 WeakPolarHBondContact O-CB 3.34Å; F259-V263 VanDerWaalsContact O-CG2 3.26Å; F259-V263 WeakPolarHBondContact O-CG2 3.26Å; F259-V263 PolarHBondContact O-N 2.9Å; L260-V263 PolarHBondContact O-N 3.32Å; V263-Y266 PolarHBondContact O-N 3.07Å; V263-M267 HydrophobicContact CG1-CG 4.38Å; V263-M267 WeakPolarHBondContact O-CB 3.43Å; V263-M267 WeakPolarHBondContact O-CG 3.44Å; V263-M267 PolarHBondContact O-N 3.42Å |
| 264 | L | 73.5 | Confident | 64.7 | Low | 100 Ų | 100 | 103.8 Ų | 103.8 | 52% | 0.524 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.1 | -41 | 175.7 | -72.9 | 172.6 | 0 | 0 | 0 | 111.4 | L260 A261 M267 L268 | L260-L264 HydrophobicContact CG-CD1 4.14Å; L260-L264 HydrophobicContact CG-CG 4.49Å; L260-L264 WeakPolarHBondContact O-CB 3.41Å; L260-L264 VanDerWaalsContact O-CG 3.23Å; L260-L264 WeakPolarHBondContact O-CG 3.19Å; L260-L264 PolarHBondContact O-N 3.4Å; A261-L264 PolarHBondContact O-N 3.45Å; L264-M267 PolarHBondContact O-N 2.94Å; L264-L268 WeakPolarHBondContact O-CB 3.13Å; L264-L268 PolarHBondContact O-N 2.97Å |
| 265 | L | 76.6 | Confident | 64.1 | Low | 84 Ų | 84 | 102.4 Ų | 102.4 | 44% | 0.44 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.3 | -44.5 | 174.7 | -133.4 | 96.4 | 0 | 0 | 0 | 110.3 | A261 A262 M267 L268 F269 | A261-L265 VanDerWaalsContact O-CB 3.27Å; A261-L265 WeakPolarHBondContact O-CB 3.26Å; A261-L265 PolarHBondContact O-N 3.46Å; A262-L265 PolarHBondContact O-N 2.87Å; L265-M267 VanDerWaalsContact C-N 3.33Å; L265-M267 PolarHBondContact O-N 2.76Å; L265-L268 CarbonylContact O-C 3.56Å; L265-L268 PolarHBondContact O-N 3.46Å; L265-L268 VanDerWaalsContact O-N 3.16Å; L265-F269 HydrophobicContact CB-CD2 4.36Å; L265-F269 HydrophobicContact CD1-CE2 4.46Å; L265-F269 HydrophobicContact CD2-CD2 3.69Å; L265-F269 HydrophobicContact CD2-CE2 3.52Å; L265-F269 HydrophobicContact CG-CD2 3.67Å; L265-F269 HydrophobicContact CG-CE2 3.61Å; L265-F269 WeakPolarHBondContact O-CB 3.37Å; L265-F269 VanDerWaalsContact O-CD2 3.25Å; L265-F269 WeakPolarHBondContact O-CD2 3.44Å; L265-F269 PolarHBondContact O-N 3.42Å |
| 266 | Y | 76 | Confident | 63.2 | Low | 130 Ų | 130 | 102.4 Ų | 102.4 | 51% | 0.51 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.4 | -44.3 | 175.7 | 173.4 | -95.3 | 0 | 0 | 0 | 110.7 | A262 V263 L268 F269 V270 | A262-Y266 WeakPolarHBondContact O-CB 3.44Å; A262-Y266 PolarHBondContact O-N 3.27Å; V263-Y266 PolarHBondContact O-N 3.07Å; Y266-L268 VanDerWaalsContact C-N 3.33Å; Y266-L268 PolarHBondContact O-N 3.17Å; Y266-F269 PolarHBondContact O-N 3.46Å; Y266-V270 HydrophobicContact CD2-CB 4.42Å; Y266-V270 HydrophobicContact CD2-CG2 3.61Å; Y266-V270 HydrophobicContact CE2-CB 4.23Å; Y266-V270 HydrophobicContact CE2-CG1 4.4Å; Y266-V270 HydrophobicContact CE2-CG2 3.55Å; Y266-V270 HydrophobicContact CG-CG2 4.24Å; Y266-V270 WeakPolarHBondContact O-CA 3.3Å; Y266-V270 WeakPolarHBondContact O-CB 3.28Å; Y266-V270 WeakPolarHBondContact O-CG2 3.42Å; Y266-V270 PolarHBondContact O-N 2.98Å |
| 267 | M | 66.4 | Low | 62.4 | Low | 74 Ų | 74 | 101 Ų | 101 | 37% | 0.365 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 174.6 | -67.9 | -77.5 | -77.5 | 0 | 0 | 111.3 | V263 L264 L265 R271 | V263-M267 HydrophobicContact CG1-CG 4.38Å; V263-M267 WeakPolarHBondContact O-CB 3.43Å; V263-M267 WeakPolarHBondContact O-CG 3.44Å; V263-M267 PolarHBondContact O-N 3.42Å; L264-M267 PolarHBondContact O-N 2.94Å; L265-M267 VanDerWaalsContact C-N 3.33Å; L265-M267 PolarHBondContact O-N 2.76Å; M267-R271 WeakPolarHBondContact O-CA 3.27Å; M267-R271 WeakPolarHBondContact O-CB 3.13Å; M267-R271 PolarHBondContact O-N 2.65Å |
| 268 | L | 64.6 | Low | 61.5 | Low | 105 Ų | 105 | 98.3 Ų | 98.3 | 55% | 0.55 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67 | -49.2 | 175.5 | -112.6 | 137.3 | 0 | 0 | 0 | 112.1 | L264 L265 Y266 M272 | L264-L268 WeakPolarHBondContact O-CB 3.13Å; L264-L268 PolarHBondContact O-N 2.97Å; L265-L268 CarbonylContact O-C 3.56Å; L265-L268 PolarHBondContact O-N 3.46Å; L265-L268 VanDerWaalsContact O-N 3.16Å; Y266-L268 VanDerWaalsContact C-N 3.33Å; Y266-L268 PolarHBondContact O-N 3.17Å; L268-M272 HydrophobicContact CD2-CG 4.09Å; L268-M272 HydrophobicContact CG-CG 4.37Å; L268-M272 WeakPolarHBondContact O-CB 3.43Å; L268-M272 WeakPolarHBondContact O-CG 3.44Å; L268-M272 PolarHBondContact O-N 3.31Å |
| 269 | F | 61.8 | Low | 59.9 | Low | 123 Ų | 123 | 94.7 Ų | 94.7 | 54% | 0.539 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -78.7 | -30.6 | -174.3 | -82.3 | -76.7 | 0 | 0 | 0 | 113.5 | L234 L265 Y266 | L234-F269 HydrophobicContact CD1-CE2 4.34Å; L234-F269 HydrophobicContact CD1-CZ 3.86Å; L234-F269 HydrophobicContact CD2-CE1 4.4Å; L234-F269 HydrophobicContact CD2-CZ 3.74Å; L234-F269 HydrophobicContact CG-CZ 4.47Å; L265-F269 HydrophobicContact CB-CD2 4.36Å; L265-F269 HydrophobicContact CD1-CE2 4.46Å; L265-F269 HydrophobicContact CD2-CD2 3.69Å; L265-F269 HydrophobicContact CD2-CE2 3.52Å; L265-F269 HydrophobicContact CG-CD2 3.67Å; L265-F269 HydrophobicContact CG-CE2 3.61Å; L265-F269 WeakPolarHBondContact O-CB 3.37Å; L265-F269 VanDerWaalsContact O-CD2 3.25Å; L265-F269 WeakPolarHBondContact O-CD2 3.44Å; L265-F269 PolarHBondContact O-N 3.42Å; Y266-F269 PolarHBondContact O-N 3.46Å |
| 270 | V | 56 | Low | 58.8 | Low | 74 Ų | 74 | 92 Ų | 92 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -95.3 | -19.8 | -179.2 | -177.5 | 0 | 0 | 0 | 0 | 112.1 | Y266 | Y266-V270 HydrophobicContact CD2-CB 4.42Å; Y266-V270 HydrophobicContact CD2-CG2 3.61Å; Y266-V270 HydrophobicContact CE2-CB 4.23Å; Y266-V270 HydrophobicContact CE2-CG1 4.4Å; Y266-V270 HydrophobicContact CE2-CG2 3.55Å; Y266-V270 HydrophobicContact CG-CG2 4.24Å; Y266-V270 WeakPolarHBondContact O-CA 3.3Å; Y266-V270 WeakPolarHBondContact O-CB 3.28Å; Y266-V270 WeakPolarHBondContact O-CG2 3.42Å; Y266-V270 PolarHBondContact O-N 2.98Å |
| 271 | R | 52.5 | Low | 57.9 | Low | 84 Ų | 84 | 90.7 Ų | 90.7 | 32% | 0.317 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -113.8 | -5.2 | 177.4 | -59.8 | -156 | 173.1 | 139 | 17.8 | 117.2 | M267 D273 S279 I283 | M267-R271 WeakPolarHBondContact O-CA 3.27Å; M267-R271 WeakPolarHBondContact O-CB 3.13Å; M267-R271 PolarHBondContact O-N 2.65Å; R271-D273 VanDerWaalsContact C-N 3.29Å; R271-S279 PolarHBondContact NE-OG 2.99Å; R271-I283 VanDerWaalsContact NH1-CG1 3.3Å |
| 272 | M | 44.7 | Very low | 56.4 | Low | 140 Ų | 140 | 96.2 Ų | 96.2 | 69% | 0.69 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -89.6 | 7.4 | 172.3 | -62.1 | -77.6 | -68.2 | 0 | 0 | 113.1 | L268 P274 | L268-M272 HydrophobicContact CD2-CG 4.09Å; L268-M272 HydrophobicContact CG-CG 4.37Å; L268-M272 WeakPolarHBondContact O-CB 3.43Å; L268-M272 WeakPolarHBondContact O-CG 3.44Å; L268-M272 PolarHBondContact O-N 3.31Å; M272-P274 VanDerWaalsContact O-CD 3.25Å; M272-P274 WeakPolarHBondContact O-CD 3.25Å |
| 273 | D | 42.5 | Very low | 55.4 | Low | 84 Ų | 84 | 96 Ų | 96 | 45% | 0.449 | 51% | 0.507 | S | S | . | . | trans | -85.8 | 107.7 | 164.7 | -173.2 | 0.9 | 0 | 0 | 0 | 109.1 | R271 A275 H276 | R271-D273 VanDerWaalsContact C-N 3.29Å; D273-A275 PolarHBondContact O-N 3.21Å; D273-A275 PolarHBondContact OD1-N 2.98Å; D273-H276 IonicContact OD2-ND1 3.43Å | ||
| 274 | P | 43 | Very low | 54.8 | Low | 130 Ų | 130 | 95.8 Ų | 95.8 | 84% | 0.844 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.8 | 7.1 | -176.5 | 28.7 | -33.9 | 0 | 0 | 0 | 114.3 | M272 | M272-P274 VanDerWaalsContact O-CD 3.25Å; M272-P274 WeakPolarHBondContact O-CD 3.25Å |
| 275 | A | 43.3 | Very low | 54.2 | Low | 70 Ų | 70 | 96.7 Ų | 96.7 | 58% | 0.579 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.9 | 1.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | D273 | D273-A275 PolarHBondContact O-N 3.21Å; D273-A275 PolarHBondContact OD1-N 2.98Å |
| 276 | H | 39.3 | Very low | 53.4 | Low | 132 Ų | 132 | 97.7 Ų | 97.7 | 61% | 0.611 | 51% | 0.514 | S | S | * | . | trans | -121.6 | 106.7 | -176.2 | -81.3 | 71.7 | 0 | 0 | 0 | 114.8 | D273 S278 | D273-H276 IonicContact OD2-ND1 3.43Å; H276-S278 PolarHBondContact O-N 3.43Å | ||
| 277 | P | 44.8 | Very low | 53.1 | Low | 110 Ų | 110 | 97.2 Ų | 97.2 | 71% | 0.714 | 52% | 0.52 | S | S | * | . | trans | -85.4 | 13.8 | -176.4 | 33.1 | -34 | 0 | 0 | 0 | 115.8 | ||||
| 278 | S | 45.9 | Very low | 53.4 | Low | 100 Ų | 100 | 99.6 Ų | 99.6 | 70% | 0.699 | 53% | 0.53 | S | S | * | . | S | Bend | trans | -95.8 | 1.2 | -164.1 | 58.5 | 0 | 0 | 0 | 0 | 117.4 | H276 | H276-S278 PolarHBondContact O-N 3.43Š|
| 279 | S | 45 | Very low | 53.8 | Low | 39 Ų | 39 | 100 Ų | 100 | 27% | 0.273 | 53% | 0.53 | S | S | . | . | S | Bend | trans | -113.3 | -2.2 | -179.3 | 72.7 | 0 | 0 | 0 | 0 | 116.2 | R271 | R271-S279 PolarHBondContact NE-OG 2.99Š|
| 280 | F | 52.4 | Low | 54.3 | Low | 93 Ų | 93 | 99.5 Ų | 99.5 | 41% | 0.408 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67.4 | -38.3 | -178.3 | -135.7 | -96 | 0 | 0 | 0 | 115.7 | M43 W282 I283 S284 | M43-F280 WeakPolarHBondContact O-CE1 3.18Å; F280-W282 PolarHBondContact O-N 2.88Å; F280-I283 HydrophobicContact CD2-CD1 4.07Å; F280-I283 HydrophobicContact CE2-CD1 4.49Å; F280-I283 HydrophobicContact CG-CD1 4.32Å; F280-I283 PolarHBondContact O-N 3.21Å; F280-S284 PolarHBondContact O-N 3.13Å; F280-S284 PolarHBondContact O-OG 3.21Å |
| 281 | P | 54.9 | Low | 55.2 | Low | 73 Ų | 73 | 102.8 Ų | 102.8 | 47% | 0.474 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.4 | -29.9 | -179.2 | -21.4 | 31.9 | 0 | 0 | 0 | 113 | S284 Q285 | P281-S284 PolarHBondContact O-OG 2.81Å; P281-Q285 VanDerWaalsContact O-CB 3.29Å; P281-Q285 WeakPolarHBondContact O-CB 3.36Å; P281-Q285 PolarHBondContact O-N 3.39Å; P281-Q285 VanDerWaalsContact O-N 3.16Å |
| 282 | W | 49.3 | Very low | 56.4 | Low | 162 Ų | 162 | 104.7 Ų | 104.7 | 61% | 0.614 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -78.1 | -28.9 | -177.1 | -174.2 | 36.6 | 0 | 0 | 0 | 112.8 | F280 M286 | F280-W282 PolarHBondContact O-N 2.88Å; W282-M286 WeakPolarHBondContact O-CB 3.33Å; W282-M286 WeakPolarHBondContact O-CG 3.35Å; W282-M286 PolarHBondContact O-N 3.34Å |
| 283 | I | 57.5 | Low | 57.8 | Low | 51 Ų | 51 | 103.4 Ų | 103.4 | 26% | 0.262 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -73.5 | -44.7 | 176.5 | -49.8 | 151 | 0 | 0 | 0 | 110.2 | R271 F280 Q285 M286 L287 | R271-I283 VanDerWaalsContact NH1-CG1 3.3Å; F280-I283 HydrophobicContact CD2-CD1 4.07Å; F280-I283 HydrophobicContact CE2-CD1 4.49Å; F280-I283 HydrophobicContact CG-CD1 4.32Å; F280-I283 PolarHBondContact O-N 3.21Å; I283-Q285 PolarHBondContact O-N 2.88Å; I283-M286 PolarHBondContact O-N 2.82Å; I283-L287 VanDerWaalsContact O-CB 3.27Å; I283-L287 WeakPolarHBondContact O-CB 3.34Å; I283-L287 PolarHBondContact O-N 3.42Å |
| 284 | S | 61.3 | Low | 59.2 | Low | 53 Ų | 53 | 106 Ų | 106 | 37% | 0.371 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -61.6 | -36.5 | 176.2 | 54.2 | 0 | 0 | 0 | 0 | 110.1 | F280 P281 L287 Q288 | F280-S284 PolarHBondContact O-N 3.13Å; F280-S284 PolarHBondContact O-OG 3.21Å; P281-S284 PolarHBondContact O-OG 2.81Å; S284-L287 PolarHBondContact O-N 3.32Å; S284-Q288 VanDerWaalsContact O-CB 3.28Å; S284-Q288 WeakPolarHBondContact O-CB 3.31Å; S284-Q288 VanDerWaalsContact O-CG 3.3Å; S284-Q288 WeakPolarHBondContact O-CG 3.39Å; S284-Q288 PolarHBondContact O-N 3.32Å |
| 285 | Q | 60.3 | Low | 60.5 | Low | 119 Ų | 119 | 103.8 Ų | 103.8 | 56% | 0.556 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -70.1 | -41.3 | 175.1 | -158.4 | 163.9 | 10 | 0 | 0 | 112.3 | P281 I283 Q288 M289 | P281-Q285 VanDerWaalsContact O-CB 3.29Å; P281-Q285 WeakPolarHBondContact O-CB 3.36Å; P281-Q285 PolarHBondContact O-N 3.39Å; P281-Q285 VanDerWaalsContact O-N 3.16Å; I283-Q285 PolarHBondContact O-N 2.88Å; Q285-Q288 PolarHBondContact O-N 2.93Å; Q285-M289 WeakPolarHBondContact O-CB 3.29Å; Q285-M289 WeakPolarHBondContact O-CG 3.43Å; Q285-M289 PolarHBondContact O-N 2.82Å |
| 286 | M | 59.1 | Low | 62 | Low | 105 Ų | 105 | 104.2 Ų | 104.2 | 52% | 0.517 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 171.9 | -83 | -104.5 | 82.1 | 0 | 0 | 112.2 | W282 I283 M289 L290 | W282-M286 WeakPolarHBondContact O-CB 3.33Å; W282-M286 WeakPolarHBondContact O-CG 3.35Å; W282-M286 PolarHBondContact O-N 3.34Å; I283-M286 PolarHBondContact O-N 2.82Å; M286-M289 PolarHBondContact O-N 3.02Å; M286-L290 WeakPolarHBondContact O-CB 3.45Å; M286-L290 PolarHBondContact O-N 3.33Å |
| 287 | L | 70.6 | Confident | 63.5 | Low | 121 Ų | 121 | 103.1 Ų | 103.1 | 63% | 0.634 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -68.7 | -39.8 | 178.1 | -163.6 | 77 | 0 | 0 | 0 | 111 | I283 S284 L290 K291 | I283-L287 VanDerWaalsContact O-CB 3.27Å; I283-L287 WeakPolarHBondContact O-CB 3.34Å; I283-L287 PolarHBondContact O-N 3.42Å; S284-L287 PolarHBondContact O-N 3.32Å; L287-L290 PolarHBondContact O-N 3.07Å; L287-K291 VanDerWaalsContact O-CB 3.27Å; L287-K291 WeakPolarHBondContact O-CB 3.37Å; L287-K291 PolarHBondContact O-N 3.22Å |
| 288 | Q | 72.4 | Confident | 64.7 | Low | 124 Ų | 124 | 101 Ų | 101 | 58% | 0.579 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.9 | -42.5 | 171.9 | -83.4 | 177 | -13.8 | 0 | 0 | 111.6 | S284 Q285 K291 Q292 | S284-Q288 VanDerWaalsContact O-CB 3.28Å; S284-Q288 WeakPolarHBondContact O-CB 3.31Å; S284-Q288 VanDerWaalsContact O-CG 3.3Å; S284-Q288 WeakPolarHBondContact O-CG 3.39Å; S284-Q288 PolarHBondContact O-N 3.32Å; Q285-Q288 PolarHBondContact O-N 2.93Å; Q288-K291 PolarHBondContact O-N 3.44Å; Q288-Q292 WeakPolarHBondContact O-CB 3.23Å; Q288-Q292 VanDerWaalsContact O-CG 3.31Å; Q288-Q292 WeakPolarHBondContact O-CG 3.37Å; Q288-Q292 PolarHBondContact O-N 2.82Å |
| 289 | M | 73.6 | Confident | 65.5 | Low | 112 Ų | 112 | 97.7 Ų | 97.7 | 55% | 0.552 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.4 | -40.4 | 175.9 | -68.9 | -69.7 | -100 | 0 | 0 | 111.2 | Q285 M286 K291 Q292 M293 | Q285-M289 WeakPolarHBondContact O-CB 3.29Å; Q285-M289 WeakPolarHBondContact O-CG 3.43Å; Q285-M289 PolarHBondContact O-N 2.82Å; M286-M289 PolarHBondContact O-N 3.02Å; M289-K291 VanDerWaalsContact C-N 3.35Å; M289-Q292 PolarHBondContact O-N 3.3Å; M289-M293 WeakPolarHBondContact O-CB 3.22Å; M289-M293 PolarHBondContact O-N 3.36Å |
| 290 | L | 72.8 | Confident | 66.3 | Low | 114 Ų | 114 | 99.6 Ų | 99.6 | 60% | 0.597 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.3 | -39.7 | 175.7 | -141.2 | 90.2 | 0 | 0 | 0 | 111.6 | M286 L287 M293 W294 | M286-L290 WeakPolarHBondContact O-CB 3.45Å; M286-L290 PolarHBondContact O-N 3.33Å; L287-L290 PolarHBondContact O-N 3.07Å; L290-M293 PolarHBondContact O-N 3.49Å; L290-W294 VanDerWaalsContact O-CB 3.22Å; L290-W294 WeakPolarHBondContact O-CB 3.32Å; L290-W294 PolarHBondContact O-N 2.87Å |
| 291 | K | 74.6 | Confident | 66.7 | Low | 142 Ų | 142 | 103.5 Ų | 103.5 | 62% | 0.617 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.1 | -42.7 | 176.5 | -167.9 | 172.1 | -176.9 | 174.9 | 0 | 111.5 | L287 Q288 M289 M293 W294 D295 | L287-K291 VanDerWaalsContact O-CB 3.27Å; L287-K291 WeakPolarHBondContact O-CB 3.37Å; L287-K291 PolarHBondContact O-N 3.22Å; Q288-K291 PolarHBondContact O-N 3.44Å; M289-K291 VanDerWaalsContact C-N 3.35Å; K291-M293 VanDerWaalsContact C-N 3.34Å; K291-M293 PolarHBondContact O-N 2.82Å; K291-W294 PolarHBondContact O-N 2.9Å; K291-D295 WeakPolarHBondContact O-CB 3.18Å; K291-D295 VanDerWaalsContact O-CG 3.24Å; K291-D295 PolarHBondContact O-N 3.34Å |
| 292 | Q | 76.5 | Confident | 66.8 | Low | 125 Ų | 125 | 107.1 Ų | 107.1 | 58% | 0.584 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.7 | -38.9 | 173.5 | -76.8 | 178 | -12.4 | 0 | 0 | 112.2 | Q288 M289 A296 | Q288-Q292 WeakPolarHBondContact O-CB 3.23Å; Q288-Q292 VanDerWaalsContact O-CG 3.31Å; Q288-Q292 WeakPolarHBondContact O-CG 3.37Å; Q288-Q292 PolarHBondContact O-N 2.82Å; M289-Q292 PolarHBondContact O-N 3.3Å; Q292-A296 VanDerWaalsContact O-CB 3.25Å; Q292-A296 WeakPolarHBondContact O-CB 3.46Å; Q292-A296 PolarHBondContact O-N 2.85Å |
| 293 | M | 74 | Confident | 67.2 | Low | 113 Ų | 113 | 108.3 Ų | 108.3 | 56% | 0.557 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -71.2 | -38.7 | 177.2 | -144.3 | 175.5 | 80.7 | 0 | 0 | 111.5 | M289 L290 K291 A296 M297 | M289-M293 WeakPolarHBondContact O-CB 3.22Å; M289-M293 PolarHBondContact O-N 3.36Å; L290-M293 PolarHBondContact O-N 3.49Å; K291-M293 VanDerWaalsContact C-N 3.34Å; K291-M293 PolarHBondContact O-N 2.82Å; M293-A296 PolarHBondContact O-N 3.01Å; M293-M297 HydrophobicContact CE-CE 4.35Å; M293-M297 WeakPolarHBondContact O-CB 3.33Å; M293-M297 PolarHBondContact O-N 3.48Å |
| 294 | W | 71.8 | Confident | 67.2 | Low | 137 Ų | 137 | 109.2 Ų | 109.2 | 52% | 0.519 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.4 | -47.9 | 173 | -177.4 | -88 | 0 | 0 | 0 | 111.3 | L290 K291 A296 M297 F298 | L290-W294 VanDerWaalsContact O-CB 3.22Å; L290-W294 WeakPolarHBondContact O-CB 3.32Å; L290-W294 PolarHBondContact O-N 2.87Å; K291-W294 PolarHBondContact O-N 2.9Å; W294-A296 PolarHBondContact O-N 3.41Å; W294-M297 PolarHBondContact O-N 3.38Å; W294-F298 AromaticContact CD2-CD2 3.44Å; W294-F298 HydrophobicContact CD2-CD2 3.44Å; W294-F298 VanDerWaalsContact CD2-CD2 3.44Å; W294-F298 AromaticContact CD2-CE2 3.76Å; W294-F298 HydrophobicContact CD2-CE2 3.76Å; W294-F298 HydrophobicContact CD2-CG 4.42Å; W294-F298 AromaticContact CE2-CD2 3.67Å; W294-F298 AromaticContact CE3-CD2 3.57Å; W294-F298 HydrophobicContact CE3-CD2 3.57Å; W294-F298 AromaticContact CE3-CE2 3.33Å; W294-F298 HydrophobicContact CE3-CE2 3.33Å; W294-F298 HydrophobicContact CE3-CZ 4.36Å; W294-F298 AromaticContact CG-CD2 3.91Å; W294-F298 HydrophobicContact CG-CD2 3.91Å; W294-F298 HydrophobicContact CH2-CD2 4.12Å; W294-F298 AromaticContact CH2-CE2 3.88Å; W294-F298 HydrophobicContact CH2-CE2 3.88Å; W294-F298 HydrophobicContact CH2-CZ 4.25Å; W294-F298 HydrophobicContact CZ2-CD2 4.01Å; W294-F298 HydrophobicContact CZ2-CE2 4.26Å; W294-F298 HydrophobicContact CZ2-CG 4.4Å; W294-F298 AromaticContact CZ3-CD2 3.91Å; W294-F298 HydrophobicContact CZ3-CD2 3.91Å; W294-F298 AromaticContact CZ3-CE2 3.4Å; W294-F298 HydrophobicContact CZ3-CE2 3.4Å; W294-F298 HydrophobicContact CZ3-CZ 4Å; W294-F298 WeakPolarHBondContact O-CB 3.37Å; W294-F298 WeakPolarHBondContact O-CD2 3.25Å; W294-F298 PolarHBondContact O-N 2.99Å |
| 295 | D | 71.4 | Confident | 66.6 | Low | 85 Ų | 85 | 116.5 Ų | 116.5 | 46% | 0.455 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.8 | -42.1 | 176.5 | -70.2 | -21.4 | 0 | 0 | 0 | 110.6 | K291 M297 A299 | K291-D295 WeakPolarHBondContact O-CB 3.18Å; K291-D295 VanDerWaalsContact O-CG 3.24Å; K291-D295 PolarHBondContact O-N 3.34Å; D295-M297 VanDerWaalsContact C-N 3.35Å; D295-M297 PolarHBondContact O-N 2.98Å; D295-A299 WeakPolarHBondContact O-CA 2.82Å; D295-A299 WeakPolarHBondContact O-CB 3.39Å; D295-A299 PolarHBondContact O-N 3.32Å |
| 296 | A | 74.1 | Confident | 66.3 | Low | 78 Ų | 78 | 114.8 Ų | 114.8 | 65% | 0.645 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.4 | -37.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q292 M293 W294 | Q292-A296 VanDerWaalsContact O-CB 3.25Å; Q292-A296 WeakPolarHBondContact O-CB 3.46Å; Q292-A296 PolarHBondContact O-N 2.85Å; M293-A296 PolarHBondContact O-N 3.01Å; W294-A296 PolarHBondContact O-N 3.41Å |
| 297 | M | 71.8 | Confident | 65.9 | Low | 110 Ų | 110 | 118.5 Ų | 118.5 | 54% | 0.542 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -84.1 | -33 | -175.8 | -162.7 | 176.1 | -63.8 | 0 | 0 | 112.8 | M293 W294 D295 | M293-M297 HydrophobicContact CE-CE 4.35Å; M293-M297 WeakPolarHBondContact O-CB 3.33Å; M293-M297 PolarHBondContact O-N 3.48Å; W294-M297 PolarHBondContact O-N 3.38Å; D295-M297 VanDerWaalsContact C-N 3.35Å; D295-M297 PolarHBondContact O-N 2.98Å |
| 298 | F | 69.8 | Low | 64.6 | Low | 65 Ų | 65 | 119.8 Ų | 119.8 | 29% | 0.285 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -113.9 | -16 | -173.1 | -60.7 | -76.2 | 0 | 0 | 0 | 114.8 | W294 P300 Y301 Y302 | W294-F298 AromaticContact CD2-CD2 3.44Å; W294-F298 HydrophobicContact CD2-CD2 3.44Å; W294-F298 VanDerWaalsContact CD2-CD2 3.44Å; W294-F298 AromaticContact CD2-CE2 3.76Å; W294-F298 HydrophobicContact CD2-CE2 3.76Å; W294-F298 HydrophobicContact CD2-CG 4.42Å; W294-F298 AromaticContact CE2-CD2 3.67Å; W294-F298 AromaticContact CE3-CD2 3.57Å; W294-F298 HydrophobicContact CE3-CD2 3.57Å; W294-F298 AromaticContact CE3-CE2 3.33Å; W294-F298 HydrophobicContact CE3-CE2 3.33Å; W294-F298 HydrophobicContact CE3-CZ 4.36Å; W294-F298 AromaticContact CG-CD2 3.91Å; W294-F298 HydrophobicContact CG-CD2 3.91Å; W294-F298 HydrophobicContact CH2-CD2 4.12Å; W294-F298 AromaticContact CH2-CE2 3.88Å; W294-F298 HydrophobicContact CH2-CE2 3.88Å; W294-F298 HydrophobicContact CH2-CZ 4.25Å; W294-F298 HydrophobicContact CZ2-CD2 4.01Å; W294-F298 HydrophobicContact CZ2-CE2 4.26Å; W294-F298 HydrophobicContact CZ2-CG 4.4Å; W294-F298 AromaticContact CZ3-CD2 3.91Å; W294-F298 HydrophobicContact CZ3-CD2 3.91Å; W294-F298 AromaticContact CZ3-CE2 3.4Å; W294-F298 HydrophobicContact CZ3-CE2 3.4Å; W294-F298 HydrophobicContact CZ3-CZ 4Å; W294-F298 WeakPolarHBondContact O-CB 3.37Å; W294-F298 WeakPolarHBondContact O-CD2 3.25Å; W294-F298 PolarHBondContact O-N 2.99Å; F298-P300 VanDerWaalsContact C-N 3.3Å; F298-Y301 WeakPolarHBondContact O-CB 3.14Å; F298-Y301 PolarHBondContact O-N 3.36Å; F298-Y302 HydrophobicContact CB-CD2 4.19Å; F298-Y302 HydrophobicContact CB-CE2 3.72Å; F298-Y302 WeakPolarHBondContact O-CD2 3.39Å; F298-Y302 PolarHBondContact O-N 3.36Å |
| 299 | A | 61.7 | Low | 64.2 | Low | 30 Ų | 30 | 119.6 Ų | 119.6 | 25% | 0.248 | 60% | 0.602 | C | S | . | * | H | α-helix | trans | -56.4 | -32.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | D295 Y301 Y302 R303 | D295-A299 WeakPolarHBondContact O-CA 2.82Å; D295-A299 WeakPolarHBondContact O-CB 3.39Å; D295-A299 PolarHBondContact O-N 3.32Å; A299-Y301 VanDerWaalsContact C-N 3.27Å; A299-Y301 PolarHBondContact O-N 3.04Å; A299-Y302 PolarHBondContact O-N 3.43Å; A299-R303 PolarHBondContact O-N 3.4Å |
| 300 | P | 62.3 | Low | 63.7 | Low | 80 Ų | 80 | 120 Ų | 120 | 52% | 0.519 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -62.4 | -34.7 | 174 | -21.7 | 32.9 | 0 | 0 | 0 | 112.8 | F298 A304 | F298-P300 VanDerWaalsContact C-N 3.3Å; P300-A304 WeakPolarHBondContact O-CB 3.46Å; P300-A304 PolarHBondContact O-N 3.14Å; P300-A304 VanDerWaalsContact O-N 3.14Å |
| 301 | Y | 60.2 | Low | 63.2 | Low | 174 Ų | 174 | 120.3 Ų | 120.3 | 68% | 0.682 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -74.6 | -34.5 | -179.2 | -70.5 | -84.9 | 0 | 0 | 0 | 112.5 | F298 A299 | F298-Y301 WeakPolarHBondContact O-CB 3.14Å; F298-Y301 PolarHBondContact O-N 3.36Å; A299-Y301 VanDerWaalsContact C-N 3.27Å; A299-Y301 PolarHBondContact O-N 3.04Å |
| 302 | Y | 58.2 | Low | 62.6 | Low | 149 Ų | 149 | 119.1 Ų | 119.1 | 58% | 0.584 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -78.2 | -34 | 176.2 | -63.6 | -69.1 | 0 | 0 | 0 | 112.8 | F298 A299 R305 A306 | F298-Y302 HydrophobicContact CB-CD2 4.19Å; F298-Y302 HydrophobicContact CB-CE2 3.72Å; F298-Y302 WeakPolarHBondContact O-CD2 3.39Å; F298-Y302 PolarHBondContact O-N 3.36Å; A299-Y302 PolarHBondContact O-N 3.43Å; Y302-R305 PolarHBondContact O-N 3.44Å; Y302-A306 PolarHBondContact O-N 3.28Å |
| 303 | R | 57.4 | Low | 61.7 | Low | 187 Ų | 187 | 118.7 Ų | 118.7 | 71% | 0.706 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.4 | -36 | 174.6 | -82.8 | -174.7 | -170.5 | 144.3 | 5.1 | 113.4 | A299 R305 A306 | A299-R303 PolarHBondContact O-N 3.4Å; R303-R305 PolarHBondContact O-N 3.21Å; R303-A306 PolarHBondContact O-N 3.32Å |
| 304 | A | 56.5 | Low | 60.9 | Low | 71 Ų | 71 | 119.1 Ų | 119.1 | 59% | 0.587 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.8 | -28.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | P300 | P300-A304 WeakPolarHBondContact O-CB 3.46Å; P300-A304 PolarHBondContact O-N 3.14Å; P300-A304 VanDerWaalsContact O-N 3.14Å |
| 305 | R | 49.4 | Very low | 60.1 | Low | 206 Ų | 206 | 117.8 Ų | 117.8 | 78% | 0.777 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -85.8 | -14.1 | 177.7 | -163.2 | 171.7 | -174.8 | 167.1 | 1.7 | 114 | Y302 R303 | Y302-R305 PolarHBondContact O-N 3.44Å; R303-R305 PolarHBondContact O-N 3.21Å |
| 306 | A | 53.3 | Low | 59.2 | Low | 83 Ų | 83 | 120.3 Ų | 120.3 | 69% | 0.686 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -92.6 | -5.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y302 R303 | Y302-A306 PolarHBondContact O-N 3.28Å; R303-A306 PolarHBondContact O-N 3.32Å |
| 307 | Q | 51.3 | Low | 58 | Low | 182 Ų | 182 | 123.8 Ų | 123.8 | 85% | 0.85 | 63% | 0.626 | S | S | * | * | trans | -113.6 | 8.9 | 179.2 | -68.8 | -175.7 | -22 | 0 | 0 | 113.5 | ||||
| 308 | S | 43.8 | Very low | 56.7 | Low | 149 Ų | 149 | 125.1 Ų | 125.1 | 100% | 1.042 | 63% | 0.633 | S | S | * | * | trans | -104.4 | 0 | 166.5 | 66.5 | 0 | 0 | 0 | 0 | 110.1 |
Retrieved 308 of 308 residues in 324.3 ms
(Link to these results)