| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 40.4 | Very low | 46.6 | Very low | 247 Ų | 247 | 188.8 Ų | 188.8 | 100% | 1.217 | 90% | 0.897 | S | S | * | * | 0 | 114.2 | 0 | -77.1 | 174 | -174.1 | 0 | 0 | 109.2 | |||||
| 2 | R | 42.2 | Very low | 46.9 | Very low | 248 Ų | 248 | 182.1 Ų | 182.1 | 94% | 0.936 | 87% | 0.868 | S | S | * | * | trans | -75.5 | 122.8 | 176.1 | -89.6 | 179.8 | 174.2 | 149.1 | -1.9 | 109.2 | M4 | R2-M4 PolarHBondContact O-N 3.31Š| ||
| 3 | R | 45.8 | Very low | 46.7 | Very low | 252 Ų | 252 | 174.8 Ų | 174.8 | 95% | 0.951 | 85% | 0.845 | S | S | * | * | trans | -76.3 | 114.8 | 169.9 | -73.3 | -170.4 | -106.7 | -157.6 | -2.9 | 108.5 | A5 | R3-A5 PolarHBondContact O-N 3.05Š| ||
| 4 | M | 40.3 | Very low | 47.4 | Very low | 175 Ų | 175 | 174.1 Ų | 174.1 | 86% | 0.862 | 84% | 0.836 | S | S | * | * | trans | -81.5 | 112.2 | 169.9 | -68.8 | -77.3 | -97.6 | 0 | 0 | 107.7 | R2 L6 | R2-M4 PolarHBondContact O-N 3.31Å; M4-L6 PolarHBondContact O-N 3.49Å | ||
| 5 | A | 51.8 | Low | 47.5 | Very low | 92 Ų | 92 | 172.9 Ų | 172.9 | 76% | 0.76 | 83% | 0.829 | S | S | * | * | trans | -72.9 | 119.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | R3 K7 | R3-A5 PolarHBondContact O-N 3.05Å; A5-K7 PolarHBondContact O-N 3.14Å; A5-K7 VanDerWaalsContact O-N 3.08Å | ||
| 6 | L | 47.7 | Very low | 47.1 | Very low | 173 Ų | 173 | 164.8 Ų | 164.8 | 91% | 0.906 | 81% | 0.805 | S | S | * | * | trans | -63.1 | 108.8 | 167.5 | -83.4 | 126.3 | 0 | 0 | 0 | 108.1 | M4 K8 | M4-L6 PolarHBondContact O-N 3.49Å; L6-K8 PolarHBondContact O-N 3.43Å | ||
| 7 | K | 56.7 | Low | 47.3 | Very low | 201 Ų | 201 | 164.6 Ų | 164.6 | 87% | 0.874 | 80% | 0.795 | S | S | * | * | trans | -60.3 | 129 | 169.3 | -67.4 | 178.9 | -179.4 | 178.6 | 0 | 107.3 | A5 L9 | A5-K7 PolarHBondContact O-N 3.14Å; A5-K7 VanDerWaalsContact O-N 3.08Å; K7-L9 PolarHBondContact O-N 3.43Å; K7-L9 VanDerWaalsContact O-N 3.13Å | ||
| 8 | K | 48.7 | Very low | 47.5 | Very low | 207 Ų | 207 | 163.8 Ų | 163.8 | 90% | 0.9 | 79% | 0.794 | S | S | * | * | trans | -50.8 | 118 | -178.9 | -63.8 | -175.1 | 177.1 | -174.5 | 0 | 109.5 | L6 K10 | L6-K8 PolarHBondContact O-N 3.43Å; K8-K10 PolarHBondContact O-N 2.99Å; K8-K10 VanDerWaalsContact O-N 3.12Å | ||
| 9 | L | 44.3 | Very low | 47.6 | Very low | 166 Ų | 166 | 162.1 Ų | 162.1 | 87% | 0.869 | 79% | 0.788 | S | S | * | * | trans | -65.1 | 110.2 | 168.5 | -160.4 | 75.3 | 0 | 0 | 0 | 106.1 | K7 V11 | K7-L9 PolarHBondContact O-N 3.43Å; K7-L9 VanDerWaalsContact O-N 3.13Å; L9-V11 PolarHBondContact O-N 3.31Å | ||
| 10 | K | 44.9 | Very low | 47.6 | Very low | 190 Ų | 190 | 161.5 Ų | 161.5 | 83% | 0.826 | 79% | 0.788 | S | S | * | * | trans | -68.1 | 104.2 | 177.1 | -161.4 | 166.3 | -178.2 | 175 | 0 | 106 | K8 I12 | K8-K10 PolarHBondContact O-N 2.99Å; K8-K10 VanDerWaalsContact O-N 3.12Å; K10-I12 PolarHBondContact O-N 3.1Å | ||
| 11 | V | 49.8 | Very low | 47.5 | Very low | 126 Ų | 126 | 158.4 Ų | 158.4 | 76% | 0.764 | 78% | 0.775 | S | S | * | * | trans | -58.4 | 111.3 | 172.2 | 175.3 | 0 | 0 | 0 | 0 | 106.4 | L9 | L9-V11 PolarHBondContact O-N 3.31Š| ||
| 12 | I | 51 | Low | 47.7 | Very low | 108 Ų | 108 | 153 Ų | 153 | 55% | 0.554 | 75% | 0.751 | S | S | * | * | trans | -77.2 | 123.2 | 172.2 | -58.5 | 174 | 0 | 0 | 0 | 105.8 | K10 Y17 | K10-I12 PolarHBondContact O-N 3.1Å; I12-Y17 HydrophobicContact CG2-CE2 4.06Å; I12-Y17 WeakPolarHBondContact CG2-OH 3.22Å | ||
| 13 | P | 44.4 | Very low | 48 | Very low | 88 Ų | 88 | 149.6 Ų | 149.6 | 57% | 0.571 | 74% | 0.743 | S | S | * | * | trans | -58.6 | 138 | 177.7 | -22.3 | 33 | 0 | 0 | 0 | 111.5 | E15 G16 | P13-E15 PolarHBondContact O-N 3.33Å; P13-G16 PolarHBondContact O-N 3.35Å | ||
| 14 | K | 55.9 | Low | 47.8 | Very low | 164 Ų | 164 | 144.2 Ų | 144.2 | 71% | 0.713 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -66.6 | -22.9 | -176.5 | -69 | -169.5 | 174.3 | -169.3 | 0 | 112.9 | G16 | K14-G16 PolarHBondContact O-N 2.93Š|
| 15 | E | 48.9 | Very low | 48.5 | Very low | 157 Ų | 157 | 143.2 Ų | 143.2 | 73% | 0.734 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -71.6 | -8.9 | -178.6 | -77.4 | 68.3 | -150.2 | 0 | 0 | 114.9 | P13 | P13-E15 PolarHBondContact O-N 3.33Š|
| 16 | G | 40.9 | Very low | 48.5 | Very low | 43 Ų | 43 | 146.1 Ų | 146.1 | 44% | 0.443 | 73% | 0.73 | S | S | . | * | G | 310 helix | trans | -90.2 | -11 | -175.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | P13 K14 L18 | P13-G16 PolarHBondContact O-N 3.35Å; K14-G16 PolarHBondContact O-N 2.93Å; G16-L18 VanDerWaalsContact C-N 3.33Å; G16-L18 PolarHBondContact O-N 3.23Å |
| 17 | Y | 50.8 | Low | 48.8 | Very low | 162 Ų | 162 | 144.1 Ų | 144.1 | 64% | 0.635 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.4 | -9.1 | -172 | -68.4 | -79.8 | 0 | 0 | 0 | 114.4 | I12 | I12-Y17 HydrophobicContact CG2-CE2 4.06Å; I12-Y17 WeakPolarHBondContact CG2-OH 3.22Å |
| 18 | L | 50.5 | Low | 48.3 | Very low | 149 Ų | 149 | 141.6 Ų | 141.6 | 78% | 0.78 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | -2.4 | -175.2 | -66.8 | 174.7 | 0 | 0 | 0 | 114.2 | G16 | G16-L18 VanDerWaalsContact C-N 3.33Å; G16-L18 PolarHBondContact O-N 3.23Å |
| 19 | L | 49.2 | Very low | 48.2 | Very low | 131 Ų | 131 | 138 Ų | 138 | 69% | 0.686 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -99.8 | 8.4 | -172.1 | -86.3 | 162.3 | 0 | 0 | 0 | 115 | ||
| 20 | L | 47.4 | Very low | 48.3 | Very low | 150 Ų | 150 | 137.3 Ų | 137.3 | 79% | 0.785 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -112.5 | 9.6 | -169.5 | -111.5 | 95.2 | 0 | 0 | 0 | 117 | ||
| 21 | L | 46.8 | Very low | 48.1 | Very low | 97 Ų | 97 | 137.1 Ų | 137.1 | 51% | 0.508 | 70% | 0.701 | S | S | . | * | trans | -136.2 | 24.5 | 175.2 | -68 | 172.1 | 0 | 0 | 0 | 113.9 | F23 | L21-F23 HydrophobicContact CD2-CD2 4.44Å; L21-F23 HydrophobicContact CD2-CE2 3.72Å; L21-F23 HydrophobicContact CD2-CZ 4.45Å; L21-F23 PolarHBondContact O-N 3.38Å; L21-F23 VanDerWaalsContact O-N 3.12Å | ||
| 22 | D | 44.6 | Very low | 47.5 | Very low | 135 Ų | 135 | 137 Ų | 137 | 72% | 0.722 | 70% | 0.7 | S | S | * | * | trans | -77.3 | 88 | 155 | -66 | -23 | 0 | 0 | 0 | 105.7 | D24 | D22-D24 PolarHBondContact O-N 3.12Å; D22-D24 VanDerWaalsContact O-N 3.13Å | ||
| 23 | F | 46.9 | Very low | 46.9 | Very low | 175 Ų | 175 | 137 Ų | 137 | 77% | 0.768 | 71% | 0.71 | S | S | * | * | trans | -68.3 | 106.3 | 162.4 | -79.3 | -83.1 | 0 | 0 | 0 | 106 | L21 D25 | L21-F23 HydrophobicContact CD2-CD2 4.44Å; L21-F23 HydrophobicContact CD2-CE2 3.72Å; L21-F23 HydrophobicContact CD2-CZ 4.45Å; L21-F23 PolarHBondContact O-N 3.38Å; L21-F23 VanDerWaalsContact O-N 3.12Å; F23-D25 PolarHBondContact O-N 3.43Å | ||
| 24 | D | 43.2 | Very low | 46.9 | Very low | 140 Ų | 140 | 141.9 Ų | 141.9 | 75% | 0.749 | 73% | 0.725 | S | S | * | * | trans | -5.9 | 105.8 | 169.3 | -69.2 | -37.6 | 0 | 0 | 0 | 114.8 | D22 E26 | D22-D24 PolarHBondContact O-N 3.12Å; D22-D24 VanDerWaalsContact O-N 3.13Å; D24-E26 HydrophobicContact CB-CG 4.17Å; D24-E26 PolarHBondContact O-N 3.42Å | ||
| 25 | D | 54.4 | Low | 46 | Very low | 153 Ų | 153 | 142.9 Ų | 142.9 | 82% | 0.818 | 73% | 0.732 | S | S | * | * | trans | -67.9 | 72 | 150.8 | -75.4 | -31.8 | 0 | 0 | 0 | 107.3 | F23 | F23-D25 PolarHBondContact O-N 3.43Š| ||
| 26 | E | 50.7 | Low | 45.6 | Very low | 153 Ų | 153 | 139.3 Ų | 139.3 | 72% | 0.715 | 73% | 0.73 | S | S | * | * | trans | -94.8 | 93.9 | 160.7 | -72.7 | -69.5 | 170.4 | 0 | 0 | 106.8 | D24 D28 | D24-E26 HydrophobicContact CB-CG 4.17Å; D24-E26 PolarHBondContact O-N 3.42Å; E26-D28 PolarHBondContact O-N 2.64Å | ||
| 27 | D | 54.3 | Low | 45.3 | Very low | 131 Ų | 131 | 144.8 Ų | 144.8 | 70% | 0.701 | 75% | 0.748 | S | S | * | * | trans | -58.5 | 84.3 | 167.1 | -71.8 | -49 | 0 | 0 | 0 | 109.8 | D29 | D27-D29 PolarHBondContact O-N 3.47Š| ||
| 28 | D | 46.2 | Very low | 44.7 | Very low | 149 Ų | 149 | 142.3 Ų | 142.3 | 80% | 0.797 | 76% | 0.755 | S | S | * | * | trans | -74.7 | 78.9 | 158.2 | -85.7 | -26.9 | 0 | 0 | 0 | 108.2 | E26 I30 | E26-D28 PolarHBondContact O-N 2.64Å; D28-I30 VanDerWaalsContact C-N 3.32Å; D28-I30 PolarHBondContact O-N 3Å | ||
| 29 | D | 46.9 | Very low | 44.4 | Very low | 131 Ų | 131 | 144.4 Ų | 144.4 | 70% | 0.701 | 76% | 0.761 | S | S | * | * | trans | -52.5 | 95.1 | 162.9 | -85.2 | -30.8 | 0 | 0 | 0 | 109 | D27 K31 | D27-D29 PolarHBondContact O-N 3.47Å; D29-K31 PolarHBondContact O-N 3.36Å | ||
| 30 | I | 45.6 | Very low | 43.6 | Very low | 151 Ų | 151 | 145.3 Ų | 145.3 | 77% | 0.774 | 77% | 0.771 | S | S | * | * | trans | -68.6 | 86.5 | 163.6 | -56.2 | 178.7 | 0 | 0 | 0 | 106.6 | D28 V32 | D28-I30 VanDerWaalsContact C-N 3.32Å; D28-I30 PolarHBondContact O-N 3Å; I30-V32 HydrophobicContact CG2-CG2 3.98Å; I30-V32 PolarHBondContact O-N 3.36Å | ||
| 31 | K | 40.9 | Very low | 43.8 | Very low | 187 Ų | 187 | 147.3 Ų | 147.3 | 81% | 0.813 | 77% | 0.773 | S | S | * | * | trans | -62 | 87.2 | 164.2 | -82.2 | -176.9 | 179.1 | 175.1 | 0 | 108.9 | D29 S33 | D29-K31 PolarHBondContact O-N 3.36Å; K31-S33 PolarHBondContact O-N 2.99Å | ||
| 32 | V | 38.7 | Very low | 43.3 | Very low | 122 Ų | 122 | 147.8 Ų | 147.8 | 74% | 0.739 | 79% | 0.785 | S | S | * | * | trans | -74.5 | 102.3 | 155.7 | 177.2 | 0 | 0 | 0 | 0 | 106.1 | I30 E34 | I30-V32 HydrophobicContact CG2-CG2 3.98Å; I30-V32 PolarHBondContact O-N 3.36Å; V32-E34 PolarHBondContact O-N 3.21Å; V32-E34 VanDerWaalsContact O-N 3.1Å | ||
| 33 | S | 37.4 | Very low | 43 | Very low | 109 Ų | 109 | 147 Ų | 147 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -50.5 | 112.9 | 173.7 | 42.4 | 0 | 0 | 0 | 0 | 110.9 | K31 E35 | K31-S33 PolarHBondContact O-N 2.99Å; S33-E35 PolarHBondContact O-N 3.38Å | ||
| 34 | E | 45 | Very low | 42.6 | Very low | 191 Ų | 191 | 143 Ų | 143 | 89% | 0.893 | 79% | 0.787 | S | S | * | * | trans | -80.8 | 104 | 170.1 | -175.9 | 173.4 | -166.1 | 0 | 0 | 108.4 | V32 | V32-E34 PolarHBondContact O-N 3.21Å; V32-E34 VanDerWaalsContact O-N 3.1Å | ||
| 35 | E | 37.1 | Very low | 42.3 | Very low | 184 Ų | 184 | 146.2 Ų | 146.2 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -104.1 | 115.8 | 166.3 | -147.5 | 168.4 | -162.3 | 0 | 0 | 108.2 | S33 | S33-E35 PolarHBondContact O-N 3.38Š| ||
| 36 | A | 40.9 | Very low | 41.3 | Very low | 83 Ų | 83 | 146.3 Ų | 146.3 | 69% | 0.686 | 80% | 0.795 | S | S | * | * | trans | -62.7 | 153 | -175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 37 | L | 32.9 | Very low | 41.3 | Very low | 157 Ų | 157 | 149 Ų | 149 | 82% | 0.822 | 80% | 0.804 | S | S | * | * | -173.9 | 127.8 | 125 | -93 | 177.7 | 0 | 0 | 0 | 112.1 | |||||
| 38 | S | 38 | Very low | 40.3 | Very low | 110 Ų | 110 | 149.8 Ų | 149.8 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | 56.3 | 119.1 | 154.2 | 65 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 39 | E | 44.6 | Very low | 39.8 | Very low | 194 Ų | 194 | 151.7 Ų | 151.7 | 91% | 0.907 | 81% | 0.812 | S | S | * | * | trans | -36.4 | 126.8 | 155.8 | -77.3 | 169.2 | 128.6 | 0 | 0 | 115.5 | ||||
| 40 | V | 33.7 | Very low | 39.3 | Very low | 149 Ų | 149 | 152.3 Ų | 152.3 | 90% | 0.903 | 82% | 0.816 | S | S | * | * | trans | -136 | 135.4 | 135.7 | 169.4 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 41 | K | 50.7 | Low | 38.8 | Very low | 192 Ų | 192 | 153.2 Ų | 153.2 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -87.9 | 148.3 | -171.2 | -167.1 | 165.5 | -176.8 | 171 | 0 | 111.2 | ||||
| 42 | S | 35.9 | Very low | 38.6 | Very low | 108 Ų | 108 | 148.9 Ų | 148.9 | 76% | 0.755 | 81% | 0.814 | S | S | * | * | trans | 102.7 | 156.9 | 155.9 | -26.3 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 43 | P | 37.9 | Very low | 38.6 | Very low | 118 Ų | 118 | 149.4 Ų | 149.4 | 77% | 0.766 | 82% | 0.82 | S | S | * | * | cis | -115.8 | 163.1 | -19.5 | 33.5 | -16.9 | 0 | 0 | 0 | 113 | ||||
| 44 | A | 38.8 | Very low | 38.3 | Very low | 92 Ų | 92 | 153.4 Ų | 153.4 | 76% | 0.76 | 83% | 0.826 | S | S | * | * | trans | -64.1 | 139.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 45 | F | 37.2 | Very low | 38 | Very low | 207 Ų | 207 | 148.5 Ų | 148.5 | 91% | 0.908 | 82% | 0.818 | S | S | * | * | trans | -105 | 125.6 | 158.1 | -107.5 | -90.4 | 0 | 0 | 0 | 109 | ||||
| 46 | D | 33.1 | Very low | 37.8 | Very low | 155 Ų | 155 | 148.7 Ų | 148.7 | 83% | 0.829 | 82% | 0.819 | S | S | * | * | trans | -63.9 | 148.9 | -173.5 | -80.8 | -46 | 0 | 0 | 0 | 113.5 | ||||
| 47 | K | 50.7 | Low | 37.7 | Very low | 208 Ų | 208 | 148.5 Ų | 148.5 | 90% | 0.904 | 82% | 0.818 | S | S | * | * | trans | -80.4 | 133.6 | 173.7 | -61 | 171.2 | 179.3 | 173.9 | 0 | 109.8 | ||||
| 48 | N | 34.3 | Very low | 38.1 | Very low | 149 Ų | 149 | 148.6 Ų | 148.6 | 80% | 0.797 | 82% | 0.819 | S | S | * | * | trans | -146 | 112.7 | 143.6 | 58.7 | 16.4 | 0 | 0 | 0 | 108 | ||||
| 49 | E | 35.6 | Very low | 38.1 | Very low | 188 Ų | 188 | 151.9 Ų | 151.9 | 88% | 0.879 | 82% | 0.822 | S | S | * | * | 63.4 | 98.6 | 95.6 | -81 | -171.8 | 177.3 | 0 | 0 | 115.7 | |||||
| 50 | N | 36.4 | Very low | 38.4 | Very low | 144 Ų | 144 | 149.5 Ų | 149.5 | 77% | 0.77 | 82% | 0.816 | S | S | * | * | 62.7 | 95.6 | 127.7 | -163.4 | 11.2 | 0 | 0 | 0 | 119.1 | |||||
| 51 | I | 35.6 | Very low | 39 | Very low | 170 Ų | 170 | 150 Ų | 150 | 87% | 0.872 | 81% | 0.811 | S | S | * | * | trans | -142.8 | 122.3 | 146.6 | -52.4 | 179.7 | 0 | 0 | 0 | 109.2 | ||||
| 52 | S | 36.3 | Very low | 38.6 | Very low | 97 Ų | 97 | 144 Ų | 144 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | trans | -60.7 | 146.7 | 167.8 | -71.1 | 0 | 0 | 0 | 0 | 111.8 | Q54 | S52-Q54 PolarHBondContact O-N 3.04Š| ||
| 53 | P | 38.6 | Very low | 38.7 | Very low | 132 Ų | 132 | 145 Ų | 145 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | trans | -81.6 | 115.2 | 179.7 | 30.7 | -30 | 0 | 0 | 0 | 111.3 | ||||
| 54 | Q | 31.1 | Very low | 38.9 | Very low | 193 Ų | 193 | 146.3 Ų | 146.3 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | trans | -95.5 | 135.9 | 152.1 | -99.2 | -171.5 | -51.6 | 0 | 0 | 108.7 | S52 | S52-Q54 PolarHBondContact O-N 3.04Š| ||
| 55 | A | 39 | Very low | 39.2 | Very low | 88 Ų | 88 | 149.2 Ų | 149.2 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | -63 | 144.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 56 | E | 32.3 | Very low | 39.1 | Very low | 188 Ų | 188 | 145.1 Ų | 145.1 | 88% | 0.879 | 79% | 0.791 | S | S | * | * | trans | -172.1 | 156.6 | 130 | -83.2 | -46.6 | 147.6 | 0 | 0 | 107.7 | ||||
| 57 | A | 38.3 | Very low | 39.6 | Very low | 80 Ų | 80 | 142.2 Ų | 142.2 | 66% | 0.661 | 78% | 0.783 | S | S | * | * | trans | -74 | 159.6 | -170.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 58 | D | 41.3 | Very low | 39 | Very low | 158 Ų | 158 | 141.7 Ų | 141.7 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | 31.1 | 105.5 | 153.8 | -61.4 | -16.1 | 0 | 0 | 0 | 119.3 | ||||
| 59 | E | 38.2 | Very low | 39.4 | Very low | 179 Ų | 179 | 142.7 Ų | 142.7 | 84% | 0.836 | 79% | 0.79 | S | S | * | * | trans | -136 | 116.7 | 147.3 | -72.9 | -88.4 | 152 | 0 | 0 | 108.5 | M61 | E59-M61 PolarHBondContact O-N 2.94Š| ||
| 60 | D | 52 | Low | 39.6 | Very low | 145 Ų | 145 | 140.9 Ų | 140.9 | 78% | 0.775 | 79% | 0.787 | S | S | * | * | trans | -45.4 | 120.6 | 158.3 | 171.2 | 29 | 0 | 0 | 0 | 111.1 | G62 | D60-G62 PolarHBondContact OD1-N 3.26Š| ||
| 61 | M | 45.6 | Very low | 39.8 | Very low | 160 Ų | 160 | 143.2 Ų | 143.2 | 79% | 0.788 | 79% | 0.79 | S | S | * | * | trans | -138.1 | 72 | 164.7 | -62.8 | -64 | -85.5 | 0 | 0 | 107.9 | E59 D63 | E59-M61 PolarHBondContact O-N 2.94Å; M61-D63 PolarHBondContact O-N 2.99Å | ||
| 62 | G | 43 | Very low | 40 | Very low | 64 Ų | 64 | 140.3 Ų | 140.3 | 66% | 0.66 | 79% | 0.785 | S | S | * | * | trans | -60 | 120.2 | 145.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | D60 | D60-G62 PolarHBondContact OD1-N 3.26Š| ||
| 63 | D | 37.3 | Very low | 39.9 | Very low | 129 Ų | 129 | 143.2 Ų | 143.2 | 69% | 0.69 | 79% | 0.788 | S | S | * | * | trans | -149.4 | 131.9 | 154.7 | -127.1 | -5.2 | 0 | 0 | 0 | 112.9 | M61 | M61-D63 PolarHBondContact O-N 2.99Š| ||
| 64 | E | 41.4 | Very low | 39.8 | Very low | 146 Ų | 146 | 142.4 Ų | 142.4 | 68% | 0.682 | 78% | 0.78 | S | S | * | * | trans | 31 | 109.5 | 151.4 | -78.8 | 176.5 | 151.3 | 0 | 0 | 119.6 | ||||
| 65 | V | 45.2 | Very low | 40.2 | Very low | 153 Ų | 153 | 139.5 Ų | 139.5 | 93% | 0.927 | 77% | 0.77 | S | S | * | * | -112.1 | 93.8 | 129.3 | -71.3 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 66 | D | 35.4 | Very low | 40.1 | Very low | 122 Ų | 122 | 142 Ų | 142 | 65% | 0.652 | 77% | 0.772 | S | S | * | * | trans | -69 | 145.4 | 175 | -160.7 | 10.6 | 0 | 0 | 0 | 111.6 | ||||
| 67 | S | 44.6 | Very low | 40.5 | Very low | 93 Ų | 93 | 139 Ų | 139 | 65% | 0.65 | 77% | 0.768 | S | S | * | * | trans | 58.8 | 101 | 153.5 | 77.7 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 68 | M | 38.2 | Very low | 40.3 | Very low | 197 Ų | 197 | 140 Ų | 140 | 97% | 0.97 | 78% | 0.776 | S | S | * | * | trans | -163.9 | 59.2 | 130.6 | -112.9 | -176.9 | 168.5 | 0 | 0 | 110 | D70 | M68-D70 PolarHBondContact O-N 3.22Š| ||
| 69 | L | 41.2 | Very low | 40 | Very low | 171 Ų | 171 | 140.4 Ų | 140.4 | 90% | 0.895 | 78% | 0.777 | S | S | * | * | trans | -86.9 | 98 | 161.1 | -142.1 | 101.3 | 0 | 0 | 0 | 106.8 | K71 | L69-K71 PolarHBondContact O-N 3.1Š| ||
| 70 | D | 39.8 | Very low | 39.8 | Very low | 150 Ų | 150 | 135.3 Ų | 135.3 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | trans | -59.7 | 122.5 | 177.3 | -170.4 | 16.2 | 0 | 0 | 0 | 109.9 | M68 S72 | M68-D70 PolarHBondContact O-N 3.22Å; D70-S72 PolarHBondContact O-N 2.98Å | ||
| 71 | K | 42.3 | Very low | 39.4 | Very low | 192 Ų | 192 | 137.7 Ų | 137.7 | 84% | 0.835 | 78% | 0.776 | S | S | * | * | trans | -79.2 | 94.9 | 179.6 | -67.2 | 177 | -179.4 | 176.2 | 0 | 107.6 | L69 E73 | L69-K71 PolarHBondContact O-N 3.1Å; K71-E73 PolarHBondContact O-N 2.96Å; K71-E73 VanDerWaalsContact O-N 3.12Å | ||
| 72 | S | 39.5 | Very low | 38.9 | Very low | 109 Ų | 109 | 136.6 Ų | 136.6 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | trans | -76.3 | 97.4 | 160.1 | 46.6 | 0 | 0 | 0 | 0 | 108.9 | D70 V74 | D70-S72 PolarHBondContact O-N 2.98Å; S72-V74 PolarHBondContact O-N 2.95Å; S72-V74 VanDerWaalsContact O-N 3.13Å | ||
| 73 | E | 34.5 | Very low | 38.5 | Very low | 159 Ų | 159 | 141.1 Ų | 141.1 | 74% | 0.743 | 78% | 0.777 | S | S | * | * | trans | -52.2 | 110.3 | 163.8 | -88.7 | 178 | 153.9 | 0 | 0 | 109.9 | K71 N75 | K71-E73 PolarHBondContact O-N 2.96Å; K71-E73 VanDerWaalsContact O-N 3.12Å; E73-N75 VanDerWaalsContact C-N 3.33Å; E73-N75 PolarHBondContact O-N 3.17Å; E73-N75 VanDerWaalsContact O-N 3.07Å | ||
| 74 | V | 36.3 | Very low | 38.8 | Very low | 115 Ų | 115 | 142.1 Ų | 142.1 | 70% | 0.697 | 78% | 0.783 | S | S | * | * | trans | -76.1 | 88.9 | 165 | 177.6 | 0 | 0 | 0 | 0 | 107.7 | S72 N76 | S72-V74 PolarHBondContact O-N 2.95Å; S72-V74 VanDerWaalsContact O-N 3.13Å; V74-N76 PolarHBondContact O-N 3.39Å | ||
| 75 | N | 39.1 | Very low | 38.7 | Very low | 131 Ų | 131 | 142.4 Ų | 142.4 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -81.5 | 99.5 | 167.8 | -77.3 | -41.8 | 0 | 0 | 0 | 109.3 | E73 | E73-N75 VanDerWaalsContact C-N 3.33Å; E73-N75 PolarHBondContact O-N 3.17Å; E73-N75 VanDerWaalsContact O-N 3.07Å | ||
| 76 | N | 36.2 | Very low | 38.8 | Very low | 141 Ų | 141 | 140 Ų | 140 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 119.7 | 167.2 | -70.7 | -45.8 | 0 | 0 | 0 | 109.3 | V74 | V74-N76 PolarHBondContact O-N 3.39Š|
| 77 | P | 41.6 | Very low | 39.1 | Very low | 124 Ų | 124 | 139.7 Ų | 139.7 | 81% | 0.805 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 133.2 | 171.3 | 12.6 | 0.6 | 0 | 0 | 0 | 110.5 | ||
| 78 | A | 33.8 | Very low | 38.8 | Very low | 101 Ų | 101 | 143.9 Ų | 143.9 | 84% | 0.835 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 136.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | G80 | A78-G80 PolarHBondContact O-N 3.02Å; A78-G80 VanDerWaalsContact O-N 3.15Å |
| 79 | I | 35.2 | Very low | 39.3 | Very low | 168 Ų | 168 | 140.8 Ų | 140.8 | 86% | 0.862 | 78% | 0.783 | S | S | * | * | trans | -72.3 | 102.3 | 173.4 | -116.6 | 156.4 | 0 | 0 | 0 | 108.7 | ||||
| 80 | G | 34.6 | Very low | 39.8 | Very low | 72 Ų | 72 | 142.5 Ų | 142.5 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | trans | -90.7 | 122.6 | 161.4 | 0 | 0 | 0 | 0 | 0 | 108.3 | A78 | A78-G80 PolarHBondContact O-N 3.02Å; A78-G80 VanDerWaalsContact O-N 3.15Å | ||
| 81 | K | 42.3 | Very low | 40.3 | Very low | 195 Ų | 195 | 137.4 Ų | 137.4 | 85% | 0.848 | 77% | 0.766 | S | S | * | * | trans | -76.2 | 118.9 | 169.2 | -63.5 | -179.5 | 177.4 | 179.7 | 0 | 107.9 | ||||
| 82 | D | 34.9 | Very low | 40.8 | Very low | 136 Ų | 136 | 133.2 Ų | 133.2 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | -167.2 | 147.6 | 128.1 | -127.8 | -15.5 | 0 | 0 | 0 | 115 | |||||
| 83 | E | 35.8 | Very low | 41.6 | Very low | 159 Ų | 159 | 136.8 Ų | 136.8 | 74% | 0.743 | 76% | 0.761 | S | S | * | * | trans | 55.2 | 107.4 | 148.8 | -77.3 | 165.9 | -171 | 0 | 0 | 123.1 | I85 | E83-I85 PolarHBondContact O-N 3.39Š| ||
| 84 | N | 43.1 | Very low | 43 | Very low | 151 Ų | 151 | 135.1 Ų | 135.1 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | trans | -16.3 | 109.4 | 143 | -176.8 | -11.7 | 0 | 0 | 0 | 116.6 | ||||
| 85 | I | 38.1 | Very low | 44.6 | Very low | 152 Ų | 152 | 135.1 Ų | 135.1 | 78% | 0.779 | 75% | 0.751 | S | S | * | * | trans | -142.4 | 114.1 | 143 | -50.9 | -179.3 | 0 | 0 | 0 | 108.3 | E83 P87 | E83-I85 PolarHBondContact O-N 3.39Å; I85-P87 WeakPolarHBondContact O-CD 3.43Å | ||
| 86 | S | 47.3 | Very low | 46.4 | Very low | 102 Ų | 102 | 131.2 Ų | 131.2 | 71% | 0.713 | 74% | 0.742 | S | S | * | * | trans | -70.7 | 130.5 | 166.7 | 173.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 87 | P | 42.6 | Very low | 48.6 | Very low | 115 Ų | 115 | 131.6 Ų | 131.6 | 75% | 0.747 | 74% | 0.739 | S | S | * | * | trans | -109 | 131 | 156.9 | 7.6 | 14.5 | 0 | 0 | 0 | 111 | I85 | I85-P87 WeakPolarHBondContact O-CD 3.43Š| ||
| 88 | Q | 39.3 | Very low | 50.6 | Low | 181 Ų | 181 | 130.8 Ų | 130.8 | 85% | 0.846 | 72% | 0.724 | S | S | * | * | trans | -40.5 | 137.4 | 178.3 | -61.8 | 177.2 | 28.5 | 0 | 0 | 115.8 | K90 | Q88-K90 PolarHBondContact O-N 3.39Å; Q88-K90 VanDerWaalsContact O-N 3.13Å | ||
| 89 | V | 48.7 | Very low | 53.1 | Low | 132 Ų | 132 | 129.9 Ų | 129.9 | 80% | 0.8 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -64.8 | 101.2 | 166.5 | 172.8 | 0 | 0 | 0 | 0 | 110 | V92 | V89-V92 HydrophobicContact CG1-CG2 4.47Š|
| 90 | K | 50.2 | Low | 55.6 | Low | 208 Ų | 208 | 123.1 Ų | 123.1 | 90% | 0.904 | 68% | 0.68 | S | S | * | * | trans | -158.5 | 100.2 | 154 | -105.9 | -178.4 | -178.5 | -176 | 0 | 107.8 | Q88 | Q88-K90 PolarHBondContact O-N 3.39Å; Q88-K90 VanDerWaalsContact O-N 3.13Å | ||
| 91 | G | 51 | Low | 58.2 | Low | 43 Ų | 43 | 121.8 Ų | 121.8 | 44% | 0.443 | 66% | 0.659 | S | S | . | * | trans | 147.8 | 21.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | M95 | G91-M95 WeakPolarHBondContact O-CE 3.25Š| ||
| 92 | V | 52 | Low | 60.6 | Low | 103 Ų | 103 | 117.6 Ų | 117.6 | 62% | 0.624 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -78 | -25.9 | -176.7 | -172.3 | 0 | 0 | 0 | 0 | 112.2 | V89 | V89-V92 HydrophobicContact CG1-CG2 4.47Å |
| 93 | E | 56.9 | Low | 63.3 | Low | 185 Ų | 185 | 116.6 Ų | 116.6 | 86% | 0.864 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -76.8 | -30.1 | -178.2 | -67.9 | 176 | 172.3 | 0 | 0 | 113.3 | ||
| 94 | D | 63.6 | Low | 66.1 | Low | 123 Ų | 123 | 114.5 Ų | 114.5 | 66% | 0.658 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -76.8 | -41.8 | -176.4 | -165.7 | 27.8 | 0 | 0 | 0 | 112.3 | G96 H97 E98 | D94-G96 VanDerWaalsContact C-N 3.28Å; D94-G96 PolarHBondContact O-N 3.43Å; D94-H97 PolarHBondContact O-N 3.26Å; D94-E98 PolarHBondContact O-N 3.02Å |
| 95 | M | 69.8 | Low | 68.6 | Low | 116 Ų | 116 | 113.3 Ų | 113.3 | 57% | 0.571 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -63.7 | -31.9 | 175.5 | -71 | -172.8 | -80.7 | 0 | 0 | 112.8 | G91 E98 V99 | G91-M95 WeakPolarHBondContact O-CE 3.25Å; M95-E98 PolarHBondContact O-N 3.45Å; M95-V99 WeakPolarHBondContact O-CB 3.43Å; M95-V99 VanDerWaalsContact O-CG2 3.27Å; M95-V99 WeakPolarHBondContact O-CG2 3.39Å; M95-V99 PolarHBondContact O-N 2.98Å |
| 96 | G | 77.7 | Confident | 71.2 | Confident | 49 Ų | 49 | 109 Ų | 109 | 51% | 0.505 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -67.1 | -38 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | D94 G100 | D94-G96 VanDerWaalsContact C-N 3.28Å; D94-G96 PolarHBondContact O-N 3.43Å; G96-G100 PolarHBondContact O-N 2.78Å |
| 97 | H | 81.8 | Confident | 73.6 | Confident | 148 Ų | 148 | 105.9 Ų | 105.9 | 69% | 0.685 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -70.4 | -39.1 | 176.2 | -176.7 | -90.1 | 0 | 0 | 0 | 111.8 | D94 G100 S101 | D94-H97 PolarHBondContact O-N 3.26Å; H97-G100 PolarHBondContact O-N 3.5Å; H97-S101 PolarHBondContact O-N 3.27Å |
| 98 | E | 84.4 | Confident | 76.2 | Confident | 107 Ų | 107 | 105 Ų | 105 | 50% | 0.5 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.3 | -48.9 | 174.7 | -177.4 | 173.8 | -170 | 0 | 0 | 112.2 | D94 M95 G100 S101 M102 | D94-E98 PolarHBondContact O-N 3.02Å; M95-E98 PolarHBondContact O-N 3.45Å; E98-G100 VanDerWaalsContact C-N 3.32Å; E98-G100 PolarHBondContact O-N 3.01Å; E98-S101 PolarHBondContact O-N 3.31Å; E98-M102 HydrophobicContact CG-CE 3.66Å; E98-M102 HydrophobicContact CG-SD 4.42Å; E98-M102 WeakPolarHBondContact O-CG 3.37Å; E98-M102 PolarHBondContact O-N 2.99Å; E98-M102 VanDerWaalsContact OE1-CE 3.25Å; E98-M102 WeakPolarHBondContact OE1-CE 3.48Å |
| 99 | V | 85.5 | Confident | 78.9 | Confident | 82 Ų | 82 | 100.4 Ų | 100.4 | 50% | 0.497 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.1 | -40.7 | 176.8 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | M95 M102 L103 | M95-V99 WeakPolarHBondContact O-CB 3.43Å; M95-V99 VanDerWaalsContact O-CG2 3.27Å; M95-V99 WeakPolarHBondContact O-CG2 3.39Å; M95-V99 PolarHBondContact O-N 2.98Å; V99-M102 PolarHBondContact O-N 3.48Å; V99-L103 HydrophobicContact CG1-CD1 4.12Å; V99-L103 HydrophobicContact CG1-CG 4.48Å; V99-L103 WeakPolarHBondContact O-CG 3.37Å; V99-L103 PolarHBondContact O-N 3.34Å |
| 100 | G | 88.5 | Confident | 81.2 | Confident | 27 Ų | 27 | 98.7 Ų | 98.7 | 28% | 0.278 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58 | -48.3 | 173 | 0 | 0 | 0 | 0 | 0 | 112.5 | G96 H97 E98 M102 L103 D104 | G96-G100 PolarHBondContact O-N 2.78Å; H97-G100 PolarHBondContact O-N 3.5Å; E98-G100 VanDerWaalsContact C-N 3.32Å; E98-G100 PolarHBondContact O-N 3.01Å; G100-M102 VanDerWaalsContact C-N 3.32Å; G100-M102 PolarHBondContact O-N 3.45Å; G100-L103 PolarHBondContact O-N 3.24Å; G100-D104 PolarHBondContact O-N 2.97Å |
| 101 | S | 89.2 | Confident | 83.5 | Confident | 43 Ų | 43 | 95.8 Ų | 95.8 | 30% | 0.301 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.5 | -36.5 | 177.3 | -174.3 | 0 | 0 | 0 | 0 | 113.1 | H97 E98 K105 | H97-S101 PolarHBondContact O-N 3.27Å; E98-S101 PolarHBondContact O-N 3.31Å; S101-K105 VanDerWaalsContact O-CG 3.26Å; S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.48Å; S101-K105 VanDerWaalsContact O-N 3.12Å |
| 102 | M | 91.4 | Very high | 85.7 | Confident | 108 Ų | 108 | 98.7 Ų | 98.7 | 53% | 0.532 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.8 | -40.3 | 176 | -70.8 | 179.2 | -178.9 | 0 | 0 | 112 | E98 V99 G100 S106 | E98-M102 HydrophobicContact CG-CE 3.66Å; E98-M102 HydrophobicContact CG-SD 4.42Å; E98-M102 WeakPolarHBondContact O-CG 3.37Å; E98-M102 PolarHBondContact O-N 2.99Å; E98-M102 VanDerWaalsContact OE1-CE 3.25Å; E98-M102 WeakPolarHBondContact OE1-CE 3.48Å; V99-M102 PolarHBondContact O-N 3.48Å; G100-M102 VanDerWaalsContact C-N 3.32Å; G100-M102 PolarHBondContact O-N 3.45Å; M102-S106 WeakPolarHBondContact O-CB 3.35Å; M102-S106 PolarHBondContact O-N 3.44Å |
| 103 | L | 93.6 | Very high | 87.9 | Confident | 115 Ų | 115 | 98.1 Ų | 98.1 | 60% | 0.602 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.6 | -41.2 | 175.9 | -72.1 | 172.6 | 0 | 0 | 0 | 112 | V99 G100 S106 G107 | V99-L103 HydrophobicContact CG1-CD1 4.12Å; V99-L103 HydrophobicContact CG1-CG 4.48Å; V99-L103 WeakPolarHBondContact O-CG 3.37Å; V99-L103 PolarHBondContact O-N 3.34Å; G100-L103 PolarHBondContact O-N 3.24Å; L103-S106 WeakPolarHBondContact O-CB 3.47Å; L103-S106 PolarHBondContact O-N 3.02Å; L103-G107 PolarHBondContact O-N 3.07Å |
| 104 | D | 93.5 | Very high | 89.8 | Confident | 114 Ų | 114 | 93.9 Ų | 93.9 | 61% | 0.61 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.1 | -46 | 176 | -72.6 | -18.6 | 0 | 0 | 0 | 111.2 | G100 S106 G107 D108 | G100-D104 PolarHBondContact O-N 2.97Å; D104-S106 VanDerWaalsContact C-N 3.34Å; D104-S106 PolarHBondContact O-N 3Å; D104-G107 PolarHBondContact O-N 3.31Å; D104-D108 PolarHBondContact O-N 3.1Å |
| 105 | K | 94.7 | Very high | 91.5 | Very high | 126 Ų | 126 | 91.5 Ų | 91.5 | 55% | 0.548 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 174.7 | -71.5 | 169.5 | -172.7 | 172.3 | 0 | 112 | S101 G107 D108 D109 | S101-K105 VanDerWaalsContact O-CG 3.26Å; S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.48Å; S101-K105 VanDerWaalsContact O-N 3.12Å; K105-G107 VanDerWaalsContact C-N 3.35Å; K105-D108 PolarHBondContact O-N 3.18Å; K105-D109 PolarHBondContact O-N 2.92Å |
| 106 | S | 94.6 | Very high | 92.8 | Very high | 61 Ų | 61 | 91.6 Ų | 91.6 | 43% | 0.427 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.4 | -42.6 | 176 | -176.8 | 0 | 0 | 0 | 0 | 111.5 | M102 L103 D104 D109 I110 | M102-S106 WeakPolarHBondContact O-CB 3.35Å; M102-S106 PolarHBondContact O-N 3.44Å; L103-S106 WeakPolarHBondContact O-CB 3.47Å; L103-S106 PolarHBondContact O-N 3.02Å; D104-S106 VanDerWaalsContact C-N 3.34Å; D104-S106 PolarHBondContact O-N 3Å; S106-D109 PolarHBondContact O-N 3.45Å; S106-I110 WeakPolarHBondContact O-CB 3.4Å; S106-I110 WeakPolarHBondContact O-CD1 3.39Å; S106-I110 WeakPolarHBondContact O-CG1 3.5Å; S106-I110 PolarHBondContact O-N 2.93Å |
| 107 | G | 96.4 | Very high | 93.8 | Very high | 37 Ų | 37 | 94.8 Ų | 94.8 | 38% | 0.381 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.9 | -45.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L103 D104 K105 I110 Y111 | L103-G107 PolarHBondContact O-N 3.07Å; D104-G107 PolarHBondContact O-N 3.31Å; K105-G107 VanDerWaalsContact C-N 3.35Å; G107-I110 PolarHBondContact O-N 2.98Å; G107-Y111 WeakPolarHBondContact O-CB 3.41Å; G107-Y111 PolarHBondContact O-N 3.32Å |
| 108 | D | 96.5 | Very high | 94.6 | Very high | 96 Ų | 96 | 93.8 Ų | 93.8 | 51% | 0.513 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.6 | -43.5 | 176.1 | -84 | -8.9 | 0 | 0 | 0 | 112.3 | D104 K105 Y111 K112 | D104-D108 PolarHBondContact O-N 3.1Å; K105-D108 PolarHBondContact O-N 3.18Å; D108-Y111 PolarHBondContact O-N 3.41Å; D108-K112 VanDerWaalsContact O-CG 3.26Å; D108-K112 WeakPolarHBondContact O-CG 3.49Å; D108-K112 PolarHBondContact O-N 3.49Å |
| 109 | D | 96.6 | Very high | 95.2 | Very high | 85 Ų | 85 | 93.5 Ų | 93.5 | 46% | 0.455 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -71.2 | -36 | -179.1 | -70.4 | -16.1 | 0 | 0 | 0 | 111.9 | K105 S106 K112 T113 | K105-D109 PolarHBondContact O-N 2.92Å; S106-D109 PolarHBondContact O-N 3.45Å; D109-K112 IonicContact OD1-NZ 3.02Å; D109-K112 PolarHBondContact OD1-NZ 3.04Å; D109-T113 VanDerWaalsContact O-CB 3.3Å; D109-T113 WeakPolarHBondContact O-CB 3.47Å; D109-T113 PolarHBondContact O-N 2.91Å; D109-T113 PolarHBondContact O-OG1 3.45Å |
| 110 | I | 97 | Very high | 95.9 | Very high | 96 Ų | 96 | 97.4 Ų | 97.4 | 49% | 0.492 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.3 | -48.1 | 169.1 | -69.7 | 163.9 | 0 | 0 | 0 | 109.9 | S106 G107 T113 L114 | S106-I110 WeakPolarHBondContact O-CB 3.4Å; S106-I110 WeakPolarHBondContact O-CD1 3.39Å; S106-I110 WeakPolarHBondContact O-CG1 3.5Å; S106-I110 PolarHBondContact O-N 2.93Å; G107-I110 PolarHBondContact O-N 2.98Å; I110-T113 PolarHBondContact O-N 3.44Å; I110-L114 HydrophobicContact CG2-CD1 3.84Å; I110-L114 HydrophobicContact CG2-CG 4.33Å; I110-L114 WeakPolarHBondContact O-CB 3.39Å; I110-L114 WeakPolarHBondContact O-CG 3.49Å; I110-L114 PolarHBondContact O-N 3.36Å |
| 111 | Y | 97.9 | Very high | 96.3 | Very high | 147 Ų | 147 | 99.7 Ų | 99.7 | 58% | 0.576 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.8 | -47.6 | -179.9 | 176.2 | -97.2 | 0 | 0 | 0 | 111.9 | G107 D108 T113 L114 H115 | G107-Y111 WeakPolarHBondContact O-CB 3.41Å; G107-Y111 PolarHBondContact O-N 3.32Å; D108-Y111 PolarHBondContact O-N 3.41Å; Y111-T113 PolarHBondContact O-N 3.36Å; Y111-L114 PolarHBondContact O-N 3.47Å; Y111-H115 WeakPolarHBondContact O-CB 3.49Å; Y111-H115 PolarHBondContact O-N 2.87Å |
| 112 | K | 97.5 | Very high | 96.8 | Very high | 105 Ų | 105 | 102 Ų | 102 | 46% | 0.457 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.4 | -46.3 | 176.8 | -70 | 167.2 | -159.5 | 155.4 | 0 | 111.4 | D108 D109 L114 H115 I116 | D108-K112 VanDerWaalsContact O-CG 3.26Å; D108-K112 WeakPolarHBondContact O-CG 3.49Å; D108-K112 PolarHBondContact O-N 3.49Å; D109-K112 IonicContact OD1-NZ 3.02Å; D109-K112 PolarHBondContact OD1-NZ 3.04Å; K112-L114 PolarHBondContact O-N 3.49Å; K112-H115 PolarHBondContact O-N 3.21Å; K112-I116 WeakPolarHBondContact O-CG1 3.49Å; K112-I116 PolarHBondContact O-N 3.39Å |
| 113 | T | 98 | Very high | 97.1 | Very high | 90 Ų | 90 | 100.2 Ų | 100.2 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.7 | -46 | 179.8 | -58.5 | 0 | 0 | 0 | 0 | 111.3 | D109 I110 Y111 H115 I116 K117 | D109-T113 VanDerWaalsContact O-CB 3.3Å; D109-T113 WeakPolarHBondContact O-CB 3.47Å; D109-T113 PolarHBondContact O-N 2.91Å; D109-T113 PolarHBondContact O-OG1 3.45Å; I110-T113 PolarHBondContact O-N 3.44Å; Y111-T113 PolarHBondContact O-N 3.36Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 3.37Å; T113-I116 PolarHBondContact O-N 2.85Å; T113-K117 WeakPolarHBondContact O-CB 3.32Å; T113-K117 PolarHBondContact O-N 3.23Å |
| 114 | L | 98 | Very high | 97.3 | Very high | 97 Ų | 97 | 101 Ų | 101 | 51% | 0.508 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.9 | -38.9 | 175.9 | -72.3 | 176.2 | 0 | 0 | 0 | 112.3 | I110 Y111 K112 K117 R118 | I110-L114 HydrophobicContact CG2-CD1 3.84Å; I110-L114 HydrophobicContact CG2-CG 4.33Å; I110-L114 WeakPolarHBondContact O-CB 3.39Å; I110-L114 WeakPolarHBondContact O-CG 3.49Å; I110-L114 PolarHBondContact O-N 3.36Å; Y111-L114 PolarHBondContact O-N 3.47Å; K112-L114 PolarHBondContact O-N 3.49Å; L114-K117 PolarHBondContact O-N 3.41Å; L114-R118 WeakPolarHBondContact O-CB 3.45Å; L114-R118 PolarHBondContact O-N 3.04Å |
| 115 | H | 97.8 | Very high | 97.6 | Very high | 73 Ų | 73 | 100.1 Ų | 100.1 | 34% | 0.338 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.3 | -46.4 | 177.1 | -171.9 | 85 | 0 | 0 | 0 | 111.6 | Y111 K112 T113 R118 K119 | Y111-H115 WeakPolarHBondContact O-CB 3.49Å; Y111-H115 PolarHBondContact O-N 2.87Å; K112-H115 PolarHBondContact O-N 3.21Å; T113-H115 VanDerWaalsContact C-N 3.34Å; T113-H115 PolarHBondContact O-N 3.37Å; H115-R118 PolarHBondContact O-N 3.14Å; H115-K119 WeakPolarHBondContact O-CG 3.33Å; H115-K119 PolarHBondContact O-N 3.08Å |
| 116 | I | 98.2 | Very high | 97.7 | Very high | 117 Ų | 117 | 100.9 Ų | 100.9 | 60% | 0.6 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.1 | -47.9 | 176.1 | -67.9 | 165 | 0 | 0 | 0 | 110.4 | K112 T113 R118 K119 W120 | K112-I116 WeakPolarHBondContact O-CG1 3.49Å; K112-I116 PolarHBondContact O-N 3.39Å; T113-I116 PolarHBondContact O-N 2.85Å; I116-R118 VanDerWaalsContact C-N 3.32Å; I116-R118 PolarHBondContact O-N 3.49Å; I116-K119 PolarHBondContact O-N 3.41Å; I116-W120 WeakPolarHBondContact O-CB 3.48Å; I116-W120 PolarHBondContact O-N 3.47Å |
| 117 | K | 98.4 | Very high | 97.9 | Very high | 117 Ų | 117 | 103.9 Ų | 103.9 | 51% | 0.509 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 178.2 | -173.6 | 175.8 | -172.8 | -75.4 | 0 | 111.8 | T113 L114 W120 M121 | T113-K117 WeakPolarHBondContact O-CB 3.32Å; T113-K117 PolarHBondContact O-N 3.23Å; L114-K117 PolarHBondContact O-N 3.41Å; K117-W120 PolarHBondContact O-N 3.19Å; K117-M121 HydrophobicContact CG-CE 4.26Å; K117-M121 HydrophobicContact CG-SD 4.43Å; K117-M121 WeakPolarHBondContact O-CG 3.39Å; K117-M121 PolarHBondContact O-N 3.43Å |
| 118 | R | 98.3 | Very high | 98 | Very high | 126 Ų | 126 | 104.1 Ų | 104.1 | 48% | 0.475 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.6 | -50.6 | 175.3 | -177.4 | -174.5 | -62.6 | 133.1 | 2.6 | 111 | L114 H115 I116 W120 M121 E122 | L114-R118 WeakPolarHBondContact O-CB 3.45Å; L114-R118 PolarHBondContact O-N 3.04Å; H115-R118 PolarHBondContact O-N 3.14Å; I116-R118 VanDerWaalsContact C-N 3.32Å; I116-R118 PolarHBondContact O-N 3.49Å; R118-W120 VanDerWaalsContact C-N 3.31Å; R118-W120 PolarHBondContact O-N 2.88Å; R118-M121 PolarHBondContact O-N 3.27Å; R118-E122 WeakPolarHBondContact CD-OE1 3.47Å; R118-E122 HydrophobicContact CG-CG 4.37Å; R118-E122 WeakPolarHBondContact CG-OE1 3.46Å; R118-E122 WeakPolarHBondContact O-CG 3.31Å; R118-E122 PolarHBondContact O-N 2.97Å |
| 119 | K | 98.4 | Very high | 98.1 | Very high | 101 Ų | 101 | 106 Ų | 106 | 44% | 0.439 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.9 | -42.3 | 179.9 | -76 | -73.9 | 160.8 | -147.2 | 0 | 112.2 | H115 I116 E122 T123 | H115-K119 WeakPolarHBondContact O-CG 3.33Å; H115-K119 PolarHBondContact O-N 3.08Å; I116-K119 PolarHBondContact O-N 3.41Å; K119-E122 IonicContact NZ-OE2 2.79Å; K119-E122 PolarHBondContact NZ-OE2 3.5Å; K119-E122 PolarHBondContact O-N 2.97Å; K119-T123 PolarHBondContact O-N 3.13Å; K119-T123 PolarHBondContact O-OG1 3.3Å |
| 120 | W | 98.4 | Very high | 98.2 | Very high | 164 Ų | 164 | 109.2 Ų | 109.2 | 62% | 0.621 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.1 | -47.4 | 174.9 | 176.2 | 82.4 | 0 | 0 | 0 | 112.1 | I116 K117 R118 E122 T123 Y124 | I116-W120 WeakPolarHBondContact O-CB 3.48Å; I116-W120 PolarHBondContact O-N 3.47Å; K117-W120 PolarHBondContact O-N 3.19Å; R118-W120 VanDerWaalsContact C-N 3.31Å; R118-W120 PolarHBondContact O-N 2.88Å; W120-E122 PolarHBondContact O-N 3.17Å; W120-T123 PolarHBondContact O-N 2.96Å; W120-Y124 HydrophobicContact CZ2-CD2 4.48Å; W120-Y124 VanDerWaalsContact O-CB 3.31Å; W120-Y124 WeakPolarHBondContact O-CB 3.46Å; W120-Y124 PolarHBondContact O-N 3.4Å |
| 121 | M | 98.5 | Very high | 98.2 | Very high | 76 Ų | 76 | 108.2 Ų | 108.2 | 37% | 0.374 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.6 | -41.3 | 177.7 | -69.8 | -175.7 | -53.7 | 0 | 0 | 112.4 | K117 R118 T123 Y124 V125 | K117-M121 HydrophobicContact CG-CE 4.26Å; K117-M121 HydrophobicContact CG-SD 4.43Å; K117-M121 WeakPolarHBondContact O-CG 3.39Å; K117-M121 PolarHBondContact O-N 3.43Å; R118-M121 PolarHBondContact O-N 3.27Å; M121-T123 PolarHBondContact O-N 3.35Å; M121-Y124 PolarHBondContact O-N 3.38Å; M121-V125 WeakPolarHBondContact O-CB 3.49Å; M121-V125 WeakPolarHBondContact O-CG2 3.37Å; M121-V125 PolarHBondContact O-N 3.06Å |
| 122 | E | 98.3 | Very high | 98.2 | Very high | 91 Ų | 91 | 104.7 Ų | 104.7 | 43% | 0.425 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -57.5 | -48.8 | 176.1 | -76.4 | 171.2 | -173.9 | 0 | 0 | 111.1 | R118 K119 W120 K126 | R118-E122 WeakPolarHBondContact CD-OE1 3.47Å; R118-E122 HydrophobicContact CG-CG 4.37Å; R118-E122 WeakPolarHBondContact CG-OE1 3.46Å; R118-E122 WeakPolarHBondContact O-CG 3.31Å; R118-E122 PolarHBondContact O-N 2.97Å; K119-E122 IonicContact NZ-OE2 2.79Å; K119-E122 PolarHBondContact NZ-OE2 3.5Å; K119-E122 PolarHBondContact O-N 2.97Å; W120-E122 PolarHBondContact O-N 3.17Å; E122-K126 VanDerWaalsContact O-CB 3.3Å; E122-K126 WeakPolarHBondContact O-CB 3.44Å; E122-K126 PolarHBondContact O-N 3.12Å; E122-K126 VanDerWaalsContact O-N 3.07Å |
| 123 | T | 98.3 | Very high | 98.3 | Very high | 70 Ų | 70 | 103.1 Ų | 103.1 | 43% | 0.429 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.3 | -47.4 | 177.3 | -60.2 | 0 | 0 | 0 | 0 | 111.4 | K119 W120 M121 V125 K126 E127 | K119-T123 PolarHBondContact O-N 3.13Å; K119-T123 PolarHBondContact O-OG1 3.3Å; W120-T123 PolarHBondContact O-N 2.96Å; M121-T123 PolarHBondContact O-N 3.35Å; T123-V125 PolarHBondContact O-N 3.01Å; T123-K126 WeakPolarHBondContact O-CB 3.45Å; T123-K126 PolarHBondContact O-N 3.33Å; T123-E127 HydrophobicContact CG2-CG 4.28Å; T123-E127 WeakPolarHBondContact O-CG 3.34Å; T123-E127 PolarHBondContact O-N 3.29Å |
| 124 | Y | 98.4 | Very high | 98.3 | Very high | 132 Ų | 132 | 103.8 Ų | 103.8 | 52% | 0.518 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -58.4 | -46.8 | -179.3 | 175.6 | -97.7 | 0 | 0 | 0 | 112.3 | W120 M121 S128 | W120-Y124 HydrophobicContact CZ2-CD2 4.48Å; W120-Y124 VanDerWaalsContact O-CB 3.31Å; W120-Y124 WeakPolarHBondContact O-CB 3.46Å; W120-Y124 PolarHBondContact O-N 3.4Å; M121-Y124 PolarHBondContact O-N 3.38Å; Y124-S128 WeakPolarHBondContact O-CB 3.26Å; Y124-S128 PolarHBondContact O-N 2.98Å; Y124-S128 PolarHBondContact O-OG 2.91Å |
| 125 | V | 98.6 | Very high | 98.3 | Very high | 95 Ų | 95 | 106.3 Ų | 106.3 | 58% | 0.576 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.4 | -43.3 | 177.6 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | M121 T123 E127 S128 F129 | M121-V125 WeakPolarHBondContact O-CB 3.49Å; M121-V125 WeakPolarHBondContact O-CG2 3.37Å; M121-V125 PolarHBondContact O-N 3.06Å; T123-V125 PolarHBondContact O-N 3.01Å; V125-E127 PolarHBondContact O-N 3.43Å; V125-S128 PolarHBondContact O-N 3.14Å; V125-F129 WeakPolarHBondContact O-CB 3.47Å; V125-F129 PolarHBondContact O-N 3.33Å |
| 126 | K | 98.4 | Very high | 98.3 | Very high | 143 Ų | 143 | 107.7 Ų | 107.7 | 62% | 0.622 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.8 | -48.1 | 178.6 | -177.8 | 179.3 | -179.7 | 178.2 | 0 | 111.8 | E122 T123 K130 | E122-K126 VanDerWaalsContact O-CB 3.3Å; E122-K126 WeakPolarHBondContact O-CB 3.44Å; E122-K126 PolarHBondContact O-N 3.12Å; E122-K126 VanDerWaalsContact O-N 3.07Å; T123-K126 WeakPolarHBondContact O-CB 3.45Å; T123-K126 PolarHBondContact O-N 3.33Å; K126-K130 WeakPolarHBondContact O-CB 3.35Å; K126-K130 PolarHBondContact O-N 3.42Å |
| 127 | E | 98.3 | Very high | 98.3 | Very high | 123 Ų | 123 | 106.8 Ų | 106.8 | 58% | 0.575 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -68.3 | -40.6 | 180 | -70.7 | 179.7 | 169.5 | 0 | 0 | 112 | T123 V125 F129 K130 C131 | T123-E127 HydrophobicContact CG2-CG 4.28Å; T123-E127 WeakPolarHBondContact O-CG 3.34Å; T123-E127 PolarHBondContact O-N 3.29Å; V125-E127 PolarHBondContact O-N 3.43Å; E127-F129 PolarHBondContact O-N 3.02Å; E127-K130 PolarHBondContact O-N 3.26Å; E127-C131 WeakPolarHBondContact O-CB 3.35Å; E127-C131 PolarHBondContact O-N 2.96Å |
| 128 | S | 98.3 | Very high | 98.3 | Very high | 43 Ų | 43 | 108 Ų | 108 | 30% | 0.301 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 176.6 | -63.1 | 0 | 0 | 0 | 0 | 111.7 | Y124 V125 S132 | Y124-S128 WeakPolarHBondContact O-CB 3.26Å; Y124-S128 PolarHBondContact O-N 2.98Å; Y124-S128 PolarHBondContact O-OG 2.91Å; V125-S128 PolarHBondContact O-N 3.14Å; S128-S132 VanDerWaalsContact O-CB 3.31Å; S128-S132 WeakPolarHBondContact O-CB 3.28Å; S128-S132 PolarHBondContact O-N 3.46Å; S128-S132 PolarHBondContact O-OG 2.94Å |
| 129 | F | 98.3 | Very high | 98.3 | Very high | 134 Ų | 134 | 108.6 Ų | 108.6 | 59% | 0.588 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.6 | -42.4 | 177.4 | -165.6 | -105.4 | 0 | 0 | 0 | 111.6 | V125 E127 C131 S132 N133 | V125-F129 WeakPolarHBondContact O-CB 3.47Å; V125-F129 PolarHBondContact O-N 3.33Å; E127-F129 PolarHBondContact O-N 3.02Å; F129-C131 PolarHBondContact O-N 3.21Å; F129-S132 PolarHBondContact O-N 3.43Å; F129-N133 WeakPolarHBondContact CD1-ND2 3.44Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.46Å; F129-N133 WeakPolarHBondContact O-CB 3.46Å; F129-N133 PolarHBondContact O-N 2.9Å |
| 130 | K | 98.3 | Very high | 98.3 | Very high | 153 Ų | 153 | 106.8 Ų | 106.8 | 67% | 0.665 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -58.3 | -49 | 175.3 | -177.5 | 178.7 | 179 | 177.7 | 0 | 111.8 | K126 E127 N133 Q134 | K126-K130 WeakPolarHBondContact O-CB 3.35Å; K126-K130 PolarHBondContact O-N 3.42Å; E127-K130 PolarHBondContact O-N 3.26Å; K130-N133 PolarHBondContact O-N 3.07Å; K130-Q134 PolarHBondContact O-N 3.41Å |
| 131 | C | 98 | Very high | 98.3 | Very high | 76 Ų | 76 | 104.2 Ų | 104.2 | 51% | 0.514 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 179.1 | -175.9 | 0 | 0 | 0 | 0 | 111.7 | E127 F129 Q134 K135 | E127-C131 WeakPolarHBondContact O-CB 3.35Å; E127-C131 PolarHBondContact O-N 2.96Å; F129-C131 PolarHBondContact O-N 3.21Å; C131-Q134 PolarHBondContact O-N 3.11Å; C131-K135 PolarHBondContact O-N 3.18Å |
| 132 | S | 98.3 | Very high | 98.3 | Very high | 72 Ų | 72 | 103.3 Ų | 103.3 | 50% | 0.503 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 178.1 | -61.6 | 0 | 0 | 0 | 0 | 111.9 | S128 F129 Q134 K135 L136 | S128-S132 VanDerWaalsContact O-CB 3.31Å; S128-S132 WeakPolarHBondContact O-CB 3.28Å; S128-S132 PolarHBondContact O-N 3.46Å; S128-S132 PolarHBondContact O-OG 2.94Å; F129-S132 PolarHBondContact O-N 3.43Å; S132-Q134 PolarHBondContact O-N 3.03Å; S132-K135 WeakPolarHBondContact O-CB 3.14Å; S132-K135 PolarHBondContact O-N 3.06Å; S132-K135 VanDerWaalsContact O-N 3.16Å; S132-L136 PolarHBondContact O-N 3.47Å |
| 133 | N | 98.3 | Very high | 98.2 | Very high | 72 Ų | 72 | 102.3 Ų | 102.3 | 39% | 0.385 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 176.4 | -76.4 | -1 | 0 | 0 | 0 | 111.9 | F129 K130 K135 L136 E137 | F129-N133 WeakPolarHBondContact CD1-ND2 3.44Å; F129-N133 WeakPolarHBondContact CE1-ND2 3.46Å; F129-N133 WeakPolarHBondContact O-CB 3.46Å; F129-N133 PolarHBondContact O-N 2.9Å; K130-N133 PolarHBondContact O-N 3.07Å; N133-K135 VanDerWaalsContact C-N 3.27Å; N133-K135 PolarHBondContact O-N 2.88Å; N133-L136 PolarHBondContact O-N 3.26Å; N133-E137 WeakPolarHBondContact O-CB 3.29Å; N133-E137 PolarHBondContact O-N 3.39Å |
| 134 | Q | 98.3 | Very high | 98.2 | Very high | 105 Ų | 105 | 105 Ų | 105 | 49% | 0.491 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.1 | -32.9 | 176.4 | -168.4 | -176.1 | 11.5 | 0 | 0 | 112.3 | K130 C131 S132 R138 | K130-Q134 PolarHBondContact O-N 3.41Å; C131-Q134 PolarHBondContact O-N 3.11Å; S132-Q134 PolarHBondContact O-N 3.03Å; Q134-R138 WeakPolarHBondContact O-CB 3.44Å; Q134-R138 VanDerWaalsContact O-CG 3.31Å; Q134-R138 WeakPolarHBondContact O-CG 3.34Å; Q134-R138 PolarHBondContact O-N 3.24Å; Q134-R138 PolarHBondContact O-NE 3.4Å |
| 135 | K | 98.3 | Very high | 98.2 | Very high | 149 Ų | 149 | 106.7 Ų | 106.7 | 65% | 0.648 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.8 | -44.8 | 174 | -171.1 | 176.8 | 179.8 | -179 | 0 | 110.9 | C131 S132 N133 R138 F139 | C131-K135 PolarHBondContact O-N 3.18Å; S132-K135 WeakPolarHBondContact O-CB 3.14Å; S132-K135 PolarHBondContact O-N 3.06Å; S132-K135 VanDerWaalsContact O-N 3.16Å; N133-K135 VanDerWaalsContact C-N 3.27Å; N133-K135 PolarHBondContact O-N 2.88Å; K135-R138 PolarHBondContact O-N 2.97Å; K135-F139 PolarHBondContact O-N 3.49Å |
| 136 | L | 98.3 | Very high | 98.1 | Very high | 103 Ų | 103 | 107.5 Ų | 107.5 | 54% | 0.539 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.5 | -46.6 | 177 | -179.8 | 60.6 | 0 | 0 | 0 | 111.5 | S132 N133 R138 F139 C140 | S132-L136 PolarHBondContact O-N 3.47Å; N133-L136 PolarHBondContact O-N 3.26Å; L136-R138 PolarHBondContact O-N 3.48Å; L136-F139 WeakPolarHBondContact O-CB 3.35Å; L136-F139 PolarHBondContact O-N 3.3Å; L136-F139 VanDerWaalsContact O-N 3.15Å; L136-C140 PolarHBondContact O-N 2.92Å; L136-C140 PolarHBondContact O-SG 3.37Å; L136-C140 VanDerWaalsContact O-SG 3.34Å |
| 137 | E | 98.3 | Very high | 98.1 | Very high | 97 Ų | 97 | 109.1 Ų | 109.1 | 45% | 0.453 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.8 | -45.4 | 178.8 | -171.1 | -168.4 | 168.1 | 0 | 0 | 111.8 | N133 F139 C140 K141 | N133-E137 WeakPolarHBondContact O-CB 3.29Å; N133-E137 PolarHBondContact O-N 3.39Å; E137-F139 VanDerWaalsContact C-N 3.31Å; E137-F139 PolarHBondContact O-N 3.46Å; E137-C140 PolarHBondContact O-N 3.21Å; E137-K141 HydrophobicContact CG-CD 4.21Å; E137-K141 WeakPolarHBondContact O-CB 3.49Å; E137-K141 WeakPolarHBondContact O-CG 3.38Å; E137-K141 PolarHBondContact O-N 3.26Å; E137-K141 WeakPolarHBondContact OE1-CE 3.39Å; E137-K141 IonicContact OE1-NZ 2.63Å; E137-K141 PolarHBondContact OE1-NZ 3.38Å |
| 138 | R | 98.3 | Very high | 98.1 | Very high | 143 Ų | 143 | 109.8 Ų | 109.8 | 54% | 0.54 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.6 | -41.1 | 175.4 | -77.2 | -175.9 | -69.5 | 155.3 | -7.1 | 112.2 | Q134 K135 L136 T142 | Q134-R138 WeakPolarHBondContact O-CB 3.44Å; Q134-R138 VanDerWaalsContact O-CG 3.31Å; Q134-R138 WeakPolarHBondContact O-CG 3.34Å; Q134-R138 PolarHBondContact O-N 3.24Å; Q134-R138 PolarHBondContact O-NE 3.4Å; K135-R138 PolarHBondContact O-N 2.97Å; L136-R138 PolarHBondContact O-N 3.48Å; R138-T142 WeakPolarHBondContact O-CB 3.37Å; R138-T142 PolarHBondContact O-N 3.4Å; R138-T142 PolarHBondContact O-OG1 3.39Å |
| 139 | F | 97.9 | Very high | 98.1 | Very high | 138 Ų | 138 | 111.5 Ų | 111.5 | 61% | 0.605 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63 | -50.4 | 176.2 | 177.4 | -96.7 | 0 | 0 | 0 | 111.1 | K135 L136 E137 K141 T142 N143 | K135-F139 PolarHBondContact O-N 3.49Å; L136-F139 WeakPolarHBondContact O-CB 3.35Å; L136-F139 PolarHBondContact O-N 3.3Å; L136-F139 VanDerWaalsContact O-N 3.15Å; E137-F139 VanDerWaalsContact C-N 3.31Å; E137-F139 PolarHBondContact O-N 3.46Å; F139-K141 PolarHBondContact O-N 3.08Å; F139-T142 PolarHBondContact O-N 3.4Å; F139-N143 WeakPolarHBondContact O-CB 3.39Å; F139-N143 PolarHBondContact O-N 2.96Å |
| 140 | C | 97.7 | Very high | 98 | Very high | 64 Ų | 64 | 110.6 Ų | 110.6 | 43% | 0.432 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -56.9 | -49.8 | 178.1 | -68.9 | 0 | 0 | 0 | 0 | 111.9 | L136 E137 T142 N143 E144 | L136-C140 PolarHBondContact O-N 2.92Å; L136-C140 PolarHBondContact O-SG 3.37Å; L136-C140 VanDerWaalsContact O-SG 3.34Å; E137-C140 PolarHBondContact O-N 3.21Å; C140-T142 VanDerWaalsContact C-N 3.29Å; C140-T142 PolarHBondContact O-N 2.87Å; C140-N143 PolarHBondContact O-N 3.31Å; C140-E144 WeakPolarHBondContact O-CB 3.48Å; C140-E144 PolarHBondContact O-N 2.92Å |
| 141 | K | 98.1 | Very high | 98 | Very high | 109 Ų | 109 | 106.7 Ų | 106.7 | 47% | 0.474 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.8 | -36.5 | 178.1 | -74.8 | 178 | 171.5 | 174.2 | 0 | 112.9 | E137 F139 R145 | E137-K141 HydrophobicContact CG-CD 4.21Å; E137-K141 WeakPolarHBondContact O-CB 3.49Å; E137-K141 WeakPolarHBondContact O-CG 3.38Å; E137-K141 PolarHBondContact O-N 3.26Å; E137-K141 WeakPolarHBondContact OE1-CE 3.39Å; E137-K141 IonicContact OE1-NZ 2.63Å; E137-K141 PolarHBondContact OE1-NZ 3.38Å; F139-K141 PolarHBondContact O-N 3.08Å; K141-R145 WeakPolarHBondContact O-CB 3.45Å; K141-R145 PolarHBondContact O-N 3.4Å; K141-R145 VanDerWaalsContact O-N 3.16Å |
| 142 | T | 98.4 | Very high | 98 | Very high | 58 Ų | 58 | 106.6 Ų | 106.6 | 36% | 0.356 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.3 | -48.8 | 177.4 | -57.8 | 0 | 0 | 0 | 0 | 110.6 | R138 F139 C140 E144 R145 E146 | R138-T142 WeakPolarHBondContact O-CB 3.37Å; R138-T142 PolarHBondContact O-N 3.4Å; R138-T142 PolarHBondContact O-OG1 3.39Å; F139-T142 PolarHBondContact O-N 3.4Å; C140-T142 VanDerWaalsContact C-N 3.29Å; C140-T142 PolarHBondContact O-N 2.87Å; T142-E144 VanDerWaalsContact C-N 3.34Å; T142-E144 PolarHBondContact O-N 2.89Å; T142-R145 WeakPolarHBondContact O-CB 3.4Å; T142-R145 PolarHBondContact O-N 2.92Å; T142-E146 WeakPolarHBondContact O-CG 3.42Å; T142-E146 PolarHBondContact O-N 3.42Å |
| 143 | N | 97.6 | Very high | 97.9 | Very high | 70 Ų | 70 | 108.6 Ų | 108.6 | 37% | 0.374 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.9 | -42.5 | 177.8 | 175.4 | 70.4 | 0 | 0 | 0 | 112.2 | F139 C140 E146 R147 | F139-N143 WeakPolarHBondContact O-CB 3.39Å; F139-N143 PolarHBondContact O-N 2.96Å; C140-N143 PolarHBondContact O-N 3.31Å; N143-E146 PolarHBondContact O-N 3.06Å; N143-R147 WeakPolarHBondContact O-CG 3.34Å; N143-R147 PolarHBondContact O-N 3.17Å |
| 144 | E | 97.7 | Very high | 97.9 | Very high | 126 Ų | 126 | 110.1 Ų | 110.1 | 59% | 0.589 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.5 | -46.6 | 175.8 | -169.5 | -164.6 | 153.1 | 0 | 0 | 111.8 | C140 T142 E146 R147 K148 | C140-E144 WeakPolarHBondContact O-CB 3.48Å; C140-E144 PolarHBondContact O-N 2.92Å; T142-E144 VanDerWaalsContact C-N 3.34Å; T142-E144 PolarHBondContact O-N 2.89Å; E144-E146 VanDerWaalsContact C-N 3.32Å; E144-E146 PolarHBondContact O-N 3.13Å; E144-R147 PolarHBondContact O-N 2.89Å; E144-K148 PolarHBondContact O-N 2.96Å |
| 145 | R | 97.9 | Very high | 97.8 | Very high | 168 Ų | 168 | 107 Ų | 107 | 63% | 0.634 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60 | -42.5 | 176.4 | -172 | -170 | -58.6 | 137.5 | 3.4 | 111.9 | K141 T142 K148 N149 | K141-R145 WeakPolarHBondContact O-CB 3.45Å; K141-R145 PolarHBondContact O-N 3.4Å; K141-R145 VanDerWaalsContact O-N 3.16Å; T142-R145 WeakPolarHBondContact O-CB 3.4Å; T142-R145 PolarHBondContact O-N 2.92Å; R145-K148 PolarHBondContact O-N 2.97Å; R145-N149 WeakPolarHBondContact O-CB 3.39Å; R145-N149 PolarHBondContact O-N 3.38Å |
| 146 | E | 98.1 | Very high | 97.8 | Very high | 111 Ų | 111 | 105.7 Ų | 105.7 | 52% | 0.519 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 177.9 | -73.8 | -179.4 | 176.3 | 0 | 0 | 111.7 | T142 N143 E144 K148 N149 I150 | T142-E146 WeakPolarHBondContact O-CG 3.42Å; T142-E146 PolarHBondContact O-N 3.42Å; N143-E146 PolarHBondContact O-N 3.06Å; E144-E146 VanDerWaalsContact C-N 3.32Å; E144-E146 PolarHBondContact O-N 3.13Å; E146-K148 PolarHBondContact O-N 3.3Å; E146-N149 WeakPolarHBondContact O-CB 3.49Å; E146-N149 PolarHBondContact O-N 3.12Å; E146-I150 WeakPolarHBondContact O-CG1 3.34Å; E146-I150 PolarHBondContact O-N 3.33Å |
| 147 | R | 97.9 | Very high | 97.8 | Very high | 177 Ų | 177 | 106.8 Ų | 106.8 | 67% | 0.668 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59.5 | -45.6 | 174.6 | -71.4 | 177.5 | 66.8 | 121.9 | 0.8 | 111.7 | N143 E144 N149 I150 N151 | N143-R147 WeakPolarHBondContact O-CG 3.34Å; N143-R147 PolarHBondContact O-N 3.17Å; E144-R147 PolarHBondContact O-N 2.89Å; R147-N149 PolarHBondContact O-N 3.39Å; R147-I150 PolarHBondContact O-N 2.8Å; R147-N151 WeakPolarHBondContact O-CB 3.34Å; R147-N151 PolarHBondContact O-N 3.31Å |
| 148 | K | 97.6 | Very high | 97.7 | Very high | 138 Ų | 138 | 107.7 Ų | 107.7 | 60% | 0.6 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.6 | -42.9 | 176.4 | -170.3 | 168.8 | -173.8 | 163.6 | 0 | 111.6 | E144 R145 E146 N151 N152 | E144-K148 PolarHBondContact O-N 2.96Å; R145-K148 PolarHBondContact O-N 2.97Å; E146-K148 PolarHBondContact O-N 3.3Å; K148-N151 PolarHBondContact O-N 3.38Å; K148-N152 WeakPolarHBondContact O-CB 3.44Å; K148-N152 PolarHBondContact O-N 3.15Å; K148-N152 PolarHBondContact O-OD1 2.98Å |
| 149 | N | 98 | Very high | 97.7 | Very high | 78 Ų | 78 | 105 Ų | 105 | 42% | 0.417 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.5 | -44 | 177.2 | -177.6 | 43.1 | 0 | 0 | 0 | 112.5 | R145 E146 R147 N152 K153 | R145-N149 WeakPolarHBondContact O-CB 3.39Å; R145-N149 PolarHBondContact O-N 3.38Å; E146-N149 WeakPolarHBondContact O-CB 3.49Å; E146-N149 PolarHBondContact O-N 3.12Å; R147-N149 PolarHBondContact O-N 3.39Å; N149-N152 PolarHBondContact O-N 3.08Å; N149-K153 WeakPolarHBondContact O-CG 3.35Å; N149-K153 PolarHBondContact O-N 3.49Å; N149-K153 WeakPolarHBondContact OD1-CE 3.35Å |
| 150 | I | 97.4 | Very high | 97.7 | Very high | 116 Ų | 116 | 102.6 Ų | 102.6 | 60% | 0.595 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.3 | -47.1 | 176.1 | -68.4 | 165.7 | 0 | 0 | 0 | 110.2 | E146 R147 N152 K153 F154 | E146-I150 WeakPolarHBondContact O-CG1 3.34Å; E146-I150 PolarHBondContact O-N 3.33Å; R147-I150 PolarHBondContact O-N 2.8Å; I150-N152 PolarHBondContact O-N 3.42Å; I150-K153 PolarHBondContact O-N 3.22Å; I150-F154 PolarHBondContact O-N 2.97Å |
| 151 | N | 97.6 | Very high | 97.7 | Very high | 71 Ų | 71 | 104 Ų | 104 | 38% | 0.38 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.1 | -46.3 | 178.6 | -170.9 | 62.1 | 0 | 0 | 0 | 111.6 | R147 K148 K153 F154 C155 | R147-N151 WeakPolarHBondContact O-CB 3.34Å; R147-N151 PolarHBondContact O-N 3.31Å; K148-N151 PolarHBondContact O-N 3.38Å; N151-K153 PolarHBondContact O-N 2.89Å; N151-F154 WeakPolarHBondContact O-CB 3.39Å; N151-F154 PolarHBondContact O-N 3.18Å; N151-C155 PolarHBondContact O-N 3.39Å; N151-C155 PolarHBondContact O-SG 2.84Å |
| 152 | N | 97.5 | Very high | 97.7 | Very high | 74 Ų | 74 | 104.8 Ų | 104.8 | 40% | 0.396 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.4 | -47.1 | 179 | -71.5 | -4.3 | 0 | 0 | 0 | 112 | K148 N149 I150 F154 C155 E156 | K148-N152 WeakPolarHBondContact O-CB 3.44Å; K148-N152 PolarHBondContact O-N 3.15Å; K148-N152 PolarHBondContact O-OD1 2.98Å; N149-N152 PolarHBondContact O-N 3.08Å; I150-N152 PolarHBondContact O-N 3.42Å; N152-F154 VanDerWaalsContact C-N 3.27Å; N152-F154 PolarHBondContact O-N 2.78Å; N152-C155 PolarHBondContact O-N 3.33Å; N152-E156 WeakPolarHBondContact O-CG 3.46Å; N152-E156 PolarHBondContact O-N 3.18Å |
| 153 | K | 97.7 | Very high | 97.7 | Very high | 114 Ų | 114 | 107.6 Ų | 107.6 | 50% | 0.496 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -58.8 | -40.4 | 176.4 | -73.9 | 175.7 | 179.3 | -178.7 | 0 | 112 | N149 I150 N151 Q157 | N149-K153 WeakPolarHBondContact O-CG 3.35Å; N149-K153 PolarHBondContact O-N 3.49Å; N149-K153 WeakPolarHBondContact OD1-CE 3.35Å; I150-K153 PolarHBondContact O-N 3.22Å; N151-K153 PolarHBondContact O-N 2.89Å; K153-Q157 WeakPolarHBondContact O-CG 3.49Å; K153-Q157 PolarHBondContact O-N 2.75Å |
| 154 | F | 97 | Very high | 97.7 | Very high | 103 Ų | 103 | 110.9 Ų | 110.9 | 45% | 0.452 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.9 | -46.7 | 176.7 | -171.7 | -100.5 | 0 | 0 | 0 | 111.2 | I150 N151 N152 E156 Q157 Y158 | I150-F154 PolarHBondContact O-N 2.97Å; N151-F154 WeakPolarHBondContact O-CB 3.39Å; N151-F154 PolarHBondContact O-N 3.18Å; N152-F154 VanDerWaalsContact C-N 3.27Å; N152-F154 PolarHBondContact O-N 2.78Å; F154-E156 VanDerWaalsContact C-N 3.34Å; F154-E156 PolarHBondContact O-N 2.93Å; F154-Q157 WeakPolarHBondContact O-CB 3.43Å; F154-Q157 PolarHBondContact O-N 2.85Å; F154-Q157 VanDerWaalsContact O-N 3.15Å; F154-Y158 AromaticContact CD1-CD2 3.84Å; F154-Y158 HydrophobicContact CD1-CD2 3.84Å; F154-Y158 AromaticContact CD1-CE2 3.75Å; F154-Y158 HydrophobicContact CD1-CE2 3.75Å; F154-Y158 HydrophobicContact CD2-CD2 4.49Å; F154-Y158 HydrophobicContact CD2-CE2 4.08Å; F154-Y158 AromaticContact CE1-CD2 3.66Å; F154-Y158 HydrophobicContact CE1-CD2 3.66Å; F154-Y158 AromaticContact CE1-CE2 3.13Å; F154-Y158 HydrophobicContact CE1-CE2 3.13Å; F154-Y158 AromaticContact CE1-CZ 3.71Å; F154-Y158 HydrophobicContact CE2-CD2 4.35Å; F154-Y158 AromaticContact CE2-CE2 3.52Å; F154-Y158 HydrophobicContact CE2-CE2 3.52Å; F154-Y158 HydrophobicContact CG-CD2 4.29Å; F154-Y158 HydrophobicContact CG-CE2 4.21Å; F154-Y158 AromaticContact CZ-CD2 3.98Å; F154-Y158 HydrophobicContact CZ-CD2 3.98Å; F154-Y158 AromaticContact CZ-CE2 3.04Å; F154-Y158 HydrophobicContact CZ-CE2 3.04Å; F154-Y158 AromaticContact CZ-CZ 3.54Å; F154-Y158 WeakPolarHBondContact CZ-OH 3.02Å; F154-Y158 WeakPolarHBondContact O-CD2 3.42Å; F154-Y158 PolarHBondContact O-N 2.87Å; F154-Y158 VanDerWaalsContact O-N 3.08Å |
| 155 | C | 97.2 | Very high | 97.7 | Very high | 39 Ų | 39 | 107.6 Ų | 107.6 | 26% | 0.264 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57.3 | -44.2 | 175.2 | -70.5 | 0 | 0 | 0 | 0 | 112.3 | N151 N152 Q157 Y158 I159 | N151-C155 PolarHBondContact O-N 3.39Å; N151-C155 PolarHBondContact O-SG 2.84Å; N152-C155 PolarHBondContact O-N 3.33Å; C155-Q157 VanDerWaalsContact C-N 3.31Å; C155-Q157 PolarHBondContact O-N 3.46Å; C155-Y158 PolarHBondContact O-N 2.88Å; C155-I159 VanDerWaalsContact O-CG1 3.29Å; C155-I159 WeakPolarHBondContact O-CG1 3.44Å; C155-I159 PolarHBondContact O-N 3.47Å |
| 156 | E | 97.6 | Very high | 97.8 | Very high | 122 Ų | 122 | 104.1 Ų | 104.1 | 57% | 0.57 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58.2 | -41.6 | 176.1 | -75.8 | 174.7 | -176.5 | 0 | 0 | 112.3 | N152 F154 I159 T160 | N152-E156 WeakPolarHBondContact O-CG 3.46Å; N152-E156 PolarHBondContact O-N 3.18Å; F154-E156 VanDerWaalsContact C-N 3.34Å; F154-E156 PolarHBondContact O-N 2.93Å; E156-I159 PolarHBondContact O-N 2.87Å; E156-T160 WeakPolarHBondContact O-CB 3.44Å; E156-T160 PolarHBondContact O-N 3.04Å; E156-T160 PolarHBondContact O-OG1 3.39Å |
| 157 | Q | 97.8 | Very high | 97.8 | Very high | 126 Ų | 126 | 105 Ų | 105 | 59% | 0.589 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63 | -43.8 | 175.6 | -72.3 | 179.6 | 0.9 | 0 | 0 | 112 | K153 F154 C155 T161 | K153-Q157 WeakPolarHBondContact O-CG 3.49Å; K153-Q157 PolarHBondContact O-N 2.75Å; F154-Q157 WeakPolarHBondContact O-CB 3.43Å; F154-Q157 PolarHBondContact O-N 2.85Å; F154-Q157 VanDerWaalsContact O-N 3.15Å; C155-Q157 VanDerWaalsContact C-N 3.31Å; C155-Q157 PolarHBondContact O-N 3.46Å; Q157-T161 WeakPolarHBondContact O-CB 3.31Å; Q157-T161 PolarHBondContact O-N 3.46Å; Q157-T161 PolarHBondContact O-OG1 3.36Å |
| 158 | Y | 96.8 | Very high | 97.8 | Very high | 117 Ų | 117 | 100.8 Ų | 100.8 | 46% | 0.459 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.8 | -47.3 | 177.5 | -88.8 | -101.9 | 0 | 0 | 0 | 111.6 | F154 C155 T160 T161 F162 | F154-Y158 AromaticContact CD1-CD2 3.84Å; F154-Y158 HydrophobicContact CD1-CD2 3.84Å; F154-Y158 AromaticContact CD1-CE2 3.75Å; F154-Y158 HydrophobicContact CD1-CE2 3.75Å; F154-Y158 HydrophobicContact CD2-CD2 4.49Å; F154-Y158 HydrophobicContact CD2-CE2 4.08Å; F154-Y158 AromaticContact CE1-CD2 3.66Å; F154-Y158 HydrophobicContact CE1-CD2 3.66Å; F154-Y158 AromaticContact CE1-CE2 3.13Å; F154-Y158 HydrophobicContact CE1-CE2 3.13Å; F154-Y158 AromaticContact CE1-CZ 3.71Å; F154-Y158 HydrophobicContact CE2-CD2 4.35Å; F154-Y158 AromaticContact CE2-CE2 3.52Å; F154-Y158 HydrophobicContact CE2-CE2 3.52Å; F154-Y158 HydrophobicContact CG-CD2 4.29Å; F154-Y158 HydrophobicContact CG-CE2 4.21Å; F154-Y158 AromaticContact CZ-CD2 3.98Å; F154-Y158 HydrophobicContact CZ-CD2 3.98Å; F154-Y158 AromaticContact CZ-CE2 3.04Å; F154-Y158 HydrophobicContact CZ-CE2 3.04Å; F154-Y158 AromaticContact CZ-CZ 3.54Å; F154-Y158 WeakPolarHBondContact CZ-OH 3.02Å; F154-Y158 WeakPolarHBondContact O-CD2 3.42Å; F154-Y158 PolarHBondContact O-N 2.87Å; F154-Y158 VanDerWaalsContact O-N 3.08Å; C155-Y158 PolarHBondContact O-N 2.88Å; Y158-T160 VanDerWaalsContact C-N 3.33Å; Y158-T160 PolarHBondContact O-N 3.2Å; Y158-T161 PolarHBondContact O-N 2.96Å; Y158-F162 HydrophobicContact CD1-CD2 4.48Å; Y158-F162 AromaticContact CD1-CE2 3.69Å; Y158-F162 HydrophobicContact CD1-CE2 3.69Å; Y158-F162 HydrophobicContact CD1-CZ 4.25Å; Y158-F162 WeakPolarHBondContact O-CD2 3.39Å; Y158-F162 PolarHBondContact O-N 2.83Å |
| 159 | I | 97.2 | Very high | 97.9 | Very high | 86 Ų | 86 | 97.9 Ų | 97.9 | 44% | 0.441 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.1 | -49.9 | 178.5 | -69.9 | 166 | 0 | 0 | 0 | 109.9 | C155 E156 T161 F162 Q163 | C155-I159 VanDerWaalsContact O-CG1 3.29Å; C155-I159 WeakPolarHBondContact O-CG1 3.44Å; C155-I159 PolarHBondContact O-N 3.47Å; E156-I159 PolarHBondContact O-N 2.87Å; I159-T161 VanDerWaalsContact C-N 3.32Å; I159-T161 PolarHBondContact O-N 3.21Å; I159-F162 PolarHBondContact O-N 3.34Å; I159-Q163 HydrophobicContact CG2-CG 4.4Å; I159-Q163 WeakPolarHBondContact O-CB 3.48Å; I159-Q163 VanDerWaalsContact O-CG 3.28Å; I159-Q163 WeakPolarHBondContact O-CG 3.38Å; I159-Q163 PolarHBondContact O-N 2.88Å |
| 160 | T | 97.9 | Very high | 97.9 | Very high | 88 Ų | 88 | 99.8 Ų | 99.8 | 54% | 0.54 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.2 | -42.1 | 179.9 | -55.8 | 0 | 0 | 0 | 0 | 111.6 | E156 Y158 K164 | E156-T160 WeakPolarHBondContact O-CB 3.44Å; E156-T160 PolarHBondContact O-N 3.04Å; E156-T160 PolarHBondContact O-OG1 3.39Å; Y158-T160 VanDerWaalsContact C-N 3.33Å; Y158-T160 PolarHBondContact O-N 3.2Å; T160-K164 WeakPolarHBondContact O-CB 3.41Å; T160-K164 PolarHBondContact O-N 3.4Å |
| 161 | T | 98.3 | Very high | 97.9 | Very high | 93 Ų | 93 | 100 Ų | 100 | 57% | 0.571 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.1 | -43.5 | 180 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | Q157 Y158 I159 K164 S165 | Q157-T161 WeakPolarHBondContact O-CB 3.31Å; Q157-T161 PolarHBondContact O-N 3.46Å; Q157-T161 PolarHBondContact O-OG1 3.36Å; Y158-T161 PolarHBondContact O-N 2.96Å; I159-T161 VanDerWaalsContact C-N 3.32Å; I159-T161 PolarHBondContact O-N 3.21Å; T161-K164 PolarHBondContact O-N 2.93Å; T161-S165 PolarHBondContact O-N 3.05Å |
| 162 | F | 98.1 | Very high | 98 | Very high | 125 Ų | 125 | 102.7 Ų | 102.7 | 55% | 0.548 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68.7 | -40.9 | 178 | -74.8 | -55.5 | 0 | 0 | 0 | 112.6 | Y158 I159 K164 S165 D166 | Y158-F162 HydrophobicContact CD1-CD2 4.48Å; Y158-F162 AromaticContact CD1-CE2 3.69Å; Y158-F162 HydrophobicContact CD1-CE2 3.69Å; Y158-F162 HydrophobicContact CD1-CZ 4.25Å; Y158-F162 WeakPolarHBondContact O-CD2 3.39Å; Y158-F162 PolarHBondContact O-N 2.83Å; I159-F162 PolarHBondContact O-N 3.34Å; F162-K164 VanDerWaalsContact C-N 3.29Å; F162-K164 PolarHBondContact O-N 3.47Å; F162-S165 WeakPolarHBondContact O-CB 3.39Å; F162-S165 PolarHBondContact O-N 3.2Å; F162-D166 PolarHBondContact O-N 3.27Å |
| 163 | Q | 98.3 | Very high | 98 | Very high | 118 Ų | 118 | 102.9 Ų | 102.9 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.6 | -42.8 | 174.4 | -75 | 175.2 | -12.5 | 0 | 0 | 111.7 | I159 D166 M167 | I159-Q163 HydrophobicContact CG2-CG 4.4Å; I159-Q163 WeakPolarHBondContact O-CB 3.48Å; I159-Q163 VanDerWaalsContact O-CG 3.28Å; I159-Q163 WeakPolarHBondContact O-CG 3.38Å; I159-Q163 PolarHBondContact O-N 2.88Å; Q163-D166 PolarHBondContact O-N 3.42Å; Q163-M167 WeakPolarHBondContact O-CG 3.49Å; Q163-M167 PolarHBondContact O-N 3.23Å; Q163-M167 VanDerWaalsContact O-N 3.08Å |
| 164 | K | 98.3 | Very high | 98.1 | Very high | 138 Ų | 138 | 101.7 Ų | 101.7 | 60% | 0.6 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.5 | -45.4 | 174.8 | -175.9 | 179.5 | 176.8 | -176.1 | 0 | 111.9 | T160 T161 F162 D166 M167 D168 | T160-K164 WeakPolarHBondContact O-CB 3.41Å; T160-K164 PolarHBondContact O-N 3.4Å; T161-K164 PolarHBondContact O-N 2.93Å; F162-K164 VanDerWaalsContact C-N 3.29Å; F162-K164 PolarHBondContact O-N 3.47Å; K164-D166 VanDerWaalsContact C-N 3.29Å; K164-D166 PolarHBondContact O-N 2.98Å; K164-M167 WeakPolarHBondContact O-CB 3.32Å; K164-M167 PolarHBondContact O-N 3.16Å; K164-D168 PolarHBondContact O-N 2.93Å |
| 165 | S | 98.5 | Very high | 98.1 | Very high | 57 Ų | 57 | 101.9 Ų | 101.9 | 40% | 0.399 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.3 | -42.1 | 176.7 | -177.2 | 0 | 0 | 0 | 0 | 111.9 | T161 F162 D168 V169 | T161-S165 PolarHBondContact O-N 3.05Å; F162-S165 WeakPolarHBondContact O-CB 3.39Å; F162-S165 PolarHBondContact O-N 3.2Å; S165-D168 PolarHBondContact O-N 3.48Å; S165-V169 WeakPolarHBondContact O-CG2 3.43Å; S165-V169 PolarHBondContact O-N 3.25Å |
| 166 | D | 98.5 | Very high | 98.2 | Very high | 96 Ų | 96 | 105.7 Ų | 105.7 | 51% | 0.513 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.3 | -43 | 177.3 | -80.6 | -6 | 0 | 0 | 0 | 111.6 | F162 Q163 K164 V169 Q170 | F162-D166 PolarHBondContact O-N 3.27Å; Q163-D166 PolarHBondContact O-N 3.42Å; K164-D166 VanDerWaalsContact C-N 3.29Å; K164-D166 PolarHBondContact O-N 2.98Å; D166-V169 PolarHBondContact O-N 2.9Å; D166-Q170 PolarHBondContact O-N 2.63Å |
| 167 | M | 98.4 | Very high | 98.2 | Very high | 128 Ų | 128 | 105.9 Ų | 105.9 | 63% | 0.631 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.4 | -43.3 | 174.2 | -75.1 | 175.4 | 56.1 | 0 | 0 | 112 | Q163 K164 V169 Q170 K171 | Q163-M167 WeakPolarHBondContact O-CG 3.49Å; Q163-M167 PolarHBondContact O-N 3.23Å; Q163-M167 VanDerWaalsContact O-N 3.08Å; K164-M167 WeakPolarHBondContact O-CB 3.32Å; K164-M167 PolarHBondContact O-N 3.16Å; M167-V169 VanDerWaalsContact C-N 3.34Å; M167-V169 PolarHBondContact O-N 3.4Å; M167-Q170 PolarHBondContact O-N 3.34Å; M167-K171 PolarHBondContact O-N 3.36Å |
| 168 | D | 98.4 | Very high | 98.3 | Very high | 89 Ų | 89 | 106.6 Ų | 106.6 | 48% | 0.476 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.5 | -40.1 | 179.2 | -71.9 | -23.4 | 0 | 0 | 0 | 111.1 | K164 S165 K171 F172 | K164-D168 PolarHBondContact O-N 2.93Å; S165-D168 PolarHBondContact O-N 3.48Å; D168-K171 PolarHBondContact O-N 2.93Å; D168-F172 WeakPolarHBondContact O-CB 3.38Å; D168-F172 PolarHBondContact O-N 3.42Å |
| 169 | V | 98.6 | Very high | 98.3 | Very high | 77 Ų | 77 | 104.8 Ų | 104.8 | 47% | 0.467 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.3 | -41.8 | 173.7 | 169.2 | 0 | 0 | 0 | 0 | 111.5 | S165 D166 M167 F172 N173 | S165-V169 WeakPolarHBondContact O-CG2 3.43Å; S165-V169 PolarHBondContact O-N 3.25Å; D166-V169 PolarHBondContact O-N 2.9Å; M167-V169 VanDerWaalsContact C-N 3.34Å; M167-V169 PolarHBondContact O-N 3.4Å; V169-F172 PolarHBondContact O-N 3.1Å; V169-N173 PolarHBondContact O-N 3.28Å; V169-N173 PolarHBondContact O-ND2 3.33Å |
| 170 | Q | 98.4 | Very high | 98.4 | Very high | 118 Ų | 118 | 104.5 Ų | 104.5 | 55% | 0.551 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -61.8 | -49.1 | 176.1 | -176.3 | 180 | -22.3 | 0 | 0 | 111 | D166 M167 F172 N173 E174 | D166-Q170 PolarHBondContact O-N 2.63Å; M167-Q170 PolarHBondContact O-N 3.34Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.86Å; Q170-N173 WeakPolarHBondContact O-CB 3.5Å; Q170-N173 PolarHBondContact O-N 3.43Å; Q170-N173 VanDerWaalsContact O-N 3.11Å; Q170-E174 PolarHBondContact NE2-OE1 3.44Å; Q170-E174 PolarHBondContact O-N 3.18Å; Q170-E174 VanDerWaalsContact O-N 3.07Å |
| 171 | K | 98.6 | Very high | 98.4 | Very high | 121 Ų | 121 | 103.8 Ų | 103.8 | 53% | 0.526 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 178.7 | -173.6 | -178.5 | 175.9 | -171.6 | 0 | 112 | M167 D168 N173 E174 E175 | M167-K171 PolarHBondContact O-N 3.36Å; D168-K171 PolarHBondContact O-N 2.93Å; K171-N173 VanDerWaalsContact C-N 3.29Å; K171-N173 PolarHBondContact O-N 3.15Å; K171-E174 PolarHBondContact O-N 3.05Å; K171-E175 WeakPolarHBondContact CE-OE1 3.3Å; K171-E175 PolarHBondContact O-N 2.98Å |
| 172 | F | 98.4 | Very high | 98.4 | Very high | 127 Ų | 127 | 102.8 Ų | 102.8 | 56% | 0.557 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -58.4 | -42.2 | 175 | 172.6 | -99.3 | 0 | 0 | 0 | 112 | D168 V169 Q170 E175 K176 | D168-F172 WeakPolarHBondContact O-CB 3.38Å; D168-F172 PolarHBondContact O-N 3.42Å; V169-F172 PolarHBondContact O-N 3.1Å; Q170-F172 VanDerWaalsContact C-N 3.33Å; Q170-F172 PolarHBondContact O-N 2.86Å; F172-E175 PolarHBondContact O-N 3.32Å; F172-K176 HydrophobicContact CE1-CD 4.34Å; F172-K176 VanDerWaalsContact O-CB 3.26Å; F172-K176 WeakPolarHBondContact O-CB 3.41Å; F172-K176 PolarHBondContact O-N 3.34Å |
| 173 | N | 98.4 | Very high | 98.4 | Very high | 78 Ų | 78 | 100.5 Ų | 100.5 | 42% | 0.417 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.7 | -39.9 | 178.3 | -74.8 | -35.1 | 0 | 0 | 0 | 112.3 | V169 Q170 K171 K176 E177 | V169-N173 PolarHBondContact O-N 3.28Å; V169-N173 PolarHBondContact O-ND2 3.33Å; Q170-N173 WeakPolarHBondContact O-CB 3.5Å; Q170-N173 PolarHBondContact O-N 3.43Å; Q170-N173 VanDerWaalsContact O-N 3.11Å; K171-N173 VanDerWaalsContact C-N 3.29Å; K171-N173 PolarHBondContact O-N 3.15Å; N173-K176 PolarHBondContact O-N 2.92Å; N173-E177 PolarHBondContact O-N 3.36Å |
| 174 | E | 98.5 | Very high | 98.4 | Very high | 89 Ų | 89 | 100.8 Ų | 100.8 | 42% | 0.416 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.5 | -43.5 | 175.1 | -68.3 | 174.4 | -165 | 0 | 0 | 112 | Q170 K171 E177 K178 | Q170-E174 PolarHBondContact NE2-OE1 3.44Å; Q170-E174 PolarHBondContact O-N 3.18Å; Q170-E174 VanDerWaalsContact O-N 3.07Å; K171-E174 PolarHBondContact O-N 3.05Å; E174-E177 PolarHBondContact O-N 2.89Å; E174-K178 WeakPolarHBondContact O-CG 3.31Å; E174-K178 PolarHBondContact O-N 3.31Å; E174-K178 VanDerWaalsContact O-N 3.14Å |
| 175 | E | 98.4 | Very high | 98.4 | Very high | 108 Ų | 108 | 101.5 Ų | 101.5 | 51% | 0.505 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.2 | -41.8 | 176.5 | -73.2 | -179.7 | -172.1 | 0 | 0 | 111.9 | K171 F172 E177 K178 S179 | K171-E175 WeakPolarHBondContact CE-OE1 3.3Å; K171-E175 PolarHBondContact O-N 2.98Å; F172-E175 PolarHBondContact O-N 3.32Å; E175-E177 VanDerWaalsContact C-N 3.34Å; E175-E177 PolarHBondContact O-N 3.36Å; E175-K178 PolarHBondContact O-N 3.04Å; E175-S179 PolarHBondContact O-N 2.84Å |
| 176 | K | 98.3 | Very high | 98.4 | Very high | 118 Ų | 118 | 105.4 Ų | 105.4 | 51% | 0.513 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.4 | -45.8 | 174.5 | 177.1 | -172.3 | 170.3 | -175 | 0 | 111.2 | F172 N173 S179 V180 | F172-K176 HydrophobicContact CE1-CD 4.34Å; F172-K176 VanDerWaalsContact O-CB 3.26Å; F172-K176 WeakPolarHBondContact O-CB 3.41Å; F172-K176 PolarHBondContact O-N 3.34Å; N173-K176 PolarHBondContact O-N 2.92Å; K176-S179 PolarHBondContact O-N 3.46Å; K176-V180 HydrophobicContact CG-CG2 4.45Å; K176-V180 VanDerWaalsContact O-CG2 3.31Å; K176-V180 WeakPolarHBondContact O-CG2 3.45Å; K176-V180 PolarHBondContact O-N 3.48Å |
| 177 | E | 98.5 | Very high | 98.4 | Very high | 126 Ų | 126 | 106 Ų | 106 | 59% | 0.589 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.5 | -43.8 | 179.3 | -173.3 | 175.5 | 177.4 | 0 | 0 | 111.7 | N173 E174 E175 S179 V180 N181 | N173-E177 PolarHBondContact O-N 3.36Å; E174-E177 PolarHBondContact O-N 2.89Å; E175-E177 VanDerWaalsContact C-N 3.34Å; E175-E177 PolarHBondContact O-N 3.36Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 3.16Å; E177-V180 PolarHBondContact O-N 2.97Å; E177-N181 WeakPolarHBondContact O-CB 3.32Å; E177-N181 VanDerWaalsContact O-CG 3.27Å; E177-N181 PolarHBondContact O-N 3.47Å; E177-N181 PolarHBondContact O-ND2 3.46Å |
| 178 | K | 98.4 | Very high | 98.4 | Very high | 142 Ų | 142 | 105.9 Ų | 105.9 | 62% | 0.617 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -57.8 | -45.6 | 174 | -70.6 | 170.1 | -173.6 | 169.4 | 0 | 111.8 | E174 E175 N181 S182 | E174-K178 WeakPolarHBondContact O-CG 3.31Å; E174-K178 PolarHBondContact O-N 3.31Å; E174-K178 VanDerWaalsContact O-N 3.14Å; E175-K178 PolarHBondContact O-N 3.04Å; K178-N181 PolarHBondContact O-N 2.93Å; K178-S182 PolarHBondContact O-N 3.22Å |
| 179 | S | 98.2 | Very high | 98.4 | Very high | 79 Ų | 79 | 104.3 Ų | 104.3 | 55% | 0.552 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.1 | -45.6 | 178.6 | -175.2 | 0 | 0 | 0 | 0 | 112 | E175 K176 E177 N181 S182 C183 | E175-S179 PolarHBondContact O-N 2.84Å; K176-S179 PolarHBondContact O-N 3.46Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 3.16Å; S179-N181 VanDerWaalsContact C-N 3.34Å; S179-N181 PolarHBondContact O-N 3.03Å; S179-S182 PolarHBondContact O-N 2.75Å; S179-C183 WeakPolarHBondContact O-CB 3.43Å; S179-C183 PolarHBondContact O-N 3.5Å |
| 180 | V | 98.6 | Very high | 98.4 | Very high | 80 Ų | 80 | 105.3 Ų | 105.3 | 49% | 0.485 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -58.6 | -46 | 176.3 | 168.4 | 0 | 0 | 0 | 0 | 111.1 | K176 E177 S182 C183 Q184 | K176-V180 HydrophobicContact CG-CG2 4.45Å; K176-V180 VanDerWaalsContact O-CG2 3.31Å; K176-V180 WeakPolarHBondContact O-CG2 3.45Å; K176-V180 PolarHBondContact O-N 3.48Å; E177-V180 PolarHBondContact O-N 2.97Å; V180-S182 VanDerWaalsContact C-N 3.34Å; V180-S182 PolarHBondContact O-N 3.07Å; V180-C183 PolarHBondContact O-N 3.22Å; V180-Q184 PolarHBondContact O-N 2.9Å |
| 181 | N | 98.5 | Very high | 98.4 | Very high | 73 Ų | 73 | 106.1 Ų | 106.1 | 39% | 0.39 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.6 | -39.7 | 178.3 | -72.1 | -24.8 | 0 | 0 | 0 | 112.3 | E177 K178 S179 Q184 K185 | E177-N181 WeakPolarHBondContact O-CB 3.32Å; E177-N181 VanDerWaalsContact O-CG 3.27Å; E177-N181 PolarHBondContact O-N 3.47Å; E177-N181 PolarHBondContact O-ND2 3.46Å; K178-N181 PolarHBondContact O-N 2.93Å; S179-N181 VanDerWaalsContact C-N 3.34Å; S179-N181 PolarHBondContact O-N 3.03Å; N181-Q184 PolarHBondContact O-N 3.44Å; N181-K185 WeakPolarHBondContact O-CG 3.47Å; N181-K185 PolarHBondContact O-N 3.19Å |
| 182 | S | 98.4 | Very high | 98.4 | Very high | 72 Ų | 72 | 105.9 Ų | 105.9 | 50% | 0.503 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65 | -46.5 | 175.3 | -166.6 | 0 | 0 | 0 | 0 | 111.8 | K178 S179 V180 Q184 K185 E186 | K178-S182 PolarHBondContact O-N 3.22Å; S179-S182 PolarHBondContact O-N 2.75Å; V180-S182 VanDerWaalsContact C-N 3.34Å; V180-S182 PolarHBondContact O-N 3.07Å; S182-Q184 VanDerWaalsContact C-N 3.28Å; S182-Q184 PolarHBondContact O-N 3Å; S182-K185 PolarHBondContact O-N 3.2Å; S182-E186 PolarHBondContact O-N 3.41Å |
| 183 | C | 98.2 | Very high | 98.4 | Very high | 77 Ų | 77 | 103.3 Ų | 103.3 | 52% | 0.52 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.6 | -40 | 178 | -175.9 | 0 | 0 | 0 | 0 | 111.6 | S179 V180 E186 Q187 | S179-C183 WeakPolarHBondContact O-CB 3.43Å; S179-C183 PolarHBondContact O-N 3.5Å; V180-C183 PolarHBondContact O-N 3.22Å; C183-E186 PolarHBondContact O-N 2.93Å; C183-Q187 WeakPolarHBondContact O-CB 3.37Å; C183-Q187 PolarHBondContact O-N 2.9Å |
| 184 | Q | 98.6 | Very high | 98.4 | Very high | 123 Ų | 123 | 105.4 Ų | 105.4 | 58% | 0.575 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.5 | -43 | 176.5 | -174.5 | 177.2 | -4 | 0 | 0 | 112.4 | V180 N181 S182 Q187 Q188 | V180-Q184 PolarHBondContact O-N 2.9Å; N181-Q184 PolarHBondContact O-N 3.44Å; S182-Q184 VanDerWaalsContact C-N 3.28Å; S182-Q184 PolarHBondContact O-N 3Å; Q184-Q187 PolarHBondContact O-N 3.32Å; Q184-Q188 PolarHBondContact O-N 2.97Å |
| 185 | K | 98.4 | Very high | 98.4 | Very high | 153 Ų | 153 | 104.2 Ų | 104.2 | 67% | 0.665 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61.8 | -45.9 | 175.7 | -71.9 | 176 | -178.7 | 179.6 | 0 | 111.3 | N181 S182 Q187 Q188 A189 | N181-K185 WeakPolarHBondContact O-CG 3.47Å; N181-K185 PolarHBondContact O-N 3.19Å; S182-K185 PolarHBondContact O-N 3.2Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 3.47Å; K185-Q188 PolarHBondContact O-N 2.79Å; K185-A189 PolarHBondContact O-N 3.22Å |
| 186 | E | 97.9 | Very high | 98.3 | Very high | 139 Ų | 139 | 102.1 Ų | 102.1 | 65% | 0.65 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -63.7 | -40.8 | 178.3 | -168 | 176.2 | -174 | 0 | 0 | 111.6 | S182 C183 Q188 A189 L190 | S182-E186 PolarHBondContact O-N 3.41Å; C183-E186 PolarHBondContact O-N 2.93Å; E186-Q188 VanDerWaalsContact C-N 3.3Å; E186-Q188 PolarHBondContact O-N 3.18Å; E186-A189 PolarHBondContact O-N 2.97Å; E186-L190 WeakPolarHBondContact O-CB 3.38Å; E186-L190 PolarHBondContact O-N 3.4Å |
| 187 | Q | 98.3 | Very high | 98.3 | Very high | 108 Ų | 108 | 102.8 Ų | 102.8 | 51% | 0.505 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.4 | -39.7 | 174.5 | -169.7 | -174 | 29.6 | 0 | 0 | 112 | C183 Q184 K185 K191 | C183-Q187 WeakPolarHBondContact O-CB 3.37Å; C183-Q187 PolarHBondContact O-N 2.9Å; Q184-Q187 PolarHBondContact O-N 3.32Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 3.47Å; Q187-K191 WeakPolarHBondContact O-CG 3.22Å; Q187-K191 PolarHBondContact O-N 2.81Å; Q187-K191 VanDerWaalsContact O-N 3.14Å |
| 188 | Q | 98.4 | Very high | 98.3 | Very high | 126 Ų | 126 | 101.4 Ų | 101.4 | 59% | 0.589 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67.7 | -45.2 | 176.3 | -172.6 | 177.2 | 6.9 | 0 | 0 | 111.6 | Q184 K185 E186 L190 K191 L192 | Q184-Q188 PolarHBondContact O-N 2.97Å; K185-Q188 PolarHBondContact O-N 2.79Å; E186-Q188 VanDerWaalsContact C-N 3.3Å; E186-Q188 PolarHBondContact O-N 3.18Å; Q188-L190 VanDerWaalsContact C-N 3.3Å; Q188-L190 PolarHBondContact O-N 2.88Å; Q188-K191 PolarHBondContact O-N 3.2Å; Q188-L192 PolarHBondContact O-N 3.49Å; Q188-L192 VanDerWaalsContact O-N 3.1Å |
| 189 | A | 98.4 | Very high | 98.3 | Very high | 57 Ų | 57 | 100.4 Ų | 100.4 | 47% | 0.471 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.1 | -42 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | K185 E186 K191 L192 S193 | K185-A189 PolarHBondContact O-N 3.22Å; E186-A189 PolarHBondContact O-N 2.97Å; A189-K191 PolarHBondContact O-N 3.38Å; A189-L192 PolarHBondContact O-N 3.43Å; A189-S193 WeakPolarHBondContact O-CB 3.31Å; A189-S193 PolarHBondContact O-N 2.88Å |
| 190 | L | 98.4 | Very high | 98.3 | Very high | 98 Ų | 98 | 100.5 Ų | 100.5 | 51% | 0.513 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.3 | -40.7 | 177.2 | -175.9 | 65.2 | 0 | 0 | 0 | 112.4 | E186 Q188 S193 K194 | E186-L190 WeakPolarHBondContact O-CB 3.38Å; E186-L190 PolarHBondContact O-N 3.4Å; Q188-L190 VanDerWaalsContact C-N 3.3Å; Q188-L190 PolarHBondContact O-N 2.88Å; L190-S193 PolarHBondContact O-N 3.41Å; L190-K194 WeakPolarHBondContact O-CG 3.33Å; L190-K194 PolarHBondContact O-N 2.74Å |
| 191 | K | 98.4 | Very high | 98.3 | Very high | 135 Ų | 135 | 101 Ų | 101 | 59% | 0.587 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.8 | -44.8 | 175.6 | -74.8 | 174.4 | -177.6 | 176.8 | 0 | 111.5 | Q187 Q188 A189 K194 C195 | Q187-K191 WeakPolarHBondContact O-CG 3.22Å; Q187-K191 PolarHBondContact O-N 2.81Å; Q187-K191 VanDerWaalsContact O-N 3.14Å; Q188-K191 PolarHBondContact O-N 3.2Å; A189-K191 PolarHBondContact O-N 3.38Å; K191-K194 PolarHBondContact O-N 3.06Å; K191-C195 PolarHBondContact O-N 3.5Å; K191-C195 VanDerWaalsContact O-N 3.07Å |
| 192 | L | 98.3 | Very high | 98.3 | Very high | 116 Ų | 116 | 103.9 Ų | 103.9 | 61% | 0.607 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.8 | -44.4 | 177.9 | -69.5 | 173 | 0 | 0 | 0 | 111.6 | Q188 A189 K194 C195 S196 | Q188-L192 PolarHBondContact O-N 3.49Å; Q188-L192 VanDerWaalsContact O-N 3.1Å; A189-L192 PolarHBondContact O-N 3.43Å; L192-K194 PolarHBondContact O-N 3Å; L192-C195 WeakPolarHBondContact O-CB 3.45Å; L192-C195 PolarHBondContact O-N 3.37Å; L192-S196 PolarHBondContact O-N 2.87Å |
| 193 | S | 98.4 | Very high | 98.2 | Very high | 72 Ų | 72 | 102.8 Ų | 102.8 | 50% | 0.503 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -58 | -46.7 | 176.6 | -179.5 | 0 | 0 | 0 | 0 | 111.9 | A189 L190 C195 S196 Q197 | A189-S193 WeakPolarHBondContact O-CB 3.31Å; A189-S193 PolarHBondContact O-N 2.88Å; L190-S193 PolarHBondContact O-N 3.41Å; S193-C195 VanDerWaalsContact C-N 3.35Å; S193-C195 PolarHBondContact O-N 3.34Å; S193-S196 PolarHBondContact O-N 2.93Å; S193-Q197 WeakPolarHBondContact O-CB 3.33Å; S193-Q197 PolarHBondContact O-N 2.93Å |
| 194 | K | 98.3 | Very high | 98.2 | Very high | 122 Ų | 122 | 102.9 Ų | 102.9 | 53% | 0.53 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.6 | -40.9 | 175.1 | -75.7 | -176.8 | 177.3 | -176.8 | 0 | 112.9 | L190 K191 L192 Q197 N198 | L190-K194 WeakPolarHBondContact O-CG 3.33Å; L190-K194 PolarHBondContact O-N 2.74Å; K191-K194 PolarHBondContact O-N 3.06Å; L192-K194 PolarHBondContact O-N 3Å; K194-Q197 PolarHBondContact O-N 2.93Å; K194-N198 WeakPolarHBondContact O-CB 3.43Å; K194-N198 VanDerWaalsContact O-CG 3.27Å; K194-N198 PolarHBondContact O-N 3.38Å; K194-N198 PolarHBondContact O-ND2 3.34Å |
| 195 | C | 98.1 | Very high | 98.2 | Very high | 65 Ų | 65 | 103.1 Ų | 103.1 | 44% | 0.439 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.9 | -47.2 | 177.5 | -177.8 | 0 | 0 | 0 | 0 | 111.4 | K191 L192 S193 Q197 N198 Q199 | K191-C195 PolarHBondContact O-N 3.5Å; K191-C195 VanDerWaalsContact O-N 3.07Å; L192-C195 WeakPolarHBondContact O-CB 3.45Å; L192-C195 PolarHBondContact O-N 3.37Å; S193-C195 VanDerWaalsContact C-N 3.35Å; S193-C195 PolarHBondContact O-N 3.34Å; C195-Q197 PolarHBondContact O-N 3.46Å; C195-N198 PolarHBondContact O-N 3.47Å; C195-Q199 WeakPolarHBondContact O-CG 3.48Å; C195-Q199 PolarHBondContact O-N 3.38Å |
| 196 | S | 98.2 | Very high | 98.2 | Very high | 64 Ų | 64 | 100.6 Ų | 100.6 | 45% | 0.448 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62 | -42.4 | 176.9 | 178.3 | 0 | 0 | 0 | 0 | 112.7 | L192 S193 N198 Q199 T200 | L192-S196 PolarHBondContact O-N 2.87Å; S193-S196 PolarHBondContact O-N 2.93Å; S196-N198 PolarHBondContact O-N 3.4Å; S196-Q199 PolarHBondContact O-N 3.23Å; S196-T200 WeakPolarHBondContact O-CB 3.32Å; S196-T200 PolarHBondContact O-N 3.47Å; S196-T200 PolarHBondContact O-OG1 3.46Å |
| 197 | Q | 98.1 | Very high | 98.2 | Very high | 132 Ų | 132 | 99.9 Ų | 99.9 | 62% | 0.617 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.3 | -43.3 | 175.4 | -171.1 | 179 | 27.5 | 0 | 0 | 111.9 | S193 K194 C195 T200 L201 | S193-Q197 WeakPolarHBondContact O-CB 3.33Å; S193-Q197 PolarHBondContact O-N 2.93Å; K194-Q197 PolarHBondContact O-N 2.93Å; C195-Q197 PolarHBondContact O-N 3.46Å; Q197-T200 PolarHBondContact O-N 3.35Å; Q197-L201 PolarHBondContact O-N 2.96Å |
| 198 | N | 98.3 | Very high | 98.1 | Very high | 97 Ų | 97 | 100.5 Ų | 100.5 | 52% | 0.519 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.9 | -43.9 | 177.3 | -73.9 | -15.1 | 0 | 0 | 0 | 111.9 | K194 C195 S196 T200 L201 E202 | K194-N198 WeakPolarHBondContact O-CB 3.43Å; K194-N198 VanDerWaalsContact O-CG 3.27Å; K194-N198 PolarHBondContact O-N 3.38Å; K194-N198 PolarHBondContact O-ND2 3.34Å; C195-N198 PolarHBondContact O-N 3.47Å; S196-N198 PolarHBondContact O-N 3.4Å; N198-T200 VanDerWaalsContact C-N 3.32Å; N198-T200 PolarHBondContact O-N 3.4Å; N198-L201 WeakPolarHBondContact O-CB 3.26Å; N198-L201 PolarHBondContact O-N 2.91Å; N198-E202 PolarHBondContact O-N 2.92Å |
| 199 | Q | 97.9 | Very high | 98.1 | Very high | 120 Ų | 120 | 101.2 Ų | 101.2 | 56% | 0.561 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.7 | -41.9 | 175.5 | -72.8 | 173.5 | -13.2 | 0 | 0 | 111.9 | C195 S196 L201 E202 A203 | C195-Q199 WeakPolarHBondContact O-CG 3.48Å; C195-Q199 PolarHBondContact O-N 3.38Å; S196-Q199 PolarHBondContact O-N 3.23Å; Q199-L201 VanDerWaalsContact C-N 3.33Å; Q199-L201 PolarHBondContact O-N 3.5Å; Q199-E202 PolarHBondContact O-N 2.9Å; Q199-A203 PolarHBondContact O-N 2.91Å |
| 200 | T | 98.1 | Very high | 98 | Very high | 82 Ų | 82 | 103.8 Ų | 103.8 | 50% | 0.503 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.4 | -41.8 | 177.2 | -56.6 | 0 | 0 | 0 | 0 | 111 | S196 Q197 N198 A203 V204 | S196-T200 WeakPolarHBondContact O-CB 3.32Å; S196-T200 PolarHBondContact O-N 3.47Å; S196-T200 PolarHBondContact O-OG1 3.46Å; Q197-T200 PolarHBondContact O-N 3.35Å; N198-T200 VanDerWaalsContact C-N 3.32Å; N198-T200 PolarHBondContact O-N 3.4Å; T200-A203 PolarHBondContact O-N 2.9Å; T200-V204 VanDerWaalsContact O-CG2 3.32Å; T200-V204 WeakPolarHBondContact O-CG2 3.47Å; T200-V204 PolarHBondContact O-N 3.34Å |
| 201 | L | 98.3 | Very high | 97.9 | Very high | 90 Ų | 90 | 102.4 Ų | 102.4 | 47% | 0.471 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 176.1 | 179.7 | 63.4 | 0 | 0 | 0 | 112.2 | Q197 N198 Q199 V204 K205 | Q197-L201 PolarHBondContact O-N 2.96Å; N198-L201 WeakPolarHBondContact O-CB 3.26Å; N198-L201 PolarHBondContact O-N 2.91Å; Q199-L201 VanDerWaalsContact C-N 3.33Å; Q199-L201 PolarHBondContact O-N 3.5Å; L201-V204 PolarHBondContact O-N 3.44Å; L201-K205 WeakPolarHBondContact O-CG 3.33Å; L201-K205 PolarHBondContact O-N 2.98Å |
| 202 | E | 98.3 | Very high | 97.7 | Very high | 133 Ų | 133 | 99.7 Ų | 99.7 | 62% | 0.621 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.7 | -46.3 | 174.7 | -75.9 | -177.5 | 170 | 0 | 0 | 111.7 | N198 Q199 V204 K205 E206 | N198-E202 PolarHBondContact O-N 2.92Å; Q199-E202 PolarHBondContact O-N 2.9Å; E202-V204 VanDerWaalsContact C-N 3.33Å; E202-V204 PolarHBondContact O-N 3.22Å; E202-K205 WeakPolarHBondContact O-CB 3.49Å; E202-K205 PolarHBondContact O-N 3.3Å; E202-E206 PolarHBondContact O-N 3.33Å |
| 203 | A | 98.1 | Very high | 97.6 | Very high | 49 Ų | 49 | 99.8 Ų | 99.8 | 41% | 0.405 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -41.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q199 T200 E206 M207 | Q199-A203 PolarHBondContact O-N 2.91Å; T200-A203 PolarHBondContact O-N 2.9Å; A203-E206 PolarHBondContact O-N 2.97Å; A203-M207 WeakPolarHBondContact O-CG 3.3Å; A203-M207 PolarHBondContact O-N 2.92Å |
| 204 | V | 98.1 | Very high | 97.4 | Very high | 79 Ų | 79 | 100.5 Ų | 100.5 | 48% | 0.479 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.9 | -42.6 | 175.8 | 170 | 0 | 0 | 0 | 0 | 111.4 | T200 L201 E202 M207 H208 | T200-V204 VanDerWaalsContact O-CG2 3.32Å; T200-V204 WeakPolarHBondContact O-CG2 3.47Å; T200-V204 PolarHBondContact O-N 3.34Å; L201-V204 PolarHBondContact O-N 3.44Å; E202-V204 VanDerWaalsContact C-N 3.33Å; E202-V204 PolarHBondContact O-N 3.22Å; V204-M207 PolarHBondContact O-N 3.43Å; V204-H208 WeakPolarHBondContact O-CB 3.21Å; V204-H208 PolarHBondContact O-N 2.83Å |
| 205 | K | 97.9 | Very high | 97.1 | Very high | 128 Ų | 128 | 100.1 Ų | 100.1 | 56% | 0.557 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.4 | -45.9 | 176.3 | -74.8 | 174.8 | 178.6 | -179.2 | 0 | 111.7 | L201 E202 H208 E209 | L201-K205 WeakPolarHBondContact O-CG 3.33Å; L201-K205 PolarHBondContact O-N 2.98Å; E202-K205 WeakPolarHBondContact O-CB 3.49Å; E202-K205 PolarHBondContact O-N 3.3Å; K205-H208 WeakPolarHBondContact O-CB 3.45Å; K205-H208 PolarHBondContact O-N 3.24Å; K205-E209 PolarHBondContact O-N 2.92Å |
| 206 | E | 97.9 | Very high | 96.8 | Very high | 101 Ų | 101 | 103 Ų | 103 | 47% | 0.472 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 179.2 | -168.9 | -171.8 | 163.3 | 0 | 0 | 111.7 | E202 A203 H208 E209 K210 | E202-E206 PolarHBondContact O-N 3.33Å; A203-E206 PolarHBondContact O-N 2.97Å; E206-H208 VanDerWaalsContact C-N 3.34Å; E206-H208 PolarHBondContact O-N 3.49Å; E206-E209 PolarHBondContact O-N 3.36Å; E206-K210 WeakPolarHBondContact O-CG 3.25Å; E206-K210 PolarHBondContact O-N 2.74Å; E206-K210 VanDerWaalsContact OE1-CE 3.25Å; E206-K210 WeakPolarHBondContact OE1-CE 3.37Å; E206-K210 IonicContact OE1-NZ 2.64Å; E206-K210 PolarHBondContact OE1-NZ 3.21Å |
| 207 | M | 97.3 | Very high | 96.3 | Very high | 123 Ų | 123 | 104.2 Ų | 104.2 | 61% | 0.606 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.4 | -40.5 | 175.3 | -73.7 | -157.5 | -56.4 | 0 | 0 | 112.5 | A203 V204 S211 | A203-M207 WeakPolarHBondContact O-CG 3.3Å; A203-M207 PolarHBondContact O-N 2.92Å; V204-M207 PolarHBondContact O-N 3.43Å; M207-S211 WeakPolarHBondContact O-CB 3.47Å; M207-S211 PolarHBondContact O-N 3.46Å; M207-S211 PolarHBondContact O-OG 3.22Å |
| 208 | H | 97.5 | Very high | 95.7 | Very high | 122 Ų | 122 | 103.6 Ų | 103.6 | 57% | 0.565 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.3 | -46.3 | 176.3 | 173.2 | -86.9 | 0 | 0 | 0 | 111.3 | V204 K205 E206 S211 M212 | V204-H208 WeakPolarHBondContact O-CB 3.21Å; V204-H208 PolarHBondContact O-N 2.83Å; K205-H208 WeakPolarHBondContact O-CB 3.45Å; K205-H208 PolarHBondContact O-N 3.24Å; E206-H208 VanDerWaalsContact C-N 3.34Å; E206-H208 PolarHBondContact O-N 3.49Å; H208-S211 WeakPolarHBondContact O-CB 3.26Å; H208-S211 PolarHBondContact O-N 2.99Å; H208-M212 WeakPolarHBondContact O-CG 3.35Å; H208-M212 PolarHBondContact O-N 2.98Å |
| 209 | E | 97.1 | Very high | 94.4 | Very high | 140 Ų | 140 | 101.8 Ų | 101.8 | 65% | 0.654 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.7 | -48.1 | 178.3 | -171.2 | 166.2 | -155.9 | 0 | 0 | 111.9 | K205 E206 S211 M212 E213 | K205-E209 PolarHBondContact O-N 2.92Å; E206-E209 PolarHBondContact O-N 3.36Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.43Å; E209-M212 PolarHBondContact O-N 3.37Å; E209-E213 PolarHBondContact O-N 2.95Å |
| 210 | K | 96.5 | Very high | 92.7 | Very high | 112 Ų | 112 | 101.3 Ų | 101.3 | 49% | 0.487 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.3 | -40.4 | 174.4 | -72.6 | 176.6 | -175.3 | 167.5 | 0 | 112.5 | E206 E213 V214 | E206-K210 WeakPolarHBondContact O-CG 3.25Å; E206-K210 PolarHBondContact O-N 2.74Å; E206-K210 VanDerWaalsContact OE1-CE 3.25Å; E206-K210 WeakPolarHBondContact OE1-CE 3.37Å; E206-K210 IonicContact OE1-NZ 2.64Å; E206-K210 PolarHBondContact OE1-NZ 3.21Å; K210-E213 PolarHBondContact O-N 3.02Å; K210-V214 WeakPolarHBondContact O-CG2 3.44Å; K210-V214 PolarHBondContact O-N 2.94Å |
| 211 | S | 96 | Very high | 90.7 | Very high | 68 Ų | 68 | 105.9 Ų | 105.9 | 48% | 0.476 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.6 | -43 | 178.3 | -61.1 | 0 | 0 | 0 | 0 | 111.5 | M207 H208 E209 V214 L215 | M207-S211 WeakPolarHBondContact O-CB 3.47Å; M207-S211 PolarHBondContact O-N 3.46Å; M207-S211 PolarHBondContact O-OG 3.22Å; H208-S211 WeakPolarHBondContact O-CB 3.26Å; H208-S211 PolarHBondContact O-N 2.99Å; E209-S211 VanDerWaalsContact C-N 3.31Å; E209-S211 PolarHBondContact O-N 3.43Å; S211-V214 PolarHBondContact O-N 2.97Å; S211-L215 WeakPolarHBondContact O-CG 3.27Å; S211-L215 PolarHBondContact O-N 2.94Å; S211-L215 VanDerWaalsContact O-N 3.1Å |
| 212 | M | 95.5 | Very high | 88.3 | Confident | 78 Ų | 78 | 115.1 Ų | 115.1 | 38% | 0.384 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.8 | -41.9 | 176 | -73.3 | -63.2 | -62 | 0 | 0 | 112.1 | H208 E209 L215 M216 | H208-M212 WeakPolarHBondContact O-CG 3.35Å; H208-M212 PolarHBondContact O-N 2.98Å; E209-M212 PolarHBondContact O-N 3.37Å; M212-L215 PolarHBondContact O-N 3.31Å; M212-M216 HydrophobicContact CE-CE 4.11Å; M212-M216 WeakPolarHBondContact O-CG 3.48Å; M212-M216 PolarHBondContact O-N 3.19Å |
| 213 | E | 95.3 | Very high | 87.8 | Confident | 119 Ų | 119 | 114.2 Ų | 114.2 | 56% | 0.556 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -60.6 | -45.3 | 176.5 | -175.6 | 178.8 | -170 | 0 | 0 | 111.9 | E209 K210 L215 M216 N217 | E209-E213 PolarHBondContact O-N 2.95Å; K210-E213 PolarHBondContact O-N 3.02Å; E213-L215 VanDerWaalsContact C-N 3.33Å; E213-L215 PolarHBondContact O-N 3.12Å; E213-M216 PolarHBondContact O-N 2.99Å; E213-N217 WeakPolarHBondContact O-CB 3.41Å; E213-N217 VanDerWaalsContact O-CG 3.3Å; E213-N217 PolarHBondContact O-N 3.13Å; E213-N217 PolarHBondContact O-ND2 3.12Å; E213-N217 VanDerWaalsContact O-ND2 3.14Å |
| 214 | V | 95 | Very high | 87.3 | Confident | 86 Ų | 86 | 117.6 Ų | 117.6 | 52% | 0.521 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -58.5 | -45.3 | 175 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | K210 S211 N217 L218 | K210-V214 WeakPolarHBondContact O-CG2 3.44Å; K210-V214 PolarHBondContact O-N 2.94Å; S211-V214 PolarHBondContact O-N 2.97Å; V214-N217 PolarHBondContact O-N 3.13Å; V214-L218 HydrophobicContact CG1-CD1 3.94Å; V214-L218 VanDerWaalsContact O-CD1 3.22Å; V214-L218 WeakPolarHBondContact O-CD1 3.39Å; V214-L218 PolarHBondContact O-N 3.43Å; V214-L218 VanDerWaalsContact O-N 3.12Å |
| 215 | L | 92.4 | Very high | 86.6 | Confident | 115 Ų | 115 | 119.8 Ų | 119.8 | 60% | 0.602 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.6 | -42.9 | 178.7 | -71.4 | 172.1 | 0 | 0 | 0 | 112.4 | S211 M212 E213 L218 G219 | S211-L215 WeakPolarHBondContact O-CG 3.27Å; S211-L215 PolarHBondContact O-N 2.94Å; S211-L215 VanDerWaalsContact O-N 3.1Å; M212-L215 PolarHBondContact O-N 3.31Å; E213-L215 VanDerWaalsContact C-N 3.33Å; E213-L215 PolarHBondContact O-N 3.12Å; L215-L218 PolarHBondContact O-N 3.28Å; L215-G219 PolarHBondContact O-N 3.33Å |
| 216 | M | 90.8 | Very high | 86 | Confident | 126 Ų | 126 | 119.3 Ų | 119.3 | 62% | 0.621 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -62.6 | -44.9 | 176.9 | -71.9 | -174.2 | -173.2 | 0 | 0 | 111.7 | M212 E213 L218 G219 T220 | M212-M216 HydrophobicContact CE-CE 4.11Å; M212-M216 WeakPolarHBondContact O-CG 3.48Å; M212-M216 PolarHBondContact O-N 3.19Å; E213-M216 PolarHBondContact O-N 2.99Å; M216-L218 VanDerWaalsContact C-N 3.29Å; M216-L218 PolarHBondContact O-N 3.48Å; M216-G219 PolarHBondContact O-N 3.29Å; M216-G219 VanDerWaalsContact O-N 3.1Å; M216-T220 PolarHBondContact O-N 3.18Å; M216-T220 PolarHBondContact O-OG1 3.36Å |
| 217 | N | 88.9 | Confident | 85.2 | Confident | 89 Ų | 89 | 120.4 Ų | 120.4 | 48% | 0.476 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.9 | -29.7 | 179.7 | -73.4 | -33.5 | 0 | 0 | 0 | 113.3 | E213 V214 T220 | E213-N217 WeakPolarHBondContact O-CB 3.41Å; E213-N217 VanDerWaalsContact O-CG 3.3Å; E213-N217 PolarHBondContact O-N 3.13Å; E213-N217 PolarHBondContact O-ND2 3.12Å; E213-N217 VanDerWaalsContact O-ND2 3.14Å; V214-N217 PolarHBondContact O-N 3.13Å; N217-T220 PolarHBondContact O-OG1 3.4Å; N217-T220 VanDerWaalsContact O-OG1 3.05Å |
| 218 | L | 84.1 | Confident | 84.4 | Confident | 118 Ų | 118 | 120.3 Ų | 120.3 | 62% | 0.618 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -70 | -38.1 | 171.4 | -99.2 | 90.5 | 0 | 0 | 0 | 112.4 | V214 L215 M216 T220 K221 | V214-L218 HydrophobicContact CG1-CD1 3.94Å; V214-L218 VanDerWaalsContact O-CD1 3.22Å; V214-L218 WeakPolarHBondContact O-CD1 3.39Å; V214-L218 PolarHBondContact O-N 3.43Å; V214-L218 VanDerWaalsContact O-N 3.12Å; L215-L218 PolarHBondContact O-N 3.28Å; M216-L218 VanDerWaalsContact C-N 3.29Å; M216-L218 PolarHBondContact O-N 3.48Å; L218-T220 VanDerWaalsContact C-N 3.3Å; L218-T220 PolarHBondContact O-N 3.07Å; L218-K221 PolarHBondContact O-N 3.15Å |
| 219 | G | 72.5 | Confident | 83.5 | Confident | 60 Ų | 60 | 120.1 Ų | 120.1 | 62% | 0.619 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -68.5 | -24.2 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | L215 M216 | L215-G219 PolarHBondContact O-N 3.33Å; M216-G219 PolarHBondContact O-N 3.29Å; M216-G219 VanDerWaalsContact O-N 3.1Å |
| 220 | T | 62.3 | Low | 82.5 | Confident | 110 Ų | 110 | 118.6 Ų | 118.6 | 68% | 0.675 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | -2.2 | 179.9 | 42.5 | 0 | 0 | 0 | 0 | 115.2 | M216 N217 L218 | M216-T220 PolarHBondContact O-N 3.18Å; M216-T220 PolarHBondContact O-OG1 3.36Å; N217-T220 PolarHBondContact O-OG1 3.4Å; N217-T220 VanDerWaalsContact O-OG1 3.05Å; L218-T220 VanDerWaalsContact C-N 3.3Å; L218-T220 PolarHBondContact O-N 3.07Å |
| 221 | K | 55.2 | Low | 81.3 | Confident | 178 Ų | 178 | 119.2 Ų | 119.2 | 77% | 0.774 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | 15.7 | -177.8 | -88.2 | -173.7 | 176.2 | 178.8 | 0 | 115 | L218 | L218-K221 PolarHBondContact O-N 3.15Š|
| 222 | Y | 47.5 | Very low | 79.9 | Confident | 283 Ų | 283 | 123.8 Ų | 123.8 | 100% | 1.11 | 63% | 0.632 | S | S | * | * | trans | -125.8 | 0 | 172.5 | -75.8 | -81.7 | 0 | 0 | 0 | 111.1 |
Retrieved 222 of 222 residues in 195.4 ms
(Link to these results)