| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.8 | Very low | 39.5 | Very low | 248 Ų | 248 | 143.5 Ų | 143.5 | 100% | 1.222 | 83% | 0.827 | S | S | * | * | 0 | 97.5 | 0 | -70.3 | -135 | -76.5 | 0 | 0 | 108.1 | |||||
| 2 | A | 36.3 | Very low | 39.6 | Very low | 97 Ų | 97 | 149.4 Ų | 149.4 | 80% | 0.802 | 83% | 0.829 | S | S | * | * | trans | -156.1 | 93.6 | 166 | 0 | 0 | 0 | 0 | 0 | 105.1 | D4 | A2-D4 PolarHBondContact O-N 2.75Š| ||
| 3 | L | 38.8 | Very low | 39.7 | Very low | 165 Ų | 165 | 152.7 Ų | 152.7 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | trans | -91.3 | 89.1 | 174.8 | -86.9 | 160.4 | 0 | 0 | 0 | 106.6 | I5 | L3-I5 PolarHBondContact O-N 3.06Å; L3-I5 VanDerWaalsContact O-N 3.17Å | ||
| 4 | D | 36.9 | Very low | 39.4 | Very low | 154 Ų | 154 | 147.1 Ų | 147.1 | 82% | 0.824 | 82% | 0.819 | S | S | * | * | trans | -74.4 | 99.7 | 164.3 | -88.5 | -26.1 | 0 | 0 | 0 | 108.1 | A2 L6 | A2-D4 PolarHBondContact O-N 2.75Å; D4-L6 VanDerWaalsContact C-N 3.34Å; D4-L6 PolarHBondContact O-N 3.37Å; D4-L6 VanDerWaalsContact O-N 3.09Å | ||
| 5 | I | 40.1 | Very low | 39.5 | Very low | 153 Ų | 153 | 145.2 Ų | 145.2 | 79% | 0.785 | 82% | 0.815 | S | S | * | * | trans | -75 | 92.8 | 169.2 | -62.1 | 171.2 | 0 | 0 | 0 | 106.3 | L3 A7 | L3-I5 PolarHBondContact O-N 3.06Å; L3-I5 VanDerWaalsContact O-N 3.17Å; I5-A7 VanDerWaalsContact C-N 3.32Å; I5-A7 PolarHBondContact O-N 3.46Å | ||
| 6 | L | 40 | Very low | 39.4 | Very low | 153 Ų | 153 | 141.8 Ų | 141.8 | 80% | 0.801 | 81% | 0.811 | S | S | * | * | trans | -63.6 | 95.6 | 162.9 | -87.7 | 158.2 | 0 | 0 | 0 | 108.1 | D4 M8 | D4-L6 VanDerWaalsContact C-N 3.34Å; D4-L6 PolarHBondContact O-N 3.37Å; D4-L6 VanDerWaalsContact O-N 3.09Å; L6-M8 VanDerWaalsContact C-N 3.29Å; L6-M8 PolarHBondContact O-N 3.37Å | ||
| 7 | A | 39.1 | Very low | 39.7 | Very low | 93 Ų | 93 | 142.7 Ų | 142.7 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | trans | -65.8 | 91.5 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | I5 A9 | I5-A7 VanDerWaalsContact C-N 3.32Å; I5-A7 PolarHBondContact O-N 3.46Å; A7-A9 PolarHBondContact O-N 3.37Å; A7-A9 VanDerWaalsContact O-N 3.16Å | ||
| 8 | M | 38.7 | Very low | 39.9 | Very low | 156 Ų | 156 | 141.3 Ų | 141.3 | 77% | 0.768 | 81% | 0.806 | S | S | * | * | trans | -63.9 | 110 | 167.8 | -78.6 | -65.1 | -63.7 | 0 | 0 | 108.7 | L6 | L6-M8 VanDerWaalsContact C-N 3.29Å; L6-M8 PolarHBondContact O-N 3.37Å | ||
| 9 | A | 39.2 | Very low | 40 | Very low | 76 Ų | 76 | 146.3 Ų | 146.3 | 63% | 0.628 | 81% | 0.81 | S | S | * | * | trans | -58 | 141.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | A7 L11 | A7-A9 PolarHBondContact O-N 3.37Å; A7-A9 VanDerWaalsContact O-N 3.16Å; A9-L11 PolarHBondContact O-N 3.34Å | ||
| 10 | P | 38.8 | Very low | 40.2 | Very low | 125 Ų | 125 | 146.8 Ų | 146.8 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | trans | -71.5 | 104.8 | 179.2 | -4.2 | 19.4 | 0 | 0 | 0 | 109.7 | Y12 | P10-Y12 PolarHBondContact O-N 3.44Š| ||
| 11 | L | 42.7 | Very low | 40.1 | Very low | 158 Ų | 158 | 141.9 Ų | 141.9 | 83% | 0.827 | 79% | 0.792 | S | S | * | * | trans | -77.3 | 57.5 | 167.2 | -80.9 | 166.7 | 0 | 0 | 0 | 110.7 | A9 | A9-L11 PolarHBondContact O-N 3.34Š| ||
| 12 | Y | 40.4 | Very low | 40 | Very low | 215 Ų | 215 | 135.3 Ų | 135.3 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | -137.3 | 80.2 | 167 | -113 | -91.5 | 0 | 0 | 0 | 108.7 | P10 A14 | P10-Y12 PolarHBondContact O-N 3.44Å; Y12-A14 VanDerWaalsContact C-N 3.28Å; Y12-A14 PolarHBondContact O-N 3.49Å; Y12-A14 VanDerWaalsContact O-N 3.12Å | ||
| 13 | Q | 41.6 | Very low | 40.3 | Very low | 192 Ų | 192 | 140.7 Ų | 140.7 | 90% | 0.897 | 77% | 0.774 | S | S | * | * | trans | -76.8 | 91.4 | 161.3 | -150.9 | 167.3 | 17.9 | 0 | 0 | 105.8 | ||||
| 14 | A | 35.4 | Very low | 40.5 | Very low | 75 Ų | 75 | 138.1 Ų | 138.1 | 62% | 0.62 | 77% | 0.765 | S | S | * | * | trans | -53.4 | 126.9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | Y12 A16 | Y12-A14 VanDerWaalsContact C-N 3.28Å; Y12-A14 PolarHBondContact O-N 3.49Å; Y12-A14 VanDerWaalsContact O-N 3.12Å; A14-A16 PolarHBondContact O-N 2.97Å | ||
| 15 | P | 41.2 | Very low | 40.6 | Very low | 118 Ų | 118 | 138.2 Ų | 138.2 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | trans | -61.3 | 120.8 | 173.1 | -9.9 | 23.1 | 0 | 0 | 0 | 106.2 | I17 | P15-I17 VanDerWaalsContact C-N 3.34Å; P15-I17 PolarHBondContact O-N 3.43Å | ||
| 16 | A | 38 | Very low | 40.6 | Very low | 91 Ų | 91 | 136 Ų | 136 | 75% | 0.752 | 76% | 0.761 | S | S | * | * | trans | -55.7 | 105.6 | 169.6 | 0 | 0 | 0 | 0 | 0 | 106.6 | A14 T18 | A14-A16 PolarHBondContact O-N 2.97Å; A16-T18 PolarHBondContact O-N 2.9Å | ||
| 17 | I | 43.7 | Very low | 40.7 | Very low | 157 Ų | 157 | 134.1 Ų | 134.1 | 81% | 0.805 | 76% | 0.761 | S | S | * | * | trans | -60.3 | 97.5 | 168.3 | -62.6 | 169.3 | 0 | 0 | 0 | 104.1 | P15 R19 | P15-I17 VanDerWaalsContact C-N 3.34Å; P15-I17 PolarHBondContact O-N 3.43Å; I17-R19 PolarHBondContact O-N 2.63Å | ||
| 18 | T | 42.8 | Very low | 41.2 | Very low | 117 Ų | 117 | 139.2 Ų | 139.2 | 72% | 0.718 | 77% | 0.766 | S | S | * | * | trans | -58.3 | 96.4 | 164.8 | 41.5 | 0 | 0 | 0 | 0 | 104.9 | A16 I20 | A16-T18 PolarHBondContact O-N 2.9Å; T18-I20 PolarHBondContact O-N 3.45Å | ||
| 19 | R | 42.7 | Very low | 41.3 | Very low | 236 Ų | 236 | 142.5 Ų | 142.5 | 89% | 0.891 | 77% | 0.77 | S | S | * | * | trans | -51.4 | 103.5 | 158.1 | -82.9 | -176.3 | -175.9 | 173 | 2 | 104.5 | I17 G21 | I17-R19 PolarHBondContact O-N 2.63Å; R19-G21 PolarHBondContact O-N 3.3Å | ||
| 20 | I | 43.5 | Very low | 41.4 | Very low | 157 Ų | 157 | 144.7 Ų | 144.7 | 81% | 0.805 | 78% | 0.777 | S | S | * | * | trans | -58.6 | 98.3 | 165.2 | -63.6 | 169.1 | 0 | 0 | 0 | 103.3 | T18 | T18-I20 PolarHBondContact O-N 3.45Š| ||
| 21 | G | 39 | Very low | 41.8 | Very low | 43 Ų | 43 | 143.2 Ų | 143.2 | 44% | 0.443 | 78% | 0.775 | S | S | . | * | trans | -54.1 | 142.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | R19 K23 | R19-G21 PolarHBondContact O-N 3.3Å; G21-K23 PolarHBondContact O-N 3.48Å | ||
| 22 | P | 42 | Very low | 42.1 | Very low | 111 Ų | 111 | 142.5 Ų | 142.5 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | trans | -59.3 | 114.4 | 175.5 | 27.3 | -31.3 | 0 | 0 | 0 | 106.2 | T24 | P22-T24 HydrophobicContact CB-CG2 4.38Å; P22-T24 PolarHBondContact O-N 3.35Å | ||
| 23 | K | 41.2 | Very low | 42.4 | Very low | 209 Ų | 209 | 137.6 Ų | 137.6 | 91% | 0.909 | 77% | 0.767 | S | S | * | * | trans | -71.3 | 74.2 | 165.8 | -75.6 | -168 | 176.1 | -175.7 | 0 | 106.8 | G21 D25 | G21-K23 PolarHBondContact O-N 3.48Å; K23-D25 PolarHBondContact O-N 2.88Å | ||
| 24 | T | 43.4 | Very low | 43.2 | Very low | 111 Ų | 111 | 133.5 Ų | 133.5 | 68% | 0.681 | 75% | 0.751 | S | S | * | * | trans | -77.6 | 96.4 | 160.9 | 45.7 | 0 | 0 | 0 | 0 | 106 | P22 P26 | P22-T24 HydrophobicContact CB-CG2 4.38Å; P22-T24 PolarHBondContact O-N 3.35Å; T24-P26 VanDerWaalsContact O-CD 3.28Å; T24-P26 WeakPolarHBondContact O-CD 3.39Å | ||
| 25 | D | 38.7 | Very low | 44.3 | Very low | 156 Ų | 156 | 138.3 Ų | 138.3 | 83% | 0.834 | 76% | 0.758 | S | S | * | * | trans | -58.5 | 117.6 | 157 | -103.1 | -33.4 | 0 | 0 | 0 | 106.7 | K23 S27 | K23-D25 PolarHBondContact O-N 2.88Å; D25-S27 PolarHBondContact O-N 3.26Å | ||
| 26 | P | 40.7 | Very low | 45 | Very low | 107 Ų | 107 | 137.9 Ų | 137.9 | 70% | 0.695 | 76% | 0.755 | S | S | * | * | trans | -69.2 | 105.7 | 174.6 | 27.6 | -30.3 | 0 | 0 | 0 | 106.9 | T24 K28 | T24-P26 VanDerWaalsContact O-CD 3.28Å; T24-P26 WeakPolarHBondContact O-CD 3.39Å; P26-K28 PolarHBondContact O-N 3.2Å | ||
| 27 | S | 41.5 | Very low | 45.9 | Very low | 113 Ų | 113 | 137 Ų | 137 | 79% | 0.79 | 74% | 0.737 | S | S | * | * | trans | -57.4 | 105.2 | 171.3 | 65.9 | 0 | 0 | 0 | 0 | 108.2 | D25 R29 | D25-S27 PolarHBondContact O-N 3.26Å; S27-R29 VanDerWaalsContact C-N 3.32Å; S27-R29 PolarHBondContact O-N 2.9Å | ||
| 28 | K | 49.9 | Very low | 46.7 | Very low | 201 Ų | 201 | 134.9 Ų | 134.9 | 87% | 0.874 | 73% | 0.732 | S | S | * | * | trans | -66.6 | 90.9 | 171.1 | -74.6 | 178.3 | 178.2 | 176.6 | 0 | 108.6 | P26 | P26-K28 PolarHBondContact O-N 3.2Š| ||
| 29 | R | 40.5 | Very low | 47.6 | Very low | 225 Ų | 225 | 131 Ų | 131 | 85% | 0.849 | 71% | 0.708 | S | S | * | * | trans | -164.2 | 110 | 148.1 | -103.9 | 168.1 | -153.8 | -163.8 | 5.8 | 107.4 | S27 A31 | S27-R29 VanDerWaalsContact C-N 3.32Å; S27-R29 PolarHBondContact O-N 2.9Å; R29-A31 PolarHBondContact O-N 2.85Å | ||
| 30 | P | 40.7 | Very low | 48.6 | Very low | 121 Ų | 121 | 124.1 Ų | 124.1 | 79% | 0.786 | 70% | 0.696 | S | S | * | * | trans | -57.2 | 128.5 | 162.8 | 25.2 | -29.7 | 0 | 0 | 0 | 106.9 | D32 | P30-D32 PolarHBondContact O-N 3.46Š| ||
| 31 | A | 48.1 | Very low | 49.7 | Very low | 94 Ų | 94 | 122.4 Ų | 122.4 | 78% | 0.777 | 68% | 0.679 | S | S | * | * | trans | -59.4 | 110.3 | 168.8 | 0 | 0 | 0 | 0 | 0 | 106.5 | R29 | R29-A31 PolarHBondContact O-N 2.85Š| ||
| 32 | D | 49.2 | Very low | 51.4 | Low | 143 Ų | 143 | 125.7 Ų | 125.7 | 77% | 0.765 | 69% | 0.691 | S | S | * | * | trans | -56.6 | 123.5 | 177.1 | -115.9 | -20.5 | 0 | 0 | 0 | 107.2 | P30 L34 | P30-D32 PolarHBondContact O-N 3.46Å; D32-L34 PolarHBondContact O-N 3.49Å | ||
| 33 | P | 47.3 | Very low | 53.2 | Low | 113 Ų | 113 | 128 Ų | 128 | 73% | 0.734 | 69% | 0.69 | S | S | * | * | trans | -59.4 | 115.4 | -178.9 | 20.9 | -29.5 | 0 | 0 | 0 | 108.4 | K35 | P33-K35 PolarHBondContact O-N 3.2Š| ||
| 34 | L | 56.8 | Low | 55.2 | Low | 105 Ų | 105 | 119.3 Ų | 119.3 | 55% | 0.55 | 65% | 0.653 | S | S | . | * | trans | -53.5 | 109.7 | 178 | -70.5 | 174.3 | 0 | 0 | 0 | 108.5 | D32 P36 F211 I215 | D32-L34 PolarHBondContact O-N 3.49Å; L34-P36 WeakPolarHBondContact O-CD 3.47Å; L34-F211 HydrophobicContact CB-CZ 3.9Å; L34-F211 HydrophobicContact CD2-CE2 3.81Å; L34-F211 HydrophobicContact CD2-CZ 3.61Å; L34-F211 HydrophobicContact CG-CZ 4.22Å; L34-I215 HydrophobicContact CD1-CD1 3.7Å; L34-I215 HydrophobicContact CD1-CG1 4.17Å; L34-I215 HydrophobicContact CD2-CD1 4.08Å; L34-I215 HydrophobicContact CD2-CG1 4.22Å; L34-I215 HydrophobicContact CG-CD1 4.46Å | ||
| 35 | K | 58.7 | Low | 56.9 | Low | 176 Ų | 176 | 118.6 Ų | 118.6 | 77% | 0.765 | 65% | 0.649 | S | S | * | * | trans | -55.7 | 126.2 | 179.9 | -94.1 | 176.2 | 177.9 | 172.5 | 0 | 109.2 | P33 L37 | P33-K35 PolarHBondContact O-N 3.2Å; K35-L37 PolarHBondContact O-N 2.86Å | ||
| 36 | P | 55.6 | Low | 59.1 | Low | 110 Ų | 110 | 114.3 Ų | 114.3 | 71% | 0.714 | 63% | 0.629 | S | S | * | * | trans | -56.4 | 128 | 173.6 | -23.8 | 32.9 | 0 | 0 | 0 | 110.2 | L34 V38 | L34-P36 WeakPolarHBondContact O-CD 3.47Å; P36-V38 HydrophobicContact CB-CG2 4.06Å; P36-V38 PolarHBondContact O-N 2.92Å | ||
| 37 | L | 58.8 | Low | 61.3 | Low | 71 Ų | 71 | 115.6 Ų | 115.6 | 37% | 0.372 | 63% | 0.628 | S | S | . | * | trans | -76.1 | 61.2 | 178.9 | -71.1 | 167.3 | 0 | 0 | 0 | 110.9 | K35 K208 F211 | K35-L37 PolarHBondContact O-N 2.86Å; L37-K208 HydrophobicContact CB-CD 4.34Å; L37-K208 HydrophobicContact CB-CG 4.08Å; L37-K208 HydrophobicContact CD1-CB 4.05Å; L37-K208 HydrophobicContact CD1-CG 3.84Å; L37-K208 HydrophobicContact CD2-CG 3.97Å; L37-K208 HydrophobicContact CG-CG 4.18Å; L37-K208 WeakPolarHBondContact O-CE 3.3Å; L37-K208 PolarHBondContact O-NZ 3.08Å; L37-F211 HydrophobicContact CD1-CB 4.43Å; L37-F211 HydrophobicContact CD1-CD1 3.43Å; L37-F211 VanDerWaalsContact CD1-CD1 3.43Å; L37-F211 HydrophobicContact CD1-CE1 3.9Å; L37-F211 HydrophobicContact CD1-CG 4.21Å; L37-F211 HydrophobicContact CD2-CD1 4.36Å; L37-F211 HydrophobicContact CD2-CG 4.49Å; L37-F211 HydrophobicContact CG-CD1 4.05Å; L37-F211 HydrophobicContact CG-CE1 4.18Å | ||
| 38 | V | 60.1 | Low | 63.5 | Low | 114 Ų | 114 | 116.3 Ų | 116.3 | 69% | 0.691 | 62% | 0.619 | S | S | * | * | trans | -70.4 | 132.3 | 176.1 | -174.9 | 0 | 0 | 0 | 0 | 108.8 | P36 S40 | P36-V38 HydrophobicContact CB-CG2 4.06Å; P36-V38 PolarHBondContact O-N 2.92Å; V38-S40 PolarHBondContact O-N 3.45Å | ||
| 39 | P | 61.3 | Low | 65.2 | Low | 36 Ų | 36 | 106.9 Ų | 106.9 | 23% | 0.234 | 58% | 0.579 | C | S | . | * | trans | -53.7 | 131.3 | 172.2 | -23.4 | 33.1 | 0 | 0 | 0 | 110.7 | R41 E196 | P39-R41 PolarHBondContact O-N 3.28Å; P39-E196 HydrophobicContact CG-CG 4.33Å | ||
| 40 | S | 63.3 | Low | 67.4 | Low | 90 Ų | 90 | 101.8 Ų | 101.8 | 63% | 0.629 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -72.6 | -18.8 | -175.3 | 81.9 | 0 | 0 | 0 | 0 | 112.8 | V38 E204 | V38-S40 PolarHBondContact O-N 3.45Å; S40-E204 VanDerWaalsContact CB-OE1 3.31Å; S40-E204 WeakPolarHBondContact CB-OE1 3.33Å; S40-E204 PolarHBondContact OG-OE1 2.98Å |
| 41 | R | 67.4 | Low | 69.7 | Low | 121 Ų | 121 | 104.6 Ų | 104.6 | 46% | 0.457 | 56% | 0.557 | S | S | . | * | trans | -109.7 | 145.2 | -179.7 | -63.5 | 178.9 | -179.7 | -168.9 | -2.7 | 109.4 | P39 V199 | P39-R41 PolarHBondContact O-N 3.28Å; R41-V199 HydrophobicContact CB-CG1 3.54Å; R41-V199 WeakPolarHBondContact O-CG1 3.24Å | ||
| 42 | T | 74.6 | Confident | 71.7 | Confident | 112 Ų | 112 | 103.9 Ų | 103.9 | 69% | 0.687 | 54% | 0.54 | S | S | * | . | trans | -120.9 | 0.9 | 177.1 | 52.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 43 | K | 79.2 | Confident | 73.7 | Confident | 160 Ų | 160 | 97.4 Ų | 97.4 | 70% | 0.696 | 51% | 0.505 | S | S | * | . | S | Bend | trans | -135.2 | 142.8 | -175.4 | -63.5 | -177.8 | -179.4 | 179.1 | 0 | 111.2 | T45 | K43-T45 PolarHBondContact O-N 3.16Š|
| 44 | L | 82.3 | Confident | 75.8 | Confident | 27 Ų | 27 | 95.6 Ų | 95.6 | 14% | 0.141 | 50% | 0.495 | C | S | . | . | trans | -72.1 | 124.2 | 174.6 | -58.8 | 163.5 | 0 | 0 | 0 | 109.7 | A49 K50 M53 F195 L198 V199 | L44-A49 HydrophobicContact CB-CB 4.48Å; L44-A49 HydrophobicContact CD2-CB 4.05Å; L44-K50 HydrophobicContact CB-CG 3.93Å; L44-K50 HydrophobicContact CD1-CG 4.46Å; L44-K50 WeakPolarHBondContact O-CE 3.29Å; L44-M53 HydrophobicContact CD1-CB 4.07Å; L44-M53 HydrophobicContact CD1-CG 3.57Å; L44-F195 HydrophobicContact CD1-CD2 4.04Å; L44-F195 HydrophobicContact CD1-CE2 3.97Å; L44-F195 HydrophobicContact CD2-CD2 4.08Å; L44-F195 HydrophobicContact CD2-CE2 4.15Å; L44-F195 HydrophobicContact CG-CD2 4.08Å; L44-F195 HydrophobicContact CG-CE2 3.78Å; L44-L198 HydrophobicContact CD2-CB 3.68Å; L44-V199 HydrophobicContact CD2-CG2 3.61Å; L44-V199 HydrophobicContact CG-CG2 4.27Å | ||
| 45 | T | 79.9 | Confident | 77.5 | Confident | 95 Ų | 95 | 95.4 Ų | 95.4 | 58% | 0.583 | 49% | 0.494 | S | S | * | . | trans | -98 | -28.4 | -174.5 | 48.9 | 0 | 0 | 0 | 0 | 112.9 | K43 | K43-T45 PolarHBondContact O-N 3.16Š| ||
| 46 | T | 85.3 | Confident | 79.1 | Confident | 67 Ų | 67 | 88.1 Ų | 88.1 | 41% | 0.411 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -92.5 | 149.2 | -178.7 | 60.4 | 0 | 0 | 0 | 0 | 112.3 | E48 A49 K50 | T46-E48 VanDerWaalsContact C-N 3.32Å; T46-A49 PolarHBondContact O-N 3.27Å; T46-A49 WeakPolarHBondContact OG1-CB 3.35Å; T46-A49 PolarHBondContact OG1-N 3.44Å; T46-K50 WeakPolarHBondContact O-CG 3.4Å; T46-K50 PolarHBondContact O-N 3.01Å; T46-K50 VanDerWaalsContact O-N 3.17Å |
| 47 | I | 85.9 | Confident | 80.8 | Confident | 134 Ų | 134 | 85.5 Ų | 85.5 | 69% | 0.687 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -69.3 | -37.4 | 179.4 | -61.2 | 171.9 | 0 | 0 | 0 | 109.6 | K50 R51 | I47-K50 PolarHBondContact O-N 3.48Å; I47-R51 WeakPolarHBondContact O-CB 3.49Å; I47-R51 PolarHBondContact O-N 3.49Å |
| 48 | E | 88 | Confident | 82.3 | Confident | 128 Ų | 128 | 85.8 Ų | 85.8 | 60% | 0.598 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -61.8 | -45.2 | 176.6 | -62.2 | 74.4 | -163.8 | 0 | 0 | 111.1 | T46 R51 I52 | T46-E48 VanDerWaalsContact C-N 3.32Å; E48-R51 PolarHBondContact O-N 2.92Å; E48-I52 VanDerWaalsContact O-CG1 3.26Å; E48-I52 WeakPolarHBondContact O-CG1 3.24Å; E48-I52 PolarHBondContact O-N 3.12Å |
| 49 | A | 85.4 | Confident | 83.8 | Confident | 3 Ų | 3 | 82.4 Ų | 82.4 | 3% | 0.025 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -67.1 | -39 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L44 T46 R51 I52 M53 L198 | L44-A49 HydrophobicContact CB-CB 4.48Å; L44-A49 HydrophobicContact CD2-CB 4.05Å; T46-A49 PolarHBondContact O-N 3.27Å; T46-A49 WeakPolarHBondContact OG1-CB 3.35Å; T46-A49 PolarHBondContact OG1-N 3.44Å; A49-R51 VanDerWaalsContact C-N 3.32Å; A49-R51 PolarHBondContact O-N 2.99Å; A49-I52 PolarHBondContact O-N 3.3Å; A49-M53 VanDerWaalsContact O-CG 3.32Å; A49-M53 WeakPolarHBondContact O-CG 3.26Å; A49-M53 PolarHBondContact O-N 3.35Å; A49-L198 HydrophobicContact CB-CB 4.2Å; A49-L198 HydrophobicContact CB-CD1 4.17Å; A49-L198 HydrophobicContact CB-CD2 4.01Å; A49-L198 HydrophobicContact CB-CG 4.36Å |
| 50 | K | 87.8 | Confident | 85.2 | Confident | 118 Ų | 118 | 81.2 Ų | 81.2 | 51% | 0.513 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.4 | -39.2 | 171.9 | -70.5 | 176.6 | -175.7 | 177.8 | 0 | 111.7 | L44 T46 I47 S54 | L44-K50 HydrophobicContact CB-CG 3.93Å; L44-K50 HydrophobicContact CD1-CG 4.46Å; L44-K50 WeakPolarHBondContact O-CE 3.29Å; T46-K50 WeakPolarHBondContact O-CG 3.4Å; T46-K50 PolarHBondContact O-N 3.01Å; T46-K50 VanDerWaalsContact O-N 3.17Å; I47-K50 PolarHBondContact O-N 3.48Å; K50-S54 VanDerWaalsContact O-CB 3.29Å; K50-S54 WeakPolarHBondContact O-CB 3.45Å; K50-S54 PolarHBondContact O-N 3.49Å |
| 51 | R | 89.8 | Confident | 86.4 | Confident | 179 Ų | 179 | 80.3 Ų | 80.3 | 68% | 0.675 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -67.6 | -44 | 177.2 | -172.9 | 176.6 | -178.1 | -177.6 | 0.7 | 112 | I47 E48 A49 M53 S54 I55 | I47-R51 WeakPolarHBondContact O-CB 3.49Å; I47-R51 PolarHBondContact O-N 3.49Å; E48-R51 PolarHBondContact O-N 2.92Å; A49-R51 VanDerWaalsContact C-N 3.32Å; A49-R51 PolarHBondContact O-N 2.99Å; R51-M53 VanDerWaalsContact C-N 3.33Å; R51-M53 PolarHBondContact O-N 3.17Å; R51-S54 PolarHBondContact O-N 3.29Å; R51-I55 HydrophobicContact CG-CD1 3.94Å; R51-I55 HydrophobicContact CG-CG1 4.47Å; R51-I55 VanDerWaalsContact O-CG1 3.25Å; R51-I55 WeakPolarHBondContact O-CG1 3.38Å; R51-I55 PolarHBondContact O-N 2.9Å |
| 52 | I | 90 | Very high | 87.5 | Confident | 80 Ų | 80 | 78.2 Ų | 78.2 | 41% | 0.41 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -58.3 | -47.7 | 175.9 | -70.2 | 164.1 | 0 | 0 | 0 | 110.2 | E48 A49 I55 L56 L198 | E48-I52 VanDerWaalsContact O-CG1 3.26Å; E48-I52 WeakPolarHBondContact O-CG1 3.24Å; E48-I52 PolarHBondContact O-N 3.12Å; A49-I52 PolarHBondContact O-N 3.3Å; I52-I55 PolarHBondContact O-N 3.29Å; I52-L56 PolarHBondContact O-N 2.94Å; I52-L198 HydrophobicContact CG2-CD1 4.17Å |
| 53 | M | 91 | Very high | 88.3 | Confident | 6 Ų | 6 | 74.6 Ų | 74.6 | 3% | 0.03 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -65 | -41.5 | 177.6 | -68.5 | -60.8 | -57.8 | 0 | 0 | 112.3 | L44 A49 R51 I55 L56 D57 R191 L194 F195 L198 | L44-M53 HydrophobicContact CD1-CB 4.07Å; L44-M53 HydrophobicContact CD1-CG 3.57Å; A49-M53 VanDerWaalsContact O-CG 3.32Å; A49-M53 WeakPolarHBondContact O-CG 3.26Å; A49-M53 PolarHBondContact O-N 3.35Å; R51-M53 VanDerWaalsContact C-N 3.33Å; R51-M53 PolarHBondContact O-N 3.17Å; M53-I55 PolarHBondContact O-N 3.38Å; M53-L56 PolarHBondContact O-N 3.45Å; M53-D57 WeakPolarHBondContact O-CB 3.25Å; M53-D57 VanDerWaalsContact O-CG 3.25Å; M53-D57 PolarHBondContact O-N 3.2Å; M53-R191 HydrophobicContact CE-CG 3.61Å; M53-L194 HydrophobicContact SD-CB 4.4Å; M53-F195 HydrophobicContact CE-CB 4.02Å; M53-F195 HydrophobicContact CE-CD2 4.21Å; M53-F195 HydrophobicContact SD-CB 4.34Å; M53-L198 HydrophobicContact CG-CD1 3.99Å; M53-L198 HydrophobicContact SD-CD1 4.03Å |
| 54 | S | 91 | Very high | 88.7 | Confident | 75 Ų | 75 | 68.8 Ų | 68.8 | 52% | 0.524 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -64 | -37.6 | 176.5 | 177.7 | 0 | 0 | 0 | 0 | 112.9 | K50 R51 L56 E58 | K50-S54 VanDerWaalsContact O-CB 3.29Å; K50-S54 WeakPolarHBondContact O-CB 3.45Å; K50-S54 PolarHBondContact O-N 3.49Å; R51-S54 PolarHBondContact O-N 3.29Å; S54-L56 VanDerWaalsContact C-N 3.33Å; S54-E58 VanDerWaalsContact O-CB 3.24Å; S54-E58 WeakPolarHBondContact O-CB 3.45Å; S54-E58 PolarHBondContact O-N 3.37Å |
| 55 | I | 92.7 | Very high | 88.9 | Confident | 102 Ų | 102 | 67.7 Ų | 67.7 | 52% | 0.523 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 174.8 | -69.8 | 164.7 | 0 | 0 | 0 | 110.2 | R51 I52 M53 E58 A59 | R51-I55 HydrophobicContact CG-CD1 3.94Å; R51-I55 HydrophobicContact CG-CG1 4.47Å; R51-I55 VanDerWaalsContact O-CG1 3.25Å; R51-I55 WeakPolarHBondContact O-CG1 3.38Å; R51-I55 PolarHBondContact O-N 2.9Å; I52-I55 PolarHBondContact O-N 3.29Å; M53-I55 PolarHBondContact O-N 3.38Å; I55-E58 PolarHBondContact O-N 3.48Å; I55-A59 WeakPolarHBondContact O-CB 3.43Å; I55-A59 PolarHBondContact O-N 3.43Å |
| 56 | L | 91.3 | Very high | 89.4 | Confident | 23 Ų | 23 | 65.7 Ų | 65.7 | 12% | 0.12 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -68.5 | -44.7 | 178.6 | -175.3 | 58.9 | 0 | 0 | 0 | 111.9 | I52 M53 S54 E58 A59 I60 R191 L194 | I52-L56 PolarHBondContact O-N 2.94Å; M53-L56 PolarHBondContact O-N 3.45Å; S54-L56 VanDerWaalsContact C-N 3.33Å; L56-E58 VanDerWaalsContact C-N 3.3Å; L56-E58 PolarHBondContact O-N 3.03Å; L56-A59 PolarHBondContact O-N 3Å; L56-I60 HydrophobicContact CD1-CD1 4.38Å; L56-I60 HydrophobicContact CG-CD1 4.09Å; L56-I60 VanDerWaalsContact O-CG1 3.28Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 2.66Å; L56-R191 HydrophobicContact CD2-CB 3.61Å; L56-R191 HydrophobicContact CD2-CG 3.81Å; L56-R191 HydrophobicContact CG-CB 4.23Å; L56-R191 HydrophobicContact CG-CG 4.23Å; L56-L194 HydrophobicContact CD2-CD1 3.76Å |
| 57 | D | 91.6 | Very high | 89.5 | Confident | 54 Ų | 54 | 63.7 Ų | 63.7 | 29% | 0.289 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -60.6 | -41 | 175.5 | -68.8 | -22.3 | 0 | 0 | 0 | 110.5 | M53 I60 N61 R191 | M53-D57 WeakPolarHBondContact O-CB 3.25Å; M53-D57 VanDerWaalsContact O-CG 3.25Å; M53-D57 PolarHBondContact O-N 3.2Å; D57-I60 PolarHBondContact O-N 2.82Å; D57-N61 WeakPolarHBondContact O-CB 3.38Å; D57-N61 PolarHBondContact O-N 3.03Å; D57-N61 PolarHBondContact O-ND2 2.88Å; D57-R191 IonicContact OD1-CZ 2.85Å; D57-R191 IonicContact OD1-NE 3.06Å; D57-R191 PolarHBondContact OD1-NE 2.97Å; D57-R191 IonicContact OD1-NH2 3.99Å; D57-R191 PolarHBondContact OD1-NH2 3.18Å; D57-R191 IonicContact OD2-NH2 2.71Å; D57-R191 PolarHBondContact OD2-NH2 2.69Å |
| 58 | E | 91.1 | Very high | 89.5 | Confident | 78 Ų | 78 | 57.4 Ų | 57.4 | 36% | 0.364 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67.1 | -36.9 | 174.7 | 179.7 | 65.5 | -174 | 0 | 0 | 112.9 | S54 I55 L56 K62 | S54-E58 VanDerWaalsContact O-CB 3.24Å; S54-E58 WeakPolarHBondContact O-CB 3.45Å; S54-E58 PolarHBondContact O-N 3.37Å; I55-E58 PolarHBondContact O-N 3.48Å; L56-E58 VanDerWaalsContact C-N 3.3Å; L56-E58 PolarHBondContact O-N 3.03Å; E58-K62 HydrophobicContact CG-CD 4.45Å; E58-K62 WeakPolarHBondContact O-CG 3.25Å; E58-K62 PolarHBondContact O-N 3.25Å; E58-K62 VanDerWaalsContact O-N 3.08Å; E58-K62 WeakPolarHBondContact OE1-CE 3.34Å; E58-K62 IonicContact OE1-NZ 3.81Å; E58-K62 PolarHBondContact OE1-NZ 3.25Å |
| 59 | A | 90.7 | Very high | 89.4 | Confident | 42 Ų | 42 | 51.8 Ų | 51.8 | 35% | 0.347 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -67.7 | -43.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | I55 L56 K62 V63 | I55-A59 WeakPolarHBondContact O-CB 3.43Å; I55-A59 PolarHBondContact O-N 3.43Å; L56-A59 PolarHBondContact O-N 3Å; A59-K62 PolarHBondContact O-N 3.29Å; A59-V63 VanDerWaalsContact O-CG2 3.3Å; A59-V63 WeakPolarHBondContact O-CG2 3.47Å; A59-V63 PolarHBondContact O-N 3.04Å |
| 60 | I | 90.4 | Very high | 89.3 | Confident | 12 Ų | 12 | 55.1 Ų | 55.1 | 6% | 0.062 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.2 | -50.4 | 174.8 | -69.4 | 166.4 | 0 | 0 | 0 | 109.6 | L56 D57 K62 V63 E64 L187 R191 | L56-I60 HydrophobicContact CD1-CD1 4.38Å; L56-I60 HydrophobicContact CG-CD1 4.09Å; L56-I60 VanDerWaalsContact O-CG1 3.28Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 2.66Å; D57-I60 PolarHBondContact O-N 2.82Å; I60-K62 VanDerWaalsContact C-N 3.3Å; I60-K62 PolarHBondContact O-N 3.06Å; I60-V63 PolarHBondContact O-N 2.66Å; I60-V63 VanDerWaalsContact O-N 3.16Å; I60-E64 HydrophobicContact CG2-CG 4.34Å; I60-E64 WeakPolarHBondContact O-CB 3.47Å; I60-E64 WeakPolarHBondContact O-CG 3.04Å; I60-E64 PolarHBondContact O-N 3.45Å; I60-L187 HydrophobicContact CD1-CB 4.21Å; I60-L187 HydrophobicContact CG1-CB 3.85Å; I60-L187 HydrophobicContact CG1-CD1 4.33Å; I60-R191 HydrophobicContact CD1-CB 4.06Å; I60-R191 HydrophobicContact CD1-CG 4.16Å |
| 61 | N | 89.9 | Confident | 89 | Confident | 70 Ų | 70 | 51.2 Ų | 51.2 | 37% | 0.374 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -55.8 | -42.2 | 177.3 | -72.9 | -18 | 0 | 0 | 0 | 112.9 | D57 L65 | D57-N61 WeakPolarHBondContact O-CB 3.38Å; D57-N61 PolarHBondContact O-N 3.03Å; D57-N61 PolarHBondContact O-ND2 2.88Å; N61-L65 WeakPolarHBondContact O-CG 3.44Å; N61-L65 PolarHBondContact O-N 2.75Å |
| 62 | K | 90.4 | Very high | 88.6 | Confident | 77 Ų | 77 | 42.8 Ų | 42.8 | 34% | 0.335 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -68.2 | -42.7 | 177.9 | -77.1 | 171.9 | 177.9 | 147.5 | 0 | 112.2 | E58 A59 I60 E64 L65 V66 | E58-K62 HydrophobicContact CG-CD 4.45Å; E58-K62 WeakPolarHBondContact O-CG 3.25Å; E58-K62 PolarHBondContact O-N 3.25Å; E58-K62 VanDerWaalsContact O-N 3.08Å; E58-K62 WeakPolarHBondContact OE1-CE 3.34Å; E58-K62 IonicContact OE1-NZ 3.81Å; E58-K62 PolarHBondContact OE1-NZ 3.25Å; A59-K62 PolarHBondContact O-N 3.29Å; I60-K62 VanDerWaalsContact C-N 3.3Å; I60-K62 PolarHBondContact O-N 3.06Å; K62-E64 VanDerWaalsContact C-N 3.33Å; K62-L65 PolarHBondContact O-N 2.83Å; K62-V66 WeakPolarHBondContact O-CG2 2.84Å; K62-V66 PolarHBondContact O-N 3.35Å |
| 63 | V | 89.6 | Confident | 88.2 | Confident | 36 Ų | 36 | 39.5 Ų | 39.5 | 22% | 0.218 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.4 | -42.6 | 176.3 | 170.1 | 0 | 0 | 0 | 0 | 110.5 | A59 I60 L65 V66 T67 F183 I184 L187 | A59-V63 VanDerWaalsContact O-CG2 3.3Å; A59-V63 WeakPolarHBondContact O-CG2 3.47Å; A59-V63 PolarHBondContact O-N 3.04Å; I60-V63 PolarHBondContact O-N 2.66Å; I60-V63 VanDerWaalsContact O-N 3.16Å; V63-L65 VanDerWaalsContact C-N 3.26Å; V63-L65 PolarHBondContact O-N 3.18Å; V63-V66 PolarHBondContact O-N 3.28Å; V63-T67 HydrophobicContact CG1-CG2 4.23Å; V63-T67 VanDerWaalsContact O-CG2 3.24Å; V63-T67 WeakPolarHBondContact O-CG2 3.42Å; V63-T67 PolarHBondContact O-N 3.39Å; V63-T67 PolarHBondContact O-OG1 3.16Å; V63-T67 VanDerWaalsContact O-OG1 3.06Å; V63-F183 HydrophobicContact CG1-CD1 3.74Å; V63-F183 HydrophobicContact CG1-CE1 3.7Å; V63-F183 HydrophobicContact CG2-CE1 4.25Å; V63-I184 HydrophobicContact CG1-CG1 4.12Å; V63-L187 HydrophobicContact CB-CD1 4.48Å; V63-L187 HydrophobicContact CG1-CD1 4.29Å; V63-L187 HydrophobicContact CG2-CD1 4.34Å |
| 64 | E | 88.6 | Confident | 87.6 | Confident | 39 Ų | 39 | 43.4 Ų | 43.4 | 18% | 0.182 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -57.5 | -36.6 | 175 | -78 | -178.1 | 167.4 | 0 | 0 | 113.3 | I60 K62 T67 L68 R176 I184 | I60-E64 HydrophobicContact CG2-CG 4.34Å; I60-E64 WeakPolarHBondContact O-CB 3.47Å; I60-E64 WeakPolarHBondContact O-CG 3.04Å; I60-E64 PolarHBondContact O-N 3.45Å; K62-E64 VanDerWaalsContact C-N 3.33Å; E64-T67 PolarHBondContact O-OG1 3.37Å; E64-L68 VanDerWaalsContact O-CD1 3.3Å; E64-L68 WeakPolarHBondContact O-CD1 3.48Å; E64-L68 WeakPolarHBondContact O-CG 3.38Å; E64-R176 PolarHBondContact O-NH2 3.16Å; E64-I184 HydrophobicContact CG-CD1 4.03Å; E64-I184 HydrophobicContact CG-CG1 4.37Å; E64-I184 HydrophobicContact CG-CG2 4.24Å |
| 65 | L | 87.6 | Confident | 86.9 | Confident | 4 Ų | 4 | 42.5 Ų | 42.5 | 2% | 0.021 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -75.8 | -41.9 | 176.6 | -69.9 | 171.1 | 0 | 0 | 0 | 112.3 | N61 K62 V63 T67 L68 L156 L160 A166 Q170 | N61-L65 WeakPolarHBondContact O-CG 3.44Å; N61-L65 PolarHBondContact O-N 2.75Å; K62-L65 PolarHBondContact O-N 2.83Å; V63-L65 VanDerWaalsContact C-N 3.26Å; V63-L65 PolarHBondContact O-N 3.18Å; L65-T67 VanDerWaalsContact C-N 3.33Å; L65-T67 PolarHBondContact O-N 3.31Å; L65-L68 PolarHBondContact O-N 3.2Å; L65-L156 HydrophobicContact CB-CD2 3.82Å; L65-L156 HydrophobicContact CD1-CD2 4.4Å; L65-L160 HydrophobicContact CD1-CD2 4.02Å; L65-A166 HydrophobicContact CD1-CB 4.47Å; L65-A166 HydrophobicContact CD2-CB 4.09Å; L65-Q170 HydrophobicContact CD2-CG 3.75Å; L65-Q170 HydrophobicContact CG-CG 4.5Å |
| 66 | V | 88.9 | Confident | 85.8 | Confident | 52 Ų | 52 | 42.6 Ų | 42.6 | 32% | 0.315 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.9 | -40.8 | 178.7 | 174.1 | 0 | 0 | 0 | 0 | 111.5 | K62 V63 L68 L69 T152 L156 | K62-V66 WeakPolarHBondContact O-CG2 2.84Å; K62-V66 PolarHBondContact O-N 3.35Å; V63-V66 PolarHBondContact O-N 3.28Å; V66-L68 PolarHBondContact O-N 3.04Å; V66-L68 VanDerWaalsContact O-N 3.13Å; V66-L69 HydrophobicContact CG1-CD1 4.38Å; V66-L69 WeakPolarHBondContact O-CB 3.43Å; V66-L69 WeakPolarHBondContact O-CG 3.45Å; V66-L69 PolarHBondContact O-N 3.2Å; V66-L69 VanDerWaalsContact O-N 3.08Å; V66-T152 HydrophobicContact CG1-CG2 4.12Å; V66-T152 HydrophobicContact CG2-CG2 3.67Å; V66-L156 HydrophobicContact CG2-CD1 3.64Å; V66-L156 HydrophobicContact CG2-CD2 3.84Å; V66-L156 HydrophobicContact CG2-CG 3.96Å |
| 67 | T | 87.5 | Confident | 84.6 | Confident | 26 Ų | 26 | 50.1 Ų | 50.1 | 16% | 0.16 | 27% | 0.269 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -14.3 | -179.9 | 53.9 | 0 | 0 | 0 | 0 | 113.8 | V63 E64 L65 R176 A180 I184 | V63-T67 HydrophobicContact CG1-CG2 4.23Å; V63-T67 VanDerWaalsContact O-CG2 3.24Å; V63-T67 WeakPolarHBondContact O-CG2 3.42Å; V63-T67 PolarHBondContact O-N 3.39Å; V63-T67 PolarHBondContact O-OG1 3.16Å; V63-T67 VanDerWaalsContact O-OG1 3.06Å; E64-T67 PolarHBondContact O-OG1 3.37Å; L65-T67 VanDerWaalsContact C-N 3.33Å; L65-T67 PolarHBondContact O-N 3.31Å; T67-R176 PolarHBondContact OG1-NE 2.92Å; T67-A180 HydrophobicContact CG2-CB 3.72Å; T67-I184 HydrophobicContact CG2-CD1 4.34Å |
| 68 | L | 86.8 | Confident | 83.5 | Confident | 2 Ų | 2 | 53.2 Ų | 53.2 | 1% | 0.01 | 29% | 0.285 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.6 | -8.2 | 177 | -65.4 | 167.7 | 0 | 0 | 0 | 113.1 | E64 L65 V66 S70 Y71 V72 L169 Q172 R176 | E64-L68 VanDerWaalsContact O-CD1 3.3Å; E64-L68 WeakPolarHBondContact O-CD1 3.48Å; E64-L68 WeakPolarHBondContact O-CG 3.38Å; L65-L68 PolarHBondContact O-N 3.2Å; V66-L68 PolarHBondContact O-N 3.04Å; V66-L68 VanDerWaalsContact O-N 3.13Å; L68-S70 VanDerWaalsContact C-N 3.3Å; L68-S70 PolarHBondContact O-N 2.85Å; L68-Y71 WeakPolarHBondContact O-CB 3.34Å; L68-Y71 PolarHBondContact O-N 3.14Å; L68-Y71 VanDerWaalsContact O-N 3.11Å; L68-V72 WeakPolarHBondContact O-CG2 3.48Å; L68-V72 PolarHBondContact O-N 2.88Å; L68-V72 VanDerWaalsContact O-N 3.16Å; L68-L169 HydrophobicContact CD1-CB 4.41Å; L68-L169 VanDerWaalsContact CD1-O 3.25Å; L68-L169 WeakPolarHBondContact CD1-O 3.45Å; L68-Q172 WeakPolarHBondContact CD2-O 3.35Å; L68-R176 HydrophobicContact CD2-CG 3.68Å; L68-R176 HydrophobicContact CG-CG 4.47Å |
| 69 | L | 86.3 | Confident | 82.5 | Confident | 9 Ų | 9 | 50 Ų | 50 | 5% | 0.047 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.2 | -33.4 | -177 | -63.7 | -178.7 | 0 | 0 | 0 | 113 | V66 Y71 V72 A73 V91 T152 V155 L159 | V66-L69 HydrophobicContact CG1-CD1 4.38Å; V66-L69 WeakPolarHBondContact O-CB 3.43Å; V66-L69 WeakPolarHBondContact O-CG 3.45Å; V66-L69 PolarHBondContact O-N 3.2Å; V66-L69 VanDerWaalsContact O-N 3.08Å; L69-Y71 VanDerWaalsContact C-N 3.3Å; L69-Y71 PolarHBondContact O-N 3.45Å; L69-V72 PolarHBondContact O-N 2.92Å; L69-A73 WeakPolarHBondContact O-CB 3.39Å; L69-A73 PolarHBondContact O-N 3.02Å; L69-V91 HydrophobicContact CD2-CG2 4.35Å; L69-T152 HydrophobicContact CD1-CG2 4.42Å; L69-V155 HydrophobicContact CD1-CG1 4.15Å; L69-V155 HydrophobicContact CD2-CG1 3.52Å; L69-V155 HydrophobicContact CG-CG1 4.5Å; L69-L159 HydrophobicContact CD2-CD1 4.08Å |
| 70 | S | 82.1 | Confident | 81.4 | Confident | 74 Ų | 74 | 52.4 Ų | 52.4 | 52% | 0.517 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -65.3 | -33.1 | 174.9 | 55.7 | 0 | 0 | 0 | 0 | 112.7 | L68 S74 | L68-S70 VanDerWaalsContact C-N 3.3Å; L68-S70 PolarHBondContact O-N 2.85Å; S70-S74 WeakPolarHBondContact O-CB 3.26Å; S70-S74 PolarHBondContact O-N 3.41Å; S70-S74 PolarHBondContact O-OG 3.46Å |
| 71 | Y | 82.2 | Confident | 80.3 | Confident | 36 Ų | 36 | 55.6 Ų | 55.6 | 14% | 0.141 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -69.5 | -44.1 | 174.6 | 168.7 | -102.5 | 0 | 0 | 0 | 111.4 | L68 L69 A73 S74 N75 V79 Q172 S175 | L68-Y71 WeakPolarHBondContact O-CB 3.34Å; L68-Y71 PolarHBondContact O-N 3.14Å; L68-Y71 VanDerWaalsContact O-N 3.11Å; L69-Y71 VanDerWaalsContact C-N 3.3Å; L69-Y71 PolarHBondContact O-N 3.45Å; Y71-A73 VanDerWaalsContact C-N 3.31Å; Y71-A73 PolarHBondContact O-N 2.71Å; Y71-S74 PolarHBondContact O-N 3.05Å; Y71-S74 VanDerWaalsContact O-N 3.17Å; Y71-N75 WeakPolarHBondContact CD2-ND2 3.4Å; Y71-N75 HydrophobicContact CE2-CB 4.16Å; Y71-N75 WeakPolarHBondContact CE2-ND2 3.35Å; Y71-N75 PolarHBondContact O-N 3.21Å; Y71-N75 PolarHBondContact O-ND2 3.37Å; Y71-N75 VanDerWaalsContact O-ND2 3.16Å; Y71-V79 HydrophobicContact CE1-CG2 4.23Å; Y71-Q172 HydrophobicContact CD1-CB 4.39Å; Y71-Q172 HydrophobicContact CE1-CB 3.99Å; Y71-Q172 HydrophobicContact CE1-CG 4.03Å; Y71-S175 WeakPolarHBondContact CD2-OG 3.46Å; Y71-S175 WeakPolarHBondContact CE2-OG 3.47Å; Y71-S175 VanDerWaalsContact CG-CB 3.42Å |
| 72 | V | 82.1 | Confident | 79.4 | Confident | 1 Ų | 1 | 55.7 Ų | 55.7 | 1% | 0.006 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -63 | -39.7 | 177.8 | 179.5 | 0 | 0 | 0 | 0 | 111.4 | L68 L69 S74 V79 L83 M88 V91 L169 | L68-V72 WeakPolarHBondContact O-CG2 3.48Å; L68-V72 PolarHBondContact O-N 2.88Å; L68-V72 VanDerWaalsContact O-N 3.16Å; L69-V72 PolarHBondContact O-N 2.92Å; V72-S74 VanDerWaalsContact C-N 3.31Å; V72-S74 PolarHBondContact O-N 3.49Å; V72-V79 HydrophobicContact CG1-CG1 3.98Å; V72-V79 HydrophobicContact CG2-CG1 4.38Å; V72-L83 HydrophobicContact CG1-CD1 3.53Å; V72-L83 HydrophobicContact CG2-CD1 4.18Å; V72-M88 HydrophobicContact CG1-SD 3.93Å; V72-V91 HydrophobicContact CB-CG1 4.25Å; V72-V91 HydrophobicContact CG1-CB 4.39Å; V72-V91 HydrophobicContact CG1-CG1 3.9Å; V72-V91 HydrophobicContact CG1-CG2 4.19Å; V72-L169 HydrophobicContact CG2-CD1 4.35Å; V72-L169 HydrophobicContact CG2-CD2 3.45Å; V72-L169 VanDerWaalsContact CG2-CD2 3.45Å |
| 73 | A | 79.8 | Confident | 78.6 | Confident | 11 Ų | 11 | 52.3 Ų | 52.3 | 9% | 0.091 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.1 | -38.9 | 174 | 0 | 0 | 0 | 0 | 0 | 113 | L69 Y71 R76 V91 E95 | L69-A73 WeakPolarHBondContact O-CB 3.39Å; L69-A73 PolarHBondContact O-N 3.02Å; Y71-A73 VanDerWaalsContact C-N 3.31Å; Y71-A73 PolarHBondContact O-N 2.71Å; A73-R76 WeakPolarHBondContact O-CG 3.32Å; A73-R76 PolarHBondContact O-NE 3.3Å; A73-R76 VanDerWaalsContact O-NE 3.08Å; A73-V91 HydrophobicContact CB-CG1 4.35Å; A73-E95 HydrophobicContact CB-CB 4.2Å; A73-E95 HydrophobicContact CB-CG 3.89Å; A73-E95 VanDerWaalsContact CB-OE2 3.31Å; A73-E95 WeakPolarHBondContact CB-OE2 3.25Å |
| 74 | S | 79.6 | Confident | 78.2 | Confident | 88 Ų | 88 | 52.2 Ų | 52.2 | 62% | 0.615 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -86.1 | -27.2 | -174.1 | -54.3 | 0 | 0 | 0 | 0 | 114.4 | S70 Y71 V72 | S70-S74 WeakPolarHBondContact O-CB 3.26Å; S70-S74 PolarHBondContact O-N 3.41Å; S70-S74 PolarHBondContact O-OG 3.46Å; Y71-S74 PolarHBondContact O-N 3.05Å; Y71-S74 VanDerWaalsContact O-N 3.17Å; V72-S74 VanDerWaalsContact C-N 3.31Å; V72-S74 PolarHBondContact O-N 3.49Å |
| 75 | N | 75.7 | Confident | 77.8 | Confident | 57 Ų | 57 | 56.1 Ų | 56.1 | 31% | 0.305 | 32% | 0.324 | S | S | . | . | trans | -117.4 | 71.1 | -175.1 | -61.2 | -76.3 | 0 | 0 | 0 | 110.8 | Y71 V79 | Y71-N75 WeakPolarHBondContact CD2-ND2 3.4Å; Y71-N75 HydrophobicContact CE2-CB 4.16Å; Y71-N75 WeakPolarHBondContact CE2-ND2 3.35Å; Y71-N75 PolarHBondContact O-N 3.21Å; Y71-N75 PolarHBondContact O-ND2 3.37Å; Y71-N75 VanDerWaalsContact O-ND2 3.16Å; N75-V79 WeakPolarHBondContact O-CB 3.3Å; N75-V79 WeakPolarHBondContact O-CG2 3.34Å | ||
| 76 | R | 69.4 | Low | 77.6 | Confident | 103 Ų | 103 | 61 Ų | 61 | 39% | 0.389 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -72.8 | -44 | -167.9 | -61.5 | -177.6 | 177.4 | -165.2 | -1.6 | 112.9 | A73 D78 V79 E80 M88 E95 | A73-R76 WeakPolarHBondContact O-CG 3.32Å; A73-R76 PolarHBondContact O-NE 3.3Å; A73-R76 VanDerWaalsContact O-NE 3.08Å; R76-D78 PolarHBondContact O-N 2.88Å; R76-V79 PolarHBondContact O-N 3.36Å; R76-E80 VanDerWaalsContact O-CB 3.29Å; R76-E80 WeakPolarHBondContact O-CB 3.29Å; R76-E80 PolarHBondContact O-N 2.84Å; R76-E80 VanDerWaalsContact O-N 3.08Å; R76-M88 HydrophobicContact CB-CE 4.25Å; R76-M88 HydrophobicContact CG-CE 4.43Å; R76-E95 IonicContact CZ-OE2 2.65Å; R76-E95 IonicContact NE-OE2 3.08Å; R76-E95 IonicContact NH2-OE1 3.48Å; R76-E95 IonicContact NH2-OE2 2.82Å; R76-E95 PolarHBondContact NH2-OE2 2.92Å |
| 77 | E | 67.6 | Low | 77.3 | Confident | 182 Ų | 182 | 59 Ų | 59 | 85% | 0.85 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -66.8 | -35.9 | -174.6 | -62.3 | -178.4 | -179.1 | 0 | 0 | 112.4 | V79 | E77-V79 VanDerWaalsContact C-N 3.35Å; E77-V79 PolarHBondContact O-N 3.31Å |
| 78 | D | 67 | Low | 77.1 | Confident | 118 Ų | 118 | 57.9 Ų | 57.9 | 63% | 0.631 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -77.3 | -20.9 | -178.1 | -65.1 | -32.6 | 0 | 0 | 0 | 113.5 | R76 | R76-D78 PolarHBondContact O-N 2.88Å |
| 79 | V | 69.8 | Low | 77.1 | Confident | 12 Ų | 12 | 62.9 Ų | 62.9 | 7% | 0.073 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -114.3 | -19.5 | -165.6 | -175.1 | 0 | 0 | 0 | 0 | 112.3 | Y71 V72 N75 R76 E77 G81 V82 L83 M88 L169 | Y71-V79 HydrophobicContact CE1-CG2 4.23Å; V72-V79 HydrophobicContact CG1-CG1 3.98Å; V72-V79 HydrophobicContact CG2-CG1 4.38Å; N75-V79 WeakPolarHBondContact O-CB 3.3Å; N75-V79 WeakPolarHBondContact O-CG2 3.34Å; R76-V79 PolarHBondContact O-N 3.36Å; E77-V79 VanDerWaalsContact C-N 3.35Å; E77-V79 PolarHBondContact O-N 3.31Å; V79-G81 PolarHBondContact O-N 2.96Å; V79-V82 PolarHBondContact O-N 3.39Å; V79-V82 VanDerWaalsContact O-N 3.15Å; V79-L83 HydrophobicContact CG1-CB 4.47Å; V79-L83 HydrophobicContact CG1-CD1 3.23Å; V79-L83 HydrophobicContact CG1-CD2 4.4Å; V79-L83 HydrophobicContact CG1-CG 3.43Å; V79-L83 VanDerWaalsContact CG1-CG 3.43Å; V79-L83 PolarHBondContact O-N 3.29Å; V79-M88 HydrophobicContact CG1-SD 4.39Å; V79-L169 HydrophobicContact CG1-CD2 4.32Å |
| 80 | E | 67.7 | Low | 77.1 | Confident | 91 Ų | 91 | 62.7 Ų | 62.7 | 43% | 0.425 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.4 | -38.4 | -178.9 | -173.3 | 158.6 | -139.1 | 0 | 0 | 113.5 | R76 V82 G84 M88 R92 | R76-E80 VanDerWaalsContact O-CB 3.29Å; R76-E80 WeakPolarHBondContact O-CB 3.29Å; R76-E80 PolarHBondContact O-N 2.84Å; R76-E80 VanDerWaalsContact O-N 3.08Å; E80-V82 PolarHBondContact O-N 2.9Å; E80-G84 PolarHBondContact O-N 3.48Å; E80-M88 HydrophobicContact CB-CE 4.26Å; E80-M88 HydrophobicContact CB-CG 4.32Å; E80-M88 HydrophobicContact CG-CG 4.29Å; E80-R92 IonicContact OE1-NH1 2.66Å |
| 81 | G | 68.7 | Low | 77.4 | Confident | 80 Ų | 80 | 59.4 Ų | 59.4 | 83% | 0.825 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -69 | -17.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | V79 | V79-G81 PolarHBondContact O-N 2.96Å |
| 82 | V | 70.4 | Confident | 77.6 | Confident | 72 Ų | 72 | 60.9 Ų | 60.9 | 44% | 0.436 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -105.5 | -37.2 | -172.4 | -179.9 | 0 | 0 | 0 | 0 | 112.3 | V79 E80 L168 | V79-V82 PolarHBondContact O-N 3.39Å; V79-V82 VanDerWaalsContact O-N 3.15Å; E80-V82 PolarHBondContact O-N 2.9Å; V82-L168 HydrophobicContact CG1-CB 4.17Å; V82-L168 HydrophobicContact CG1-CD1 3.44Å; V82-L168 VanDerWaalsContact CG1-CD1 3.44Å; V82-L168 HydrophobicContact CG1-CG 4.44Å |
| 83 | L | 74.6 | Confident | 77.9 | Confident | 5 Ų | 5 | 65.5 Ų | 65.5 | 3% | 0.026 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -89.5 | -19.2 | -177.6 | -61.5 | -172 | 0 | 0 | 0 | 114.1 | V72 V79 I87 M88 L159 A165 L169 | V72-L83 HydrophobicContact CG1-CD1 3.53Å; V72-L83 HydrophobicContact CG2-CD1 4.18Å; V79-L83 HydrophobicContact CG1-CB 4.47Å; V79-L83 HydrophobicContact CG1-CD1 3.23Å; V79-L83 HydrophobicContact CG1-CD2 4.4Å; V79-L83 HydrophobicContact CG1-CG 3.43Å; V79-L83 VanDerWaalsContact CG1-CG 3.43Å; V79-L83 PolarHBondContact O-N 3.29Å; L83-I87 HydrophobicContact CB-CB 4.15Å; L83-I87 HydrophobicContact CB-CG2 3.92Å; L83-I87 HydrophobicContact CD1-CG2 3.97Å; L83-I87 HydrophobicContact CG-CG2 4.47Å; L83-I87 WeakPolarHBondContact O-CB 3.32Å; L83-I87 WeakPolarHBondContact O-CD1 3.44Å; L83-M88 HydrophobicContact CB-CG 4.37Å; L83-M88 HydrophobicContact CB-SD 4.38Å; L83-M88 HydrophobicContact CD1-SD 4.09Å; L83-L159 HydrophobicContact CD2-CD2 4.49Å; L83-A165 HydrophobicContact CD2-CB 3.79Å; L83-L169 HydrophobicContact CD1-CD1 4.01Å; L83-L169 HydrophobicContact CD1-CD2 4.08Å; L83-L169 HydrophobicContact CD1-CG 4.41Å; L83-L169 HydrophobicContact CD2-CD1 3.61Å; L83-L169 HydrophobicContact CD2-CD2 4.02Å; L83-L169 HydrophobicContact CD2-CG 3.67Å; L83-L169 HydrophobicContact CG-CD1 4.48Å; L83-L169 HydrophobicContact CG-CD2 4.5Å |
| 84 | G | 80.1 | Confident | 78.4 | Confident | 34 Ų | 34 | 65.9 Ų | 65.9 | 35% | 0.351 | 35% | 0.352 | S | S | . | . | trans | 78.5 | 158.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | E80 D86 I87 M88 | E80-G84 PolarHBondContact O-N 3.48Å; G84-D86 VanDerWaalsContact C-N 3.33Å; G84-D86 PolarHBondContact O-N 3.43Å; G84-I87 PolarHBondContact O-N 2.91Å; G84-M88 WeakPolarHBondContact O-CG 3.17Å; G84-M88 PolarHBondContact O-N 3.18Å; G84-M88 VanDerWaalsContact O-N 3.13Å | ||
| 85 | E | 80 | Confident | 78.8 | Confident | 121 Ų | 121 | 63.4 Ų | 63.4 | 57% | 0.565 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -64.3 | -35.4 | -167.9 | -157.7 | -169.1 | 142 | 0 | 0 | 113.1 | M88 R89 | E85-M88 PolarHBondContact O-N 3.06Å; E85-R89 VanDerWaalsContact O-CB 3.24Å; E85-R89 WeakPolarHBondContact O-CB 3.29Å; E85-R89 PolarHBondContact O-N 3.33Å; E85-R89 IonicContact OE1-CZ 3.39Å; E85-R89 IonicContact OE1-NH2 3.66Å; E85-R89 PolarHBondContact OE1-NH2 3.41Å |
| 86 | D | 82.6 | Confident | 79.5 | Confident | 108 Ų | 108 | 64.8 Ų | 64.8 | 58% | 0.578 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -69 | -40.6 | -178.5 | -66.9 | -32.6 | 0 | 0 | 0 | 112.6 | G84 A90 | G84-D86 VanDerWaalsContact C-N 3.33Å; G84-D86 PolarHBondContact O-N 3.43Å; D86-A90 WeakPolarHBondContact O-CB 3.4Å; D86-A90 PolarHBondContact O-N 2.99Å |
| 87 | I | 84.1 | Confident | 80.4 | Confident | 9 Ų | 9 | 61.8 Ų | 61.8 | 5% | 0.046 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -69.5 | -44 | 176.1 | -70.8 | 164.1 | 0 | 0 | 0 | 109.5 | L83 G84 R89 A90 V91 L158 L159 N162 A165 | L83-I87 HydrophobicContact CB-CB 4.15Å; L83-I87 HydrophobicContact CB-CG2 3.92Å; L83-I87 HydrophobicContact CD1-CG2 3.97Å; L83-I87 HydrophobicContact CG-CG2 4.47Å; L83-I87 WeakPolarHBondContact O-CB 3.32Å; L83-I87 WeakPolarHBondContact O-CD1 3.44Å; G84-I87 PolarHBondContact O-N 2.91Å; I87-R89 VanDerWaalsContact C-N 3.32Å; I87-R89 PolarHBondContact O-N 2.94Å; I87-A90 PolarHBondContact O-N 3.06Å; I87-V91 HydrophobicContact CG2-CG2 4.29Å; I87-V91 VanDerWaalsContact O-CG2 3.29Å; I87-V91 WeakPolarHBondContact O-CG2 3.48Å; I87-V91 PolarHBondContact O-N 3.33Å; I87-L158 HydrophobicContact CG1-CB 3.76Å; I87-L159 HydrophobicContact CD1-CD2 4.14Å; I87-L159 HydrophobicContact CG2-CD2 3.8Å; I87-L159 HydrophobicContact CG2-CG 4.4Å; I87-N162 HydrophobicContact CD1-CB 4.37Å; I87-A165 HydrophobicContact CD1-CB 4.39Å |
| 88 | M | 83.1 | Confident | 81.4 | Confident | 3 Ų | 3 | 55 Ų | 55 | 2% | 0.015 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62 | -40 | 177 | -71.6 | -59.9 | -69.5 | 0 | 0 | 112 | V72 R76 V79 E80 L83 G84 E85 V91 R92 | V72-M88 HydrophobicContact CG1-SD 3.93Å; R76-M88 HydrophobicContact CB-CE 4.25Å; R76-M88 HydrophobicContact CG-CE 4.43Å; V79-M88 HydrophobicContact CG1-SD 4.39Å; E80-M88 HydrophobicContact CB-CE 4.26Å; E80-M88 HydrophobicContact CB-CG 4.32Å; E80-M88 HydrophobicContact CG-CG 4.29Å; L83-M88 HydrophobicContact CB-CG 4.37Å; L83-M88 HydrophobicContact CB-SD 4.38Å; L83-M88 HydrophobicContact CD1-SD 4.09Å; G84-M88 WeakPolarHBondContact O-CG 3.17Å; G84-M88 PolarHBondContact O-N 3.18Å; G84-M88 VanDerWaalsContact O-N 3.13Å; E85-M88 PolarHBondContact O-N 3.06Å; M88-V91 PolarHBondContact O-N 3.34Å; M88-R92 WeakPolarHBondContact O-CG 3.29Å; M88-R92 PolarHBondContact O-N 3.46Å |
| 89 | R | 85.7 | Confident | 82.5 | Confident | 106 Ų | 106 | 54.1 Ų | 54.1 | 40% | 0.4 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -61.2 | -47.8 | 174.4 | -170.9 | -177.6 | -57.5 | 165.2 | 4.1 | 111.5 | E85 I87 V91 R92 E93 | E85-R89 VanDerWaalsContact O-CB 3.24Å; E85-R89 WeakPolarHBondContact O-CB 3.29Å; E85-R89 PolarHBondContact O-N 3.33Å; E85-R89 IonicContact OE1-CZ 3.39Å; E85-R89 IonicContact OE1-NH2 3.66Å; E85-R89 PolarHBondContact OE1-NH2 3.41Å; I87-R89 VanDerWaalsContact C-N 3.32Å; I87-R89 PolarHBondContact O-N 2.94Å; R89-V91 VanDerWaalsContact C-N 3.33Å; R89-V91 PolarHBondContact O-N 2.87Å; R89-R92 WeakPolarHBondContact O-CB 3.39Å; R89-R92 PolarHBondContact O-N 3.37Å; R89-E93 WeakPolarHBondContact O-CG 3.33Å; R89-E93 PolarHBondContact O-N 3.16Å |
| 90 | A | 87.1 | Confident | 83.4 | Confident | 5 Ų | 5 | 57 Ų | 57 | 4% | 0.041 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -64.5 | -35.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | D86 I87 H94 V155 L158 | D86-A90 WeakPolarHBondContact O-CB 3.4Å; D86-A90 PolarHBondContact O-N 2.99Å; I87-A90 PolarHBondContact O-N 3.06Å; A90-H94 WeakPolarHBondContact O-CB 3.46Å; A90-H94 PolarHBondContact O-N 2.98Å; A90-V155 HydrophobicContact CB-CG2 3.87Å; A90-V155 WeakPolarHBondContact O-CG2 3.43Å; A90-L158 HydrophobicContact CB-CD1 3.65Å |
| 91 | V | 87.9 | Confident | 84.3 | Confident | 5 Ų | 5 | 54.6 Ų | 54.6 | 3% | 0.03 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -69.1 | -38.4 | 174.8 | 173.9 | 0 | 0 | 0 | 0 | 111.3 | L69 V72 A73 I87 M88 R89 H94 E95 V155 | L69-V91 HydrophobicContact CD2-CG2 4.35Å; V72-V91 HydrophobicContact CB-CG1 4.25Å; V72-V91 HydrophobicContact CG1-CB 4.39Å; V72-V91 HydrophobicContact CG1-CG1 3.9Å; V72-V91 HydrophobicContact CG1-CG2 4.19Å; A73-V91 HydrophobicContact CB-CG1 4.35Å; I87-V91 HydrophobicContact CG2-CG2 4.29Å; I87-V91 VanDerWaalsContact O-CG2 3.29Å; I87-V91 WeakPolarHBondContact O-CG2 3.48Å; I87-V91 PolarHBondContact O-N 3.33Å; M88-V91 PolarHBondContact O-N 3.34Å; R89-V91 VanDerWaalsContact C-N 3.33Å; R89-V91 PolarHBondContact O-N 2.87Å; V91-H94 WeakPolarHBondContact O-CB 3.44Å; V91-H94 PolarHBondContact O-N 2.89Å; V91-E95 WeakPolarHBondContact O-CB 3.36Å; V91-E95 PolarHBondContact O-N 3.39Å; V91-V155 HydrophobicContact CG2-CG1 3.77Å; V91-V155 HydrophobicContact CG2-CG2 4.29Å |
| 92 | R | 86.3 | Confident | 85.3 | Confident | 68 Ų | 68 | 55.7 Ų | 55.7 | 26% | 0.257 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -61.2 | -50 | 174 | -74.8 | -174.4 | -61.1 | -103.8 | 6.9 | 111.6 | E80 M88 R89 H94 E95 D96 | E80-R92 IonicContact OE1-NH1 2.66Å; M88-R92 WeakPolarHBondContact O-CG 3.29Å; M88-R92 PolarHBondContact O-N 3.46Å; R89-R92 WeakPolarHBondContact O-CB 3.39Å; R89-R92 PolarHBondContact O-N 3.37Å; R92-H94 PolarHBondContact O-N 3.46Å; R92-E95 WeakPolarHBondContact O-CB 3.18Å; R92-E95 PolarHBondContact O-N 3.03Å; R92-E95 VanDerWaalsContact O-N 3.09Å; R92-D96 VanDerWaalsContact O-CG 3.24Å; R92-D96 PolarHBondContact O-N 3.44Å |
| 93 | E | 88 | Confident | 86.1 | Confident | 98 Ų | 98 | 57.3 Ų | 57.3 | 46% | 0.458 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -58.8 | -37.6 | 175.6 | -69 | 169.2 | -170.6 | 0 | 0 | 111.6 | R89 L97 | R89-E93 WeakPolarHBondContact O-CG 3.33Å; R89-E93 PolarHBondContact O-N 3.16Å; E93-L97 VanDerWaalsContact O-CG 3.26Å; E93-L97 WeakPolarHBondContact O-CG 3.31Å; E93-L97 PolarHBondContact O-N 3.48Å |
| 94 | H | 90.3 | Very high | 86.7 | Confident | 18 Ų | 18 | 59.9 Ų | 59.9 | 8% | 0.083 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.3 | -42.8 | 174.6 | -171 | 59.3 | 0 | 0 | 0 | 112.9 | A90 V91 R92 L97 C98 S151 T152 V155 | A90-H94 WeakPolarHBondContact O-CB 3.46Å; A90-H94 PolarHBondContact O-N 2.98Å; V91-H94 WeakPolarHBondContact O-CB 3.44Å; V91-H94 PolarHBondContact O-N 2.89Å; R92-H94 PolarHBondContact O-N 3.46Å; H94-L97 PolarHBondContact O-N 2.84Å; H94-C98 WeakPolarHBondContact O-CB 3.04Å; H94-C98 PolarHBondContact O-N 2.67Å; H94-C98 PolarHBondContact O-SG 3.39Å; H94-S151 VanDerWaalsContact CA-OG 3.25Å; H94-S151 WeakPolarHBondContact CA-OG 3.29Å; H94-S151 WeakPolarHBondContact CB-OG 3.27Å; H94-S151 PolarHBondContact ND1-OG 2.98Å; H94-T152 PolarHBondContact CE1-OG1 3.41Å; H94-V155 HydrophobicContact CB-CG2 4.18Å |
| 95 | E | 89.8 | Confident | 87 | Confident | 37 Ų | 37 | 60.4 Ų | 60.4 | 17% | 0.173 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -64.6 | -46.1 | 178 | -170.4 | -171.2 | 169.9 | 0 | 0 | 111 | A73 R76 V91 R92 L97 C98 Q99 | A73-E95 HydrophobicContact CB-CB 4.2Å; A73-E95 HydrophobicContact CB-CG 3.89Å; A73-E95 VanDerWaalsContact CB-OE2 3.31Å; A73-E95 WeakPolarHBondContact CB-OE2 3.25Å; R76-E95 IonicContact CZ-OE2 2.65Å; R76-E95 IonicContact NE-OE2 3.08Å; R76-E95 IonicContact NH2-OE1 3.48Å; R76-E95 IonicContact NH2-OE2 2.82Å; R76-E95 PolarHBondContact NH2-OE2 2.92Å; V91-E95 WeakPolarHBondContact O-CB 3.36Å; V91-E95 PolarHBondContact O-N 3.39Å; R92-E95 WeakPolarHBondContact O-CB 3.18Å; R92-E95 PolarHBondContact O-N 3.03Å; R92-E95 VanDerWaalsContact O-N 3.09Å; E95-L97 VanDerWaalsContact C-N 3.31Å; E95-L97 PolarHBondContact O-N 3.27Å; E95-C98 CarbonylContact O-C 3.19Å; E95-C98 WeakPolarHBondContact O-CA 2.89Å; E95-C98 WeakPolarHBondContact O-CB 3.34Å; E95-C98 PolarHBondContact O-N 3.48Å; E95-Q99 HydrophobicContact CG-CG 4.45Å; E95-Q99 WeakPolarHBondContact O-CG 3.48Å; E95-Q99 PolarHBondContact O-N 2.98Å; E95-Q99 PolarHBondContact OE1-NE2 3.17Å |
| 96 | D | 89.1 | Confident | 87.4 | Confident | 85 Ų | 85 | 62.4 Ų | 62.4 | 46% | 0.455 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.1 | -44.9 | 178.4 | -65.8 | -23.9 | 0 | 0 | 0 | 110.7 | R92 C98 Q99 V100 | R92-D96 VanDerWaalsContact O-CG 3.24Å; R92-D96 PolarHBondContact O-N 3.44Å; D96-C98 PolarHBondContact O-N 2.97Å; D96-Q99 PolarHBondContact O-N 2.49Å; D96-V100 VanDerWaalsContact O-CG2 3.27Å; D96-V100 WeakPolarHBondContact O-CG2 3.34Å; D96-V100 PolarHBondContact O-N 3.09Å |
| 97 | L | 89.2 | Confident | 87.5 | Confident | 41 Ų | 41 | 59.4 Ų | 59.4 | 22% | 0.215 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.6 | -41.3 | 174.5 | -69.4 | 171.3 | 0 | 0 | 0 | 112.2 | E93 H94 E95 V100 L101 L144 Q147 I148 | E93-L97 VanDerWaalsContact O-CG 3.26Å; E93-L97 WeakPolarHBondContact O-CG 3.31Å; E93-L97 PolarHBondContact O-N 3.48Å; H94-L97 PolarHBondContact O-N 2.84Å; E95-L97 VanDerWaalsContact C-N 3.31Å; E95-L97 PolarHBondContact O-N 3.27Å; L97-V100 PolarHBondContact O-N 2.95Å; L97-L101 PolarHBondContact O-N 3.28Å; L97-L144 HydrophobicContact CD2-CD1 4.01Å; L97-Q147 HydrophobicContact CD1-CB 4.32Å; L97-Q147 HydrophobicContact CD2-CB 4.43Å; L97-I148 HydrophobicContact CB-CG1 3.79Å |
| 98 | C | 88.3 | Confident | 87.6 | Confident | 39 Ų | 39 | 59.4 Ų | 59.4 | 26% | 0.264 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.8 | -41.3 | 175.9 | -71.5 | 0 | 0 | 0 | 0 | 111.9 | H94 E95 D96 L101 L102 | H94-C98 WeakPolarHBondContact O-CB 3.04Å; H94-C98 PolarHBondContact O-N 2.67Å; H94-C98 PolarHBondContact O-SG 3.39Å; E95-C98 CarbonylContact O-C 3.19Å; E95-C98 WeakPolarHBondContact O-CA 2.89Å; E95-C98 WeakPolarHBondContact O-CB 3.34Å; E95-C98 PolarHBondContact O-N 3.48Å; D96-C98 PolarHBondContact O-N 2.97Å; C98-L101 PolarHBondContact O-N 3.42Å; C98-L102 VanDerWaalsContact O-CG 3.31Å; C98-L102 WeakPolarHBondContact O-CG 3.49Å; C98-L102 PolarHBondContact O-N 3.01Å |
| 99 | Q | 89.3 | Confident | 87.7 | Confident | 99 Ų | 99 | 65.8 Ų | 65.8 | 46% | 0.463 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -64.2 | -44.5 | 176.5 | -70.6 | -179.2 | 17.2 | 0 | 0 | 111.2 | E95 D96 L101 L102 E103 | E95-Q99 HydrophobicContact CG-CG 4.45Å; E95-Q99 WeakPolarHBondContact O-CG 3.48Å; E95-Q99 PolarHBondContact O-N 2.98Å; E95-Q99 PolarHBondContact OE1-NE2 3.17Å; D96-Q99 PolarHBondContact O-N 2.49Å; Q99-L101 VanDerWaalsContact C-N 3.3Å; Q99-L101 PolarHBondContact O-N 3.34Å; Q99-L102 PolarHBondContact O-N 3.3Å; Q99-E103 WeakPolarHBondContact O-CB 3.32Å; Q99-E103 PolarHBondContact O-N 3.18Å |
| 100 | V | 89.1 | Confident | 87.6 | Confident | 73 Ų | 73 | 64.2 Ų | 64.2 | 44% | 0.442 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.2 | -40.5 | 174.9 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | D96 L97 N104 L144 | D96-V100 VanDerWaalsContact O-CG2 3.27Å; D96-V100 WeakPolarHBondContact O-CG2 3.34Å; D96-V100 PolarHBondContact O-N 3.09Å; L97-V100 PolarHBondContact O-N 2.95Å; V100-N104 WeakPolarHBondContact O-CB 3.37Å; V100-N104 PolarHBondContact O-N 2.85Å; V100-N104 PolarHBondContact O-ND2 3.37Å; V100-L144 HydrophobicContact CG1-CD1 4.36Å; V100-L144 HydrophobicContact CG1-CD2 3.93Å |
| 101 | L | 87.6 | Confident | 87.4 | Confident | 41 Ų | 41 | 65.7 Ų | 65.7 | 22% | 0.215 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -65.3 | -46.6 | 175.7 | -179.7 | 71.5 | 0 | 0 | 0 | 111.6 | L97 C98 Q99 E103 N104 V105 L141 L144 I148 | L97-L101 PolarHBondContact O-N 3.28Å; C98-L101 PolarHBondContact O-N 3.42Å; Q99-L101 VanDerWaalsContact C-N 3.3Å; Q99-L101 PolarHBondContact O-N 3.34Å; L101-E103 VanDerWaalsContact C-N 3.3Å; L101-E103 PolarHBondContact O-N 3.27Å; L101-N104 PolarHBondContact O-N 3.4Å; L101-V105 HydrophobicContact CD1-CG2 4.25Å; L101-V105 HydrophobicContact CG-CG2 4.32Å; L101-V105 WeakPolarHBondContact O-CB 3.37Å; L101-V105 VanDerWaalsContact O-CG2 3.23Å; L101-V105 WeakPolarHBondContact O-CG2 3.26Å; L101-V105 PolarHBondContact O-N 3.24Å; L101-L141 HydrophobicContact CD1-CD2 4.01Å; L101-L144 HydrophobicContact CB-CD2 3.79Å; L101-L144 HydrophobicContact CB-CG 4.22Å; L101-L144 HydrophobicContact CD1-CD2 3.79Å; L101-L144 HydrophobicContact CD1-CG 4.14Å; L101-L144 HydrophobicContact CG-CD2 4.44Å; L101-I148 HydrophobicContact CB-CD1 3.58Å; L101-I148 HydrophobicContact CD2-CD1 3.45Å; L101-I148 VanDerWaalsContact CD2-CD1 3.45Å; L101-I148 HydrophobicContact CG-CD1 4.01Å |
| 102 | L | 88 | Confident | 87 | Confident | 102 Ų | 102 | 68.5 Ų | 68.5 | 53% | 0.534 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | 178.9 | -74.3 | 172.5 | 0 | 0 | 0 | 111.5 | C98 Q99 V105 R106 | C98-L102 VanDerWaalsContact O-CG 3.31Å; C98-L102 WeakPolarHBondContact O-CG 3.49Å; C98-L102 PolarHBondContact O-N 3.01Å; Q99-L102 PolarHBondContact O-N 3.3Å; L102-V105 PolarHBondContact O-N 2.91Å; L102-R106 WeakPolarHBondContact O-CB 3.5Å; L102-R106 VanDerWaalsContact O-CG 3.29Å; L102-R106 WeakPolarHBondContact O-CG 3.33Å; L102-R106 PolarHBondContact O-N 3.23Å |
| 103 | E | 88.4 | Confident | 86.8 | Confident | 107 Ų | 107 | 70.2 Ų | 70.2 | 50% | 0.5 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -68.5 | -43.2 | 178.3 | -166.6 | 54.7 | -146.2 | 0 | 0 | 111.8 | Q99 L101 V105 R106 C107 | Q99-E103 WeakPolarHBondContact O-CB 3.32Å; Q99-E103 PolarHBondContact O-N 3.18Å; L101-E103 VanDerWaalsContact C-N 3.3Å; L101-E103 PolarHBondContact O-N 3.27Å; E103-V105 VanDerWaalsContact C-N 3.31Å; E103-V105 PolarHBondContact O-N 3.4Å; E103-R106 PolarHBondContact O-N 3.08Å; E103-R106 IonicContact OE2-NH1 2.93Å; E103-C107 WeakPolarHBondContact O-CB 3.19Å; E103-C107 PolarHBondContact O-N 2.83Å |
| 104 | N | 86.1 | Confident | 86.4 | Confident | 58 Ų | 58 | 68.3 Ų | 68.3 | 31% | 0.31 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 174.1 | -74.3 | -24.8 | 0 | 0 | 0 | 112.1 | V100 L101 L108 L141 | V100-N104 WeakPolarHBondContact O-CB 3.37Å; V100-N104 PolarHBondContact O-N 2.85Å; V100-N104 PolarHBondContact O-ND2 3.37Å; L101-N104 PolarHBondContact O-N 3.4Å; N104-L108 WeakPolarHBondContact O-CB 3.27Å; N104-L108 WeakPolarHBondContact O-CG 3.18Å; N104-L108 PolarHBondContact O-N 3.31Å; N104-L141 HydrophobicContact CB-CD2 3.77Å |
| 105 | V | 87.1 | Confident | 85.6 | Confident | 45 Ų | 45 | 68.3 Ų | 68.3 | 27% | 0.273 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -69.1 | -39.5 | 176.6 | 170.3 | 0 | 0 | 0 | 0 | 111.5 | L101 L102 E103 L108 K109 L141 | L101-V105 HydrophobicContact CD1-CG2 4.25Å; L101-V105 HydrophobicContact CG-CG2 4.32Å; L101-V105 WeakPolarHBondContact O-CB 3.37Å; L101-V105 VanDerWaalsContact O-CG2 3.23Å; L101-V105 WeakPolarHBondContact O-CG2 3.26Å; L101-V105 PolarHBondContact O-N 3.24Å; L102-V105 PolarHBondContact O-N 2.91Å; E103-V105 VanDerWaalsContact C-N 3.31Å; E103-V105 PolarHBondContact O-N 3.4Å; V105-L108 PolarHBondContact O-N 2.94Å; V105-K109 HydrophobicContact CG1-CD 4.3Å; V105-K109 WeakPolarHBondContact O-CB 3.43Å; V105-K109 WeakPolarHBondContact O-CG 3.45Å; V105-K109 PolarHBondContact O-N 2.95Å; V105-L141 HydrophobicContact CG2-CD1 4.26Å; V105-L141 HydrophobicContact CG2-CD2 4.49Å |
| 106 | R | 87.8 | Confident | 84.7 | Confident | 163 Ų | 163 | 73.5 Ų | 73.5 | 62% | 0.615 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -62.4 | -47.6 | 173.6 | -77.4 | 173.3 | -178.7 | 176.7 | 0.1 | 111.2 | L102 E103 L108 K109 E110 | L102-R106 WeakPolarHBondContact O-CB 3.5Å; L102-R106 VanDerWaalsContact O-CG 3.29Å; L102-R106 WeakPolarHBondContact O-CG 3.33Å; L102-R106 PolarHBondContact O-N 3.23Å; E103-R106 PolarHBondContact O-N 3.08Å; E103-R106 IonicContact OE2-NH1 2.93Å; R106-L108 VanDerWaalsContact C-N 3.32Å; R106-L108 PolarHBondContact O-N 3.37Å; R106-K109 PolarHBondContact O-N 3.44Å; R106-E110 WeakPolarHBondContact O-CB 3.35Å; R106-E110 PolarHBondContact O-N 2.78Å |
| 107 | C | 85.8 | Confident | 83.9 | Confident | 46 Ų | 46 | 75 Ų | 75 | 31% | 0.311 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -58.3 | -44.9 | 176 | -175.6 | 0 | 0 | 0 | 0 | 111.3 | E103 E110 K111 | E103-C107 WeakPolarHBondContact O-CB 3.19Å; E103-C107 PolarHBondContact O-N 2.83Å; C107-E110 PolarHBondContact O-N 3.32Å; C107-K111 VanDerWaalsContact O-CG 3.3Å; C107-K111 WeakPolarHBondContact O-CG 3.41Å; C107-K111 PolarHBondContact O-N 3.32Å |
| 108 | L | 85.8 | Confident | 82.6 | Confident | 8 Ų | 8 | 77.3 Ų | 77.3 | 4% | 0.042 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.2 | -48.8 | 175.8 | -84.1 | 169.4 | 0 | 0 | 0 | 112.5 | N104 V105 R106 E110 K111 E112 I134 Q137 K138 L141 | N104-L108 WeakPolarHBondContact O-CB 3.27Å; N104-L108 WeakPolarHBondContact O-CG 3.18Å; N104-L108 PolarHBondContact O-N 3.31Å; V105-L108 PolarHBondContact O-N 2.94Å; R106-L108 VanDerWaalsContact C-N 3.32Å; R106-L108 PolarHBondContact O-N 3.37Å; L108-E110 VanDerWaalsContact C-N 3.28Å; L108-E110 PolarHBondContact O-N 2.93Å; L108-K111 PolarHBondContact O-N 3.43Å; L108-K111 VanDerWaalsContact O-N 3.15Å; L108-E112 WeakPolarHBondContact O-CB 3.3Å; L108-E112 WeakPolarHBondContact O-CG 3.29Å; L108-E112 PolarHBondContact O-N 2.95Å; L108-I134 HydrophobicContact CD2-CG2 4.15Å; L108-Q137 HydrophobicContact CD1-CB 4.39Å; L108-Q137 HydrophobicContact CD2-CB 3.45Å; L108-Q137 VanDerWaalsContact CD2-CB 3.45Å; L108-Q137 HydrophobicContact CG-CB 4.12Å; L108-K138 HydrophobicContact CD1-CG 4.43Å; L108-K138 HydrophobicContact CD2-CG 4.3Å; L108-L141 HydrophobicContact CD1-CD1 3.47Å; L108-L141 VanDerWaalsContact CD1-CD1 3.47Å; L108-L141 HydrophobicContact CD1-CD2 3.97Å; L108-L141 HydrophobicContact CD1-CG 3.79Å |
| 109 | K | 85.1 | Confident | 81 | Confident | 138 Ų | 138 | 81.9 Ų | 81.9 | 60% | 0.6 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -59.8 | -39.6 | 177.7 | -77.3 | -179.3 | 176.9 | -174.7 | 0 | 112.2 | V105 R106 E112 R113 | V105-K109 HydrophobicContact CG1-CD 4.3Å; V105-K109 WeakPolarHBondContact O-CB 3.43Å; V105-K109 WeakPolarHBondContact O-CG 3.45Å; V105-K109 PolarHBondContact O-N 2.95Å; R106-K109 PolarHBondContact O-N 3.44Å; K109-E112 PolarHBondContact O-N 2.88Å; K109-R113 WeakPolarHBondContact O-CB 3.34Å; K109-R113 PolarHBondContact O-N 2.97Å |
| 110 | E | 84.4 | Confident | 79.4 | Confident | 73 Ų | 73 | 86.2 Ų | 86.2 | 34% | 0.341 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -67 | -40 | 176.8 | -179.3 | 54.8 | -156 | 0 | 0 | 111.4 | R106 C107 L108 R113 Q114 | R106-E110 WeakPolarHBondContact O-CB 3.35Å; R106-E110 PolarHBondContact O-N 2.78Å; C107-E110 PolarHBondContact O-N 3.32Å; L108-E110 VanDerWaalsContact C-N 3.28Å; L108-E110 PolarHBondContact O-N 2.93Å; E110-R113 VanDerWaalsContact CD-NH2 3.32Å; E110-R113 PolarHBondContact O-N 2.89Å; E110-R113 IonicContact OE1-CZ 2.85Å; E110-R113 IonicContact OE1-NE 3.33Å; E110-R113 IonicContact OE1-NH2 3.99Å; E110-R113 PolarHBondContact OE1-NH2 3.41Å; E110-R113 IonicContact OE2-CZ 3.43Å; E110-R113 IonicContact OE2-NE 3.59Å; E110-R113 PolarHBondContact OE2-NE 2.94Å; E110-R113 IonicContact OE2-NH2 3.83Å; E110-R113 PolarHBondContact OE2-NH2 3.17Å; E110-Q114 WeakPolarHBondContact O-CB 3.33Å; E110-Q114 WeakPolarHBondContact O-CG 3.44Å; E110-Q114 PolarHBondContact O-N 2.87Å; E110-Q114 PolarHBondContact OE1-NE2 3.45Å |
| 111 | K | 81.8 | Confident | 77.9 | Confident | 35 Ų | 35 | 86.5 Ų | 86.5 | 15% | 0.152 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -66.9 | -36.7 | 173.7 | -70.3 | -176.8 | 177.7 | -176.8 | 0 | 113.1 | C107 L108 L115 I134 Q137 | C107-K111 VanDerWaalsContact O-CG 3.3Å; C107-K111 WeakPolarHBondContact O-CG 3.41Å; C107-K111 PolarHBondContact O-N 3.32Å; L108-K111 PolarHBondContact O-N 3.43Å; L108-K111 VanDerWaalsContact O-N 3.15Å; K111-L115 PolarHBondContact O-N 3.45Å; K111-L115 VanDerWaalsContact O-N 3.08Å; K111-I134 HydrophobicContact CB-CD1 4Å; K111-I134 HydrophobicContact CB-CG1 4.07Å; K111-Q137 VanDerWaalsContact CD-OE1 3.3Å |
| 112 | E | 80.9 | Confident | 76.3 | Confident | 65 Ų | 65 | 92.5 Ų | 92.5 | 30% | 0.304 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -67.9 | -42 | 175 | -73.1 | 177.6 | 152.5 | 0 | 0 | 111.4 | L108 K109 L115 Q116 I134 K138 | L108-E112 WeakPolarHBondContact O-CB 3.3Å; L108-E112 WeakPolarHBondContact O-CG 3.29Å; L108-E112 PolarHBondContact O-N 2.95Å; K109-E112 PolarHBondContact O-N 2.88Å; E112-L115 WeakPolarHBondContact O-CB 3.4Å; E112-L115 PolarHBondContact O-N 3.43Å; E112-Q116 PolarHBondContact O-N 2.94Å; E112-I134 HydrophobicContact CG-CD1 4.13Å; E112-I134 HydrophobicContact CG-CG2 4.19Å; E112-K138 WeakPolarHBondContact OE1-CE 3.28Å; E112-K138 IonicContact OE1-NZ 3.64Å; E112-K138 PolarHBondContact OE1-NZ 3.24Å |
| 113 | R | 81.2 | Confident | 74.9 | Confident | 104 Ų | 104 | 95.5 Ų | 95.5 | 39% | 0.392 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62 | -45.6 | 174.1 | -174.2 | -175.5 | 73.1 | 86.7 | 1.9 | 111.7 | K109 E110 L115 Q116 E117 | K109-R113 WeakPolarHBondContact O-CB 3.34Å; K109-R113 PolarHBondContact O-N 2.97Å; E110-R113 VanDerWaalsContact CD-NH2 3.32Å; E110-R113 PolarHBondContact O-N 2.89Å; E110-R113 IonicContact OE1-CZ 2.85Å; E110-R113 IonicContact OE1-NE 3.33Å; E110-R113 IonicContact OE1-NH2 3.99Å; E110-R113 PolarHBondContact OE1-NH2 3.41Å; E110-R113 IonicContact OE2-CZ 3.43Å; E110-R113 IonicContact OE2-NE 3.59Å; E110-R113 PolarHBondContact OE2-NE 2.94Å; E110-R113 IonicContact OE2-NH2 3.83Å; E110-R113 PolarHBondContact OE2-NH2 3.17Å; R113-L115 VanDerWaalsContact C-N 3.29Å; R113-L115 PolarHBondContact O-N 3.01Å; R113-Q116 PolarHBondContact O-N 3.26Å; R113-E117 WeakPolarHBondContact CG-OE1 2.97Å; R113-E117 IonicContact CZ-OE1 2.87Å; R113-E117 IonicContact CZ-OE2 3.82Å; R113-E117 IonicContact NH1-OE1 3.71Å; R113-E117 PolarHBondContact NH1-OE1 3.45Å; R113-E117 IonicContact NH1-OE2 3.84Å; R113-E117 PolarHBondContact NH1-OE2 3.49Å; R113-E117 WeakPolarHBondContact O-CG 3.33Å; R113-E117 PolarHBondContact O-N 2.84Å |
| 114 | Q | 78.9 | Confident | 73.6 | Confident | 58 Ų | 58 | 96.8 Ų | 96.8 | 27% | 0.271 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.9 | -35.5 | 176.1 | -73.7 | 170.1 | 7.8 | 0 | 0 | 112.4 | E110 Q118 | E110-Q114 WeakPolarHBondContact O-CB 3.33Å; E110-Q114 WeakPolarHBondContact O-CG 3.44Å; E110-Q114 PolarHBondContact O-N 2.87Å; E110-Q114 PolarHBondContact OE1-NE2 3.45Å; Q114-Q118 VanDerWaalsContact O-CB 3.28Å; Q114-Q118 WeakPolarHBondContact O-CB 3.4Å; Q114-Q118 VanDerWaalsContact O-CG 3.28Å; Q114-Q118 WeakPolarHBondContact O-CG 3.16Å; Q114-Q118 PolarHBondContact O-N 2.67Å; Q114-Q118 VanDerWaalsContact O-N 3.14Å |
| 115 | L | 74.8 | Confident | 72.6 | Confident | 17 Ų | 17 | 96 Ų | 96 | 9% | 0.089 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -65.8 | -44.7 | 172.2 | -84.9 | -172.4 | 0 | 0 | 0 | 112 | K111 E112 R113 E117 Q118 E119 W126 L127 R130 L131 I134 | K111-L115 PolarHBondContact O-N 3.45Å; K111-L115 VanDerWaalsContact O-N 3.08Å; E112-L115 WeakPolarHBondContact O-CB 3.4Å; E112-L115 PolarHBondContact O-N 3.43Å; R113-L115 VanDerWaalsContact C-N 3.29Å; R113-L115 PolarHBondContact O-N 3.01Å; L115-E117 VanDerWaalsContact C-N 3.31Å; L115-E117 PolarHBondContact O-N 3.48Å; L115-Q118 PolarHBondContact O-N 2.87Å; L115-E119 WeakPolarHBondContact O-CG 3.26Å; L115-E119 PolarHBondContact O-N 3.28Å; L115-W126 HydrophobicContact CD2-CZ3 4.36Å; L115-L127 HydrophobicContact CD2-CD2 4.3Å; L115-R130 HydrophobicContact CD1-CG 4.11Å; L115-R130 HydrophobicContact CD2-CB 3.94Å; L115-R130 HydrophobicContact CD2-CG 3.41Å; L115-R130 VanDerWaalsContact CD2-CG 3.41Å; L115-R130 HydrophobicContact CG-CG 3.81Å; L115-L131 HydrophobicContact CD1-CD2 4.13Å; L115-L131 HydrophobicContact CD1-CG 4.41Å; L115-I134 HydrophobicContact CD1-CD1 3.22Å; L115-I134 HydrophobicContact CD1-CG1 4.47Å; L115-I134 HydrophobicContact CG-CD1 3.96Å |
| 116 | Q | 70.2 | Confident | 71.6 | Confident | 146 Ų | 146 | 100 Ų | 100 | 68% | 0.682 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -64.6 | -32 | 177.5 | -90.6 | 172.3 | -38.3 | 0 | 0 | 113.5 | E112 R113 | E112-Q116 PolarHBondContact O-N 2.94Å; R113-Q116 PolarHBondContact O-N 3.26Å |
| 117 | E | 71.2 | Confident | 70.5 | Confident | 116 Ų | 116 | 94 Ų | 94 | 54% | 0.542 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -80.6 | -21.7 | 177.3 | -72.3 | 171.4 | -173.4 | 0 | 0 | 113.1 | R113 L115 | R113-E117 WeakPolarHBondContact CG-OE1 2.97Å; R113-E117 IonicContact CZ-OE1 2.87Å; R113-E117 IonicContact CZ-OE2 3.82Å; R113-E117 IonicContact NH1-OE1 3.71Å; R113-E117 PolarHBondContact NH1-OE1 3.45Å; R113-E117 IonicContact NH1-OE2 3.84Å; R113-E117 PolarHBondContact NH1-OE2 3.49Å; R113-E117 WeakPolarHBondContact O-CG 3.33Å; R113-E117 PolarHBondContact O-N 2.84Å; L115-E117 VanDerWaalsContact C-N 3.31Å; L115-E117 PolarHBondContact O-N 3.48Å |
| 118 | Q | 61.8 | Low | 69.9 | Low | 91 Ų | 91 | 98.7 Ų | 98.7 | 43% | 0.425 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -109.2 | -5.3 | -175.4 | -65.7 | 176.1 | 4.5 | 0 | 0 | 114.1 | Q114 L115 E120 A121 W126 | Q114-Q118 VanDerWaalsContact O-CB 3.28Å; Q114-Q118 WeakPolarHBondContact O-CB 3.4Å; Q114-Q118 VanDerWaalsContact O-CG 3.28Å; Q114-Q118 WeakPolarHBondContact O-CG 3.16Å; Q114-Q118 PolarHBondContact O-N 2.67Å; Q114-Q118 VanDerWaalsContact O-N 3.14Å; L115-Q118 PolarHBondContact O-N 2.87Å; Q118-E120 PolarHBondContact O-N 2.94Å; Q118-E120 VanDerWaalsContact O-N 3.09Å; Q118-A121 PolarHBondContact O-N 3.46Å; Q118-A121 VanDerWaalsContact O-N 3.17Å; Q118-W126 VanDerWaalsContact OE1-CH2 3.23Å |
| 119 | E | 55.4 | Low | 69.4 | Low | 135 Ų | 135 | 103.8 Ų | 103.8 | 63% | 0.631 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | -16.9 | 170.5 | -101.2 | -179.8 | 162.5 | 0 | 0 | 113.2 | L115 | L115-E119 WeakPolarHBondContact O-CG 3.26Å; L115-E119 PolarHBondContact O-N 3.28Å |
| 120 | E | 55.2 | Low | 68.8 | Low | 190 Ų | 190 | 100.2 Ų | 100.2 | 89% | 0.888 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.6 | -9 | 178.3 | -65.4 | -168.8 | 159.5 | 0 | 0 | 114.6 | Q118 | Q118-E120 PolarHBondContact O-N 2.94Å; Q118-E120 VanDerWaalsContact O-N 3.09Å |
| 121 | A | 58.8 | Low | 68.5 | Low | 78 Ų | 78 | 101.4 Ų | 101.4 | 65% | 0.645 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.3 | -48.7 | -163.6 | 0 | 0 | 0 | 0 | 0 | 118.9 | Q118 | Q118-A121 PolarHBondContact O-N 3.46Å; Q118-A121 VanDerWaalsContact O-N 3.17Å |
| 122 | E | 53.2 | Low | 68.5 | Low | 168 Ų | 168 | 104.7 Ų | 104.7 | 79% | 0.785 | 51% | 0.506 | S | S | * | . | S | Bend | trans | -149.8 | 165.5 | -166.3 | -68 | -172.5 | 172 | 0 | 0 | 117.4 | ||
| 123 | E | 59.5 | Low | 68.5 | Low | 164 Ų | 164 | 103.8 Ų | 103.8 | 77% | 0.766 | 51% | 0.507 | S | S | * | . | trans | -23.8 | 140.1 | -169.2 | -65.9 | -175.8 | 158.1 | 0 | 0 | 121.6 | G125 W126 | E123-G125 VanDerWaalsContact C-N 3.26Å; E123-G125 PolarHBondContact O-N 3.35Å; E123-W126 PolarHBondContact O-N 3.26Å | ||
| 124 | E | 60.3 | Low | 68.5 | Low | 135 Ų | 135 | 99.2 Ų | 99.2 | 63% | 0.631 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -56.4 | -23.3 | 179.9 | -72.3 | -171 | 168.8 | 0 | 0 | 116.4 | R128 | E124-R128 WeakPolarHBondContact O-CG 3.32Å; E124-R128 PolarHBondContact O-N 3.5Å; E124-R128 PolarHBondContact O-NE 3Å; E124-R128 IonicContact OE2-CZ 2.92Å; E124-R128 IonicContact OE2-NH1 2.69Å; E124-R128 IonicContact OE2-NH2 3.73Å; E124-R128 PolarHBondContact OE2-NH2 2.83Å |
| 125 | G | 64.8 | Low | 68.6 | Low | 42 Ų | 42 | 102.7 Ų | 102.7 | 43% | 0.433 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -73.1 | -45.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | E123 R128 D129 | E123-G125 VanDerWaalsContact C-N 3.26Å; E123-G125 PolarHBondContact O-N 3.35Å; G125-R128 PolarHBondContact O-N 3.47Å; G125-D129 PolarHBondContact O-N 2.89Å |
| 126 | W | 66.7 | Low | 69 | Low | 127 Ų | 127 | 107.8 Ų | 107.8 | 48% | 0.481 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -69.7 | -36.1 | -179.9 | 178.7 | 89.5 | 0 | 0 | 0 | 112.3 | L115 Q118 E123 R128 D129 R130 | L115-W126 HydrophobicContact CD2-CZ3 4.36Å; Q118-W126 VanDerWaalsContact OE1-CH2 3.23Å; E123-W126 PolarHBondContact O-N 3.26Å; W126-R128 VanDerWaalsContact C-N 3.33Å; W126-R128 PolarHBondContact O-N 3.17Å; W126-D129 PolarHBondContact O-N 3.3Å; W126-R130 PolarHBondContact O-N 3.41Å |
| 127 | L | 65.6 | Low | 69.4 | Low | 39 Ų | 39 | 103.1 Ų | 103.1 | 20% | 0.204 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -59.7 | -41.6 | 174.1 | -69.4 | 172 | 0 | 0 | 0 | 111.9 | L115 R130 L131 | L115-L127 HydrophobicContact CD2-CD2 4.3Å; L127-R130 PolarHBondContact O-N 3.31Å; L127-L131 WeakPolarHBondContact O-CB 3.23Å; L127-L131 WeakPolarHBondContact O-CD1 3.28Å; L127-L131 VanDerWaalsContact O-CG 3.25Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 2.83Å |
| 128 | R | 72.6 | Confident | 69.9 | Low | 143 Ų | 143 | 102.5 Ų | 102.5 | 54% | 0.54 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 177.2 | -77.7 | -173.5 | -100.8 | -99.1 | 5.2 | 112.1 | E124 G125 W126 R130 L131 L132 | E124-R128 WeakPolarHBondContact O-CG 3.32Å; E124-R128 PolarHBondContact O-N 3.5Å; E124-R128 PolarHBondContact O-NE 3Å; E124-R128 IonicContact OE2-CZ 2.92Å; E124-R128 IonicContact OE2-NH1 2.69Å; E124-R128 IonicContact OE2-NH2 3.73Å; E124-R128 PolarHBondContact OE2-NH2 2.83Å; G125-R128 PolarHBondContact O-N 3.47Å; W126-R128 VanDerWaalsContact C-N 3.33Å; W126-R128 PolarHBondContact O-N 3.17Å; R128-R130 PolarHBondContact O-N 3.43Å; R128-L131 PolarHBondContact O-N 2.99Å; R128-L132 WeakPolarHBondContact O-CB 3.24Å; R128-L132 WeakPolarHBondContact O-CD1 3.38Å; R128-L132 WeakPolarHBondContact O-CG 3.48Å; R128-L132 PolarHBondContact O-N 3.36Å |
| 129 | D | 76.1 | Confident | 70.9 | Confident | 116 Ų | 116 | 101.4 Ų | 101.4 | 62% | 0.62 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.7 | -37.7 | 178.5 | -79.8 | -6 | 0 | 0 | 0 | 112.7 | G125 W126 S133 | G125-D129 PolarHBondContact O-N 2.89Å; W126-D129 PolarHBondContact O-N 3.3Å; D129-S133 PolarHBondContact O-N 2.95Å |
| 130 | R | 71.6 | Confident | 72.1 | Confident | 62 Ų | 62 | 97.9 Ų | 97.9 | 23% | 0.234 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -71.7 | -38.5 | 177.4 | -171 | 60.6 | 169.8 | -150 | -9.7 | 112.3 | L115 W126 L127 R128 S133 I134 | L115-R130 HydrophobicContact CD1-CG 4.11Å; L115-R130 HydrophobicContact CD2-CB 3.94Å; L115-R130 HydrophobicContact CD2-CG 3.41Å; L115-R130 VanDerWaalsContact CD2-CG 3.41Å; L115-R130 HydrophobicContact CG-CG 3.81Å; W126-R130 PolarHBondContact O-N 3.41Å; L127-R130 PolarHBondContact O-N 3.31Å; R128-R130 PolarHBondContact O-N 3.43Å; R130-S133 WeakPolarHBondContact O-CB 3.3Å; R130-S133 PolarHBondContact O-N 3.35Å; R130-I134 WeakPolarHBondContact O-CG1 3.42Å; R130-I134 PolarHBondContact O-N 3.26Å |
| 131 | L | 78.2 | Confident | 73.5 | Confident | 99 Ų | 99 | 90.3 Ų | 90.3 | 52% | 0.518 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.4 | -47.2 | 171.5 | -78.6 | 164.7 | 0 | 0 | 0 | 111.4 | L115 L127 R128 S133 I134 E135 | L115-L131 HydrophobicContact CD1-CD2 4.13Å; L115-L131 HydrophobicContact CD1-CG 4.41Å; L127-L131 WeakPolarHBondContact O-CB 3.23Å; L127-L131 WeakPolarHBondContact O-CD1 3.28Å; L127-L131 VanDerWaalsContact O-CG 3.25Å; L127-L131 WeakPolarHBondContact O-CG 3.36Å; L127-L131 PolarHBondContact O-N 2.83Å; R128-L131 PolarHBondContact O-N 2.99Å; L131-S133 VanDerWaalsContact C-N 3.29Å; L131-S133 PolarHBondContact O-N 3.25Å; L131-I134 PolarHBondContact O-N 3Å; L131-E135 WeakPolarHBondContact O-CB 3.37Å; L131-E135 PolarHBondContact O-N 3.04Å |
| 132 | L | 80.8 | Confident | 74.7 | Confident | 104 Ų | 104 | 90.5 Ų | 90.5 | 55% | 0.545 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -58.4 | -39.8 | 174.5 | -78.7 | 158.9 | 0 | 0 | 0 | 112 | R128 E135 L136 | R128-L132 WeakPolarHBondContact O-CB 3.24Å; R128-L132 WeakPolarHBondContact O-CD1 3.38Å; R128-L132 WeakPolarHBondContact O-CG 3.48Å; R128-L132 PolarHBondContact O-N 3.36Å; L132-E135 PolarHBondContact O-N 3.31Å; L132-L136 VanDerWaalsContact O-CB 3.29Å; L132-L136 WeakPolarHBondContact O-CB 3.37Å; L132-L136 PolarHBondContact O-N 3.08Å |
| 133 | S | 81.4 | Confident | 76.4 | Confident | 45 Ų | 45 | 86 Ų | 86 | 32% | 0.315 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -65.1 | -41.3 | 176.2 | -172.1 | 0 | 0 | 0 | 0 | 113 | D129 R130 L131 Q137 | D129-S133 PolarHBondContact O-N 2.95Å; R130-S133 WeakPolarHBondContact O-CB 3.3Å; R130-S133 PolarHBondContact O-N 3.35Å; L131-S133 VanDerWaalsContact C-N 3.29Å; L131-S133 PolarHBondContact O-N 3.25Å; S133-Q137 WeakPolarHBondContact O-CG 3.48Å; S133-Q137 PolarHBondContact O-N 3.47Å |
| 134 | I | 81.2 | Confident | 77.7 | Confident | 8 Ų | 8 | 79 Ų | 79 | 4% | 0.041 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -67.9 | -42.5 | 175.9 | -69.9 | 178.8 | 0 | 0 | 0 | 110.7 | L108 K111 E112 L115 R130 L131 Q137 K138 | L108-I134 HydrophobicContact CD2-CG2 4.15Å; K111-I134 HydrophobicContact CB-CD1 4Å; K111-I134 HydrophobicContact CB-CG1 4.07Å; E112-I134 HydrophobicContact CG-CD1 4.13Å; E112-I134 HydrophobicContact CG-CG2 4.19Å; L115-I134 HydrophobicContact CD1-CD1 3.22Å; L115-I134 HydrophobicContact CD1-CG1 4.47Å; L115-I134 HydrophobicContact CG-CD1 3.96Å; R130-I134 WeakPolarHBondContact O-CG1 3.42Å; R130-I134 PolarHBondContact O-N 3.26Å; L131-I134 PolarHBondContact O-N 3Å; I134-Q137 PolarHBondContact O-N 3.44Å; I134-K138 HydrophobicContact CG2-CD 4.1Å; I134-K138 HydrophobicContact CG2-CG 4.4Å; I134-K138 WeakPolarHBondContact O-CB 3.31Å; I134-K138 WeakPolarHBondContact O-CG 3.39Å; I134-K138 PolarHBondContact O-N 3.48Å |
| 135 | E | 82.1 | Confident | 78.9 | Confident | 132 Ų | 132 | 75.1 Ų | 75.1 | 62% | 0.617 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -64.8 | -41 | 178.6 | -170 | 165 | -151.7 | 0 | 0 | 111.8 | L131 L132 Q137 K138 S139 | L131-E135 WeakPolarHBondContact O-CB 3.37Å; L131-E135 PolarHBondContact O-N 3.04Å; L132-E135 PolarHBondContact O-N 3.31Å; E135-Q137 PolarHBondContact O-N 3.39Å; E135-K138 WeakPolarHBondContact O-CB 3.36Å; E135-K138 PolarHBondContact O-N 2.89Å; E135-S139 PolarHBondContact O-N 3.34Å |
| 136 | L | 82.1 | Confident | 80.1 | Confident | 123 Ų | 123 | 77 Ų | 77 | 64% | 0.644 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -61.2 | -44.1 | 172.6 | -175.6 | 64.7 | 0 | 0 | 0 | 111.3 | L132 S139 S140 | L132-L136 VanDerWaalsContact O-CB 3.29Å; L132-L136 WeakPolarHBondContact O-CB 3.37Å; L132-L136 PolarHBondContact O-N 3.08Å; L136-S139 PolarHBondContact O-N 2.83Å; L136-S139 PolarHBondContact O-OG 3.03Å; L136-S140 PolarHBondContact O-N 3.48Å |
| 137 | Q | 79.6 | Confident | 81.2 | Confident | 49 Ų | 49 | 75.9 Ų | 75.9 | 23% | 0.229 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -66.5 | -38.5 | 176.3 | -79 | -168.9 | -36.8 | 0 | 0 | 112.8 | L108 K111 S133 I134 E135 S139 S140 L141 | L108-Q137 HydrophobicContact CD1-CB 4.39Å; L108-Q137 HydrophobicContact CD2-CB 3.45Å; L108-Q137 VanDerWaalsContact CD2-CB 3.45Å; L108-Q137 HydrophobicContact CG-CB 4.12Å; K111-Q137 VanDerWaalsContact CD-OE1 3.3Å; S133-Q137 WeakPolarHBondContact O-CG 3.48Å; S133-Q137 PolarHBondContact O-N 3.47Å; I134-Q137 PolarHBondContact O-N 3.44Å; E135-Q137 PolarHBondContact O-N 3.39Å; Q137-S139 VanDerWaalsContact C-N 3.31Å; Q137-S139 PolarHBondContact O-N 3.05Å; Q137-S140 PolarHBondContact O-N 3.39Å; Q137-S140 VanDerWaalsContact O-N 3.16Å; Q137-S140 PolarHBondContact O-OG 2.85Å; Q137-L141 PolarHBondContact O-N 3.45Å |
| 138 | K | 81.9 | Confident | 82.3 | Confident | 102 Ų | 102 | 75 Ų | 75 | 44% | 0.443 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -59.5 | -42 | 171.5 | -76.3 | 176 | 178.1 | 177.2 | 0 | 111.5 | L108 E112 I134 E135 S140 L141 | L108-K138 HydrophobicContact CD1-CG 4.43Å; L108-K138 HydrophobicContact CD2-CG 4.3Å; E112-K138 WeakPolarHBondContact OE1-CE 3.28Å; E112-K138 IonicContact OE1-NZ 3.64Å; E112-K138 PolarHBondContact OE1-NZ 3.24Å; I134-K138 HydrophobicContact CG2-CD 4.1Å; I134-K138 HydrophobicContact CG2-CG 4.4Å; I134-K138 WeakPolarHBondContact O-CB 3.31Å; I134-K138 WeakPolarHBondContact O-CG 3.39Å; I134-K138 PolarHBondContact O-N 3.48Å; E135-K138 WeakPolarHBondContact O-CB 3.36Å; E135-K138 PolarHBondContact O-N 2.89Å; K138-S140 VanDerWaalsContact C-N 3.27Å; K138-S140 PolarHBondContact O-N 3.43Å; K138-L141 WeakPolarHBondContact O-CB 3.42Å; K138-L141 PolarHBondContact O-N 2.85Å |
| 139 | S | 82.1 | Confident | 83.2 | Confident | 69 Ų | 69 | 73.6 Ų | 73.6 | 48% | 0.483 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63.4 | -35.1 | 176.8 | 79.7 | 0 | 0 | 0 | 0 | 111.8 | E135 L136 Q137 L141 S142 P143 | E135-S139 PolarHBondContact O-N 3.34Å; L136-S139 PolarHBondContact O-N 2.83Å; L136-S139 PolarHBondContact O-OG 3.03Å; Q137-S139 VanDerWaalsContact C-N 3.31Å; Q137-S139 PolarHBondContact O-N 3.05Å; S139-L141 VanDerWaalsContact C-N 3.28Å; S139-L141 PolarHBondContact O-N 3.43Å; S139-S142 PolarHBondContact O-N 3.33Å; S139-P143 VanDerWaalsContact O-CD 3.24Å; S139-P143 WeakPolarHBondContact O-CD 3.28Å |
| 140 | S | 80.7 | Confident | 83.9 | Confident | 60 Ų | 60 | 71.2 Ų | 71.2 | 42% | 0.42 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -70.5 | -18.5 | 177 | 76.8 | 0 | 0 | 0 | 0 | 114.5 | L136 Q137 K138 S142 P143 | L136-S140 PolarHBondContact O-N 3.48Å; Q137-S140 PolarHBondContact O-N 3.39Å; Q137-S140 VanDerWaalsContact O-N 3.16Å; Q137-S140 PolarHBondContact O-OG 2.85Å; K138-S140 VanDerWaalsContact C-N 3.27Å; K138-S140 PolarHBondContact O-N 3.43Å; S140-S142 VanDerWaalsContact C-N 3.31Å; S140-P143 WeakPolarHBondContact O-CD 3.46Å |
| 141 | L | 83.9 | Confident | 84.8 | Confident | 31 Ų | 31 | 69 Ų | 69 | 16% | 0.162 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -70.2 | -26.9 | 173.1 | -61.6 | -174.4 | 0 | 0 | 0 | 113 | L101 N104 V105 L108 Q137 K138 S139 L144 T145 | L101-L141 HydrophobicContact CD1-CD2 4.01Å; N104-L141 HydrophobicContact CB-CD2 3.77Å; V105-L141 HydrophobicContact CG2-CD1 4.26Å; V105-L141 HydrophobicContact CG2-CD2 4.49Å; L108-L141 HydrophobicContact CD1-CD1 3.47Å; L108-L141 VanDerWaalsContact CD1-CD1 3.47Å; L108-L141 HydrophobicContact CD1-CD2 3.97Å; L108-L141 HydrophobicContact CD1-CG 3.79Å; Q137-L141 PolarHBondContact O-N 3.45Å; K138-L141 WeakPolarHBondContact O-CB 3.42Å; K138-L141 PolarHBondContact O-N 2.85Å; S139-L141 VanDerWaalsContact C-N 3.28Å; S139-L141 PolarHBondContact O-N 3.43Å; L141-L144 PolarHBondContact O-N 2.78Å; L141-T145 WeakPolarHBondContact O-CB 3.41Å; L141-T145 PolarHBondContact O-N 3.44Å; L141-T145 PolarHBondContact O-OG1 2.96Å |
| 142 | S | 85.4 | Confident | 85.4 | Confident | 83 Ų | 83 | 65.4 Ų | 65.4 | 58% | 0.58 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -64.7 | -50.2 | -176.7 | 174 | 0 | 0 | 0 | 0 | 112.3 | S139 S140 L144 T145 Q146 | S139-S142 PolarHBondContact O-N 3.33Å; S140-S142 VanDerWaalsContact C-N 3.31Å; S142-L144 VanDerWaalsContact C-N 3.3Å; S142-L144 PolarHBondContact O-N 3.14Å; S142-T145 PolarHBondContact O-N 3.45Å; S142-Q146 PolarHBondContact O-N 3.35Å |
| 143 | P | 87.6 | Confident | 85.9 | Confident | 74 Ų | 74 | 65.5 Ų | 65.5 | 48% | 0.481 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -57.2 | -40.7 | 171.9 | -25.7 | 33.5 | 0 | 0 | 0 | 113.4 | S139 S140 Q146 Q147 | S139-P143 VanDerWaalsContact O-CD 3.24Å; S139-P143 WeakPolarHBondContact O-CD 3.28Å; S140-P143 WeakPolarHBondContact O-CD 3.46Å; P143-Q146 WeakPolarHBondContact O-CB 3.33Å; P143-Q146 PolarHBondContact O-N 3.26Å; P143-Q147 WeakPolarHBondContact O-CG 3.2Å; P143-Q147 PolarHBondContact O-N 2.84Å |
| 144 | L | 86.3 | Confident | 86.3 | Confident | 15 Ų | 15 | 66 Ų | 66 | 8% | 0.079 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -67.4 | -40.7 | -179.9 | -176.8 | 59.2 | 0 | 0 | 0 | 112 | L97 V100 L101 L141 S142 Q146 Q147 I148 | L97-L144 HydrophobicContact CD2-CD1 4.01Å; V100-L144 HydrophobicContact CG1-CD1 4.36Å; V100-L144 HydrophobicContact CG1-CD2 3.93Å; L101-L144 HydrophobicContact CB-CD2 3.79Å; L101-L144 HydrophobicContact CB-CG 4.22Å; L101-L144 HydrophobicContact CD1-CD2 3.79Å; L101-L144 HydrophobicContact CD1-CG 4.14Å; L101-L144 HydrophobicContact CG-CD2 4.44Å; L141-L144 PolarHBondContact O-N 2.78Å; S142-L144 VanDerWaalsContact C-N 3.3Å; S142-L144 PolarHBondContact O-N 3.14Å; L144-Q146 PolarHBondContact O-N 2.95Å; L144-Q147 PolarHBondContact O-N 2.94Å; L144-I148 HydrophobicContact CG-CD1 4.3Å; L144-I148 WeakPolarHBondContact O-CG1 3.3Å; L144-I148 PolarHBondContact O-N 2.87Å |
| 145 | T | 85.8 | Confident | 86.7 | Confident | 54 Ų | 54 | 65.7 Ų | 65.7 | 33% | 0.331 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -61 | -37.5 | 173.3 | -57.6 | 0 | 0 | 0 | 0 | 110.8 | L141 S142 K149 | L141-T145 WeakPolarHBondContact O-CB 3.41Å; L141-T145 PolarHBondContact O-N 3.44Å; L141-T145 PolarHBondContact O-OG1 2.96Å; S142-T145 PolarHBondContact O-N 3.45Å; T145-K149 WeakPolarHBondContact O-CG 3.46Å; T145-K149 PolarHBondContact O-N 2.83Å |
| 146 | Q | 90.1 | Very high | 87 | Confident | 82 Ų | 82 | 60.4 Ų | 60.4 | 38% | 0.383 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -68.5 | -42.7 | 176 | -173.5 | 56.5 | 36.7 | 0 | 0 | 111.8 | S142 P143 L144 I148 K149 D150 | S142-Q146 PolarHBondContact O-N 3.35Å; P143-Q146 WeakPolarHBondContact O-CB 3.33Å; P143-Q146 PolarHBondContact O-N 3.26Å; L144-Q146 PolarHBondContact O-N 2.95Å; Q146-I148 VanDerWaalsContact C-N 3.33Å; Q146-I148 PolarHBondContact O-N 3.15Å; Q146-K149 WeakPolarHBondContact O-CB 3.37Å; Q146-K149 PolarHBondContact O-N 3.39Å; Q146-D150 PolarHBondContact NE2-OD1 3.29Å; Q146-D150 PolarHBondContact NE2-OD2 2.9Å; Q146-D150 PolarHBondContact O-N 2.93Å |
| 147 | Q | 89.9 | Confident | 87.4 | Confident | 103 Ų | 103 | 61.3 Ų | 61.3 | 48% | 0.481 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -60.8 | -41.6 | 174.5 | -70.8 | 175.5 | 13.3 | 0 | 0 | 112 | L97 P143 L144 D150 S151 | L97-Q147 HydrophobicContact CD1-CB 4.32Å; L97-Q147 HydrophobicContact CD2-CB 4.43Å; P143-Q147 WeakPolarHBondContact O-CG 3.2Å; P143-Q147 PolarHBondContact O-N 2.84Å; L144-Q147 PolarHBondContact O-N 2.94Å; Q147-D150 PolarHBondContact O-N 3.43Å; Q147-S151 WeakPolarHBondContact O-CB 3.39Å; Q147-S151 PolarHBondContact O-N 2.92Å |
| 148 | I | 89.4 | Confident | 87.7 | Confident | 21 Ų | 21 | 61.6 Ų | 61.6 | 11% | 0.108 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 174.5 | -71.8 | 167.7 | 0 | 0 | 0 | 110.4 | L97 L101 L144 Q146 D150 S151 T152 | L97-I148 HydrophobicContact CB-CG1 3.79Å; L101-I148 HydrophobicContact CB-CD1 3.58Å; L101-I148 HydrophobicContact CD2-CD1 3.45Å; L101-I148 VanDerWaalsContact CD2-CD1 3.45Å; L101-I148 HydrophobicContact CG-CD1 4.01Å; L144-I148 HydrophobicContact CG-CD1 4.3Å; L144-I148 WeakPolarHBondContact O-CG1 3.3Å; L144-I148 PolarHBondContact O-N 2.87Å; Q146-I148 VanDerWaalsContact C-N 3.33Å; Q146-I148 PolarHBondContact O-N 3.15Å; I148-D150 VanDerWaalsContact C-N 3.33Å; I148-D150 PolarHBondContact O-N 2.87Å; I148-S151 PolarHBondContact O-N 3.42Å; I148-T152 PolarHBondContact O-N 2.86Å; I148-T152 PolarHBondContact O-OG1 2.91Å |
| 149 | K | 90.3 | Very high | 87.9 | Confident | 114 Ų | 114 | 56.8 Ų | 56.8 | 50% | 0.496 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58.9 | -44.5 | 176 | -74.7 | 173.4 | -178.5 | 176.3 | 0 | 112 | T145 Q146 T152 K153 | T145-K149 WeakPolarHBondContact O-CG 3.46Å; T145-K149 PolarHBondContact O-N 2.83Å; Q146-K149 WeakPolarHBondContact O-CB 3.37Å; Q146-K149 PolarHBondContact O-N 3.39Å; K149-T152 PolarHBondContact O-N 3.25Å; K149-K153 VanDerWaalsContact O-CG 3.27Å; K149-K153 WeakPolarHBondContact O-CG 3.35Å; K149-K153 PolarHBondContact O-N 3.39Å |
| 150 | D | 91.3 | Very high | 88.1 | Confident | 66 Ų | 66 | 57.3 Ų | 57.3 | 35% | 0.353 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -72.3 | -33.6 | -178 | -66.5 | -29.7 | 0 | 0 | 0 | 111.8 | Q146 Q147 I148 K153 N154 | Q146-D150 PolarHBondContact NE2-OD1 3.29Å; Q146-D150 PolarHBondContact NE2-OD2 2.9Å; Q146-D150 PolarHBondContact O-N 2.93Å; Q147-D150 PolarHBondContact O-N 3.43Å; I148-D150 VanDerWaalsContact C-N 3.33Å; I148-D150 PolarHBondContact O-N 2.87Å; D150-K153 PolarHBondContact O-N 3.4Å; D150-K153 IonicContact OD1-NZ 2.75Å; D150-K153 PolarHBondContact OD1-NZ 2.9Å; D150-N154 WeakPolarHBondContact O-CB 3.23Å; D150-N154 PolarHBondContact O-N 3.41Å |
| 151 | S | 91.4 | Very high | 88.4 | Confident | 15 Ų | 15 | 59.2 Ų | 59.2 | 11% | 0.105 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64.4 | -47.8 | 169.2 | 172.8 | 0 | 0 | 0 | 0 | 111.9 | H94 Q147 I148 K153 N154 V155 | H94-S151 VanDerWaalsContact CA-OG 3.25Å; H94-S151 WeakPolarHBondContact CA-OG 3.29Å; H94-S151 WeakPolarHBondContact CB-OG 3.27Å; H94-S151 PolarHBondContact ND1-OG 2.98Å; Q147-S151 WeakPolarHBondContact O-CB 3.39Å; Q147-S151 PolarHBondContact O-N 2.92Å; I148-S151 PolarHBondContact O-N 3.42Å; S151-K153 VanDerWaalsContact C-N 3.3Å; S151-K153 PolarHBondContact O-N 3.24Å; S151-N154 WeakPolarHBondContact O-CA 3.29Å; S151-N154 WeakPolarHBondContact O-CB 3.45Å; S151-N154 PolarHBondContact O-N 2.87Å; S151-V155 WeakPolarHBondContact O-CG2 3.48Å; S151-V155 PolarHBondContact O-N 3.34Å |
| 152 | T | 91 | Very high | 88.4 | Confident | 24 Ų | 24 | 60.5 Ų | 60.5 | 15% | 0.147 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -57.1 | -43.7 | 173.4 | -53.1 | 0 | 0 | 0 | 0 | 111 | V66 L69 H94 I148 K149 N154 V155 L156 | V66-T152 HydrophobicContact CG1-CG2 4.12Å; V66-T152 HydrophobicContact CG2-CG2 3.67Å; L69-T152 HydrophobicContact CD1-CG2 4.42Å; H94-T152 PolarHBondContact CE1-OG1 3.41Å; I148-T152 PolarHBondContact O-N 2.86Å; I148-T152 PolarHBondContact O-OG1 2.91Å; K149-T152 PolarHBondContact O-N 3.25Å; T152-N154 VanDerWaalsContact C-N 3.29Å; T152-N154 PolarHBondContact O-N 3.31Å; T152-V155 PolarHBondContact O-N 3.44Å; T152-L156 HydrophobicContact CG2-CD1 4.15Å; T152-L156 HydrophobicContact CG2-CG 4.41Å; T152-L156 WeakPolarHBondContact O-CB 3.47Å; T152-L156 VanDerWaalsContact O-CG 3.29Å; T152-L156 WeakPolarHBondContact O-CG 3.35Å; T152-L156 PolarHBondContact O-N 3.31Å |
| 153 | K | 90.7 | Very high | 88.2 | Confident | 105 Ų | 105 | 60 Ų | 60 | 46% | 0.457 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.6 | -35 | 175 | -71.2 | 171.3 | -163.3 | 159.1 | 0 | 112.3 | K149 D150 S151 R157 | K149-K153 VanDerWaalsContact O-CG 3.27Å; K149-K153 WeakPolarHBondContact O-CG 3.35Å; K149-K153 PolarHBondContact O-N 3.39Å; D150-K153 PolarHBondContact O-N 3.4Å; D150-K153 IonicContact OD1-NZ 2.75Å; D150-K153 PolarHBondContact OD1-NZ 2.9Å; S151-K153 VanDerWaalsContact C-N 3.3Å; S151-K153 PolarHBondContact O-N 3.24Å; K153-R157 WeakPolarHBondContact O-CB 3.31Å; K153-R157 VanDerWaalsContact O-CG 3.26Å; K153-R157 WeakPolarHBondContact O-CG 3.47Å; K153-R157 PolarHBondContact O-N 3.5Å; K153-R157 PolarHBondContact O-NE 2.83Å; K153-R157 VanDerWaalsContact O-NE 3.14Å |
| 154 | N | 89.9 | Confident | 87.9 | Confident | 57 Ų | 57 | 63.7 Ų | 63.7 | 31% | 0.305 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -68 | -48.9 | 178 | -165.4 | 47.3 | 0 | 0 | 0 | 110.7 | D150 S151 T152 L156 R157 L158 | D150-N154 WeakPolarHBondContact O-CB 3.23Å; D150-N154 PolarHBondContact O-N 3.41Å; S151-N154 WeakPolarHBondContact O-CA 3.29Å; S151-N154 WeakPolarHBondContact O-CB 3.45Å; S151-N154 PolarHBondContact O-N 2.87Å; T152-N154 VanDerWaalsContact C-N 3.29Å; T152-N154 PolarHBondContact O-N 3.31Å; N154-L156 PolarHBondContact O-N 3.05Å; N154-R157 PolarHBondContact O-N 3.18Å; N154-L158 WeakPolarHBondContact O-CG 3.46Å; N154-L158 PolarHBondContact O-N 2.97Å |
| 155 | V | 88.5 | Confident | 87.6 | Confident | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -58.1 | -47.9 | 174.8 | 176.3 | 0 | 0 | 0 | 0 | 110.9 | L69 A90 V91 H94 S151 T152 R157 L158 L159 | L69-V155 HydrophobicContact CD1-CG1 4.15Å; L69-V155 HydrophobicContact CD2-CG1 3.52Å; L69-V155 HydrophobicContact CG-CG1 4.5Å; A90-V155 HydrophobicContact CB-CG2 3.87Å; A90-V155 WeakPolarHBondContact O-CG2 3.43Å; V91-V155 HydrophobicContact CG2-CG1 3.77Å; V91-V155 HydrophobicContact CG2-CG2 4.29Å; H94-V155 HydrophobicContact CB-CG2 4.18Å; S151-V155 WeakPolarHBondContact O-CG2 3.48Å; S151-V155 PolarHBondContact O-N 3.34Å; T152-V155 PolarHBondContact O-N 3.44Å; V155-R157 VanDerWaalsContact C-N 3.35Å; V155-R157 PolarHBondContact O-N 3.17Å; V155-L158 PolarHBondContact O-N 2.95Å; V155-L159 HydrophobicContact CG1-CD1 3.9Å; V155-L159 HydrophobicContact CG1-CG 4.32Å; V155-L159 WeakPolarHBondContact O-CB 3.49Å; V155-L159 WeakPolarHBondContact O-CG 3.25Å; V155-L159 PolarHBondContact O-N 2.8Å |
| 156 | L | 88.8 | Confident | 87.4 | Confident | 21 Ų | 21 | 60.9 Ų | 60.9 | 11% | 0.11 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -61.6 | -39.6 | 176.2 | -75.5 | 176.4 | 0 | 0 | 0 | 112.8 | L65 V66 T152 N154 L158 L159 L160 | L65-L156 HydrophobicContact CB-CD2 3.82Å; L65-L156 HydrophobicContact CD1-CD2 4.4Å; V66-L156 HydrophobicContact CG2-CD1 3.64Å; V66-L156 HydrophobicContact CG2-CD2 3.84Å; V66-L156 HydrophobicContact CG2-CG 3.96Å; T152-L156 HydrophobicContact CG2-CD1 4.15Å; T152-L156 HydrophobicContact CG2-CG 4.41Å; T152-L156 WeakPolarHBondContact O-CB 3.47Å; T152-L156 VanDerWaalsContact O-CG 3.29Å; T152-L156 WeakPolarHBondContact O-CG 3.35Å; T152-L156 PolarHBondContact O-N 3.31Å; N154-L156 PolarHBondContact O-N 3.05Å; L156-L158 VanDerWaalsContact C-N 3.33Å; L156-L158 PolarHBondContact O-N 2.99Å; L156-L159 PolarHBondContact O-N 3.48Å; L156-L160 VanDerWaalsContact O-CB 3.26Å; L156-L160 WeakPolarHBondContact O-CB 3.24Å; L156-L160 WeakPolarHBondContact O-CG 3.34Å; L156-L160 PolarHBondContact O-N 3.37Å |
| 157 | R | 89.9 | Confident | 87 | Confident | 143 Ų | 143 | 65.5 Ų | 65.5 | 54% | 0.54 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -61.1 | -43.9 | 175.6 | -84.2 | 179.6 | -75.7 | 143 | -6.2 | 111 | K153 N154 V155 L160 S161 | K153-R157 WeakPolarHBondContact O-CB 3.31Å; K153-R157 VanDerWaalsContact O-CG 3.26Å; K153-R157 WeakPolarHBondContact O-CG 3.47Å; K153-R157 PolarHBondContact O-N 3.5Å; K153-R157 PolarHBondContact O-NE 2.83Å; K153-R157 VanDerWaalsContact O-NE 3.14Å; N154-R157 PolarHBondContact O-N 3.18Å; V155-R157 VanDerWaalsContact C-N 3.35Å; V155-R157 PolarHBondContact O-N 3.17Å; R157-L160 PolarHBondContact O-N 3.09Å; R157-S161 WeakPolarHBondContact O-CB 3.37Å; R157-S161 PolarHBondContact O-N 2.98Å; R157-S161 PolarHBondContact O-OG 3.37Å |
| 158 | L | 87.4 | Confident | 86.5 | Confident | 55 Ų | 55 | 64.7 Ų | 64.7 | 29% | 0.288 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -66.8 | -43.8 | 178.9 | -67.8 | 170.9 | 0 | 0 | 0 | 111.5 | I87 A90 N154 V155 L156 S161 N162 | I87-L158 HydrophobicContact CG1-CB 3.76Å; A90-L158 HydrophobicContact CB-CD1 3.65Å; N154-L158 WeakPolarHBondContact O-CG 3.46Å; N154-L158 PolarHBondContact O-N 2.97Å; V155-L158 PolarHBondContact O-N 2.95Å; L156-L158 VanDerWaalsContact C-N 3.33Å; L156-L158 PolarHBondContact O-N 2.99Å; L158-S161 PolarHBondContact O-N 3.01Å; L158-N162 PolarHBondContact O-N 3.28Å; L158-N162 VanDerWaalsContact O-N 3.16Å |
| 159 | L | 85.8 | Confident | 86.1 | Confident | 1 Ų | 1 | 64.1 Ų | 64.1 | 1% | 0.005 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.7 | -43.4 | 175.4 | -72.3 | 176.1 | 0 | 0 | 0 | 112.4 | L69 L83 I87 V155 L156 S161 N162 L169 | L69-L159 HydrophobicContact CD2-CD1 4.08Å; L83-L159 HydrophobicContact CD2-CD2 4.49Å; I87-L159 HydrophobicContact CD1-CD2 4.14Å; I87-L159 HydrophobicContact CG2-CD2 3.8Å; I87-L159 HydrophobicContact CG2-CG 4.4Å; V155-L159 HydrophobicContact CG1-CD1 3.9Å; V155-L159 HydrophobicContact CG1-CG 4.32Å; V155-L159 WeakPolarHBondContact O-CB 3.49Å; V155-L159 WeakPolarHBondContact O-CG 3.25Å; V155-L159 PolarHBondContact O-N 2.8Å; L156-L159 PolarHBondContact O-N 3.48Å; L159-S161 VanDerWaalsContact C-N 3.3Å; L159-S161 PolarHBondContact O-N 3.43Å; L159-N162 CarbonylContact O-C 3.55Å; L159-N162 PolarHBondContact O-N 3.24Å; L159-L169 HydrophobicContact CD1-CD1 4.19Å; L159-L169 HydrophobicContact CD2-CD1 3.5Å |
| 160 | L | 86.1 | Confident | 85.7 | Confident | 80 Ų | 80 | 61.2 Ų | 61.2 | 42% | 0.419 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -71.3 | -26.6 | 177.9 | -68.1 | 171.9 | 0 | 0 | 0 | 112.5 | L65 L156 R157 N162 | L65-L160 HydrophobicContact CD1-CD2 4.02Å; L156-L160 VanDerWaalsContact O-CB 3.26Å; L156-L160 WeakPolarHBondContact O-CB 3.24Å; L156-L160 WeakPolarHBondContact O-CG 3.34Å; L156-L160 PolarHBondContact O-N 3.37Å; R157-L160 PolarHBondContact O-N 3.09Å; L160-N162 VanDerWaalsContact C-N 3.27Å |
| 161 | S | 86.7 | Confident | 85.1 | Confident | 99 Ų | 99 | 64.5 Ų | 64.5 | 69% | 0.692 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -73 | -20.9 | 173 | -57.4 | 0 | 0 | 0 | 0 | 112.4 | R157 L158 L159 P163 | R157-S161 WeakPolarHBondContact O-CB 3.37Å; R157-S161 PolarHBondContact O-N 2.98Å; R157-S161 PolarHBondContact O-OG 3.37Å; L158-S161 PolarHBondContact O-N 3.01Å; L159-S161 VanDerWaalsContact C-N 3.3Å; L159-S161 PolarHBondContact O-N 3.43Å; S161-P163 WeakPolarHBondContact O-CD 3.36Å |
| 162 | N | 85.2 | Confident | 84.4 | Confident | 58 Ų | 58 | 67.7 Ų | 67.7 | 31% | 0.31 | 33% | 0.334 | S | S | . | . | trans | -118.2 | 84.2 | 173.5 | -172.1 | -12.3 | 0 | 0 | 0 | 111.4 | I87 L158 L159 L160 Q164 A165 A166 | I87-N162 HydrophobicContact CD1-CB 4.37Å; L158-N162 PolarHBondContact O-N 3.28Å; L158-N162 VanDerWaalsContact O-N 3.16Å; L159-N162 CarbonylContact O-C 3.55Å; L159-N162 PolarHBondContact O-N 3.24Å; L160-N162 VanDerWaalsContact C-N 3.27Å; N162-Q164 PolarHBondContact O-N 2.87Å; N162-Q164 VanDerWaalsContact O-N 3.15Å; N162-Q164 PolarHBondContact OD1-N 3.23Å; N162-A165 HydrophobicContact CB-CB 4.05Å; N162-A165 PolarHBondContact O-N 3.26Å; N162-A165 VanDerWaalsContact O-N 3.15Å; N162-A165 PolarHBondContact OD1-N 2.98Å; N162-A166 PolarHBondContact O-N 3.06Å; N162-A166 VanDerWaalsContact O-N 3.11Å | ||
| 163 | P | 80.3 | Confident | 83.4 | Confident | 74 Ų | 74 | 69.1 Ų | 69.1 | 48% | 0.481 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65.7 | -21.3 | -173.7 | 26.2 | -35.2 | 0 | 0 | 0 | 114 | S161 R167 | S161-P163 WeakPolarHBondContact O-CD 3.36Å; P163-R167 WeakPolarHBondContact O-CB 3.46Å; P163-R167 VanDerWaalsContact O-CG 3.25Å; P163-R167 WeakPolarHBondContact O-CG 3.33Å; P163-R167 PolarHBondContact O-N 2.89Å; P163-R167 VanDerWaalsContact O-N 3.16Å |
| 164 | Q | 81.6 | Confident | 82.5 | Confident | 151 Ų | 151 | 71.5 Ų | 71.5 | 71% | 0.706 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -72.5 | -44.7 | 175.3 | -68 | -179 | -15.8 | 0 | 0 | 110.6 | N162 R167 L168 | N162-Q164 PolarHBondContact O-N 2.87Å; N162-Q164 VanDerWaalsContact O-N 3.15Å; N162-Q164 PolarHBondContact OD1-N 3.23Å; Q164-R167 PolarHBondContact O-N 3.21Å; Q164-L168 WeakPolarHBondContact O-CG 3.48Å; Q164-L168 PolarHBondContact O-N 3.06Å; Q164-L168 VanDerWaalsContact O-N 3.1Å |
| 165 | A | 79.2 | Confident | 81.6 | Confident | 2 Ų | 2 | 70.8 Ų | 70.8 | 2% | 0.017 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | L83 I87 N162 R167 L168 L169 | L83-A165 HydrophobicContact CD2-CB 3.79Å; I87-A165 HydrophobicContact CD1-CB 4.39Å; N162-A165 HydrophobicContact CB-CB 4.05Å; N162-A165 PolarHBondContact O-N 3.26Å; N162-A165 VanDerWaalsContact O-N 3.15Å; N162-A165 PolarHBondContact OD1-N 2.98Å; A165-R167 PolarHBondContact O-N 3.29Å; A165-L168 PolarHBondContact O-N 3.24Å; A165-L169 WeakPolarHBondContact O-CG 3.37Å; A165-L169 PolarHBondContact O-N 2.99Å; A165-L169 VanDerWaalsContact O-N 3.09Å |
| 166 | A | 81.8 | Confident | 81.4 | Confident | 7 Ų | 7 | 72.2 Ų | 72.2 | 6% | 0.058 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.2 | -42.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | L65 N162 L169 Q170 | L65-A166 HydrophobicContact CD1-CB 4.47Å; L65-A166 HydrophobicContact CD2-CB 4.09Å; N162-A166 PolarHBondContact O-N 3.06Å; N162-A166 VanDerWaalsContact O-N 3.11Å; A166-L169 PolarHBondContact O-N 3.07Å; A166-Q170 WeakPolarHBondContact O-CG 3.48Å; A166-Q170 PolarHBondContact O-N 2.91Å |
| 167 | R | 81.7 | Confident | 81.2 | Confident | 179 Ų | 179 | 74.1 Ų | 74.1 | 68% | 0.675 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -66.7 | -41.2 | 178.3 | -75.8 | 175.9 | -173.3 | -160 | 2.5 | 112.5 | P163 Q164 A165 L169 Q170 M171 | P163-R167 WeakPolarHBondContact O-CB 3.46Å; P163-R167 VanDerWaalsContact O-CG 3.25Å; P163-R167 WeakPolarHBondContact O-CG 3.33Å; P163-R167 PolarHBondContact O-N 2.89Å; P163-R167 VanDerWaalsContact O-N 3.16Å; Q164-R167 PolarHBondContact O-N 3.21Å; A165-R167 PolarHBondContact O-N 3.29Å; R167-L169 VanDerWaalsContact C-N 3.29Å; R167-L169 PolarHBondContact O-N 3.05Å; R167-Q170 PolarHBondContact O-N 3.38Å; R167-M171 WeakPolarHBondContact O-CG 3.4Å; R167-M171 PolarHBondContact O-N 3.42Å |
| 168 | L | 79.8 | Confident | 80.9 | Confident | 86 Ų | 86 | 70.3 Ų | 70.3 | 45% | 0.45 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -64.4 | -36.4 | 177.5 | -70.3 | 171.9 | 0 | 0 | 0 | 111.4 | V82 Q164 A165 M171 | V82-L168 HydrophobicContact CG1-CB 4.17Å; V82-L168 HydrophobicContact CG1-CD1 3.44Å; V82-L168 VanDerWaalsContact CG1-CD1 3.44Å; V82-L168 HydrophobicContact CG1-CG 4.44Å; Q164-L168 WeakPolarHBondContact O-CG 3.48Å; Q164-L168 PolarHBondContact O-N 3.06Å; Q164-L168 VanDerWaalsContact O-N 3.1Å; A165-L168 PolarHBondContact O-N 3.24Å; L168-M171 HydrophobicContact CD2-SD 4.42Å; L168-M171 PolarHBondContact O-N 3.43Å |
| 169 | L | 80.8 | Confident | 80.9 | Confident | 9 Ų | 9 | 74.2 Ų | 74.2 | 5% | 0.047 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -64.8 | -44.7 | 171.3 | -73.2 | 174.7 | 0 | 0 | 0 | 112.6 | L68 V72 V79 L83 L159 A165 A166 R167 M171 Q172 | L68-L169 HydrophobicContact CD1-CB 4.41Å; L68-L169 VanDerWaalsContact CD1-O 3.25Å; L68-L169 WeakPolarHBondContact CD1-O 3.45Å; V72-L169 HydrophobicContact CG2-CD1 4.35Å; V72-L169 HydrophobicContact CG2-CD2 3.45Å; V72-L169 VanDerWaalsContact CG2-CD2 3.45Å; V79-L169 HydrophobicContact CG1-CD2 4.32Å; L83-L169 HydrophobicContact CD1-CD1 4.01Å; L83-L169 HydrophobicContact CD1-CD2 4.08Å; L83-L169 HydrophobicContact CD1-CG 4.41Å; L83-L169 HydrophobicContact CD2-CD1 3.61Å; L83-L169 HydrophobicContact CD2-CD2 4.02Å; L83-L169 HydrophobicContact CD2-CG 3.67Å; L83-L169 HydrophobicContact CG-CD1 4.48Å; L83-L169 HydrophobicContact CG-CD2 4.5Å; L159-L169 HydrophobicContact CD1-CD1 4.19Å; L159-L169 HydrophobicContact CD2-CD1 3.5Å; A165-L169 WeakPolarHBondContact O-CG 3.37Å; A165-L169 PolarHBondContact O-N 2.99Å; A165-L169 VanDerWaalsContact O-N 3.09Å; A166-L169 PolarHBondContact O-N 3.07Å; R167-L169 VanDerWaalsContact C-N 3.29Å; R167-L169 PolarHBondContact O-N 3.05Å; L169-M171 PolarHBondContact O-N 3.49Å; L169-M171 VanDerWaalsContact O-N 3.11Å; L169-Q172 WeakPolarHBondContact O-CB 3.35Å; L169-Q172 PolarHBondContact O-N 2.86Å |
| 170 | Q | 81.2 | Confident | 81 | Confident | 53 Ų | 53 | 75 Ų | 75 | 25% | 0.248 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -60.4 | -21.2 | 178.1 | -75.7 | 175.6 | -37.9 | 0 | 0 | 113.3 | L65 A166 R167 Q172 T173 | L65-Q170 HydrophobicContact CD2-CG 3.75Å; L65-Q170 HydrophobicContact CG-CG 4.5Å; A166-Q170 WeakPolarHBondContact O-CG 3.48Å; A166-Q170 PolarHBondContact O-N 2.91Å; R167-Q170 PolarHBondContact O-N 3.38Å; Q170-Q172 VanDerWaalsContact C-N 3.27Å; Q170-Q172 PolarHBondContact O-N 3.21Å; Q170-T173 WeakPolarHBondContact O-CG2 3.41Å |
| 171 | M | 79.9 | Confident | 81.1 | Confident | 136 Ų | 136 | 74 Ų | 74 | 67% | 0.67 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.7 | -17.9 | 173.8 | -66.6 | 179.9 | 68.6 | 0 | 0 | 113.2 | R167 L168 L169 T173 | R167-M171 WeakPolarHBondContact O-CG 3.4Å; R167-M171 PolarHBondContact O-N 3.42Å; L168-M171 HydrophobicContact CD2-SD 4.42Å; L168-M171 PolarHBondContact O-N 3.43Å; L169-M171 PolarHBondContact O-N 3.49Å; L169-M171 VanDerWaalsContact O-N 3.11Å; M171-T173 PolarHBondContact O-N 3.08Å; M171-T173 VanDerWaalsContact O-N 3.13Å |
| 172 | Q | 76 | Confident | 81.3 | Confident | 82 Ų | 82 | 74 Ų | 74 | 38% | 0.383 | 38% | 0.383 | S | S | . | . | trans | -87.7 | 41.7 | -179.8 | -55.2 | -65.1 | 7 | 0 | 0 | 112.8 | L68 Y71 L169 Q170 Q174 S175 | L68-Q172 WeakPolarHBondContact CD2-O 3.35Å; Y71-Q172 HydrophobicContact CD1-CB 4.39Å; Y71-Q172 HydrophobicContact CE1-CB 3.99Å; Y71-Q172 HydrophobicContact CE1-CG 4.03Å; L169-Q172 WeakPolarHBondContact O-CB 3.35Å; L169-Q172 PolarHBondContact O-N 2.86Å; Q170-Q172 VanDerWaalsContact C-N 3.27Å; Q170-Q172 PolarHBondContact O-N 3.21Å; Q172-Q174 PolarHBondContact O-N 2.91Å; Q172-S175 PolarHBondContact O-N 3.24Å | ||
| 173 | T | 69.4 | Low | 81.6 | Confident | 53 Ų | 53 | 76.6 Ų | 76.6 | 33% | 0.325 | 39% | 0.391 | S | S | . | . | G | 310 helix | trans | -62.3 | -25.3 | -176 | 54.6 | 0 | 0 | 0 | 0 | 114.5 | Q170 M171 S175 R176 | Q170-T173 WeakPolarHBondContact O-CG2 3.41Å; M171-T173 PolarHBondContact O-N 3.08Å; M171-T173 VanDerWaalsContact O-N 3.13Å; T173-S175 PolarHBondContact O-N 3.21Å; T173-R176 PolarHBondContact O-N 2.85Å |
| 174 | Q | 72.1 | Confident | 82 | Confident | 156 Ų | 156 | 73.1 Ų | 73.1 | 73% | 0.729 | 37% | 0.369 | S | S | * | . | G | 310 helix | trans | -68.7 | -14 | -179.2 | -69.3 | 72.4 | 24.3 | 0 | 0 | 113.3 | Q172 | Q172-Q174 PolarHBondContact O-N 2.91Š|
| 175 | S | 72.8 | Confident | 82.5 | Confident | 41 Ų | 41 | 69.5 Ų | 69.5 | 29% | 0.287 | 35% | 0.354 | S | S | . | . | G | 310 helix | trans | -92.8 | 5.9 | -176.3 | -54.6 | 0 | 0 | 0 | 0 | 114.2 | Y71 Q172 T173 | Y71-S175 WeakPolarHBondContact CD2-OG 3.46Å; Y71-S175 WeakPolarHBondContact CE2-OG 3.47Å; Y71-S175 VanDerWaalsContact CG-CB 3.42Å; Q172-S175 PolarHBondContact O-N 3.24Å; T173-S175 PolarHBondContact O-N 3.21Å |
| 176 | R | 82.3 | Confident | 83.2 | Confident | 31 Ų | 31 | 72.6 Ų | 72.6 | 12% | 0.117 | 38% | 0.376 | C | S | . | . | S | Bend | trans | -80.9 | 152.4 | 178.2 | -66.6 | 177.3 | 177 | 155.1 | 0.6 | 111.3 | E64 T67 L68 T173 | E64-R176 PolarHBondContact O-NH2 3.16Å; T67-R176 PolarHBondContact OG1-NE 2.92Å; L68-R176 HydrophobicContact CD2-CG 3.68Å; L68-R176 HydrophobicContact CG-CG 4.47Å; T173-R176 PolarHBondContact O-N 2.85Å |
| 177 | S | 84.9 | Confident | 83.7 | Confident | 60 Ų | 60 | 73.6 Ų | 73.6 | 42% | 0.42 | 38% | 0.38 | S | S | . | . | trans | -71.2 | 156.9 | 167.4 | 83.1 | 0 | 0 | 0 | 0 | 111.1 | E179 A180 Q181 | S177-E179 VanDerWaalsContact C-N 3.26Å; S177-E179 VanDerWaalsContact CB-OE2 3.3Å; S177-E179 WeakPolarHBondContact CB-OE2 3.44Å; S177-E179 PolarHBondContact O-N 3.16Å; S177-E179 PolarHBondContact OG-OE2 3.28Å; S177-A180 PolarHBondContact O-N 2.9Å; S177-A180 PolarHBondContact OG-N 3.08Å; S177-Q181 PolarHBondContact O-N 2.86Å | ||
| 178 | A | 85.2 | Confident | 84.1 | Confident | 64 Ų | 64 | 69.1 Ų | 69.1 | 53% | 0.529 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.2 | -36.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | Q181 N182 | A178-Q181 PolarHBondContact O-N 3.19Å; A178-N182 WeakPolarHBondContact O-CB 3.48Å; A178-N182 PolarHBondContact O-N 3.06Å; A178-N182 PolarHBondContact O-ND2 3.15Å |
| 179 | E | 87.2 | Confident | 84.7 | Confident | 137 Ų | 137 | 72.1 Ų | 72.1 | 64% | 0.64 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -66.5 | -40.3 | 178.1 | -56.5 | 76.1 | -166.3 | 0 | 0 | 111.6 | S177 F183 | S177-E179 VanDerWaalsContact C-N 3.26Å; S177-E179 VanDerWaalsContact CB-OE2 3.3Å; S177-E179 WeakPolarHBondContact CB-OE2 3.44Å; S177-E179 PolarHBondContact O-N 3.16Å; S177-E179 PolarHBondContact OG-OE2 3.28Å; E179-F183 PolarHBondContact O-N 3.11Å; E179-F183 VanDerWaalsContact O-N 3.11Å |
| 180 | A | 86.3 | Confident | 85.3 | Confident | 16 Ų | 16 | 75.3 Ų | 75.3 | 13% | 0.132 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -66.4 | -40.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | T67 S177 F183 I184 | T67-A180 HydrophobicContact CG2-CB 3.72Å; S177-A180 PolarHBondContact O-N 2.9Å; S177-A180 PolarHBondContact OG-N 3.08Å; A180-F183 PolarHBondContact O-N 2.95Å; A180-I184 WeakPolarHBondContact O-CG1 3.37Å; A180-I184 PolarHBondContact O-N 2.81Å |
| 181 | Q | 89.2 | Confident | 85.8 | Confident | 59 Ų | 59 | 77.2 Ų | 77.2 | 28% | 0.276 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -67.5 | -45.4 | 177.2 | -171.7 | 56.3 | 45.6 | 0 | 0 | 111.8 | S177 A178 F183 I184 D185 | S177-Q181 PolarHBondContact O-N 2.86Å; A178-Q181 PolarHBondContact O-N 3.19Å; Q181-F183 PolarHBondContact O-N 3.43Å; Q181-I184 PolarHBondContact O-N 3.43Å; Q181-I184 VanDerWaalsContact O-N 3.08Å; Q181-D185 PolarHBondContact NE2-OD1 3.29Å; Q181-D185 VanDerWaalsContact O-CG 3.3Å; Q181-D185 PolarHBondContact O-N 2.98Å |
| 182 | N | 90.7 | Very high | 86.2 | Confident | 101 Ų | 101 | 72.6 Ų | 72.6 | 54% | 0.54 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -57.6 | -37.3 | 175.6 | -73.3 | -21.1 | 0 | 0 | 0 | 112.5 | A178 S186 | A178-N182 WeakPolarHBondContact O-CB 3.48Å; A178-N182 PolarHBondContact O-N 3.06Å; A178-N182 PolarHBondContact O-ND2 3.15Å; N182-S186 WeakPolarHBondContact O-CB 3.34Å; N182-S186 PolarHBondContact O-N 2.95Å; N182-S186 PolarHBondContact O-OG 3.15Å |
| 183 | F | 91.2 | Very high | 86.8 | Confident | 111 Ų | 111 | 73.9 Ų | 73.9 | 49% | 0.487 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66.5 | -42.2 | 176.3 | -177.6 | -113.9 | 0 | 0 | 0 | 112.1 | V63 E179 A180 Q181 S186 L187 | V63-F183 HydrophobicContact CG1-CD1 3.74Å; V63-F183 HydrophobicContact CG1-CE1 3.7Å; V63-F183 HydrophobicContact CG2-CE1 4.25Å; E179-F183 PolarHBondContact O-N 3.11Å; E179-F183 VanDerWaalsContact O-N 3.11Å; A180-F183 PolarHBondContact O-N 2.95Å; Q181-F183 PolarHBondContact O-N 3.43Å; F183-S186 PolarHBondContact O-N 3.02Å; F183-L187 HydrophobicContact CD1-CD1 4.13Å; F183-L187 HydrophobicContact CE1-CD1 3.69Å; F183-L187 HydrophobicContact CE1-CG 4.43Å; F183-L187 HydrophobicContact CZ-CD1 3.98Å; F183-L187 HydrophobicContact CZ-CD2 4.5Å; F183-L187 HydrophobicContact CZ-CG 4.34Å; F183-L187 WeakPolarHBondContact O-CG 3.45Å; F183-L187 PolarHBondContact O-N 3.14Å |
| 184 | I | 89.9 | Confident | 87.7 | Confident | 2 Ų | 2 | 73.8 Ų | 73.8 | 1% | 0.01 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -63.5 | -45.8 | 175.1 | -67.5 | 163.1 | 0 | 0 | 0 | 110.4 | V63 E64 T67 A180 Q181 S186 L187 I188 | V63-I184 HydrophobicContact CG1-CG1 4.12Å; E64-I184 HydrophobicContact CG-CD1 4.03Å; E64-I184 HydrophobicContact CG-CG1 4.37Å; E64-I184 HydrophobicContact CG-CG2 4.24Å; T67-I184 HydrophobicContact CG2-CD1 4.34Å; A180-I184 WeakPolarHBondContact O-CG1 3.37Å; A180-I184 PolarHBondContact O-N 2.81Å; Q181-I184 PolarHBondContact O-N 3.43Å; Q181-I184 VanDerWaalsContact O-N 3.08Å; I184-S186 VanDerWaalsContact C-N 3.3Å; I184-S186 PolarHBondContact O-N 3.49Å; I184-L187 WeakPolarHBondContact O-CB 3.47Å; I184-L187 PolarHBondContact O-N 2.89Å; I184-L187 VanDerWaalsContact O-N 3.07Å; I184-I188 HydrophobicContact CG2-CD1 3.82Å; I184-I188 HydrophobicContact CG2-CG1 4.41Å; I184-I188 WeakPolarHBondContact O-CG1 3.28Å; I184-I188 PolarHBondContact O-N 3.09Å |
| 185 | D | 91.7 | Very high | 88.4 | Confident | 75 Ų | 75 | 69.7 Ų | 69.7 | 40% | 0.401 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.4 | -41.5 | 178.5 | -65 | -22.6 | 0 | 0 | 0 | 111.4 | Q181 L187 I188 E189 | Q181-D185 PolarHBondContact NE2-OD1 3.29Å; Q181-D185 VanDerWaalsContact O-CG 3.3Å; Q181-D185 PolarHBondContact O-N 2.98Å; D185-L187 VanDerWaalsContact C-N 3.33Å; D185-L187 PolarHBondContact O-N 3.47Å; D185-I188 PolarHBondContact O-N 2.73Å; D185-E189 PolarHBondContact O-N 3.3Å |
| 186 | S | 93.3 | Very high | 89 | Confident | 67 Ų | 67 | 72.2 Ų | 72.2 | 47% | 0.469 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.3 | -38.3 | 174.4 | -58.3 | 0 | 0 | 0 | 0 | 112.4 | N182 F183 I184 E189 L190 | N182-S186 WeakPolarHBondContact O-CB 3.34Å; N182-S186 PolarHBondContact O-N 2.95Å; N182-S186 PolarHBondContact O-OG 3.15Å; F183-S186 PolarHBondContact O-N 3.02Å; I184-S186 VanDerWaalsContact C-N 3.3Å; I184-S186 PolarHBondContact O-N 3.49Å; S186-E189 PolarHBondContact O-N 2.84Å; S186-L190 WeakPolarHBondContact O-CB 3.47Å; S186-L190 PolarHBondContact O-N 2.83Å |
| 187 | L | 91.6 | Very high | 89.1 | Confident | 28 Ų | 28 | 76.8 Ų | 76.8 | 15% | 0.147 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -69 | -36.9 | 175.3 | -71.2 | 174 | 0 | 0 | 0 | 111.9 | I60 V63 F183 I184 D185 L190 R191 | I60-L187 HydrophobicContact CD1-CB 4.21Å; I60-L187 HydrophobicContact CG1-CB 3.85Å; I60-L187 HydrophobicContact CG1-CD1 4.33Å; V63-L187 HydrophobicContact CB-CD1 4.48Å; V63-L187 HydrophobicContact CG1-CD1 4.29Å; V63-L187 HydrophobicContact CG2-CD1 4.34Å; F183-L187 HydrophobicContact CD1-CD1 4.13Å; F183-L187 HydrophobicContact CE1-CD1 3.69Å; F183-L187 HydrophobicContact CE1-CG 4.43Å; F183-L187 HydrophobicContact CZ-CD1 3.98Å; F183-L187 HydrophobicContact CZ-CD2 4.5Å; F183-L187 HydrophobicContact CZ-CG 4.34Å; F183-L187 WeakPolarHBondContact O-CG 3.45Å; F183-L187 PolarHBondContact O-N 3.14Å; I184-L187 WeakPolarHBondContact O-CB 3.47Å; I184-L187 PolarHBondContact O-N 2.89Å; I184-L187 VanDerWaalsContact O-N 3.07Å; D185-L187 VanDerWaalsContact C-N 3.33Å; D185-L187 PolarHBondContact O-N 3.47Å; L187-L190 PolarHBondContact O-N 2.92Å; L187-R191 VanDerWaalsContact O-CB 3.23Å; L187-R191 WeakPolarHBondContact O-CB 3.39Å; L187-R191 PolarHBondContact O-N 2.98Å |
| 188 | I | 91.4 | Very high | 89.2 | Confident | 84 Ų | 84 | 76.9 Ų | 76.9 | 43% | 0.431 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66.5 | -41.6 | 174.8 | -67.2 | 168.1 | 0 | 0 | 0 | 110.5 | I184 D185 R191 G192 | I184-I188 HydrophobicContact CG2-CD1 3.82Å; I184-I188 HydrophobicContact CG2-CG1 4.41Å; I184-I188 WeakPolarHBondContact O-CG1 3.28Å; I184-I188 PolarHBondContact O-N 3.09Å; D185-I188 PolarHBondContact O-N 2.73Å; I188-R191 WeakPolarHBondContact O-CB 3.31Å; I188-R191 PolarHBondContact O-N 2.85Å; I188-G192 PolarHBondContact O-N 3.33Å |
| 189 | E | 92.4 | Very high | 89.2 | Confident | 150 Ų | 150 | 74.2 Ų | 74.2 | 70% | 0.701 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.8 | -47 | 174.3 | -172.3 | -178.6 | 179.3 | 0 | 0 | 111.2 | D185 S186 R191 G192 F193 | D185-E189 PolarHBondContact O-N 3.3Å; S186-E189 PolarHBondContact O-N 2.84Å; E189-R191 PolarHBondContact O-N 2.66Å; E189-G192 WeakPolarHBondContact O-CA 3.39Å; E189-G192 PolarHBondContact O-N 2.93Å; E189-F193 PolarHBondContact O-N 2.96Å |
| 190 | L | 92.5 | Very high | 89 | Confident | 76 Ų | 76 | 68.9 Ų | 68.9 | 40% | 0.398 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -56.9 | -40.8 | 174.1 | 177.4 | 63.6 | 0 | 0 | 0 | 111.4 | S186 L187 F193 L194 | S186-L190 WeakPolarHBondContact O-CB 3.47Å; S186-L190 PolarHBondContact O-N 2.83Å; L187-L190 PolarHBondContact O-N 2.92Å; L190-F193 PolarHBondContact O-N 3.25Å; L190-L194 HydrophobicContact CD1-CD1 4.01Å; L190-L194 HydrophobicContact CD1-CG 4.03Å; L190-L194 HydrophobicContact CD2-CD1 4.49Å; L190-L194 HydrophobicContact CG-CD1 3.89Å; L190-L194 HydrophobicContact CG-CG 4.32Å; L190-L194 WeakPolarHBondContact O-CB 3.43Å; L190-L194 VanDerWaalsContact O-CG 3.3Å; L190-L194 WeakPolarHBondContact O-CG 3.5Å; L190-L194 PolarHBondContact O-N 3Å |
| 191 | R | 91.6 | Very high | 88.8 | Confident | 93 Ų | 93 | 69.7 Ų | 69.7 | 35% | 0.351 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.9 | -41.3 | 176.1 | -172.2 | -92.7 | -173.8 | -163.8 | -3.7 | 111.4 | M53 L56 D57 I60 L187 I188 E189 F195 | M53-R191 HydrophobicContact CE-CG 3.61Å; L56-R191 HydrophobicContact CD2-CB 3.61Å; L56-R191 HydrophobicContact CD2-CG 3.81Å; L56-R191 HydrophobicContact CG-CB 4.23Å; L56-R191 HydrophobicContact CG-CG 4.23Å; D57-R191 IonicContact OD1-CZ 2.85Å; D57-R191 IonicContact OD1-NE 3.06Å; D57-R191 PolarHBondContact OD1-NE 2.97Å; D57-R191 IonicContact OD1-NH2 3.99Å; D57-R191 PolarHBondContact OD1-NH2 3.18Å; D57-R191 IonicContact OD2-NH2 2.71Å; D57-R191 PolarHBondContact OD2-NH2 2.69Å; I60-R191 HydrophobicContact CD1-CB 4.06Å; I60-R191 HydrophobicContact CD1-CG 4.16Å; L187-R191 VanDerWaalsContact O-CB 3.23Å; L187-R191 WeakPolarHBondContact O-CB 3.39Å; L187-R191 PolarHBondContact O-N 2.98Å; I188-R191 WeakPolarHBondContact O-CB 3.31Å; I188-R191 PolarHBondContact O-N 2.85Å; E189-R191 PolarHBondContact O-N 2.66Å; R191-F195 VanDerWaalsContact O-CB 3.31Å; R191-F195 WeakPolarHBondContact O-CB 3.38Å; R191-F195 PolarHBondContact O-N 2.92Å |
| 192 | G | 88.6 | Confident | 88.5 | Confident | 39 Ų | 39 | 71.8 Ų | 71.8 | 40% | 0.402 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.4 | -48 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113 | I188 E189 F195 E196 | I188-G192 PolarHBondContact O-N 3.33Å; E189-G192 WeakPolarHBondContact O-CA 3.39Å; E189-G192 PolarHBondContact O-N 2.93Å; G192-F195 WeakPolarHBondContact O-CB 3.47Å; G192-F195 PolarHBondContact O-N 3Å; G192-E196 PolarHBondContact O-N 2.68Å |
| 193 | F | 88.9 | Confident | 88.2 | Confident | 109 Ų | 109 | 71.9 Ų | 71.9 | 48% | 0.478 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -61 | -48.6 | 177.8 | 173.6 | -96.6 | 0 | 0 | 0 | 112.4 | E189 L190 F195 E196 K197 | E189-F193 PolarHBondContact O-N 2.96Å; L190-F193 PolarHBondContact O-N 3.25Å; F193-F195 VanDerWaalsContact C-N 3.3Å; F193-F195 PolarHBondContact O-N 2.88Å; F193-E196 PolarHBondContact O-N 3.36Å; F193-K197 HydrophobicContact CD1-CG 4.21Å; F193-K197 HydrophobicContact CE1-CG 3.84Å; F193-K197 HydrophobicContact CE2-CD 4.48Å; F193-K197 HydrophobicContact CE2-CG 4.25Å; F193-K197 HydrophobicContact CZ-CD 4.2Å; F193-K197 HydrophobicContact CZ-CG 3.89Å; F193-K197 WeakPolarHBondContact O-CG 3.38Å; F193-K197 PolarHBondContact O-N 3.26Å |
| 194 | L | 87.4 | Confident | 87.8 | Confident | 51 Ų | 51 | 68.3 Ų | 68.3 | 27% | 0.267 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.2 | -38.6 | 178.6 | -74.5 | 173.9 | 0 | 0 | 0 | 111.3 | M53 L56 L190 K197 L198 | M53-L194 HydrophobicContact SD-CB 4.4Å; L56-L194 HydrophobicContact CD2-CD1 3.76Å; L190-L194 HydrophobicContact CD1-CD1 4.01Å; L190-L194 HydrophobicContact CD1-CG 4.03Å; L190-L194 HydrophobicContact CD2-CD1 4.49Å; L190-L194 HydrophobicContact CG-CD1 3.89Å; L190-L194 HydrophobicContact CG-CG 4.32Å; L190-L194 WeakPolarHBondContact O-CB 3.43Å; L190-L194 VanDerWaalsContact O-CG 3.3Å; L190-L194 WeakPolarHBondContact O-CG 3.5Å; L190-L194 PolarHBondContact O-N 3Å; L194-K197 PolarHBondContact O-N 3Å; L194-L198 VanDerWaalsContact O-CB 3.29Å; L194-L198 WeakPolarHBondContact O-CB 3.38Å; L194-L198 WeakPolarHBondContact O-CG 3.32Å; L194-L198 PolarHBondContact O-N 3.34Å |
| 195 | F | 87.6 | Confident | 87.6 | Confident | 69 Ų | 69 | 70.5 Ų | 70.5 | 30% | 0.303 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59.2 | -49 | 173.9 | -177.1 | -96.3 | 0 | 0 | 0 | 111.4 | L44 M53 R191 G192 F193 K197 L198 V199 | L44-F195 HydrophobicContact CD1-CD2 4.04Å; L44-F195 HydrophobicContact CD1-CE2 3.97Å; L44-F195 HydrophobicContact CD2-CD2 4.08Å; L44-F195 HydrophobicContact CD2-CE2 4.15Å; L44-F195 HydrophobicContact CG-CD2 4.08Å; L44-F195 HydrophobicContact CG-CE2 3.78Å; M53-F195 HydrophobicContact CE-CB 4.02Å; M53-F195 HydrophobicContact CE-CD2 4.21Å; M53-F195 HydrophobicContact SD-CB 4.34Å; R191-F195 VanDerWaalsContact O-CB 3.31Å; R191-F195 WeakPolarHBondContact O-CB 3.38Å; R191-F195 PolarHBondContact O-N 2.92Å; G192-F195 WeakPolarHBondContact O-CB 3.47Å; G192-F195 PolarHBondContact O-N 3Å; F193-F195 VanDerWaalsContact C-N 3.3Å; F193-F195 PolarHBondContact O-N 2.88Å; F195-K197 VanDerWaalsContact C-N 3.32Å; F195-K197 PolarHBondContact O-N 3.34Å; F195-L198 PolarHBondContact O-N 3.45Å; F195-V199 HydrophobicContact CD1-CG2 4.22Å; F195-V199 HydrophobicContact CD2-CG2 4.33Å; F195-V199 HydrophobicContact CE1-CG2 3.95Å; F195-V199 HydrophobicContact CE2-CG2 4.07Å; F195-V199 HydrophobicContact CG-CG2 4.41Å; F195-V199 HydrophobicContact CZ-CG2 3.87Å; F195-V199 WeakPolarHBondContact O-CB 3.29Å; F195-V199 WeakPolarHBondContact O-CG2 3.41Å; F195-V199 PolarHBondContact O-N 2.97Å |
| 196 | E | 86 | Confident | 87.4 | Confident | 95 Ų | 95 | 75 Ų | 75 | 44% | 0.444 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -59.4 | -43.5 | 177 | -167.3 | -172.5 | 163.8 | 0 | 0 | 111.6 | P39 G192 F193 V199 T200 K208 | P39-E196 HydrophobicContact CG-CG 4.33Å; G192-E196 PolarHBondContact O-N 2.68Å; F193-E196 PolarHBondContact O-N 3.36Å; E196-V199 PolarHBondContact O-N 2.91Å; E196-T200 WeakPolarHBondContact O-CB 3.44Å; E196-T200 PolarHBondContact O-N 3.43Å; E196-T200 PolarHBondContact O-OG1 3.48Å; E196-K208 IonicContact OE1-NZ 3.58Å |
| 197 | K | 84.4 | Confident | 87.1 | Confident | 127 Ų | 127 | 76.8 Ų | 76.8 | 55% | 0.552 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -64.3 | -41.9 | 178 | -69.7 | -65 | -176.2 | -175.1 | 0 | 113 | F193 L194 F195 V199 T200 | F193-K197 HydrophobicContact CD1-CG 4.21Å; F193-K197 HydrophobicContact CE1-CG 3.84Å; F193-K197 HydrophobicContact CE2-CD 4.48Å; F193-K197 HydrophobicContact CE2-CG 4.25Å; F193-K197 HydrophobicContact CZ-CD 4.2Å; F193-K197 HydrophobicContact CZ-CG 3.89Å; F193-K197 WeakPolarHBondContact O-CG 3.38Å; F193-K197 PolarHBondContact O-N 3.26Å; L194-K197 PolarHBondContact O-N 3Å; F195-K197 VanDerWaalsContact C-N 3.32Å; F195-K197 PolarHBondContact O-N 3.34Å; K197-V199 VanDerWaalsContact C-N 3.31Å; K197-T200 PolarHBondContact O-N 2.84Å |
| 198 | L | 85.6 | Confident | 86.9 | Confident | 61 Ų | 61 | 77.3 Ų | 77.3 | 32% | 0.319 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -73.3 | -24.4 | -179.8 | -71.2 | 170.1 | 0 | 0 | 0 | 112.8 | L44 A49 I52 M53 L194 F195 | L44-L198 HydrophobicContact CD2-CB 3.68Å; A49-L198 HydrophobicContact CB-CB 4.2Å; A49-L198 HydrophobicContact CB-CD1 4.17Å; A49-L198 HydrophobicContact CB-CD2 4.01Å; A49-L198 HydrophobicContact CB-CG 4.36Å; I52-L198 HydrophobicContact CG2-CD1 4.17Å; M53-L198 HydrophobicContact CG-CD1 3.99Å; M53-L198 HydrophobicContact SD-CD1 4.03Å; L194-L198 VanDerWaalsContact O-CB 3.29Å; L194-L198 WeakPolarHBondContact O-CB 3.38Å; L194-L198 WeakPolarHBondContact O-CG 3.32Å; L194-L198 PolarHBondContact O-N 3.34Å; F195-L198 PolarHBondContact O-N 3.45Å |
| 199 | V | 85.8 | Confident | 86.8 | Confident | 8 Ų | 8 | 76 Ų | 76 | 5% | 0.048 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -87.8 | -24.6 | 177.1 | 175.6 | 0 | 0 | 0 | 0 | 111.9 | R41 L44 F195 E196 K197 | R41-V199 HydrophobicContact CB-CG1 3.54Å; R41-V199 WeakPolarHBondContact O-CG1 3.24Å; L44-V199 HydrophobicContact CD2-CG2 3.61Å; L44-V199 HydrophobicContact CG-CG2 4.27Å; F195-V199 HydrophobicContact CD1-CG2 4.22Å; F195-V199 HydrophobicContact CD2-CG2 4.33Å; F195-V199 HydrophobicContact CE1-CG2 3.95Å; F195-V199 HydrophobicContact CE2-CG2 4.07Å; F195-V199 HydrophobicContact CG-CG2 4.41Å; F195-V199 HydrophobicContact CZ-CG2 3.87Å; F195-V199 WeakPolarHBondContact O-CB 3.29Å; F195-V199 WeakPolarHBondContact O-CG2 3.41Å; F195-V199 PolarHBondContact O-N 2.97Å; E196-V199 PolarHBondContact O-N 2.91Å; K197-V199 VanDerWaalsContact C-N 3.31Å |
| 200 | T | 83.7 | Confident | 86.6 | Confident | 26 Ų | 26 | 74.1 Ų | 74.1 | 16% | 0.16 | 38% | 0.379 | C | S | . | . | S | Bend | trans | -73.6 | 126.2 | 178.3 | -59.5 | 0 | 0 | 0 | 0 | 111.7 | E196 K197 E204 A205 | E196-T200 WeakPolarHBondContact O-CB 3.44Å; E196-T200 PolarHBondContact O-N 3.43Å; E196-T200 PolarHBondContact O-OG1 3.48Å; K197-T200 PolarHBondContact O-N 2.84Å; T200-E204 HydrophobicContact CG2-CB 4.07Å; T200-A205 HydrophobicContact CG2-CB 4.14Å |
| 201 | S | 82.3 | Confident | 86.5 | Confident | 32 Ų | 32 | 73.4 Ų | 73.4 | 22% | 0.224 | 37% | 0.373 | C | S | . | . | trans | -73.3 | 147.1 | 174 | 174.1 | 0 | 0 | 0 | 0 | 111.8 | M203 E204 A205 | S201-M203 PolarHBondContact O-N 3.11Å; S201-M203 VanDerWaalsContact O-N 3.12Å; S201-M203 PolarHBondContact OG-N 3.45Å; S201-E204 PolarHBondContact N-OE2 2.87Å; S201-E204 WeakPolarHBondContact O-CB 3.4Å; S201-E204 PolarHBondContact O-N 3.26Å; S201-A205 PolarHBondContact O-N 2.78Å | ||
| 202 | P | 82.1 | Confident | 86.4 | Confident | 103 Ų | 103 | 73.2 Ų | 73.2 | 67% | 0.669 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -53.6 | -32.6 | 172.1 | -26.6 | 34.5 | 0 | 0 | 0 | 113.6 | R206 | P202-R206 WeakPolarHBondContact O-CG 3.39Å; P202-R206 PolarHBondContact O-N 3.18Å; P202-R206 VanDerWaalsContact O-N 3.16Å |
| 203 | M | 83.9 | Confident | 86.7 | Confident | 104 Ų | 104 | 77.8 Ų | 77.8 | 51% | 0.512 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -71.1 | -42 | 176 | -166.4 | 64.4 | 76.3 | 0 | 0 | 111.8 | S201 A205 R206 H207 | S201-M203 PolarHBondContact O-N 3.11Å; S201-M203 VanDerWaalsContact O-N 3.12Å; S201-M203 PolarHBondContact OG-N 3.45Å; M203-A205 VanDerWaalsContact C-N 3.34Å; M203-A205 PolarHBondContact O-N 2.95Å; M203-R206 PolarHBondContact O-N 3.23Å; M203-H207 PolarHBondContact O-CD2 2.96Å; M203-H207 VanDerWaalsContact O-CD2 3.29Å; M203-H207 PolarHBondContact O-N 3.46Å |
| 204 | E | 83.9 | Confident | 86.9 | Confident | 36 Ų | 36 | 76.1 Ų | 76.1 | 17% | 0.168 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63 | -41.8 | 175.4 | -71 | 168.5 | -165.5 | 0 | 0 | 111.3 | S40 T200 S201 R206 H207 K208 | S40-E204 VanDerWaalsContact CB-OE1 3.31Å; S40-E204 WeakPolarHBondContact CB-OE1 3.33Å; S40-E204 PolarHBondContact OG-OE1 2.98Å; T200-E204 HydrophobicContact CG2-CB 4.07Å; S201-E204 PolarHBondContact N-OE2 2.87Å; S201-E204 WeakPolarHBondContact O-CB 3.4Å; S201-E204 PolarHBondContact O-N 3.26Å; E204-R206 VanDerWaalsContact C-N 3.33Å; E204-R206 PolarHBondContact O-N 3.13Å; E204-H207 PolarHBondContact O-N 3.31Å; E204-K208 WeakPolarHBondContact O-CB 3.48Å; E204-K208 VanDerWaalsContact O-CG 3.29Å; E204-K208 WeakPolarHBondContact O-CG 3.45Å; E204-K208 PolarHBondContact O-N 3.45Å |
| 205 | A | 84.8 | Confident | 87.2 | Confident | 48 Ų | 48 | 75.1 Ų | 75.1 | 40% | 0.397 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -60.4 | -42.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | T200 S201 M203 K208 A209 | T200-A205 HydrophobicContact CG2-CB 4.14Å; S201-A205 PolarHBondContact O-N 2.78Å; M203-A205 VanDerWaalsContact C-N 3.34Å; M203-A205 PolarHBondContact O-N 2.95Å; A205-K208 PolarHBondContact O-N 3.41Å; A205-A209 WeakPolarHBondContact O-CB 3.25Å; A205-A209 PolarHBondContact O-N 3.06Å |
| 206 | R | 87.4 | Confident | 87.5 | Confident | 169 Ų | 169 | 76.3 Ų | 76.3 | 64% | 0.638 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -64.6 | -44.2 | 174.5 | -73.9 | 177.6 | -177.9 | 173.6 | 1.1 | 112.1 | P202 M203 E204 A209 Q210 | P202-R206 WeakPolarHBondContact O-CG 3.39Å; P202-R206 PolarHBondContact O-N 3.18Å; P202-R206 VanDerWaalsContact O-N 3.16Å; M203-R206 PolarHBondContact O-N 3.23Å; E204-R206 VanDerWaalsContact C-N 3.33Å; E204-R206 PolarHBondContact O-N 3.13Å; R206-A209 PolarHBondContact O-N 3.23Å; R206-Q210 WeakPolarHBondContact O-CG 3.43Å; R206-Q210 PolarHBondContact O-N 3.38Å |
| 207 | H | 86.8 | Confident | 87.9 | Confident | 104 Ų | 104 | 79.1 Ų | 79.1 | 48% | 0.481 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 176.9 | -71.1 | -168.8 | 0 | 0 | 0 | 111.6 | M203 E204 A209 Q210 F211 | M203-H207 PolarHBondContact O-CD2 2.96Å; M203-H207 VanDerWaalsContact O-CD2 3.29Å; M203-H207 PolarHBondContact O-N 3.46Å; E204-H207 PolarHBondContact O-N 3.31Å; H207-A209 PolarHBondContact O-N 3.13Å; H207-Q210 PolarHBondContact O-N 3.32Å; H207-F211 VanDerWaalsContact O-CB 3.25Å; H207-F211 WeakPolarHBondContact O-CB 3.16Å; H207-F211 PolarHBondContact O-N 3.41Å |
| 208 | K | 86.9 | Confident | 88.3 | Confident | 39 Ų | 39 | 78.4 Ų | 78.4 | 17% | 0.17 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -58.9 | -45.9 | 174.2 | -71.9 | -173.6 | 178.1 | -171.8 | 0 | 111.1 | L37 E196 E204 A205 F211 I212 | L37-K208 HydrophobicContact CB-CD 4.34Å; L37-K208 HydrophobicContact CB-CG 4.08Å; L37-K208 HydrophobicContact CD1-CB 4.05Å; L37-K208 HydrophobicContact CD1-CG 3.84Å; L37-K208 HydrophobicContact CD2-CG 3.97Å; L37-K208 HydrophobicContact CG-CG 4.18Å; L37-K208 WeakPolarHBondContact O-CE 3.3Å; L37-K208 PolarHBondContact O-NZ 3.08Å; E196-K208 IonicContact OE1-NZ 3.58Å; E204-K208 WeakPolarHBondContact O-CB 3.48Å; E204-K208 VanDerWaalsContact O-CG 3.29Å; E204-K208 WeakPolarHBondContact O-CG 3.45Å; E204-K208 PolarHBondContact O-N 3.45Å; A205-K208 PolarHBondContact O-N 3.41Å; K208-F211 PolarHBondContact O-N 2.87Å; K208-I212 VanDerWaalsContact O-CG1 3.29Å; K208-I212 WeakPolarHBondContact O-CG1 3.47Å; K208-I212 PolarHBondContact O-N 2.89Å |
| 209 | A | 89.4 | Confident | 88.7 | Confident | 57 Ų | 57 | 79.9 Ų | 79.9 | 47% | 0.471 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.6 | -45 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | A205 R206 H207 I212 Q213 | A205-A209 WeakPolarHBondContact O-CB 3.25Å; A205-A209 PolarHBondContact O-N 3.06Å; R206-A209 PolarHBondContact O-N 3.23Å; H207-A209 PolarHBondContact O-N 3.13Å; A209-I212 PolarHBondContact O-N 3.24Å; A209-Q213 WeakPolarHBondContact O-CB 3.41Å; A209-Q213 PolarHBondContact O-N 3.09Å |
| 210 | Q | 89.9 | Confident | 89.2 | Confident | 110 Ų | 110 | 82.4 Ų | 82.4 | 51% | 0.514 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.3 | -43.6 | 176.2 | -74.3 | 174.3 | -14.4 | 0 | 0 | 111.6 | R206 H207 I212 Q213 D214 | R206-Q210 WeakPolarHBondContact O-CG 3.43Å; R206-Q210 PolarHBondContact O-N 3.38Å; H207-Q210 PolarHBondContact O-N 3.32Å; Q210-I212 PolarHBondContact O-N 3.23Å; Q210-Q213 WeakPolarHBondContact O-CB 3.41Å; Q210-Q213 PolarHBondContact O-N 3.42Å; Q210-Q213 VanDerWaalsContact O-N 3.16Å; Q210-D214 PolarHBondContact O-N 3.45Å |
| 211 | F | 88.6 | Confident | 89.8 | Confident | 62 Ų | 62 | 84.8 Ų | 84.8 | 27% | 0.272 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -59.8 | -45.6 | 176.9 | -180 | -102.2 | 0 | 0 | 0 | 112.6 | L34 L37 H207 K208 Q213 D214 I215 | L34-F211 HydrophobicContact CB-CZ 3.9Å; L34-F211 HydrophobicContact CD2-CE2 3.81Å; L34-F211 HydrophobicContact CD2-CZ 3.61Å; L34-F211 HydrophobicContact CG-CZ 4.22Å; L37-F211 HydrophobicContact CD1-CB 4.43Å; L37-F211 HydrophobicContact CD1-CD1 3.43Å; L37-F211 VanDerWaalsContact CD1-CD1 3.43Å; L37-F211 HydrophobicContact CD1-CE1 3.9Å; L37-F211 HydrophobicContact CD1-CG 4.21Å; L37-F211 HydrophobicContact CD2-CD1 4.36Å; L37-F211 HydrophobicContact CD2-CG 4.49Å; L37-F211 HydrophobicContact CG-CD1 4.05Å; L37-F211 HydrophobicContact CG-CE1 4.18Å; H207-F211 VanDerWaalsContact O-CB 3.25Å; H207-F211 WeakPolarHBondContact O-CB 3.16Å; H207-F211 PolarHBondContact O-N 3.41Å; K208-F211 PolarHBondContact O-N 2.87Å; F211-Q213 VanDerWaalsContact C-N 3.31Å; F211-Q213 PolarHBondContact O-N 3.48Å; F211-D214 PolarHBondContact O-N 2.93Å; F211-I215 HydrophobicContact CD1-CD1 3.61Å; F211-I215 HydrophobicContact CE1-CD1 3.24Å; F211-I215 HydrophobicContact CE1-CG1 4.42Å; F211-I215 HydrophobicContact CE2-CD1 4.22Å; F211-I215 HydrophobicContact CG-CD1 4.31Å; F211-I215 HydrophobicContact CZ-CD1 3.61Å; F211-I215 WeakPolarHBondContact O-CG1 3.49Å; F211-I215 PolarHBondContact O-N 2.98Å |
| 212 | I | 91.4 | Very high | 90.5 | Very high | 88 Ų | 88 | 87.3 Ų | 87.3 | 45% | 0.451 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.9 | -41.8 | 175.4 | -68.4 | 166.6 | 0 | 0 | 0 | 110.5 | K208 A209 Q210 I215 N216 | K208-I212 VanDerWaalsContact O-CG1 3.29Å; K208-I212 WeakPolarHBondContact O-CG1 3.47Å; K208-I212 PolarHBondContact O-N 2.89Å; A209-I212 PolarHBondContact O-N 3.24Å; Q210-I212 PolarHBondContact O-N 3.23Å; I212-I215 PolarHBondContact O-N 2.91Å; I212-N216 WeakPolarHBondContact O-CB 3.25Å; I212-N216 PolarHBondContact O-N 3.01Å; I212-N216 PolarHBondContact O-ND2 3.29Å |
| 213 | Q | 93.7 | Very high | 91.2 | Very high | 136 Ų | 136 | 87 Ų | 87 | 64% | 0.636 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -63.1 | -43 | 177.8 | -172.8 | -179.9 | 16.1 | 0 | 0 | 112.2 | A209 Q210 F211 N216 R217 | A209-Q213 WeakPolarHBondContact O-CB 3.41Å; A209-Q213 PolarHBondContact O-N 3.09Å; Q210-Q213 WeakPolarHBondContact O-CB 3.41Å; Q210-Q213 PolarHBondContact O-N 3.42Å; Q210-Q213 VanDerWaalsContact O-N 3.16Å; F211-Q213 VanDerWaalsContact C-N 3.31Å; F211-Q213 PolarHBondContact O-N 3.48Å; Q213-N216 PolarHBondContact O-N 3.33Å; Q213-R217 PolarHBondContact O-N 3.43Å |
| 214 | D | 92.8 | Very high | 91.8 | Very high | 73 Ų | 73 | 87.5 Ų | 87.5 | 39% | 0.39 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64.8 | -42.2 | 177.1 | -83.9 | -39.4 | 0 | 0 | 0 | 112.1 | Q210 F211 R217 Q218 | Q210-D214 PolarHBondContact O-N 3.45Å; F211-D214 PolarHBondContact O-N 2.93Å; D214-R217 PolarHBondContact O-N 3.4Å; D214-R217 IonicContact OD1-CZ 3.7Å; D214-R217 IonicContact OD1-NE 2.66Å; D214-R217 IonicContact OD1-NH2 3.82Å; D214-R217 PolarHBondContact OD1-NH2 3.45Å; D214-Q218 WeakPolarHBondContact O-CG 3.38Å; D214-Q218 PolarHBondContact O-N 3.1Å |
| 215 | I | 93.8 | Very high | 92.4 | Very high | 30 Ų | 30 | 90.2 Ų | 90.2 | 15% | 0.154 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -60.4 | -46.6 | 173.1 | -71.2 | 170.1 | 0 | 0 | 0 | 110.4 | L34 F211 I212 R217 Q218 N219 | L34-I215 HydrophobicContact CD1-CD1 3.7Å; L34-I215 HydrophobicContact CD1-CG1 4.17Å; L34-I215 HydrophobicContact CD2-CD1 4.08Å; L34-I215 HydrophobicContact CD2-CG1 4.22Å; L34-I215 HydrophobicContact CG-CD1 4.46Å; F211-I215 HydrophobicContact CD1-CD1 3.61Å; F211-I215 HydrophobicContact CE1-CD1 3.24Å; F211-I215 HydrophobicContact CE1-CG1 4.42Å; F211-I215 HydrophobicContact CE2-CD1 4.22Å; F211-I215 HydrophobicContact CG-CD1 4.31Å; F211-I215 HydrophobicContact CZ-CD1 3.61Å; F211-I215 WeakPolarHBondContact O-CG1 3.49Å; F211-I215 PolarHBondContact O-N 2.98Å; I212-I215 PolarHBondContact O-N 2.91Å; I215-R217 VanDerWaalsContact C-N 3.29Å; I215-R217 PolarHBondContact O-N 3.16Å; I215-Q218 PolarHBondContact O-N 3.28Å; I215-N219 WeakPolarHBondContact O-CB 3.34Å; I215-N219 PolarHBondContact O-N 2.95Å |
| 216 | N | 94.1 | Very high | 93 | Very high | 95 Ų | 95 | 91.4 Ų | 91.4 | 51% | 0.508 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 180 | -73.1 | -17.7 | 0 | 0 | 0 | 111.6 | I212 Q213 N219 S220 | I212-N216 WeakPolarHBondContact O-CB 3.25Å; I212-N216 PolarHBondContact O-N 3.01Å; I212-N216 PolarHBondContact O-ND2 3.29Å; Q213-N216 PolarHBondContact O-N 3.33Å; N216-N219 PolarHBondContact O-N 3.31Å; N216-S220 WeakPolarHBondContact O-CB 3.46Å; N216-S220 PolarHBondContact O-N 3.33Å |
| 217 | R | 94.4 | Very high | 93.4 | Very high | 154 Ų | 154 | 86.4 Ų | 86.4 | 58% | 0.581 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -64.8 | -44.9 | 174.4 | -174.3 | 177.3 | 62.5 | 165.8 | -7.2 | 111.6 | Q213 D214 I215 S220 N221 | Q213-R217 PolarHBondContact O-N 3.43Å; D214-R217 PolarHBondContact O-N 3.4Å; D214-R217 IonicContact OD1-CZ 3.7Å; D214-R217 IonicContact OD1-NE 2.66Å; D214-R217 IonicContact OD1-NH2 3.82Å; D214-R217 PolarHBondContact OD1-NH2 3.45Å; I215-R217 VanDerWaalsContact C-N 3.29Å; I215-R217 PolarHBondContact O-N 3.16Å; R217-S220 PolarHBondContact O-N 2.88Å; R217-N221 VanDerWaalsContact O-CG 3.27Å; R217-N221 PolarHBondContact O-N 2.82Å; R217-N221 PolarHBondContact O-OD1 3.16Å |
| 218 | Q | 93.9 | Very high | 94 | Very high | 111 Ų | 111 | 85.1 Ų | 85.1 | 52% | 0.519 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 176.2 | -74.8 | -178 | -0.6 | 0 | 0 | 111.7 | D214 I215 S220 N221 N222 | D214-Q218 WeakPolarHBondContact O-CG 3.38Å; D214-Q218 PolarHBondContact O-N 3.1Å; I215-Q218 PolarHBondContact O-N 3.28Å; Q218-S220 PolarHBondContact O-N 3.25Å; Q218-N221 PolarHBondContact O-N 3.08Å; Q218-N222 WeakPolarHBondContact O-CB 3.49Å; Q218-N222 PolarHBondContact O-N 2.99Å; Q218-N222 PolarHBondContact O-ND2 3.42Å; Q218-N222 PolarHBondContact O-OD1 3.17Å |
| 219 | N | 93.6 | Very high | 94.5 | Very high | 92 Ų | 92 | 88 Ų | 88 | 49% | 0.492 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.8 | -43 | 176.9 | -76.6 | -7.8 | 0 | 0 | 0 | 111.7 | I215 N216 N221 N222 Q223 | I215-N219 WeakPolarHBondContact O-CB 3.34Å; I215-N219 PolarHBondContact O-N 2.95Å; N216-N219 PolarHBondContact O-N 3.31Å; N219-N221 PolarHBondContact O-N 3.16Å; N219-N222 PolarHBondContact O-N 3.37Å; N219-Q223 WeakPolarHBondContact O-CB 3.38Å; N219-Q223 PolarHBondContact O-N 2.88Å |
| 220 | S | 96.6 | Very high | 94.8 | Very high | 62 Ų | 62 | 90.9 Ų | 90.9 | 43% | 0.434 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61.6 | -42.4 | 175.7 | -174.2 | 0 | 0 | 0 | 0 | 112.1 | N216 R217 Q218 Q223 Q224 | N216-S220 WeakPolarHBondContact O-CB 3.46Å; N216-S220 PolarHBondContact O-N 3.33Å; R217-S220 PolarHBondContact O-N 2.88Å; Q218-S220 PolarHBondContact O-N 3.25Å; S220-Q223 PolarHBondContact O-N 2.98Å; S220-Q224 WeakPolarHBondContact O-CG 3.27Å; S220-Q224 PolarHBondContact O-N 3.11Å; S220-Q224 VanDerWaalsContact O-N 3.08Å |
| 221 | N | 96.1 | Very high | 95.2 | Very high | 76 Ų | 76 | 90.9 Ų | 90.9 | 41% | 0.406 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.4 | -42.5 | 177.5 | -69.4 | -4.9 | 0 | 0 | 0 | 111.3 | R217 Q218 N219 Q223 Q224 I225 | R217-N221 VanDerWaalsContact O-CG 3.27Å; R217-N221 PolarHBondContact O-N 2.82Å; R217-N221 PolarHBondContact O-OD1 3.16Å; Q218-N221 PolarHBondContact O-N 3.08Å; N219-N221 PolarHBondContact O-N 3.16Å; N221-Q223 VanDerWaalsContact C-N 3.3Å; N221-Q223 PolarHBondContact O-N 3.46Å; N221-Q224 PolarHBondContact O-N 3.24Å; N221-I225 WeakPolarHBondContact O-CG1 3.36Å; N221-I225 PolarHBondContact O-N 3.15Å |
| 222 | N | 95.7 | Very high | 95.6 | Very high | 84 Ų | 84 | 92.3 Ų | 92.3 | 45% | 0.449 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.3 | -40.4 | 176.3 | -69.2 | -12.5 | 0 | 0 | 0 | 111 | Q218 N219 I225 I226 | Q218-N222 WeakPolarHBondContact O-CB 3.49Å; Q218-N222 PolarHBondContact O-N 2.99Å; Q218-N222 PolarHBondContact O-ND2 3.42Å; Q218-N222 PolarHBondContact O-OD1 3.17Å; N219-N222 PolarHBondContact O-N 3.37Å; N222-I225 PolarHBondContact O-N 3.43Å; N222-I226 VanDerWaalsContact O-CG1 3.28Å; N222-I226 WeakPolarHBondContact O-CG1 3.1Å; N222-I226 PolarHBondContact O-N 3.13Å |
| 223 | Q | 97 | Very high | 95.9 | Very high | 96 Ų | 96 | 93.4 Ų | 93.4 | 45% | 0.449 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.7 | -45.7 | 176 | -170.3 | 61.2 | 46.2 | 0 | 0 | 111.3 | N219 S220 N221 I225 I226 D227 | N219-Q223 WeakPolarHBondContact O-CB 3.38Å; N219-Q223 PolarHBondContact O-N 2.88Å; S220-Q223 PolarHBondContact O-N 2.98Å; N221-Q223 VanDerWaalsContact C-N 3.3Å; N221-Q223 PolarHBondContact O-N 3.46Å; Q223-I225 VanDerWaalsContact C-N 3.29Å; Q223-I225 PolarHBondContact O-N 3.3Å; Q223-I226 WeakPolarHBondContact O-CB 3.3Å; Q223-I226 PolarHBondContact O-N 3.23Å; Q223-I226 VanDerWaalsContact O-N 3.14Å; Q223-D227 PolarHBondContact NE2-OD1 3.46Å; Q223-D227 PolarHBondContact O-N 3.49Å |
| 224 | Q | 97.1 | Very high | 96.1 | Very high | 116 Ų | 116 | 89.5 Ų | 89.5 | 54% | 0.542 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -59 | -41.3 | 175.4 | -72.3 | 175.5 | 1.9 | 0 | 0 | 112.2 | S220 N221 D227 T228 | S220-Q224 WeakPolarHBondContact O-CG 3.27Å; S220-Q224 PolarHBondContact O-N 3.11Å; S220-Q224 VanDerWaalsContact O-N 3.08Å; N221-Q224 PolarHBondContact O-N 3.24Å; Q224-D227 PolarHBondContact O-N 3.45Å; Q224-T228 VanDerWaalsContact O-CG2 3.3Å; Q224-T228 WeakPolarHBondContact O-CG2 3.42Å; Q224-T228 PolarHBondContact O-N 3.46Å; Q224-T228 PolarHBondContact O-OG1 3.02Å |
| 225 | I | 96.6 | Very high | 96.3 | Very high | 92 Ų | 92 | 90.8 Ų | 90.8 | 47% | 0.472 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 176.3 | -65.9 | 165.3 | 0 | 0 | 0 | 110.3 | N221 N222 Q223 D227 T228 L229 | N221-I225 WeakPolarHBondContact O-CG1 3.36Å; N221-I225 PolarHBondContact O-N 3.15Å; N222-I225 PolarHBondContact O-N 3.43Å; Q223-I225 VanDerWaalsContact C-N 3.29Å; Q223-I225 PolarHBondContact O-N 3.3Å; I225-D227 PolarHBondContact O-N 3.11Å; I225-T228 WeakPolarHBondContact CA-OG1 3.44Å; I225-T228 PolarHBondContact O-N 3.39Å; I225-T228 PolarHBondContact O-OG1 2.98Å; I225-L229 HydrophobicContact CG2-CD1 3.94Å; I225-L229 HydrophobicContact CG2-CG 4.4Å; I225-L229 WeakPolarHBondContact O-CG 3.28Å; I225-L229 PolarHBondContact O-N 3.3Å |
| 226 | I | 96.3 | Very high | 96.5 | Very high | 73 Ų | 73 | 97.1 Ų | 97.1 | 37% | 0.374 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -57.2 | -51.2 | 175.9 | -70 | 164.7 | 0 | 0 | 0 | 110 | N222 Q223 T228 L229 E230 | N222-I226 VanDerWaalsContact O-CG1 3.28Å; N222-I226 WeakPolarHBondContact O-CG1 3.1Å; N222-I226 PolarHBondContact O-N 3.13Å; Q223-I226 WeakPolarHBondContact O-CB 3.3Å; Q223-I226 PolarHBondContact O-N 3.23Å; Q223-I226 VanDerWaalsContact O-N 3.14Å; I226-T228 VanDerWaalsContact C-N 3.3Å; I226-T228 PolarHBondContact O-N 3.43Å; I226-L229 PolarHBondContact O-N 2.97Å; I226-L229 VanDerWaalsContact O-N 3.09Å; I226-E230 HydrophobicContact CG2-CG 4.17Å; I226-E230 WeakPolarHBondContact O-CB 3.5Å; I226-E230 WeakPolarHBondContact O-CG 3.35Å; I226-E230 PolarHBondContact O-N 2.92Å |
| 227 | D | 97.6 | Very high | 96.6 | Very high | 64 Ų | 64 | 96.1 Ų | 96.1 | 34% | 0.342 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.4 | -40.4 | -179.5 | -60 | -16.7 | 0 | 0 | 0 | 111.4 | Q223 Q224 I225 N231 | Q223-D227 PolarHBondContact NE2-OD1 3.46Å; Q223-D227 PolarHBondContact O-N 3.49Å; Q224-D227 PolarHBondContact O-N 3.45Å; I225-D227 PolarHBondContact O-N 3.11Å; D227-N231 WeakPolarHBondContact O-CB 3.35Å; D227-N231 VanDerWaalsContact O-CG 3.26Å; D227-N231 PolarHBondContact O-N 3.36Å; D227-N231 PolarHBondContact O-ND2 3.5Å |
| 228 | T | 97.7 | Very high | 96.8 | Very high | 77 Ų | 77 | 95 Ų | 95 | 47% | 0.472 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65 | -42.1 | 175.9 | 57.6 | 0 | 0 | 0 | 0 | 112.4 | Q224 I225 I226 N231 E232 | Q224-T228 VanDerWaalsContact O-CG2 3.3Å; Q224-T228 WeakPolarHBondContact O-CG2 3.42Å; Q224-T228 PolarHBondContact O-N 3.46Å; Q224-T228 PolarHBondContact O-OG1 3.02Å; I225-T228 WeakPolarHBondContact CA-OG1 3.44Å; I225-T228 PolarHBondContact O-N 3.39Å; I225-T228 PolarHBondContact O-OG1 2.98Å; I226-T228 VanDerWaalsContact C-N 3.3Å; I226-T228 PolarHBondContact O-N 3.43Å; T228-N231 PolarHBondContact O-N 3.31Å; T228-E232 PolarHBondContact O-N 3.45Å |
| 229 | L | 97.3 | Very high | 97 | Very high | 100 Ų | 100 | 94.5 Ų | 94.5 | 52% | 0.524 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.4 | -38.1 | 178.8 | -70.2 | 173.8 | 0 | 0 | 0 | 111.9 | I225 I226 E232 L233 | I225-L229 HydrophobicContact CG2-CD1 3.94Å; I225-L229 HydrophobicContact CG2-CG 4.4Å; I225-L229 WeakPolarHBondContact O-CG 3.28Å; I225-L229 PolarHBondContact O-N 3.3Å; I226-L229 PolarHBondContact O-N 2.97Å; I226-L229 VanDerWaalsContact O-N 3.09Å; L229-E232 PolarHBondContact O-N 3.47Å; L229-L233 VanDerWaalsContact O-CB 3.27Å; L229-L233 WeakPolarHBondContact O-CB 3.46Å; L229-L233 PolarHBondContact O-N 3.21Å |
| 230 | E | 97.3 | Very high | 97.2 | Very high | 118 Ų | 118 | 96.9 Ų | 96.9 | 55% | 0.551 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.7 | -43.8 | 174.5 | -74.2 | -177.9 | 169.8 | 0 | 0 | 111.3 | I226 L233 A234 | I226-E230 HydrophobicContact CG2-CG 4.17Å; I226-E230 WeakPolarHBondContact O-CB 3.5Å; I226-E230 WeakPolarHBondContact O-CG 3.35Å; I226-E230 PolarHBondContact O-N 2.92Å; E230-L233 PolarHBondContact O-N 2.99Å; E230-A234 WeakPolarHBondContact O-CB 3.36Å; E230-A234 PolarHBondContact O-N 2.87Å |
| 231 | N | 97.6 | Very high | 97.2 | Very high | 109 Ų | 109 | 97.7 Ų | 97.7 | 58% | 0.583 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.9 | -45.1 | 175.1 | -74.8 | -42.4 | 0 | 0 | 0 | 112.3 | D227 T228 L233 A234 E235 | D227-N231 WeakPolarHBondContact O-CB 3.35Å; D227-N231 VanDerWaalsContact O-CG 3.26Å; D227-N231 PolarHBondContact O-N 3.36Å; D227-N231 PolarHBondContact O-ND2 3.5Å; T228-N231 PolarHBondContact O-N 3.31Å; N231-L233 VanDerWaalsContact C-N 3.3Å; N231-L233 PolarHBondContact O-N 3.48Å; N231-A234 PolarHBondContact O-N 3.31Å; N231-E235 PolarHBondContact O-N 3.37Å |
| 232 | E | 97.5 | Very high | 97.2 | Very high | 93 Ų | 93 | 95.9 Ų | 95.9 | 44% | 0.435 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.6 | -40.7 | 174.8 | -81.5 | -166.7 | -157.8 | 0 | 0 | 112.3 | T228 L229 R236 | T228-E232 PolarHBondContact O-N 3.45Å; L229-E232 PolarHBondContact O-N 3.47Å; E232-R236 WeakPolarHBondContact O-CB 3.04Å; E232-R236 WeakPolarHBondContact O-CG 3.16Å; E232-R236 PolarHBondContact O-N 3.5Å; E232-R236 IonicContact OE2-CZ 2.68Å; E232-R236 IonicContact OE2-NH1 3.66Å; E232-R236 PolarHBondContact OE2-NH1 2.91Å; E232-R236 IonicContact OE2-NH2 3.9Å; E232-R236 PolarHBondContact OE2-NH2 3.39Å |
| 233 | L | 96.4 | Very high | 97.3 | Very high | 111 Ų | 111 | 97.6 Ų | 97.6 | 58% | 0.581 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -65.5 | -43.4 | 177.6 | -175.4 | 142.7 | 0 | 0 | 0 | 110.6 | L229 E230 N231 R236 M237 | L229-L233 VanDerWaalsContact O-CB 3.27Å; L229-L233 WeakPolarHBondContact O-CB 3.46Å; L229-L233 PolarHBondContact O-N 3.21Å; E230-L233 PolarHBondContact O-N 2.99Å; N231-L233 VanDerWaalsContact C-N 3.3Å; N231-L233 PolarHBondContact O-N 3.48Å; L233-R236 PolarHBondContact O-N 3.05Å; L233-M237 HydrophobicContact CD2-CG 4.03Å; L233-M237 HydrophobicContact CG-CG 4.47Å; L233-M237 WeakPolarHBondContact O-CB 3.41Å; L233-M237 WeakPolarHBondContact O-CG 3.07Å; L233-M237 PolarHBondContact O-N 3.23Å |
| 234 | A | 97.9 | Very high | 97.4 | Very high | 53 Ų | 53 | 96.1 Ų | 96.1 | 44% | 0.438 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.2 | -46.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | E230 N231 M237 K238 | E230-A234 WeakPolarHBondContact O-CB 3.36Å; E230-A234 PolarHBondContact O-N 2.87Å; N231-A234 PolarHBondContact O-N 3.31Å; A234-M237 PolarHBondContact O-N 2.92Å; A234-K238 WeakPolarHBondContact O-CB 3.17Å; A234-K238 PolarHBondContact O-N 2.82Å |
| 235 | E | 97.9 | Very high | 97.4 | Very high | 101 Ų | 101 | 97 Ų | 97 | 47% | 0.472 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.1 | -42.1 | 177.2 | -78.1 | -61.5 | 136.5 | 0 | 0 | 112.2 | N231 M237 K238 N239 | N231-E235 PolarHBondContact O-N 3.37Å; E235-M237 VanDerWaalsContact C-N 3.34Å; E235-M237 PolarHBondContact O-N 3.44Å; E235-K238 PolarHBondContact O-N 3.08Å; E235-N239 WeakPolarHBondContact O-CB 3.07Å; E235-N239 PolarHBondContact O-N 3.22Å; E235-N239 PolarHBondContact O-ND2 3.28Å |
| 236 | R | 97.1 | Very high | 97.4 | Very high | 162 Ų | 162 | 99.7 Ų | 99.7 | 61% | 0.611 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.5 | -39.3 | 174.5 | -74.4 | -165.8 | -175.3 | 97.3 | 2.8 | 112.3 | E232 L233 R240 | E232-R236 WeakPolarHBondContact O-CB 3.04Å; E232-R236 WeakPolarHBondContact O-CG 3.16Å; E232-R236 PolarHBondContact O-N 3.5Å; E232-R236 IonicContact OE2-CZ 2.68Å; E232-R236 IonicContact OE2-NH1 3.66Å; E232-R236 PolarHBondContact OE2-NH1 2.91Å; E232-R236 IonicContact OE2-NH2 3.9Å; E232-R236 PolarHBondContact OE2-NH2 3.39Å; L233-R236 PolarHBondContact O-N 3.05Å; R236-R240 WeakPolarHBondContact O-CB 3.15Å; R236-R240 PolarHBondContact O-N 3.37Å |
| 237 | M | 96.8 | Very high | 97.5 | Very high | 75 Ų | 75 | 101.7 Ų | 101.7 | 37% | 0.369 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 175.8 | -74.5 | -68.4 | -70.2 | 0 | 0 | 111.5 | L233 A234 E235 R240 N241 | L233-M237 HydrophobicContact CD2-CG 4.03Å; L233-M237 HydrophobicContact CG-CG 4.47Å; L233-M237 WeakPolarHBondContact O-CB 3.41Å; L233-M237 WeakPolarHBondContact O-CG 3.07Å; L233-M237 PolarHBondContact O-N 3.23Å; A234-M237 PolarHBondContact O-N 2.92Å; E235-M237 VanDerWaalsContact C-N 3.34Å; E235-M237 PolarHBondContact O-N 3.44Å; M237-R240 PolarHBondContact O-N 3.49Å; M237-R240 PolarHBondContact SD-NH2 2.91Å; M237-N241 WeakPolarHBondContact O-CB 3.29Å; M237-N241 PolarHBondContact O-N 2.9Å; M237-N241 PolarHBondContact O-ND2 3.46Å; M237-N241 PolarHBondContact O-OD1 3.15Å |
| 238 | K | 98.1 | Very high | 97.5 | Very high | 129 Ų | 129 | 103 Ų | 103 | 56% | 0.561 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.5 | -46.6 | 176.2 | -178.2 | -178.3 | 173.9 | -170.5 | 0 | 112 | A234 E235 R240 N241 A242 | A234-K238 WeakPolarHBondContact O-CB 3.17Å; A234-K238 PolarHBondContact O-N 2.82Å; E235-K238 PolarHBondContact O-N 3.08Å; K238-R240 PolarHBondContact O-N 3.13Å; K238-N241 PolarHBondContact O-N 3.42Å; K238-A242 PolarHBondContact O-N 2.97Å |
| 239 | N | 97.9 | Very high | 97.5 | Very high | 102 Ų | 102 | 105.5 Ų | 105.5 | 55% | 0.545 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.7 | -44.5 | 177.1 | -73.3 | -21.1 | 0 | 0 | 0 | 111.9 | E235 N241 A242 E243 | E235-N239 WeakPolarHBondContact O-CB 3.07Å; E235-N239 PolarHBondContact O-N 3.22Å; E235-N239 PolarHBondContact O-ND2 3.28Å; N239-N241 PolarHBondContact O-N 2.99Å; N239-A242 PolarHBondContact O-N 3.3Å; N239-E243 PolarHBondContact O-N 3.12Å |
| 240 | R | 97.8 | Very high | 97.6 | Very high | 141 Ų | 141 | 104.1 Ų | 104.1 | 53% | 0.532 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.6 | -43 | 176 | -177.6 | 164.2 | 67.7 | 103.9 | -4.1 | 112.1 | R236 M237 K238 E243 V244 | R236-R240 WeakPolarHBondContact O-CB 3.15Å; R236-R240 PolarHBondContact O-N 3.37Å; M237-R240 PolarHBondContact O-N 3.49Å; M237-R240 PolarHBondContact SD-NH2 2.91Å; K238-R240 PolarHBondContact O-N 3.13Å; R240-E243 PolarHBondContact O-N 2.82Å; R240-V244 VanDerWaalsContact O-CG2 3.31Å; R240-V244 WeakPolarHBondContact O-CG2 3.1Å; R240-V244 PolarHBondContact O-N 3.08Å |
| 241 | N | 96.9 | Very high | 97.6 | Very high | 79 Ų | 79 | 102.2 Ų | 102.2 | 42% | 0.422 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.2 | -42.8 | 177.3 | -70.2 | -11.4 | 0 | 0 | 0 | 111.4 | M237 K238 N239 E243 V244 E245 | M237-N241 WeakPolarHBondContact O-CB 3.29Å; M237-N241 PolarHBondContact O-N 2.9Å; M237-N241 PolarHBondContact O-ND2 3.46Å; M237-N241 PolarHBondContact O-OD1 3.15Å; K238-N241 PolarHBondContact O-N 3.42Å; N239-N241 PolarHBondContact O-N 2.99Å; N241-E243 VanDerWaalsContact C-N 3.32Å; N241-E243 PolarHBondContact O-N 2.8Å; N241-V244 PolarHBondContact O-N 3.41Å; N241-E245 WeakPolarHBondContact O-CG 3.36Å; N241-E245 PolarHBondContact O-N 2.94Å |
| 242 | A | 97.6 | Very high | 97.6 | Very high | 38 Ų | 38 | 101.7 Ų | 101.7 | 31% | 0.314 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.1 | -35.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | K238 N239 K246 | K238-A242 PolarHBondContact O-N 2.97Å; N239-A242 PolarHBondContact O-N 3.3Å; A242-K246 WeakPolarHBondContact O-CG 3.47Å; A242-K246 PolarHBondContact O-N 2.86Å; A242-K246 VanDerWaalsContact O-N 3.13Å |
| 243 | E | 97.8 | Very high | 97.7 | Very high | 121 Ų | 121 | 101.3 Ų | 101.3 | 57% | 0.565 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -68.1 | -45.2 | 174.1 | -171.6 | 166.1 | -148.6 | 0 | 0 | 111.5 | N239 R240 N241 E245 K246 E247 | N239-E243 PolarHBondContact O-N 3.12Å; R240-E243 PolarHBondContact O-N 2.82Å; N241-E243 VanDerWaalsContact C-N 3.32Å; N241-E243 PolarHBondContact O-N 2.8Å; E243-E245 VanDerWaalsContact C-N 3.3Å; E243-E245 PolarHBondContact O-N 2.88Å; E243-K246 WeakPolarHBondContact O-CB 3.46Å; E243-K246 PolarHBondContact O-N 3.22Å; E243-K246 VanDerWaalsContact O-N 3.15Å; E243-E247 PolarHBondContact O-N 2.89Å |
| 244 | V | 97.8 | Very high | 97.7 | Very high | 64 Ų | 64 | 101.3 Ų | 101.3 | 39% | 0.388 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.6 | -40.1 | 174.6 | 169.4 | 0 | 0 | 0 | 0 | 111.6 | R240 N241 E247 N248 | R240-V244 VanDerWaalsContact O-CG2 3.31Å; R240-V244 WeakPolarHBondContact O-CG2 3.1Å; R240-V244 PolarHBondContact O-N 3.08Å; N241-V244 PolarHBondContact O-N 3.41Å; V244-E247 PolarHBondContact O-N 2.84Å; V244-N248 WeakPolarHBondContact CG1-ND2 3.29Å; V244-N248 VanDerWaalsContact O-CB 3.3Å; V244-N248 WeakPolarHBondContact O-CB 3.31Å; V244-N248 PolarHBondContact O-N 2.78Å; V244-N248 PolarHBondContact O-ND2 3.07Å; V244-N248 VanDerWaalsContact O-ND2 3.07Å |
| 245 | E | 97 | Very high | 97.8 | Very high | 134 Ų | 134 | 104.7 Ų | 104.7 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63 | -42.7 | 175 | -75.5 | 171.2 | -173.5 | 0 | 0 | 112.3 | N241 E243 N248 F249 | N241-E245 WeakPolarHBondContact O-CG 3.36Å; N241-E245 PolarHBondContact O-N 2.94Å; E243-E245 VanDerWaalsContact C-N 3.3Å; E243-E245 PolarHBondContact O-N 2.88Å; E245-N248 PolarHBondContact O-N 3.38Å; E245-F249 PolarHBondContact O-N 3.44Å |
| 246 | K | 98 | Very high | 97.8 | Very high | 150 Ų | 150 | 103.6 Ų | 103.6 | 65% | 0.652 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.4 | -46.1 | 175.2 | -71.9 | 171 | -175.6 | 176.9 | 0 | 111.8 | A242 E243 N248 F249 V250 | A242-K246 WeakPolarHBondContact O-CG 3.47Å; A242-K246 PolarHBondContact O-N 2.86Å; A242-K246 VanDerWaalsContact O-N 3.13Å; E243-K246 WeakPolarHBondContact O-CB 3.46Å; E243-K246 PolarHBondContact O-N 3.22Å; E243-K246 VanDerWaalsContact O-N 3.15Å; K246-N248 VanDerWaalsContact C-N 3.34Å; K246-N248 PolarHBondContact O-N 3.38Å; K246-F249 WeakPolarHBondContact O-CB 3.44Å; K246-F249 PolarHBondContact O-N 2.99Å; K246-V250 WeakPolarHBondContact O-CG2 3.47Å; K246-V250 PolarHBondContact O-N 3.07Å |
| 247 | E | 97.8 | Very high | 97.8 | Very high | 115 Ų | 115 | 100.9 Ų | 100.9 | 54% | 0.537 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.3 | -42.3 | 176.9 | -71.7 | -172.1 | 162 | 0 | 0 | 111.5 | E243 V244 F249 V250 I251 | E243-E247 PolarHBondContact O-N 2.89Å; V244-E247 PolarHBondContact O-N 2.84Å; E247-F249 VanDerWaalsContact C-N 3.29Å; E247-F249 PolarHBondContact O-N 3.41Å; E247-V250 PolarHBondContact O-N 3.48Å; E247-I251 VanDerWaalsContact O-CG1 3.27Å; E247-I251 WeakPolarHBondContact O-CG1 3.32Å; E247-I251 PolarHBondContact O-N 3.41Å |
| 248 | N | 97.9 | Very high | 97.9 | Very high | 90 Ų | 90 | 102.4 Ų | 102.4 | 48% | 0.481 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -38.5 | 175.4 | -79.2 | -35.6 | 0 | 0 | 0 | 112.3 | V244 E245 K246 I251 Q252 | V244-N248 WeakPolarHBondContact CG1-ND2 3.29Å; V244-N248 VanDerWaalsContact O-CB 3.3Å; V244-N248 WeakPolarHBondContact O-CB 3.31Å; V244-N248 PolarHBondContact O-N 2.78Å; V244-N248 PolarHBondContact O-ND2 3.07Å; V244-N248 VanDerWaalsContact O-ND2 3.07Å; E245-N248 PolarHBondContact O-N 3.38Å; K246-N248 VanDerWaalsContact C-N 3.34Å; K246-N248 PolarHBondContact O-N 3.38Å; N248-I251 PolarHBondContact O-N 2.79Å; N248-Q252 PolarHBondContact O-N 2.77Å |
| 249 | F | 98.1 | Very high | 97.8 | Very high | 131 Ų | 131 | 102.1 Ų | 102.1 | 58% | 0.575 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.8 | -47.8 | 174.3 | -178.4 | -96.1 | 0 | 0 | 0 | 111.6 | E245 K246 E247 I251 Q252 E253 | E245-F249 PolarHBondContact O-N 3.44Å; K246-F249 WeakPolarHBondContact O-CB 3.44Å; K246-F249 PolarHBondContact O-N 2.99Å; E247-F249 VanDerWaalsContact C-N 3.29Å; E247-F249 PolarHBondContact O-N 3.41Å; F249-I251 VanDerWaalsContact C-N 3.33Å; F249-I251 PolarHBondContact O-N 2.9Å; F249-Q252 WeakPolarHBondContact O-CB 3.44Å; F249-Q252 PolarHBondContact O-N 3.43Å; F249-Q252 VanDerWaalsContact O-N 3.08Å; F249-E253 HydrophobicContact CD1-CG 4.3Å; F249-E253 HydrophobicContact CE1-CG 3.86Å; F249-E253 WeakPolarHBondContact CE1-OE1 3.33Å; F249-E253 HydrophobicContact CZ-CG 4.07Å; F249-E253 VanDerWaalsContact CZ-OE1 3.29Å; F249-E253 WeakPolarHBondContact CZ-OE1 3.31Å; F249-E253 PolarHBondContact O-N 3.01Å |
| 250 | V | 98.2 | Very high | 97.8 | Very high | 71 Ų | 71 | 103 Ų | 103 | 43% | 0.43 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.5 | -42.3 | 176.4 | 174.3 | 0 | 0 | 0 | 0 | 111.3 | K246 E247 Q252 E253 L254 | K246-V250 WeakPolarHBondContact O-CG2 3.47Å; K246-V250 PolarHBondContact O-N 3.07Å; E247-V250 PolarHBondContact O-N 3.48Å; V250-Q252 VanDerWaalsContact C-N 3.28Å; V250-Q252 PolarHBondContact O-N 3.17Å; V250-E253 PolarHBondContact O-N 2.92Å; V250-L254 HydrophobicContact CG1-CD1 3.94Å; V250-L254 HydrophobicContact CG1-CG 4.29Å; V250-L254 WeakPolarHBondContact O-CB 3.46Å; V250-L254 WeakPolarHBondContact O-CG 3.27Å; V250-L254 PolarHBondContact O-N 3.27Å |
| 251 | I | 98 | Very high | 97.9 | Very high | 77 Ų | 77 | 100.8 Ų | 100.8 | 40% | 0.395 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.7 | -42.4 | 175.1 | -71.4 | 165.4 | 0 | 0 | 0 | 110.6 | E247 N248 F249 L254 K255 | E247-I251 VanDerWaalsContact O-CG1 3.27Å; E247-I251 WeakPolarHBondContact O-CG1 3.32Å; E247-I251 PolarHBondContact O-N 3.41Å; N248-I251 PolarHBondContact O-N 2.79Å; F249-I251 VanDerWaalsContact C-N 3.33Å; F249-I251 PolarHBondContact O-N 2.9Å; I251-L254 PolarHBondContact O-N 2.88Å; I251-K255 HydrophobicContact CG2-CD 4.09Å; I251-K255 HydrophobicContact CG2-CG 4.49Å; I251-K255 WeakPolarHBondContact O-CB 3.3Å; I251-K255 VanDerWaalsContact O-CG 3.27Å; I251-K255 WeakPolarHBondContact O-CG 3.47Å; I251-K255 PolarHBondContact O-N 3.12Å |
| 252 | Q | 97.9 | Very high | 97.9 | Very high | 98 Ų | 98 | 101 Ų | 101 | 46% | 0.458 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.6 | -42.1 | 178.8 | -171 | 61.7 | 22.6 | 0 | 0 | 111.9 | N248 F249 V250 K255 N256 | N248-Q252 PolarHBondContact O-N 2.77Å; F249-Q252 WeakPolarHBondContact O-CB 3.44Å; F249-Q252 PolarHBondContact O-N 3.43Å; F249-Q252 VanDerWaalsContact O-N 3.08Å; V250-Q252 VanDerWaalsContact C-N 3.28Å; V250-Q252 PolarHBondContact O-N 3.17Å; Q252-K255 PolarHBondContact O-N 3.45Å; Q252-N256 VanDerWaalsContact O-CG 3.23Å; Q252-N256 PolarHBondContact O-N 3.37Å; Q252-N256 PolarHBondContact O-ND2 3.3Å |
| 253 | E | 98.1 | Very high | 97.9 | Very high | 85 Ų | 85 | 105.1 Ų | 105.1 | 40% | 0.397 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.2 | -46.6 | 173.8 | -71.6 | -169.4 | 147.5 | 0 | 0 | 111.6 | F249 V250 K255 N256 H257 | F249-E253 HydrophobicContact CD1-CG 4.3Å; F249-E253 HydrophobicContact CE1-CG 3.86Å; F249-E253 WeakPolarHBondContact CE1-OE1 3.33Å; F249-E253 HydrophobicContact CZ-CG 4.07Å; F249-E253 VanDerWaalsContact CZ-OE1 3.29Å; F249-E253 WeakPolarHBondContact CZ-OE1 3.31Å; F249-E253 PolarHBondContact O-N 3.01Å; V250-E253 PolarHBondContact O-N 2.92Å; E253-K255 VanDerWaalsContact C-N 3.34Å; E253-K255 PolarHBondContact O-N 2.86Å; E253-N256 WeakPolarHBondContact O-CB 3.42Å; E253-N256 PolarHBondContact O-N 2.97Å; E253-N256 VanDerWaalsContact O-N 3.17Å; E253-H257 PolarHBondContact O-N 3.34Å; E253-H257 PolarHBondContact O-ND1 3.43Å |
| 254 | L | 98.2 | Very high | 97.8 | Very high | 111 Ų | 111 | 106.9 Ų | 106.9 | 58% | 0.581 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63 | -39.8 | 178.5 | -71.8 | 174.3 | 0 | 0 | 0 | 112 | V250 I251 N256 H257 L258 | V250-L254 HydrophobicContact CG1-CD1 3.94Å; V250-L254 HydrophobicContact CG1-CG 4.29Å; V250-L254 WeakPolarHBondContact O-CB 3.46Å; V250-L254 WeakPolarHBondContact O-CG 3.27Å; V250-L254 PolarHBondContact O-N 3.27Å; I251-L254 PolarHBondContact O-N 2.88Å; L254-N256 VanDerWaalsContact C-N 3.33Å; L254-N256 PolarHBondContact O-N 3.44Å; L254-H257 PolarHBondContact O-N 2.9Å; L254-L258 VanDerWaalsContact O-CB 3.31Å; L254-L258 WeakPolarHBondContact O-CB 3.27Å; L254-L258 PolarHBondContact O-N 3.45Å |
| 255 | K | 98.1 | Very high | 97.8 | Very high | 124 Ų | 124 | 106.4 Ų | 106.4 | 54% | 0.539 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 172.8 | -78.1 | 174.1 | 179.1 | 176 | 0 | 111.7 | I251 Q252 E253 L258 H259 | I251-K255 HydrophobicContact CG2-CD 4.09Å; I251-K255 HydrophobicContact CG2-CG 4.49Å; I251-K255 WeakPolarHBondContact O-CB 3.3Å; I251-K255 VanDerWaalsContact O-CG 3.27Å; I251-K255 WeakPolarHBondContact O-CG 3.47Å; I251-K255 PolarHBondContact O-N 3.12Å; Q252-K255 PolarHBondContact O-N 3.45Å; E253-K255 VanDerWaalsContact C-N 3.34Å; E253-K255 PolarHBondContact O-N 2.86Å; K255-L258 PolarHBondContact O-N 2.96Å; K255-H259 WeakPolarHBondContact O-CB 3.44Å; K255-H259 PolarHBondContact O-N 3.47Å |
| 256 | N | 98 | Very high | 97.8 | Very high | 79 Ų | 79 | 106.4 Ų | 106.4 | 42% | 0.422 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.9 | -46.1 | 177.9 | -70.5 | -17.2 | 0 | 0 | 0 | 111.6 | Q252 E253 L254 H259 Q260 | Q252-N256 VanDerWaalsContact O-CG 3.23Å; Q252-N256 PolarHBondContact O-N 3.37Å; Q252-N256 PolarHBondContact O-ND2 3.3Å; E253-N256 WeakPolarHBondContact O-CB 3.42Å; E253-N256 PolarHBondContact O-N 2.97Å; E253-N256 VanDerWaalsContact O-N 3.17Å; L254-N256 VanDerWaalsContact C-N 3.33Å; L254-N256 PolarHBondContact O-N 3.44Å; N256-H259 PolarHBondContact O-N 3.21Å; N256-Q260 WeakPolarHBondContact O-CG 3.32Å; N256-Q260 PolarHBondContact O-N 2.99Å |
| 257 | H | 97.9 | Very high | 97.7 | Very high | 105 Ų | 105 | 103 Ų | 103 | 49% | 0.486 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.2 | -44.7 | 176 | -72 | 104.6 | 0 | 0 | 0 | 111.7 | E253 L254 H259 Q260 V261 | E253-H257 PolarHBondContact O-N 3.34Å; E253-H257 PolarHBondContact O-ND1 3.43Å; L254-H257 PolarHBondContact O-N 2.9Å; H257-H259 VanDerWaalsContact C-N 3.33Å; H257-H259 PolarHBondContact O-N 3.02Å; H257-Q260 PolarHBondContact O-N 2.87Å; H257-V261 WeakPolarHBondContact O-CG2 3.43Å; H257-V261 PolarHBondContact O-N 2.81Å |
| 258 | L | 98.1 | Very high | 97.7 | Very high | 107 Ų | 107 | 100 Ų | 100 | 56% | 0.56 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.3 | -45.4 | 176.6 | -178.9 | 62.8 | 0 | 0 | 0 | 111.2 | L254 K255 Q260 V261 L262 | L254-L258 VanDerWaalsContact O-CB 3.31Å; L254-L258 WeakPolarHBondContact O-CB 3.27Å; L254-L258 PolarHBondContact O-N 3.45Å; K255-L258 PolarHBondContact O-N 2.96Å; L258-Q260 VanDerWaalsContact C-N 3.34Å; L258-Q260 PolarHBondContact O-N 3.4Å; L258-V261 PolarHBondContact O-N 3.19Å; L258-L262 HydrophobicContact CD1-CD1 4.32Å; L258-L262 HydrophobicContact CD1-CG 4.37Å; L258-L262 HydrophobicContact CG-CD1 4.07Å; L258-L262 WeakPolarHBondContact O-CB 3.35Å; L258-L262 VanDerWaalsContact O-CG 3.32Å; L258-L262 WeakPolarHBondContact O-CG 3.34Å; L258-L262 PolarHBondContact O-N 2.93Å |
| 259 | H | 97.7 | Very high | 97.7 | Very high | 123 Ų | 123 | 101.5 Ų | 101.5 | 57% | 0.569 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61 | -41.8 | 176.7 | -176.5 | 69.5 | 0 | 0 | 0 | 112.2 | K255 N256 H257 K263 | K255-H259 WeakPolarHBondContact O-CB 3.44Å; K255-H259 PolarHBondContact O-N 3.47Å; N256-H259 PolarHBondContact O-N 3.21Å; H257-H259 VanDerWaalsContact C-N 3.33Å; H257-H259 PolarHBondContact O-N 3.02Å; H259-K263 WeakPolarHBondContact O-CB 3.34Å; H259-K263 PolarHBondContact O-N 2.96Å |
| 260 | Q | 97.8 | Very high | 97.6 | Very high | 120 Ų | 120 | 99.4 Ų | 99.4 | 56% | 0.561 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.5 | -44.1 | 176.6 | -71.4 | 173.7 | 17.9 | 0 | 0 | 112.3 | N256 H257 L258 K263 F264 | N256-Q260 WeakPolarHBondContact O-CG 3.32Å; N256-Q260 PolarHBondContact O-N 2.99Å; H257-Q260 PolarHBondContact O-N 2.87Å; L258-Q260 VanDerWaalsContact C-N 3.34Å; L258-Q260 PolarHBondContact O-N 3.4Å; Q260-K263 PolarHBondContact O-N 3.39Å; Q260-F264 WeakPolarHBondContact O-CB 3.37Å; Q260-F264 PolarHBondContact O-N 3.32Å |
| 261 | V | 98 | Very high | 97.6 | Very high | 94 Ų | 94 | 104.3 Ų | 104.3 | 57% | 0.57 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.2 | -44.7 | 177.8 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | H257 L258 F264 S265 | H257-V261 WeakPolarHBondContact O-CG2 3.43Å; H257-V261 PolarHBondContact O-N 2.81Å; L258-V261 PolarHBondContact O-N 3.19Å; V261-F264 PolarHBondContact O-N 2.85Å; V261-S265 WeakPolarHBondContact O-CB 3.41Å; V261-S265 PolarHBondContact O-N 3.03Å; V261-S265 PolarHBondContact O-OG 3.49Å |
| 262 | L | 97.3 | Very high | 97.5 | Very high | 85 Ų | 85 | 104.7 Ų | 104.7 | 45% | 0.445 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.2 | -47.8 | 175.7 | -74.4 | 171.1 | 0 | 0 | 0 | 111.5 | L258 F264 S265 E266 | L258-L262 HydrophobicContact CD1-CD1 4.32Å; L258-L262 HydrophobicContact CD1-CG 4.37Å; L258-L262 HydrophobicContact CG-CD1 4.07Å; L258-L262 WeakPolarHBondContact O-CB 3.35Å; L258-L262 VanDerWaalsContact O-CG 3.32Å; L258-L262 WeakPolarHBondContact O-CG 3.34Å; L258-L262 PolarHBondContact O-N 2.93Å; L262-F264 VanDerWaalsContact C-N 3.32Å; L262-F264 PolarHBondContact O-N 2.9Å; L262-S265 PolarHBondContact O-N 3.48Å; L262-S265 PolarHBondContact O-OG 2.98Å; L262-E266 WeakPolarHBondContact O-CB 3.4Å; L262-E266 WeakPolarHBondContact O-CG 3.41Å; L262-E266 PolarHBondContact O-N 2.95Å |
| 263 | K | 97.4 | Very high | 97.5 | Very high | 124 Ų | 124 | 105.7 Ų | 105.7 | 54% | 0.539 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.9 | -39 | 178 | -172.1 | 177.2 | -177.8 | 178.7 | 0 | 112 | H259 Q260 N267 | H259-K263 WeakPolarHBondContact O-CB 3.34Å; H259-K263 PolarHBondContact O-N 2.96Å; Q260-K263 PolarHBondContact O-N 3.39Å; K263-N267 WeakPolarHBondContact O-CB 3.37Å; K263-N267 VanDerWaalsContact O-CG 3.28Å; K263-N267 PolarHBondContact O-N 3.25Å; K263-N267 PolarHBondContact O-ND2 3.3Å |
| 264 | F | 97.3 | Very high | 97.5 | Very high | 157 Ų | 157 | 106.9 Ų | 106.9 | 69% | 0.689 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67.5 | -44.1 | 176.9 | -178.3 | -95.9 | 0 | 0 | 0 | 111.5 | Q260 V261 L262 N267 S268 | Q260-F264 WeakPolarHBondContact O-CB 3.37Å; Q260-F264 PolarHBondContact O-N 3.32Å; V261-F264 PolarHBondContact O-N 2.85Å; L262-F264 VanDerWaalsContact C-N 3.32Å; L262-F264 PolarHBondContact O-N 2.9Å; F264-N267 PolarHBondContact O-N 3.16Å; F264-S268 WeakPolarHBondContact O-CB 3.34Å; F264-S268 PolarHBondContact O-N 3.3Å |
| 265 | S | 96.2 | Very high | 97.5 | Very high | 55 Ų | 55 | 108 Ų | 108 | 39% | 0.385 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.4 | -41.5 | -179.5 | 70.6 | 0 | 0 | 0 | 0 | 112.2 | V261 L262 N267 S268 L269 | V261-S265 WeakPolarHBondContact O-CB 3.41Å; V261-S265 PolarHBondContact O-N 3.03Å; V261-S265 PolarHBondContact O-OG 3.49Å; L262-S265 PolarHBondContact O-N 3.48Å; L262-S265 PolarHBondContact O-OG 2.98Å; S265-N267 PolarHBondContact O-N 3.42Å; S265-S268 PolarHBondContact O-N 2.91Å; S265-L269 VanDerWaalsContact O-CB 3.28Å; S265-L269 WeakPolarHBondContact O-CB 3.4Å; S265-L269 PolarHBondContact O-N 2.82Å |
| 266 | E | 97.4 | Very high | 97.4 | Very high | 133 Ų | 133 | 104.8 Ų | 104.8 | 62% | 0.621 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -59.1 | -46.8 | 173.7 | -77.2 | 178.2 | 172.9 | 0 | 0 | 111.6 | L262 L269 L270 | L262-E266 WeakPolarHBondContact O-CB 3.4Å; L262-E266 WeakPolarHBondContact O-CG 3.41Å; L262-E266 PolarHBondContact O-N 2.95Å; E266-L269 PolarHBondContact O-N 3.39Å; E266-L270 WeakPolarHBondContact O-CB 3.28Å; E266-L270 PolarHBondContact O-N 2.92Å |
| 267 | N | 97 | Very high | 97.4 | Very high | 79 Ų | 79 | 104.6 Ų | 104.6 | 42% | 0.422 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.7 | -41.5 | 177.3 | -76.5 | -44.8 | 0 | 0 | 0 | 112.1 | K263 F264 S265 L270 R271 | K263-N267 WeakPolarHBondContact O-CB 3.37Å; K263-N267 VanDerWaalsContact O-CG 3.28Å; K263-N267 PolarHBondContact O-N 3.25Å; K263-N267 PolarHBondContact O-ND2 3.3Å; F264-N267 PolarHBondContact O-N 3.16Å; S265-N267 PolarHBondContact O-N 3.42Å; N267-L270 PolarHBondContact O-N 2.9Å; N267-R271 WeakPolarHBondContact O-CG 3.49Å; N267-R271 PolarHBondContact O-N 3.46Å |
| 268 | S | 96.7 | Very high | 97.4 | Very high | 53 Ų | 53 | 107.3 Ų | 107.3 | 37% | 0.371 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.6 | -46.5 | 175.8 | -171.7 | 0 | 0 | 0 | 0 | 111 | F264 S265 L270 R271 T272 | F264-S268 WeakPolarHBondContact O-CB 3.34Å; F264-S268 PolarHBondContact O-N 3.3Å; S265-S268 PolarHBondContact O-N 2.91Å; S268-L270 VanDerWaalsContact C-N 3.34Å; S268-L270 PolarHBondContact O-N 2.96Å; S268-R271 PolarHBondContact O-N 3.14Å; S268-T272 PolarHBondContact O-N 3.49Å; S268-T272 PolarHBondContact O-OG1 3.42Å |
| 269 | L | 97.4 | Very high | 97.3 | Very high | 120 Ų | 120 | 107.3 Ų | 107.3 | 63% | 0.628 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.1 | -43.4 | 179.2 | -171 | 155.9 | 0 | 0 | 0 | 110.9 | S265 E266 R271 T272 K273 | S265-L269 VanDerWaalsContact O-CB 3.28Å; S265-L269 WeakPolarHBondContact O-CB 3.4Å; S265-L269 PolarHBondContact O-N 2.82Å; E266-L269 PolarHBondContact O-N 3.39Å; L269-R271 PolarHBondContact O-N 2.96Å; L269-T272 PolarHBondContact O-N 3.27Å; L269-K273 VanDerWaalsContact O-CB 3.31Å; L269-K273 WeakPolarHBondContact O-CB 3.49Å; L269-K273 PolarHBondContact O-N 3.36Å |
| 270 | L | 97.4 | Very high | 97.3 | Very high | 88 Ų | 88 | 108 Ų | 108 | 46% | 0.461 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60.2 | -45.5 | 176.3 | -175.5 | 66.6 | 0 | 0 | 0 | 111.6 | E266 N267 S268 K273 Q274 | E266-L270 WeakPolarHBondContact O-CB 3.28Å; E266-L270 PolarHBondContact O-N 2.92Å; N267-L270 PolarHBondContact O-N 2.9Å; S268-L270 VanDerWaalsContact C-N 3.34Å; S268-L270 PolarHBondContact O-N 2.96Å; L270-K273 PolarHBondContact O-N 2.86Å; L270-Q274 WeakPolarHBondContact O-CB 3.31Å; L270-Q274 VanDerWaalsContact O-CG 3.31Å; L270-Q274 WeakPolarHBondContact O-CG 3.5Å; L270-Q274 PolarHBondContact O-N 2.9Å |
| 271 | R | 97.2 | Very high | 97.3 | Very high | 174 Ų | 174 | 108.4 Ų | 108.4 | 66% | 0.657 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62 | -50.8 | 176.4 | -75.7 | -179.8 | -178.7 | 178.2 | 0.7 | 111.8 | N267 S268 L269 K273 Q274 E275 | N267-R271 WeakPolarHBondContact O-CG 3.49Å; N267-R271 PolarHBondContact O-N 3.46Å; S268-R271 PolarHBondContact O-N 3.14Å; L269-R271 PolarHBondContact O-N 2.96Å; R271-K273 VanDerWaalsContact C-N 3.26Å; R271-K273 PolarHBondContact O-N 3.3Å; R271-Q274 PolarHBondContact O-N 2.87Å; R271-Q274 VanDerWaalsContact O-N 3.14Å; R271-E275 WeakPolarHBondContact O-CB 3.37Å; R271-E275 WeakPolarHBondContact O-CG 3.39Å; R271-E275 PolarHBondContact O-N 2.89Å |
| 272 | T | 97.3 | Very high | 97.3 | Very high | 84 Ų | 84 | 106.3 Ų | 106.3 | 52% | 0.515 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -57.3 | -42.1 | 178.3 | -55.5 | 0 | 0 | 0 | 0 | 111.2 | S268 L269 A276 | S268-T272 PolarHBondContact O-N 3.49Å; S268-T272 PolarHBondContact O-OG1 3.42Å; L269-T272 PolarHBondContact O-N 3.27Å; T272-A276 VanDerWaalsContact O-CB 3.26Å; T272-A276 WeakPolarHBondContact O-CB 3.31Å; T272-A276 PolarHBondContact O-N 3.37Å |
| 273 | K | 97.7 | Very high | 97.2 | Very high | 119 Ų | 119 | 106.2 Ų | 106.2 | 52% | 0.517 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.4 | -46.8 | 176.7 | -175.6 | -179.4 | 174.3 | -176.1 | 0 | 111.8 | L269 L270 R271 A276 E277 | L269-K273 VanDerWaalsContact O-CB 3.31Å; L269-K273 WeakPolarHBondContact O-CB 3.49Å; L269-K273 PolarHBondContact O-N 3.36Å; L270-K273 PolarHBondContact O-N 2.86Å; R271-K273 VanDerWaalsContact C-N 3.26Å; R271-K273 PolarHBondContact O-N 3.3Å; K273-A276 PolarHBondContact O-N 3.02Å; K273-E277 WeakPolarHBondContact CE-OE1 3.3Å; K273-E277 WeakPolarHBondContact O-CB 3.46Å; K273-E277 WeakPolarHBondContact O-CG 3.37Å; K273-E277 PolarHBondContact O-N 3.27Å |
| 274 | Q | 97.7 | Very high | 97.2 | Very high | 110 Ų | 110 | 106.9 Ų | 106.9 | 51% | 0.514 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.9 | -40.9 | 178.7 | -73.9 | 176.8 | -0.1 | 0 | 0 | 112.3 | L270 R271 E277 K278 | L270-Q274 WeakPolarHBondContact O-CB 3.31Å; L270-Q274 VanDerWaalsContact O-CG 3.31Å; L270-Q274 WeakPolarHBondContact O-CG 3.5Å; L270-Q274 PolarHBondContact O-N 2.9Å; R271-Q274 PolarHBondContact O-N 2.87Å; R271-Q274 VanDerWaalsContact O-N 3.14Å; Q274-E277 PolarHBondContact O-N 3.49Å; Q274-K278 WeakPolarHBondContact O-CB 3.14Å; Q274-K278 PolarHBondContact O-N 3.45Å |
| 275 | E | 97.1 | Very high | 97.3 | Very high | 134 Ų | 134 | 108.1 Ų | 108.1 | 63% | 0.626 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.3 | -44.6 | 175.1 | -75.9 | 174.3 | -176.9 | 0 | 0 | 111.4 | R271 E277 K278 Q279 | R271-E275 WeakPolarHBondContact O-CB 3.37Å; R271-E275 WeakPolarHBondContact O-CG 3.39Å; R271-E275 PolarHBondContact O-N 2.89Å; E275-E277 PolarHBondContact O-N 3.09Å; E275-K278 PolarHBondContact O-N 3.29Å; E275-Q279 WeakPolarHBondContact O-CB 3.26Å; E275-Q279 PolarHBondContact O-N 3.17Å |
| 276 | A | 97.1 | Very high | 97.3 | Very high | 57 Ų | 57 | 107.4 Ų | 107.4 | 47% | 0.471 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | T272 K273 Q279 Q280 | T272-A276 VanDerWaalsContact O-CB 3.26Å; T272-A276 WeakPolarHBondContact O-CB 3.31Å; T272-A276 PolarHBondContact O-N 3.37Å; K273-A276 PolarHBondContact O-N 3.02Å; A276-Q279 PolarHBondContact O-N 3.33Å; A276-Q280 VanDerWaalsContact O-CB 3.3Å; A276-Q280 WeakPolarHBondContact O-CB 3.39Å; A276-Q280 PolarHBondContact O-N 3.01Å |
| 277 | E | 97.6 | Very high | 97.3 | Very high | 76 Ų | 76 | 103.4 Ų | 103.4 | 36% | 0.355 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.1 | -39.4 | 175.7 | -76.2 | 179.4 | -169 | 0 | 0 | 112.3 | K273 Q274 E275 K281 | K273-E277 WeakPolarHBondContact CE-OE1 3.3Å; K273-E277 WeakPolarHBondContact O-CB 3.46Å; K273-E277 WeakPolarHBondContact O-CG 3.37Å; K273-E277 PolarHBondContact O-N 3.27Å; Q274-E277 PolarHBondContact O-N 3.49Å; E275-E277 PolarHBondContact O-N 3.09Å; E277-K281 WeakPolarHBondContact O-CB 3.5Å; E277-K281 VanDerWaalsContact O-CG 3.31Å; E277-K281 WeakPolarHBondContact O-CG 3.31Å; E277-K281 PolarHBondContact O-N 2.93Å |
| 278 | K | 97.7 | Very high | 97.3 | Very high | 162 Ų | 162 | 105.4 Ų | 105.4 | 70% | 0.704 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.7 | -45.1 | 175.9 | -175.1 | -179.1 | 177.1 | -174.7 | 0 | 110.8 | Q274 E275 K281 A282 | Q274-K278 WeakPolarHBondContact O-CB 3.14Å; Q274-K278 PolarHBondContact O-N 3.45Å; E275-K278 PolarHBondContact O-N 3.29Å; K278-K281 PolarHBondContact O-N 3.04Å; K278-A282 PolarHBondContact O-N 2.85Å |
| 279 | Q | 97.1 | Very high | 97.4 | Very high | 107 Ų | 107 | 105.8 Ų | 105.8 | 50% | 0.5 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.3 | -46.2 | 177.3 | -172.5 | 58.9 | 31 | 0 | 0 | 111 | E275 A276 K281 A282 D283 | E275-Q279 WeakPolarHBondContact O-CB 3.26Å; E275-Q279 PolarHBondContact O-N 3.17Å; A276-Q279 PolarHBondContact O-N 3.33Å; Q279-K281 VanDerWaalsContact C-N 3.32Å; Q279-K281 PolarHBondContact O-N 2.83Å; Q279-A282 WeakPolarHBondContact O-CB 3.5Å; Q279-A282 PolarHBondContact O-N 3.49Å; Q279-A282 VanDerWaalsContact O-N 3.09Å; Q279-D283 PolarHBondContact NE2-OD1 3.12Å; Q279-D283 PolarHBondContact NE2-OD2 2.83Å; Q279-D283 PolarHBondContact O-N 3.37Å |
| 280 | Q | 97.4 | Very high | 97.4 | Very high | 137 Ų | 137 | 107 Ų | 107 | 64% | 0.64 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -56.3 | -44.9 | 175.7 | -174.4 | -171.7 | 31.1 | 0 | 0 | 111.9 | A276 A282 D283 F284 | A276-Q280 VanDerWaalsContact O-CB 3.3Å; A276-Q280 WeakPolarHBondContact O-CB 3.39Å; A276-Q280 PolarHBondContact O-N 3.01Å; Q280-A282 VanDerWaalsContact C-N 3.35Å; Q280-D283 PolarHBondContact O-N 3.09Å; Q280-F284 VanDerWaalsContact O-CB 3.27Å; Q280-F284 WeakPolarHBondContact O-CB 3.44Å; Q280-F284 PolarHBondContact O-N 3.46Å |
| 281 | K | 97.3 | Very high | 97.4 | Very high | 128 Ų | 128 | 106.1 Ų | 106.1 | 56% | 0.557 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.3 | -39.1 | 177 | -74.5 | 172.1 | -175.5 | 170.8 | 0 | 112.1 | E277 K278 Q279 R285 | E277-K281 WeakPolarHBondContact O-CB 3.5Å; E277-K281 VanDerWaalsContact O-CG 3.31Å; E277-K281 WeakPolarHBondContact O-CG 3.31Å; E277-K281 PolarHBondContact O-N 2.93Å; K278-K281 PolarHBondContact O-N 3.04Å; Q279-K281 VanDerWaalsContact C-N 3.32Å; Q279-K281 PolarHBondContact O-N 2.83Å; K281-R285 WeakPolarHBondContact O-CG 3.34Å; K281-R285 PolarHBondContact O-N 2.9Å; K281-R285 VanDerWaalsContact O-N 3.12Å |
| 282 | A | 97.1 | Very high | 97.5 | Very high | 50 Ų | 50 | 100.3 Ų | 100.3 | 41% | 0.413 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.4 | -47.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | K278 Q279 Q280 F284 R285 A286 | K278-A282 PolarHBondContact O-N 2.85Å; Q279-A282 WeakPolarHBondContact O-CB 3.5Å; Q279-A282 PolarHBondContact O-N 3.49Å; Q279-A282 VanDerWaalsContact O-N 3.09Å; Q280-A282 VanDerWaalsContact C-N 3.35Å; A282-F284 VanDerWaalsContact C-N 3.34Å; A282-F284 PolarHBondContact O-N 3.29Å; A282-R285 PolarHBondContact O-N 3.48Å; A282-A286 WeakPolarHBondContact O-CB 3.27Å; A282-A286 PolarHBondContact O-N 3.04Å |
| 283 | D | 97 | Very high | 97.5 | Very high | 83 Ų | 83 | 102.4 Ų | 102.4 | 44% | 0.444 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.3 | -39.5 | 179.2 | -69.2 | -23.4 | 0 | 0 | 0 | 111.8 | Q279 Q280 A286 S287 | Q279-D283 PolarHBondContact NE2-OD1 3.12Å; Q279-D283 PolarHBondContact NE2-OD2 2.83Å; Q279-D283 PolarHBondContact O-N 3.37Å; Q280-D283 PolarHBondContact O-N 3.09Å; D283-A286 PolarHBondContact O-N 3.4Å; D283-S287 VanDerWaalsContact O-CB 3.29Å; D283-S287 WeakPolarHBondContact O-CB 3.41Å; D283-S287 PolarHBondContact O-N 3.45Å |
| 284 | F | 97.6 | Very high | 97.5 | Very high | 139 Ų | 139 | 101 Ų | 101 | 61% | 0.61 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.7 | -47.7 | 174.4 | -179.3 | -99 | 0 | 0 | 0 | 111.7 | Q280 A282 S287 Q288 | Q280-F284 VanDerWaalsContact O-CB 3.27Å; Q280-F284 WeakPolarHBondContact O-CB 3.44Å; Q280-F284 PolarHBondContact O-N 3.46Å; A282-F284 VanDerWaalsContact C-N 3.34Å; A282-F284 PolarHBondContact O-N 3.29Å; F284-S287 WeakPolarHBondContact O-CB 3.29Å; F284-S287 PolarHBondContact O-N 2.88Å; F284-Q288 WeakPolarHBondContact O-CB 3.18Å; F284-Q288 PolarHBondContact O-N 2.94Å |
| 285 | R | 97.6 | Very high | 97.5 | Very high | 183 Ų | 183 | 101.3 Ų | 101.3 | 69% | 0.691 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.5 | -43 | 176.7 | -73.3 | 176.1 | -180 | -177.5 | -0.3 | 112 | K281 A282 S287 Q288 A289 | K281-R285 WeakPolarHBondContact O-CG 3.34Å; K281-R285 PolarHBondContact O-N 2.9Å; K281-R285 VanDerWaalsContact O-N 3.12Å; A282-R285 PolarHBondContact O-N 3.48Å; R285-S287 VanDerWaalsContact C-N 3.31Å; R285-S287 PolarHBondContact O-N 3.45Å; R285-Q288 PolarHBondContact O-N 3.12Å; R285-A289 WeakPolarHBondContact O-CB 3.46Å; R285-A289 PolarHBondContact O-N 3.45Å |
| 286 | A | 97.6 | Very high | 97.6 | Very high | 39 Ų | 39 | 100.5 Ų | 100.5 | 32% | 0.322 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.2 | -40.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A282 D283 A289 R290 | A282-A286 WeakPolarHBondContact O-CB 3.27Å; A282-A286 PolarHBondContact O-N 3.04Å; D283-A286 PolarHBondContact O-N 3.4Å; A286-A289 PolarHBondContact O-N 2.89Å; A286-R290 WeakPolarHBondContact O-CG 3.45Å; A286-R290 PolarHBondContact O-N 3.26Å |
| 287 | S | 96.6 | Very high | 97.6 | Very high | 50 Ų | 50 | 101.7 Ų | 101.7 | 35% | 0.35 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.7 | -47.3 | 174.3 | -167.8 | 0 | 0 | 0 | 0 | 111.8 | D283 F284 R285 A289 R290 V291 | D283-S287 VanDerWaalsContact O-CB 3.29Å; D283-S287 WeakPolarHBondContact O-CB 3.41Å; D283-S287 PolarHBondContact O-N 3.45Å; F284-S287 WeakPolarHBondContact O-CB 3.29Å; F284-S287 PolarHBondContact O-N 2.88Å; R285-S287 VanDerWaalsContact C-N 3.31Å; R285-S287 PolarHBondContact O-N 3.45Å; S287-A289 VanDerWaalsContact C-N 3.31Å; S287-A289 PolarHBondContact O-N 3.37Å; S287-R290 WeakPolarHBondContact O-CB 3.35Å; S287-R290 PolarHBondContact O-N 2.86Å; S287-R290 VanDerWaalsContact O-N 3.12Å; S287-V291 WeakPolarHBondContact O-CG2 3.47Å; S287-V291 PolarHBondContact O-N 3.3Å |
| 288 | Q | 98.1 | Very high | 97.6 | Very high | 120 Ų | 120 | 102 Ų | 102 | 56% | 0.561 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.5 | -42.7 | 177.1 | -170.7 | 179.6 | 35.4 | 0 | 0 | 111.8 | F284 R285 V291 A292 | F284-Q288 WeakPolarHBondContact O-CB 3.18Å; F284-Q288 PolarHBondContact O-N 2.94Å; R285-Q288 PolarHBondContact O-N 3.12Å; Q288-V291 PolarHBondContact O-N 2.99Å; Q288-A292 WeakPolarHBondContact O-CB 3.44Å; Q288-A292 PolarHBondContact O-N 3.26Å |
| 289 | A | 97.8 | Very high | 97.6 | Very high | 62 Ų | 62 | 99.7 Ų | 99.7 | 51% | 0.512 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.3 | -41 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | R285 A286 S287 A292 K293 | R285-A289 WeakPolarHBondContact O-CB 3.46Å; R285-A289 PolarHBondContact O-N 3.45Å; A286-A289 PolarHBondContact O-N 2.89Å; S287-A289 VanDerWaalsContact C-N 3.31Å; S287-A289 PolarHBondContact O-N 3.37Å; A289-A292 PolarHBondContact O-N 2.93Å; A289-K293 WeakPolarHBondContact O-CB 3.46Å; A289-K293 PolarHBondContact O-N 3.31Å |
| 290 | R | 97.8 | Very high | 97.7 | Very high | 145 Ų | 145 | 99.3 Ų | 99.3 | 55% | 0.547 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.9 | -44.7 | 174.3 | -74.2 | -172.6 | -62.7 | -95.3 | 3.2 | 111.9 | A286 S287 K293 I294 | A286-R290 WeakPolarHBondContact O-CG 3.45Å; A286-R290 PolarHBondContact O-N 3.26Å; S287-R290 WeakPolarHBondContact O-CB 3.35Å; S287-R290 PolarHBondContact O-N 2.86Å; S287-R290 VanDerWaalsContact O-N 3.12Å; R290-K293 PolarHBondContact O-N 2.9Å; R290-I294 WeakPolarHBondContact O-CG1 3.48Å; R290-I294 PolarHBondContact O-N 2.94Å |
| 291 | V | 97.9 | Very high | 97.7 | Very high | 70 Ų | 70 | 98 Ų | 98 | 42% | 0.424 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 177.3 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | S287 Q288 K293 I294 Q295 | S287-V291 WeakPolarHBondContact O-CG2 3.47Å; S287-V291 PolarHBondContact O-N 3.3Å; Q288-V291 PolarHBondContact O-N 2.99Å; V291-K293 VanDerWaalsContact C-N 3.32Å; V291-K293 PolarHBondContact O-N 3.45Å; V291-I294 PolarHBondContact O-N 2.99Å; V291-Q295 HydrophobicContact CG1-CG 4.34Å; V291-Q295 WeakPolarHBondContact O-CB 3.41Å; V291-Q295 VanDerWaalsContact O-CG 3.29Å; V291-Q295 WeakPolarHBondContact O-CG 3.48Å; V291-Q295 PolarHBondContact O-N 3.34Å |
| 292 | A | 97.7 | Very high | 97.7 | Very high | 51 Ų | 51 | 97.4 Ų | 97.4 | 42% | 0.421 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.3 | -41.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q288 A289 Q295 Q296 | Q288-A292 WeakPolarHBondContact O-CB 3.44Å; Q288-A292 PolarHBondContact O-N 3.26Å; A289-A292 PolarHBondContact O-N 2.93Å; A292-Q295 PolarHBondContact O-N 3.3Å; A292-Q296 PolarHBondContact O-N 3.2Å |
| 293 | K | 98.3 | Very high | 97.8 | Very high | 129 Ų | 129 | 98 Ų | 98 | 56% | 0.561 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.8 | -48.5 | 175.9 | -171.7 | -176.5 | 179.9 | -164.1 | 0 | 111.9 | A289 R290 V291 Q295 Q296 E297 | A289-K293 WeakPolarHBondContact O-CB 3.46Å; A289-K293 PolarHBondContact O-N 3.31Å; R290-K293 PolarHBondContact O-N 2.9Å; V291-K293 VanDerWaalsContact C-N 3.32Å; V291-K293 PolarHBondContact O-N 3.45Å; K293-Q295 VanDerWaalsContact C-N 3.33Å; K293-Q295 PolarHBondContact O-N 3.41Å; K293-Q296 WeakPolarHBondContact O-CB 3.47Å; K293-Q296 PolarHBondContact O-N 3.41Å; K293-E297 WeakPolarHBondContact CE-OE1 3.44Å; K293-E297 IonicContact NZ-OE1 2.86Å; K293-E297 WeakPolarHBondContact O-CG 3.29Å; K293-E297 PolarHBondContact O-N 3.33Å |
| 294 | I | 97.9 | Very high | 97.8 | Very high | 90 Ų | 90 | 99.1 Ų | 99.1 | 46% | 0.462 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.7 | -41 | 178.4 | -68.6 | 167.7 | 0 | 0 | 0 | 110.7 | R290 V291 Q296 E297 I298 | R290-I294 WeakPolarHBondContact O-CG1 3.48Å; R290-I294 PolarHBondContact O-N 2.94Å; V291-I294 PolarHBondContact O-N 2.99Å; I294-Q296 VanDerWaalsContact C-N 3.32Å; I294-Q296 PolarHBondContact O-N 2.87Å; I294-E297 PolarHBondContact O-N 2.95Å; I294-I298 HydrophobicContact CG2-CD1 3.9Å; I294-I298 HydrophobicContact CG2-CG1 4.38Å; I294-I298 VanDerWaalsContact O-CG1 3.29Å; I294-I298 WeakPolarHBondContact O-CG1 3.27Å; I294-I298 PolarHBondContact O-N 2.94Å |
| 295 | Q | 98.1 | Very high | 97.8 | Very high | 116 Ų | 116 | 99.3 Ų | 99.3 | 54% | 0.542 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.6 | -41.8 | 175.5 | -75.5 | 173.8 | -12.8 | 0 | 0 | 111.9 | V291 A292 K293 I298 L299 | V291-Q295 HydrophobicContact CG1-CG 4.34Å; V291-Q295 WeakPolarHBondContact O-CB 3.41Å; V291-Q295 VanDerWaalsContact O-CG 3.29Å; V291-Q295 WeakPolarHBondContact O-CG 3.48Å; V291-Q295 PolarHBondContact O-N 3.34Å; A292-Q295 PolarHBondContact O-N 3.3Å; K293-Q295 VanDerWaalsContact C-N 3.33Å; K293-Q295 PolarHBondContact O-N 3.41Å; Q295-I298 PolarHBondContact O-N 3.49Å; Q295-L299 WeakPolarHBondContact O-CG 3.29Å; Q295-L299 PolarHBondContact O-N 3.44Å; Q295-L299 VanDerWaalsContact O-N 3.08Å |
| 296 | Q | 97.9 | Very high | 97.8 | Very high | 116 Ų | 116 | 97.3 Ų | 97.3 | 54% | 0.542 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64 | -43.8 | 175 | -173.7 | 179.4 | 4 | 0 | 0 | 111.9 | A292 K293 I294 I298 L299 Q300 | A292-Q296 PolarHBondContact O-N 3.2Å; K293-Q296 WeakPolarHBondContact O-CB 3.47Å; K293-Q296 PolarHBondContact O-N 3.41Å; I294-Q296 VanDerWaalsContact C-N 3.32Å; I294-Q296 PolarHBondContact O-N 2.87Å; Q296-I298 VanDerWaalsContact C-N 3.35Å; Q296-I298 PolarHBondContact O-N 2.88Å; Q296-L299 PolarHBondContact O-N 3.46Å; Q296-Q300 WeakPolarHBondContact O-CG 3.35Å; Q296-Q300 PolarHBondContact O-N 2.84Å |
| 297 | E | 97.9 | Very high | 97.8 | Very high | 82 Ų | 82 | 99.1 Ų | 99.1 | 38% | 0.383 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.1 | -41.7 | 175.8 | -72.6 | 171 | -173.9 | 0 | 0 | 111.6 | K293 I294 L299 Q300 L301 | K293-E297 WeakPolarHBondContact CE-OE1 3.44Å; K293-E297 IonicContact NZ-OE1 2.86Å; K293-E297 WeakPolarHBondContact O-CG 3.29Å; K293-E297 PolarHBondContact O-N 3.33Å; I294-E297 PolarHBondContact O-N 2.95Å; E297-L299 PolarHBondContact O-N 3.3Å; E297-Q300 PolarHBondContact O-N 3.38Å; E297-L301 WeakPolarHBondContact O-CB 3.42Å; E297-L301 WeakPolarHBondContact O-CG 3.28Å; E297-L301 PolarHBondContact O-N 3.34Å |
| 298 | I | 98 | Very high | 97.9 | Very high | 82 Ų | 82 | 101.4 Ų | 101.4 | 42% | 0.421 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.2 | -48.6 | 175 | -71.9 | 167 | 0 | 0 | 0 | 110.7 | I294 Q295 Q296 Q300 L301 Q302 | I294-I298 HydrophobicContact CG2-CD1 3.9Å; I294-I298 HydrophobicContact CG2-CG1 4.38Å; I294-I298 VanDerWaalsContact O-CG1 3.29Å; I294-I298 WeakPolarHBondContact O-CG1 3.27Å; I294-I298 PolarHBondContact O-N 2.94Å; Q295-I298 PolarHBondContact O-N 3.49Å; Q296-I298 VanDerWaalsContact C-N 3.35Å; Q296-I298 PolarHBondContact O-N 2.88Å; I298-Q300 VanDerWaalsContact C-N 3.33Å; I298-Q300 PolarHBondContact O-N 3.48Å; I298-L301 PolarHBondContact O-N 2.88Å; I298-Q302 HydrophobicContact CG2-CG 4.38Å; I298-Q302 WeakPolarHBondContact O-CB 3.34Å; I298-Q302 VanDerWaalsContact O-CG 3.28Å; I298-Q302 WeakPolarHBondContact O-CG 3.33Å; I298-Q302 PolarHBondContact O-N 3.5Å |
| 299 | L | 97.9 | Very high | 97.9 | Very high | 115 Ų | 115 | 98.8 Ų | 98.8 | 60% | 0.602 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.3 | -40.4 | 179.6 | -70.8 | 173.4 | 0 | 0 | 0 | 111.8 | Q295 Q296 E297 Q302 S303 | Q295-L299 WeakPolarHBondContact O-CG 3.29Å; Q295-L299 PolarHBondContact O-N 3.44Å; Q295-L299 VanDerWaalsContact O-N 3.08Å; Q296-L299 PolarHBondContact O-N 3.46Å; E297-L299 PolarHBondContact O-N 3.3Å; L299-Q302 PolarHBondContact O-N 3.08Å; L299-S303 PolarHBondContact O-N 3.47Å |
| 300 | Q | 97.8 | Very high | 97.8 | Very high | 99 Ų | 99 | 98.7 Ų | 98.7 | 46% | 0.463 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.8 | -47.5 | 175.7 | -74.4 | 175.8 | -5.4 | 0 | 0 | 111.5 | Q296 E297 I298 Q302 S303 Q304 | Q296-Q300 WeakPolarHBondContact O-CG 3.35Å; Q296-Q300 PolarHBondContact O-N 2.84Å; E297-Q300 PolarHBondContact O-N 3.38Å; I298-Q300 VanDerWaalsContact C-N 3.33Å; I298-Q300 PolarHBondContact O-N 3.48Å; Q300-Q302 VanDerWaalsContact C-N 3.34Å; Q300-Q302 PolarHBondContact O-N 3.41Å; Q300-S303 PolarHBondContact O-N 2.88Å; Q300-Q304 WeakPolarHBondContact O-CG 3.42Å; Q300-Q304 PolarHBondContact O-N 3.45Å |
| 301 | L | 98.1 | Very high | 97.8 | Very high | 109 Ų | 109 | 97.4 Ų | 97.4 | 57% | 0.571 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -64 | -38.9 | 177.8 | -74.2 | 171.7 | 0 | 0 | 0 | 112.1 | E297 I298 Q304 F305 | E297-L301 WeakPolarHBondContact O-CB 3.42Å; E297-L301 WeakPolarHBondContact O-CG 3.28Å; E297-L301 PolarHBondContact O-N 3.34Å; I298-L301 PolarHBondContact O-N 2.88Å; L301-Q304 PolarHBondContact O-N 3.26Å; L301-F305 VanDerWaalsContact O-CB 3.27Å; L301-F305 WeakPolarHBondContact O-CB 3.41Å; L301-F305 PolarHBondContact O-N 2.9Å |
| 302 | Q | 98.2 | Very high | 97.8 | Very high | 115 Ų | 115 | 99.3 Ų | 99.3 | 54% | 0.537 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.7 | -43.5 | 174.4 | -77.2 | 176.6 | -14.5 | 0 | 0 | 111.8 | I298 L299 Q300 F305 Y306 | I298-Q302 HydrophobicContact CG2-CG 4.38Å; I298-Q302 WeakPolarHBondContact O-CB 3.34Å; I298-Q302 VanDerWaalsContact O-CG 3.28Å; I298-Q302 WeakPolarHBondContact O-CG 3.33Å; I298-Q302 PolarHBondContact O-N 3.5Å; L299-Q302 PolarHBondContact O-N 3.08Å; Q300-Q302 VanDerWaalsContact C-N 3.34Å; Q300-Q302 PolarHBondContact O-N 3.41Å; Q302-F305 PolarHBondContact O-N 3.32Å; Q302-Y306 WeakPolarHBondContact O-CB 3.41Å; Q302-Y306 PolarHBondContact O-N 3.49Å |
| 303 | S | 97.5 | Very high | 97.7 | Very high | 62 Ų | 62 | 103.9 Ų | 103.9 | 43% | 0.434 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.9 | -44.6 | 175.6 | 176.1 | 0 | 0 | 0 | 0 | 111.9 | L299 Q300 F305 Y306 N307 | L299-S303 PolarHBondContact O-N 3.47Å; Q300-S303 PolarHBondContact O-N 2.88Å; S303-F305 PolarHBondContact O-N 2.95Å; S303-Y306 PolarHBondContact O-N 3.48Å; S303-N307 PolarHBondContact O-N 3.5Å; S303-N307 PolarHBondContact O-ND2 2.96Å; S303-N307 PolarHBondContact O-OD1 3.35Å |
| 304 | Q | 97.8 | Very high | 97.7 | Very high | 107 Ų | 107 | 103.4 Ų | 103.4 | 50% | 0.5 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.8 | -44.7 | 176.3 | -72.9 | 174.6 | 5.4 | 0 | 0 | 111.8 | Q300 L301 N307 L308 | Q300-Q304 WeakPolarHBondContact O-CG 3.42Å; Q300-Q304 PolarHBondContact O-N 3.45Å; L301-Q304 PolarHBondContact O-N 3.26Å; Q304-N307 PolarHBondContact O-N 2.97Å; Q304-L308 WeakPolarHBondContact O-CG 3.28Å; Q304-L308 PolarHBondContact O-N 2.98Å |
| 305 | F | 98 | Very high | 97.6 | Very high | 144 Ų | 144 | 101.6 Ų | 101.6 | 63% | 0.632 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60 | -47.7 | 176 | 175.7 | -99.7 | 0 | 0 | 0 | 111.5 | L301 Q302 S303 N307 L308 V309 | L301-F305 VanDerWaalsContact O-CB 3.27Å; L301-F305 WeakPolarHBondContact O-CB 3.41Å; L301-F305 PolarHBondContact O-N 2.9Å; Q302-F305 PolarHBondContact O-N 3.32Å; S303-F305 PolarHBondContact O-N 2.95Å; F305-N307 PolarHBondContact O-N 2.94Å; F305-L308 PolarHBondContact O-N 2.88Å; F305-V309 HydrophobicContact CD1-CG2 4.3Å; F305-V309 HydrophobicContact CD2-CG2 4.43Å; F305-V309 HydrophobicContact CE1-CG2 3.88Å; F305-V309 HydrophobicContact CE2-CG2 4.02Å; F305-V309 HydrophobicContact CZ-CG2 3.73Å; F305-V309 VanDerWaalsContact O-CG2 3.3Å; F305-V309 WeakPolarHBondContact O-CG2 3.41Å; F305-V309 PolarHBondContact O-N 2.86Å |
| 306 | Y | 98 | Very high | 97.6 | Very high | 141 Ų | 141 | 100.2 Ų | 100.2 | 55% | 0.553 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59.2 | -45.9 | 177.4 | -180 | -97.2 | 0 | 0 | 0 | 111.7 | Q302 S303 L308 V309 M310 | Q302-Y306 WeakPolarHBondContact O-CB 3.41Å; Q302-Y306 PolarHBondContact O-N 3.49Å; S303-Y306 PolarHBondContact O-N 3.48Å; Y306-L308 PolarHBondContact O-N 3.32Å; Y306-V309 PolarHBondContact O-N 3.36Å; Y306-M310 HydrophobicContact CD1-CG 4.16Å; Y306-M310 HydrophobicContact CE1-CG 3.71Å; Y306-M310 HydrophobicContact CE2-CG 4.21Å; Y306-M310 HydrophobicContact CE2-SD 4.34Å; Y306-M310 WeakPolarHBondContact O-CG 3.35Å; Y306-M310 PolarHBondContact O-N 3.45Å |
| 307 | N | 97.3 | Very high | 97.6 | Very high | 77 Ų | 77 | 98.6 Ų | 98.6 | 41% | 0.412 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.4 | -47.5 | 178.1 | -67.8 | -12.1 | 0 | 0 | 0 | 111.6 | S303 Q304 F305 V309 M310 E311 | S303-N307 PolarHBondContact O-N 3.5Å; S303-N307 PolarHBondContact O-ND2 2.96Å; S303-N307 PolarHBondContact O-OD1 3.35Å; Q304-N307 PolarHBondContact O-N 2.97Å; F305-N307 PolarHBondContact O-N 2.94Å; N307-V309 VanDerWaalsContact C-N 3.31Å; N307-V309 PolarHBondContact O-N 3.01Å; N307-M310 PolarHBondContact O-N 3.02Å; N307-M310 VanDerWaalsContact O-N 3.13Å; N307-E311 WeakPolarHBondContact O-CG 3.26Å; N307-E311 PolarHBondContact O-N 3.37Å |
| 308 | L | 97.8 | Very high | 97.5 | Very high | 97 Ų | 97 | 96.9 Ų | 96.9 | 51% | 0.508 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -38.8 | 176.9 | -76 | 171.4 | 0 | 0 | 0 | 112.6 | Q304 F305 Y306 N312 | Q304-L308 WeakPolarHBondContact O-CG 3.28Å; Q304-L308 PolarHBondContact O-N 2.98Å; F305-L308 PolarHBondContact O-N 2.88Å; Y306-L308 PolarHBondContact O-N 3.32Å; L308-N312 VanDerWaalsContact O-CB 3.28Å; L308-N312 WeakPolarHBondContact O-CB 3.44Å; L308-N312 VanDerWaalsContact O-CG 3.31Å; L308-N312 PolarHBondContact O-N 3.46Å; L308-N312 PolarHBondContact O-ND2 2.83Å |
| 309 | V | 98.2 | Very high | 97.4 | Very high | 66 Ų | 66 | 98.4 Ų | 98.4 | 40% | 0.4 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 175.4 | 169 | 0 | 0 | 0 | 0 | 110.8 | F305 Y306 N307 R313 | F305-V309 HydrophobicContact CD1-CG2 4.3Å; F305-V309 HydrophobicContact CD2-CG2 4.43Å; F305-V309 HydrophobicContact CE1-CG2 3.88Å; F305-V309 HydrophobicContact CE2-CG2 4.02Å; F305-V309 HydrophobicContact CZ-CG2 3.73Å; F305-V309 VanDerWaalsContact O-CG2 3.3Å; F305-V309 WeakPolarHBondContact O-CG2 3.41Å; F305-V309 PolarHBondContact O-N 2.86Å; Y306-V309 PolarHBondContact O-N 3.36Å; N307-V309 VanDerWaalsContact C-N 3.31Å; N307-V309 PolarHBondContact O-N 3.01Å; V309-R313 WeakPolarHBondContact O-CB 3.3Å; V309-R313 PolarHBondContact O-N 3.43Å |
| 310 | M | 96.9 | Very high | 97.4 | Very high | 60 Ų | 60 | 100.9 Ų | 100.9 | 30% | 0.296 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.9 | -47.2 | 178.2 | -68.8 | -57.3 | -64.3 | 0 | 0 | 112 | Y306 N307 N312 R313 E314 | Y306-M310 HydrophobicContact CD1-CG 4.16Å; Y306-M310 HydrophobicContact CE1-CG 3.71Å; Y306-M310 HydrophobicContact CE2-CG 4.21Å; Y306-M310 HydrophobicContact CE2-SD 4.34Å; Y306-M310 WeakPolarHBondContact O-CG 3.35Å; Y306-M310 PolarHBondContact O-N 3.45Å; N307-M310 PolarHBondContact O-N 3.02Å; N307-M310 VanDerWaalsContact O-N 3.13Å; M310-N312 PolarHBondContact O-N 3.17Å; M310-R313 WeakPolarHBondContact O-CB 3.34Å; M310-R313 PolarHBondContact O-N 2.91Å; M310-E314 WeakPolarHBondContact O-CG 3.43Å; M310-E314 PolarHBondContact O-N 3.13Å |
| 311 | E | 96.9 | Very high | 97.4 | Very high | 118 Ų | 118 | 102.8 Ų | 102.8 | 55% | 0.551 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -57.8 | -46.3 | 175.8 | -73.5 | 174.8 | -172.4 | 0 | 0 | 111.6 | N307 R313 E314 A315 | N307-E311 WeakPolarHBondContact O-CG 3.26Å; N307-E311 PolarHBondContact O-N 3.37Å; E311-R313 PolarHBondContact O-N 3.45Å; E311-E314 PolarHBondContact O-N 2.97Å; E311-A315 WeakPolarHBondContact O-CB 3.41Å; E311-A315 PolarHBondContact O-N 3.26Å |
| 312 | N | 97.1 | Very high | 97.3 | Very high | 109 Ų | 109 | 104 Ų | 104 | 58% | 0.583 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.9 | -41.4 | 176.7 | -80.7 | -40.8 | 0 | 0 | 0 | 112 | L308 M310 A315 E316 | L308-N312 VanDerWaalsContact O-CB 3.28Å; L308-N312 WeakPolarHBondContact O-CB 3.44Å; L308-N312 VanDerWaalsContact O-CG 3.31Å; L308-N312 PolarHBondContact O-N 3.46Å; L308-N312 PolarHBondContact O-ND2 2.83Å; M310-N312 PolarHBondContact O-N 3.17Å; N312-A315 PolarHBondContact O-N 2.98Å; N312-E316 VanDerWaalsContact O-CB 3.26Å; N312-E316 WeakPolarHBondContact O-CB 3.5Å; N312-E316 PolarHBondContact O-N 3.41Å |
| 313 | R | 97.1 | Very high | 97.3 | Very high | 147 Ų | 147 | 104.7 Ų | 104.7 | 56% | 0.555 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.3 | -42.1 | 177.1 | -176.9 | 178.3 | 178.2 | 165.2 | 1.5 | 111.6 | V309 M310 E311 Q317 | V309-R313 WeakPolarHBondContact O-CB 3.3Å; V309-R313 PolarHBondContact O-N 3.43Å; M310-R313 WeakPolarHBondContact O-CB 3.34Å; M310-R313 PolarHBondContact O-N 2.91Å; E311-R313 PolarHBondContact O-N 3.45Å; R313-Q317 WeakPolarHBondContact O-CB 3.4Å; R313-Q317 VanDerWaalsContact O-CG 3.24Å; R313-Q317 WeakPolarHBondContact O-CG 3.33Å; R313-Q317 PolarHBondContact O-N 3.4Å |
| 314 | E | 97 | Very high | 97.2 | Very high | 120 Ų | 120 | 109.2 Ų | 109.2 | 56% | 0.561 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66 | -44.6 | 176.4 | -72.6 | 178.4 | -177.3 | 0 | 0 | 111.8 | M310 E311 Q317 A318 | M310-E314 WeakPolarHBondContact O-CG 3.43Å; M310-E314 PolarHBondContact O-N 3.13Å; E311-E314 PolarHBondContact O-N 2.97Å; E314-Q317 PolarHBondContact O-N 2.94Å; E314-A318 WeakPolarHBondContact O-CB 3.41Å; E314-A318 PolarHBondContact O-N 3.41Å |
| 315 | A | 96.8 | Very high | 97.2 | Very high | 51 Ų | 51 | 110.7 Ų | 110.7 | 42% | 0.421 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.7 | -45.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | E311 N312 A318 L319 | E311-A315 WeakPolarHBondContact O-CB 3.41Å; E311-A315 PolarHBondContact O-N 3.26Å; N312-A315 PolarHBondContact O-N 2.98Å; A315-A318 PolarHBondContact O-N 2.87Å; A315-L319 WeakPolarHBondContact O-CG 3.41Å; A315-L319 PolarHBondContact O-N 3.41Å |
| 316 | E | 97.4 | Very high | 97.1 | Very high | 88 Ų | 88 | 107.4 Ų | 107.4 | 41% | 0.411 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.5 | -47.1 | 175.5 | -168.1 | -154 | 163 | 0 | 0 | 111.2 | N312 A318 L319 R320 | N312-E316 VanDerWaalsContact O-CB 3.26Å; N312-E316 WeakPolarHBondContact O-CB 3.5Å; N312-E316 PolarHBondContact O-N 3.41Å; E316-A318 VanDerWaalsContact C-N 3.32Å; E316-A318 PolarHBondContact O-N 3.31Å; E316-L319 PolarHBondContact O-N 2.82Å; E316-R320 WeakPolarHBondContact O-CG 3.24Å; E316-R320 PolarHBondContact O-N 3.48Å; E316-R320 IonicContact OE1-CZ 2.71Å; E316-R320 IonicContact OE1-NE 3.77Å; E316-R320 PolarHBondContact OE1-NE 3.2Å; E316-R320 IonicContact OE1-NH2 3.25Å; E316-R320 PolarHBondContact OE1-NH2 2.98Å |
| 317 | Q | 97.1 | Very high | 97 | Very high | 82 Ų | 82 | 105.2 Ų | 105.2 | 38% | 0.383 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61 | -40.2 | 176.6 | -76.3 | 177.3 | 11.7 | 0 | 0 | 112.2 | R313 E314 R320 K321 | R313-Q317 WeakPolarHBondContact O-CB 3.4Å; R313-Q317 VanDerWaalsContact O-CG 3.24Å; R313-Q317 WeakPolarHBondContact O-CG 3.33Å; R313-Q317 PolarHBondContact O-N 3.4Å; E314-Q317 PolarHBondContact O-N 2.94Å; Q317-R320 PolarHBondContact O-N 3.2Å; Q317-K321 WeakPolarHBondContact O-CG 3.43Å; Q317-K321 PolarHBondContact O-N 3.28Å |
| 318 | A | 96.3 | Very high | 96.9 | Very high | 45 Ų | 45 | 104 Ų | 104 | 37% | 0.372 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | E314 A315 E316 K321 K322 | E314-A318 WeakPolarHBondContact O-CB 3.41Å; E314-A318 PolarHBondContact O-N 3.41Å; A315-A318 PolarHBondContact O-N 2.87Å; E316-A318 VanDerWaalsContact C-N 3.32Å; E316-A318 PolarHBondContact O-N 3.31Å; A318-K321 PolarHBondContact O-N 2.94Å; A318-K322 WeakPolarHBondContact O-CG 2.73Å; A318-K322 PolarHBondContact O-N 2.81Å |
| 319 | L | 96.8 | Very high | 96.8 | Very high | 114 Ų | 114 | 104.6 Ų | 104.6 | 60% | 0.597 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.1 | -43.3 | 174.5 | -71.2 | 174.8 | 0 | 0 | 0 | 112 | A315 E316 K321 K322 K323 | A315-L319 WeakPolarHBondContact O-CG 3.41Å; A315-L319 PolarHBondContact O-N 3.41Å; E316-L319 PolarHBondContact O-N 2.82Å; L319-K321 VanDerWaalsContact C-N 3.32Å; L319-K321 PolarHBondContact O-N 2.82Å; L319-K322 PolarHBondContact O-N 2.94Å; L319-K323 WeakPolarHBondContact O-CB 3.39Å; L319-K323 PolarHBondContact O-N 2.65Å |
| 320 | R | 97.1 | Very high | 96.7 | Very high | 167 Ų | 167 | 105.8 Ų | 105.8 | 63% | 0.63 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58.8 | -42.3 | 174.3 | -73.3 | -175.1 | -176.7 | -154.1 | 2.9 | 111.8 | E316 Q317 K323 Y324 | E316-R320 WeakPolarHBondContact O-CG 3.24Å; E316-R320 PolarHBondContact O-N 3.48Å; E316-R320 IonicContact OE1-CZ 2.71Å; E316-R320 IonicContact OE1-NE 3.77Å; E316-R320 PolarHBondContact OE1-NE 3.2Å; E316-R320 IonicContact OE1-NH2 3.25Å; E316-R320 PolarHBondContact OE1-NH2 2.98Å; Q317-R320 PolarHBondContact O-N 3.2Å; R320-K323 PolarHBondContact O-N 3.22Å; R320-Y324 WeakPolarHBondContact O-CB 3.48Å; R320-Y324 PolarHBondContact O-N 3.47Å |
| 321 | K | 97.2 | Very high | 96.7 | Very high | 139 Ų | 139 | 107.8 Ų | 107.8 | 60% | 0.604 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.6 | -43.1 | 175 | -73.5 | 173.3 | -177 | 175.8 | 0 | 112.1 | Q317 A318 L319 Y324 K325 | Q317-K321 WeakPolarHBondContact O-CG 3.43Å; Q317-K321 PolarHBondContact O-N 3.28Å; A318-K321 PolarHBondContact O-N 2.94Å; L319-K321 VanDerWaalsContact C-N 3.32Å; L319-K321 PolarHBondContact O-N 2.82Å; K321-Y324 PolarHBondContact O-N 3.09Å; K321-K325 WeakPolarHBondContact O-CG 3.37Å; K321-K325 PolarHBondContact O-N 3.49Å; K321-K325 VanDerWaalsContact O-N 3.09Å |
| 322 | K | 96.9 | Very high | 96.7 | Very high | 134 Ų | 134 | 105.7 Ų | 105.7 | 58% | 0.583 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.3 | -45.8 | 175.5 | -73.4 | 176.8 | -178.3 | 179.6 | 0 | 111.3 | A318 L319 Y324 K325 V326 | A318-K322 WeakPolarHBondContact O-CG 2.73Å; A318-K322 PolarHBondContact O-N 2.81Å; L319-K322 PolarHBondContact O-N 2.94Å; K322-Y324 PolarHBondContact O-N 3.39Å; K322-K325 PolarHBondContact O-N 2.88Å; K322-V326 WeakPolarHBondContact O-CG2 3.44Å; K322-V326 PolarHBondContact O-N 3.17Å |
| 323 | K | 97.2 | Very high | 96.6 | Very high | 131 Ų | 131 | 108.7 Ų | 108.7 | 57% | 0.57 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -55.1 | -52.1 | 175.3 | 179 | -178.5 | 165.9 | 179.8 | 0 | 110.6 | L319 R320 K325 V326 E327 | L319-K323 WeakPolarHBondContact O-CB 3.39Å; L319-K323 PolarHBondContact O-N 2.65Å; R320-K323 PolarHBondContact O-N 3.22Å; K323-K325 VanDerWaalsContact C-N 3.32Å; K323-K325 PolarHBondContact O-N 3.42Å; K323-V326 PolarHBondContact O-N 3.05Å; K323-E327 VanDerWaalsContact CE-CD 3.41Å; K323-E327 WeakPolarHBondContact CE-OE1 3.31Å; K323-E327 HydrophobicContact CG-CG 4.32Å; K323-E327 IonicContact NZ-OE1 2.97Å; K323-E327 PolarHBondContact NZ-OE1 2.85Å; K323-E327 WeakPolarHBondContact O-CG 3.32Å; K323-E327 PolarHBondContact O-N 2.92Å |
| 324 | Y | 97.1 | Very high | 96.6 | Very high | 157 Ų | 157 | 105.3 Ų | 105.3 | 62% | 0.616 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.4 | -40.3 | 178.7 | 179.1 | -102.8 | 0 | 0 | 0 | 113.2 | R320 K321 K322 E327 T328 | R320-Y324 WeakPolarHBondContact O-CB 3.48Å; R320-Y324 PolarHBondContact O-N 3.47Å; K321-Y324 PolarHBondContact O-N 3.09Å; K322-Y324 PolarHBondContact O-N 3.39Å; Y324-E327 PolarHBondContact O-N 3.43Å; Y324-T328 WeakPolarHBondContact O-CB 3.41Å; Y324-T328 PolarHBondContact O-N 3.38Å; Y324-T328 PolarHBondContact O-OG1 2.94Å |
| 325 | K | 96.9 | Very high | 96.5 | Very high | 138 Ų | 138 | 104.6 Ų | 104.6 | 60% | 0.6 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.2 | -48.4 | 175.1 | -73.8 | 178.8 | 178.2 | -169.5 | 0 | 112 | K321 K322 K323 T328 E329 | K321-K325 WeakPolarHBondContact O-CG 3.37Å; K321-K325 PolarHBondContact O-N 3.49Å; K321-K325 VanDerWaalsContact O-N 3.09Å; K322-K325 PolarHBondContact O-N 2.88Å; K323-K325 VanDerWaalsContact C-N 3.32Å; K323-K325 PolarHBondContact O-N 3.42Å; K325-T328 WeakPolarHBondContact O-CB 3.5Å; K325-T328 PolarHBondContact O-N 3.33Å; K325-E329 WeakPolarHBondContact O-CG 3.42Å; K325-E329 PolarHBondContact O-N 3.43Å |
| 326 | V | 96.3 | Very high | 96.6 | Very high | 75 Ų | 75 | 107.3 Ų | 107.3 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.4 | -42.4 | 178.6 | 174.3 | 0 | 0 | 0 | 0 | 111 | K322 K323 T328 E329 I330 | K322-V326 WeakPolarHBondContact O-CG2 3.44Å; K322-V326 PolarHBondContact O-N 3.17Å; K323-V326 PolarHBondContact O-N 3.05Å; V326-T328 VanDerWaalsContact C-N 3.3Å; V326-T328 PolarHBondContact O-N 3.33Å; V326-E329 PolarHBondContact O-N 3.25Å; V326-I330 HydrophobicContact CG1-CD1 3.92Å; V326-I330 HydrophobicContact CG1-CG1 4.42Å; V326-I330 VanDerWaalsContact O-CG1 3.31Å; V326-I330 WeakPolarHBondContact O-CG1 3.39Å; V326-I330 PolarHBondContact O-N 3.49Å |
| 327 | E | 95 | Very high | 96.5 | Very high | 94 Ų | 94 | 109.9 Ų | 109.9 | 44% | 0.439 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59 | -42 | 174.3 | -73.8 | 175.2 | 152.9 | 0 | 0 | 111.4 | K323 Y324 I330 E331 | K323-E327 VanDerWaalsContact CE-CD 3.41Å; K323-E327 WeakPolarHBondContact CE-OE1 3.31Å; K323-E327 HydrophobicContact CG-CG 4.32Å; K323-E327 IonicContact NZ-OE1 2.97Å; K323-E327 PolarHBondContact NZ-OE1 2.85Å; K323-E327 WeakPolarHBondContact O-CG 3.32Å; K323-E327 PolarHBondContact O-N 2.92Å; Y324-E327 PolarHBondContact O-N 3.43Å; E327-I330 PolarHBondContact O-N 2.9Å; E327-E331 WeakPolarHBondContact O-CB 3.5Å; E327-E331 PolarHBondContact O-N 3.3Å |
| 328 | T | 96.2 | Very high | 96.5 | Very high | 52 Ų | 52 | 110.7 Ų | 110.7 | 32% | 0.319 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.3 | -39.8 | 176 | -52.3 | 0 | 0 | 0 | 0 | 111.8 | Y324 K325 V326 E331 N332 | Y324-T328 WeakPolarHBondContact O-CB 3.41Å; Y324-T328 PolarHBondContact O-N 3.38Å; Y324-T328 PolarHBondContact O-OG1 2.94Å; K325-T328 WeakPolarHBondContact O-CB 3.5Å; K325-T328 PolarHBondContact O-N 3.33Å; V326-T328 VanDerWaalsContact C-N 3.3Å; V326-T328 PolarHBondContact O-N 3.33Å; T328-E331 PolarHBondContact O-N 2.96Å; T328-N332 WeakPolarHBondContact O-CB 3.46Å; T328-N332 PolarHBondContact O-N 2.89Å; T328-N332 PolarHBondContact O-ND2 3.17Å |
| 329 | E | 95.9 | Very high | 96.5 | Very high | 110 Ų | 110 | 112.3 Ų | 112.3 | 51% | 0.514 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.7 | -42.9 | 174.9 | -74.1 | 169.9 | -165 | 0 | 0 | 111.6 | K325 V326 N332 W333 | K325-E329 WeakPolarHBondContact O-CG 3.42Å; K325-E329 PolarHBondContact O-N 3.43Å; V326-E329 PolarHBondContact O-N 3.25Å; E329-N332 WeakPolarHBondContact O-CB 3.5Å; E329-N332 PolarHBondContact O-N 2.73Å; E329-W333 PolarHBondContact O-N 3.24Å |
| 330 | I | 95.6 | Very high | 96.5 | Very high | 91 Ų | 91 | 112.4 Ų | 112.4 | 47% | 0.467 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.3 | -47.9 | 174.8 | -69.4 | 167.2 | 0 | 0 | 0 | 110.2 | V326 E327 N332 W333 I334 | V326-I330 HydrophobicContact CG1-CD1 3.92Å; V326-I330 HydrophobicContact CG1-CG1 4.42Å; V326-I330 VanDerWaalsContact O-CG1 3.31Å; V326-I330 WeakPolarHBondContact O-CG1 3.39Å; V326-I330 PolarHBondContact O-N 3.49Å; E327-I330 PolarHBondContact O-N 2.9Å; I330-N332 VanDerWaalsContact C-N 3.28Å; I330-N332 PolarHBondContact O-N 2.87Å; I330-W333 WeakPolarHBondContact O-CB 3.43Å; I330-W333 PolarHBondContact O-N 3.45Å; I330-I334 HydrophobicContact CG2-CD1 3.83Å; I330-I334 HydrophobicContact CG2-CG1 4.35Å; I330-I334 WeakPolarHBondContact O-CG1 3.35Å; I330-I334 PolarHBondContact O-N 3.36Å |
| 331 | E | 96.3 | Very high | 96.5 | Very high | 101 Ų | 101 | 108.9 Ų | 108.9 | 47% | 0.472 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -57.6 | -43.2 | 177.3 | -168 | 67.5 | -156.8 | 0 | 0 | 111.2 | E327 T328 W333 I334 Q335 | E327-E331 WeakPolarHBondContact O-CB 3.5Å; E327-E331 PolarHBondContact O-N 3.3Å; T328-E331 PolarHBondContact O-N 2.96Å; E331-W333 VanDerWaalsContact C-N 3.34Å; E331-W333 PolarHBondContact O-N 2.91Å; E331-I334 PolarHBondContact O-N 2.91Å; E331-Q335 WeakPolarHBondContact O-CG 3.29Å; E331-Q335 PolarHBondContact O-N 2.85Å |
| 332 | N | 96.7 | Very high | 96.4 | Very high | 75 Ų | 75 | 104.1 Ų | 104.1 | 40% | 0.401 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.9 | -38.5 | 175.1 | -68.7 | -26.5 | 0 | 0 | 0 | 112.4 | T328 E329 I330 K336 | T328-N332 WeakPolarHBondContact O-CB 3.46Å; T328-N332 PolarHBondContact O-N 2.89Å; T328-N332 PolarHBondContact O-ND2 3.17Å; E329-N332 WeakPolarHBondContact O-CB 3.5Å; E329-N332 PolarHBondContact O-N 2.73Å; I330-N332 VanDerWaalsContact C-N 3.28Å; I330-N332 PolarHBondContact O-N 2.87Å; N332-K336 WeakPolarHBondContact O-CB 3.39Å; N332-K336 VanDerWaalsContact O-CG 3.29Å; N332-K336 WeakPolarHBondContact O-CG 3.45Å; N332-K336 PolarHBondContact O-N 3.27Å |
| 333 | W | 96.7 | Very high | 96.3 | Very high | 171 Ų | 171 | 102.7 Ų | 102.7 | 65% | 0.648 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -68.6 | -38.8 | 175.7 | -80 | 115 | 0 | 0 | 0 | 112.4 | E329 I330 E331 K336 Y337 | E329-W333 PolarHBondContact O-N 3.24Å; I330-W333 WeakPolarHBondContact O-CB 3.43Å; I330-W333 PolarHBondContact O-N 3.45Å; E331-W333 VanDerWaalsContact C-N 3.34Å; E331-W333 PolarHBondContact O-N 2.91Å; W333-K336 HydrophobicContact CE3-CD 4.22Å; W333-K336 HydrophobicContact CZ3-CD 4.4Å; W333-K336 PolarHBondContact O-N 3.44Å; W333-Y337 WeakPolarHBondContact O-CB 3.49Å; W333-Y337 PolarHBondContact O-N 3.05Å |
| 334 | I | 95.8 | Very high | 96.1 | Very high | 77 Ų | 77 | 101.4 Ų | 101.4 | 40% | 0.395 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.8 | -51.1 | 173.3 | -67.9 | 168.3 | 0 | 0 | 0 | 109.5 | I330 E331 K336 Y337 D338 | I330-I334 HydrophobicContact CG2-CD1 3.83Å; I330-I334 HydrophobicContact CG2-CG1 4.35Å; I330-I334 WeakPolarHBondContact O-CG1 3.35Å; I330-I334 PolarHBondContact O-N 3.36Å; E331-I334 PolarHBondContact O-N 2.91Å; I334-K336 VanDerWaalsContact C-N 3.32Å; I334-K336 PolarHBondContact O-N 3.5Å; I334-Y337 PolarHBondContact O-N 2.71Å; I334-Y337 VanDerWaalsContact O-N 3.13Å; I334-D338 WeakPolarHBondContact O-CB 3.4Å; I334-D338 PolarHBondContact O-N 2.98Å |
| 335 | Q | 96.3 | Very high | 96 | Very high | 105 Ų | 105 | 98.6 Ų | 98.6 | 49% | 0.491 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.4 | -42.3 | 178.6 | -72.8 | 175.3 | 11.5 | 0 | 0 | 112.7 | E331 T339 | E331-Q335 WeakPolarHBondContact O-CG 3.29Å; E331-Q335 PolarHBondContact O-N 2.85Å; Q335-T339 WeakPolarHBondContact O-CB 3.38Å; Q335-T339 PolarHBondContact O-N 3.41Å; Q335-T339 PolarHBondContact O-OG1 3.13Å |
| 336 | K | 97 | Very high | 95.9 | Very high | 107 Ų | 107 | 97.8 Ų | 97.8 | 47% | 0.465 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.8 | -48.8 | 174.7 | -76.9 | 176.8 | -178.6 | -175.2 | 0 | 111.5 | N332 W333 I334 D338 T339 E340 | N332-K336 WeakPolarHBondContact O-CB 3.39Å; N332-K336 VanDerWaalsContact O-CG 3.29Å; N332-K336 WeakPolarHBondContact O-CG 3.45Å; N332-K336 PolarHBondContact O-N 3.27Å; W333-K336 HydrophobicContact CE3-CD 4.22Å; W333-K336 HydrophobicContact CZ3-CD 4.4Å; W333-K336 PolarHBondContact O-N 3.44Å; I334-K336 VanDerWaalsContact C-N 3.32Å; I334-K336 PolarHBondContact O-N 3.5Å; K336-D338 PolarHBondContact O-N 3.01Å; K336-T339 PolarHBondContact O-N 3.33Å; K336-E340 WeakPolarHBondContact O-CB 3.35Å; K336-E340 WeakPolarHBondContact O-CG 3.32Å; K336-E340 PolarHBondContact O-N 3.44Å |
| 337 | Y | 97.1 | Very high | 95.8 | Very high | 143 Ų | 143 | 98.7 Ų | 98.7 | 56% | 0.561 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -59.5 | -47.1 | 178.5 | 177.4 | -91.9 | 0 | 0 | 0 | 111.5 | W333 I334 T339 E340 M341 | W333-Y337 WeakPolarHBondContact O-CB 3.49Å; W333-Y337 PolarHBondContact O-N 3.05Å; I334-Y337 PolarHBondContact O-N 2.71Å; I334-Y337 VanDerWaalsContact O-N 3.13Å; Y337-T339 VanDerWaalsContact C-N 3.29Å; Y337-T339 PolarHBondContact O-N 2.89Å; Y337-E340 PolarHBondContact O-N 2.89Å; Y337-M341 HydrophobicContact CD1-CG 3.96Å; Y337-M341 HydrophobicContact CD2-CG 4.09Å; Y337-M341 HydrophobicContact CE1-CG 3.55Å; Y337-M341 HydrophobicContact CE2-CG 3.71Å; Y337-M341 HydrophobicContact CE2-SD 4.08Å; Y337-M341 HydrophobicContact CG-CG 4.22Å; Y337-M341 VanDerWaalsContact CZ-CG 3.42Å; Y337-M341 WeakPolarHBondContact O-CB 3.47Å; Y337-M341 VanDerWaalsContact O-CG 3.24Å; Y337-M341 WeakPolarHBondContact O-CG 3.24Å; Y337-M341 PolarHBondContact O-N 3.43Å |
| 338 | D | 97.3 | Very high | 95.7 | Very high | 98 Ų | 98 | 98.5 Ų | 98.5 | 52% | 0.524 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.9 | -38.8 | 178.6 | -70.8 | -17.4 | 0 | 0 | 0 | 111.6 | I334 K336 G342 | I334-D338 WeakPolarHBondContact O-CB 3.4Å; I334-D338 PolarHBondContact O-N 2.98Å; K336-D338 PolarHBondContact O-N 3.01Å; D338-G342 PolarHBondContact O-N 2.91Å |
| 339 | T | 95.8 | Very high | 95.6 | Very high | 80 Ų | 80 | 101 Ų | 101 | 49% | 0.491 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.3 | -53 | 176.3 | -52.7 | 0 | 0 | 0 | 0 | 111.1 | Q335 K336 Y337 M341 G342 E343 | Q335-T339 WeakPolarHBondContact O-CB 3.38Å; Q335-T339 PolarHBondContact O-N 3.41Å; Q335-T339 PolarHBondContact O-OG1 3.13Å; K336-T339 PolarHBondContact O-N 3.33Å; Y337-T339 VanDerWaalsContact C-N 3.29Å; Y337-T339 PolarHBondContact O-N 2.89Å; T339-M341 VanDerWaalsContact C-N 3.35Å; T339-M341 PolarHBondContact O-N 3.4Å; T339-G342 PolarHBondContact O-N 2.86Å; T339-G342 VanDerWaalsContact O-N 3.14Å; T339-E343 WeakPolarHBondContact O-CG 3.21Å; T339-E343 PolarHBondContact O-N 2.88Å |
| 340 | E | 96.5 | Very high | 95.5 | Very high | 116 Ų | 116 | 100.6 Ų | 100.6 | 54% | 0.542 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62 | -41.4 | -179.7 | -72.4 | 176.2 | -168.7 | 0 | 0 | 111.6 | K336 Y337 E343 K344 | K336-E340 WeakPolarHBondContact O-CB 3.35Å; K336-E340 WeakPolarHBondContact O-CG 3.32Å; K336-E340 PolarHBondContact O-N 3.44Å; Y337-E340 PolarHBondContact O-N 2.89Å; E340-E343 PolarHBondContact O-N 3.42Å; E340-K344 WeakPolarHBondContact O-CB 3.49Å; E340-K344 WeakPolarHBondContact O-CG 3.31Å; E340-K344 PolarHBondContact O-N 2.82Å |
| 341 | M | 96.1 | Very high | 95.4 | Very high | 93 Ų | 93 | 101.7 Ų | 101.7 | 46% | 0.458 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.4 | -38.7 | 174.7 | -74.6 | -57.2 | -53.6 | 0 | 0 | 112 | Y337 T339 K344 Q345 | Y337-M341 HydrophobicContact CD1-CG 3.96Å; Y337-M341 HydrophobicContact CD2-CG 4.09Å; Y337-M341 HydrophobicContact CE1-CG 3.55Å; Y337-M341 HydrophobicContact CE2-CG 3.71Å; Y337-M341 HydrophobicContact CE2-SD 4.08Å; Y337-M341 HydrophobicContact CG-CG 4.22Å; Y337-M341 VanDerWaalsContact CZ-CG 3.42Å; Y337-M341 WeakPolarHBondContact O-CB 3.47Å; Y337-M341 VanDerWaalsContact O-CG 3.24Å; Y337-M341 WeakPolarHBondContact O-CG 3.24Å; Y337-M341 PolarHBondContact O-N 3.43Å; T339-M341 VanDerWaalsContact C-N 3.35Å; T339-M341 PolarHBondContact O-N 3.4Å; M341-K344 PolarHBondContact O-N 2.94Å; M341-Q345 WeakPolarHBondContact O-CB 3.33Å; M341-Q345 PolarHBondContact O-N 2.82Å |
| 342 | G | 95.4 | Very high | 95.3 | Very high | 38 Ų | 38 | 102.5 Ų | 102.5 | 39% | 0.392 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.7 | -49.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | D338 T339 K344 Q345 E346 | D338-G342 PolarHBondContact O-N 2.91Å; T339-G342 PolarHBondContact O-N 2.86Å; T339-G342 VanDerWaalsContact O-N 3.14Å; G342-K344 VanDerWaalsContact C-N 3.35Å; G342-K344 PolarHBondContact O-N 3.21Å; G342-Q345 PolarHBondContact O-N 2.86Å; G342-E346 PolarHBondContact O-N 2.71Å |
| 343 | E | 94.9 | Very high | 95.2 | Very high | 104 Ų | 104 | 100.1 Ų | 100.1 | 49% | 0.486 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.2 | -43.4 | 175.4 | -71.2 | 175.5 | 177.8 | 0 | 0 | 111.5 | T339 E340 E346 E347 | T339-E343 WeakPolarHBondContact O-CG 3.21Å; T339-E343 PolarHBondContact O-N 2.88Å; E340-E343 PolarHBondContact O-N 3.42Å; E343-E346 PolarHBondContact O-N 2.99Å; E343-E347 WeakPolarHBondContact O-CG 3.42Å; E343-E347 PolarHBondContact O-N 2.92Å |
| 344 | K | 94.1 | Very high | 95 | Very high | 105 Ų | 105 | 95.3 Ų | 95.3 | 46% | 0.457 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -66.3 | -35.9 | 176.2 | -70.5 | -45.4 | -179.5 | -162.7 | 0 | 113.5 | E340 M341 G342 E347 L348 | E340-K344 WeakPolarHBondContact O-CB 3.49Å; E340-K344 WeakPolarHBondContact O-CG 3.31Å; E340-K344 PolarHBondContact O-N 2.82Å; M341-K344 PolarHBondContact O-N 2.94Å; G342-K344 VanDerWaalsContact C-N 3.35Å; G342-K344 PolarHBondContact O-N 3.21Å; K344-E347 VanDerWaalsContact CD-OE2 3.29Å; K344-E347 WeakPolarHBondContact CD-OE2 3.31Å; K344-E347 IonicContact NZ-OE1 3.94Å; K344-E347 PolarHBondContact NZ-OE1 2.9Å; K344-E347 IonicContact NZ-OE2 3.48Å; K344-E347 PolarHBondContact NZ-OE2 3.33Å; K344-L348 WeakPolarHBondContact O-CB 3.29Å; K344-L348 VanDerWaalsContact O-CG 3.31Å; K344-L348 WeakPolarHBondContact O-CG 3.37Å; K344-L348 PolarHBondContact O-N 3.44Å |
| 345 | Q | 94.4 | Very high | 94.8 | Very high | 97 Ų | 97 | 97 Ų | 97 | 45% | 0.453 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.7 | -42.8 | 174.4 | -176.9 | 60.7 | 29 | 0 | 0 | 110.8 | M341 G342 L348 E349 | M341-Q345 WeakPolarHBondContact O-CB 3.33Å; M341-Q345 PolarHBondContact O-N 2.82Å; G342-Q345 PolarHBondContact O-N 2.86Å; Q345-L348 PolarHBondContact O-N 3.21Å; Q345-E349 WeakPolarHBondContact CG-OE1 3.42Å; Q345-E349 PolarHBondContact NE2-OE1 2.87Å; Q345-E349 WeakPolarHBondContact O-CG 3.44Å; Q345-E349 PolarHBondContact O-N 3.34Å |
| 346 | E | 94.4 | Very high | 94.7 | Very high | 122 Ų | 122 | 99 Ų | 99 | 57% | 0.57 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.9 | -46.8 | 174.9 | -170.8 | 175 | -167.5 | 0 | 0 | 111.4 | G342 E343 L348 E349 D350 | G342-E346 PolarHBondContact O-N 2.71Å; E343-E346 PolarHBondContact O-N 2.99Å; E346-L348 VanDerWaalsContact C-N 3.31Å; E346-L348 PolarHBondContact O-N 3.48Å; E346-E349 PolarHBondContact O-N 2.97Å; E346-D350 WeakPolarHBondContact O-CB 3.48Å; E346-D350 PolarHBondContact O-N 3.44Å |
| 347 | E | 94.4 | Very high | 94.4 | Very high | 93 Ų | 93 | 100 Ų | 100 | 44% | 0.435 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -56.8 | -42.1 | 173.7 | -75.5 | 176.6 | -163.4 | 0 | 0 | 112.3 | E343 K344 L351 | E343-E347 WeakPolarHBondContact O-CG 3.42Å; E343-E347 PolarHBondContact O-N 2.92Å; K344-E347 VanDerWaalsContact CD-OE2 3.29Å; K344-E347 WeakPolarHBondContact CD-OE2 3.31Å; K344-E347 IonicContact NZ-OE1 3.94Å; K344-E347 PolarHBondContact NZ-OE1 2.9Å; K344-E347 IonicContact NZ-OE2 3.48Å; K344-E347 PolarHBondContact NZ-OE2 3.33Å; E347-L351 WeakPolarHBondContact O-CB 3.23Å; E347-L351 VanDerWaalsContact O-CG 3.31Å; E347-L351 WeakPolarHBondContact O-CG 3.44Å; E347-L351 PolarHBondContact O-N 3.14Å |
| 348 | L | 93 | Very high | 94.2 | Very high | 91 Ų | 91 | 99.1 Ų | 99.1 | 48% | 0.476 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.2 | -44.6 | 177 | -78.6 | 175.1 | 0 | 0 | 0 | 111.6 | K344 Q345 E346 D350 L351 E352 | K344-L348 WeakPolarHBondContact O-CB 3.29Å; K344-L348 VanDerWaalsContact O-CG 3.31Å; K344-L348 WeakPolarHBondContact O-CG 3.37Å; K344-L348 PolarHBondContact O-N 3.44Å; Q345-L348 PolarHBondContact O-N 3.21Å; E346-L348 VanDerWaalsContact C-N 3.31Å; E346-L348 PolarHBondContact O-N 3.48Å; L348-D350 VanDerWaalsContact C-N 3.33Å; L348-D350 PolarHBondContact O-N 2.8Å; L348-L351 PolarHBondContact O-N 3.3Å; L348-E352 WeakPolarHBondContact O-CB 3.35Å; L348-E352 VanDerWaalsContact O-CG 3.31Å; L348-E352 WeakPolarHBondContact O-CG 3.34Å; L348-E352 PolarHBondContact O-N 3.27Å |
| 349 | E | 94.7 | Very high | 93.9 | Very high | 103 Ų | 103 | 100.2 Ų | 100.2 | 48% | 0.481 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.3 | -40.6 | 177.9 | -74.5 | 174.8 | -166.1 | 0 | 0 | 111.7 | Q345 E346 E352 A353 | Q345-E349 WeakPolarHBondContact CG-OE1 3.42Å; Q345-E349 PolarHBondContact NE2-OE1 2.87Å; Q345-E349 WeakPolarHBondContact O-CG 3.44Å; Q345-E349 PolarHBondContact O-N 3.34Å; E346-E349 PolarHBondContact O-N 2.97Å; E349-E352 PolarHBondContact O-N 2.78Å; E349-A353 WeakPolarHBondContact O-CB 3.47Å; E349-A353 PolarHBondContact O-N 3.48Å |
| 350 | D | 93.9 | Very high | 93.8 | Very high | 102 Ų | 102 | 101 Ų | 101 | 55% | 0.545 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.9 | -47.8 | 173.3 | -81.7 | -13.5 | 0 | 0 | 0 | 111.7 | E346 L348 E352 A353 V354 | E346-D350 WeakPolarHBondContact O-CB 3.48Å; E346-D350 PolarHBondContact O-N 3.44Å; L348-D350 VanDerWaalsContact C-N 3.33Å; L348-D350 PolarHBondContact O-N 2.8Å; D350-E352 VanDerWaalsContact C-N 3.35Å; D350-E352 PolarHBondContact O-N 3.43Å; D350-A353 WeakPolarHBondContact O-CB 3.31Å; D350-A353 PolarHBondContact O-N 3.5Å; D350-V354 WeakPolarHBondContact O-CG2 3.48Å; D350-V354 PolarHBondContact O-N 3.18Å |
| 351 | L | 93.6 | Very high | 93.4 | Very high | 114 Ų | 114 | 98 Ų | 98 | 60% | 0.597 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.6 | -39.6 | 176.5 | -76.5 | 174.3 | 0 | 0 | 0 | 112.1 | E347 L348 A353 V354 H355 | E347-L351 WeakPolarHBondContact O-CB 3.23Å; E347-L351 VanDerWaalsContact O-CG 3.31Å; E347-L351 WeakPolarHBondContact O-CG 3.44Å; E347-L351 PolarHBondContact O-N 3.14Å; L348-L351 PolarHBondContact O-N 3.3Å; L351-A353 VanDerWaalsContact C-N 3.31Å; L351-V354 PolarHBondContact O-N 2.9Å; L351-H355 VanDerWaalsContact O-CB 3.23Å; L351-H355 WeakPolarHBondContact O-CB 3.31Å; L351-H355 PolarHBondContact O-N 2.88Å |
| 352 | E | 92.6 | Very high | 93.1 | Very high | 119 Ų | 119 | 97.7 Ų | 97.7 | 56% | 0.556 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64.8 | -36.5 | 173.9 | -77.5 | -175.5 | -178.3 | 0 | 0 | 111.5 | L348 E349 D350 H355 R356 | L348-E352 WeakPolarHBondContact O-CB 3.35Å; L348-E352 VanDerWaalsContact O-CG 3.31Å; L348-E352 WeakPolarHBondContact O-CG 3.34Å; L348-E352 PolarHBondContact O-N 3.27Å; E349-E352 PolarHBondContact O-N 2.78Å; D350-E352 VanDerWaalsContact C-N 3.35Å; D350-E352 PolarHBondContact O-N 3.43Å; E352-H355 PolarHBondContact O-N 3.02Å; E352-R356 WeakPolarHBondContact O-CB 3.46Å; E352-R356 VanDerWaalsContact O-CG 3.29Å; E352-R356 WeakPolarHBondContact O-CG 3.38Å; E352-R356 PolarHBondContact O-N 3.23Å; E352-R356 PolarHBondContact O-NE 2.92Å |
| 353 | A | 94.4 | Very high | 92.8 | Very high | 24 Ų | 24 | 99.9 Ų | 99.9 | 20% | 0.198 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -62.8 | -51 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | E349 D350 L351 H355 R356 E357 | E349-A353 WeakPolarHBondContact O-CB 3.47Å; E349-A353 PolarHBondContact O-N 3.48Å; D350-A353 WeakPolarHBondContact O-CB 3.31Å; D350-A353 PolarHBondContact O-N 3.5Å; L351-A353 VanDerWaalsContact C-N 3.31Å; A353-H355 VanDerWaalsContact C-N 3.34Å; A353-H355 PolarHBondContact O-N 3.36Å; A353-R356 VanDerWaalsContact CA-NH2 3.34Å; A353-R356 WeakPolarHBondContact O-CB 3.37Å; A353-R356 PolarHBondContact O-N 2.88Å; A353-E357 WeakPolarHBondContact O-CG 3.25Å; A353-E357 PolarHBondContact O-N 3.44Å |
| 354 | V | 93.9 | Very high | 92.6 | Very high | 70 Ų | 70 | 98.9 Ų | 98.9 | 42% | 0.424 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -59.2 | -46.1 | 174.9 | 174.5 | 0 | 0 | 0 | 0 | 110.7 | D350 L351 R356 E357 E358 | D350-V354 WeakPolarHBondContact O-CG2 3.48Å; D350-V354 PolarHBondContact O-N 3.18Å; L351-V354 PolarHBondContact O-N 2.9Å; V354-R356 VanDerWaalsContact C-N 3.31Å; V354-R356 PolarHBondContact O-N 2.8Å; V354-E357 WeakPolarHBondContact O-CB 3.19Å; V354-E357 PolarHBondContact O-N 3.36Å; V354-E357 VanDerWaalsContact O-N 3.13Å; V354-E358 HydrophobicContact CG1-CG 4.18Å; V354-E358 WeakPolarHBondContact O-CB 3.38Å; V354-E358 WeakPolarHBondContact O-CG 3.29Å; V354-E358 PolarHBondContact O-N 3.36Å |
| 355 | H | 91 | Very high | 92.3 | Very high | 114 Ų | 114 | 99 Ų | 99 | 53% | 0.528 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.3 | -39.8 | 178.9 | -176.3 | 64.3 | 0 | 0 | 0 | 112.1 | L351 E352 A353 K359 | L351-H355 VanDerWaalsContact O-CB 3.23Å; L351-H355 WeakPolarHBondContact O-CB 3.31Å; L351-H355 PolarHBondContact O-N 2.88Å; E352-H355 PolarHBondContact O-N 3.02Å; A353-H355 VanDerWaalsContact C-N 3.34Å; A353-H355 PolarHBondContact O-N 3.36Å; H355-K359 WeakPolarHBondContact O-CB 3.3Å; H355-K359 PolarHBondContact O-N 2.86Å |
| 356 | R | 93.4 | Very high | 92 | Very high | 146 Ų | 146 | 100.1 Ų | 100.1 | 55% | 0.551 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.2 | -46.2 | 173.4 | -80.9 | -176.6 | -71.4 | 111.1 | -8.5 | 111.2 | E352 A353 V354 K359 I360 | E352-R356 WeakPolarHBondContact O-CB 3.46Å; E352-R356 VanDerWaalsContact O-CG 3.29Å; E352-R356 WeakPolarHBondContact O-CG 3.38Å; E352-R356 PolarHBondContact O-N 3.23Å; E352-R356 PolarHBondContact O-NE 2.92Å; A353-R356 VanDerWaalsContact CA-NH2 3.34Å; A353-R356 WeakPolarHBondContact O-CB 3.37Å; A353-R356 PolarHBondContact O-N 2.88Å; V354-R356 VanDerWaalsContact C-N 3.31Å; V354-R356 PolarHBondContact O-N 2.8Å; R356-K359 PolarHBondContact O-N 3.45Å; R356-I360 VanDerWaalsContact O-CG1 3.31Å; R356-I360 WeakPolarHBondContact O-CG1 3.48Å; R356-I360 PolarHBondContact O-N 3.13Å |
| 357 | E | 92.5 | Very high | 91.7 | Very high | 129 Ų | 129 | 101 Ų | 101 | 60% | 0.603 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.6 | -48 | 177.3 | -70.7 | 178.7 | -178 | 0 | 0 | 112 | A353 V354 K359 I360 A361 | A353-E357 WeakPolarHBondContact O-CG 3.25Å; A353-E357 PolarHBondContact O-N 3.44Å; V354-E357 WeakPolarHBondContact O-CB 3.19Å; V354-E357 PolarHBondContact O-N 3.36Å; V354-E357 VanDerWaalsContact O-N 3.13Å; E357-K359 VanDerWaalsContact C-N 3.28Å; E357-K359 PolarHBondContact O-N 2.97Å; E357-I360 WeakPolarHBondContact O-CB 3.45Å; E357-I360 PolarHBondContact O-N 2.99Å; E357-A361 WeakPolarHBondContact O-CB 3.43Å; E357-A361 PolarHBondContact O-N 2.85Å |
| 358 | E | 90.9 | Very high | 91.3 | Very high | 123 Ų | 123 | 103.8 Ų | 103.8 | 58% | 0.575 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60 | -39 | 175.9 | -74 | -172.8 | 161.2 | 0 | 0 | 111.9 | V354 A361 L362 | V354-E358 HydrophobicContact CG1-CG 4.18Å; V354-E358 WeakPolarHBondContact O-CB 3.38Å; V354-E358 WeakPolarHBondContact O-CG 3.29Å; V354-E358 PolarHBondContact O-N 3.36Å; E358-A361 PolarHBondContact O-N 3.4Å; E358-L362 VanDerWaalsContact O-CB 3.25Å; E358-L362 WeakPolarHBondContact O-CB 3.48Å; E358-L362 PolarHBondContact O-N 3.42Å |
| 359 | K | 92.5 | Very high | 91 | Very high | 121 Ų | 121 | 105.2 Ų | 105.2 | 53% | 0.526 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.5 | -42.5 | 176.4 | -172.2 | 176.9 | -179.5 | -179.8 | 0 | 111.3 | H355 R356 E357 L362 E363 | H355-K359 WeakPolarHBondContact O-CB 3.3Å; H355-K359 PolarHBondContact O-N 2.86Å; R356-K359 PolarHBondContact O-N 3.45Å; E357-K359 VanDerWaalsContact C-N 3.28Å; E357-K359 PolarHBondContact O-N 2.97Å; K359-L362 PolarHBondContact O-N 3.36Å; K359-E363 WeakPolarHBondContact O-CG 3.48Å; K359-E363 PolarHBondContact O-N 3.25Å |
| 360 | I | 92.8 | Very high | 90.6 | Very high | 96 Ų | 96 | 106.9 Ų | 106.9 | 49% | 0.492 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.4 | -49.6 | 173.5 | -67.5 | 163.5 | 0 | 0 | 0 | 110 | R356 E357 L362 E363 E364 | R356-I360 VanDerWaalsContact O-CG1 3.31Å; R356-I360 WeakPolarHBondContact O-CG1 3.48Å; R356-I360 PolarHBondContact O-N 3.13Å; E357-I360 WeakPolarHBondContact O-CB 3.45Å; E357-I360 PolarHBondContact O-N 2.99Å; I360-L362 VanDerWaalsContact C-N 3.31Å; I360-L362 PolarHBondContact O-N 2.86Å; I360-E363 WeakPolarHBondContact O-CB 3.42Å; I360-E363 PolarHBondContact O-N 3.18Å; I360-E363 VanDerWaalsContact O-N 3.14Å; I360-E364 WeakPolarHBondContact O-CG 3.39Å; I360-E364 PolarHBondContact O-N 2.92Å |
| 361 | A | 88.7 | Confident | 90.3 | Very high | 54 Ų | 54 | 105.5 Ų | 105.5 | 45% | 0.446 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.3 | -39.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | E357 E358 E364 L365 | E357-A361 WeakPolarHBondContact O-CB 3.43Å; E357-A361 PolarHBondContact O-N 2.85Å; E358-A361 PolarHBondContact O-N 3.4Å; A361-E364 PolarHBondContact O-N 2.78Å; A361-L365 WeakPolarHBondContact O-CB 3.5Å; A361-L365 PolarHBondContact O-N 3.36Å |
| 362 | L | 89.1 | Confident | 89.7 | Confident | 86 Ų | 86 | 105.3 Ų | 105.3 | 45% | 0.45 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.3 | -42 | 175.3 | -178.7 | 68.4 | 0 | 0 | 0 | 111.5 | E358 K359 I360 L365 K366 | E358-L362 VanDerWaalsContact O-CB 3.25Å; E358-L362 WeakPolarHBondContact O-CB 3.48Å; E358-L362 PolarHBondContact O-N 3.42Å; K359-L362 PolarHBondContact O-N 3.36Å; I360-L362 VanDerWaalsContact C-N 3.31Å; I360-L362 PolarHBondContact O-N 2.86Å; L362-L365 PolarHBondContact O-N 2.94Å; L362-K366 HydrophobicContact CG-CD 4.4Å; L362-K366 WeakPolarHBondContact O-CB 3.28Å; L362-K366 VanDerWaalsContact O-CG 3.3Å; L362-K366 WeakPolarHBondContact O-CG 3.46Å; L362-K366 PolarHBondContact O-N 3.27Å |
| 363 | E | 89.7 | Confident | 89.3 | Confident | 84 Ų | 84 | 102.9 Ų | 102.9 | 39% | 0.393 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63 | -43.7 | 174.6 | -76.8 | -175.2 | -169.1 | 0 | 0 | 111.8 | K359 I360 K366 R367 | K359-E363 WeakPolarHBondContact O-CG 3.48Å; K359-E363 PolarHBondContact O-N 3.25Å; I360-E363 WeakPolarHBondContact O-CB 3.42Å; I360-E363 PolarHBondContact O-N 3.18Å; I360-E363 VanDerWaalsContact O-N 3.14Å; E363-K366 PolarHBondContact O-N 3.48Å; E363-R367 WeakPolarHBondContact O-CG 3.35Å; E363-R367 PolarHBondContact O-N 3.42Å; E363-R367 IonicContact OE2-NH2 3.65Å; E363-R367 PolarHBondContact OE2-NH2 3.26Å |
| 364 | E | 90.1 | Very high | 88.7 | Confident | 84 Ų | 84 | 107.3 Ų | 107.3 | 39% | 0.393 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.4 | -45.9 | 172.9 | -71.7 | -176 | -172.8 | 0 | 0 | 111.9 | I360 A361 K366 R367 R368 | I360-E364 WeakPolarHBondContact O-CG 3.39Å; I360-E364 PolarHBondContact O-N 2.92Å; A361-E364 PolarHBondContact O-N 2.78Å; E364-K366 VanDerWaalsContact C-N 3.34Å; E364-K366 PolarHBondContact O-N 3.44Å; E364-R367 WeakPolarHBondContact O-CB 3.47Å; E364-R367 PolarHBondContact O-N 2.76Å; E364-R368 WeakPolarHBondContact O-CG 3.33Å; E364-R368 PolarHBondContact O-N 3.29Å; E364-R368 IonicContact OE2-NH2 3.18Å |
| 365 | L | 89.1 | Confident | 88.2 | Confident | 106 Ų | 106 | 108.7 Ų | 108.7 | 56% | 0.555 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.9 | -39.6 | 177.9 | -170.8 | 67.3 | 0 | 0 | 0 | 111.5 | A361 L362 R368 H369 | A361-L365 WeakPolarHBondContact O-CB 3.5Å; A361-L365 PolarHBondContact O-N 3.36Å; L362-L365 PolarHBondContact O-N 2.94Å; L365-R368 PolarHBondContact O-N 2.83Å; L365-H369 VanDerWaalsContact O-CB 3.3Å; L365-H369 WeakPolarHBondContact O-CB 3.45Å; L365-H369 PolarHBondContact O-N 2.91Å |
| 366 | K | 87.3 | Confident | 87.6 | Confident | 121 Ų | 121 | 110.3 Ų | 110.3 | 53% | 0.526 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 172.7 | -78.2 | 174.4 | 179.9 | 174.2 | 0 | 111.6 | L362 E363 E364 H369 K370 | L362-K366 HydrophobicContact CG-CD 4.4Å; L362-K366 WeakPolarHBondContact O-CB 3.28Å; L362-K366 VanDerWaalsContact O-CG 3.3Å; L362-K366 WeakPolarHBondContact O-CG 3.46Å; L362-K366 PolarHBondContact O-N 3.27Å; E363-K366 PolarHBondContact O-N 3.48Å; E364-K366 VanDerWaalsContact C-N 3.34Å; E364-K366 PolarHBondContact O-N 3.44Å; K366-H369 PolarHBondContact O-N 3.32Å; K366-K370 WeakPolarHBondContact O-CG 3.3Å; K366-K370 PolarHBondContact O-N 2.87Å |
| 367 | R | 87.4 | Confident | 87.1 | Confident | 141 Ų | 141 | 106.5 Ų | 106.5 | 53% | 0.532 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.4 | -48.6 | 173.8 | -70.6 | -178.9 | -165.2 | 102.9 | 8.8 | 110.5 | E363 E364 H369 K370 V371 | E363-R367 WeakPolarHBondContact O-CG 3.35Å; E363-R367 PolarHBondContact O-N 3.42Å; E363-R367 IonicContact OE2-NH2 3.65Å; E363-R367 PolarHBondContact OE2-NH2 3.26Å; E364-R367 WeakPolarHBondContact O-CB 3.47Å; E364-R367 PolarHBondContact O-N 2.76Å; R367-H369 VanDerWaalsContact C-N 3.35Å; R367-H369 PolarHBondContact O-N 3.46Å; R367-K370 PolarHBondContact O-N 2.91Å; R367-V371 WeakPolarHBondContact O-CG2 3.39Å; R367-V371 PolarHBondContact O-N 3.16Å; R367-V371 VanDerWaalsContact O-N 3.16Å |
| 368 | R | 86.2 | Confident | 86.5 | Confident | 152 Ų | 152 | 105.7 Ų | 105.7 | 57% | 0.574 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.2 | -43.9 | 175.7 | -68.4 | 179.1 | -168.2 | 166.8 | 9.7 | 112 | E364 L365 V371 L372 | E364-R368 WeakPolarHBondContact O-CG 3.33Å; E364-R368 PolarHBondContact O-N 3.29Å; E364-R368 IonicContact OE2-NH2 3.18Å; L365-R368 PolarHBondContact O-N 2.83Å; R368-V371 PolarHBondContact O-N 3.17Å; R368-L372 PolarHBondContact O-N 3.14Å |
| 369 | H | 86.4 | Confident | 85.8 | Confident | 120 Ų | 120 | 103.6 Ų | 103.6 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.7 | -41.2 | 178.4 | -176.4 | 69.4 | 0 | 0 | 0 | 112 | L365 K366 R367 V371 L372 V373 | L365-H369 VanDerWaalsContact O-CB 3.3Å; L365-H369 WeakPolarHBondContact O-CB 3.45Å; L365-H369 PolarHBondContact O-N 2.91Å; K366-H369 PolarHBondContact O-N 3.32Å; R367-H369 VanDerWaalsContact C-N 3.35Å; R367-H369 PolarHBondContact O-N 3.46Å; H369-V371 VanDerWaalsContact C-N 3.35Å; H369-V371 PolarHBondContact O-N 3.33Å; H369-L372 PolarHBondContact O-N 2.83Å; H369-V373 WeakPolarHBondContact O-CB 3.39Å; H369-V373 VanDerWaalsContact O-CG2 3.28Å; H369-V373 WeakPolarHBondContact O-CG2 3.48Å; H369-V373 PolarHBondContact O-N 3.36Å |
| 370 | K | 87.6 | Confident | 85 | Confident | 139 Ų | 139 | 105.6 Ų | 105.6 | 60% | 0.604 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -57.7 | -47.9 | 174 | -77.7 | -179.6 | 179.6 | -173.7 | 0 | 111.6 | K366 R367 L372 V373 E374 | K366-K370 WeakPolarHBondContact O-CG 3.3Å; K366-K370 PolarHBondContact O-N 2.87Å; R367-K370 PolarHBondContact O-N 2.91Å; K370-L372 PolarHBondContact O-N 3.17Å; K370-V373 PolarHBondContact O-N 2.93Å; K370-E374 WeakPolarHBondContact O-CG 3.29Å; K370-E374 PolarHBondContact O-N 3.32Å |
| 371 | V | 86.8 | Confident | 84.2 | Confident | 73 Ų | 73 | 106.4 Ų | 106.4 | 44% | 0.442 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.1 | -48.3 | 176.2 | 176.2 | 0 | 0 | 0 | 0 | 110.6 | R367 R368 H369 V373 E374 E375 | R367-V371 WeakPolarHBondContact O-CG2 3.39Å; R367-V371 PolarHBondContact O-N 3.16Å; R367-V371 VanDerWaalsContact O-N 3.16Å; R368-V371 PolarHBondContact O-N 3.17Å; H369-V371 VanDerWaalsContact C-N 3.35Å; H369-V371 PolarHBondContact O-N 3.33Å; V371-V373 VanDerWaalsContact C-N 3.3Å; V371-V373 PolarHBondContact O-N 2.91Å; V371-E374 WeakPolarHBondContact O-CB 3.42Å; V371-E374 PolarHBondContact O-N 2.98Å; V371-E375 HydrophobicContact CG1-CG 4.42Å; V371-E375 WeakPolarHBondContact O-CG 3.41Å; V371-E375 PolarHBondContact O-N 3.35Å |
| 372 | L | 80.9 | Confident | 83.4 | Confident | 109 Ų | 109 | 109.7 Ų | 109.7 | 57% | 0.571 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.4 | -37.1 | 176.2 | -99.6 | 129.3 | 0 | 0 | 0 | 113.3 | R368 H369 K370 F376 | R368-L372 PolarHBondContact O-N 3.14Å; H369-L372 PolarHBondContact O-N 2.83Å; K370-L372 PolarHBondContact O-N 3.17Å; L372-F376 VanDerWaalsContact O-CB 3.28Å; L372-F376 WeakPolarHBondContact O-CB 3.28Å; L372-F376 PolarHBondContact O-N 3.48Å |
| 373 | V | 84.3 | Confident | 82.6 | Confident | 69 Ų | 69 | 114.4 Ų | 114.4 | 42% | 0.418 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.8 | -43.6 | 176.1 | 168.6 | 0 | 0 | 0 | 0 | 110.6 | H369 K370 V371 F376 V377 | H369-V373 WeakPolarHBondContact O-CB 3.39Å; H369-V373 VanDerWaalsContact O-CG2 3.28Å; H369-V373 WeakPolarHBondContact O-CG2 3.48Å; H369-V373 PolarHBondContact O-N 3.36Å; K370-V373 PolarHBondContact O-N 2.93Å; V371-V373 VanDerWaalsContact C-N 3.3Å; V371-V373 PolarHBondContact O-N 2.91Å; V373-F376 PolarHBondContact O-N 3.45Å; V373-V377 WeakPolarHBondContact O-CG2 3.29Å; V373-V377 PolarHBondContact O-N 3.19Å |
| 374 | E | 83.2 | Confident | 81.9 | Confident | 117 Ų | 117 | 115.1 Ų | 115.1 | 55% | 0.547 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60 | -47 | 174.1 | -71.5 | 169.4 | -170.6 | 0 | 0 | 111.1 | K370 V371 F376 V377 Q378 | K370-E374 WeakPolarHBondContact O-CG 3.29Å; K370-E374 PolarHBondContact O-N 3.32Å; V371-E374 WeakPolarHBondContact O-CB 3.42Å; V371-E374 PolarHBondContact O-N 2.98Å; E374-F376 VanDerWaalsContact C-N 3.35Å; E374-F376 PolarHBondContact O-N 2.85Å; E374-V377 PolarHBondContact O-N 3.45Å; E374-Q378 WeakPolarHBondContact O-CG 3.36Å; E374-Q378 PolarHBondContact O-N 3.3Å |
| 375 | E | 83.2 | Confident | 81.2 | Confident | 98 Ų | 98 | 115.2 Ų | 115.2 | 46% | 0.458 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.1 | -41.7 | 173.9 | -71.8 | 177.2 | 175.8 | 0 | 0 | 112 | V371 V377 Q378 I379 | V371-E375 HydrophobicContact CG1-CG 4.42Å; V371-E375 WeakPolarHBondContact O-CG 3.41Å; V371-E375 PolarHBondContact O-N 3.35Å; E375-V377 VanDerWaalsContact C-N 3.35Å; E375-V377 PolarHBondContact O-N 2.86Å; E375-Q378 PolarHBondContact O-N 3.14Å; E375-I379 VanDerWaalsContact O-CG1 3.29Å; E375-I379 WeakPolarHBondContact O-CG1 3.5Å; E375-I379 PolarHBondContact O-N 3.28Å |
| 376 | F | 77.8 | Confident | 80.3 | Confident | 148 Ų | 148 | 113.4 Ų | 113.4 | 65% | 0.649 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -65.7 | -38.3 | 178.4 | -161.4 | -87 | 0 | 0 | 0 | 111.9 | L372 V373 E374 R380 | L372-F376 VanDerWaalsContact O-CB 3.28Å; L372-F376 WeakPolarHBondContact O-CB 3.28Å; L372-F376 PolarHBondContact O-N 3.48Å; V373-F376 PolarHBondContact O-N 3.45Å; E374-F376 VanDerWaalsContact C-N 3.35Å; E374-F376 PolarHBondContact O-N 2.85Å; F376-R380 VanDerWaalsContact O-CB 3.29Å; F376-R380 WeakPolarHBondContact O-CB 3.26Å; F376-R380 PolarHBondContact O-N 3.19Å |
| 377 | V | 82.7 | Confident | 79.4 | Confident | 67 Ų | 67 | 110.9 Ų | 110.9 | 41% | 0.406 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.3 | -47.6 | 172.9 | 170.9 | 0 | 0 | 0 | 0 | 110.1 | V373 E374 E375 I379 R380 E381 | V373-V377 WeakPolarHBondContact O-CG2 3.29Å; V373-V377 PolarHBondContact O-N 3.19Å; E374-V377 PolarHBondContact O-N 3.45Å; E375-V377 VanDerWaalsContact C-N 3.35Å; E375-V377 PolarHBondContact O-N 2.86Å; V377-I379 PolarHBondContact O-N 3.32Å; V377-R380 WeakPolarHBondContact O-CB 3.46Å; V377-R380 PolarHBondContact O-N 3.49Å; V377-R380 VanDerWaalsContact O-N 3.14Å; V377-E381 HydrophobicContact CG1-CG 4.27Å; V377-E381 WeakPolarHBondContact O-CB 3.33Å; V377-E381 WeakPolarHBondContact O-CG 3.33Å; V377-E381 PolarHBondContact O-N 3.3Å |
| 378 | Q | 78.9 | Confident | 78.7 | Confident | 112 Ų | 112 | 109.9 Ų | 109.9 | 52% | 0.523 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -57.6 | -48.7 | 176.4 | -72.6 | 174.2 | 12.9 | 0 | 0 | 111.8 | E374 E375 R380 E381 E382 | E374-Q378 WeakPolarHBondContact O-CG 3.36Å; E374-Q378 PolarHBondContact O-N 3.3Å; E375-Q378 PolarHBondContact O-N 3.14Å; Q378-R380 VanDerWaalsContact C-N 3.29Å; Q378-R380 PolarHBondContact O-N 2.92Å; Q378-E381 PolarHBondContact O-N 2.85Å; Q378-E382 WeakPolarHBondContact O-CB 3.39Å; Q378-E382 WeakPolarHBondContact O-CG 3.46Å; Q378-E382 PolarHBondContact O-N 2.86Å |
| 379 | I | 76.3 | Confident | 78.1 | Confident | 78 Ų | 78 | 109.1 Ų | 109.1 | 40% | 0.4 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61 | -39.4 | 176.9 | -68.9 | 166.5 | 0 | 0 | 0 | 111.2 | E375 V377 R383 | E375-I379 VanDerWaalsContact O-CG1 3.29Å; E375-I379 WeakPolarHBondContact O-CG1 3.5Å; E375-I379 PolarHBondContact O-N 3.28Å; V377-I379 PolarHBondContact O-N 3.32Å; I379-R383 HydrophobicContact CG2-CG 4.49Å; I379-R383 WeakPolarHBondContact O-CB 3.47Å; I379-R383 VanDerWaalsContact O-CG 3.23Å; I379-R383 WeakPolarHBondContact O-CG 3.4Å; I379-R383 PolarHBondContact O-N 2.8Å |
| 380 | R | 77.4 | Confident | 77.2 | Confident | 163 Ų | 163 | 111.9 Ų | 111.9 | 62% | 0.615 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -67.3 | -44.8 | 178.7 | -172.6 | -179.2 | 176.3 | -175.6 | -0.9 | 111.2 | F376 V377 Q378 R383 E384 | F376-R380 VanDerWaalsContact O-CB 3.29Å; F376-R380 WeakPolarHBondContact O-CB 3.26Å; F376-R380 PolarHBondContact O-N 3.19Å; V377-R380 WeakPolarHBondContact O-CB 3.46Å; V377-R380 PolarHBondContact O-N 3.49Å; V377-R380 VanDerWaalsContact O-N 3.14Å; Q378-R380 VanDerWaalsContact C-N 3.29Å; Q378-R380 PolarHBondContact O-N 2.92Å; R380-R383 PolarHBondContact O-N 3.31Å; R380-E384 PolarHBondContact O-N 3.45Å |
| 381 | E | 75.4 | Confident | 76.3 | Confident | 114 Ų | 114 | 110.1 Ų | 110.1 | 53% | 0.533 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 175.6 | -72.7 | 178 | 173.5 | 0 | 0 | 111.4 | V377 Q378 R383 E384 I385 | V377-E381 HydrophobicContact CG1-CG 4.27Å; V377-E381 WeakPolarHBondContact O-CB 3.33Å; V377-E381 WeakPolarHBondContact O-CG 3.33Å; V377-E381 PolarHBondContact O-N 3.3Å; Q378-E381 PolarHBondContact O-N 2.85Å; E381-R383 PolarHBondContact O-N 3.29Å; E381-E384 PolarHBondContact O-N 2.9Å; E381-I385 VanDerWaalsContact O-CG1 3.26Å; E381-I385 WeakPolarHBondContact O-CG1 3.36Å; E381-I385 PolarHBondContact O-N 3.34Å |
| 382 | E | 72.5 | Confident | 75.5 | Confident | 123 Ų | 123 | 112.1 Ų | 112.1 | 58% | 0.575 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -58.1 | -46 | 172.8 | -77.8 | -175 | 165.2 | 0 | 0 | 111.3 | Q378 E384 I385 T386 | Q378-E382 WeakPolarHBondContact O-CB 3.39Å; Q378-E382 WeakPolarHBondContact O-CG 3.46Å; Q378-E382 PolarHBondContact O-N 2.86Å; E382-E384 VanDerWaalsContact C-N 3.35Å; E382-E384 PolarHBondContact O-N 2.86Å; E382-I385 PolarHBondContact O-N 2.91Å; E382-T386 WeakPolarHBondContact O-CB 3.33Å; E382-T386 PolarHBondContact O-N 3.48Å; E382-T386 PolarHBondContact O-OG1 3.33Å |
| 383 | R | 71.8 | Confident | 75 | Confident | 184 Ų | 184 | 109.4 Ų | 109.4 | 69% | 0.694 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.4 | -41 | 175.6 | -77.3 | 177.2 | -177.4 | -166.6 | 3.5 | 112.1 | I379 R380 E381 T386 S387 | I379-R383 HydrophobicContact CG2-CG 4.49Å; I379-R383 WeakPolarHBondContact O-CB 3.47Å; I379-R383 VanDerWaalsContact O-CG 3.23Å; I379-R383 WeakPolarHBondContact O-CG 3.4Å; I379-R383 PolarHBondContact O-N 2.8Å; R380-R383 PolarHBondContact O-N 3.31Å; E381-R383 PolarHBondContact O-N 3.29Å; R383-T386 PolarHBondContact O-N 2.83Å; R383-S387 WeakPolarHBondContact O-CB 3.23Å; R383-S387 PolarHBondContact O-N 3.46Å |
| 384 | E | 74.3 | Confident | 74.2 | Confident | 99 Ų | 99 | 112.1 Ų | 112.1 | 46% | 0.463 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.9 | -43.5 | 175.1 | -77.4 | -148.3 | -177.7 | 0 | 0 | 112.4 | R380 E381 E382 T386 S387 K388 | R380-E384 PolarHBondContact O-N 3.45Å; E381-E384 PolarHBondContact O-N 2.9Å; E382-E384 VanDerWaalsContact C-N 3.35Å; E382-E384 PolarHBondContact O-N 2.86Å; E384-T386 VanDerWaalsContact C-N 3.35Å; E384-S387 PolarHBondContact O-N 2.9Å; E384-K388 WeakPolarHBondContact O-CB 3.36Å; E384-K388 WeakPolarHBondContact O-CG 3.4Å; E384-K388 PolarHBondContact O-N 3Å; E384-K388 IonicContact OE2-NZ 3.59Å |
| 385 | I | 76.1 | Confident | 73.5 | Confident | 86 Ų | 86 | 111.6 Ų | 111.6 | 44% | 0.441 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.1 | -43.2 | 176.4 | -67.9 | 163.9 | 0 | 0 | 0 | 110.3 | E381 E382 S387 K388 K389 | E381-I385 VanDerWaalsContact O-CG1 3.26Å; E381-I385 WeakPolarHBondContact O-CG1 3.36Å; E381-I385 PolarHBondContact O-N 3.34Å; E382-I385 PolarHBondContact O-N 2.91Å; I385-S387 VanDerWaalsContact C-N 3.33Å; I385-S387 PolarHBondContact O-N 3.44Å; I385-K388 PolarHBondContact O-N 3.41Å; I385-K389 HydrophobicContact CG2-CD 4.19Å; I385-K389 WeakPolarHBondContact O-CB 3.37Å; I385-K389 WeakPolarHBondContact O-CG 3.27Å; I385-K389 PolarHBondContact O-N 3.04Å |
| 386 | T | 69.4 | Low | 72.8 | Confident | 68 Ų | 68 | 112.4 Ų | 112.4 | 42% | 0.417 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.9 | -37.1 | 178.9 | -37.2 | 0 | 0 | 0 | 0 | 111.2 | E382 R383 E384 R390 | E382-T386 WeakPolarHBondContact O-CB 3.33Å; E382-T386 PolarHBondContact O-N 3.48Å; E382-T386 PolarHBondContact O-OG1 3.33Å; R383-T386 PolarHBondContact O-N 2.83Å; E384-T386 VanDerWaalsContact C-N 3.35Å; T386-R390 WeakPolarHBondContact O-CG 3.39Å; T386-R390 PolarHBondContact O-N 3.2Å |
| 387 | S | 68.7 | Low | 72.2 | Confident | 69 Ų | 69 | 111.3 Ų | 111.3 | 48% | 0.483 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.2 | -43 | 173.6 | -169.1 | 0 | 0 | 0 | 0 | 111.9 | R383 E384 I385 R390 M391 | R383-S387 WeakPolarHBondContact O-CB 3.23Å; R383-S387 PolarHBondContact O-N 3.46Å; E384-S387 PolarHBondContact O-N 2.9Å; I385-S387 VanDerWaalsContact C-N 3.33Å; I385-S387 PolarHBondContact O-N 3.44Å; S387-R390 PolarHBondContact O-N 3.42Å; S387-M391 VanDerWaalsContact O-CG 3.27Å; S387-M391 WeakPolarHBondContact O-CG 3.44Å; S387-M391 PolarHBondContact O-N 2.94Å |
| 388 | K | 72.5 | Confident | 71.7 | Confident | 120 Ų | 120 | 112.2 Ų | 112.2 | 52% | 0.522 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.9 | -47.1 | 174.7 | -78 | 171.6 | 179.3 | 165.1 | 0 | 111.4 | E384 I385 R390 M391 E392 | E384-K388 WeakPolarHBondContact O-CB 3.36Å; E384-K388 WeakPolarHBondContact O-CG 3.4Å; E384-K388 PolarHBondContact O-N 3Å; E384-K388 IonicContact OE2-NZ 3.59Å; I385-K388 PolarHBondContact O-N 3.41Å; K388-R390 VanDerWaalsContact C-N 3.34Å; K388-R390 PolarHBondContact O-N 3.05Å; K388-M391 PolarHBondContact O-N 3.41Å; K388-E392 WeakPolarHBondContact O-CG 3.33Å; K388-E392 PolarHBondContact O-N 3.46Å |
| 389 | K | 73.3 | Confident | 71.3 | Confident | 136 Ų | 136 | 114.9 Ų | 114.9 | 59% | 0.591 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60.5 | -38.9 | 175.5 | -74.1 | 178.8 | 178.5 | 178.7 | 0 | 113 | I385 A393 | I385-K389 HydrophobicContact CG2-CD 4.19Å; I385-K389 WeakPolarHBondContact O-CB 3.37Å; I385-K389 WeakPolarHBondContact O-CG 3.27Å; I385-K389 PolarHBondContact O-N 3.04Å; K389-A393 WeakPolarHBondContact O-CB 3.47Å; K389-A393 PolarHBondContact O-N 3.47Å |
| 390 | R | 68.9 | Low | 70.9 | Confident | 178 Ų | 178 | 117.5 Ų | 117.5 | 67% | 0.672 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.1 | -44.8 | 174 | -79.5 | -178.3 | -174 | 160.3 | 3.1 | 111.9 | T386 S387 K388 A393 E394 | T386-R390 WeakPolarHBondContact O-CG 3.39Å; T386-R390 PolarHBondContact O-N 3.2Å; S387-R390 PolarHBondContact O-N 3.42Å; K388-R390 VanDerWaalsContact C-N 3.34Å; K388-R390 PolarHBondContact O-N 3.05Å; R390-A393 PolarHBondContact O-N 3.18Å; R390-E394 WeakPolarHBondContact O-CG 3.36Å; R390-E394 PolarHBondContact O-N 3.39Å |
| 391 | M | 67.7 | Low | 70.5 | Confident | 101 Ų | 101 | 113.8 Ų | 113.8 | 50% | 0.498 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.6 | -40.5 | 177.5 | -70.4 | -78.8 | -73.9 | 0 | 0 | 112.1 | S387 K388 E394 Q395 | S387-M391 VanDerWaalsContact O-CG 3.27Å; S387-M391 WeakPolarHBondContact O-CG 3.44Å; S387-M391 PolarHBondContact O-N 2.94Å; K388-M391 PolarHBondContact O-N 3.41Å; M391-E394 PolarHBondContact O-N 3.01Å; M391-Q395 WeakPolarHBondContact O-CG 3.47Å; M391-Q395 PolarHBondContact O-N 2.99Å |
| 392 | E | 70.3 | Confident | 70 | Confident | 116 Ų | 116 | 117 Ų | 117 | 54% | 0.542 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.8 | -44.9 | 175.8 | -73.8 | 169.9 | 177.1 | 0 | 0 | 111.8 | K388 E394 Q395 E396 | K388-E392 WeakPolarHBondContact O-CG 3.33Å; K388-E392 PolarHBondContact O-N 3.46Å; E392-E394 PolarHBondContact O-N 2.89Å; E392-Q395 PolarHBondContact O-N 2.89Å; E392-E396 PolarHBondContact O-N 2.6Å |
| 393 | A | 71.4 | Confident | 69.8 | Low | 51 Ų | 51 | 113.4 Ų | 113.4 | 42% | 0.421 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.9 | -37.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | K389 R390 E396 M397 | K389-A393 WeakPolarHBondContact O-CB 3.47Å; K389-A393 PolarHBondContact O-N 3.47Å; R390-A393 PolarHBondContact O-N 3.18Å; A393-E396 PolarHBondContact O-N 3.36Å; A393-M397 WeakPolarHBondContact O-CB 3.47Å; A393-M397 PolarHBondContact O-N 3.02Å |
| 394 | E | 66.6 | Low | 69.6 | Low | 126 Ų | 126 | 107 Ų | 107 | 59% | 0.589 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.6 | -41.9 | 172.8 | -79.8 | 179.9 | 178.8 | 0 | 0 | 111.7 | R390 M391 E392 M397 V398 | R390-E394 WeakPolarHBondContact O-CG 3.36Å; R390-E394 PolarHBondContact O-N 3.39Å; M391-E394 PolarHBondContact O-N 3.01Å; E392-E394 PolarHBondContact O-N 2.89Å; E394-M397 PolarHBondContact O-N 3Å; E394-V398 VanDerWaalsContact O-CG2 3.29Å; E394-V398 WeakPolarHBondContact O-CG2 3.43Å; E394-V398 PolarHBondContact O-N 3.44Å |
| 395 | Q | 68.8 | Low | 69.1 | Low | 106 Ų | 106 | 106.1 Ų | 106.1 | 50% | 0.495 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.9 | -39.6 | 175.9 | -72.2 | 178.8 | 16.5 | 0 | 0 | 112.4 | M391 E392 V398 R399 | M391-Q395 WeakPolarHBondContact O-CG 3.47Å; M391-Q395 PolarHBondContact O-N 2.99Å; E392-Q395 PolarHBondContact O-N 2.89Å; Q395-V398 PolarHBondContact O-N 3.32Å; Q395-R399 WeakPolarHBondContact O-CG 3.29Å; Q395-R399 PolarHBondContact O-N 2.83Å |
| 396 | E | 68.4 | Low | 68.5 | Low | 116 Ų | 116 | 108 Ų | 108 | 54% | 0.542 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.9 | -42.8 | 174.4 | -75.6 | -173.3 | 160.2 | 0 | 0 | 112.3 | E392 A393 V398 R399 M400 | E392-E396 PolarHBondContact O-N 2.6Å; A393-E396 PolarHBondContact O-N 3.36Å; E396-V398 VanDerWaalsContact C-N 3.32Å; E396-V398 PolarHBondContact O-N 2.97Å; E396-R399 WeakPolarHBondContact O-CB 3.47Å; E396-R399 PolarHBondContact O-N 3.41Å; E396-R399 VanDerWaalsContact O-N 3.13Å; E396-M400 WeakPolarHBondContact O-CG 3.41Å; E396-M400 PolarHBondContact O-N 3.31Å |
| 397 | M | 64.3 | Low | 68.2 | Low | 124 Ų | 124 | 110.6 Ų | 110.6 | 61% | 0.611 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -58.8 | -42.9 | 173.4 | -89.8 | -72.6 | -79.3 | 0 | 0 | 111.7 | A393 E394 R399 M400 V401 | A393-M397 WeakPolarHBondContact O-CB 3.47Å; A393-M397 PolarHBondContact O-N 3.02Å; E394-M397 PolarHBondContact O-N 3Å; M397-R399 VanDerWaalsContact C-N 3.33Å; M397-R399 PolarHBondContact O-N 2.89Å; M397-M400 PolarHBondContact O-N 3.33Å; M397-V401 WeakPolarHBondContact O-CB 3.28Å; M397-V401 VanDerWaalsContact O-CG2 3.28Å; M397-V401 WeakPolarHBondContact O-CG2 3.47Å; M397-V401 PolarHBondContact O-N 3.13Å |
| 398 | V | 71.8 | Confident | 67.8 | Low | 87 Ų | 87 | 113.2 Ų | 113.2 | 53% | 0.527 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.7 | -39.3 | 175.6 | 170.7 | 0 | 0 | 0 | 0 | 111.6 | E394 Q395 E396 R402 | E394-V398 VanDerWaalsContact O-CG2 3.29Å; E394-V398 WeakPolarHBondContact O-CG2 3.43Å; E394-V398 PolarHBondContact O-N 3.44Å; Q395-V398 PolarHBondContact O-N 3.32Å; E396-V398 VanDerWaalsContact C-N 3.32Å; E396-V398 PolarHBondContact O-N 2.97Å; V398-R402 WeakPolarHBondContact O-CB 3.44Å; V398-R402 PolarHBondContact O-N 2.91Å |
| 399 | R | 71.4 | Confident | 67.3 | Low | 167 Ų | 167 | 110.5 Ų | 110.5 | 63% | 0.63 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64.8 | -45.3 | 174.6 | -72.6 | 175.5 | -174.5 | 168.8 | 3.7 | 111.8 | Q395 E396 M397 R402 A403 | Q395-R399 WeakPolarHBondContact O-CG 3.29Å; Q395-R399 PolarHBondContact O-N 2.83Å; E396-R399 WeakPolarHBondContact O-CB 3.47Å; E396-R399 PolarHBondContact O-N 3.41Å; E396-R399 VanDerWaalsContact O-N 3.13Å; M397-R399 VanDerWaalsContact C-N 3.33Å; M397-R399 PolarHBondContact O-N 2.89Å; R399-R402 PolarHBondContact O-N 2.97Å; R399-A403 WeakPolarHBondContact O-CB 3.45Å; R399-A403 PolarHBondContact O-N 2.86Å |
| 400 | M | 67.8 | Low | 66.8 | Low | 134 Ų | 134 | 111.4 Ų | 111.4 | 66% | 0.66 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63.1 | -42.3 | 177.6 | -71.1 | -149.2 | -179.4 | 0 | 0 | 112 | E396 M397 A403 A404 | E396-M400 WeakPolarHBondContact O-CG 3.41Å; E396-M400 PolarHBondContact O-N 3.31Å; M397-M400 PolarHBondContact O-N 3.33Å; M400-A403 PolarHBondContact O-N 3.04Å; M400-A404 WeakPolarHBondContact O-CB 3.27Å; M400-A404 PolarHBondContact O-N 2.95Å |
| 401 | V | 68.7 | Low | 66.3 | Low | 84 Ų | 84 | 111 Ų | 111 | 51% | 0.509 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.4 | -42.5 | 175.9 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | M397 A404 T405 | M397-V401 WeakPolarHBondContact O-CB 3.28Å; M397-V401 VanDerWaalsContact O-CG2 3.28Å; M397-V401 WeakPolarHBondContact O-CG2 3.47Å; M397-V401 PolarHBondContact O-N 3.13Å; V401-A404 PolarHBondContact O-N 3.4Å; V401-T405 WeakPolarHBondContact O-CB 3.41Å; V401-T405 PolarHBondContact O-N 3.49Å; V401-T405 PolarHBondContact O-OG1 3.34Å |
| 402 | R | 65.7 | Low | 65.9 | Low | 183 Ų | 183 | 112.9 Ų | 112.9 | 69% | 0.691 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -61.2 | -44.2 | 174.4 | -91.4 | -179.2 | 171.3 | -179.7 | -1.3 | 112.4 | V398 R399 T405 L406 | V398-R402 WeakPolarHBondContact O-CB 3.44Å; V398-R402 PolarHBondContact O-N 2.91Å; R399-R402 PolarHBondContact O-N 2.97Å; R402-T405 PolarHBondContact O-N 3.35Å; R402-L406 PolarHBondContact O-N 2.94Å |
| 403 | A | 68.1 | Low | 65.1 | Low | 47 Ų | 47 | 108 Ų | 108 | 39% | 0.388 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.6 | -44.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | R399 M400 T405 L406 I407 | R399-A403 WeakPolarHBondContact O-CB 3.45Å; R399-A403 PolarHBondContact O-N 2.86Å; M400-A403 PolarHBondContact O-N 3.04Å; A403-T405 VanDerWaalsContact C-N 3.32Å; A403-T405 PolarHBondContact O-N 3.36Å; A403-L406 PolarHBondContact O-N 2.63Å; A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.48Å; A403-I407 PolarHBondContact O-N 2.94Å |
| 404 | A | 67.1 | Low | 64.6 | Low | 48 Ų | 48 | 112.5 Ų | 112.5 | 40% | 0.397 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.3 | -39.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | M400 V401 Q408 | M400-A404 WeakPolarHBondContact O-CB 3.27Å; M400-A404 PolarHBondContact O-N 2.95Å; V401-A404 PolarHBondContact O-N 3.4Å; A404-Q408 WeakPolarHBondContact O-CB 3.39Å; A404-Q408 VanDerWaalsContact O-CG 3.29Å; A404-Q408 WeakPolarHBondContact O-CG 3.29Å; A404-Q408 PolarHBondContact O-N 3.41Å |
| 405 | T | 64 | Low | 64.1 | Low | 81 Ų | 81 | 111.7 Ų | 111.7 | 50% | 0.497 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -68.3 | -39.6 | 178.7 | -47.5 | 0 | 0 | 0 | 0 | 112 | V401 R402 A403 A409 | V401-T405 WeakPolarHBondContact O-CB 3.41Å; V401-T405 PolarHBondContact O-N 3.49Å; V401-T405 PolarHBondContact O-OG1 3.34Å; R402-T405 PolarHBondContact O-N 3.35Å; A403-T405 VanDerWaalsContact C-N 3.32Å; A403-T405 PolarHBondContact O-N 3.36Å; T405-A409 VanDerWaalsContact O-CB 3.27Å; T405-A409 WeakPolarHBondContact O-CB 3.35Å; T405-A409 PolarHBondContact O-N 3.41Å |
| 406 | L | 63.8 | Low | 63.4 | Low | 126 Ų | 126 | 112 Ų | 112 | 66% | 0.66 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.4 | -43.7 | 176.2 | -86.9 | 161.8 | 0 | 0 | 0 | 112.3 | R402 A403 A409 F410 | R402-L406 PolarHBondContact O-N 2.94Å; A403-L406 PolarHBondContact O-N 2.63Å; L406-A409 PolarHBondContact O-N 3.27Å; L406-F410 WeakPolarHBondContact O-CB 3.09Å; L406-F410 PolarHBondContact O-N 3.3Å |
| 407 | I | 63.1 | Low | 62.6 | Low | 122 Ų | 122 | 115.3 Ų | 115.3 | 63% | 0.626 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -65.2 | -43.8 | 177.9 | -66.7 | 166.7 | 0 | 0 | 0 | 110.6 | A403 A409 F410 W411 | A403-I407 VanDerWaalsContact O-CG1 3.29Å; A403-I407 WeakPolarHBondContact O-CG1 3.48Å; A403-I407 PolarHBondContact O-N 2.94Å; I407-A409 PolarHBondContact O-N 3.31Å; I407-F410 PolarHBondContact O-N 2.99Å; I407-W411 PolarHBondContact O-N 3.01Å; I407-W411 VanDerWaalsContact O-N 3.17Å |
| 408 | Q | 60.4 | Low | 61.6 | Low | 124 Ų | 124 | 113.7 Ų | 113.7 | 58% | 0.579 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65.3 | -37.1 | 176.2 | -74.3 | -176.5 | -10.7 | 0 | 0 | 112.7 | A404 K412 | A404-Q408 WeakPolarHBondContact O-CB 3.39Å; A404-Q408 VanDerWaalsContact O-CG 3.29Å; A404-Q408 WeakPolarHBondContact O-CG 3.29Å; A404-Q408 PolarHBondContact O-N 3.41Å; Q408-K412 WeakPolarHBondContact O-CB 3.45Å; Q408-K412 VanDerWaalsContact O-CG 3.27Å; Q408-K412 WeakPolarHBondContact O-CG 3.27Å; Q408-K412 PolarHBondContact O-N 3.44Å |
| 409 | A | 61.1 | Low | 60.8 | Low | 64 Ų | 64 | 116 Ų | 116 | 53% | 0.529 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -71.5 | -37.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | T405 L406 I407 G413 | T405-A409 VanDerWaalsContact O-CB 3.27Å; T405-A409 WeakPolarHBondContact O-CB 3.35Å; T405-A409 PolarHBondContact O-N 3.41Å; L406-A409 PolarHBondContact O-N 3.27Å; I407-A409 PolarHBondContact O-N 3.31Å; A409-G413 PolarHBondContact O-N 3.17Å |
| 410 | F | 62.6 | Low | 59.2 | Low | 155 Ų | 155 | 114.6 Ų | 114.6 | 68% | 0.68 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -70.1 | -42.8 | 179.9 | -159.8 | -98.3 | 0 | 0 | 0 | 112.2 | L406 I407 G413 Y414 | L406-F410 WeakPolarHBondContact O-CB 3.09Å; L406-F410 PolarHBondContact O-N 3.3Å; I407-F410 PolarHBondContact O-N 2.99Å; F410-G413 PolarHBondContact O-N 3.46Å; F410-Y414 PolarHBondContact O-N 2.96Å |
| 411 | W | 59.8 | Low | 58.1 | Low | 169 Ų | 169 | 120.4 Ų | 120.4 | 64% | 0.64 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -68.5 | -42.2 | 177.3 | -172.6 | -112.5 | 0 | 0 | 0 | 112.7 | I407 G413 Y414 L415 | I407-W411 PolarHBondContact O-N 3.01Å; I407-W411 VanDerWaalsContact O-N 3.17Å; W411-G413 VanDerWaalsContact C-N 3.26Å; W411-G413 PolarHBondContact O-N 3.05Å; W411-Y414 HydrophobicContact CZ3-CD1 4.39Å; W411-Y414 PolarHBondContact O-N 3.21Å; W411-L415 PolarHBondContact O-N 3.31Å |
| 412 | K | 59.5 | Low | 56.5 | Low | 141 Ų | 141 | 121.9 Ų | 121.9 | 61% | 0.613 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -63.6 | -31.5 | 173.4 | -71.9 | -178.4 | -176.9 | 179.7 | 0 | 112.1 | Q408 V416 | Q408-K412 WeakPolarHBondContact O-CB 3.45Å; Q408-K412 VanDerWaalsContact O-CG 3.27Å; Q408-K412 WeakPolarHBondContact O-CG 3.27Å; Q408-K412 PolarHBondContact O-N 3.44Å; K412-V416 WeakPolarHBondContact O-CB 3.38Å; K412-V416 WeakPolarHBondContact O-CG2 3.29Å |
| 413 | G | 53.3 | Low | 54.9 | Low | 13 Ų | 13 | 122.1 Ų | 122.1 | 13% | 0.134 | 62% | 0.615 | C | S | . | * | H | α-helix | trans | -76 | -34.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | A409 F410 W411 R417 | A409-G413 PolarHBondContact O-N 3.17Å; F410-G413 PolarHBondContact O-N 3.46Å; W411-G413 VanDerWaalsContact C-N 3.26Å; W411-G413 PolarHBondContact O-N 3.05Å; G413-R417 WeakPolarHBondContact O-CG 3.4Å; G413-R417 PolarHBondContact O-N 2.88Å; G413-R417 PolarHBondContact O-NE 3.36Å; G413-R417 PolarHBondContact O-NH2 3.37Å |
| 414 | Y | 60 | Low | 53.1 | Low | 145 Ų | 145 | 127.8 Ų | 127.8 | 57% | 0.569 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -70.4 | -43.3 | 177.1 | 179.5 | -104 | 0 | 0 | 0 | 112 | F410 W411 V416 R417 | F410-Y414 PolarHBondContact O-N 2.96Å; W411-Y414 HydrophobicContact CZ3-CD1 4.39Å; W411-Y414 PolarHBondContact O-N 3.21Å; Y414-V416 PolarHBondContact O-N 3.25Å; Y414-R417 PolarHBondContact O-N 3.18Å |
| 415 | L | 56.6 | Low | 51.2 | Low | 109 Ų | 109 | 133.3 Ų | 133.3 | 57% | 0.571 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -62.3 | -29.5 | 177 | -152.3 | 76.4 | 0 | 0 | 0 | 112.3 | W411 | W411-L415 PolarHBondContact O-N 3.31Å |
| 416 | V | 53.8 | Low | 49.4 | Very low | 113 Ų | 113 | 140.8 Ų | 140.8 | 69% | 0.685 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -85 | -21.9 | -177.9 | 170.1 | 0 | 0 | 0 | 0 | 113.6 | K412 Y414 | K412-V416 WeakPolarHBondContact O-CB 3.38Å; K412-V416 WeakPolarHBondContact O-CG2 3.29Å; Y414-V416 PolarHBondContact O-N 3.25Å |
| 417 | R | 51.6 | Low | 47.6 | Very low | 185 Ų | 185 | 138.3 Ų | 138.3 | 70% | 0.698 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -95.4 | -13.9 | -176.7 | -74.9 | -175.7 | -71.7 | -96 | 2.3 | 115.3 | G413 Y414 | G413-R417 WeakPolarHBondContact O-CG 3.4Å; G413-R417 PolarHBondContact O-N 2.88Å; G413-R417 PolarHBondContact O-NE 3.36Å; G413-R417 PolarHBondContact O-NH2 3.37Å; Y414-R417 PolarHBondContact O-N 3.18Å |
| 418 | S | 43.7 | Very low | 45.9 | Very low | 91 Ų | 91 | 143.1 Ų | 143.1 | 64% | 0.636 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -87.6 | -24.8 | -179.9 | 178.7 | 0 | 0 | 0 | 0 | 113.7 | ||
| 419 | L | 54.8 | Low | 44.4 | Very low | 134 Ų | 134 | 140.5 Ų | 140.5 | 70% | 0.702 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -110.3 | 53.7 | -168.4 | -100.8 | 150.1 | 0 | 0 | 0 | 113.5 | ||
| 420 | L | 38.6 | Very low | 42.8 | Very low | 139 Ų | 139 | 147.5 Ų | 147.5 | 73% | 0.728 | 71% | 0.711 | S | S | * | * | trans | 177 | 74.6 | 155.4 | -93.5 | 153.7 | 0 | 0 | 0 | 117.4 | ||||
| 421 | R | 43.4 | Very low | 41.1 | Very low | 256 Ų | 256 | 144.5 Ų | 144.5 | 97% | 0.966 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -142.1 | 37.3 | 142.7 | -131.2 | -168.8 | -157.1 | -102.6 | 4.6 | 114.3 | ||
| 422 | S | 36.2 | Very low | 39.6 | Very low | 114 Ų | 114 | 146.8 Ų | 146.8 | 80% | 0.797 | 73% | 0.729 | S | S | * | * | S | Bend | trans | 176.3 | 79.4 | 142.7 | 61.7 | 0 | 0 | 0 | 0 | 111.9 | ||
| 423 | K | 30.8 | Very low | 38.2 | Very low | 189 Ų | 189 | 143.4 Ų | 143.4 | 82% | 0.822 | 73% | 0.734 | S | S | * | * | trans | 169.1 | 133.6 | 140.5 | -102.8 | 178.6 | 177.2 | 171.4 | 0 | 111.1 | ||||
| 424 | K | 30.1 | Very low | 36.9 | Very low | 166 Ų | 166 | 152.6 Ų | 152.6 | 72% | 0.722 | 77% | 0.77 | S | S | * | * | trans | 67.9 | 121.1 | 150.6 | -100 | 175.3 | 173.4 | 171.3 | 0 | 121.5 | ||||
| 425 | K | 27.2 | Very low | 35.5 | Very low | 164 Ų | 164 | 154.4 Ų | 154.4 | 71% | 0.713 | 78% | 0.784 | S | S | * | * | trans | 79.5 | 114.3 | 132 | -84.2 | -179.8 | 176.4 | -172.4 | 0 | 121.1 | ||||
| 426 | R | 26.6 | Very low | 34.2 | Very low | 237 Ų | 237 | 159.3 Ų | 159.3 | 89% | 0.894 | 80% | 0.801 | S | S | * | * | 47.3 | 127.1 | 120.4 | -74.4 | 172.1 | 81.6 | 167.7 | 1 | 119.4 | |||||
| 427 | G | 27.1 | Very low | 33 | Very low | 74 Ų | 74 | 157.5 Ų | 157.5 | 76% | 0.763 | 81% | 0.805 | S | S | * | * | trans | 109.5 | 114.2 | 131.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 428 | K | 26.8 | Very low | 31.9 | Very low | 224 Ų | 224 | 158.6 Ų | 158.6 | 97% | 0.974 | 82% | 0.815 | S | S | * | * | 80.3 | 115.7 | 62.9 | -164.6 | -178.5 | -165.9 | -179.8 | 0 | 112.4 | |||||
| 429 | G | 28.6 | Very low | 31.2 | Very low | 69 Ų | 69 | 163.1 Ų | 163.1 | 71% | 0.711 | 83% | 0.826 | S | S | * | * | trans | 139.4 | 100.2 | 164.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 430 | K | 27.1 | Very low | 30 | Very low | 211 Ų | 211 | 166.7 Ų | 166.7 | 92% | 0.917 | 84% | 0.836 | S | S | * | * | 77.4 | 115.7 | 51.1 | -159.4 | -174.1 | -170.3 | -176.6 | 0 | 113 | |||||
| 431 | A | 28.2 | Very low | 29.6 | Very low | 92 Ų | 92 | 163.7 Ų | 163.7 | 76% | 0.76 | 84% | 0.838 | S | S | * | * | trans | 143.4 | 120.2 | 144.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 432 | K | 27.8 | Very low | 28.9 | Very low | 217 Ų | 217 | 161.4 Ų | 161.4 | 94% | 0.943 | 84% | 0.836 | S | S | * | * | cis | 79.6 | 116.2 | 43.3 | -155.1 | -174.6 | -167.3 | -174.8 | 0 | 112.9 | ||||
| 433 | G | 29.3 | Very low | 28.8 | Very low | 69 Ų | 69 | 163.3 Ų | 163.3 | 71% | 0.711 | 83% | 0.832 | S | S | * | * | trans | 147.1 | 104.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 434 | K | 27.9 | Very low | 28.8 | Very low | 206 Ų | 206 | 163 Ų | 163 | 90% | 0.896 | 83% | 0.831 | S | S | * | * | 65.4 | 103.5 | 50.4 | -142.8 | -170.9 | -167.6 | -171.2 | 0 | 110.8 | |||||
| 435 | E | 28.9 | Very low | 29.1 | Very low | 183 Ų | 183 | 158.4 Ų | 158.4 | 86% | 0.855 | 83% | 0.83 | S | S | * | * | 178 | 137.7 | 115 | -97.9 | 178.4 | 142.6 | 0 | 0 | 108 | |||||
| 436 | K | 29.6 | Very low | 29.5 | Very low | 212 Ų | 212 | 161 Ų | 161 | 92% | 0.922 | 84% | 0.841 | S | S | * | * | 65 | 114.7 | 55.9 | -102.7 | -166.9 | -178 | -176 | 0 | 115.9 | |||||
| 437 | G | 29.2 | Very low | 30.1 | Very low | 76 Ų | 76 | 153.1 Ų | 153.1 | 78% | 0.784 | 83% | 0.834 | S | S | * | * | trans | 153.1 | 119.3 | 163.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 438 | K | 27.9 | Very low | 30.8 | Very low | 208 Ų | 208 | 159.5 Ų | 159.5 | 90% | 0.904 | 84% | 0.841 | S | S | * | * | cis | 70.9 | 90.7 | 29.8 | -152 | -172.2 | -170.1 | -175.5 | 0 | 115.3 | ||||
| 439 | Q | 30.1 | Very low | 31.7 | Very low | 186 Ų | 186 | 162 Ų | 162 | 87% | 0.869 | 85% | 0.851 | S | S | * | * | trans | -179.7 | 134.3 | 140.5 | -111.7 | 170.6 | -30 | 0 | 0 | 108 | ||||
| 440 | K | 28.9 | Very low | 31.8 | Very low | 209 Ų | 209 | 166.7 Ų | 166.7 | 91% | 0.909 | 86% | 0.858 | S | S | * | * | cis | 62.9 | 110.3 | 44.5 | -107.6 | -168.4 | -176.5 | -175.9 | 0 | 114.6 | ||||
| 441 | G | 30.7 | Very low | 32.1 | Very low | 75 Ų | 75 | 164.3 Ų | 164.3 | 77% | 0.773 | 86% | 0.855 | S | S | * | * | trans | 153.1 | 99.4 | 166.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 442 | K | 28.7 | Very low | 32.3 | Very low | 209 Ų | 209 | 168.3 Ų | 168.3 | 91% | 0.909 | 86% | 0.861 | S | S | * | * | 53.6 | 105.1 | 73.2 | -108.6 | -169.4 | -178.4 | -177.2 | 0 | 114.2 | |||||
| 443 | E | 32.4 | Very low | 32.6 | Very low | 153 Ų | 153 | 165.5 Ų | 165.5 | 72% | 0.715 | 86% | 0.856 | S | S | * | * | 166.8 | 115.4 | 124.4 | -99 | -163.1 | 138.8 | 0 | 0 | 108.7 | |||||
| 444 | K | 32 | Very low | 32.8 | Very low | 184 Ų | 184 | 171.5 Ų | 171.5 | 80% | 0.8 | 87% | 0.865 | S | S | * | * | 87.2 | 138.4 | 86.3 | -90 | -170.2 | -165.3 | 155.1 | 0 | 113.3 | |||||
| 445 | G | 35.8 | Very low | 33.1 | Very low | 68 Ų | 68 | 169.2 Ų | 169.2 | 70% | 0.701 | 86% | 0.863 | S | S | * | * | trans | 101 | 94.1 | 145.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 446 | K | 35.6 | Very low | 33.4 | Very low | 219 Ų | 219 | 168.2 Ų | 168.2 | 95% | 0.952 | 86% | 0.863 | S | S | * | * | 56.2 | 128 | 76 | -81.6 | -169.9 | 170.3 | -178.2 | 0 | 114.7 | |||||
| 447 | G | 38.7 | Very low | 33.7 | Very low | 72 Ų | 72 | 164.8 Ų | 164.8 | 74% | 0.742 | 86% | 0.859 | S | S | * | * | trans | 96.6 | 136.6 | 151.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 448 | K | 43.2 | Very low | 34.1 | Very low | 208 Ų | 208 | 172.3 Ų | 172.3 | 90% | 0.904 | 87% | 0.865 | S | S | * | * | cis | -163.9 | 158 | 18.8 | -81.1 | 165.3 | 171.7 | 172.3 | 0 | 103.4 | ||||
| 449 | K | 45 | Very low | 34.6 | Very low | 276 Ų | 276 | 169 Ų | 169 | 100% | 1.2 | 86% | 0.861 | S | S | * | * | cis | -160.4 | 0 | 7 | -146.2 | -179.2 | -177.5 | -174.3 | 0 | 105.4 |
Retrieved 449 of 449 residues in 194.8 ms
(Link to these results)