| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.6 | Very low | 37.1 | Very low | 245 Ų | 245 | 135.3 Ų | 135.3 | 100% | 1.207 | 88% | 0.879 | S | S | * | * | 0 | 167.6 | 0 | -74 | 155.1 | 66.4 | 0 | 0 | 108.5 | |||||
| 2 | S | 38.3 | Very low | 36.7 | Very low | 130 Ų | 130 | 129.7 Ų | 129.7 | 91% | 0.909 | 86% | 0.864 | S | S | * | * | trans | -27.8 | 148.1 | -177.7 | -43.6 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 3 | G | 32.2 | Very low | 36.3 | Very low | 76 Ų | 76 | 125.4 Ų | 125.4 | 78% | 0.784 | 86% | 0.857 | S | S | * | * | cis | 176.5 | -160.9 | 3.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 4 | A | 37.1 | Very low | 36 | Very low | 113 Ų | 113 | 128.6 Ų | 128.6 | 93% | 0.934 | 86% | 0.861 | S | S | * | * | trans | -52.3 | 163.5 | -175.8 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 5 | G | 32 | Very low | 36 | Very low | 74 Ų | 74 | 127.5 Ų | 127.5 | 76% | 0.763 | 86% | 0.856 | S | S | * | * | cis | 148.5 | 171.2 | -3.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 6 | G | 34.1 | Very low | 36.4 | Very low | 87 Ų | 87 | 126.9 Ų | 126.9 | 90% | 0.897 | 85% | 0.85 | S | S | * | * | trans | 75.6 | 143 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 7 | G | 33.6 | Very low | 36.5 | Very low | 73 Ų | 73 | 127.1 Ų | 127.1 | 75% | 0.753 | 85% | 0.85 | S | S | * | * | cis | 137.7 | 109.8 | -10.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 8 | K | 38.4 | Very low | 36.3 | Very low | 214 Ų | 214 | 123.8 Ų | 123.8 | 93% | 0.93 | 84% | 0.841 | S | S | * | * | trans | -176.8 | 121.3 | 152.2 | -105.3 | 162.3 | -176 | -178.6 | 0 | 113.8 | ||||
| 9 | R | 41.5 | Very low | 36.4 | Very low | 240 Ų | 240 | 123.8 Ų | 123.8 | 91% | 0.906 | 84% | 0.839 | S | S | * | * | trans | -130.4 | 173.5 | 151.4 | -88.8 | -171 | 177.2 | -168.7 | -0.6 | 105.3 | ||||
| 10 | P | 46.5 | Very low | 36.6 | Very low | 120 Ų | 120 | 123.7 Ų | 123.7 | 78% | 0.779 | 84% | 0.837 | S | S | * | * | cis | -95.4 | -155.8 | 7.4 | 44.6 | -38.5 | 0 | 0 | 0 | 111.2 | ||||
| 11 | S | 36.7 | Very low | 36.4 | Very low | 116 Ų | 116 | 126.3 Ų | 126.3 | 81% | 0.811 | 84% | 0.837 | S | S | * | * | cis | -151.8 | 175.8 | 4.2 | -128.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 12 | G | 31.8 | Very low | 36.2 | Very low | 68 Ų | 68 | 123.6 Ų | 123.6 | 70% | 0.701 | 82% | 0.818 | S | S | * | * | cis | 145 | 116.5 | -5.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 13 | G | 32.1 | Very low | 36 | Very low | 74 Ų | 74 | 126.8 Ų | 126.8 | 76% | 0.763 | 82% | 0.815 | S | S | * | * | trans | 83.4 | 140.3 | -166.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 14 | D | 32.6 | Very low | 36.2 | Very low | 171 Ų | 171 | 127.7 Ų | 127.7 | 91% | 0.914 | 81% | 0.81 | S | S | * | * | cis | -141.1 | 171 | -3 | -117.4 | -40.3 | 0 | 0 | 0 | 111.2 | ||||
| 15 | S | 35.5 | Very low | 35.9 | Very low | 112 Ų | 112 | 131.5 Ų | 131.5 | 78% | 0.783 | 81% | 0.805 | S | S | * | * | trans | -104.6 | 166 | 179.6 | -55.3 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 16 | P | 42.8 | Very low | 36 | Very low | 117 Ų | 117 | 137.5 Ų | 137.5 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | cis | -124.9 | -178.4 | -8.3 | 41.4 | -27.2 | 0 | 0 | 0 | 113.6 | ||||
| 17 | P | 36.9 | Very low | 36 | Very low | 131 Ų | 131 | 140.1 Ų | 140.1 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | -131 | 161.3 | 124.2 | 21.9 | -4.5 | 0 | 0 | 0 | 113.3 | |||||
| 18 | G | 34 | Very low | 36.3 | Very low | 67 Ų | 67 | 145.6 Ų | 145.6 | 69% | 0.691 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 158.3 | -168.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 19 | P | 38.5 | Very low | 36.1 | Very low | 124 Ų | 124 | 142.7 Ų | 142.7 | 81% | 0.805 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 142.2 | 179 | 32.1 | -34.5 | 0 | 0 | 0 | 112.2 | ||
| 20 | P | 39.8 | Very low | 35.9 | Very low | 122 Ų | 122 | 137 Ų | 137 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -71 | 159.7 | 173.5 | 30.6 | -35.3 | 0 | 0 | 0 | 112.4 | K22 | P20-K22 PolarHBondContact O-N 2.83Š|
| 21 | E | 32.7 | Very low | 35.5 | Very low | 179 Ų | 179 | 137.1 Ų | 137.1 | 84% | 0.836 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 125.5 | -167.9 | -57.1 | 177.4 | 135.4 | 0 | 0 | 113.7 | K23 | E21-K23 PolarHBondContact O-N 3.42Å; E21-K23 VanDerWaalsContact O-N 3.14Å |
| 22 | K | 33.9 | Very low | 35.8 | Very low | 188 Ų | 188 | 137.3 Ų | 137.3 | 82% | 0.817 | 78% | 0.78 | S | S | * | * | trans | -78.1 | 95.3 | 165.8 | -77.4 | -176.4 | 176 | 176.5 | 0 | 109.7 | P20 S24 | P20-K22 PolarHBondContact O-N 2.83Å; K22-S24 PolarHBondContact O-N 3.41Å | ||
| 23 | K | 34.1 | Very low | 36.4 | Very low | 196 Ų | 196 | 138.4 Ų | 138.4 | 85% | 0.852 | 77% | 0.773 | S | S | * | * | trans | -65.1 | 78.1 | 155.9 | -76.7 | -165 | 174.5 | -171.7 | 0 | 109.4 | E21 K25 | E21-K23 PolarHBondContact O-N 3.42Å; E21-K23 VanDerWaalsContact O-N 3.14Å; K23-K25 PolarHBondContact O-N 2.96Å | ||
| 24 | S | 34.6 | Very low | 36.9 | Very low | 95 Ų | 95 | 142.7 Ų | 142.7 | 66% | 0.664 | 78% | 0.777 | S | S | * | * | trans | -71.9 | 78 | 175.8 | -73.1 | 0 | 0 | 0 | 0 | 109.8 | K22 K26 | K22-S24 PolarHBondContact O-N 3.41Å; S24-K26 PolarHBondContact O-N 3.18Å | ||
| 25 | K | 32.5 | Very low | 37.9 | Very low | 194 Ų | 194 | 139.4 Ų | 139.4 | 84% | 0.843 | 76% | 0.759 | S | S | * | * | trans | -60.5 | 89.6 | 167.5 | -170.4 | 177.5 | -174 | 179.5 | 0 | 107.8 | K23 E27 | K23-K25 PolarHBondContact O-N 2.96Å; K25-E27 PolarHBondContact O-N 2.87Å | ||
| 26 | K | 34.3 | Very low | 38.5 | Very low | 200 Ų | 200 | 142.1 Ų | 142.1 | 87% | 0.87 | 76% | 0.759 | S | S | * | * | trans | -72.6 | 84.8 | -178.9 | -173 | -174.3 | 179.1 | -170 | 0 | 107.4 | S24 E28 | S24-K26 PolarHBondContact O-N 3.18Å; K26-E28 PolarHBondContact O-N 3.33Å | ||
| 27 | E | 34.1 | Very low | 38.7 | Very low | 142 Ų | 142 | 142.5 Ų | 142.5 | 66% | 0.664 | 76% | 0.762 | S | S | * | * | trans | -44.6 | 128.5 | 167.4 | -65.4 | 178.8 | 137 | 0 | 0 | 108.6 | K25 K29 | K25-E27 PolarHBondContact O-N 2.87Å; E27-K29 PolarHBondContact O-N 2.66Å | ||
| 28 | E | 38 | Very low | 39.4 | Very low | 187 Ų | 187 | 142.9 Ų | 142.9 | 87% | 0.874 | 76% | 0.755 | S | S | * | * | trans | -70.9 | 82.3 | 175.5 | -169.6 | 176.3 | -172.1 | 0 | 0 | 108.4 | K26 T30 | K26-E28 PolarHBondContact O-N 3.33Å; E28-T30 PolarHBondContact O-N 2.7Å | ||
| 29 | K | 35.4 | Very low | 40.3 | Very low | 153 Ų | 153 | 151.1 Ų | 151.1 | 67% | 0.665 | 77% | 0.766 | S | S | * | * | trans | -66.5 | 92 | 171.4 | -73.1 | -174.9 | 177.6 | -179.7 | 0 | 107.4 | E27 T31 | E27-K29 PolarHBondContact O-N 2.66Å; K29-T31 VanDerWaalsContact C-N 3.32Å; K29-T31 PolarHBondContact O-N 3.09Å; K29-T31 PolarHBondContact O-OG1 3.15Å | ||
| 30 | T | 36.7 | Very low | 41 | Very low | 122 Ų | 122 | 150.9 Ų | 150.9 | 75% | 0.748 | 76% | 0.756 | S | S | * | * | trans | -37.5 | 103 | 157.1 | 40.1 | 0 | 0 | 0 | 0 | 107.2 | E28 T32 | E28-T30 PolarHBondContact O-N 2.7Å; T30-T32 PolarHBondContact O-N 3.24Å | ||
| 31 | T | 38.3 | Very low | 41.8 | Very low | 122 Ų | 122 | 149 Ų | 149 | 75% | 0.748 | 75% | 0.75 | S | S | * | * | trans | -80.1 | 77.9 | -170.3 | -64.9 | 0 | 0 | 0 | 0 | 106.9 | K29 T33 | K29-T31 VanDerWaalsContact C-N 3.32Å; K29-T31 PolarHBondContact O-N 3.09Å; K29-T31 PolarHBondContact O-OG1 3.15Å; T31-T33 HydrophobicContact CG2-CG2 4.33Å; T31-T33 PolarHBondContact O-N 2.88Å | ||
| 32 | T | 44 | Very low | 42.7 | Very low | 120 Ų | 120 | 143.7 Ų | 143.7 | 74% | 0.736 | 75% | 0.745 | S | S | * | * | trans | -60.1 | 90.6 | 166.2 | 177.4 | 0 | 0 | 0 | 0 | 106.7 | T30 L34 | T30-T32 PolarHBondContact O-N 3.24Å; T32-L34 PolarHBondContact O-N 3.47Å | ||
| 33 | T | 44 | Very low | 43.4 | Very low | 91 Ų | 91 | 136.9 Ų | 136.9 | 56% | 0.558 | 72% | 0.719 | S | S | * | * | trans | -61.5 | 104 | 172.9 | 48.9 | 0 | 0 | 0 | 0 | 106.2 | T31 I35 | T31-T33 HydrophobicContact CG2-CG2 4.33Å; T31-T33 PolarHBondContact O-N 2.88Å; T33-I35 VanDerWaalsContact C-N 3.25Å; T33-I35 PolarHBondContact O-N 2.79Å | ||
| 34 | L | 42.4 | Very low | 44.6 | Very low | 163 Ų | 163 | 132.5 Ų | 132.5 | 85% | 0.853 | 71% | 0.713 | S | S | * | * | trans | -59.5 | 92.3 | 172.4 | -96.8 | 161.2 | 0 | 0 | 0 | 108 | T32 E36 | T32-L34 PolarHBondContact O-N 3.47Å; L34-E36 PolarHBondContact O-N 2.91Å; L34-E36 VanDerWaalsContact O-N 3.09Å | ||
| 35 | I | 53.1 | Low | 46.4 | Very low | 103 Ų | 103 | 130.6 Ų | 130.6 | 53% | 0.528 | 70% | 0.699 | S | S | . | * | trans | -65 | 109.8 | 170 | -64.4 | 171.8 | 0 | 0 | 0 | 105.4 | T33 F56 | T33-I35 VanDerWaalsContact C-N 3.25Å; T33-I35 PolarHBondContact O-N 2.79Å; I35-F56 HydrophobicContact CD1-CE2 4.46Å; I35-F56 HydrophobicContact CD1-CZ 4.17Å | ||
| 36 | E | 49.1 | Very low | 48.7 | Very low | 168 Ų | 168 | 126.3 Ų | 126.3 | 79% | 0.785 | 69% | 0.689 | S | S | * | * | trans | -51.9 | 136.2 | 169.2 | -68.3 | -165.8 | 128.6 | 0 | 0 | 108.7 | L34 I38 | L34-E36 PolarHBondContact O-N 2.91Å; L34-E36 VanDerWaalsContact O-N 3.09Å; E36-I38 VanDerWaalsContact C-N 3.32Å; E36-I38 PolarHBondContact O-N 3.17Å | ||
| 37 | P | 47 | Very low | 50.9 | Low | 126 Ų | 126 | 123.9 Ų | 123.9 | 82% | 0.818 | 68% | 0.681 | S | S | * | * | trans | -61.3 | 91.2 | -178 | -26.7 | 36.2 | 0 | 0 | 0 | 112.2 | R39 | P37-R39 PolarHBondContact O-N 2.92Š| ||
| 38 | I | 51.8 | Low | 53 | Low | 139 Ų | 139 | 120.4 Ų | 120.4 | 71% | 0.713 | 67% | 0.665 | S | S | * | * | trans | -57.2 | 111.6 | 174 | -60.1 | 178.3 | 0 | 0 | 0 | 106.4 | E36 I40 | E36-I38 VanDerWaalsContact C-N 3.32Å; E36-I38 PolarHBondContact O-N 3.17Å; I38-I40 PolarHBondContact O-N 2.91Å | ||
| 39 | R | 52.7 | Low | 55.1 | Low | 240 Ų | 240 | 116 Ų | 116 | 91% | 0.906 | 65% | 0.645 | S | S | * | * | trans | -64 | 101.8 | 173.5 | -66.5 | -173.2 | -177.1 | -154.9 | 1.9 | 107.2 | P37 A41 | P37-R39 PolarHBondContact O-N 2.92Å; R39-A41 VanDerWaalsContact C-N 3.27Å; R39-A41 PolarHBondContact O-N 3.42Å | ||
| 40 | I | 52.2 | Low | 57.5 | Low | 119 Ų | 119 | 113.2 Ų | 113.2 | 61% | 0.61 | 64% | 0.638 | S | S | * | * | trans | -63.6 | 96.3 | 170.6 | -57.3 | 178.5 | 0 | 0 | 0 | 106.2 | I38 G42 V43 | I38-I40 PolarHBondContact O-N 2.91Å; I40-G42 PolarHBondContact O-N 3.28Å; I40-V43 HydrophobicContact CG2-CG1 4.04Å | ||
| 41 | A | 56.6 | Low | 60 | Low | 81 Ų | 81 | 112.3 Ų | 112.3 | 67% | 0.669 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -53 | 135.1 | 165.9 | 0 | 0 | 0 | 0 | 0 | 107.6 | R39 V43 | R39-A41 VanDerWaalsContact C-N 3.27Å; R39-A41 PolarHBondContact O-N 3.42Å; A41-V43 PolarHBondContact O-N 2.94Å |
| 42 | G | 51.2 | Low | 62.4 | Low | 69 Ų | 69 | 111.1 Ų | 111.1 | 71% | 0.711 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 120.2 | -160 | 0 | 0 | 0 | 0 | 0 | 112.8 | I40 S44 | I40-G42 PolarHBondContact O-N 3.28Å; G42-S44 PolarHBondContact O-N 3.31Å |
| 43 | V | 48.9 | Very low | 64.7 | Low | 45 Ų | 45 | 108.2 Ų | 108.2 | 27% | 0.273 | 59% | 0.593 | S | S | . | * | P | Polyproline II helix | trans | -69.5 | 123.2 | 172.6 | -82.6 | 0 | 0 | 0 | 0 | 109.1 | I40 A41 S45 E48 M49 K52 | I40-V43 HydrophobicContact CG2-CG1 4.04Å; A41-V43 PolarHBondContact O-N 2.94Å; V43-S45 VanDerWaalsContact C-N 3.27Å; V43-S45 PolarHBondContact O-N 2.99Å; V43-E48 WeakPolarHBondContact CA-OE2 3.4Å; V43-E48 HydrophobicContact CB-CB 4.31Å; V43-E48 HydrophobicContact CG1-CB 4.03Å; V43-M49 HydrophobicContact CG1-CB 4.25Å; V43-M49 HydrophobicContact CG2-CB 4.48Å; V43-M49 HydrophobicContact CG2-CE 3.81Å; V43-K52 HydrophobicContact CG1-CD 4.43Å |
| 44 | S | 59.8 | Low | 67 | Low | 104 Ų | 104 | 108.5 Ų | 108.5 | 73% | 0.727 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -73.9 | -22.2 | -176.8 | -29.4 | 0 | 0 | 0 | 0 | 112.4 | G42 E48 | G42-S44 PolarHBondContact O-N 3.31Å; S44-E48 WeakPolarHBondContact CB-OE1 3.12Å; S44-E48 PolarHBondContact N-OE2 3.3Å; S44-E48 PolarHBondContact OG-OE1 2.94Å; S44-E48 PolarHBondContact OG-OE2 2.82Å |
| 45 | S | 72.8 | Confident | 69.3 | Low | 55 Ų | 55 | 106.4 Ų | 106.4 | 39% | 0.385 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -150.1 | 153.6 | -176.8 | 176.4 | 0 | 0 | 0 | 0 | 110.1 | V43 E47 E48 | V43-S45 VanDerWaalsContact C-N 3.27Å; V43-S45 PolarHBondContact O-N 2.99Å; S45-E47 PolarHBondContact O-N 3.22Å; S45-E47 WeakPolarHBondContact OG-CB 3.34Å; S45-E47 PolarHBondContact OG-N 3.5Å; S45-E48 PolarHBondContact O-N 3.21Å; S45-E48 VanDerWaalsContact O-N 3.15Å |
| 46 | T | 79.9 | Confident | 71.2 | Confident | 103 Ų | 103 | 107 Ų | 107 | 63% | 0.632 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -51.5 | -38.2 | 167.6 | -49.4 | 0 | 0 | 0 | 0 | 111.3 | E48 M49 D50 | T46-E48 VanDerWaalsContact C-N 3.3Å; T46-E48 PolarHBondContact O-N 3.47Å; T46-M49 WeakPolarHBondContact O-CA 3.3Å; T46-M49 WeakPolarHBondContact O-CB 3.39Å; T46-M49 PolarHBondContact O-N 2.96Å; T46-D50 PolarHBondContact O-N 2.95Å |
| 47 | E | 80.2 | Confident | 73.3 | Confident | 150 Ų | 150 | 104.9 Ų | 104.9 | 70% | 0.701 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -61.2 | -34.2 | -179.1 | -164.5 | 168 | -151.1 | 0 | 0 | 112.8 | S45 M51 | S45-E47 PolarHBondContact O-N 3.22Å; S45-E47 WeakPolarHBondContact OG-CB 3.34Å; S45-E47 PolarHBondContact OG-N 3.5Å; E47-M51 VanDerWaalsContact O-CB 3.26Å; E47-M51 WeakPolarHBondContact O-CB 3.44Å; E47-M51 PolarHBondContact O-N 2.99Å |
| 48 | E | 79.8 | Confident | 75.4 | Confident | 69 Ų | 69 | 103.1 Ų | 103.1 | 32% | 0.322 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -71.3 | -30.5 | 172.5 | -65.4 | -177.2 | -176 | 0 | 0 | 112.9 | V43 S44 S45 T46 K52 | V43-E48 WeakPolarHBondContact CA-OE2 3.4Å; V43-E48 HydrophobicContact CB-CB 4.31Å; V43-E48 HydrophobicContact CG1-CB 4.03Å; S44-E48 WeakPolarHBondContact CB-OE1 3.12Å; S44-E48 PolarHBondContact N-OE2 3.3Å; S44-E48 PolarHBondContact OG-OE1 2.94Å; S44-E48 PolarHBondContact OG-OE2 2.82Å; S45-E48 PolarHBondContact O-N 3.21Å; S45-E48 VanDerWaalsContact O-N 3.15Å; T46-E48 VanDerWaalsContact C-N 3.3Å; T46-E48 PolarHBondContact O-N 3.47Å; E48-K52 WeakPolarHBondContact O-CD 3.39Å; E48-K52 VanDerWaalsContact O-CG 3.3Å; E48-K52 WeakPolarHBondContact O-CG 3.39Å; E48-K52 PolarHBondContact O-N 3.5Å |
| 49 | M | 81.3 | Confident | 77.5 | Confident | 94 Ų | 94 | 103 Ų | 103 | 46% | 0.463 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -72.2 | -48.9 | 175.9 | -169.7 | -173.6 | -61.7 | 0 | 0 | 109.9 | V43 T46 M51 K52 V53 | V43-M49 HydrophobicContact CG1-CB 4.25Å; V43-M49 HydrophobicContact CG2-CB 4.48Å; V43-M49 HydrophobicContact CG2-CE 3.81Å; T46-M49 WeakPolarHBondContact O-CA 3.3Å; T46-M49 WeakPolarHBondContact O-CB 3.39Å; T46-M49 PolarHBondContact O-N 2.96Å; M49-M51 VanDerWaalsContact C-N 3.32Å; M49-M51 PolarHBondContact O-N 3.23Å; M49-K52 PolarHBondContact O-N 3.44Å; M49-V53 WeakPolarHBondContact O-CG2 3.32Å; M49-V53 PolarHBondContact O-N 3.43Å |
| 50 | D | 85.9 | Confident | 79.5 | Confident | 95 Ų | 95 | 94.9 Ų | 94.9 | 51% | 0.508 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.7 | -41.5 | 178.3 | -74.4 | -35.5 | 0 | 0 | 0 | 111.4 | T46 K52 V53 L54 | T46-D50 PolarHBondContact O-N 2.95Å; D50-K52 PolarHBondContact O-N 2.82Å; D50-V53 PolarHBondContact O-N 2.74Å; D50-L54 WeakPolarHBondContact O-CB 3.43Å; D50-L54 PolarHBondContact O-N 2.82Å |
| 51 | M | 89.1 | Confident | 81.5 | Confident | 103 Ų | 103 | 93.7 Ų | 93.7 | 51% | 0.507 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -57.9 | -46 | 174 | -171.5 | 61.1 | 63.1 | 0 | 0 | 112.3 | E47 M49 L54 Q55 | E47-M51 VanDerWaalsContact O-CB 3.26Å; E47-M51 WeakPolarHBondContact O-CB 3.44Å; E47-M51 PolarHBondContact O-N 2.99Å; M49-M51 VanDerWaalsContact C-N 3.32Å; M49-M51 PolarHBondContact O-N 3.23Å; M51-L54 PolarHBondContact O-N 2.75Å; M51-Q55 VanDerWaalsContact O-CG 3.29Å; M51-Q55 WeakPolarHBondContact O-CG 3.26Å; M51-Q55 PolarHBondContact O-N 3.47Å |
| 52 | K | 88 | Confident | 83.3 | Confident | 97 Ų | 97 | 92.9 Ų | 92.9 | 42% | 0.422 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.2 | -37.7 | 177 | -73.1 | 166.4 | -175 | 160.7 | 0 | 112.1 | V43 E48 M49 D50 Q55 F56 | V43-K52 HydrophobicContact CG1-CD 4.43Å; E48-K52 WeakPolarHBondContact O-CD 3.39Å; E48-K52 VanDerWaalsContact O-CG 3.3Å; E48-K52 WeakPolarHBondContact O-CG 3.39Å; E48-K52 PolarHBondContact O-N 3.5Å; M49-K52 PolarHBondContact O-N 3.44Å; D50-K52 PolarHBondContact O-N 2.82Å; K52-Q55 PolarHBondContact O-N 2.78Å; K52-F56 WeakPolarHBondContact O-CB 3.21Å; K52-F56 PolarHBondContact O-N 3.5Å |
| 53 | V | 92.6 | Very high | 85.3 | Confident | 58 Ų | 58 | 92 Ų | 92 | 35% | 0.352 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.1 | -39.1 | 174.4 | 170.1 | 0 | 0 | 0 | 0 | 111.2 | M49 D50 F56 K57 | M49-V53 WeakPolarHBondContact O-CG2 3.32Å; M49-V53 PolarHBondContact O-N 3.43Å; D50-V53 PolarHBondContact O-N 2.74Å; V53-F56 PolarHBondContact O-N 2.88Å; V53-K57 HydrophobicContact CG1-CD 4Å; V53-K57 WeakPolarHBondContact O-CB 3.41Å; V53-K57 VanDerWaalsContact O-CG 3.28Å; V53-K57 WeakPolarHBondContact O-CG 3.29Å; V53-K57 PolarHBondContact O-N 2.82Å |
| 54 | L | 93.7 | Very high | 87.5 | Confident | 97 Ų | 97 | 96.9 Ų | 96.9 | 51% | 0.508 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.1 | -45.2 | 176.1 | -144.6 | 79.5 | 0 | 0 | 0 | 111.3 | D50 M51 F56 K57 N58 | D50-L54 WeakPolarHBondContact O-CB 3.43Å; D50-L54 PolarHBondContact O-N 2.82Å; M51-L54 PolarHBondContact O-N 2.75Å; L54-F56 PolarHBondContact O-N 2.89Å; L54-K57 PolarHBondContact O-N 3.24Å; L54-N58 WeakPolarHBondContact O-CB 3.28Å; L54-N58 PolarHBondContact O-N 2.98Å |
| 55 | Q | 89.6 | Confident | 89.1 | Confident | 119 Ų | 119 | 97.4 Ų | 97.4 | 56% | 0.556 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59 | -44.9 | 174.9 | -73 | 170.6 | -0.6 | 0 | 0 | 112 | M51 K52 N58 K59 | M51-Q55 VanDerWaalsContact O-CG 3.29Å; M51-Q55 WeakPolarHBondContact O-CG 3.26Å; M51-Q55 PolarHBondContact O-N 3.47Å; K52-Q55 PolarHBondContact O-N 2.78Å; Q55-N58 PolarHBondContact O-N 2.97Å; Q55-K59 PolarHBondContact O-N 3.27Å |
| 56 | F | 92.2 | Very high | 90.2 | Very high | 115 Ų | 115 | 100.7 Ų | 100.7 | 50% | 0.504 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.7 | -41.5 | 177 | -175.8 | -95.5 | 0 | 0 | 0 | 112.5 | I35 K52 V53 L54 K59 K60 | I35-F56 HydrophobicContact CD1-CE2 4.46Å; I35-F56 HydrophobicContact CD1-CZ 4.17Å; K52-F56 WeakPolarHBondContact O-CB 3.21Å; K52-F56 PolarHBondContact O-N 3.5Å; V53-F56 PolarHBondContact O-N 2.88Å; L54-F56 PolarHBondContact O-N 2.89Å; F56-K59 PolarHBondContact O-N 3.16Å; F56-K60 HydrophobicContact CE1-CG 4.03Å; F56-K60 HydrophobicContact CZ-CG 4.12Å; F56-K60 PolarHBondContact O-N 2.86Å |
| 57 | K | 93.6 | Very high | 90.9 | Very high | 125 Ų | 125 | 101.7 Ų | 101.7 | 54% | 0.543 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.7 | -45.9 | 174.6 | -76.8 | 170.7 | 179.3 | 173.5 | 0 | 111.5 | V53 L54 K60 L61 | V53-K57 HydrophobicContact CG1-CD 4Å; V53-K57 WeakPolarHBondContact O-CB 3.41Å; V53-K57 VanDerWaalsContact O-CG 3.28Å; V53-K57 WeakPolarHBondContact O-CG 3.29Å; V53-K57 PolarHBondContact O-N 2.82Å; L54-K57 PolarHBondContact O-N 3.24Å; K57-K60 CarbonylContact O-C 3.5Å; K57-K60 PolarHBondContact O-N 3.01Å; K57-L61 WeakPolarHBondContact O-CG 3.49Å; K57-L61 PolarHBondContact O-N 3.47Å |
| 58 | N | 92.1 | Very high | 91.6 | Very high | 88 Ų | 88 | 103.6 Ų | 103.6 | 47% | 0.471 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62 | -46 | 176.4 | -78.1 | -5 | 0 | 0 | 0 | 111.4 | L54 Q55 K60 L61 C62 | L54-N58 WeakPolarHBondContact O-CB 3.28Å; L54-N58 PolarHBondContact O-N 2.98Å; Q55-N58 PolarHBondContact O-N 2.97Å; N58-K60 VanDerWaalsContact C-N 3.31Å; N58-K60 PolarHBondContact O-N 2.98Å; N58-L61 WeakPolarHBondContact O-CA 3.46Å; N58-L61 WeakPolarHBondContact O-CB 3.41Å; N58-L61 PolarHBondContact O-N 3.19Å; N58-C62 PolarHBondContact O-N 2.82Å; N58-C62 PolarHBondContact O-SG 2.64Å; N58-C62 VanDerWaalsContact O-SG 3.34Å |
| 59 | K | 94.8 | Very high | 92.4 | Very high | 136 Ų | 136 | 104.1 Ų | 104.1 | 59% | 0.591 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -57.3 | -43.7 | 174.8 | -172.1 | 178.8 | -179.8 | -176.2 | 0 | 112 | Q55 F56 L61 C62 E63 | Q55-K59 PolarHBondContact O-N 3.27Å; F56-K59 PolarHBondContact O-N 3.16Å; K59-L61 PolarHBondContact O-N 3.11Å; K59-C62 PolarHBondContact O-N 2.85Å; K59-E63 WeakPolarHBondContact CE-OE1 3.46Å; K59-E63 IonicContact NZ-OE1 3.99Å; K59-E63 WeakPolarHBondContact O-CG 3.31Å; K59-E63 PolarHBondContact O-N 3.26Å |
| 60 | K | 95.4 | Very high | 93 | Very high | 71 Ų | 71 | 102 Ų | 102 | 31% | 0.309 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.6 | -11.4 | 175.4 | -80.9 | -73 | 170.4 | -161.4 | 0 | 114.7 | F56 K57 N58 E63 R64 | F56-K60 HydrophobicContact CE1-CG 4.03Å; F56-K60 HydrophobicContact CZ-CG 4.12Å; F56-K60 PolarHBondContact O-N 2.86Å; K57-K60 CarbonylContact O-C 3.5Å; K57-K60 PolarHBondContact O-N 3.01Å; N58-K60 VanDerWaalsContact C-N 3.31Å; N58-K60 PolarHBondContact O-N 2.98Å; K60-E63 WeakPolarHBondContact CD-OE2 3.41Å; K60-E63 WeakPolarHBondContact CE-OE2 3.43Å; K60-E63 IonicContact NZ-OE2 3.39Å; K60-E63 PolarHBondContact NZ-OE2 2.98Å; K60-R64 WeakPolarHBondContact O-CG 3.41Å |
| 61 | L | 94.1 | Very high | 93.3 | Very high | 93 Ų | 93 | 102.6 Ų | 102.6 | 49% | 0.487 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -87.2 | -42.9 | 167.5 | -71.3 | 168.8 | 0 | 0 | 0 | 110.9 | K57 N58 K59 E63 R64 L65 | K57-L61 WeakPolarHBondContact O-CG 3.49Å; K57-L61 PolarHBondContact O-N 3.47Å; N58-L61 WeakPolarHBondContact O-CA 3.46Å; N58-L61 WeakPolarHBondContact O-CB 3.41Å; N58-L61 PolarHBondContact O-N 3.19Å; K59-L61 PolarHBondContact O-N 3.11Å; L61-E63 PolarHBondContact O-N 3.3Å; L61-R64 PolarHBondContact O-N 3.34Å; L61-L65 WeakPolarHBondContact O-CB 3.47Å; L61-L65 PolarHBondContact O-N 3.08Å |
| 62 | C | 94.1 | Very high | 93.6 | Very high | 64 Ų | 64 | 101.6 Ų | 101.6 | 43% | 0.432 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -54.7 | -52.2 | 171.9 | -61.6 | 0 | 0 | 0 | 0 | 111.3 | N58 K59 R64 L65 E66 | N58-C62 PolarHBondContact O-N 2.82Å; N58-C62 PolarHBondContact O-SG 2.64Å; N58-C62 VanDerWaalsContact O-SG 3.34Å; K59-C62 PolarHBondContact O-N 2.85Å; C62-R64 PolarHBondContact O-N 3.45Å; C62-R64 VanDerWaalsContact O-N 3.11Å; C62-L65 WeakPolarHBondContact O-CA 3.39Å; C62-L65 PolarHBondContact O-N 2.92Å; C62-E66 WeakPolarHBondContact O-CB 3.4Å; C62-E66 WeakPolarHBondContact O-CG 3.42Å; C62-E66 PolarHBondContact O-N 3.44Å |
| 63 | E | 93.8 | Very high | 93.9 | Very high | 52 Ų | 52 | 100.6 Ų | 100.6 | 24% | 0.243 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -56.7 | -31.2 | 178.7 | -71.1 | 172.3 | -161.9 | 0 | 0 | 113.2 | K59 K60 L61 Q67 | K59-E63 WeakPolarHBondContact CE-OE1 3.46Å; K59-E63 IonicContact NZ-OE1 3.99Å; K59-E63 WeakPolarHBondContact O-CG 3.31Å; K59-E63 PolarHBondContact O-N 3.26Å; K60-E63 WeakPolarHBondContact CD-OE2 3.41Å; K60-E63 WeakPolarHBondContact CE-OE2 3.43Å; K60-E63 IonicContact NZ-OE2 3.39Å; K60-E63 PolarHBondContact NZ-OE2 2.98Å; L61-E63 PolarHBondContact O-N 3.3Å; E63-Q67 VanDerWaalsContact O-CD 3.3Å; E63-Q67 WeakPolarHBondContact O-CG 3.2Å; E63-Q67 PolarHBondContact O-N 3.27Å |
| 64 | R | 94.5 | Very high | 94.1 | Very high | 147 Ų | 147 | 104.3 Ų | 104.3 | 56% | 0.555 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -82.5 | -30.4 | 175 | -69.8 | -175.2 | -153.2 | 140.6 | 2.3 | 113.3 | K60 L61 C62 R68 | K60-R64 WeakPolarHBondContact O-CG 3.41Å; L61-R64 PolarHBondContact O-N 3.34Å; C62-R64 PolarHBondContact O-N 3.45Å; C62-R64 VanDerWaalsContact O-N 3.11Å; R64-R68 WeakPolarHBondContact O-CG 3.38Å; R64-R68 PolarHBondContact O-N 2.86Å |
| 65 | L | 94.4 | Very high | 94.3 | Very high | 115 Ų | 115 | 104.7 Ų | 104.7 | 60% | 0.602 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -71.2 | -44.5 | 176.8 | -170.9 | 153.4 | 0 | 0 | 0 | 109.5 | L61 C62 Q67 R68 Q69 | L61-L65 WeakPolarHBondContact O-CB 3.47Å; L61-L65 PolarHBondContact O-N 3.08Å; C62-L65 WeakPolarHBondContact O-CA 3.39Å; C62-L65 PolarHBondContact O-N 2.92Å; L65-Q67 PolarHBondContact O-N 3.3Å; L65-R68 PolarHBondContact O-N 2.77Å; L65-R68 VanDerWaalsContact O-N 3.16Å; L65-Q69 WeakPolarHBondContact O-CB 3.33Å; L65-Q69 PolarHBondContact O-N 2.77Å |
| 66 | E | 94.8 | Very high | 94.6 | Very high | 123 Ų | 123 | 106.2 Ų | 106.2 | 58% | 0.575 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -55.5 | -46.5 | 170.5 | -69.5 | 158 | -157.8 | 0 | 0 | 111.6 | C62 R68 Q69 A70 | C62-E66 WeakPolarHBondContact O-CB 3.4Å; C62-E66 WeakPolarHBondContact O-CG 3.42Å; C62-E66 PolarHBondContact O-N 3.44Å; E66-R68 PolarHBondContact O-N 3.43Å; E66-Q69 PolarHBondContact O-N 3Å; E66-A70 PolarHBondContact O-N 2.86Å |
| 67 | Q | 95.6 | Very high | 94.7 | Very high | 125 Ų | 125 | 105.4 Ų | 105.4 | 58% | 0.584 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.9 | -38.6 | 175.2 | -77.1 | 168.9 | -0.1 | 0 | 0 | 113.2 | E63 L65 M71 | E63-Q67 VanDerWaalsContact O-CD 3.3Å; E63-Q67 WeakPolarHBondContact O-CG 3.2Å; E63-Q67 PolarHBondContact O-N 3.27Å; L65-Q67 PolarHBondContact O-N 3.3Å; Q67-M71 WeakPolarHBondContact O-CG 3.47Å; Q67-M71 PolarHBondContact O-N 3.24Å |
| 68 | R | 95.2 | Very high | 94.9 | Very high | 190 Ų | 190 | 105.6 Ų | 105.6 | 72% | 0.717 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -69 | -42.5 | 175.1 | -81.5 | -174.7 | 171.4 | -162.4 | -4 | 112 | R64 L65 E66 M71 E72 | R64-R68 WeakPolarHBondContact O-CG 3.38Å; R64-R68 PolarHBondContact O-N 2.86Å; L65-R68 PolarHBondContact O-N 2.77Å; L65-R68 VanDerWaalsContact O-N 3.16Å; E66-R68 PolarHBondContact O-N 3.43Å; R68-M71 HydrophobicContact CG-CE 4.35Å; R68-M71 PolarHBondContact O-N 2.91Å; R68-E72 WeakPolarHBondContact O-CB 3.37Å; R68-E72 PolarHBondContact O-N 2.95Å |
| 69 | Q | 95.4 | Very high | 95 | Very high | 80 Ų | 80 | 105.8 Ų | 105.8 | 37% | 0.374 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.5 | -46.8 | 177.7 | -168 | 63.7 | 58.7 | 0 | 0 | 110.5 | L65 E66 M71 E72 D73 | L65-Q69 WeakPolarHBondContact O-CB 3.33Å; L65-Q69 PolarHBondContact O-N 2.77Å; E66-Q69 PolarHBondContact O-N 3Å; Q69-M71 PolarHBondContact O-N 3.14Å; Q69-E72 CarbonylContact O-C 3.56Å; Q69-E72 WeakPolarHBondContact O-CB 3.41Å; Q69-E72 PolarHBondContact O-N 2.87Å; Q69-D73 PolarHBondContact NE2-OD1 3.08Å; Q69-D73 WeakPolarHBondContact O-CB 3.47Å; Q69-D73 PolarHBondContact O-N 3.46Å |
| 70 | A | 94.1 | Very high | 95.1 | Very high | 49 Ų | 49 | 103.5 Ų | 103.5 | 41% | 0.405 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.7 | -43.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | E66 D73 E74 | E66-A70 PolarHBondContact O-N 2.86Å; A70-D73 PolarHBondContact O-N 2.97Å; A70-E74 WeakPolarHBondContact O-CB 3.31Å; A70-E74 WeakPolarHBondContact O-CG 3.32Å; A70-E74 PolarHBondContact O-N 3.43Å |
| 71 | M | 92.8 | Very high | 95.1 | Very high | 107 Ų | 107 | 105.5 Ų | 105.5 | 53% | 0.527 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.3 | -33.4 | 174.9 | -68.7 | -175.1 | -62.6 | 0 | 0 | 112.8 | Q67 R68 Q69 L75 | Q67-M71 WeakPolarHBondContact O-CG 3.47Å; Q67-M71 PolarHBondContact O-N 3.24Å; R68-M71 HydrophobicContact CG-CE 4.35Å; R68-M71 PolarHBondContact O-N 2.91Å; Q69-M71 PolarHBondContact O-N 3.14Å; M71-L75 WeakPolarHBondContact O-CB 3.46Å; M71-L75 VanDerWaalsContact O-CG 3.23Å; M71-L75 WeakPolarHBondContact O-CG 3.41Å; M71-L75 PolarHBondContact O-N 2.93Å |
| 72 | E | 94.8 | Very high | 95.1 | Very high | 82 Ų | 82 | 105.8 Ų | 105.8 | 38% | 0.383 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.4 | -41.8 | 175.2 | -164.3 | -174.8 | 126.9 | 0 | 0 | 111 | R68 Q69 L75 R76 | R68-E72 WeakPolarHBondContact O-CB 3.37Å; R68-E72 PolarHBondContact O-N 2.95Å; Q69-E72 CarbonylContact O-C 3.56Å; Q69-E72 WeakPolarHBondContact O-CB 3.41Å; Q69-E72 PolarHBondContact O-N 2.87Å; E72-L75 PolarHBondContact O-N 3.46Å; E72-R76 WeakPolarHBondContact O-CB 3.17Å; E72-R76 WeakPolarHBondContact O-CG 3.37Å; E72-R76 PolarHBondContact O-N 2.87Å; E72-R76 IonicContact OE1-CZ 3.01Å; E72-R76 IonicContact OE1-NE 3.56Å; E72-R76 PolarHBondContact OE1-NE 3.23Å; E72-R76 IonicContact OE1-NH2 2.62Å; E72-R76 PolarHBondContact OE1-NH2 2.97Å |
| 73 | D | 94.9 | Very high | 95 | Very high | 77 Ų | 77 | 108.2 Ų | 108.2 | 41% | 0.412 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.3 | -42.3 | 177.4 | -61.2 | -18.9 | 0 | 0 | 0 | 111.1 | Q69 A70 L75 R76 E77 | Q69-D73 PolarHBondContact NE2-OD1 3.08Å; Q69-D73 WeakPolarHBondContact O-CB 3.47Å; Q69-D73 PolarHBondContact O-N 3.46Å; A70-D73 PolarHBondContact O-N 2.97Å; D73-L75 VanDerWaalsContact C-N 3.33Å; D73-L75 PolarHBondContact O-N 3.5Å; D73-R76 PolarHBondContact O-N 2.87Å; D73-E77 WeakPolarHBondContact O-CB 3.45Å; D73-E77 PolarHBondContact O-N 3.47Å |
| 74 | E | 96.7 | Very high | 95 | Very high | 135 Ų | 135 | 111.4 Ų | 111.4 | 63% | 0.631 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.7 | -40.5 | 171.1 | -77.9 | 179.5 | -169.2 | 0 | 0 | 112.3 | A70 K78 | A70-E74 WeakPolarHBondContact O-CB 3.31Å; A70-E74 WeakPolarHBondContact O-CG 3.32Å; A70-E74 PolarHBondContact O-N 3.43Å; E74-K78 WeakPolarHBondContact O-CB 3.47Å; E74-K78 PolarHBondContact O-N 2.81Å |
| 75 | L | 96.5 | Very high | 95 | Very high | 106 Ų | 106 | 112.3 Ų | 112.3 | 56% | 0.555 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -70.2 | -39.2 | 176.4 | -74.4 | 170.5 | 0 | 0 | 0 | 112.1 | M71 E72 D73 K78 I79 | M71-L75 WeakPolarHBondContact O-CB 3.46Å; M71-L75 VanDerWaalsContact O-CG 3.23Å; M71-L75 WeakPolarHBondContact O-CG 3.41Å; M71-L75 PolarHBondContact O-N 2.93Å; E72-L75 PolarHBondContact O-N 3.46Å; D73-L75 VanDerWaalsContact C-N 3.33Å; D73-L75 PolarHBondContact O-N 3.5Å; L75-K78 PolarHBondContact O-N 3.5Å; L75-I79 VanDerWaalsContact O-CG1 3.28Å; L75-I79 WeakPolarHBondContact O-CG1 3.5Å; L75-I79 PolarHBondContact O-N 2.84Å |
| 76 | R | 96.4 | Very high | 94.8 | Very high | 150 Ų | 150 | 112.3 Ų | 112.3 | 57% | 0.566 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.9 | -47 | 174.3 | -74.4 | 166.6 | 177.6 | -76.3 | 1.4 | 111.2 | E72 D73 K78 I79 E80 | E72-R76 WeakPolarHBondContact O-CB 3.17Å; E72-R76 WeakPolarHBondContact O-CG 3.37Å; E72-R76 PolarHBondContact O-N 2.87Å; E72-R76 IonicContact OE1-CZ 3.01Å; E72-R76 IonicContact OE1-NE 3.56Å; E72-R76 PolarHBondContact OE1-NE 3.23Å; E72-R76 IonicContact OE1-NH2 2.62Å; E72-R76 PolarHBondContact OE1-NH2 2.97Å; D73-R76 PolarHBondContact O-N 2.87Å; R76-K78 VanDerWaalsContact C-N 3.29Å; R76-K78 PolarHBondContact O-N 2.95Å; R76-I79 PolarHBondContact O-N 2.95Å; R76-E80 PolarHBondContact O-N 3.34Å |
| 77 | E | 95.8 | Very high | 94.5 | Very high | 98 Ų | 98 | 109 Ų | 109 | 46% | 0.458 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.8 | -35.5 | 176.4 | -159.1 | -145 | -176.3 | 0 | 0 | 111.6 | D73 K81 | D73-E77 WeakPolarHBondContact O-CB 3.45Å; D73-E77 PolarHBondContact O-N 3.47Å; E77-K81 WeakPolarHBondContact O-CB 3.42Å; E77-K81 WeakPolarHBondContact O-CD 3.48Å; E77-K81 WeakPolarHBondContact O-CG 3.45Å; E77-K81 PolarHBondContact O-N 2.87Å; E77-K81 WeakPolarHBondContact OE1-CE 3.47Å; E77-K81 IonicContact OE1-NZ 3.77Å; E77-K81 PolarHBondContact OE1-NZ 2.95Å; E77-K81 IonicContact OE2-NZ 2.64Å; E77-K81 PolarHBondContact OE2-NZ 3.24Å |
| 78 | K | 96.9 | Very high | 94.3 | Very high | 129 Ų | 129 | 107.2 Ų | 107.2 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -68 | -39.6 | 173.9 | -174.1 | 178.9 | 177.4 | -175.8 | 0 | 112.7 | E74 L75 R76 K81 L82 | E74-K78 WeakPolarHBondContact O-CB 3.47Å; E74-K78 PolarHBondContact O-N 2.81Å; L75-K78 PolarHBondContact O-N 3.5Å; R76-K78 VanDerWaalsContact C-N 3.29Å; R76-K78 PolarHBondContact O-N 2.95Å; K78-K81 PolarHBondContact O-N 3.17Å; K78-L82 HydrophobicContact CG-CD1 4.35Å; K78-L82 WeakPolarHBondContact O-CG 3.42Å; K78-L82 PolarHBondContact O-N 3.01Å; K78-L82 VanDerWaalsContact O-N 3.1Å |
| 79 | I | 94.4 | Very high | 94.1 | Very high | 92 Ų | 92 | 101.3 Ų | 101.3 | 47% | 0.472 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.5 | -51.2 | 174.3 | -71.8 | 162.4 | 0 | 0 | 0 | 109.5 | L75 R76 K81 L82 E83 | L75-I79 VanDerWaalsContact O-CG1 3.28Å; L75-I79 WeakPolarHBondContact O-CG1 3.5Å; L75-I79 PolarHBondContact O-N 2.84Å; R76-I79 PolarHBondContact O-N 2.95Å; I79-K81 VanDerWaalsContact C-N 3.26Å; I79-K81 PolarHBondContact O-N 2.92Å; I79-L82 CarbonylContact O-C 3.56Å; I79-L82 WeakPolarHBondContact O-CA 3.43Å; I79-L82 WeakPolarHBondContact O-CB 3.44Å; I79-L82 PolarHBondContact O-N 3.47Å; I79-E83 HydrophobicContact CG2-CG 4.16Å; I79-E83 WeakPolarHBondContact CG2-OE1 3.32Å; I79-E83 WeakPolarHBondContact O-CG 3.47Å; I79-E83 PolarHBondContact O-N 3.11Å |
| 80 | E | 95.7 | Very high | 93.9 | Very high | 88 Ų | 88 | 99.6 Ų | 99.6 | 41% | 0.411 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.6 | -37.9 | 179.2 | -165.6 | -161.6 | -179.9 | 0 | 0 | 112.3 | R76 K84 | R76-E80 PolarHBondContact O-N 3.34Å; E80-K84 HydrophobicContact CG-CD 4.37Å; E80-K84 WeakPolarHBondContact O-CB 3.38Å; E80-K84 WeakPolarHBondContact O-CD 3.47Å; E80-K84 VanDerWaalsContact O-CG 3.25Å; E80-K84 WeakPolarHBondContact O-CG 3.43Å; E80-K84 PolarHBondContact O-N 3.29Å; E80-K84 VanDerWaalsContact OE1-CE 3.24Å; E80-K84 WeakPolarHBondContact OE1-CE 3.47Å; E80-K84 IonicContact OE1-NZ 3.2Å; E80-K84 PolarHBondContact OE1-NZ 3.27Å; E80-K84 IonicContact OE2-NZ 2.69Å |
| 81 | K | 95.3 | Very high | 93.7 | Very high | 113 Ų | 113 | 100.9 Ų | 100.9 | 49% | 0.491 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.8 | -36.9 | 173.6 | -75.5 | 166 | -177.1 | 171.5 | 0 | 112.9 | E77 K78 I79 R85 | E77-K81 WeakPolarHBondContact O-CB 3.42Å; E77-K81 WeakPolarHBondContact O-CD 3.48Å; E77-K81 WeakPolarHBondContact O-CG 3.45Å; E77-K81 PolarHBondContact O-N 2.87Å; E77-K81 WeakPolarHBondContact OE1-CE 3.47Å; E77-K81 IonicContact OE1-NZ 3.77Å; E77-K81 PolarHBondContact OE1-NZ 2.95Å; E77-K81 IonicContact OE2-NZ 2.64Å; E77-K81 PolarHBondContact OE2-NZ 3.24Å; K78-K81 PolarHBondContact O-N 3.17Å; I79-K81 VanDerWaalsContact C-N 3.26Å; I79-K81 PolarHBondContact O-N 2.92Å; K81-R85 PolarHBondContact O-N 2.9Å |
| 82 | L | 94.7 | Very high | 93.7 | Very high | 100 Ų | 100 | 99.3 Ų | 99.3 | 52% | 0.524 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -73.6 | -42.2 | 176.9 | -71.8 | 169.1 | 0 | 0 | 0 | 111.5 | K78 I79 R85 Q86 | K78-L82 HydrophobicContact CG-CD1 4.35Å; K78-L82 WeakPolarHBondContact O-CG 3.42Å; K78-L82 PolarHBondContact O-N 3.01Å; K78-L82 VanDerWaalsContact O-N 3.1Å; I79-L82 CarbonylContact O-C 3.56Å; I79-L82 WeakPolarHBondContact O-CA 3.43Å; I79-L82 WeakPolarHBondContact O-CB 3.44Å; I79-L82 PolarHBondContact O-N 3.47Å; L82-R85 WeakPolarHBondContact O-CB 3.48Å; L82-R85 PolarHBondContact O-N 3.4Å; L82-Q86 WeakPolarHBondContact O-CB 3.5Å; L82-Q86 PolarHBondContact O-N 3.05Å |
| 83 | E | 93.2 | Very high | 93.4 | Very high | 114 Ų | 114 | 99.3 Ų | 99.3 | 53% | 0.533 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.7 | -45.3 | 175.5 | -68.9 | 171.3 | 156.6 | 0 | 0 | 111.8 | I79 R85 Q86 A87 | I79-E83 HydrophobicContact CG2-CG 4.16Å; I79-E83 WeakPolarHBondContact CG2-OE1 3.32Å; I79-E83 WeakPolarHBondContact O-CG 3.47Å; I79-E83 PolarHBondContact O-N 3.11Å; E83-R85 VanDerWaalsContact C-N 3.29Å; E83-R85 PolarHBondContact O-N 3.09Å; E83-Q86 PolarHBondContact O-N 3.45Å; E83-A87 PolarHBondContact O-N 3.24Å |
| 84 | K | 92.6 | Very high | 93.2 | Very high | 120 Ų | 120 | 97.2 Ų | 97.2 | 52% | 0.522 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.9 | -36.6 | 174.6 | -75.5 | 170 | -177 | 169.3 | 0 | 112.7 | E80 T88 | E80-K84 HydrophobicContact CG-CD 4.37Å; E80-K84 WeakPolarHBondContact O-CB 3.38Å; E80-K84 WeakPolarHBondContact O-CD 3.47Å; E80-K84 VanDerWaalsContact O-CG 3.25Å; E80-K84 WeakPolarHBondContact O-CG 3.43Å; E80-K84 PolarHBondContact O-N 3.29Å; E80-K84 VanDerWaalsContact OE1-CE 3.24Å; E80-K84 WeakPolarHBondContact OE1-CE 3.47Å; E80-K84 IonicContact OE1-NZ 3.2Å; E80-K84 PolarHBondContact OE1-NZ 3.27Å; E80-K84 IonicContact OE2-NZ 2.69Å; K84-T88 PolarHBondContact O-N 2.96Å; K84-T88 PolarHBondContact O-OG1 3.06Å |
| 85 | R | 94 | Very high | 93 | Very high | 165 Ų | 165 | 94.6 Ų | 94.6 | 62% | 0.623 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -68.3 | -49.4 | 172.7 | 176.6 | 178.3 | 170.1 | 169.4 | 0.1 | 111 | K81 L82 E83 A87 T88 D89 | K81-R85 PolarHBondContact O-N 2.9Å; L82-R85 WeakPolarHBondContact O-CB 3.48Å; L82-R85 PolarHBondContact O-N 3.4Å; E83-R85 VanDerWaalsContact C-N 3.29Å; E83-R85 PolarHBondContact O-N 3.09Å; R85-A87 VanDerWaalsContact C-N 3.33Å; R85-A87 PolarHBondContact O-N 3Å; R85-T88 WeakPolarHBondContact O-CA 3.29Å; R85-T88 VanDerWaalsContact O-CB 3.27Å; R85-T88 WeakPolarHBondContact O-CB 3.32Å; R85-T88 PolarHBondContact O-N 3.49Å; R85-D89 WeakPolarHBondContact CG-OD2 3.36Å; R85-D89 IonicContact CZ-OD2 3.84Å; R85-D89 IonicContact NE-OD2 3.85Å; R85-D89 PolarHBondContact NE-OD2 3.28Å; R85-D89 IonicContact NH2-OD2 3.77Å; R85-D89 PolarHBondContact O-N 2.85Å |
| 86 | Q | 91.3 | Very high | 92.6 | Very high | 115 Ų | 115 | 93.4 Ų | 93.4 | 54% | 0.537 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -55.9 | -46.7 | -179.1 | -177.6 | 174.7 | -9.4 | 0 | 0 | 111.3 | L82 E83 T88 D89 D90 | L82-Q86 WeakPolarHBondContact O-CB 3.5Å; L82-Q86 PolarHBondContact O-N 3.05Å; E83-Q86 PolarHBondContact O-N 3.45Å; Q86-T88 PolarHBondContact O-N 3.48Å; Q86-T88 VanDerWaalsContact O-N 3.15Å; Q86-D89 PolarHBondContact O-N 2.97Å; Q86-D89 VanDerWaalsContact O-N 3.14Å; Q86-D90 WeakPolarHBondContact O-CB 3.4Å; Q86-D90 VanDerWaalsContact O-CG 3.24Å; Q86-D90 PolarHBondContact O-N 2.82Å |
| 87 | A | 88.1 | Confident | 92.3 | Very high | 55 Ų | 55 | 87.8 Ų | 87.8 | 46% | 0.455 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -59.7 | -27.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | E83 R85 T91 | E83-A87 PolarHBondContact O-N 3.24Å; R85-A87 VanDerWaalsContact C-N 3.33Å; R85-A87 PolarHBondContact O-N 3Å; A87-T91 WeakPolarHBondContact O-CB 3.49Å; A87-T91 PolarHBondContact O-N 2.92Å; A87-T91 PolarHBondContact O-OG1 3.45Å |
| 88 | T | 91.1 | Very high | 92.1 | Very high | 86 Ų | 86 | 89.9 Ų | 89.9 | 53% | 0.528 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -78.6 | -42.7 | 175.8 | -54 | 0 | 0 | 0 | 0 | 111.5 | K84 R85 Q86 T91 T92 | K84-T88 PolarHBondContact O-N 2.96Å; K84-T88 PolarHBondContact O-OG1 3.06Å; R85-T88 WeakPolarHBondContact O-CA 3.29Å; R85-T88 VanDerWaalsContact O-CB 3.27Å; R85-T88 WeakPolarHBondContact O-CB 3.32Å; R85-T88 PolarHBondContact O-N 3.49Å; Q86-T88 PolarHBondContact O-N 3.48Å; Q86-T88 VanDerWaalsContact O-N 3.15Å; T88-T91 PolarHBondContact O-N 2.93Å; T88-T92 PolarHBondContact O-N 3.27Å; T88-T92 VanDerWaalsContact O-N 3.07Å; T88-T92 PolarHBondContact O-OG1 3.42Å |
| 89 | D | 90.6 | Very high | 91.8 | Very high | 66 Ų | 66 | 90.1 Ų | 90.1 | 35% | 0.353 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -66.9 | -43.4 | 177.3 | -69.6 | -19.5 | 0 | 0 | 0 | 110 | R85 Q86 T91 T92 L93 | R85-D89 WeakPolarHBondContact CG-OD2 3.36Å; R85-D89 IonicContact CZ-OD2 3.84Å; R85-D89 IonicContact NE-OD2 3.85Å; R85-D89 PolarHBondContact NE-OD2 3.28Å; R85-D89 IonicContact NH2-OD2 3.77Å; R85-D89 PolarHBondContact O-N 2.85Å; Q86-D89 PolarHBondContact O-N 2.97Å; Q86-D89 VanDerWaalsContact O-N 3.14Å; D89-T91 PolarHBondContact O-N 3.36Å; D89-T92 WeakPolarHBondContact O-CB 3.49Å; D89-T92 PolarHBondContact O-N 3.48Å; D89-T92 VanDerWaalsContact O-N 3.12Å; D89-L93 WeakPolarHBondContact O-CG 3.29Å; D89-L93 PolarHBondContact O-N 3.3Å |
| 90 | D | 91.9 | Very high | 91.5 | Very high | 44 Ų | 44 | 89.2 Ų | 89.2 | 24% | 0.235 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -58 | -45.9 | 172.3 | -73.8 | -22.7 | 0 | 0 | 0 | 112.6 | Q86 T92 L93 L94 L223 | Q86-D90 WeakPolarHBondContact O-CB 3.4Å; Q86-D90 VanDerWaalsContact O-CG 3.24Å; Q86-D90 PolarHBondContact O-N 2.82Å; D90-T92 PolarHBondContact O-N 3.18Å; D90-L93 PolarHBondContact O-N 2.91Å; D90-L94 WeakPolarHBondContact O-CG 3.38Å; D90-L94 PolarHBondContact O-N 3.16Å; D90-L223 HydrophobicContact CB-CD1 4.16Å; D90-L223 HydrophobicContact CB-CD2 4.05Å |
| 91 | T | 90.3 | Very high | 91.2 | Very high | 76 Ų | 76 | 86.8 Ų | 86.8 | 47% | 0.466 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.9 | -39.2 | 176.3 | -65.3 | 0 | 0 | 0 | 0 | 110.9 | A87 T88 D89 I95 | A87-T91 WeakPolarHBondContact O-CB 3.49Å; A87-T91 PolarHBondContact O-N 2.92Å; A87-T91 PolarHBondContact O-OG1 3.45Å; T88-T91 PolarHBondContact O-N 2.93Å; D89-T91 PolarHBondContact O-N 3.36Å; T91-I95 HydrophobicContact CG2-CD1 4.12Å; T91-I95 WeakPolarHBondContact O-CD1 3.42Å; T91-I95 VanDerWaalsContact O-CG1 3.28Å; T91-I95 WeakPolarHBondContact O-CG1 3.23Å; T91-I95 PolarHBondContact O-N 3.01Å; T91-I95 VanDerWaalsContact O-N 3.16Å |
| 92 | T | 91.7 | Very high | 90.9 | Very high | 74 Ų | 74 | 86.2 Ų | 86.2 | 45% | 0.454 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -68.1 | -45.3 | 177.4 | -55.4 | 0 | 0 | 0 | 0 | 111.4 | T88 D89 D90 L94 I95 V96 | T88-T92 PolarHBondContact O-N 3.27Å; T88-T92 VanDerWaalsContact O-N 3.07Å; T88-T92 PolarHBondContact O-OG1 3.42Å; D89-T92 WeakPolarHBondContact O-CB 3.49Å; D89-T92 PolarHBondContact O-N 3.48Å; D89-T92 VanDerWaalsContact O-N 3.12Å; D90-T92 PolarHBondContact O-N 3.18Å; T92-L94 VanDerWaalsContact C-N 3.34Å; T92-L94 PolarHBondContact O-N 3.49Å; T92-I95 PolarHBondContact O-N 3.38Å; T92-V96 WeakPolarHBondContact O-CG2 3.12Å; T92-V96 PolarHBondContact O-N 3.01Å |
| 93 | L | 90.3 | Very high | 90.5 | Very high | 83 Ų | 83 | 85 Ų | 85 | 44% | 0.435 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -59 | -42.6 | 175.7 | -71.9 | 169.1 | 0 | 0 | 0 | 112.2 | D89 D90 I95 V96 N97 F222 L226 | D89-L93 WeakPolarHBondContact O-CG 3.29Å; D89-L93 PolarHBondContact O-N 3.3Å; D90-L93 PolarHBondContact O-N 2.91Å; L93-I95 PolarHBondContact O-N 3.39Å; L93-V96 PolarHBondContact O-N 3.02Å; L93-N97 WeakPolarHBondContact O-CB 3.45Å; L93-N97 PolarHBondContact O-N 3.4Å; L93-F222 HydrophobicContact CB-CE1 4.47Å; L93-L226 HydrophobicContact CD1-CD1 4.21Å |
| 94 | L | 90.5 | Very high | 90.1 | Very high | 33 Ų | 33 | 80.2 Ų | 80.2 | 17% | 0.173 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.2 | -40.4 | 175.6 | -76.2 | 173.1 | 0 | 0 | 0 | 112.7 | D90 T92 R98 L215 A219 F222 L223 | D90-L94 WeakPolarHBondContact O-CG 3.38Å; D90-L94 PolarHBondContact O-N 3.16Å; T92-L94 VanDerWaalsContact C-N 3.34Å; T92-L94 PolarHBondContact O-N 3.49Å; L94-R98 WeakPolarHBondContact O-CB 3.46Å; L94-R98 PolarHBondContact O-N 3.2Å; L94-L215 HydrophobicContact CD1-CD2 4.12Å; L94-A219 HydrophobicContact CD1-CB 4.06Å; L94-A219 HydrophobicContact CD2-CB 3.53Å; L94-A219 HydrophobicContact CG-CB 4.47Å; L94-F222 HydrophobicContact CD2-CD1 3.74Å; L94-F222 HydrophobicContact CD2-CE1 4.43Å; L94-L223 HydrophobicContact CD1-CD1 4.05Å; L94-L223 HydrophobicContact CD2-CG 4.36Å; L94-L223 HydrophobicContact CG-CD1 4.45Å; L94-L223 HydrophobicContact CG-CD2 4.39Å; L94-L223 HydrophobicContact CG-CG 4.42Å |
| 95 | I | 90.8 | Very high | 89.9 | Confident | 79 Ų | 79 | 78.7 Ų | 78.7 | 41% | 0.405 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65.2 | -47.4 | 176.6 | -70.1 | 165.7 | 0 | 0 | 0 | 110.6 | T91 T92 L93 R98 Y99 | T91-I95 HydrophobicContact CG2-CD1 4.12Å; T91-I95 WeakPolarHBondContact O-CD1 3.42Å; T91-I95 VanDerWaalsContact O-CG1 3.28Å; T91-I95 WeakPolarHBondContact O-CG1 3.23Å; T91-I95 PolarHBondContact O-N 3.01Å; T91-I95 VanDerWaalsContact O-N 3.16Å; T92-I95 PolarHBondContact O-N 3.38Å; L93-I95 PolarHBondContact O-N 3.39Å; I95-R98 PolarHBondContact O-N 3.01Å; I95-Y99 HydrophobicContact CG2-CD2 3.81Å; I95-Y99 HydrophobicContact CG2-CE2 3.7Å; I95-Y99 VanDerWaalsContact O-CD2 3.23Å; I95-Y99 WeakPolarHBondContact O-CD2 3.28Å; I95-Y99 PolarHBondContact O-N 2.62Å; I95-Y99 VanDerWaalsContact O-N 3.13Å |
| 96 | V | 90.1 | Very high | 89.5 | Confident | 82 Ų | 82 | 75.4 Ų | 75.4 | 50% | 0.497 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.9 | -50.2 | 179 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | T92 L93 R98 Y99 W100 | T92-V96 WeakPolarHBondContact O-CG2 3.12Å; T92-V96 PolarHBondContact O-N 3.01Å; L93-V96 PolarHBondContact O-N 3.02Å; V96-R98 VanDerWaalsContact C-N 3.3Å; V96-R98 PolarHBondContact O-N 2.94Å; V96-Y99 PolarHBondContact O-N 3.5Å; V96-W100 WeakPolarHBondContact O-CB 3.42Å; V96-W100 PolarHBondContact O-N 2.99Å |
| 97 | N | 90.1 | Very high | 89 | Confident | 31 Ų | 31 | 70.6 Ų | 70.6 | 17% | 0.166 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -61.4 | -37.5 | 179.6 | -177.3 | 33 | 0 | 0 | 0 | 112.2 | L93 S101 F222 R241 | L93-N97 WeakPolarHBondContact O-CB 3.45Å; L93-N97 PolarHBondContact O-N 3.4Å; N97-S101 VanDerWaalsContact O-CB 3.28Å; N97-S101 WeakPolarHBondContact O-CB 3.43Å; N97-S101 PolarHBondContact O-N 2.96Å; N97-S101 PolarHBondContact O-OG 3.45Å; N97-S101 PolarHBondContact OD1-OG 2.87Å; N97-F222 HydrophobicContact CB-CE1 3.85Å; N97-F222 HydrophobicContact CB-CE2 4.15Å; N97-F222 HydrophobicContact CB-CZ 3.61Å; N97-F222 WeakPolarHBondContact ND2-CD2 3.38Å; N97-F222 WeakPolarHBondContact ND2-CE2 3.26Å; N97-F222 WeakPolarHBondContact ND2-CG 3.37Å; N97-F222 WeakPolarHBondContact ND2-CZ 3.31Å; N97-R241 PolarHBondContact OD1-NH1 3.1Å |
| 98 | R | 90.1 | Very high | 88.8 | Confident | 143 Ų | 143 | 71.5 Ų | 71.5 | 54% | 0.54 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.8 | -49.2 | 174.5 | -173.1 | -171 | 70.6 | 177.6 | -0.2 | 111.7 | L94 I95 V96 Q102 | L94-R98 WeakPolarHBondContact O-CB 3.46Å; L94-R98 PolarHBondContact O-N 3.2Å; I95-R98 PolarHBondContact O-N 3.01Å; V96-R98 VanDerWaalsContact C-N 3.3Å; V96-R98 PolarHBondContact O-N 2.94Å; R98-Q102 WeakPolarHBondContact O-CB 3.49Å; R98-Q102 PolarHBondContact O-N 2.8Å |
| 99 | Y | 90.8 | Very high | 88.5 | Confident | 133 Ų | 133 | 71.7 Ų | 71.7 | 52% | 0.522 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -67.7 | -38.8 | -179.9 | -78.1 | -61.8 | 0 | 0 | 0 | 112.7 | I95 V96 Q102 L103 | I95-Y99 HydrophobicContact CG2-CD2 3.81Å; I95-Y99 HydrophobicContact CG2-CE2 3.7Å; I95-Y99 VanDerWaalsContact O-CD2 3.23Å; I95-Y99 WeakPolarHBondContact O-CD2 3.28Å; I95-Y99 PolarHBondContact O-N 2.62Å; I95-Y99 VanDerWaalsContact O-N 3.13Å; V96-Y99 PolarHBondContact O-N 3.5Å; Y99-Q102 PolarHBondContact O-N 2.82Å; Y99-L103 PolarHBondContact O-N 3.05Å |
| 100 | W | 88.9 | Confident | 88 | Confident | 74 Ų | 74 | 72 Ų | 72 | 28% | 0.28 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.6 | -45.1 | 176.7 | -165.3 | -69.3 | 0 | 0 | 0 | 111.6 | V96 Q102 L103 E104 M242 | V96-W100 WeakPolarHBondContact O-CB 3.42Å; V96-W100 PolarHBondContact O-N 2.99Å; W100-Q102 VanDerWaalsContact C-N 3.34Å; W100-Q102 PolarHBondContact O-N 2.8Å; W100-L103 WeakPolarHBondContact O-CB 3.15Å; W100-L103 PolarHBondContact O-N 2.76Å; W100-E104 PolarHBondContact NE1-OE1 3.05Å; W100-E104 WeakPolarHBondContact O-CG 3.32Å; W100-E104 PolarHBondContact O-N 3.35Å; W100-M242 HydrophobicContact CZ2-CB 4.48Å |
| 101 | S | 89 | Confident | 87.3 | Confident | 37 Ų | 37 | 72.9 Ų | 72.9 | 26% | 0.259 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.4 | -38.4 | 176.1 | -52.1 | 0 | 0 | 0 | 0 | 111.8 | N97 E104 D105 R241 | N97-S101 VanDerWaalsContact O-CB 3.28Å; N97-S101 WeakPolarHBondContact O-CB 3.43Å; N97-S101 PolarHBondContact O-N 2.96Å; N97-S101 PolarHBondContact O-OG 3.45Å; N97-S101 PolarHBondContact OD1-OG 2.87Å; S101-E104 PolarHBondContact O-N 3.26Å; S101-D105 PolarHBondContact O-N 3.5Å; S101-R241 PolarHBondContact OG-NH2 3.14Å |
| 102 | Q | 89.4 | Confident | 86.7 | Confident | 100 Ų | 100 | 76.8 Ų | 76.8 | 47% | 0.467 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.5 | -38.6 | 174.3 | -174 | 179.6 | 6.2 | 0 | 0 | 112.2 | R98 Y99 W100 N106 | R98-Q102 WeakPolarHBondContact O-CB 3.49Å; R98-Q102 PolarHBondContact O-N 2.8Å; Y99-Q102 PolarHBondContact O-N 2.82Å; W100-Q102 VanDerWaalsContact C-N 3.34Å; W100-Q102 PolarHBondContact O-N 2.8Å; Q102-N106 WeakPolarHBondContact O-CB 3.34Å; Q102-N106 PolarHBondContact O-N 3.34Å; Q102-N106 PolarHBondContact O-ND2 3.43Å |
| 103 | L | 85 | Confident | 85.7 | Confident | 75 Ų | 75 | 77.7 Ų | 77.7 | 39% | 0.393 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.2 | -48.7 | 173.7 | 175.5 | 62.6 | 0 | 0 | 0 | 111 | Y99 W100 D105 N106 V107 | Y99-L103 PolarHBondContact O-N 3.05Å; W100-L103 WeakPolarHBondContact O-CB 3.15Å; W100-L103 PolarHBondContact O-N 2.76Å; L103-D105 VanDerWaalsContact C-N 3.32Å; L103-D105 PolarHBondContact O-N 3.35Å; L103-N106 PolarHBondContact O-N 3.23Å; L103-V107 HydrophobicContact CD1-CG2 4.07Å; L103-V107 WeakPolarHBondContact O-CB 3.43Å; L103-V107 VanDerWaalsContact O-CG2 3.31Å; L103-V107 WeakPolarHBondContact O-CG2 3.28Å; L103-V107 PolarHBondContact O-N 2.92Å |
| 104 | E | 85.7 | Confident | 84.6 | Confident | 14 Ų | 14 | 76.1 Ų | 76.1 | 7% | 0.065 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -57.1 | -43.9 | 177.1 | -72.6 | 171.3 | 169 | 0 | 0 | 112 | W100 S101 V107 K108 R241 F244 | W100-E104 PolarHBondContact NE1-OE1 3.05Å; W100-E104 WeakPolarHBondContact O-CG 3.32Å; W100-E104 PolarHBondContact O-N 3.35Å; S101-E104 PolarHBondContact O-N 3.26Å; E104-V107 PolarHBondContact O-N 2.86Å; E104-K108 WeakPolarHBondContact O-CB 3.49Å; E104-K108 WeakPolarHBondContact O-CD 3.21Å; E104-K108 WeakPolarHBondContact O-CE 3.45Å; E104-K108 WeakPolarHBondContact O-CG 3.39Å; E104-K108 PolarHBondContact O-N 2.65Å; E104-R241 WeakPolarHBondContact OE1-CB 3.39Å; E104-R241 IonicContact OE1-CZ 2.66Å; E104-R241 IonicContact OE1-NE 2.89Å; E104-R241 PolarHBondContact OE1-NE 2.66Å; E104-R241 IonicContact OE1-NH2 3.5Å; E104-R241 PolarHBondContact OE1-NH2 3.35Å; E104-R241 IonicContact OE2-CZ 2.59Å; E104-R241 IonicContact OE2-NE 2.77Å; E104-R241 PolarHBondContact OE2-NE 2.98Å; E104-R241 IonicContact OE2-NH2 3.66Å; E104-R241 PolarHBondContact OE2-NH2 3.33Å; E104-F244 HydrophobicContact CB-CE1 4.39Å; E104-F244 HydrophobicContact CG-CD1 4.35Å; E104-F244 HydrophobicContact CG-CE1 4.45Å |
| 105 | D | 87.4 | Confident | 83.1 | Confident | 87 Ų | 87 | 79.3 Ų | 79.3 | 47% | 0.465 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -71.6 | -39.6 | 179.3 | -76.6 | -11.8 | 0 | 0 | 0 | 113.1 | S101 L103 V107 K108 V109 | S101-D105 PolarHBondContact O-N 3.5Å; L103-D105 VanDerWaalsContact C-N 3.32Å; L103-D105 PolarHBondContact O-N 3.35Å; D105-V107 VanDerWaalsContact C-N 3.3Å; D105-V107 PolarHBondContact O-N 2.94Å; D105-K108 PolarHBondContact O-N 2.97Å; D105-K108 WeakPolarHBondContact OD1-CD 3.47Å; D105-K108 WeakPolarHBondContact OD1-CE 3.31Å; D105-K108 IonicContact OD1-NZ 2.89Å; D105-K108 PolarHBondContact OD1-NZ 2.69Å; D105-V109 WeakPolarHBondContact O-CG2 3.45Å; D105-V109 PolarHBondContact O-N 3.06Å |
| 106 | N | 85.4 | Confident | 81.3 | Confident | 97 Ų | 97 | 79.5 Ų | 79.5 | 52% | 0.519 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -57.5 | -44.7 | 171.6 | -76 | -21.9 | 0 | 0 | 0 | 111.1 | Q102 L103 V109 L110 | Q102-N106 WeakPolarHBondContact O-CB 3.34Å; Q102-N106 PolarHBondContact O-N 3.34Å; Q102-N106 PolarHBondContact O-ND2 3.43Å; L103-N106 PolarHBondContact O-N 3.23Å; N106-V109 PolarHBondContact O-N 3.01Å; N106-L110 WeakPolarHBondContact O-CB 3.33Å; N106-L110 PolarHBondContact O-N 3.45Å |
| 107 | V | 82.4 | Confident | 78.9 | Confident | 13 Ų | 13 | 81.9 Ų | 81.9 | 8% | 0.079 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -70.6 | -37.3 | 179.2 | 175 | 0 | 0 | 0 | 0 | 111.6 | L103 E104 D105 V109 L110 R111 A248 | L103-V107 HydrophobicContact CD1-CG2 4.07Å; L103-V107 WeakPolarHBondContact O-CB 3.43Å; L103-V107 VanDerWaalsContact O-CG2 3.31Å; L103-V107 WeakPolarHBondContact O-CG2 3.28Å; L103-V107 PolarHBondContact O-N 2.92Å; E104-V107 PolarHBondContact O-N 2.86Å; D105-V107 VanDerWaalsContact C-N 3.3Å; D105-V107 PolarHBondContact O-N 2.94Å; V107-V109 PolarHBondContact O-N 3.01Å; V107-L110 PolarHBondContact O-N 3.41Å; V107-R111 WeakPolarHBondContact O-CB 3.22Å; V107-R111 PolarHBondContact O-N 3.37Å; V107-A248 HydrophobicContact CG1-CB 3.41Å; V107-A248 VanDerWaalsContact CG1-CB 3.41Å |
| 108 | K | 83.4 | Confident | 76.8 | Confident | 74 Ų | 74 | 87 Ų | 87 | 32% | 0.322 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -59.7 | -43.2 | 171.2 | -73.3 | 163.2 | -144.5 | 160.7 | 0 | 111.9 | E104 D105 K112 F244 | E104-K108 WeakPolarHBondContact O-CB 3.49Å; E104-K108 WeakPolarHBondContact O-CD 3.21Å; E104-K108 WeakPolarHBondContact O-CE 3.45Å; E104-K108 WeakPolarHBondContact O-CG 3.39Å; E104-K108 PolarHBondContact O-N 2.65Å; D105-K108 PolarHBondContact O-N 2.97Å; D105-K108 WeakPolarHBondContact OD1-CD 3.47Å; D105-K108 WeakPolarHBondContact OD1-CE 3.31Å; D105-K108 IonicContact OD1-NZ 2.89Å; D105-K108 PolarHBondContact OD1-NZ 2.69Å; K108-K112 WeakPolarHBondContact O-CB 3.3Å; K108-K112 WeakPolarHBondContact O-CG 3.49Å; K108-K112 PolarHBondContact O-N 2.69Å; K108-K112 VanDerWaalsContact O-N 3.13Å; K108-F244 HydrophobicContact CD-CZ 4.36Å; K108-F244 HydrophobicContact CG-CE1 4.18Å; K108-F244 HydrophobicContact CG-CZ 3.72Å |
| 109 | V | 85.3 | Confident | 74.5 | Confident | 90 Ų | 90 | 84.5 Ų | 84.5 | 55% | 0.545 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.9 | -46.5 | 176.1 | 170 | 0 | 0 | 0 | 0 | 110.3 | D105 N106 V107 R111 K112 C113 | D105-V109 WeakPolarHBondContact O-CG2 3.45Å; D105-V109 PolarHBondContact O-N 3.06Å; N106-V109 PolarHBondContact O-N 3.01Å; V107-V109 PolarHBondContact O-N 3.01Å; V109-R111 PolarHBondContact O-N 2.89Å; V109-K112 CarbonylContact O-C 3.56Å; V109-K112 WeakPolarHBondContact O-CB 3.3Å; V109-K112 PolarHBondContact O-N 2.87Å; V109-K112 VanDerWaalsContact O-N 3.14Å; V109-C113 PolarHBondContact O-N 3.37Å; V109-C113 PolarHBondContact O-SG 2.85Å |
| 110 | L | 79.8 | Confident | 72.2 | Confident | 74 Ų | 74 | 82.8 Ų | 82.8 | 39% | 0.387 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65.2 | -42.2 | -177.8 | -164 | 54.6 | 0 | 0 | 0 | 112 | N106 V107 K112 C113 I114 L252 | N106-L110 WeakPolarHBondContact O-CB 3.33Å; N106-L110 PolarHBondContact O-N 3.45Å; V107-L110 PolarHBondContact O-N 3.41Å; L110-K112 PolarHBondContact O-N 3.3Å; L110-C113 PolarHBondContact O-N 3.02Å; L110-C113 VanDerWaalsContact O-N 3.14Å; L110-I114 HydrophobicContact CD1-CD1 4.47Å; L110-I114 HydrophobicContact CG-CD1 4.13Å; L110-I114 WeakPolarHBondContact O-CD1 3.38Å; L110-I114 WeakPolarHBondContact O-CG1 3.29Å; L110-I114 PolarHBondContact O-N 3.06Å; L110-L252 HydrophobicContact CD2-CD1 3.55Å; L110-L252 HydrophobicContact CD2-CD2 3.7Å; L110-L252 HydrophobicContact CD2-CG 4.28Å; L110-L252 HydrophobicContact CG-CD1 3.84Å |
| 111 | R | 77.1 | Confident | 69.6 | Low | 61 Ų | 61 | 82.2 Ų | 82.2 | 23% | 0.23 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -56 | -47.3 | 170 | -178.4 | -178.7 | -100.3 | 173.8 | -6 | 110.9 | V107 V109 C113 I114 E115 D247 H251 | V107-R111 WeakPolarHBondContact O-CB 3.22Å; V107-R111 PolarHBondContact O-N 3.37Å; V109-R111 PolarHBondContact O-N 2.89Å; R111-C113 VanDerWaalsContact C-N 3.27Å; R111-C113 PolarHBondContact O-N 3.39Å; R111-I114 PolarHBondContact O-N 3.31Å; R111-E115 VanDerWaalsContact CG-OE2 3.28Å; R111-E115 WeakPolarHBondContact CG-OE2 3.44Å; R111-E115 PolarHBondContact O-N 2.82Å; R111-D247 IonicContact CZ-OD2 2.75Å; R111-D247 IonicContact NH1-OD2 3.77Å; R111-D247 IonicContact NH2-OD2 3.35Å; R111-D247 PolarHBondContact NH2-OD2 3.46Å; R111-H251 PolarHBondContact NH2-CD2 3.26Å; R111-H251 PolarHBondContact NH2-ND1 3.38Å |
| 112 | K | 77.9 | Confident | 67.3 | Low | 158 Ų | 158 | 86.8 Ų | 86.8 | 69% | 0.687 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.5 | -23.7 | 176.8 | -76.1 | 177.1 | 179.2 | -179.6 | 0 | 114.9 | K108 V109 L110 P116 | K108-K112 WeakPolarHBondContact O-CB 3.3Å; K108-K112 WeakPolarHBondContact O-CG 3.49Å; K108-K112 PolarHBondContact O-N 2.69Å; K108-K112 VanDerWaalsContact O-N 3.13Å; V109-K112 CarbonylContact O-C 3.56Å; V109-K112 WeakPolarHBondContact O-CB 3.3Å; V109-K112 PolarHBondContact O-N 2.87Å; V109-K112 VanDerWaalsContact O-N 3.14Å; L110-K112 PolarHBondContact O-N 3.3Å; K112-P116 VanDerWaalsContact O-CD 3.28Å; K112-P116 WeakPolarHBondContact O-CD 3.24Å; K112-P116 WeakPolarHBondContact O-CG 3.07Å |
| 113 | C | 70.4 | Confident | 64.8 | Low | 94 Ų | 94 | 86.3 Ų | 86.3 | 64% | 0.635 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -81.8 | -16.8 | 173.2 | -69.4 | 0 | 0 | 0 | 0 | 113.3 | V109 L110 R111 | V109-C113 PolarHBondContact O-N 3.37Å; V109-C113 PolarHBondContact O-SG 2.85Å; L110-C113 PolarHBondContact O-N 3.02Å; L110-C113 VanDerWaalsContact O-N 3.14Å; R111-C113 VanDerWaalsContact C-N 3.27Å; R111-C113 PolarHBondContact O-N 3.39Å |
| 114 | I | 66.4 | Low | 63 | Low | 50 Ų | 50 | 88.4 Ų | 88.4 | 26% | 0.256 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -100.9 | -41.3 | -175.9 | -70.2 | 162.5 | 0 | 0 | 0 | 111.8 | L110 R111 P116 E117 L252 V255 | L110-I114 HydrophobicContact CD1-CD1 4.47Å; L110-I114 HydrophobicContact CG-CD1 4.13Å; L110-I114 WeakPolarHBondContact O-CD1 3.38Å; L110-I114 WeakPolarHBondContact O-CG1 3.29Å; L110-I114 PolarHBondContact O-N 3.06Å; R111-I114 PolarHBondContact O-N 3.31Å; I114-P116 VanDerWaalsContact C-N 3.26Å; I114-P116 WeakPolarHBondContact O-CD 3.5Å; I114-P116 VanDerWaalsContact O-N 3.13Å; I114-E117 PolarHBondContact O-N 3.19Å; I114-L252 HydrophobicContact CD1-CD1 3.76Å; I114-V255 HydrophobicContact CD1-CB 4.38Å; I114-V255 HydrophobicContact CD1-CG1 3.92Å; I114-V255 HydrophobicContact CG1-CG1 4.11Å; I114-V255 HydrophobicContact CG2-CB 4.19Å; I114-V255 HydrophobicContact CG2-CG1 3.63Å; I114-V255 HydrophobicContact CG2-CG2 3.59Å |
| 115 | E | 59 | Low | 60.9 | Low | 100 Ų | 100 | 93.9 Ų | 93.9 | 47% | 0.467 | 56% | 0.56 | S | S | . | * | G | 310 helix | trans | -47.5 | -34.4 | 176.1 | -140.5 | 88.2 | -115.3 | 0 | 0 | 115.2 | R111 E117 L118 | R111-E115 VanDerWaalsContact CG-OE2 3.28Å; R111-E115 WeakPolarHBondContact CG-OE2 3.44Å; R111-E115 PolarHBondContact O-N 2.82Å; E115-E117 VanDerWaalsContact C-N 3.32Å; E115-E117 PolarHBondContact O-N 3.32Å; E115-L118 PolarHBondContact O-N 3.03Å |
| 116 | P | 53 | Low | 58.6 | Low | 82 Ų | 82 | 95.2 Ų | 95.2 | 53% | 0.532 | 58% | 0.576 | S | S | . | * | G | 310 helix | trans | -62 | -28.2 | -176.2 | -26.7 | 36.6 | 0 | 0 | 0 | 115.8 | K112 I114 L118 A119 | K112-P116 VanDerWaalsContact O-CD 3.28Å; K112-P116 WeakPolarHBondContact O-CD 3.24Å; K112-P116 WeakPolarHBondContact O-CG 3.07Å; I114-P116 VanDerWaalsContact C-N 3.26Å; I114-P116 WeakPolarHBondContact O-CD 3.5Å; I114-P116 VanDerWaalsContact O-N 3.13Å; P116-L118 VanDerWaalsContact C-N 3.26Å; P116-L118 PolarHBondContact O-N 3.41Å; P116-A119 PolarHBondContact O-N 3.09Å |
| 117 | E | 40.3 | Very low | 56.5 | Low | 132 Ų | 132 | 94.8 Ų | 94.8 | 62% | 0.617 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -75.2 | -15.8 | -177 | -156.6 | 176.9 | 178.6 | 0 | 0 | 112.4 | I114 E115 R262 | I114-E117 PolarHBondContact O-N 3.19Å; E115-E117 VanDerWaalsContact C-N 3.32Å; E115-E117 PolarHBondContact O-N 3.32Å; E117-R262 IonicContact OE1-CZ 2.68Å; E117-R262 IonicContact OE1-NH1 3.71Å; E117-R262 PolarHBondContact OE1-NH1 3.42Å; E117-R262 IonicContact OE1-NH2 3.41Å; E117-R262 IonicContact OE2-NH1 3.64Å |
| 118 | L | 46.8 | Very low | 54.5 | Low | 138 Ų | 138 | 99.6 Ų | 99.6 | 72% | 0.723 | 62% | 0.618 | S | S | * | * | G | 310 helix | trans | -84.3 | -12.2 | 177.4 | -66.5 | 176.7 | 0 | 0 | 0 | 113.9 | E115 P116 | E115-L118 PolarHBondContact O-N 3.03Å; P116-L118 VanDerWaalsContact C-N 3.26Å; P116-L118 PolarHBondContact O-N 3.41Å |
| 119 | A | 41.5 | Very low | 52.6 | Low | 92 Ų | 92 | 102 Ų | 102 | 76% | 0.76 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -83.1 | -11.1 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | P116 | P116-A119 PolarHBondContact O-N 3.09Š|
| 120 | S | 42.3 | Very low | 50.8 | Low | 97 Ų | 97 | 103.3 Ų | 103.3 | 68% | 0.678 | 65% | 0.651 | S | S | * | * | trans | -111.4 | 54.5 | -174.5 | 60.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 121 | G | 35 | Very low | 48.5 | Very low | 62 Ų | 62 | 109.2 Ų | 109.2 | 64% | 0.639 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 142.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 122 | P | 40.5 | Very low | 46.4 | Very low | 132 Ų | 132 | 112.1 Ų | 112.1 | 86% | 0.857 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 142.9 | -178.7 | 27.9 | -34.5 | 0 | 0 | 0 | 112 | ||
| 123 | A | 35.7 | Very low | 44.1 | Very low | 90 Ų | 90 | 112.9 Ų | 112.9 | 74% | 0.744 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 141.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 124 | P | 48.8 | Very low | 42.3 | Very low | 119 Ų | 119 | 112.5 Ų | 112.5 | 77% | 0.773 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 140.9 | 173.9 | 29 | -34.4 | 0 | 0 | 0 | 110.8 | ||
| 125 | P | 40.8 | Very low | 40.7 | Very low | 129 Ų | 129 | 115.5 Ų | 115.5 | 84% | 0.838 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -68 | 145.7 | 178.7 | 27.9 | -34.2 | 0 | 0 | 0 | 112 | ||
| 126 | S | 38.2 | Very low | 39.4 | Very low | 115 Ų | 115 | 119.3 Ų | 119.3 | 80% | 0.804 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 139.9 | -175.1 | -169.6 | 0 | 0 | 0 | 0 | 113.4 | ||
| 127 | A | 41.9 | Very low | 38.4 | Very low | 88 Ų | 88 | 123.3 Ų | 123.3 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 153 | 161.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 128 | P | 40.4 | Very low | 38.1 | Very low | 115 Ų | 115 | 124.3 Ų | 124.3 | 75% | 0.747 | 78% | 0.778 | S | S | * | * | trans | -135.8 | 173.5 | 143.8 | 42.1 | -30.7 | 0 | 0 | 0 | 111.2 | ||||
| 129 | P | 44.4 | Very low | 37.2 | Very low | 124 Ų | 124 | 121.2 Ų | 121.2 | 81% | 0.805 | 78% | 0.779 | S | S | * | * | -118.3 | -170.5 | -73.7 | 38.7 | -21.7 | 0 | 0 | 0 | 110.2 | |||||
| 130 | P | 47.5 | Very low | 36.8 | Very low | 117 Ų | 117 | 123.5 Ų | 123.5 | 76% | 0.76 | 78% | 0.784 | S | S | * | * | trans | -95 | 156.2 | -156.9 | 37 | -35.9 | 0 | 0 | 0 | 115.9 | ||||
| 131 | E | 31.5 | Very low | 36.2 | Very low | 199 Ų | 199 | 122.7 Ų | 122.7 | 93% | 0.93 | 78% | 0.783 | S | S | * | * | trans | -113.9 | 155.8 | 150.4 | -70.3 | -161.8 | 145.7 | 0 | 0 | 110.3 | ||||
| 132 | T | 31.4 | Very low | 36.1 | Very low | 121 Ų | 121 | 127.2 Ų | 127.2 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | trans | -105.4 | 147.3 | -165.9 | 48.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 133 | M | 30.9 | Very low | 35.4 | Very low | 175 Ų | 175 | 127.8 Ų | 127.8 | 86% | 0.862 | 79% | 0.793 | S | S | * | * | 172.7 | 150.9 | 112 | -89.7 | -174.9 | -158.4 | 0 | 0 | 112.5 | |||||
| 134 | A | 31.1 | Very low | 35.3 | Very low | 85 Ų | 85 | 131.2 Ų | 131.2 | 70% | 0.702 | 80% | 0.798 | S | S | * | * | trans | 31.8 | 139.2 | 139.5 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 135 | T | 33.7 | Very low | 35.4 | Very low | 114 Ų | 114 | 130.6 Ų | 130.6 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | cis | -166.1 | 162.4 | 3.2 | 9.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 136 | E | 32.3 | Very low | 34.8 | Very low | 180 Ų | 180 | 130.1 Ų | 130.1 | 84% | 0.841 | 79% | 0.788 | S | S | * | * | trans | 32.2 | 121.1 | 143.9 | -62.2 | 164.5 | -173.7 | 0 | 0 | 120.3 | ||||
| 137 | D | 32.1 | Very low | 34.5 | Very low | 166 Ų | 166 | 130 Ų | 130 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | -168.6 | 176.9 | 91.3 | -161.9 | 12.3 | 0 | 0 | 0 | 111.3 | |||||
| 138 | N | 32.5 | Very low | 34 | Very low | 152 Ų | 152 | 129.5 Ų | 129.5 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -121.1 | 126.7 | -168.1 | -158.6 | 0.6 | 0 | 0 | 0 | 111 | ||||
| 139 | G | 29.5 | Very low | 33.8 | Very low | 73 Ų | 73 | 130.7 Ų | 130.7 | 75% | 0.753 | 79% | 0.789 | S | S | * | * | trans | -146.8 | 128.7 | -169.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 140 | V | 33 | Very low | 34 | Very low | 141 Ų | 141 | 130.4 Ų | 130.4 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | -99.5 | 125 | -168.5 | 174.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 141 | A | 29.4 | Very low | 34.7 | Very low | 80 Ų | 80 | 130 Ų | 130 | 66% | 0.661 | 78% | 0.784 | S | S | * | * | trans | 35.7 | 149 | 144.3 | 0 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 142 | L | 32.1 | Very low | 35.4 | Very low | 156 Ų | 156 | 126.3 Ų | 126.3 | 82% | 0.817 | 78% | 0.777 | S | S | * | * | trans | 68.2 | 114.9 | 154.6 | -69 | 163.6 | 0 | 0 | 0 | 119.7 | ||||
| 143 | T | 25.7 | Very low | 36.3 | Very low | 144 Ų | 144 | 126.3 Ų | 126.3 | 88% | 0.883 | 78% | 0.78 | S | S | * | * | 179.2 | 152.4 | 106.6 | 27.9 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 144 | L | 34.9 | Very low | 36.7 | Very low | 162 Ų | 162 | 125.9 Ų | 125.9 | 85% | 0.848 | 78% | 0.78 | S | S | * | * | trans | -86 | 174.9 | 159.4 | -80.8 | 160.8 | 0 | 0 | 0 | 108.8 | ||||
| 145 | P | 51.1 | Low | 37.5 | Very low | 106 Ų | 106 | 127.5 Ų | 127.5 | 69% | 0.688 | 78% | 0.783 | S | S | * | * | cis | -158 | -166.1 | 31 | 42.1 | -17.2 | 0 | 0 | 0 | 119 | ||||
| 146 | T | 27.7 | Very low | 37.5 | Very low | 119 Ų | 119 | 131.3 Ų | 131.3 | 73% | 0.73 | 79% | 0.793 | S | S | * | * | trans | 95.5 | 127.7 | 133.5 | -73.4 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 147 | S | 30.9 | Very low | 37.4 | Very low | 112 Ų | 112 | 126.9 Ų | 126.9 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | trans | 72.4 | 158.2 | 151.8 | -78.2 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 148 | A | 31.5 | Very low | 37.3 | Very low | 79 Ų | 79 | 127.3 Ų | 127.3 | 65% | 0.653 | 78% | 0.784 | S | S | * | * | cis | 177.5 | 177.7 | -29.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 149 | V | 36 | Very low | 37.1 | Very low | 140 Ų | 140 | 124.5 Ų | 124.5 | 85% | 0.848 | 78% | 0.776 | S | S | * | * | trans | 87.5 | 141.4 | 161.4 | -175.3 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 150 | P | 49.6 | Very low | 37.1 | Very low | 118 Ų | 118 | 129.6 Ų | 129.6 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | trans | -123.8 | -120.1 | -149.6 | 27.5 | -0.6 | 0 | 0 | 0 | 118.6 | ||||
| 151 | P | 61.3 | Low | 36.7 | Very low | 108 Ų | 108 | 127.3 Ų | 127.3 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | -108.3 | -176.8 | -126.2 | 41.1 | -25.5 | 0 | 0 | 0 | 115.2 | |||||
| 152 | P | 47.8 | Very low | 36.6 | Very low | 122 Ų | 122 | 126.5 Ų | 126.5 | 79% | 0.792 | 78% | 0.776 | S | S | * | * | -148.7 | -145.7 | 104.5 | 42.1 | -21 | 0 | 0 | 0 | 114.2 | |||||
| 153 | P | 50.4 | Low | 36.5 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 79% | 0.786 | 78% | 0.781 | S | S | * | * | -129.9 | -176.3 | -114.8 | 39.9 | -17.8 | 0 | 0 | 0 | 117.8 | |||||
| 154 | L | 38.6 | Very low | 36.6 | Very low | 165 Ų | 165 | 126.5 Ų | 126.5 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | -87.4 | 158.6 | 173.9 | -76 | 160.8 | 0 | 0 | 0 | 114 | ||||
| 155 | P | 46.6 | Very low | 36.3 | Very low | 119 Ų | 119 | 126 Ų | 126 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | trans | -104.2 | 164.3 | 156.5 | 37.8 | -29.6 | 0 | 0 | 0 | 113.2 | ||||
| 156 | E | 33.7 | Very low | 35.3 | Very low | 195 Ų | 195 | 130 Ų | 130 | 91% | 0.911 | 78% | 0.782 | S | S | * | * | trans | -115.5 | -175.2 | -175.8 | -58.6 | -176.9 | 122.1 | 0 | 0 | 113.7 | ||||
| 157 | A | 30.8 | Very low | 35.4 | Very low | 86 Ų | 86 | 131.8 Ų | 131.8 | 71% | 0.711 | 78% | 0.782 | S | S | * | * | trans | 86 | 141 | 164.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 158 | Q | 30.6 | Very low | 35.3 | Very low | 176 Ų | 176 | 135 Ų | 135 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | cis | -162.8 | 155.4 | -7.9 | -122.3 | 168.6 | -19.3 | 0 | 0 | 112 | ||||
| 159 | S | 28.2 | Very low | 35.1 | Very low | 93 Ų | 93 | 138.7 Ų | 138.7 | 65% | 0.65 | 79% | 0.794 | S | S | * | * | trans | 35.9 | 133.5 | 139.1 | -67.7 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 160 | E | 28.6 | Very low | 34.8 | Very low | 180 Ų | 180 | 138.1 Ų | 138.1 | 84% | 0.841 | 79% | 0.792 | S | S | * | * | cis | -150.7 | -159.8 | -9.3 | -45.1 | -165.2 | 159.3 | 0 | 0 | 107 | ||||
| 161 | A | 25.9 | Very low | 33.8 | Very low | 93 Ų | 93 | 140.8 Ų | 140.8 | 77% | 0.769 | 80% | 0.795 | S | S | * | * | cis | -165.1 | 170.8 | -3.7 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 162 | G | 26.5 | Very low | 32.2 | Very low | 63 Ų | 63 | 145.1 Ų | 145.1 | 65% | 0.649 | 81% | 0.806 | S | S | * | * | cis | 166.1 | 144.1 | -7.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 163 | L | 30.7 | Very low | 31.1 | Very low | 177 Ų | 177 | 149.8 Ų | 149.8 | 93% | 0.927 | 81% | 0.807 | S | S | * | * | trans | 67.3 | 145.6 | 170.5 | -54.3 | 179.4 | 0 | 0 | 0 | 117 | ||||
| 164 | T | 27.8 | Very low | 30 | Very low | 122 Ų | 122 | 152.7 Ų | 152.7 | 75% | 0.748 | 81% | 0.81 | S | S | * | * | cis | -139.9 | 149.3 | -1 | 47 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 165 | D | 28.7 | Very low | 29.5 | Very low | 153 Ų | 153 | 153.8 Ų | 153.8 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | -155.2 | 173.8 | 130 | -138.1 | -37 | 0 | 0 | 0 | 111.8 | ||||
| 166 | Q | 30 | Very low | 28.4 | Very low | 189 Ų | 189 | 154.7 Ų | 154.7 | 88% | 0.883 | 81% | 0.809 | S | S | * | * | trans | -93.2 | 159.7 | -160.9 | -74.3 | 167.7 | 94.4 | 0 | 0 | 115.8 | ||||
| 167 | Q | 29.1 | Very low | 28.1 | Very low | 157 Ų | 157 | 153.6 Ų | 153.6 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | trans | -118.5 | 123.4 | -171.8 | 173.3 | -175.7 | -10.9 | 0 | 0 | 110.8 | ||||
| 168 | L | 29 | Very low | 28 | Very low | 178 Ų | 178 | 157.8 Ų | 157.8 | 93% | 0.932 | 81% | 0.809 | S | S | * | * | trans | -136.7 | 125.1 | 160.7 | -83.3 | 174.8 | 0 | 0 | 0 | 109.8 | ||||
| 169 | Q | 27.1 | Very low | 27.9 | Very low | 158 Ų | 158 | 156.8 Ų | 156.8 | 74% | 0.738 | 81% | 0.809 | S | S | * | * | trans | -109.6 | 143.2 | 170.8 | -66.4 | 171.1 | -6.8 | 0 | 0 | 108.2 | ||||
| 170 | P | 30.8 | Very low | 27.8 | Very low | 127 Ų | 127 | 161.4 Ų | 161.4 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 139.6 | 162.1 | -9.7 | 27.2 | 0 | 0 | 0 | 110.5 | ||
| 171 | E | 28 | Very low | 28 | Very low | 175 Ų | 175 | 159.8 Ų | 159.8 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 136.9 | 162.7 | -76.7 | -176.8 | 90.9 | 0 | 0 | 110.2 | ||
| 172 | E | 27.6 | Very low | 28.2 | Very low | 198 Ų | 198 | 163.4 Ų | 163.4 | 93% | 0.925 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 135 | 157.3 | -67.6 | -173.6 | 104.7 | 0 | 0 | 109.8 | ||
| 173 | R | 24.8 | Very low | 28.4 | Very low | 220 Ų | 220 | 169.5 Ų | 169.5 | 83% | 0.83 | 83% | 0.83 | S | S | * | * | trans | -138.2 | 130.8 | 162.6 | -176.6 | 174.5 | -71.4 | -131.8 | 1.7 | 110.4 | ||||
| 174 | Q | 27.1 | Very low | 28.6 | Very low | 182 Ų | 182 | 166.4 Ų | 166.4 | 85% | 0.85 | 82% | 0.82 | S | S | * | * | trans | -80 | 148.9 | 179.6 | -55.9 | 162.8 | -61.5 | 0 | 0 | 111.7 | ||||
| 175 | E | 27.3 | Very low | 29.1 | Very low | 188 Ų | 188 | 165.1 Ų | 165.1 | 88% | 0.879 | 82% | 0.822 | S | S | * | * | trans | 171.8 | 140.6 | 148.5 | -100 | 169.4 | -153.6 | 0 | 0 | 107 | ||||
| 176 | D | 25.1 | Very low | 29.8 | Very low | 138 Ų | 138 | 163.4 Ų | 163.4 | 74% | 0.738 | 82% | 0.819 | S | S | * | * | cis | -155.7 | 160.4 | -28.5 | -164.6 | -2.8 | 0 | 0 | 0 | 106.9 | ||||
| 177 | H | 27.3 | Very low | 30.3 | Very low | 173 Ų | 173 | 160.4 Ų | 160.4 | 80% | 0.801 | 82% | 0.816 | S | S | * | * | trans | -144.5 | 103.3 | 179.1 | -94.2 | 43.8 | 0 | 0 | 0 | 112 | ||||
| 178 | Q | 28.5 | Very low | 30.6 | Very low | 174 Ų | 174 | 158.2 Ų | 158.2 | 81% | 0.813 | 83% | 0.825 | S | S | * | * | trans | -161.3 | 152 | 156.3 | -120.7 | 133.7 | 115 | 0 | 0 | 112.6 | ||||
| 179 | D | 28.7 | Very low | 30.6 | Very low | 154 Ų | 154 | 153.5 Ų | 153.5 | 82% | 0.824 | 82% | 0.819 | S | S | * | * | trans | 60.7 | 145.3 | 177.5 | -55.4 | -34.9 | 0 | 0 | 0 | 116.6 | ||||
| 180 | E | 25.6 | Very low | 30.8 | Very low | 190 Ų | 190 | 150 Ų | 150 | 89% | 0.888 | 83% | 0.825 | S | S | * | * | cis | -133 | 150.7 | 12.6 | -164.4 | 175.3 | 114.2 | 0 | 0 | 111.4 | ||||
| 181 | L | 32.9 | Very low | 30.8 | Very low | 146 Ų | 146 | 151.7 Ų | 151.7 | 76% | 0.764 | 83% | 0.827 | S | S | * | * | trans | -122.9 | 131.3 | -176.1 | -149.4 | 173.1 | 0 | 0 | 0 | 110 | ||||
| 182 | Q | 30 | Very low | 31.2 | Very low | 170 Ų | 170 | 152 Ų | 152 | 79% | 0.794 | 83% | 0.829 | S | S | * | * | trans | 116.5 | 122 | 164.5 | -63.9 | 159.6 | 30.2 | 0 | 0 | 115.3 | ||||
| 183 | Q | 30.5 | Very low | 31.5 | Very low | 191 Ų | 191 | 150.3 Ų | 150.3 | 89% | 0.893 | 83% | 0.825 | S | S | * | * | -164.3 | 170 | 106.4 | -101.6 | -167.2 | 55.5 | 0 | 0 | 111.2 | |||||
| 184 | P | 35.6 | Very low | 32 | Very low | 111 Ų | 111 | 145.5 Ų | 145.5 | 72% | 0.721 | 82% | 0.821 | S | S | * | * | trans | -104.5 | 167.1 | -131.6 | 39.8 | -39.6 | 0 | 0 | 0 | 116.7 | ||||
| 185 | A | 37.4 | Very low | 32.5 | Very low | 96 Ų | 96 | 142.6 Ų | 142.6 | 79% | 0.793 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -78.3 | 138.4 | 167.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 186 | P | 42.4 | Very low | 33 | Very low | 117 Ų | 117 | 139.6 Ų | 139.6 | 76% | 0.76 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 163.7 | 159.8 | 34.6 | -31.5 | 0 | 0 | 0 | 111.5 | ||
| 187 | P | 42.1 | Very low | 33.2 | Very low | 125 Ų | 125 | 139.6 Ų | 139.6 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -90.2 | 161 | -159.6 | 35.2 | -37.4 | 0 | 0 | 0 | 115.2 | ||
| 188 | A | 34.3 | Very low | 33.4 | Very low | 112 Ų | 112 | 140 Ų | 140 | 93% | 0.926 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 131.7 | 164.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 189 | G | 29.4 | Very low | 34.1 | Very low | 78 Ų | 78 | 136.7 Ų | 136.7 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | -152.2 | 113.8 | 166.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 190 | G | 32.3 | Very low | 34.5 | Very low | 84 Ų | 84 | 135.3 Ų | 135.3 | 87% | 0.866 | 81% | 0.814 | S | S | * | * | trans | -89 | 147.3 | 179 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 191 | D | 30.8 | Very low | 34.9 | Very low | 163 Ų | 163 | 132 Ų | 132 | 87% | 0.872 | 81% | 0.813 | S | S | * | * | trans | -145.2 | 155.9 | 152.5 | -148.4 | -12 | 0 | 0 | 0 | 109.7 | ||||
| 192 | E | 35.6 | Very low | 34.8 | Very low | 182 Ų | 182 | 132.4 Ų | 132.4 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | trans | -95.5 | 115.6 | -167.4 | -176.4 | -175.3 | 131.8 | 0 | 0 | 111.4 | ||||
| 193 | L | 32.8 | Very low | 35.3 | Very low | 163 Ų | 163 | 130.1 Ų | 130.1 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | trans | -148.1 | 143.1 | 170 | -103.2 | 129.5 | 0 | 0 | 0 | 113.6 | ||||
| 194 | T | 35.4 | Very low | 35.4 | Very low | 119 Ų | 119 | 130.7 Ų | 130.7 | 73% | 0.73 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 149.9 | -170.9 | 47.6 | 0 | 0 | 0 | 0 | 113.4 | P196 | T194-P196 WeakPolarHBondContact O-CD 3.49Š|
| 195 | P | 37.4 | Very low | 35.5 | Very low | 121 Ų | 121 | 131.7 Ų | 131.7 | 79% | 0.786 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 129.4 | 172.7 | 30.3 | -33.4 | 0 | 0 | 0 | 111.1 | ||
| 196 | P | 38 | Very low | 35.2 | Very low | 125 Ų | 125 | 134.3 Ų | 134.3 | 81% | 0.812 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -81 | 140.2 | 165.2 | 32.6 | -31.8 | 0 | 0 | 0 | 110.9 | T194 | T194-P196 WeakPolarHBondContact O-CD 3.49Š|
| 197 | T | 30.7 | Very low | 35.2 | Very low | 138 Ų | 138 | 133.1 Ų | 133.1 | 85% | 0.847 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 137.4 | 177.3 | -50.4 | 0 | 0 | 0 | 0 | 112.3 | ||
| 198 | E | 31.3 | Very low | 35.1 | Very low | 181 Ų | 181 | 132.2 Ų | 132.2 | 85% | 0.846 | 82% | 0.817 | S | S | * | * | trans | -111.4 | 156 | 157.2 | -93.9 | -157.6 | 128.8 | 0 | 0 | 111.8 | ||||
| 199 | P | 41.9 | Very low | 35.6 | Very low | 105 Ų | 105 | 133.9 Ų | 133.9 | 68% | 0.682 | 81% | 0.809 | S | S | * | * | trans | -82.4 | 164.4 | -167.2 | 33.7 | -36.8 | 0 | 0 | 0 | 114.1 | ||||
| 200 | P | 37.7 | Very low | 36.1 | Very low | 124 Ų | 124 | 135.7 Ų | 135.7 | 81% | 0.805 | 81% | 0.807 | S | S | * | * | trans | -72.6 | 150.2 | -176.1 | 30.5 | -36.6 | 0 | 0 | 0 | 113.3 | ||||
| 201 | S | 33.7 | Very low | 36.9 | Very low | 122 Ų | 122 | 137 Ų | 137 | 85% | 0.853 | 80% | 0.8 | S | S | * | * | trans | -126.1 | 121.9 | 161.5 | 43 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 202 | D | 31.8 | Very low | 37.8 | Very low | 154 Ų | 154 | 134.6 Ų | 134.6 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | trans | -82.5 | 158.3 | -177 | -97.1 | -50.3 | 0 | 0 | 0 | 112.2 | ||||
| 203 | P | 41.2 | Very low | 38.7 | Very low | 121 Ų | 121 | 131.3 Ų | 131.3 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | trans | -80.4 | 154.7 | -155.1 | 31.1 | -37.3 | 0 | 0 | 0 | 114 | ||||
| 204 | K | 32.3 | Very low | 39.9 | Very low | 203 Ų | 203 | 129 Ų | 129 | 88% | 0.883 | 78% | 0.783 | S | S | * | * | trans | -125.4 | 125.3 | 160.5 | -153.8 | 170.8 | -170.4 | 177.7 | 0 | 110.3 | D206 | K204-D206 PolarHBondContact O-N 3.41Š| ||
| 205 | T | 36 | Very low | 41.1 | Very low | 133 Ų | 133 | 127.4 Ų | 127.4 | 82% | 0.816 | 77% | 0.769 | S | S | * | * | trans | -43.2 | 115 | -175.4 | -47.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 206 | D | 32.1 | Very low | 42.8 | Very low | 151 Ų | 151 | 125.4 Ų | 125.4 | 81% | 0.807 | 76% | 0.758 | S | S | * | * | trans | -105.4 | 121.7 | 154.9 | -166.8 | 0.2 | 0 | 0 | 0 | 108.4 | K204 S208 | K204-D206 PolarHBondContact O-N 3.41Å; D206-S208 VanDerWaalsContact C-N 3.27Å; D206-S208 PolarHBondContact O-N 3.1Å; D206-S208 VanDerWaalsContact O-N 3.12Å | ||
| 207 | A | 43.5 | Very low | 44.4 | Very low | 91 Ų | 91 | 127.3 Ų | 127.3 | 75% | 0.752 | 76% | 0.756 | S | S | * | * | trans | -92.2 | 56.7 | -168 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 208 | S | 39.9 | Very low | 46.5 | Very low | 107 Ų | 107 | 127.4 Ų | 127.4 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 151.9 | 175.6 | -164.6 | 0 | 0 | 0 | 0 | 111.7 | D206 | D206-S208 VanDerWaalsContact C-N 3.27Å; D206-S208 PolarHBondContact O-N 3.1Å; D206-S208 VanDerWaalsContact O-N 3.12Å |
| 209 | L | 44.6 | Very low | 48.7 | Very low | 146 Ų | 146 | 119.6 Ų | 119.6 | 76% | 0.764 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 152.5 | -176.8 | -69.5 | 163 | 0 | 0 | 0 | 111.5 | ||
| 210 | P | 39.2 | Very low | 50.6 | Low | 117 Ų | 117 | 119.9 Ų | 119.9 | 76% | 0.76 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 127.5 | 174.7 | 24.1 | -34 | 0 | 0 | 0 | 109.4 | ||
| 211 | P | 49 | Very low | 52.7 | Low | 112 Ų | 112 | 115.7 Ų | 115.7 | 73% | 0.727 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 147.7 | -173.6 | 24.2 | -34 | 0 | 0 | 0 | 110.6 | ||
| 212 | P | 49.6 | Very low | 55.1 | Low | 112 Ų | 112 | 112.1 Ų | 112.1 | 73% | 0.727 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 146.1 | 174.9 | 24.6 | -33.9 | 0 | 0 | 0 | 110 | ||
| 213 | P | 54.1 | Low | 57.7 | Low | 112 Ų | 112 | 106.1 Ų | 106.1 | 73% | 0.727 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -55 | 132.1 | -172.6 | 22.3 | -33.7 | 0 | 0 | 0 | 110.2 | L215 | P213-L215 PolarHBondContact O-N 3.49Å; P213-L215 VanDerWaalsContact O-N 3.11Å |
| 214 | P | 58.1 | Low | 59.7 | Low | 116 Ų | 116 | 102 Ų | 102 | 75% | 0.753 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 121.5 | -167.7 | 22 | -33.5 | 0 | 0 | 0 | 110.5 | S216 | P214-S216 PolarHBondContact O-N 2.93Š|
| 215 | L | 60.3 | Low | 62.1 | Low | 85 Ų | 85 | 96.2 Ų | 96.2 | 45% | 0.445 | 58% | 0.582 | S | S | . | * | P | Polyproline II helix | trans | -51 | 133.3 | 177.6 | -64.6 | 177.2 | 0 | 0 | 0 | 109.9 | L94 P213 A219 K220 L223 | L94-L215 HydrophobicContact CD1-CD2 4.12Å; P213-L215 PolarHBondContact O-N 3.49Å; P213-L215 VanDerWaalsContact O-N 3.11Å; L215-A219 HydrophobicContact CB-CB 4.35Å; L215-K220 HydrophobicContact CB-CG 3.93Å; L215-K220 WeakPolarHBondContact O-CD 3.45Å; L215-K220 WeakPolarHBondContact O-CE 3.43Å; L215-K220 PolarHBondContact O-NZ 3.45Å; L215-L223 HydrophobicContact CD1-CD1 4.18Å |
| 216 | S | 73.5 | Confident | 64.4 | Low | 78 Ų | 78 | 91.7 Ų | 91.7 | 55% | 0.545 | 55% | 0.553 | S | S | . | * | P | Polyproline II helix | trans | -51.8 | 147.4 | 177.4 | 177.9 | 0 | 0 | 0 | 0 | 110.7 | P214 N218 A219 K220 | P214-S216 PolarHBondContact O-N 2.93Å; S216-N218 PolarHBondContact O-N 2.94Å; S216-A219 WeakPolarHBondContact O-CA 3.47Å; S216-A219 WeakPolarHBondContact O-CB 3.35Å; S216-A219 PolarHBondContact O-N 2.92Å; S216-K220 PolarHBondContact O-N 3.2Å |
| 217 | E | 72 | Confident | 67 | Low | 165 Ų | 165 | 92.3 Ų | 92.3 | 77% | 0.771 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -57 | -35.8 | 179.1 | -63.5 | 178.9 | 150 | 0 | 0 | 111.9 | A219 K220 G221 | E217-A219 PolarHBondContact O-N 3.4Å; E217-K220 PolarHBondContact O-N 3.08Å; E217-G221 PolarHBondContact O-N 3.45Å |
| 218 | N | 73.9 | Confident | 69 | Low | 140 Ų | 140 | 95.3 Ų | 95.3 | 75% | 0.749 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.6 | -33.5 | 172.1 | -72.2 | 30.3 | 0 | 0 | 0 | 113.2 | S216 F222 | S216-N218 PolarHBondContact O-N 2.94Å; N218-F222 WeakPolarHBondContact O-CB 3.44Å; N218-F222 PolarHBondContact O-N 3.04Å |
| 219 | A | 78.3 | Confident | 71.1 | Confident | 17 Ų | 17 | 91.7 Ų | 91.7 | 14% | 0.14 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -71.9 | -42.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | L94 L215 S216 E217 F222 L223 | L94-A219 HydrophobicContact CD1-CB 4.06Å; L94-A219 HydrophobicContact CD2-CB 3.53Å; L94-A219 HydrophobicContact CG-CB 4.47Å; L215-A219 HydrophobicContact CB-CB 4.35Å; S216-A219 WeakPolarHBondContact O-CA 3.47Å; S216-A219 WeakPolarHBondContact O-CB 3.35Å; S216-A219 PolarHBondContact O-N 2.92Å; E217-A219 PolarHBondContact O-N 3.4Å; A219-F222 PolarHBondContact O-N 3.2Å; A219-L223 WeakPolarHBondContact O-CG 3.48Å; A219-L223 PolarHBondContact O-N 3.41Å |
| 220 | K | 81.6 | Confident | 73.1 | Confident | 111 Ų | 111 | 86.7 Ų | 86.7 | 48% | 0.483 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.1 | -45.3 | 172.3 | -69 | 172.7 | 173.6 | 166.4 | 0 | 111.6 | L215 S216 E217 F222 L223 A224 | L215-K220 HydrophobicContact CB-CG 3.93Å; L215-K220 WeakPolarHBondContact O-CD 3.45Å; L215-K220 WeakPolarHBondContact O-CE 3.43Å; L215-K220 PolarHBondContact O-NZ 3.45Å; S216-K220 PolarHBondContact O-N 3.2Å; E217-K220 PolarHBondContact O-N 3.08Å; K220-F222 VanDerWaalsContact C-N 3.34Å; K220-F222 PolarHBondContact O-N 2.72Å; K220-L223 PolarHBondContact O-N 2.92Å; K220-A224 VanDerWaalsContact O-CB 3.28Å; K220-A224 WeakPolarHBondContact O-CB 3.12Å; K220-A224 PolarHBondContact O-N 3.04Å |
| 221 | G | 82.8 | Confident | 75.4 | Confident | 36 Ų | 36 | 89.5 Ų | 89.5 | 37% | 0.371 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.5 | -39.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | E217 T225 | E217-G221 PolarHBondContact O-N 3.45Å; G221-T225 WeakPolarHBondContact O-CB 3.48Å; G221-T225 PolarHBondContact O-N 2.78Å; G221-T225 PolarHBondContact O-OG1 3.21Å |
| 222 | F | 84.4 | Confident | 77.2 | Confident | 48 Ų | 48 | 92.1 Ų | 92.1 | 21% | 0.211 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -64.4 | -49 | 174.4 | 174.1 | -109.3 | 0 | 0 | 0 | 112.6 | L93 L94 N97 N218 A219 K220 T225 L226 | L93-F222 HydrophobicContact CB-CE1 4.47Å; L94-F222 HydrophobicContact CD2-CD1 3.74Å; L94-F222 HydrophobicContact CD2-CE1 4.43Å; N97-F222 HydrophobicContact CB-CE1 3.85Å; N97-F222 HydrophobicContact CB-CE2 4.15Å; N97-F222 HydrophobicContact CB-CZ 3.61Å; N97-F222 WeakPolarHBondContact ND2-CD2 3.38Å; N97-F222 WeakPolarHBondContact ND2-CE2 3.26Å; N97-F222 WeakPolarHBondContact ND2-CG 3.37Å; N97-F222 WeakPolarHBondContact ND2-CZ 3.31Å; N218-F222 WeakPolarHBondContact O-CB 3.44Å; N218-F222 PolarHBondContact O-N 3.04Å; A219-F222 PolarHBondContact O-N 3.2Å; K220-F222 VanDerWaalsContact C-N 3.34Å; K220-F222 PolarHBondContact O-N 2.72Å; F222-T225 WeakPolarHBondContact O-CB 3.4Å; F222-T225 PolarHBondContact O-N 2.59Å; F222-L226 HydrophobicContact CD1-CD1 4.19Å; F222-L226 HydrophobicContact CE1-CD1 3.57Å; F222-L226 HydrophobicContact CE1-CG 4.32Å; F222-L226 HydrophobicContact CE2-CD1 4.2Å; F222-L226 HydrophobicContact CE2-CD2 4.29Å; F222-L226 HydrophobicContact CE2-CG 4.15Å; F222-L226 HydrophobicContact CZ-CD1 3.58Å; F222-L226 HydrophobicContact CZ-CD2 4.3Å; F222-L226 HydrophobicContact CZ-CG 4.04Å; F222-L226 PolarHBondContact O-N 3.24Å |
| 223 | L | 85.2 | Confident | 79 | Confident | 28 Ų | 28 | 92.2 Ų | 92.2 | 15% | 0.147 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -63.5 | -43.4 | 178 | -67.4 | 176.4 | 0 | 0 | 0 | 111.9 | D90 L94 L215 A219 K220 T225 L226 E227 | D90-L223 HydrophobicContact CB-CD1 4.16Å; D90-L223 HydrophobicContact CB-CD2 4.05Å; L94-L223 HydrophobicContact CD1-CD1 4.05Å; L94-L223 HydrophobicContact CD2-CG 4.36Å; L94-L223 HydrophobicContact CG-CD1 4.45Å; L94-L223 HydrophobicContact CG-CD2 4.39Å; L94-L223 HydrophobicContact CG-CG 4.42Å; L215-L223 HydrophobicContact CD1-CD1 4.18Å; A219-L223 WeakPolarHBondContact O-CG 3.48Å; A219-L223 PolarHBondContact O-N 3.41Å; K220-L223 PolarHBondContact O-N 2.92Å; L223-T225 PolarHBondContact O-N 3.1Å; L223-L226 HydrophobicContact CD2-CD1 4.44Å; L223-L226 WeakPolarHBondContact O-CB 3.35Å; L223-L226 PolarHBondContact O-N 3.22Å; L223-L226 VanDerWaalsContact O-N 3.15Å; L223-E227 WeakPolarHBondContact O-CB 3.41Å; L223-E227 PolarHBondContact O-N 3.48Å |
| 224 | A | 84.2 | Confident | 80.5 | Confident | 34 Ų | 34 | 90.3 Ų | 90.3 | 28% | 0.281 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.8 | -27.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113 | K220 Q228 | K220-A224 VanDerWaalsContact O-CB 3.28Å; K220-A224 WeakPolarHBondContact O-CB 3.12Å; K220-A224 PolarHBondContact O-N 3.04Å; A224-Q228 WeakPolarHBondContact O-CB 3.44Å; A224-Q228 VanDerWaalsContact O-CD 3.26Å; A224-Q228 VanDerWaalsContact O-CG 3.23Å; A224-Q228 WeakPolarHBondContact O-CG 3.43Å; A224-Q228 PolarHBondContact O-N 3.3Å; A224-Q228 PolarHBondContact O-NE2 2.95Å; A224-Q228 VanDerWaalsContact O-NE2 3.07Å |
| 225 | T | 82.6 | Confident | 82 | Confident | 81 Ų | 81 | 88 Ų | 88 | 50% | 0.497 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -72.5 | -45.8 | 171.7 | -55.9 | 0 | 0 | 0 | 0 | 110.2 | G221 F222 L223 E227 Q228 S229 | G221-T225 WeakPolarHBondContact O-CB 3.48Å; G221-T225 PolarHBondContact O-N 2.78Å; G221-T225 PolarHBondContact O-OG1 3.21Å; F222-T225 WeakPolarHBondContact O-CB 3.4Å; F222-T225 PolarHBondContact O-N 2.59Å; L223-T225 PolarHBondContact O-N 3.1Å; T225-E227 VanDerWaalsContact C-N 3.29Å; T225-E227 PolarHBondContact O-N 3.43Å; T225-Q228 CarbonylContact O-C 3.59Å; T225-Q228 PolarHBondContact O-N 2.9Å; T225-Q228 VanDerWaalsContact O-N 3.09Å; T225-S229 WeakPolarHBondContact O-CB 3.34Å; T225-S229 PolarHBondContact O-N 2.86Å; T225-S229 PolarHBondContact O-OG 2.88Å |
| 226 | L | 83.9 | Confident | 83.4 | Confident | 39 Ų | 39 | 88.6 Ų | 88.6 | 20% | 0.204 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -59.5 | -37.7 | 174.7 | -70.6 | -179 | 0 | 0 | 0 | 112.8 | L93 F222 L223 Q228 L234 | L93-L226 HydrophobicContact CD1-CD1 4.21Å; F222-L226 HydrophobicContact CD1-CD1 4.19Å; F222-L226 HydrophobicContact CE1-CD1 3.57Å; F222-L226 HydrophobicContact CE1-CG 4.32Å; F222-L226 HydrophobicContact CE2-CD1 4.2Å; F222-L226 HydrophobicContact CE2-CD2 4.29Å; F222-L226 HydrophobicContact CE2-CG 4.15Å; F222-L226 HydrophobicContact CZ-CD1 3.58Å; F222-L226 HydrophobicContact CZ-CD2 4.3Å; F222-L226 HydrophobicContact CZ-CG 4.04Å; F222-L226 PolarHBondContact O-N 3.24Å; L223-L226 HydrophobicContact CD2-CD1 4.44Å; L223-L226 WeakPolarHBondContact O-CB 3.35Å; L223-L226 PolarHBondContact O-N 3.22Å; L223-L226 VanDerWaalsContact O-N 3.15Å; L226-Q228 VanDerWaalsContact C-N 3.27Å; L226-Q228 PolarHBondContact O-N 3.23Å; L226-L234 HydrophobicContact CD2-CD1 3.52Å; L226-L234 HydrophobicContact CD2-CD2 4.05Å; L226-L234 HydrophobicContact CD2-CG 4.43Å |
| 227 | E | 85.9 | Confident | 84 | Confident | 163 Ų | 163 | 90.1 Ų | 90.1 | 76% | 0.762 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -66.6 | -27.1 | 176.2 | -174.9 | 179.2 | -156.9 | 0 | 0 | 112.8 | L223 T225 | L223-E227 WeakPolarHBondContact O-CB 3.41Å; L223-E227 PolarHBondContact O-N 3.48Å; T225-E227 VanDerWaalsContact C-N 3.29Å; T225-E227 PolarHBondContact O-N 3.43Å |
| 228 | Q | 85.1 | Confident | 84.8 | Confident | 154 Ų | 154 | 86.4 Ų | 86.4 | 72% | 0.72 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -97.2 | -19.5 | -179.7 | -70.1 | 167.3 | 45.5 | 0 | 0 | 113.1 | A224 T225 L226 | A224-Q228 WeakPolarHBondContact O-CB 3.44Å; A224-Q228 VanDerWaalsContact O-CD 3.26Å; A224-Q228 VanDerWaalsContact O-CG 3.23Å; A224-Q228 WeakPolarHBondContact O-CG 3.43Å; A224-Q228 PolarHBondContact O-N 3.3Å; A224-Q228 PolarHBondContact O-NE2 2.95Å; A224-Q228 VanDerWaalsContact O-NE2 3.07Å; T225-Q228 CarbonylContact O-C 3.59Å; T225-Q228 PolarHBondContact O-N 2.9Å; T225-Q228 VanDerWaalsContact O-N 3.09Å; L226-Q228 VanDerWaalsContact C-N 3.27Å; L226-Q228 PolarHBondContact O-N 3.23Å |
| 229 | S | 84.1 | Confident | 85.7 | Confident | 32 Ų | 32 | 84.8 Ų | 84.8 | 22% | 0.224 | 45% | 0.448 | C | S | . | . | S | Bend | trans | -79 | 135.6 | 177.9 | -80.9 | 0 | 0 | 0 | 0 | 112.8 | T225 E233 | T225-S229 WeakPolarHBondContact O-CB 3.34Å; T225-S229 PolarHBondContact O-N 2.86Å; T225-S229 PolarHBondContact O-OG 2.88Å; S229-E233 VanDerWaalsContact CA-OE2 3.27Å; S229-E233 WeakPolarHBondContact CA-OE2 3.37Å; S229-E233 WeakPolarHBondContact CB-OE2 3.41Å; S229-E233 PolarHBondContact OG-OE2 3.49Å |
| 230 | G | 86.9 | Confident | 86.3 | Confident | 41 Ų | 41 | 88.6 Ų | 88.6 | 42% | 0.423 | 47% | 0.466 | S | S | . | . | trans | -70.9 | 156.5 | 168.1 | 0 | 0 | 0 | 0 | 0 | 112 | E232 E233 L234 | G230-E232 VanDerWaalsContact C-N 3.25Å; G230-E232 PolarHBondContact O-N 2.99Å; G230-E233 PolarHBondContact O-N 3.45Å; G230-E233 VanDerWaalsContact O-N 3.11Å; G230-L234 PolarHBondContact O-N 3.37Å | ||
| 231 | E | 87.9 | Confident | 86.7 | Confident | 176 Ų | 176 | 85.2 Ų | 85.2 | 82% | 0.822 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -53.7 | -42.3 | 175.9 | -177.1 | 177.5 | -167.4 | 0 | 0 | 112.1 | L234 S235 | E231-L234 PolarHBondContact O-N 2.93Å; E231-S235 WeakPolarHBondContact O-CB 3.31Å; E231-S235 PolarHBondContact O-N 3.4Å |
| 232 | E | 87.1 | Confident | 87 | Confident | 166 Ų | 166 | 88.5 Ų | 88.5 | 78% | 0.776 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -62.9 | -45.1 | 176.8 | -172.4 | 173.8 | -166.8 | 0 | 0 | 112.1 | G230 S235 L236 | G230-E232 VanDerWaalsContact C-N 3.25Å; G230-E232 PolarHBondContact O-N 2.99Å; E232-S235 PolarHBondContact O-N 3.15Å; E232-S235 PolarHBondContact O-OG 2.98Å; E232-L236 PolarHBondContact O-N 2.87Å |
| 233 | E | 87.4 | Confident | 87.2 | Confident | 114 Ų | 114 | 90.6 Ų | 90.6 | 53% | 0.533 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.5 | -43.6 | 178.1 | -176.1 | -177.7 | -145.2 | 0 | 0 | 111.8 | S229 G230 S235 L236 H237 | S229-E233 VanDerWaalsContact CA-OE2 3.27Å; S229-E233 WeakPolarHBondContact CA-OE2 3.37Å; S229-E233 WeakPolarHBondContact CB-OE2 3.41Å; S229-E233 PolarHBondContact OG-OE2 3.49Å; G230-E233 PolarHBondContact O-N 3.45Å; G230-E233 VanDerWaalsContact O-N 3.11Å; E233-S235 VanDerWaalsContact C-N 3.32Å; E233-S235 PolarHBondContact O-N 3.17Å; E233-L236 PolarHBondContact O-N 3.2Å; E233-H237 WeakPolarHBondContact O-CB 3.26Å; E233-H237 PolarHBondContact O-N 3.34Å |
| 234 | L | 85.6 | Confident | 87.4 | Confident | 73 Ų | 73 | 92.7 Ų | 92.7 | 38% | 0.382 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.8 | -39.9 | 175.7 | 179.8 | 57.6 | 0 | 0 | 0 | 111.4 | L226 G230 E231 H237 L238 | L226-L234 HydrophobicContact CD2-CD1 3.52Å; L226-L234 HydrophobicContact CD2-CD2 4.05Å; L226-L234 HydrophobicContact CD2-CG 4.43Å; G230-L234 PolarHBondContact O-N 3.37Å; E231-L234 PolarHBondContact O-N 2.93Å; L234-H237 PolarHBondContact O-N 3.26Å; L234-L238 WeakPolarHBondContact O-CB 3.36Å; L234-L238 PolarHBondContact O-N 2.9Å |
| 235 | S | 88.4 | Confident | 87.5 | Confident | 67 Ų | 67 | 91.8 Ų | 91.8 | 47% | 0.469 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 176.4 | 82.7 | 0 | 0 | 0 | 0 | 111.8 | E231 E232 E233 L238 Q239 | E231-S235 WeakPolarHBondContact O-CB 3.31Å; E231-S235 PolarHBondContact O-N 3.4Å; E232-S235 PolarHBondContact O-N 3.15Å; E232-S235 PolarHBondContact O-OG 2.98Å; E233-S235 VanDerWaalsContact C-N 3.32Å; E233-S235 PolarHBondContact O-N 3.17Å; S235-L238 PolarHBondContact O-N 3.41Å; S235-Q239 VanDerWaalsContact O-CB 3.32Å; S235-Q239 WeakPolarHBondContact O-CB 3.34Å; S235-Q239 PolarHBondContact O-N 2.87Å |
| 236 | L | 91 | Very high | 87.9 | Confident | 97 Ų | 97 | 95.2 Ų | 95.2 | 51% | 0.508 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.9 | -44.6 | 178.1 | -173.1 | 68 | 0 | 0 | 0 | 111.3 | E232 E233 L238 Q239 D240 | E232-L236 PolarHBondContact O-N 2.87Å; E233-L236 PolarHBondContact O-N 3.2Å; L236-L238 PolarHBondContact O-N 3.45Å; L236-Q239 WeakPolarHBondContact O-CB 3.47Å; L236-Q239 PolarHBondContact O-N 2.93Å; L236-D240 PolarHBondContact O-N 3.24Å |
| 237 | H | 86.6 | Confident | 88.1 | Confident | 110 Ų | 110 | 96.7 Ų | 96.7 | 51% | 0.509 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.8 | -41.5 | 177 | -174.4 | 71.1 | 0 | 0 | 0 | 112.1 | E233 L234 Q239 D240 R241 | E233-H237 WeakPolarHBondContact O-CB 3.26Å; E233-H237 PolarHBondContact O-N 3.34Å; L234-H237 PolarHBondContact O-N 3.26Å; H237-Q239 VanDerWaalsContact C-N 3.35Å; H237-D240 PolarHBondContact O-N 3.06Å; H237-R241 WeakPolarHBondContact O-CG 3.33Å; H237-R241 PolarHBondContact O-N 2.87Å; H237-R241 VanDerWaalsContact O-N 3.1Å |
| 238 | L | 88 | Confident | 88 | Confident | 87 Ų | 87 | 89.1 Ų | 89.1 | 46% | 0.455 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.4 | -36.2 | 175.3 | -172 | 64.2 | 0 | 0 | 0 | 111.8 | L234 S235 L236 M242 | L234-L238 WeakPolarHBondContact O-CB 3.36Å; L234-L238 PolarHBondContact O-N 2.9Å; S235-L238 PolarHBondContact O-N 3.41Å; L236-L238 PolarHBondContact O-N 3.45Å; L238-M242 WeakPolarHBondContact O-CB 3.39Å; L238-M242 PolarHBondContact O-N 3.31Å |
| 239 | Q | 91.9 | Very high | 88.1 | Confident | 107 Ų | 107 | 85.1 Ų | 85.1 | 50% | 0.5 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.8 | -47.3 | 174.2 | -175.4 | 175.4 | 16.2 | 0 | 0 | 111.6 | S235 L236 H237 R241 M242 L243 | S235-Q239 VanDerWaalsContact O-CB 3.32Å; S235-Q239 WeakPolarHBondContact O-CB 3.34Å; S235-Q239 PolarHBondContact O-N 2.87Å; L236-Q239 WeakPolarHBondContact O-CB 3.47Å; L236-Q239 PolarHBondContact O-N 2.93Å; H237-Q239 VanDerWaalsContact C-N 3.35Å; Q239-R241 PolarHBondContact O-N 2.87Å; Q239-M242 PolarHBondContact O-N 3.1Å; Q239-L243 HydrophobicContact CG-CD1 4.05Å; Q239-L243 HydrophobicContact CG-CG 4.41Å; Q239-L243 WeakPolarHBondContact O-CB 3.25Å; Q239-L243 VanDerWaalsContact O-CG 3.29Å; Q239-L243 WeakPolarHBondContact O-CG 3.39Å; Q239-L243 PolarHBondContact O-N 3.1Å |
| 240 | D | 90.7 | Very high | 88.4 | Confident | 97 Ų | 97 | 84.7 Ų | 84.7 | 52% | 0.519 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61.1 | -43.9 | 177 | -85.7 | -14 | 0 | 0 | 0 | 112.1 | L236 H237 M242 L243 F244 | L236-D240 PolarHBondContact O-N 3.24Å; H237-D240 PolarHBondContact O-N 3.06Å; D240-M242 VanDerWaalsContact C-N 3.34Å; D240-M242 PolarHBondContact O-N 3.42Å; D240-L243 PolarHBondContact O-N 3.05Å; D240-F244 WeakPolarHBondContact O-CB 3.47Å; D240-F244 PolarHBondContact O-N 3.48Å |
| 241 | R | 90.2 | Very high | 88.3 | Confident | 40 Ų | 40 | 86.4 Ų | 86.4 | 15% | 0.151 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -61.9 | -40.4 | 174.3 | -70.8 | -174.4 | 77.9 | 170.2 | 12.6 | 112.2 | N97 S101 E104 H237 Q239 S245 | N97-R241 PolarHBondContact OD1-NH1 3.1Å; S101-R241 PolarHBondContact OG-NH2 3.14Å; E104-R241 WeakPolarHBondContact OE1-CB 3.39Å; E104-R241 IonicContact OE1-CZ 2.66Å; E104-R241 IonicContact OE1-NE 2.89Å; E104-R241 PolarHBondContact OE1-NE 2.66Å; E104-R241 IonicContact OE1-NH2 3.5Å; E104-R241 PolarHBondContact OE1-NH2 3.35Å; E104-R241 IonicContact OE2-CZ 2.59Å; E104-R241 IonicContact OE2-NE 2.77Å; E104-R241 PolarHBondContact OE2-NE 2.98Å; E104-R241 IonicContact OE2-NH2 3.66Å; E104-R241 PolarHBondContact OE2-NH2 3.33Å; H237-R241 WeakPolarHBondContact O-CG 3.33Å; H237-R241 PolarHBondContact O-N 2.87Å; H237-R241 VanDerWaalsContact O-N 3.1Å; Q239-R241 PolarHBondContact O-N 2.87Å; R241-S245 VanDerWaalsContact O-CB 3.31Å; R241-S245 WeakPolarHBondContact O-CB 3.49Å; R241-S245 PolarHBondContact O-N 3.23Å |
| 242 | M | 89.4 | Confident | 88.3 | Confident | 104 Ų | 104 | 79.5 Ų | 79.5 | 51% | 0.512 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -66.7 | -42.1 | 175.8 | -170.2 | -173.7 | -59.4 | 0 | 0 | 112 | W100 L238 Q239 D240 S245 K246 | W100-M242 HydrophobicContact CZ2-CB 4.48Å; L238-M242 WeakPolarHBondContact O-CB 3.39Å; L238-M242 PolarHBondContact O-N 3.31Å; Q239-M242 PolarHBondContact O-N 3.1Å; D240-M242 VanDerWaalsContact C-N 3.34Å; D240-M242 PolarHBondContact O-N 3.42Å; M242-S245 PolarHBondContact O-N 2.9Å; M242-K246 WeakPolarHBondContact O-CB 3.42Å; M242-K246 PolarHBondContact O-N 3.13Å |
| 243 | L | 89.9 | Confident | 88.4 | Confident | 92 Ų | 92 | 75 Ų | 75 | 48% | 0.482 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.5 | -45.5 | 176.8 | -73.3 | 171.5 | 0 | 0 | 0 | 111.4 | Q239 D240 K246 D247 | Q239-L243 HydrophobicContact CG-CD1 4.05Å; Q239-L243 HydrophobicContact CG-CG 4.41Å; Q239-L243 WeakPolarHBondContact O-CB 3.25Å; Q239-L243 VanDerWaalsContact O-CG 3.29Å; Q239-L243 WeakPolarHBondContact O-CG 3.39Å; Q239-L243 PolarHBondContact O-N 3.1Å; D240-L243 PolarHBondContact O-N 3.05Å; L243-K246 PolarHBondContact O-N 2.98Å; L243-D247 WeakPolarHBondContact O-CB 3.4Å; L243-D247 PolarHBondContact O-N 2.9Å |
| 244 | F | 88.3 | Confident | 88.5 | Confident | 73 Ų | 73 | 76.2 Ų | 76.2 | 32% | 0.32 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -58.9 | -49.7 | 174.1 | 173.8 | -96.3 | 0 | 0 | 0 | 111.9 | E104 K108 D240 K246 D247 A248 | E104-F244 HydrophobicContact CB-CE1 4.39Å; E104-F244 HydrophobicContact CG-CD1 4.35Å; E104-F244 HydrophobicContact CG-CE1 4.45Å; K108-F244 HydrophobicContact CD-CZ 4.36Å; K108-F244 HydrophobicContact CG-CE1 4.18Å; K108-F244 HydrophobicContact CG-CZ 3.72Å; D240-F244 WeakPolarHBondContact O-CB 3.47Å; D240-F244 PolarHBondContact O-N 3.48Å; F244-K246 PolarHBondContact O-N 3.39Å; F244-D247 PolarHBondContact O-N 2.88Å; F244-A248 HydrophobicContact CZ-CB 4.44Å; F244-A248 WeakPolarHBondContact O-CB 3.46Å; F244-A248 PolarHBondContact O-N 2.73Å |
| 245 | S | 86.4 | Confident | 88.6 | Confident | 14 Ų | 14 | 74.8 Ų | 74.8 | 10% | 0.098 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60.5 | -45.3 | 179.4 | -174.3 | 0 | 0 | 0 | 0 | 111.5 | R241 M242 A248 I249 | R241-S245 VanDerWaalsContact O-CB 3.31Å; R241-S245 WeakPolarHBondContact O-CB 3.49Å; R241-S245 PolarHBondContact O-N 3.23Å; M242-S245 PolarHBondContact O-N 2.9Å; S245-A248 PolarHBondContact O-N 3.12Å; S245-I249 WeakPolarHBondContact O-CB 3.3Å; S245-I249 VanDerWaalsContact O-CG1 3.24Å; S245-I249 WeakPolarHBondContact O-CG1 3.42Å; S245-I249 PolarHBondContact O-N 3.26Å |
| 246 | K | 90.1 | Very high | 88.5 | Confident | 154 Ų | 154 | 76.2 Ų | 76.2 | 67% | 0.67 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -61.6 | -45.9 | 177.5 | -177.4 | -178.9 | 179.6 | 179.7 | 0 | 112.7 | M242 L243 F244 G250 | M242-K246 WeakPolarHBondContact O-CB 3.42Å; M242-K246 PolarHBondContact O-N 3.13Å; L243-K246 PolarHBondContact O-N 2.98Å; F244-K246 PolarHBondContact O-N 3.39Å; K246-G250 PolarHBondContact O-N 3.22Å |
| 247 | D | 88.8 | Confident | 88.6 | Confident | 70 Ų | 70 | 76 Ų | 76 | 37% | 0.374 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.9 | -48.7 | 176.3 | 174.3 | 62.9 | 0 | 0 | 0 | 111.5 | R111 L243 F244 I249 G250 H251 | R111-D247 IonicContact CZ-OD2 2.75Å; R111-D247 IonicContact NH1-OD2 3.77Å; R111-D247 IonicContact NH2-OD2 3.35Å; R111-D247 PolarHBondContact NH2-OD2 3.46Å; L243-D247 WeakPolarHBondContact O-CB 3.4Å; L243-D247 PolarHBondContact O-N 2.9Å; F244-D247 PolarHBondContact O-N 2.88Å; D247-I249 PolarHBondContact O-N 2.88Å; D247-G250 CarbonylContact O-C 3.39Å; D247-G250 WeakPolarHBondContact O-CA 3.45Å; D247-G250 PolarHBondContact O-N 2.91Å; D247-G250 VanDerWaalsContact O-N 3.09Å; D247-H251 PolarHBondContact O-CD2 2.87Å; D247-H251 PolarHBondContact O-N 2.96Å; D247-H251 IonicContact OD1-CD2 2.83Å; D247-H251 PolarHBondContact OD1-CD2 3.18Å; D247-H251 IonicContact OD1-NE2 3.51Å; D247-H251 IonicContact OD2-CD2 3.9Å |
| 248 | A | 85.2 | Confident | 88.9 | Confident | 3 Ų | 3 | 78.9 Ų | 78.9 | 3% | 0.025 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -69.3 | -35.1 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V107 F244 S245 H251 L252 | V107-A248 HydrophobicContact CG1-CB 3.41Å; V107-A248 VanDerWaalsContact CG1-CB 3.41Å; F244-A248 HydrophobicContact CZ-CB 4.44Å; F244-A248 WeakPolarHBondContact O-CB 3.46Å; F244-A248 PolarHBondContact O-N 2.73Å; S245-A248 PolarHBondContact O-N 3.12Å; A248-H251 PolarHBondContact O-N 2.9Å; A248-L252 PolarHBondContact O-N 2.95Å |
| 249 | I | 86.8 | Confident | 88.9 | Confident | 71 Ų | 71 | 78.7 Ų | 78.7 | 36% | 0.364 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -65.7 | -42.5 | 168 | -67.9 | 167.3 | 0 | 0 | 0 | 110.6 | S245 D247 H251 L252 V253 | S245-I249 WeakPolarHBondContact O-CB 3.3Å; S245-I249 VanDerWaalsContact O-CG1 3.24Å; S245-I249 WeakPolarHBondContact O-CG1 3.42Å; S245-I249 PolarHBondContact O-N 3.26Å; D247-I249 PolarHBondContact O-N 2.88Å; I249-H251 VanDerWaalsContact C-N 3.28Å; I249-H251 PolarHBondContact O-N 3.47Å; I249-L252 WeakPolarHBondContact O-CB 3.46Å; I249-L252 PolarHBondContact O-N 2.81Å; I249-L252 VanDerWaalsContact O-N 3.07Å; I249-V253 HydrophobicContact CG2-CG2 4.45Å; I249-V253 WeakPolarHBondContact O-CG2 3.23Å; I249-V253 PolarHBondContact O-N 2.89Å |
| 250 | G | 89 | Confident | 88.8 | Confident | 22 Ų | 22 | 78.6 Ų | 78.6 | 23% | 0.227 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.1 | -32 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | K246 D247 R254 | K246-G250 PolarHBondContact O-N 3.22Å; D247-G250 CarbonylContact O-C 3.39Å; D247-G250 WeakPolarHBondContact O-CA 3.45Å; D247-G250 PolarHBondContact O-N 2.91Å; D247-G250 VanDerWaalsContact O-N 3.09Å; G250-R254 VanDerWaalsContact O-CG 3.29Å; G250-R254 WeakPolarHBondContact O-CG 3.46Å; G250-R254 PolarHBondContact O-N 2.89Å; G250-R254 PolarHBondContact O-NH1 3.36Å |
| 251 | H | 86.4 | Confident | 88.9 | Confident | 77 Ų | 77 | 76.2 Ų | 76.2 | 36% | 0.356 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -67.8 | -44.7 | 168.7 | -87.9 | -121.7 | 0 | 0 | 0 | 111.9 | R111 D247 A248 I249 R254 V255 | R111-H251 PolarHBondContact NH2-CD2 3.26Å; R111-H251 PolarHBondContact NH2-ND1 3.38Å; D247-H251 PolarHBondContact O-CD2 2.87Å; D247-H251 PolarHBondContact O-N 2.96Å; D247-H251 IonicContact OD1-CD2 2.83Å; D247-H251 PolarHBondContact OD1-CD2 3.18Å; D247-H251 IonicContact OD1-NE2 3.51Å; D247-H251 IonicContact OD2-CD2 3.9Å; A248-H251 PolarHBondContact O-N 2.9Å; I249-H251 VanDerWaalsContact C-N 3.28Å; I249-H251 PolarHBondContact O-N 3.47Å; H251-R254 PolarHBondContact CD2-NH1 3.35Å; H251-R254 PolarHBondContact O-N 2.75Å; H251-V255 VanDerWaalsContact O-CG2 3.26Å; H251-V255 WeakPolarHBondContact O-CG2 3.49Å; H251-V255 PolarHBondContact O-N 2.81Å |
| 252 | L | 86.1 | Confident | 89 | Confident | 32 Ų | 32 | 80.5 Ų | 80.5 | 17% | 0.168 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.4 | -43.1 | -179.4 | -178.4 | 61.2 | 0 | 0 | 0 | 112.5 | L110 I114 A248 I249 V255 F256 | L110-L252 HydrophobicContact CD2-CD1 3.55Å; L110-L252 HydrophobicContact CD2-CD2 3.7Å; L110-L252 HydrophobicContact CD2-CG 4.28Å; L110-L252 HydrophobicContact CG-CD1 3.84Å; I114-L252 HydrophobicContact CD1-CD1 3.76Å; A248-L252 PolarHBondContact O-N 2.95Å; I249-L252 WeakPolarHBondContact O-CB 3.46Å; I249-L252 PolarHBondContact O-N 2.81Å; I249-L252 VanDerWaalsContact O-N 3.07Å; L252-V255 PolarHBondContact O-N 3.13Å; L252-V255 VanDerWaalsContact O-N 3.15Å; L252-F256 HydrophobicContact CD1-CD2 3.98Å; L252-F256 HydrophobicContact CD1-CE2 3.58Å; L252-F256 HydrophobicContact CD1-CZ 4.38Å; L252-F256 HydrophobicContact CD2-CE2 4.11Å; L252-F256 HydrophobicContact CG-CD2 3.88Å; L252-F256 HydrophobicContact CG-CE2 3.65Å; L252-F256 WeakPolarHBondContact O-CD2 3.3Å; L252-F256 PolarHBondContact O-N 3.28Å |
| 253 | V | 90 | Very high | 88.9 | Confident | 72 Ų | 72 | 78.7 Ų | 78.7 | 44% | 0.436 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -58.1 | -51.8 | 175.8 | 173 | 0 | 0 | 0 | 0 | 110.7 | I249 V255 F256 D257 | I249-V253 HydrophobicContact CG2-CG2 4.45Å; I249-V253 WeakPolarHBondContact O-CG2 3.23Å; I249-V253 PolarHBondContact O-N 2.89Å; V253-V255 PolarHBondContact O-N 2.95Å; V253-F256 CarbonylContact O-C 3.57Å; V253-F256 WeakPolarHBondContact O-CA 3.49Å; V253-F256 WeakPolarHBondContact O-CB 3.46Å; V253-F256 PolarHBondContact O-N 3.45Å; V253-D257 PolarHBondContact O-N 3.26Å |
| 254 | R | 89.3 | Confident | 89 | Confident | 139 Ų | 139 | 79 Ų | 79 | 53% | 0.525 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -59.9 | -19.7 | 178 | -65 | 173.9 | -163.4 | 122.7 | -7.4 | 114.4 | G250 H251 D257 R258 | G250-R254 VanDerWaalsContact O-CG 3.29Å; G250-R254 WeakPolarHBondContact O-CG 3.46Å; G250-R254 PolarHBondContact O-N 2.89Å; G250-R254 PolarHBondContact O-NH1 3.36Å; H251-R254 PolarHBondContact CD2-NH1 3.35Å; H251-R254 PolarHBondContact O-N 2.75Å; R254-D257 WeakPolarHBondContact CA-OD2 3.21Å; R254-R258 PolarHBondContact O-N 3.39Å |
| 255 | V | 87.9 | Confident | 89.1 | Confident | 43 Ų | 43 | 80.8 Ų | 80.8 | 26% | 0.261 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -85.5 | -42.3 | 174.7 | 174.3 | 0 | 0 | 0 | 0 | 110.2 | I114 H251 L252 V253 D257 R258 L259 | I114-V255 HydrophobicContact CD1-CB 4.38Å; I114-V255 HydrophobicContact CD1-CG1 3.92Å; I114-V255 HydrophobicContact CG1-CG1 4.11Å; I114-V255 HydrophobicContact CG2-CB 4.19Å; I114-V255 HydrophobicContact CG2-CG1 3.63Å; I114-V255 HydrophobicContact CG2-CG2 3.59Å; H251-V255 VanDerWaalsContact O-CG2 3.26Å; H251-V255 WeakPolarHBondContact O-CG2 3.49Å; H251-V255 PolarHBondContact O-N 2.81Å; L252-V255 PolarHBondContact O-N 3.13Å; L252-V255 VanDerWaalsContact O-N 3.15Å; V253-V255 PolarHBondContact O-N 2.95Å; V255-D257 VanDerWaalsContact C-N 3.34Å; V255-R258 PolarHBondContact O-N 3.42Å; V255-L259 WeakPolarHBondContact O-CB 3.32Å; V255-L259 PolarHBondContact O-N 3.02Å |
| 256 | F | 87.4 | Confident | 89 | Confident | 97 Ų | 97 | 84.7 Ų | 84.7 | 43% | 0.425 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.1 | -43 | 169.9 | -80.3 | -62.1 | 0 | 0 | 0 | 111.7 | L252 V253 R258 L259 H260 | L252-F256 HydrophobicContact CD1-CD2 3.98Å; L252-F256 HydrophobicContact CD1-CE2 3.58Å; L252-F256 HydrophobicContact CD1-CZ 4.38Å; L252-F256 HydrophobicContact CD2-CE2 4.11Å; L252-F256 HydrophobicContact CG-CD2 3.88Å; L252-F256 HydrophobicContact CG-CE2 3.65Å; L252-F256 WeakPolarHBondContact O-CD2 3.3Å; L252-F256 PolarHBondContact O-N 3.28Å; V253-F256 CarbonylContact O-C 3.57Å; V253-F256 WeakPolarHBondContact O-CA 3.49Å; V253-F256 WeakPolarHBondContact O-CB 3.46Å; V253-F256 PolarHBondContact O-N 3.45Å; F256-R258 VanDerWaalsContact C-N 3.31Å; F256-R258 PolarHBondContact O-N 3.19Å; F256-L259 PolarHBondContact O-N 2.86Å; F256-L259 VanDerWaalsContact O-N 3.14Å; F256-H260 PolarHBondContact O-N 3.11Å; F256-H260 PolarHBondContact O-ND1 2.87Å |
| 257 | D | 92.5 | Very high | 88.7 | Confident | 92 Ų | 92 | 80.1 Ų | 80.1 | 49% | 0.492 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -57.4 | -45.7 | 176.9 | -56.9 | -29.9 | 0 | 0 | 0 | 111.2 | V253 R254 V255 H260 A261 | V253-D257 PolarHBondContact O-N 3.26Å; R254-D257 WeakPolarHBondContact CA-OD2 3.21Å; V255-D257 VanDerWaalsContact C-N 3.34Å; D257-H260 PolarHBondContact O-N 2.98Å; D257-A261 WeakPolarHBondContact O-CB 3.45Å; D257-A261 PolarHBondContact O-N 2.93Å |
| 258 | R | 91.7 | Very high | 88.6 | Confident | 170 Ų | 170 | 80.7 Ų | 80.7 | 64% | 0.642 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -65.4 | -37.5 | 176.5 | -169.5 | -168.5 | -46.6 | -71.8 | -9.4 | 112.5 | R254 V255 F256 R262 | R254-R258 PolarHBondContact O-N 3.39Å; V255-R258 PolarHBondContact O-N 3.42Å; F256-R258 VanDerWaalsContact C-N 3.31Å; F256-R258 PolarHBondContact O-N 3.19Å; R258-R262 WeakPolarHBondContact O-CB 3.42Å; R258-R262 PolarHBondContact O-N 3.27Å |
| 259 | L | 89.4 | Confident | 88.5 | Confident | 83 Ų | 83 | 83.3 Ų | 83.3 | 44% | 0.435 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -70.6 | -42.6 | 178.9 | -177.5 | 62.3 | 0 | 0 | 0 | 111.2 | V255 F256 R262 I263 | V255-L259 WeakPolarHBondContact O-CB 3.32Å; V255-L259 PolarHBondContact O-N 3.02Å; F256-L259 PolarHBondContact O-N 2.86Å; F256-L259 VanDerWaalsContact O-N 3.14Å; L259-R262 PolarHBondContact O-N 3.25Å; L259-I263 HydrophobicContact CD1-CD1 4.32Å; L259-I263 HydrophobicContact CG-CD1 4.01Å; L259-I263 WeakPolarHBondContact O-CB 3.47Å; L259-I263 WeakPolarHBondContact O-CD1 3.44Å; L259-I263 VanDerWaalsContact O-CG1 3.24Å; L259-I263 WeakPolarHBondContact O-CG1 3.44Å; L259-I263 PolarHBondContact O-N 3.22Å |
| 260 | H | 90 | Very high | 88.1 | Confident | 105 Ų | 105 | 85.7 Ų | 85.7 | 49% | 0.486 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.7 | -48.7 | 174.1 | -71 | 98.6 | 0 | 0 | 0 | 110.8 | F256 D257 R262 I263 D264 | F256-H260 PolarHBondContact O-N 3.11Å; F256-H260 PolarHBondContact O-ND1 2.87Å; D257-H260 PolarHBondContact O-N 2.98Å; H260-R262 VanDerWaalsContact C-N 3.31Å; H260-R262 PolarHBondContact O-N 3.27Å; H260-I263 CarbonylContact O-C 3.59Å; H260-I263 WeakPolarHBondContact O-CA 3.34Å; H260-I263 WeakPolarHBondContact O-CB 3.19Å; H260-I263 PolarHBondContact O-N 2.99Å; H260-D264 PolarHBondContact O-N 3.32Å |
| 261 | A | 92.1 | Very high | 87.5 | Confident | 47 Ų | 47 | 91.8 Ų | 91.8 | 39% | 0.388 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -55.2 | -44.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | D257 I263 D264 D265 | D257-A261 WeakPolarHBondContact O-CB 3.45Å; D257-A261 PolarHBondContact O-N 2.93Å; A261-I263 VanDerWaalsContact C-N 3.3Å; A261-I263 PolarHBondContact O-N 2.87Å; A261-D264 PolarHBondContact O-N 2.93Å; A261-D265 WeakPolarHBondContact O-CB 3.5Å; A261-D265 VanDerWaalsContact O-CG 3.23Å; A261-D265 PolarHBondContact O-N 2.88Å |
| 262 | R | 91.6 | Very high | 86.7 | Confident | 130 Ų | 130 | 92 Ų | 92 | 49% | 0.491 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.7 | -29.7 | 175.4 | -173.2 | 178.3 | -179.5 | -180 | 2.5 | 112.9 | E117 R258 L259 H260 M266 | E117-R262 IonicContact OE1-CZ 2.68Å; E117-R262 IonicContact OE1-NH1 3.71Å; E117-R262 PolarHBondContact OE1-NH1 3.42Å; E117-R262 IonicContact OE1-NH2 3.41Å; E117-R262 IonicContact OE2-NH1 3.64Å; R258-R262 WeakPolarHBondContact O-CB 3.42Å; R258-R262 PolarHBondContact O-N 3.27Å; L259-R262 PolarHBondContact O-N 3.25Å; H260-R262 VanDerWaalsContact C-N 3.31Å; H260-R262 PolarHBondContact O-N 3.27Å; R262-M266 VanDerWaalsContact O-CG 3.28Å; R262-M266 WeakPolarHBondContact O-CG 3.41Å; R262-M266 PolarHBondContact O-N 3.49Å; R262-M266 VanDerWaalsContact O-N 3.14Å |
| 263 | I | 88.3 | Confident | 85.4 | Confident | 67 Ų | 67 | 93.5 Ų | 93.5 | 34% | 0.344 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -72.7 | -42.7 | 173.2 | -72.4 | 163.9 | 0 | 0 | 0 | 110.2 | L259 H260 A261 M266 C267 | L259-I263 HydrophobicContact CD1-CD1 4.32Å; L259-I263 HydrophobicContact CG-CD1 4.01Å; L259-I263 WeakPolarHBondContact O-CB 3.47Å; L259-I263 WeakPolarHBondContact O-CD1 3.44Å; L259-I263 VanDerWaalsContact O-CG1 3.24Å; L259-I263 WeakPolarHBondContact O-CG1 3.44Å; L259-I263 PolarHBondContact O-N 3.22Å; H260-I263 CarbonylContact O-C 3.59Å; H260-I263 WeakPolarHBondContact O-CA 3.34Å; H260-I263 WeakPolarHBondContact O-CB 3.19Å; H260-I263 PolarHBondContact O-N 2.99Å; A261-I263 VanDerWaalsContact C-N 3.3Å; A261-I263 PolarHBondContact O-N 2.87Å; I263-M266 HydrophobicContact CG1-CE 4.06Å; I263-M266 CarbonylContact O-C 3.58Å; I263-M266 PolarHBondContact O-N 3.31Å; I263-C267 WeakPolarHBondContact O-CB 3.34Å; I263-C267 PolarHBondContact O-N 2.81Å; I263-C267 PolarHBondContact O-SG 3.13Å; I263-C267 VanDerWaalsContact O-SG 3.41Å |
| 264 | D | 91.3 | Very high | 83.6 | Confident | 99 Ų | 99 | 93.1 Ų | 93.1 | 53% | 0.529 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.2 | -40.3 | 176.7 | -64.5 | -35.9 | 0 | 0 | 0 | 111.5 | H260 A261 M266 C267 T268 | H260-D264 PolarHBondContact O-N 3.32Å; A261-D264 PolarHBondContact O-N 2.93Å; D264-M266 VanDerWaalsContact C-N 3.35Å; D264-M266 PolarHBondContact O-N 2.82Å; D264-C267 PolarHBondContact O-N 3.14Å; D264-T268 WeakPolarHBondContact O-CB 3.5Å; D264-T268 WeakPolarHBondContact O-CG2 3.42Å; D264-T268 PolarHBondContact O-N 3.42Å; D264-T268 PolarHBondContact O-OG1 3.3Å |
| 265 | D | 90.7 | Very high | 81.9 | Confident | 110 Ų | 110 | 95.5 Ų | 95.5 | 59% | 0.588 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -58 | -44.4 | 170.1 | -71.8 | -27.5 | 0 | 0 | 0 | 111.4 | A261 T268 A269 | A261-D265 WeakPolarHBondContact O-CB 3.5Å; A261-D265 VanDerWaalsContact O-CG 3.23Å; A261-D265 PolarHBondContact O-N 2.88Å; D265-T268 WeakPolarHBondContact CA-OG1 3.21Å; D265-T268 PolarHBondContact O-OG1 3.3Å; D265-T268 VanDerWaalsContact O-OG1 3.05Å; D265-A269 WeakPolarHBondContact O-CB 3.19Å; D265-A269 PolarHBondContact O-N 2.71Å |
| 266 | M | 83.6 | Confident | 80.1 | Confident | 96 Ų | 96 | 102 Ų | 102 | 47% | 0.473 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -69.2 | -40.1 | 176 | -74.3 | -174.3 | -56.6 | 0 | 0 | 112.3 | R262 I263 D264 A269 I270 | R262-M266 VanDerWaalsContact O-CG 3.28Å; R262-M266 WeakPolarHBondContact O-CG 3.41Å; R262-M266 PolarHBondContact O-N 3.49Å; R262-M266 VanDerWaalsContact O-N 3.14Å; I263-M266 HydrophobicContact CG1-CE 4.06Å; I263-M266 CarbonylContact O-C 3.58Å; I263-M266 PolarHBondContact O-N 3.31Å; D264-M266 VanDerWaalsContact C-N 3.35Å; D264-M266 PolarHBondContact O-N 2.82Å; M266-A269 PolarHBondContact O-N 2.84Å; M266-I270 WeakPolarHBondContact O-CB 3.27Å; M266-I270 WeakPolarHBondContact O-CD1 3.37Å; M266-I270 WeakPolarHBondContact O-CG1 3.38Å; M266-I270 PolarHBondContact O-N 3.48Å |
| 267 | C | 84.6 | Confident | 78.7 | Confident | 58 Ų | 58 | 102 Ų | 102 | 39% | 0.392 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -67.2 | -38.3 | 179.3 | -79 | 0 | 0 | 0 | 0 | 111.8 | I263 D264 Q271 | I263-C267 WeakPolarHBondContact O-CB 3.34Å; I263-C267 PolarHBondContact O-N 2.81Å; I263-C267 PolarHBondContact O-SG 3.13Å; I263-C267 VanDerWaalsContact O-SG 3.41Å; D264-C267 PolarHBondContact O-N 3.14Å; C267-Q271 WeakPolarHBondContact O-CB 3.01Å; C267-Q271 VanDerWaalsContact O-CG 3.27Å; C267-Q271 WeakPolarHBondContact O-CG 3.38Å; C267-Q271 PolarHBondContact O-N 3.48Å; C267-Q271 VanDerWaalsContact O-N 3.08Å; C267-Q271 PolarHBondContact O-NE2 3.15Å |
| 268 | T | 87.1 | Confident | 77 | Confident | 82 Ų | 82 | 100.9 Ų | 100.9 | 50% | 0.503 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -71 | -40 | 173.1 | 51.1 | 0 | 0 | 0 | 0 | 111.6 | D264 D265 I270 Q271 A272 | D264-T268 WeakPolarHBondContact O-CB 3.5Å; D264-T268 WeakPolarHBondContact O-CG2 3.42Å; D264-T268 PolarHBondContact O-N 3.42Å; D264-T268 PolarHBondContact O-OG1 3.3Å; D265-T268 WeakPolarHBondContact CA-OG1 3.21Å; D265-T268 PolarHBondContact O-OG1 3.3Å; D265-T268 VanDerWaalsContact O-OG1 3.05Å; T268-I270 PolarHBondContact O-N 2.9Å; T268-Q271 PolarHBondContact O-N 3.49Å; T268-A272 WeakPolarHBondContact O-CB 3.42Å; T268-A272 PolarHBondContact O-N 2.86Å |
| 269 | A | 82.8 | Confident | 75.4 | Confident | 58 Ų | 58 | 96.9 Ų | 96.9 | 48% | 0.479 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -62.5 | -39.6 | 173 | 0 | 0 | 0 | 0 | 0 | 113 | D265 M266 A272 A273 | D265-A269 WeakPolarHBondContact O-CB 3.19Å; D265-A269 PolarHBondContact O-N 2.71Å; M266-A269 PolarHBondContact O-N 2.84Å; A269-A272 PolarHBondContact O-N 3.44Å; A269-A273 VanDerWaalsContact O-CB 3.29Å; A269-A273 WeakPolarHBondContact O-CB 3.47Å; A269-A273 PolarHBondContact O-N 3.07Å |
| 270 | I | 77.9 | Confident | 74.1 | Confident | 121 Ų | 121 | 99.8 Ų | 99.8 | 62% | 0.621 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -68 | -37.3 | 175.8 | -71.7 | 164.1 | 0 | 0 | 0 | 111.3 | M266 T268 A273 G274 | M266-I270 WeakPolarHBondContact O-CB 3.27Å; M266-I270 WeakPolarHBondContact O-CD1 3.37Å; M266-I270 WeakPolarHBondContact O-CG1 3.38Å; M266-I270 PolarHBondContact O-N 3.48Å; T268-I270 PolarHBondContact O-N 2.9Å; I270-A273 PolarHBondContact O-N 2.87Å; I270-G274 PolarHBondContact O-N 2.89Å |
| 271 | Q | 76.1 | Confident | 73 | Confident | 149 Ų | 149 | 100.3 Ų | 100.3 | 70% | 0.696 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.5 | -40 | 173.4 | -75.4 | 165.5 | 67.4 | 0 | 0 | 111.8 | C267 T268 G274 | C267-Q271 WeakPolarHBondContact O-CB 3.01Å; C267-Q271 VanDerWaalsContact O-CG 3.27Å; C267-Q271 WeakPolarHBondContact O-CG 3.38Å; C267-Q271 PolarHBondContact O-N 3.48Å; C267-Q271 VanDerWaalsContact O-N 3.08Å; C267-Q271 PolarHBondContact O-NE2 3.15Å; T268-Q271 PolarHBondContact O-N 3.49Å; Q271-G274 PolarHBondContact O-N 3.12Å |
| 272 | A | 69.1 | Low | 72.1 | Confident | 81 Ų | 81 | 102.5 Ų | 102.5 | 67% | 0.669 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69.6 | -30.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | T268 A269 G274 | T268-A272 WeakPolarHBondContact O-CB 3.42Å; T268-A272 PolarHBondContact O-N 2.86Å; A269-A272 PolarHBondContact O-N 3.44Å; A272-G274 PolarHBondContact O-N 3.47Å |
| 273 | A | 59.8 | Low | 71.3 | Confident | 64 Ų | 64 | 101 Ų | 101 | 53% | 0.529 | 61% | 0.609 | S | S | . | * | G | 310 helix | trans | -78.3 | 4.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | A269 I270 E275 | A269-A273 VanDerWaalsContact O-CB 3.29Å; A269-A273 WeakPolarHBondContact O-CB 3.47Å; A269-A273 PolarHBondContact O-N 3.07Å; I270-A273 PolarHBondContact O-N 2.87Å; A273-E275 PolarHBondContact O-N 3.14Å; A273-E275 VanDerWaalsContact O-N 3.14Å |
| 274 | G | 52.4 | Low | 70.8 | Confident | 65 Ų | 65 | 101.5 Ų | 101.5 | 67% | 0.67 | 62% | 0.615 | S | S | * | * | G | 310 helix | trans | -66.8 | -8.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | I270 Q271 A272 | I270-G274 PolarHBondContact O-N 2.89Å; Q271-G274 PolarHBondContact O-N 3.12Å; A272-G274 PolarHBondContact O-N 3.47Å |
| 275 | E | 53.9 | Low | 70.5 | Confident | 188 Ų | 188 | 103.2 Ų | 103.2 | 88% | 0.879 | 61% | 0.614 | S | S | * | * | G | 310 helix | trans | -100.1 | -15 | -176.7 | -62.6 | -167.1 | 143.4 | 0 | 0 | 114.9 | A273 | A273-E275 PolarHBondContact O-N 3.14Å; A273-E275 VanDerWaalsContact O-N 3.14Å |
| 276 | E | 50 | Low | 70.2 | Confident | 181 Ų | 181 | 103.8 Ų | 103.8 | 85% | 0.846 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -126.3 | 127.4 | 173.5 | -71.3 | -160 | 158.6 | 0 | 0 | 112.6 | G278 | E276-G278 PolarHBondContact O-N 3.07Š|
| 277 | G | 57.3 | Low | 70.2 | Confident | 95 Ų | 95 | 108.1 Ų | 108.1 | 98% | 0.979 | 63% | 0.628 | S | S | * | * | trans | -84.7 | 112.6 | -165.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 278 | G | 57 | Low | 70.5 | Confident | 69 Ų | 69 | 110.1 Ų | 110.1 | 71% | 0.711 | 63% | 0.634 | S | S | * | * | trans | -179.1 | 89.7 | 163.9 | 0 | 0 | 0 | 0 | 0 | 117 | E276 | E276-G278 PolarHBondContact O-N 3.07Š| ||
| 279 | P | 57.5 | Low | 70.7 | Confident | 86 Ų | 86 | 110.8 Ų | 110.8 | 56% | 0.558 | 63% | 0.634 | S | S | * | * | trans | -145.1 | 32.4 | 142.3 | 39.8 | -24.3 | 0 | 0 | 0 | 114 | N283 | P279-N283 PolarHBondContact O-N 3.44Å; P279-N283 PolarHBondContact O-ND2 3.24Å | ||
| 280 | L | 62.9 | Low | 71.1 | Confident | 145 Ų | 145 | 110.5 Ų | 110.5 | 76% | 0.759 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -68 | -44.6 | -171.4 | -137.2 | 82.3 | 0 | 0 | 0 | 113.6 | N283 V284 | L280-N283 WeakPolarHBondContact O-CB 3.41Å; L280-N283 PolarHBondContact O-N 2.79Å; L280-V284 PolarHBondContact O-N 3.15Å; L280-V284 VanDerWaalsContact O-N 3.15Å |
| 281 | E | 66.8 | Low | 71.7 | Confident | 116 Ų | 116 | 108.9 Ų | 108.9 | 54% | 0.542 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -59.1 | -49.5 | -176.5 | 178.5 | 72.7 | -163.2 | 0 | 0 | 112 | N283 V284 R285 | E281-N283 VanDerWaalsContact C-N 3.34Å; E281-N283 PolarHBondContact O-N 2.96Å; E281-V284 WeakPolarHBondContact O-CB 3.2Å; E281-V284 PolarHBondContact O-N 3.02Å; E281-R285 VanDerWaalsContact CG-NH2 3.31Å; E281-R285 WeakPolarHBondContact O-CG 3.41Å; E281-R285 PolarHBondContact O-N 3.33Å; E281-R285 VanDerWaalsContact O-N 3.1Å; E281-R285 IonicContact OE1-CZ 2.68Å; E281-R285 IonicContact OE1-NE 2.72Å; E281-R285 PolarHBondContact OE1-NE 3.12Å; E281-R285 VanDerWaalsContact OE1-NE 3.08Å; E281-R285 IonicContact OE1-NH2 2.78Å; E281-R285 PolarHBondContact OE1-NH2 3.2Å |
| 282 | D | 73.3 | Confident | 72.6 | Confident | 92 Ų | 92 | 107.8 Ų | 107.8 | 49% | 0.492 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -73.7 | -25.6 | -178.8 | -65.8 | -44.1 | 0 | 0 | 0 | 112.6 | R285 L286 | D282-R285 PolarHBondContact O-N 2.85Å; D282-R285 WeakPolarHBondContact OD1-CD 3.24Å; D282-R285 IonicContact OD1-CZ 3.61Å; D282-R285 IonicContact OD1-NE 3.54Å; D282-R285 IonicContact OD1-NH1 3.91Å; D282-R285 PolarHBondContact OD1-NH1 2.97Å; D282-L286 WeakPolarHBondContact O-CB 3.41Å; D282-L286 PolarHBondContact O-N 3.18Å |
| 283 | N | 74.9 | Confident | 73.9 | Confident | 100 Ų | 100 | 107.8 Ų | 107.8 | 54% | 0.535 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -64 | -39 | 168.4 | -93.3 | -85.5 | 0 | 0 | 0 | 112.4 | P279 L280 E281 R287 | P279-N283 PolarHBondContact O-N 3.44Å; P279-N283 PolarHBondContact O-ND2 3.24Å; L280-N283 WeakPolarHBondContact O-CB 3.41Å; L280-N283 PolarHBondContact O-N 2.79Å; E281-N283 VanDerWaalsContact C-N 3.34Å; E281-N283 PolarHBondContact O-N 2.96Å; N283-R287 WeakPolarHBondContact O-CB 3.12Å; N283-R287 PolarHBondContact O-N 3.42Å; N283-R287 VanDerWaalsContact O-N 3.08Å |
| 284 | V | 77.6 | Confident | 75.4 | Confident | 77 Ų | 77 | 111.7 Ų | 111.7 | 47% | 0.467 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -64 | -48.8 | 173.4 | 175 | 0 | 0 | 0 | 0 | 110 | L280 E281 L286 R287 D288 | L280-V284 PolarHBondContact O-N 3.15Å; L280-V284 VanDerWaalsContact O-N 3.15Å; E281-V284 WeakPolarHBondContact O-CB 3.2Å; E281-V284 PolarHBondContact O-N 3.02Å; V284-L286 VanDerWaalsContact C-N 3.34Å; V284-L286 PolarHBondContact O-N 3.02Å; V284-R287 WeakPolarHBondContact O-CB 3.4Å; V284-R287 PolarHBondContact O-N 3.22Å; V284-D288 PolarHBondContact O-N 3.4Å |
| 285 | R | 85.3 | Confident | 77.5 | Confident | 134 Ų | 134 | 110.6 Ų | 110.6 | 51% | 0.506 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -59.7 | -40.1 | 178.8 | -64.8 | 167.6 | -175.4 | 172.8 | -4.5 | 112.9 | E281 D282 L289 | E281-R285 VanDerWaalsContact CG-NH2 3.31Å; E281-R285 WeakPolarHBondContact O-CG 3.41Å; E281-R285 PolarHBondContact O-N 3.33Å; E281-R285 VanDerWaalsContact O-N 3.1Å; E281-R285 IonicContact OE1-CZ 2.68Å; E281-R285 IonicContact OE1-NE 2.72Å; E281-R285 PolarHBondContact OE1-NE 3.12Å; E281-R285 VanDerWaalsContact OE1-NE 3.08Å; E281-R285 IonicContact OE1-NH2 2.78Å; E281-R285 PolarHBondContact OE1-NH2 3.2Å; D282-R285 PolarHBondContact O-N 2.85Å; D282-R285 WeakPolarHBondContact OD1-CD 3.24Å; D282-R285 IonicContact OD1-CZ 3.61Å; D282-R285 IonicContact OD1-NE 3.54Å; D282-R285 IonicContact OD1-NH1 3.91Å; D282-R285 PolarHBondContact OD1-NH1 2.97Å; R285-L289 VanDerWaalsContact O-CB 3.32Å; R285-L289 WeakPolarHBondContact O-CB 3.42Å; R285-L289 PolarHBondContact O-N 3.4Å |
| 286 | L | 85.3 | Confident | 79.4 | Confident | 123 Ų | 123 | 110.2 Ų | 110.2 | 64% | 0.644 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64 | -40.8 | 174.1 | -122.6 | 70 | 0 | 0 | 0 | 111.8 | D282 V284 L289 A290 | D282-L286 WeakPolarHBondContact O-CB 3.41Å; D282-L286 PolarHBondContact O-N 3.18Å; V284-L286 VanDerWaalsContact C-N 3.34Å; V284-L286 PolarHBondContact O-N 3.02Å; L286-L289 PolarHBondContact O-N 3.2Å; L286-A290 VanDerWaalsContact O-CB 3.27Å; L286-A290 WeakPolarHBondContact O-CB 3.22Å; L286-A290 PolarHBondContact O-N 2.98Å |
| 287 | R | 83.5 | Confident | 81.5 | Confident | 187 Ų | 187 | 107.4 Ų | 107.4 | 71% | 0.706 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -66.4 | -41 | 178.9 | -160.3 | -177.4 | -154.5 | 109.5 | 3.3 | 111.8 | N283 V284 T291 | N283-R287 WeakPolarHBondContact O-CB 3.12Å; N283-R287 PolarHBondContact O-N 3.42Å; N283-R287 VanDerWaalsContact O-N 3.08Å; V284-R287 WeakPolarHBondContact O-CB 3.4Å; V284-R287 PolarHBondContact O-N 3.22Å; R287-T291 WeakPolarHBondContact O-CB 3.41Å; R287-T291 PolarHBondContact O-N 2.98Å; R287-T291 PolarHBondContact O-OG1 2.94Å |
| 288 | D | 89.5 | Confident | 83.3 | Confident | 99 Ų | 99 | 108.5 Ų | 108.5 | 53% | 0.529 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -68.1 | -43.1 | 176.3 | -70.6 | -19 | 0 | 0 | 0 | 111.3 | V284 T291 L292 | V284-D288 PolarHBondContact O-N 3.4Å; D288-T291 PolarHBondContact O-N 3.21Å; D288-L292 WeakPolarHBondContact O-CB 3.49Å; D288-L292 PolarHBondContact O-N 2.83Å |
| 289 | L | 92.6 | Very high | 85.1 | Confident | 96 Ų | 96 | 111.3 Ų | 111.3 | 50% | 0.503 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.1 | -43 | 175.3 | -179.1 | 61.1 | 0 | 0 | 0 | 112 | R285 L286 L292 L293 | R285-L289 VanDerWaalsContact O-CB 3.32Å; R285-L289 WeakPolarHBondContact O-CB 3.42Å; R285-L289 PolarHBondContact O-N 3.4Å; L286-L289 PolarHBondContact O-N 3.2Å; L289-L292 PolarHBondContact O-N 3.38Å; L289-L293 HydrophobicContact CD1-CD1 4.4Å; L289-L293 HydrophobicContact CG-CD1 4.14Å; L289-L293 WeakPolarHBondContact O-CB 3.36Å; L289-L293 WeakPolarHBondContact O-CG 3.28Å; L289-L293 PolarHBondContact O-N 2.96Å |
| 290 | A | 89.7 | Confident | 86.8 | Confident | 53 Ų | 53 | 111 Ų | 111 | 44% | 0.438 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.5 | -43.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | L286 L293 Q294 | L286-A290 VanDerWaalsContact O-CB 3.27Å; L286-A290 WeakPolarHBondContact O-CB 3.22Å; L286-A290 PolarHBondContact O-N 2.98Å; A290-L293 PolarHBondContact O-N 2.69Å; A290-Q294 WeakPolarHBondContact O-CB 3.38Å; A290-Q294 PolarHBondContact O-N 2.97Å |
| 291 | T | 91.5 | Very high | 88.3 | Confident | 86 Ų | 86 | 107.2 Ų | 107.2 | 53% | 0.528 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 176 | -54.3 | 0 | 0 | 0 | 0 | 111.6 | R287 D288 Q294 G295 | R287-T291 WeakPolarHBondContact O-CB 3.41Å; R287-T291 PolarHBondContact O-N 2.98Å; R287-T291 PolarHBondContact O-OG1 2.94Å; D288-T291 PolarHBondContact O-N 3.21Å; T291-Q294 PolarHBondContact O-N 2.99Å; T291-G295 PolarHBondContact O-N 2.94Å |
| 292 | L | 95.8 | Very high | 89.5 | Confident | 127 Ų | 127 | 105.3 Ų | 105.3 | 67% | 0.665 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.6 | -42.7 | 177 | -177 | 67.5 | 0 | 0 | 0 | 112 | D288 L289 G295 R296 | D288-L292 WeakPolarHBondContact O-CB 3.49Å; D288-L292 PolarHBondContact O-N 2.83Å; L289-L292 PolarHBondContact O-N 3.38Å; L292-G295 PolarHBondContact O-N 3.01Å; L292-R296 WeakPolarHBondContact O-CB 3.46Å; L292-R296 PolarHBondContact O-N 2.79Å |
| 293 | L | 95.1 | Very high | 90.5 | Very high | 81 Ų | 81 | 105.9 Ų | 105.9 | 42% | 0.424 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.6 | -48.2 | 173.6 | -78.8 | 166.1 | 0 | 0 | 0 | 111 | L289 A290 G295 R296 H297 | L289-L293 HydrophobicContact CD1-CD1 4.4Å; L289-L293 HydrophobicContact CG-CD1 4.14Å; L289-L293 WeakPolarHBondContact O-CB 3.36Å; L289-L293 WeakPolarHBondContact O-CG 3.28Å; L289-L293 PolarHBondContact O-N 2.96Å; A290-L293 PolarHBondContact O-N 2.69Å; L293-G295 VanDerWaalsContact C-N 3.34Å; L293-G295 PolarHBondContact O-N 3.34Å; L293-R296 CarbonylContact O-C 3.58Å; L293-R296 WeakPolarHBondContact O-CB 3.43Å; L293-R296 PolarHBondContact O-N 3.23Å; L293-R296 VanDerWaalsContact O-N 3.11Å; L293-H297 PolarHBondContact O-CD2 3.11Å; L293-H297 VanDerWaalsContact O-CD2 3.24Å; L293-H297 PolarHBondContact O-N 2.91Å |
| 294 | Q | 92.5 | Very high | 91.5 | Very high | 146 Ų | 146 | 107 Ų | 107 | 68% | 0.682 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.6 | -42.3 | 178.6 | -167.5 | 174.9 | 18.9 | 0 | 0 | 111.7 | A290 T291 H297 H298 | A290-Q294 WeakPolarHBondContact O-CB 3.38Å; A290-Q294 PolarHBondContact O-N 2.97Å; T291-Q294 PolarHBondContact O-N 2.99Å; Q294-H297 PolarHBondContact O-N 3.44Å; Q294-H298 WeakPolarHBondContact O-CB 3.47Å; Q294-H298 PolarHBondContact O-N 2.95Å |
| 295 | G | 94.9 | Very high | 92.3 | Very high | 42 Ų | 42 | 107.2 Ų | 107.2 | 43% | 0.433 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.2 | -41.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | T291 L292 L293 H298 K299 | T291-G295 PolarHBondContact O-N 2.94Å; L292-G295 PolarHBondContact O-N 3.01Å; L293-G295 VanDerWaalsContact C-N 3.34Å; L293-G295 PolarHBondContact O-N 3.34Å; G295-H298 PolarHBondContact O-N 3.26Å; G295-K299 WeakPolarHBondContact O-CB 3.43Å; G295-K299 PolarHBondContact O-N 3.3Å |
| 296 | R | 95.2 | Very high | 92.7 | Very high | 179 Ų | 179 | 105.5 Ų | 105.5 | 68% | 0.675 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -65.8 | -40.5 | 175.1 | -171.3 | -179.9 | -177.4 | -172.8 | 1.1 | 112.3 | L292 L293 M300 | L292-R296 WeakPolarHBondContact O-CB 3.46Å; L292-R296 PolarHBondContact O-N 2.79Å; L293-R296 CarbonylContact O-C 3.58Å; L293-R296 WeakPolarHBondContact O-CB 3.43Å; L293-R296 PolarHBondContact O-N 3.23Å; L293-R296 VanDerWaalsContact O-N 3.11Å; R296-M300 WeakPolarHBondContact O-CB 3.39Å; R296-M300 PolarHBondContact O-N 3.28Å |
| 297 | H | 93.8 | Very high | 93.1 | Very high | 122 Ų | 122 | 104.2 Ų | 104.2 | 57% | 0.565 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.8 | -43.8 | 174.9 | -86.1 | -83.2 | 0 | 0 | 0 | 111.8 | L293 Q294 M300 S301 | L293-H297 PolarHBondContact O-CD2 3.11Å; L293-H297 VanDerWaalsContact O-CD2 3.24Å; L293-H297 PolarHBondContact O-N 2.91Å; Q294-H297 PolarHBondContact O-N 3.44Å; H297-M300 PolarHBondContact O-N 3.19Å; H297-S301 WeakPolarHBondContact O-CB 3.45Å; H297-S301 PolarHBondContact O-N 3.43Å |
| 298 | H | 93.9 | Very high | 93.5 | Very high | 118 Ų | 118 | 99 Ų | 99 | 55% | 0.546 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.9 | -44.7 | 175.1 | -179.3 | 69.2 | 0 | 0 | 0 | 111.6 | Q294 G295 S301 M302 | Q294-H298 WeakPolarHBondContact O-CB 3.47Å; Q294-H298 PolarHBondContact O-N 2.95Å; G295-H298 PolarHBondContact O-N 3.26Å; H298-S301 WeakPolarHBondContact O-CB 3.35Å; H298-S301 PolarHBondContact O-N 3.41Å; H298-M302 WeakPolarHBondContact O-CG 3.35Å; H298-M302 PolarHBondContact O-N 3.31Å |
| 299 | K | 95.6 | Very high | 93.8 | Very high | 129 Ų | 129 | 99.8 Ų | 99.8 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -58.5 | -49.1 | 174.3 | 178.5 | 171.2 | 172.8 | 174.3 | 0 | 112.1 | G295 S301 M302 E303 | G295-K299 WeakPolarHBondContact O-CB 3.43Å; G295-K299 PolarHBondContact O-N 3.3Å; K299-S301 VanDerWaalsContact C-N 3.27Å; K299-S301 PolarHBondContact O-N 2.72Å; K299-M302 PolarHBondContact O-N 3.36Å; K299-E303 WeakPolarHBondContact CE-OE1 3.28Å; K299-E303 HydrophobicContact CG-CG 4.49Å; K299-E303 IonicContact NZ-OE1 3.08Å; K299-E303 WeakPolarHBondContact O-CG 3.27Å; K299-E303 PolarHBondContact O-N 3.16Å |
| 300 | M | 93.4 | Very high | 94 | Very high | 78 Ų | 78 | 99.5 Ų | 99.5 | 38% | 0.384 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62 | -35.1 | 177.2 | -169.1 | -159.2 | -64.7 | 0 | 0 | 112.2 | R296 H297 K304 | R296-M300 WeakPolarHBondContact O-CB 3.39Å; R296-M300 PolarHBondContact O-N 3.28Å; H297-M300 PolarHBondContact O-N 3.19Å; M300-K304 WeakPolarHBondContact O-CB 3.45Å; M300-K304 WeakPolarHBondContact O-CG 3.45Å; M300-K304 PolarHBondContact O-N 2.93Å |
| 301 | S | 93.9 | Very high | 94.3 | Very high | 66 Ų | 66 | 101.3 Ų | 101.3 | 46% | 0.462 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.3 | -46 | 175.7 | -178.2 | 0 | 0 | 0 | 0 | 111.5 | H297 H298 K299 K304 L305 | H297-S301 WeakPolarHBondContact O-CB 3.45Å; H297-S301 PolarHBondContact O-N 3.43Å; H298-S301 WeakPolarHBondContact O-CB 3.35Å; H298-S301 PolarHBondContact O-N 3.41Å; K299-S301 VanDerWaalsContact C-N 3.27Å; K299-S301 PolarHBondContact O-N 2.72Å; S301-K304 PolarHBondContact O-N 2.99Å; S301-L305 PolarHBondContact O-N 3.31Å |
| 302 | M | 92.3 | Very high | 94.5 | Very high | 77 Ų | 77 | 98.7 Ų | 98.7 | 38% | 0.379 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.5 | -39.5 | 174.6 | -69 | -71.6 | 97.6 | 0 | 0 | 112.7 | H298 K299 L305 N306 | H298-M302 WeakPolarHBondContact O-CG 3.35Å; H298-M302 PolarHBondContact O-N 3.31Å; K299-M302 PolarHBondContact O-N 3.36Å; M302-L305 HydrophobicContact CE-CD2 3.92Å; M302-L305 PolarHBondContact O-N 3.15Å; M302-N306 WeakPolarHBondContact O-CB 3.49Å; M302-N306 VanDerWaalsContact O-CG 3.32Å; M302-N306 PolarHBondContact O-N 2.88Å; M302-N306 PolarHBondContact O-ND2 3.44Å; M302-N306 VanDerWaalsContact O-ND2 3.11Å |
| 303 | E | 95.3 | Very high | 94.5 | Very high | 103 Ų | 103 | 100.2 Ų | 100.2 | 48% | 0.481 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.2 | -43.2 | 174.3 | -73.9 | 169.1 | 170.4 | 0 | 0 | 111.5 | K299 E307 | K299-E303 WeakPolarHBondContact CE-OE1 3.28Å; K299-E303 HydrophobicContact CG-CG 4.49Å; K299-E303 IonicContact NZ-OE1 3.08Å; K299-E303 WeakPolarHBondContact O-CG 3.27Å; K299-E303 PolarHBondContact O-N 3.16Å; E303-E307 PolarHBondContact O-N 3.32Å |
| 304 | K | 94.3 | Very high | 94.6 | Very high | 125 Ų | 125 | 103 Ų | 103 | 54% | 0.543 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.5 | -40.1 | 173.6 | -75.8 | 175.8 | 177.6 | 178.2 | 0 | 112.8 | M300 S301 E307 T308 | M300-K304 WeakPolarHBondContact O-CB 3.45Å; M300-K304 WeakPolarHBondContact O-CG 3.45Å; M300-K304 PolarHBondContact O-N 2.93Å; S301-K304 PolarHBondContact O-N 2.99Å; K304-E307 PolarHBondContact O-N 3.09Å; K304-T308 PolarHBondContact O-N 3.32Å; K304-T308 PolarHBondContact O-OG1 3.11Å |
| 305 | L | 94.9 | Very high | 94.8 | Very high | 80 Ų | 80 | 103.7 Ų | 103.7 | 42% | 0.419 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.3 | -48.6 | 176.6 | -168.4 | 80.6 | 0 | 0 | 0 | 111.2 | S301 M302 E307 T308 E309 | S301-L305 PolarHBondContact O-N 3.31Å; M302-L305 HydrophobicContact CE-CD2 3.92Å; M302-L305 PolarHBondContact O-N 3.15Å; L305-E307 PolarHBondContact O-N 2.91Å; L305-T308 PolarHBondContact O-N 3.48Å; L305-T308 PolarHBondContact O-OG1 3.27Å; L305-E309 PolarHBondContact O-N 2.71Å |
| 306 | N | 93.3 | Very high | 94.9 | Very high | 99 Ų | 99 | 109 Ų | 109 | 53% | 0.529 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.3 | -35.7 | 175.6 | -72.8 | -37.6 | 0 | 0 | 0 | 111.9 | M302 L310 | M302-N306 WeakPolarHBondContact O-CB 3.49Å; M302-N306 VanDerWaalsContact O-CG 3.32Å; M302-N306 PolarHBondContact O-N 2.88Å; M302-N306 PolarHBondContact O-ND2 3.44Å; M302-N306 VanDerWaalsContact O-ND2 3.11Å; N306-L310 VanDerWaalsContact O-CB 3.26Å; N306-L310 WeakPolarHBondContact O-CB 3.49Å; N306-L310 PolarHBondContact O-N 3.37Å |
| 307 | E | 95.1 | Very high | 95 | Very high | 96 Ų | 96 | 106 Ų | 106 | 45% | 0.449 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -70 | -40.7 | 176 | -151.5 | -148.4 | 173 | 0 | 0 | 112.6 | E303 K304 L305 L310 K311 | E303-E307 PolarHBondContact O-N 3.32Å; K304-E307 PolarHBondContact O-N 3.09Å; L305-E307 PolarHBondContact O-N 2.91Å; E307-L310 PolarHBondContact O-N 3.31Å; E307-K311 VanDerWaalsContact CD-CE 3.49Å; E307-K311 HydrophobicContact CG-CD 4.48Å; E307-K311 WeakPolarHBondContact O-CB 3.49Å; E307-K311 WeakPolarHBondContact O-CD 3.4Å; E307-K311 VanDerWaalsContact O-CG 3.26Å; E307-K311 WeakPolarHBondContact O-CG 3.39Å; E307-K311 PolarHBondContact O-N 3.45Å; E307-K311 WeakPolarHBondContact OE1-CE 3.41Å; E307-K311 IonicContact OE1-NZ 3.55Å; E307-K311 PolarHBondContact OE1-NZ 3.42Å; E307-K311 IonicContact OE2-NZ 3.19Å; E307-K311 PolarHBondContact OE2-NZ 3.46Å |
| 308 | T | 92.2 | Very high | 95.1 | Very high | 77 Ų | 77 | 107.8 Ų | 107.8 | 47% | 0.472 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.7 | -37.8 | 176.5 | 56.7 | 0 | 0 | 0 | 0 | 112 | K304 L305 K311 A312 | K304-T308 PolarHBondContact O-N 3.32Å; K304-T308 PolarHBondContact O-OG1 3.11Å; L305-T308 PolarHBondContact O-N 3.48Å; L305-T308 PolarHBondContact O-OG1 3.27Å; T308-K311 PolarHBondContact O-N 2.91Å; T308-A312 WeakPolarHBondContact O-CB 3.32Å; T308-A312 PolarHBondContact O-N 3.09Å |
| 309 | E | 95.3 | Very high | 95.2 | Very high | 116 Ų | 116 | 106.5 Ų | 106.5 | 54% | 0.542 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.4 | -44.8 | 170.9 | -75.4 | -167.3 | -171.4 | 0 | 0 | 112.1 | L305 K311 A312 R313 | L305-E309 PolarHBondContact O-N 2.71Å; E309-K311 VanDerWaalsContact C-N 3.34Å; E309-K311 PolarHBondContact O-N 3.06Å; E309-A312 PolarHBondContact O-N 3.29Å; E309-R313 WeakPolarHBondContact O-CB 3.44Å; E309-R313 PolarHBondContact O-N 2.76Å |
| 310 | L | 96.3 | Very high | 95.3 | Very high | 90 Ų | 90 | 104.6 Ų | 104.6 | 47% | 0.471 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.2 | -40.9 | 176.5 | -177.2 | 62 | 0 | 0 | 0 | 111.5 | N306 E307 R313 K314 | N306-L310 VanDerWaalsContact O-CB 3.26Å; N306-L310 WeakPolarHBondContact O-CB 3.49Å; N306-L310 PolarHBondContact O-N 3.37Å; E307-L310 PolarHBondContact O-N 3.31Å; L310-R313 PolarHBondContact O-N 2.98Å; L310-K314 WeakPolarHBondContact O-CB 3.46Å; L310-K314 WeakPolarHBondContact O-CG 3.37Å; L310-K314 PolarHBondContact O-N 3.47Å |
| 311 | K | 94.9 | Very high | 95.4 | Very high | 91 Ų | 91 | 108.9 Ų | 108.9 | 40% | 0.396 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 172.3 | -76.6 | 164.6 | 174.5 | 166.7 | 0 | 111.5 | E307 T308 E309 K314 R315 | E307-K311 VanDerWaalsContact CD-CE 3.49Å; E307-K311 HydrophobicContact CG-CD 4.48Å; E307-K311 WeakPolarHBondContact O-CB 3.49Å; E307-K311 WeakPolarHBondContact O-CD 3.4Å; E307-K311 VanDerWaalsContact O-CG 3.26Å; E307-K311 WeakPolarHBondContact O-CG 3.39Å; E307-K311 PolarHBondContact O-N 3.45Å; E307-K311 WeakPolarHBondContact OE1-CE 3.41Å; E307-K311 IonicContact OE1-NZ 3.55Å; E307-K311 PolarHBondContact OE1-NZ 3.42Å; E307-K311 IonicContact OE2-NZ 3.19Å; E307-K311 PolarHBondContact OE2-NZ 3.46Å; T308-K311 PolarHBondContact O-N 2.91Å; E309-K311 VanDerWaalsContact C-N 3.34Å; E309-K311 PolarHBondContact O-N 3.06Å; K311-K314 PolarHBondContact O-N 2.9Å; K311-R315 PolarHBondContact O-N 3.26Å |
| 312 | A | 95.8 | Very high | 95.6 | Very high | 31 Ų | 31 | 108.4 Ų | 108.4 | 26% | 0.256 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.9 | -38.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | T308 E309 R315 R316 | T308-A312 WeakPolarHBondContact O-CB 3.32Å; T308-A312 PolarHBondContact O-N 3.09Å; E309-A312 PolarHBondContact O-N 3.29Å; A312-R315 PolarHBondContact O-N 2.8Å; A312-R316 PolarHBondContact O-N 3Å |
| 313 | R | 97.5 | Very high | 95.8 | Very high | 159 Ų | 159 | 109.8 Ų | 109.8 | 60% | 0.6 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -67.4 | -37.3 | 174.7 | -169.8 | 179.1 | -174 | -171.9 | 3 | 112 | E309 L310 K317 | E309-R313 WeakPolarHBondContact O-CB 3.44Å; E309-R313 PolarHBondContact O-N 2.76Å; L310-R313 PolarHBondContact O-N 2.98Å; R313-K317 PolarHBondContact O-N 3.49Å |
| 314 | K | 96.6 | Very high | 96 | Very high | 140 Ų | 140 | 110.1 Ų | 110.1 | 61% | 0.609 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.1 | -44.7 | 171.3 | -75.5 | 178 | 179.4 | -177.1 | 0 | 111.5 | L310 K311 K317 Y318 | L310-K314 WeakPolarHBondContact O-CB 3.46Å; L310-K314 WeakPolarHBondContact O-CG 3.37Å; L310-K314 PolarHBondContact O-N 3.47Å; K311-K314 PolarHBondContact O-N 2.9Å; K314-K317 PolarHBondContact O-N 3.01Å; K314-Y318 WeakPolarHBondContact O-CB 3.38Å; K314-Y318 PolarHBondContact O-N 3.21Å |
| 315 | R | 96.4 | Very high | 96.2 | Very high | 159 Ų | 159 | 107.7 Ų | 107.7 | 60% | 0.6 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.9 | -46.8 | 175.3 | -78.9 | -166.1 | -67.6 | -107.3 | 3.1 | 112.9 | K311 A312 K317 Y318 N319 | K311-R315 PolarHBondContact O-N 3.26Å; A312-R315 PolarHBondContact O-N 2.8Å; R315-K317 PolarHBondContact O-N 3.05Å; R315-Y318 WeakPolarHBondContact O-CB 3.23Å; R315-Y318 PolarHBondContact O-N 2.9Å; R315-N319 PolarHBondContact O-N 3.42Å; R315-N319 PolarHBondContact O-OD1 2.91Å; R315-N319 VanDerWaalsContact O-OD1 3.05Å |
| 316 | R | 97.1 | Very high | 96.3 | Very high | 154 Ų | 154 | 107.1 Ų | 107.1 | 58% | 0.581 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -54.9 | -49.6 | 175.3 | -85.3 | -178 | -82 | 136.2 | -11.8 | 112.1 | A312 Y318 N319 E320 | A312-R316 PolarHBondContact O-N 3Å; R316-Y318 VanDerWaalsContact C-N 3.3Å; R316-Y318 PolarHBondContact O-N 3.27Å; R316-N319 PolarHBondContact O-N 2.81Å; R316-E320 WeakPolarHBondContact O-CB 3.44Å; R316-E320 VanDerWaalsContact O-CG 3.25Å; R316-E320 WeakPolarHBondContact O-CG 3.42Å; R316-E320 PolarHBondContact O-N 3.47Å |
| 317 | K | 97.7 | Very high | 96.4 | Very high | 116 Ų | 116 | 106.4 Ų | 106.4 | 50% | 0.504 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -35.2 | 174.5 | -76.8 | -166.5 | 168.9 | -161.3 | 0 | 114 | R313 K314 R315 W321 | R313-K317 PolarHBondContact O-N 3.49Å; K314-K317 PolarHBondContact O-N 3.01Å; R315-K317 PolarHBondContact O-N 3.05Å; K317-W321 PolarHBondContact O-N 3.37Å |
| 318 | Y | 95.6 | Very high | 96.4 | Very high | 159 Ų | 159 | 104.4 Ų | 104.4 | 62% | 0.624 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66 | -49.2 | 176.6 | 175.9 | -101 | 0 | 0 | 0 | 110.8 | K314 R315 R316 E320 W321 V322 | K314-Y318 WeakPolarHBondContact O-CB 3.38Å; K314-Y318 PolarHBondContact O-N 3.21Å; R315-Y318 WeakPolarHBondContact O-CB 3.23Å; R315-Y318 PolarHBondContact O-N 2.9Å; R316-Y318 VanDerWaalsContact C-N 3.3Å; R316-Y318 PolarHBondContact O-N 3.27Å; Y318-E320 PolarHBondContact O-N 3.11Å; Y318-W321 WeakPolarHBondContact O-CA 3.28Å; Y318-W321 PolarHBondContact O-N 3.29Å; Y318-V322 HydrophobicContact CD1-CG2 4.18Å; Y318-V322 HydrophobicContact CE1-CG2 3.77Å; Y318-V322 HydrophobicContact CE2-CG2 4.25Å; Y318-V322 WeakPolarHBondContact O-CG2 3.09Å; Y318-V322 PolarHBondContact O-N 3.22Å |
| 319 | N | 94.9 | Very high | 96.6 | Very high | 91 Ų | 91 | 105.9 Ų | 105.9 | 49% | 0.487 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.4 | -47.2 | 174.5 | -66.8 | 35.1 | 0 | 0 | 0 | 111.2 | R315 R316 W321 V322 D323 | R315-N319 PolarHBondContact O-N 3.42Å; R315-N319 PolarHBondContact O-OD1 2.91Å; R315-N319 VanDerWaalsContact O-OD1 3.05Å; R316-N319 PolarHBondContact O-N 2.81Å; N319-W321 PolarHBondContact O-N 2.88Å; N319-V322 PolarHBondContact O-N 2.86Å; N319-D323 PolarHBondContact O-N 3.34Å |
| 320 | E | 98.1 | Very high | 96.7 | Very high | 90 Ų | 90 | 103.9 Ų | 103.9 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -55.8 | -21.3 | 174.1 | -71.7 | 164.2 | -135.9 | 0 | 0 | 113.9 | R316 Y318 K324 | R316-E320 WeakPolarHBondContact O-CB 3.44Å; R316-E320 VanDerWaalsContact O-CG 3.25Å; R316-E320 WeakPolarHBondContact O-CG 3.42Å; R316-E320 PolarHBondContact O-N 3.47Å; Y318-E320 PolarHBondContact O-N 3.11Å; E320-K324 WeakPolarHBondContact O-CD 3.46Å; E320-K324 WeakPolarHBondContact O-CE 3.32Å; E320-K324 VanDerWaalsContact O-CG 3.27Å; E320-K324 WeakPolarHBondContact O-CG 3.35Å; E320-K324 PolarHBondContact O-NZ 3.48Å |
| 321 | W | 96.2 | Very high | 96.8 | Very high | 167 Ų | 167 | 105.5 Ų | 105.5 | 63% | 0.633 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -92.1 | -38.6 | 173.1 | -79.2 | 118.7 | 0 | 0 | 0 | 112.3 | K317 Y318 N319 K324 V325 | K317-W321 PolarHBondContact O-N 3.37Å; Y318-W321 WeakPolarHBondContact O-CA 3.28Å; Y318-W321 PolarHBondContact O-N 3.29Å; N319-W321 PolarHBondContact O-N 2.88Å; W321-K324 HydrophobicContact CE3-CD 4.06Å; W321-K324 HydrophobicContact CZ3-CD 4.17Å; W321-K324 PolarHBondContact O-N 3.13Å; W321-V325 WeakPolarHBondContact O-CG2 3.33Å; W321-V325 PolarHBondContact O-N 3.33Å |
| 322 | V | 97.6 | Very high | 96.9 | Very high | 56 Ų | 56 | 104.8 Ų | 104.8 | 34% | 0.339 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.3 | -49.5 | 172.6 | 173.3 | 0 | 0 | 0 | 0 | 110.4 | Y318 N319 K324 V325 T326 | Y318-V322 HydrophobicContact CD1-CG2 4.18Å; Y318-V322 HydrophobicContact CE1-CG2 3.77Å; Y318-V322 HydrophobicContact CE2-CG2 4.25Å; Y318-V322 WeakPolarHBondContact O-CG2 3.09Å; Y318-V322 PolarHBondContact O-N 3.22Å; N319-V322 PolarHBondContact O-N 2.86Å; V322-K324 PolarHBondContact O-N 3.39Å; V322-K324 VanDerWaalsContact O-N 3.16Å; V322-V325 PolarHBondContact O-N 2.89Å; V322-T326 PolarHBondContact O-N 2.9Å; V322-T326 PolarHBondContact O-OG1 3.2Å |
| 323 | D | 97.7 | Very high | 96.9 | Very high | 107 Ų | 107 | 106.3 Ų | 106.3 | 57% | 0.572 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -56.1 | -36.9 | 178.8 | -59.2 | -28 | 0 | 0 | 0 | 112.1 | N319 S327 | N319-D323 PolarHBondContact O-N 3.34Å; D323-S327 VanDerWaalsContact O-CB 3.23Å; D323-S327 WeakPolarHBondContact O-CB 3.14Å; D323-S327 PolarHBondContact O-N 3.39Å |
| 324 | K | 98.2 | Very high | 96.8 | Very high | 109 Ų | 109 | 104.4 Ų | 104.4 | 47% | 0.474 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -74.7 | -36.3 | 177.3 | -69.4 | 179 | -169.4 | 104.9 | 0 | 112.8 | E320 W321 V322 A328 | E320-K324 WeakPolarHBondContact O-CD 3.46Å; E320-K324 WeakPolarHBondContact O-CE 3.32Å; E320-K324 VanDerWaalsContact O-CG 3.27Å; E320-K324 WeakPolarHBondContact O-CG 3.35Å; E320-K324 PolarHBondContact O-NZ 3.48Å; W321-K324 HydrophobicContact CE3-CD 4.06Å; W321-K324 HydrophobicContact CZ3-CD 4.17Å; W321-K324 PolarHBondContact O-N 3.13Å; V322-K324 PolarHBondContact O-N 3.39Å; V322-K324 VanDerWaalsContact O-N 3.16Å; K324-A328 WeakPolarHBondContact O-CB 3.44Å; K324-A328 PolarHBondContact O-N 3.46Å; K324-A328 VanDerWaalsContact O-N 3.08Å |
| 325 | V | 97.8 | Very high | 96.8 | Very high | 74 Ų | 74 | 103 Ų | 103 | 45% | 0.448 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66 | -52.7 | 175 | 167.3 | 0 | 0 | 0 | 0 | 109.1 | W321 V322 S327 A328 E329 | W321-V325 WeakPolarHBondContact O-CG2 3.33Å; W321-V325 PolarHBondContact O-N 3.33Å; V322-V325 PolarHBondContact O-N 2.89Å; V325-S327 VanDerWaalsContact C-N 3.34Å; V325-S327 PolarHBondContact O-N 3.39Å; V325-A328 CarbonylContact O-C 3.57Å; V325-A328 WeakPolarHBondContact O-CA 3.42Å; V325-A328 WeakPolarHBondContact O-CB 3.35Å; V325-A328 PolarHBondContact O-N 2.91Å; V325-E329 VanDerWaalsContact CG1-CD 3.5Å; V325-E329 HydrophobicContact CG1-CG 4.23Å; V325-E329 VanDerWaalsContact CG1-OE1 3.29Å; V325-E329 WeakPolarHBondContact CG1-OE1 3.39Å; V325-E329 WeakPolarHBondContact O-CG 3.39Å; V325-E329 PolarHBondContact O-N 3.05Å |
| 326 | T | 97.1 | Very high | 96.8 | Very high | 69 Ų | 69 | 100.5 Ų | 100.5 | 42% | 0.423 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.6 | -39.7 | 177.9 | -55.9 | 0 | 0 | 0 | 0 | 112.6 | V322 A328 E329 T330 | V322-T326 PolarHBondContact O-N 2.9Å; V322-T326 PolarHBondContact O-OG1 3.2Å; T326-A328 VanDerWaalsContact C-N 3.28Å; T326-A328 PolarHBondContact O-N 3.39Å; T326-E329 VanDerWaalsContact CA-OE2 3.31Å; T326-E329 WeakPolarHBondContact CA-OE2 3.13Å; T326-E329 PolarHBondContact O-N 3.02Å; T326-T330 PolarHBondContact O-N 3.18Å; T326-T330 PolarHBondContact O-OG1 2.89Å |
| 327 | S | 97 | Very high | 96.8 | Very high | 84 Ų | 84 | 96.7 Ų | 96.7 | 59% | 0.587 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.5 | -28.6 | 173.1 | -179.7 | 0 | 0 | 0 | 0 | 113.6 | D323 V325 K331 | D323-S327 VanDerWaalsContact O-CB 3.23Å; D323-S327 WeakPolarHBondContact O-CB 3.14Å; D323-S327 PolarHBondContact O-N 3.39Å; V325-S327 VanDerWaalsContact C-N 3.34Å; V325-S327 PolarHBondContact O-N 3.39Å; S327-K331 PolarHBondContact O-N 2.66Å |
| 328 | A | 94.6 | Very high | 96.8 | Very high | 54 Ų | 54 | 94.7 Ų | 94.7 | 45% | 0.446 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -79.5 | -40 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | K324 V325 T326 K331 V332 | K324-A328 WeakPolarHBondContact O-CB 3.44Å; K324-A328 PolarHBondContact O-N 3.46Å; K324-A328 VanDerWaalsContact O-N 3.08Å; V325-A328 CarbonylContact O-C 3.57Å; V325-A328 WeakPolarHBondContact O-CA 3.42Å; V325-A328 WeakPolarHBondContact O-CB 3.35Å; V325-A328 PolarHBondContact O-N 2.91Å; T326-A328 VanDerWaalsContact C-N 3.28Å; T326-A328 PolarHBondContact O-N 3.39Å; A328-K331 PolarHBondContact O-N 2.96Å; A328-V332 WeakPolarHBondContact O-CG2 3.28Å; A328-V332 PolarHBondContact O-N 3.07Å |
| 329 | E | 96.3 | Very high | 96.9 | Very high | 108 Ų | 108 | 90.7 Ų | 90.7 | 51% | 0.505 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.7 | -49.9 | 174.5 | -70.1 | 165.6 | 157.7 | 0 | 0 | 111 | V325 T326 K331 V332 S333 | V325-E329 VanDerWaalsContact CG1-CD 3.5Å; V325-E329 HydrophobicContact CG1-CG 4.23Å; V325-E329 VanDerWaalsContact CG1-OE1 3.29Å; V325-E329 WeakPolarHBondContact CG1-OE1 3.39Å; V325-E329 WeakPolarHBondContact O-CG 3.39Å; V325-E329 PolarHBondContact O-N 3.05Å; T326-E329 VanDerWaalsContact CA-OE2 3.31Å; T326-E329 WeakPolarHBondContact CA-OE2 3.13Å; T326-E329 PolarHBondContact O-N 3.02Å; E329-K331 VanDerWaalsContact C-N 3.29Å; E329-K331 PolarHBondContact O-N 3.34Å; E329-V332 WeakPolarHBondContact O-CB 3.36Å; E329-V332 PolarHBondContact O-N 2.9Å; E329-V332 VanDerWaalsContact O-N 3.08Å; E329-S333 PolarHBondContact O-N 2.94Å; E329-S333 PolarHBondContact O-OG 3.46Å |
| 330 | T | 97 | Very high | 97 | Very high | 74 Ų | 74 | 92.3 Ų | 92.3 | 45% | 0.454 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -55.6 | -44.5 | 174.9 | -55.8 | 0 | 0 | 0 | 0 | 111.6 | T326 V332 S333 E334 | T326-T330 PolarHBondContact O-N 3.18Å; T326-T330 PolarHBondContact O-OG1 2.89Å; T330-V332 VanDerWaalsContact C-N 3.34Å; T330-V332 PolarHBondContact O-N 3.21Å; T330-S333 PolarHBondContact O-N 2.97Å; T330-E334 WeakPolarHBondContact O-CG 3.47Å; T330-E334 PolarHBondContact O-N 3.47Å |
| 331 | K | 98 | Very high | 97 | Very high | 124 Ų | 124 | 92.8 Ų | 92.8 | 54% | 0.539 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.6 | -32.2 | 178.4 | -176.6 | 172.9 | -179.7 | 177.6 | 0 | 113.3 | S327 A328 E329 M335 | S327-K331 PolarHBondContact O-N 2.66Å; A328-K331 PolarHBondContact O-N 2.96Å; E329-K331 VanDerWaalsContact C-N 3.29Å; E329-K331 PolarHBondContact O-N 3.34Å; K331-M335 HydrophobicContact CG-SD 4.29Å; K331-M335 WeakPolarHBondContact O-CB 3.45Å; K331-M335 VanDerWaalsContact O-CG 3.28Å; K331-M335 WeakPolarHBondContact O-CG 3.23Å; K331-M335 PolarHBondContact O-N 2.86Å |
| 332 | V | 96.6 | Very high | 97 | Very high | 76 Ų | 76 | 90 Ų | 90 | 46% | 0.461 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.8 | -47.4 | 172.4 | 167.2 | 0 | 0 | 0 | 0 | 109.5 | A328 E329 T330 E334 M335 E336 | A328-V332 WeakPolarHBondContact O-CG2 3.28Å; A328-V332 PolarHBondContact O-N 3.07Å; E329-V332 WeakPolarHBondContact O-CB 3.36Å; E329-V332 PolarHBondContact O-N 2.9Å; E329-V332 VanDerWaalsContact O-N 3.08Å; T330-V332 VanDerWaalsContact C-N 3.34Å; T330-V332 PolarHBondContact O-N 3.21Å; V332-E334 PolarHBondContact O-N 3.46Å; V332-M335 CarbonylContact O-C 3.59Å; V332-M335 WeakPolarHBondContact O-CA 3.43Å; V332-M335 WeakPolarHBondContact O-CB 3.32Å; V332-M335 PolarHBondContact O-N 3.48Å; V332-M335 VanDerWaalsContact O-N 3.09Å; V332-E336 HydrophobicContact CG1-CG 4.27Å; V332-E336 WeakPolarHBondContact O-CG 3.34Å; V332-E336 PolarHBondContact O-N 3.3Å |
| 333 | S | 96.1 | Very high | 97 | Very high | 63 Ų | 63 | 93.1 Ų | 93.1 | 44% | 0.441 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.5 | -38.7 | 177.3 | -58.5 | 0 | 0 | 0 | 0 | 113.6 | E329 T330 M335 E336 T337 | E329-S333 PolarHBondContact O-N 2.94Å; E329-S333 PolarHBondContact O-OG 3.46Å; T330-S333 PolarHBondContact O-N 2.97Å; S333-M335 VanDerWaalsContact C-N 3.3Å; S333-M335 PolarHBondContact O-N 2.91Å; S333-E336 WeakPolarHBondContact CA-OE2 3.46Å; S333-E336 PolarHBondContact O-N 2.94Å; S333-T337 PolarHBondContact O-N 3.02Å; S333-T337 PolarHBondContact O-OG1 3.38Å |
| 334 | E | 96.8 | Very high | 97 | Very high | 119 Ų | 119 | 96 Ų | 96 | 56% | 0.556 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -55.9 | -45.6 | 169.5 | -73.6 | 169.2 | -179 | 0 | 0 | 111.4 | T330 V332 T338 | T330-E334 WeakPolarHBondContact O-CG 3.47Å; T330-E334 PolarHBondContact O-N 3.47Å; V332-E334 PolarHBondContact O-N 3.46Å; E334-T338 WeakPolarHBondContact O-CG2 3.38Å; E334-T338 PolarHBondContact O-N 2.95Å |
| 335 | M | 96.9 | Very high | 97 | Very high | 109 Ų | 109 | 94.2 Ų | 94.2 | 54% | 0.537 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.9 | -38.2 | 178.1 | -74.2 | 175 | 51.1 | 0 | 0 | 112.2 | K331 V332 S333 T338 V339 | K331-M335 HydrophobicContact CG-SD 4.29Å; K331-M335 WeakPolarHBondContact O-CB 3.45Å; K331-M335 VanDerWaalsContact O-CG 3.28Å; K331-M335 WeakPolarHBondContact O-CG 3.23Å; K331-M335 PolarHBondContact O-N 2.86Å; V332-M335 CarbonylContact O-C 3.59Å; V332-M335 WeakPolarHBondContact O-CA 3.43Å; V332-M335 WeakPolarHBondContact O-CB 3.32Å; V332-M335 PolarHBondContact O-N 3.48Å; V332-M335 VanDerWaalsContact O-N 3.09Å; S333-M335 VanDerWaalsContact C-N 3.3Å; S333-M335 PolarHBondContact O-N 2.91Å; M335-T338 PolarHBondContact O-N 2.94Å; M335-T338 PolarHBondContact O-OG1 3.08Å; M335-V339 WeakPolarHBondContact O-CG2 3.21Å; M335-V339 PolarHBondContact O-N 3.39Å |
| 336 | E | 96.3 | Very high | 96.9 | Very high | 107 Ų | 107 | 94.7 Ų | 94.7 | 50% | 0.5 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.6 | -48.1 | 175.5 | -72.9 | 167.5 | 152.6 | 0 | 0 | 111 | V332 S333 T338 V339 E340 | V332-E336 HydrophobicContact CG1-CG 4.27Å; V332-E336 WeakPolarHBondContact O-CG 3.34Å; V332-E336 PolarHBondContact O-N 3.3Å; S333-E336 WeakPolarHBondContact CA-OE2 3.46Å; S333-E336 PolarHBondContact O-N 2.94Å; E336-T338 PolarHBondContact O-N 2.9Å; E336-V339 WeakPolarHBondContact O-CA 3.43Å; E336-V339 WeakPolarHBondContact O-CB 3.44Å; E336-V339 PolarHBondContact O-N 3.35Å; E336-E340 WeakPolarHBondContact O-CG 3.31Å; E336-E340 PolarHBondContact O-N 3.47Å |
| 337 | T | 96.7 | Very high | 96.9 | Very high | 74 Ų | 74 | 95 Ų | 95 | 45% | 0.454 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.5 | -44.4 | 174.5 | -55.5 | 0 | 0 | 0 | 0 | 112.1 | S333 V339 E340 D341 | S333-T337 PolarHBondContact O-N 3.02Å; S333-T337 PolarHBondContact O-OG1 3.38Å; T337-V339 PolarHBondContact O-N 2.97Å; T337-E340 PolarHBondContact O-N 3.08Å; T337-E340 VanDerWaalsContact O-N 3.12Å; T337-D341 PolarHBondContact O-N 3.16Å |
| 338 | T | 97.5 | Very high | 97 | Very high | 75 Ų | 75 | 96 Ų | 96 | 46% | 0.46 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.5 | -26.2 | 176.3 | 63.3 | 0 | 0 | 0 | 0 | 113.4 | E334 M335 E336 L342 | E334-T338 WeakPolarHBondContact O-CG2 3.38Å; E334-T338 PolarHBondContact O-N 2.95Å; M335-T338 PolarHBondContact O-N 2.94Å; M335-T338 PolarHBondContact O-OG1 3.08Å; E336-T338 PolarHBondContact O-N 2.9Å; T338-L342 WeakPolarHBondContact O-CB 3.38Å; T338-L342 WeakPolarHBondContact O-CD1 3.46Å; T338-L342 WeakPolarHBondContact O-CG 3.19Å; T338-L342 PolarHBondContact O-N 3.46Å |
| 339 | V | 97.4 | Very high | 97 | Very high | 74 Ų | 74 | 98.8 Ų | 98.8 | 45% | 0.448 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -76.6 | -35.3 | 174.7 | 162.7 | 0 | 0 | 0 | 0 | 111.1 | M335 E336 T337 Q343 | M335-V339 WeakPolarHBondContact O-CG2 3.21Å; M335-V339 PolarHBondContact O-N 3.39Å; E336-V339 WeakPolarHBondContact O-CA 3.43Å; E336-V339 WeakPolarHBondContact O-CB 3.44Å; E336-V339 PolarHBondContact O-N 3.35Å; T337-V339 PolarHBondContact O-N 2.97Å; V339-Q343 WeakPolarHBondContact O-CB 3.23Å; V339-Q343 VanDerWaalsContact O-CG 3.24Å; V339-Q343 WeakPolarHBondContact O-CG 3.38Å; V339-Q343 PolarHBondContact O-N 3.01Å |
| 340 | E | 97.6 | Very high | 97 | Very high | 126 Ų | 126 | 99.7 Ų | 99.7 | 59% | 0.589 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.3 | -46.8 | 173.1 | -68.6 | 177.2 | 158.2 | 0 | 0 | 111.8 | E336 T337 L342 Q343 W344 | E336-E340 WeakPolarHBondContact O-CG 3.31Å; E336-E340 PolarHBondContact O-N 3.47Å; T337-E340 PolarHBondContact O-N 3.08Å; T337-E340 VanDerWaalsContact O-N 3.12Å; E340-L342 PolarHBondContact O-N 2.85Å; E340-Q343 PolarHBondContact O-N 2.86Å; E340-W344 PolarHBondContact O-N 3.33Å |
| 341 | D | 97.1 | Very high | 97 | Very high | 100 Ų | 100 | 99.2 Ų | 99.2 | 54% | 0.535 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -56 | -47.9 | 174.7 | -78 | -31.4 | 0 | 0 | 0 | 111.7 | T337 W344 D345 | T337-D341 PolarHBondContact O-N 3.16Å; D341-W344 PolarHBondContact O-N 3.27Å; D341-D345 PolarHBondContact O-N 3Å |
| 342 | L | 96.3 | Very high | 97 | Very high | 109 Ų | 109 | 101.4 Ų | 101.4 | 57% | 0.571 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.7 | -34.5 | 178.8 | -72.6 | 172 | 0 | 0 | 0 | 112.6 | T338 E340 I346 | T338-L342 WeakPolarHBondContact O-CB 3.38Å; T338-L342 WeakPolarHBondContact O-CD1 3.46Å; T338-L342 WeakPolarHBondContact O-CG 3.19Å; T338-L342 PolarHBondContact O-N 3.46Å; E340-L342 PolarHBondContact O-N 2.85Å; L342-I346 WeakPolarHBondContact O-CB 3.34Å; L342-I346 WeakPolarHBondContact O-CD1 3.42Å; L342-I346 WeakPolarHBondContact O-CG1 3.39Å; L342-I346 PolarHBondContact O-N 3.31Å |
| 343 | Q | 97.5 | Very high | 96.9 | Very high | 121 Ų | 121 | 103 Ų | 103 | 57% | 0.565 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.1 | -41.9 | 172.2 | -79.6 | 178.4 | 56.1 | 0 | 0 | 111.6 | V339 E340 I346 E347 | V339-Q343 WeakPolarHBondContact O-CB 3.23Å; V339-Q343 VanDerWaalsContact O-CG 3.24Å; V339-Q343 WeakPolarHBondContact O-CG 3.38Å; V339-Q343 PolarHBondContact O-N 3.01Å; E340-Q343 PolarHBondContact O-N 2.86Å; Q343-I346 PolarHBondContact O-N 3.17Å; Q343-E347 PolarHBondContact O-N 2.92Å |
| 344 | W | 98.3 | Very high | 96.9 | Very high | 168 Ų | 168 | 105.3 Ų | 105.3 | 64% | 0.636 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.3 | -44.2 | 176.5 | -178.5 | 87.4 | 0 | 0 | 0 | 111.9 | E340 D341 E347 K348 | E340-W344 PolarHBondContact O-N 3.33Å; D341-W344 PolarHBondContact O-N 3.27Å; W344-E347 PolarHBondContact O-N 3.36Å; W344-K348 HydrophobicContact CD2-CD 4.49Å; W344-K348 HydrophobicContact CE3-CD 3.99Å; W344-K348 HydrophobicContact CH2-CD 3.57Å; W344-K348 HydrophobicContact CZ2-CD 4.06Å; W344-K348 HydrophobicContact CZ3-CD 3.53Å; W344-K348 WeakPolarHBondContact O-CB 3.28Å; W344-K348 PolarHBondContact O-N 2.96Å |
| 345 | D | 97.1 | Very high | 96.9 | Very high | 70 Ų | 70 | 106.1 Ų | 106.1 | 37% | 0.374 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.9 | -36.7 | 177.2 | -112.6 | -6.2 | 0 | 0 | 0 | 112.6 | D341 K348 L349 | D341-D345 PolarHBondContact O-N 3Å; D345-K348 WeakPolarHBondContact OD1-CD 3.43Å; D345-K348 WeakPolarHBondContact OD1-CE 3.19Å; D345-K348 IonicContact OD1-NZ 2.69Å; D345-K348 PolarHBondContact OD1-NZ 3.37Å; D345-L349 WeakPolarHBondContact O-CB 3.31Å; D345-L349 VanDerWaalsContact O-CG 3.3Å; D345-L349 WeakPolarHBondContact O-CG 3.33Å; D345-L349 PolarHBondContact O-N 2.82Å |
| 346 | I | 96.6 | Very high | 96.8 | Very high | 84 Ų | 84 | 105.5 Ų | 105.5 | 43% | 0.431 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.7 | -45.7 | 171.4 | -74.2 | 165.3 | 0 | 0 | 0 | 111 | L342 Q343 L349 R350 | L342-I346 WeakPolarHBondContact O-CB 3.34Å; L342-I346 WeakPolarHBondContact O-CD1 3.42Å; L342-I346 WeakPolarHBondContact O-CG1 3.39Å; L342-I346 PolarHBondContact O-N 3.31Å; Q343-I346 PolarHBondContact O-N 3.17Å; I346-L349 PolarHBondContact O-N 2.93Å; I346-R350 WeakPolarHBondContact O-CG 3.37Å; I346-R350 PolarHBondContact O-N 2.7Å |
| 347 | E | 97.7 | Very high | 96.7 | Very high | 75 Ų | 75 | 104.3 Ų | 104.3 | 35% | 0.35 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -71.6 | -36.4 | -178 | -167.3 | 50.6 | -136.8 | 0 | 0 | 112 | Q343 W344 L349 R350 N351 | Q343-E347 PolarHBondContact O-N 2.92Å; W344-E347 PolarHBondContact O-N 3.36Å; E347-L349 PolarHBondContact O-N 2.98Å; E347-R350 PolarHBondContact O-N 3.48Å; E347-R350 WeakPolarHBondContact OE2-CD 3.45Å; E347-R350 IonicContact OE2-CZ 3.8Å; E347-R350 IonicContact OE2-NE 2.72Å; E347-R350 IonicContact OE2-NH1 3.65Å; E347-R350 PolarHBondContact OE2-NH1 2.86Å; E347-N351 WeakPolarHBondContact O-CB 3.34Å; E347-N351 PolarHBondContact O-N 3.21Å; E347-N351 PolarHBondContact O-ND2 2.91Å; E347-N351 PolarHBondContact OE1-ND2 2.98Å |
| 348 | K | 97.9 | Very high | 96.7 | Very high | 106 Ų | 106 | 106.8 Ų | 106.8 | 46% | 0.461 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.9 | -40.8 | 169.4 | 171 | 175.4 | 153.9 | -154.8 | 0 | 112.4 | W344 D345 R352 | W344-K348 HydrophobicContact CD2-CD 4.49Å; W344-K348 HydrophobicContact CE3-CD 3.99Å; W344-K348 HydrophobicContact CH2-CD 3.57Å; W344-K348 HydrophobicContact CZ2-CD 4.06Å; W344-K348 HydrophobicContact CZ3-CD 3.53Å; W344-K348 WeakPolarHBondContact O-CB 3.28Å; W344-K348 PolarHBondContact O-N 2.96Å; D345-K348 WeakPolarHBondContact OD1-CD 3.43Å; D345-K348 WeakPolarHBondContact OD1-CE 3.19Å; D345-K348 IonicContact OD1-NZ 2.69Å; D345-K348 PolarHBondContact OD1-NZ 3.37Å; K348-R352 PolarHBondContact O-N 2.76Å; K348-R352 VanDerWaalsContact O-N 3.14Å |
| 349 | L | 94.8 | Very high | 96.6 | Very high | 112 Ų | 112 | 108.6 Ų | 108.6 | 59% | 0.586 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.1 | -44.9 | 173.3 | -75.2 | 170.9 | 0 | 0 | 0 | 112.1 | D345 I346 E347 N351 R352 E353 | D345-L349 WeakPolarHBondContact O-CB 3.31Å; D345-L349 VanDerWaalsContact O-CG 3.3Å; D345-L349 WeakPolarHBondContact O-CG 3.33Å; D345-L349 PolarHBondContact O-N 2.82Å; I346-L349 PolarHBondContact O-N 2.93Å; E347-L349 PolarHBondContact O-N 2.98Å; L349-N351 VanDerWaalsContact C-N 3.33Å; L349-N351 PolarHBondContact O-N 2.83Å; L349-R352 WeakPolarHBondContact O-CB 3.29Å; L349-R352 PolarHBondContact O-N 3.43Å; L349-R352 VanDerWaalsContact O-N 3.1Å; L349-E353 PolarHBondContact O-N 2.93Å |
| 350 | R | 97.4 | Very high | 96.4 | Very high | 128 Ų | 128 | 109.9 Ų | 109.9 | 48% | 0.483 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -57.9 | -43.5 | 173.4 | -73.7 | 167.1 | 174.9 | 168 | 1.4 | 112.3 | I346 E347 R352 E353 Q354 | I346-R350 WeakPolarHBondContact O-CG 3.37Å; I346-R350 PolarHBondContact O-N 2.7Å; E347-R350 PolarHBondContact O-N 3.48Å; E347-R350 WeakPolarHBondContact OE2-CD 3.45Å; E347-R350 IonicContact OE2-CZ 3.8Å; E347-R350 IonicContact OE2-NE 2.72Å; E347-R350 IonicContact OE2-NH1 3.65Å; E347-R350 PolarHBondContact OE2-NH1 2.86Å; R350-R352 VanDerWaalsContact C-N 3.26Å; R350-R352 PolarHBondContact O-N 2.9Å; R350-E353 WeakPolarHBondContact O-CB 3.45Å; R350-E353 PolarHBondContact O-N 2.85Å; R350-E353 VanDerWaalsContact O-N 3.14Å; R350-Q354 WeakPolarHBondContact O-CG 3.48Å; R350-Q354 PolarHBondContact O-N 2.88Å |
| 351 | N | 96.8 | Very high | 96.2 | Very high | 63 Ų | 63 | 106.3 Ų | 106.3 | 34% | 0.337 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.1 | -28.6 | 177.1 | -85.4 | -86.3 | 0 | 0 | 0 | 112.8 | E347 L349 K355 | E347-N351 WeakPolarHBondContact O-CB 3.34Å; E347-N351 PolarHBondContact O-N 3.21Å; E347-N351 PolarHBondContact O-ND2 2.91Å; E347-N351 PolarHBondContact OE1-ND2 2.98Å; L349-N351 VanDerWaalsContact C-N 3.33Å; L349-N351 PolarHBondContact O-N 2.83Å; N351-K355 VanDerWaalsContact O-CD 3.31Å; N351-K355 WeakPolarHBondContact O-CD 3.37Å; N351-K355 VanDerWaalsContact O-CG 3.26Å; N351-K355 WeakPolarHBondContact O-CG 3.41Å |
| 352 | R | 97.2 | Very high | 95.9 | Very high | 171 Ų | 171 | 104.5 Ų | 104.5 | 65% | 0.645 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -73.2 | -43.9 | 169.3 | -177.6 | -177.6 | 175.2 | 93.9 | 1.1 | 111.5 | K348 L349 R350 K355 L356 | K348-R352 PolarHBondContact O-N 2.76Å; K348-R352 VanDerWaalsContact O-N 3.14Å; L349-R352 WeakPolarHBondContact O-CB 3.29Å; L349-R352 PolarHBondContact O-N 3.43Å; L349-R352 VanDerWaalsContact O-N 3.1Å; R350-R352 VanDerWaalsContact C-N 3.26Å; R350-R352 PolarHBondContact O-N 2.9Å; R352-K355 PolarHBondContact O-N 3.43Å; R352-L356 HydrophobicContact CG-CD1 4.23Å; R352-L356 WeakPolarHBondContact O-CG 3.4Å; R352-L356 PolarHBondContact O-N 2.97Å; R352-L356 VanDerWaalsContact O-N 3.1Å |
| 353 | E | 94.6 | Very high | 95.7 | Very high | 109 Ų | 109 | 101.5 Ų | 101.5 | 51% | 0.509 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.3 | -48.2 | 178.4 | -162.8 | -147.7 | 134.8 | 0 | 0 | 111.6 | L349 R350 K355 L356 N357 | L349-E353 PolarHBondContact O-N 2.93Å; R350-E353 WeakPolarHBondContact O-CB 3.45Å; R350-E353 PolarHBondContact O-N 2.85Å; R350-E353 VanDerWaalsContact O-N 3.14Å; E353-K355 VanDerWaalsContact C-N 3.3Å; E353-K355 PolarHBondContact O-N 3.46Å; E353-L356 PolarHBondContact O-N 2.92Å; E353-L356 VanDerWaalsContact O-N 3.1Å; E353-N357 WeakPolarHBondContact O-CB 3.25Å; E353-N357 PolarHBondContact O-N 3.24Å; E353-N357 PolarHBondContact O-ND2 3.43Å; E353-N357 PolarHBondContact OE1-ND2 3.47Å |
| 354 | Q | 96 | Very high | 95.3 | Very high | 112 Ų | 112 | 100.5 Ų | 100.5 | 52% | 0.523 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.1 | -40.6 | 176.9 | -71.8 | 174.2 | 20.3 | 0 | 0 | 112.4 | R350 K358 | R350-Q354 WeakPolarHBondContact O-CG 3.48Å; R350-Q354 PolarHBondContact O-N 2.88Å; Q354-K358 WeakPolarHBondContact O-CB 3.41Å; Q354-K358 PolarHBondContact O-N 2.82Å |
| 355 | K | 97.3 | Very high | 94.8 | Very high | 135 Ų | 135 | 99.2 Ų | 99.2 | 59% | 0.587 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -65.1 | -42.4 | 175.8 | -70.6 | 168.4 | -171.8 | 176.3 | 0 | 111.8 | N351 R352 E353 K358 H359 | N351-K355 VanDerWaalsContact O-CD 3.31Å; N351-K355 WeakPolarHBondContact O-CD 3.37Å; N351-K355 VanDerWaalsContact O-CG 3.26Å; N351-K355 WeakPolarHBondContact O-CG 3.41Å; R352-K355 PolarHBondContact O-N 3.43Å; E353-K355 VanDerWaalsContact C-N 3.3Å; E353-K355 PolarHBondContact O-N 3.46Å; K355-K358 PolarHBondContact O-N 2.9Å; K355-H359 PolarHBondContact O-CD2 3.1Å; K355-H359 PolarHBondContact O-N 3.2Å |
| 356 | L | 94.8 | Very high | 94.2 | Very high | 97 Ų | 97 | 102.6 Ų | 102.6 | 51% | 0.508 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.5 | -44.2 | 176.2 | -68.5 | 169.7 | 0 | 0 | 0 | 111.9 | R352 E353 K358 H359 L360 | R352-L356 HydrophobicContact CG-CD1 4.23Å; R352-L356 WeakPolarHBondContact O-CG 3.4Å; R352-L356 PolarHBondContact O-N 2.97Å; R352-L356 VanDerWaalsContact O-N 3.1Å; E353-L356 PolarHBondContact O-N 2.92Å; E353-L356 VanDerWaalsContact O-N 3.1Å; L356-K358 VanDerWaalsContact C-N 3.31Å; L356-K358 PolarHBondContact O-N 2.98Å; L356-H359 PolarHBondContact O-N 2.81Å; L356-L360 WeakPolarHBondContact O-CB 3.27Å; L356-L360 PolarHBondContact O-N 3.32Å |
| 357 | N | 94.4 | Very high | 93.4 | Very high | 81 Ų | 81 | 104.2 Ų | 104.2 | 43% | 0.433 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.6 | -38.4 | 175.4 | -72.5 | -23.9 | 0 | 0 | 0 | 111.6 | E353 L360 A361 | E353-N357 WeakPolarHBondContact O-CB 3.25Å; E353-N357 PolarHBondContact O-N 3.24Å; E353-N357 PolarHBondContact O-ND2 3.43Å; E353-N357 PolarHBondContact OE1-ND2 3.47Å; N357-L360 PolarHBondContact O-N 2.92Å; N357-A361 WeakPolarHBondContact O-CB 3.38Å; N357-A361 PolarHBondContact O-N 3.13Å |
| 358 | K | 96.2 | Very high | 92.5 | Very high | 127 Ų | 127 | 108.2 Ų | 108.2 | 55% | 0.552 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.8 | -50.6 | 173.8 | -167.5 | -170.1 | -177.6 | -129.2 | 0 | 111.6 | Q354 K355 L356 L360 A361 E362 | Q354-K358 WeakPolarHBondContact O-CB 3.41Å; Q354-K358 PolarHBondContact O-N 2.82Å; K355-K358 PolarHBondContact O-N 2.9Å; L356-K358 VanDerWaalsContact C-N 3.31Å; L356-K358 PolarHBondContact O-N 2.98Å; K358-L360 VanDerWaalsContact C-N 3.29Å; K358-L360 PolarHBondContact O-N 2.75Å; K358-A361 WeakPolarHBondContact O-CB 3.48Å; K358-A361 PolarHBondContact O-N 3.32Å; K358-A361 VanDerWaalsContact O-N 3.13Å; K358-E362 WeakPolarHBondContact CE-OE1 3.48Å; K358-E362 IonicContact NZ-OE1 3.95Å; K358-E362 PolarHBondContact NZ-OE1 3.06Å; K358-E362 WeakPolarHBondContact O-CG 3.29Å; K358-E362 PolarHBondContact O-N 2.88Å |
| 359 | H | 95.4 | Very high | 91.1 | Very high | 113 Ų | 113 | 106.7 Ų | 106.7 | 52% | 0.523 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.7 | -33.4 | 178.1 | -68.2 | -40.5 | 0 | 0 | 0 | 113 | K355 L356 E362 A363 | K355-H359 PolarHBondContact O-CD2 3.1Å; K355-H359 PolarHBondContact O-N 3.2Å; L356-H359 PolarHBondContact O-N 2.81Å; H359-E362 IonicContact CE1-OE2 2.8Å; H359-E362 IonicContact CG-OE2 2.65Å; H359-E362 IonicContact ND1-OE2 3.34Å; H359-E362 PolarHBondContact ND1-OE2 3.48Å; H359-A363 WeakPolarHBondContact O-CB 3.43Å; H359-A363 PolarHBondContact O-N 3.48Å |
| 360 | L | 93.8 | Very high | 89.2 | Confident | 100 Ų | 100 | 103 Ų | 103 | 52% | 0.524 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66 | -40.4 | 172.8 | -177.8 | 60.9 | 0 | 0 | 0 | 111.8 | L356 N357 K358 M364 | L356-L360 WeakPolarHBondContact O-CB 3.27Å; L356-L360 PolarHBondContact O-N 3.32Å; N357-L360 PolarHBondContact O-N 2.92Å; K358-L360 VanDerWaalsContact C-N 3.29Å; K358-L360 PolarHBondContact O-N 2.75Å; L360-M364 HydrophobicContact CG-CE 4.29Å; L360-M364 WeakPolarHBondContact O-CG 3.5Å; L360-M364 PolarHBondContact O-N 3.15Å |
| 361 | A | 92.7 | Very high | 86.9 | Confident | 51 Ų | 51 | 106 Ų | 106 | 42% | 0.421 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.3 | -46.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | N357 K358 A363 M364 E365 | N357-A361 WeakPolarHBondContact O-CB 3.38Å; N357-A361 PolarHBondContact O-N 3.13Å; K358-A361 WeakPolarHBondContact O-CB 3.48Å; K358-A361 PolarHBondContact O-N 3.32Å; K358-A361 VanDerWaalsContact O-N 3.13Å; A361-A363 VanDerWaalsContact C-N 3.32Å; A361-A363 PolarHBondContact O-N 3.35Å; A361-M364 PolarHBondContact O-N 2.89Å; A361-E365 PolarHBondContact O-N 3.29Å |
| 362 | E | 92.2 | Very high | 84.4 | Confident | 62 Ų | 62 | 108 Ų | 108 | 29% | 0.29 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -56.1 | -44.4 | 175 | -70.8 | 166.4 | 170.8 | 0 | 0 | 111.1 | K358 H359 E365 Q366 | K358-E362 WeakPolarHBondContact CE-OE1 3.48Å; K358-E362 IonicContact NZ-OE1 3.95Å; K358-E362 PolarHBondContact NZ-OE1 3.06Å; K358-E362 WeakPolarHBondContact O-CG 3.29Å; K358-E362 PolarHBondContact O-N 2.88Å; H359-E362 IonicContact CE1-OE2 2.8Å; H359-E362 IonicContact CG-OE2 2.65Å; H359-E362 IonicContact ND1-OE2 3.34Å; H359-E362 PolarHBondContact ND1-OE2 3.48Å; E362-E365 PolarHBondContact O-N 2.94Å; E362-Q366 VanDerWaalsContact O-CG 3.29Å; E362-Q366 WeakPolarHBondContact O-CG 3.43Å; E362-Q366 PolarHBondContact O-N 3.17Å |
| 363 | A | 91.1 | Very high | 82 | Confident | 46 Ų | 46 | 103.7 Ų | 103.7 | 38% | 0.38 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.5 | -38.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | H359 A361 E365 Q366 L367 | H359-A363 WeakPolarHBondContact O-CB 3.43Å; H359-A363 PolarHBondContact O-N 3.48Å; A361-A363 VanDerWaalsContact C-N 3.32Å; A361-A363 PolarHBondContact O-N 3.35Å; A363-E365 VanDerWaalsContact C-N 3.34Å; A363-Q366 PolarHBondContact O-N 3.34Å; A363-L367 PolarHBondContact O-N 3Å |
| 364 | M | 88.2 | Confident | 79.6 | Confident | 101 Ų | 101 | 104.5 Ų | 104.5 | 50% | 0.498 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -67.6 | -33.4 | 174.5 | -76.2 | -167.6 | -64.8 | 0 | 0 | 112.7 | L360 A361 K368 | L360-M364 HydrophobicContact CG-CE 4.29Å; L360-M364 WeakPolarHBondContact O-CG 3.5Å; L360-M364 PolarHBondContact O-N 3.15Å; A361-M364 PolarHBondContact O-N 2.89Å; M364-K368 WeakPolarHBondContact O-CG 3.33Å; M364-K368 PolarHBondContact O-N 2.92Å; M364-K368 VanDerWaalsContact O-N 3.15Å |
| 365 | E | 88.6 | Confident | 76.9 | Confident | 141 Ų | 141 | 102.8 Ų | 102.8 | 66% | 0.659 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -71 | -43.4 | 174.6 | -174.1 | 167.4 | -150.2 | 0 | 0 | 111.4 | A361 E362 A363 L367 K368 S369 | A361-E365 PolarHBondContact O-N 3.29Å; E362-E365 PolarHBondContact O-N 2.94Å; A363-E365 VanDerWaalsContact C-N 3.34Å; E365-L367 VanDerWaalsContact C-N 3.3Å; E365-L367 PolarHBondContact O-N 2.93Å; E365-K368 PolarHBondContact O-N 3Å; E365-S369 WeakPolarHBondContact O-CB 3.46Å; E365-S369 PolarHBondContact O-N 3.21Å |
| 366 | Q | 85.6 | Confident | 74.1 | Confident | 140 Ų | 140 | 101.8 Ų | 101.8 | 65% | 0.654 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -57.6 | -40.9 | 172.3 | -72.8 | 172.9 | 31.4 | 0 | 0 | 112.1 | E362 A363 S369 G370 | E362-Q366 VanDerWaalsContact O-CG 3.29Å; E362-Q366 WeakPolarHBondContact O-CG 3.43Å; E362-Q366 PolarHBondContact O-N 3.17Å; A363-Q366 PolarHBondContact O-N 3.34Å; Q366-S369 PolarHBondContact O-N 3.46Å; Q366-G370 PolarHBondContact O-N 3.01Å |
| 367 | L | 78.6 | Confident | 72.1 | Confident | 119 Ų | 119 | 103.2 Ų | 103.2 | 62% | 0.623 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -62.7 | -43.5 | 174.5 | -95.5 | 164.1 | 0 | 0 | 0 | 112.9 | A363 E365 Y371 | A363-L367 PolarHBondContact O-N 3Å; E365-L367 VanDerWaalsContact C-N 3.3Å; E365-L367 PolarHBondContact O-N 2.93Å; L367-Y371 PolarHBondContact O-N 3.01Å; L367-Y371 VanDerWaalsContact O-N 3.09Å |
| 368 | K | 78.4 | Confident | 69.6 | Low | 158 Ų | 158 | 102.3 Ų | 102.3 | 69% | 0.687 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.5 | -37.5 | 176.3 | -72.2 | 171.8 | -179 | 176.2 | 0 | 112.4 | M364 E365 S372 | M364-K368 WeakPolarHBondContact O-CG 3.33Å; M364-K368 PolarHBondContact O-N 2.92Å; M364-K368 VanDerWaalsContact O-N 3.15Å; E365-K368 PolarHBondContact O-N 3Å; K368-S372 PolarHBondContact O-OG 2.96Å |
| 369 | S | 68.7 | Low | 67.3 | Low | 75 Ų | 75 | 100.3 Ų | 100.3 | 52% | 0.524 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -67.9 | -47.1 | 176.4 | -174.5 | 0 | 0 | 0 | 0 | 111.8 | E365 Q366 Y371 S372 S373 | E365-S369 WeakPolarHBondContact O-CB 3.46Å; E365-S369 PolarHBondContact O-N 3.21Å; Q366-S369 PolarHBondContact O-N 3.46Å; S369-Y371 PolarHBondContact O-N 3.05Å; S369-S372 WeakPolarHBondContact O-CB 3.24Å; S369-S372 PolarHBondContact O-N 3.26Å; S369-S373 PolarHBondContact O-OG 2.95Å; S369-S373 VanDerWaalsContact O-OG 3.04Å |
| 370 | G | 55.4 | Low | 64.6 | Low | 33 Ų | 33 | 103 Ų | 103 | 34% | 0.34 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -61 | -40 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | Q366 S372 S373 T374 | Q366-G370 PolarHBondContact O-N 3.01Å; G370-S372 PolarHBondContact O-N 3.22Å; G370-S373 PolarHBondContact O-N 3.04Å; G370-S373 VanDerWaalsContact O-N 3.1Å; G370-S373 PolarHBondContact O-OG 3.03Å; G370-T374 PolarHBondContact O-N 3.37Å |
| 371 | Y | 48.7 | Very low | 62.1 | Low | 191 Ų | 191 | 102.8 Ų | 102.8 | 75% | 0.749 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | -12.9 | 175.2 | -113.8 | -84.5 | 0 | 0 | 0 | 114.7 | L367 S369 | L367-Y371 PolarHBondContact O-N 3.01Å; L367-Y371 VanDerWaalsContact O-N 3.09Å; S369-Y371 PolarHBondContact O-N 3.05Å |
| 372 | S | 44.9 | Very low | 59.7 | Low | 107 Ų | 107 | 104.2 Ų | 104.2 | 75% | 0.748 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | -0.5 | 175.3 | -51.6 | 0 | 0 | 0 | 0 | 112.9 | K368 S369 G370 | K368-S372 PolarHBondContact O-OG 2.96Å; S369-S372 WeakPolarHBondContact O-CB 3.24Å; S369-S372 PolarHBondContact O-N 3.26Å; G370-S372 PolarHBondContact O-N 3.22Å |
| 373 | S | 45.7 | Very low | 57.1 | Low | 80 Ų | 80 | 104.5 Ų | 104.5 | 56% | 0.559 | 69% | 0.685 | S | S | * | * | trans | -140.6 | 15.1 | -168.7 | 52.6 | 0 | 0 | 0 | 0 | 115.2 | S369 G370 G375 | S369-S373 PolarHBondContact O-OG 2.95Å; S369-S373 VanDerWaalsContact O-OG 3.04Å; G370-S373 PolarHBondContact O-N 3.04Å; G370-S373 VanDerWaalsContact O-N 3.1Å; G370-S373 PolarHBondContact O-OG 3.03Å; S373-G375 PolarHBondContact O-N 3.46Å | ||
| 374 | T | 44.5 | Very low | 54.7 | Low | 125 Ų | 125 | 110.2 Ų | 110.2 | 77% | 0.767 | 70% | 0.704 | S | S | * | * | trans | -67.7 | 75.1 | 167.9 | 48.4 | 0 | 0 | 0 | 0 | 111.4 | G370 | G370-T374 PolarHBondContact O-N 3.37Š| ||
| 375 | G | 40.6 | Very low | 52.7 | Low | 76 Ų | 76 | 112.4 Ų | 112.4 | 78% | 0.784 | 72% | 0.716 | S | S | * | * | trans | -162.3 | 10.1 | -169.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | S373 | S373-G375 PolarHBondContact O-N 3.46Š| ||
| 376 | S | 38.4 | Very low | 50.9 | Low | 114 Ų | 114 | 110.9 Ų | 110.9 | 80% | 0.797 | 72% | 0.716 | S | S | * | * | trans | -154.6 | 127.3 | 167.3 | -168.7 | 0 | 0 | 0 | 0 | 113.5 | G378 | S376-G378 PolarHBondContact O-N 3.38Š| ||
| 377 | S | 53 | Low | 49.4 | Very low | 127 Ų | 127 | 109.9 Ų | 109.9 | 89% | 0.888 | 72% | 0.715 | S | S | * | * | trans | -82.8 | 81.1 | 171.3 | 55.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 378 | G | 41.4 | Very low | 48.8 | Very low | 62 Ų | 62 | 109 Ų | 109 | 64% | 0.639 | 71% | 0.711 | S | S | * | * | trans | -102.9 | 89.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S376 L380 | S376-G378 PolarHBondContact O-N 3.38Å; G378-L380 PolarHBondContact O-N 2.95Å; G378-L380 VanDerWaalsContact O-N 3.09Å | ||
| 379 | G | 47.5 | Very low | 48.8 | Very low | 85 Ų | 85 | 107.2 Ų | 107.2 | 88% | 0.876 | 71% | 0.707 | S | S | * | * | trans | -70.2 | 101.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 380 | L | 38.1 | Very low | 49.4 | Very low | 170 Ų | 170 | 110.1 Ų | 110.1 | 89% | 0.89 | 71% | 0.713 | S | S | * | * | trans | -81.4 | 130 | 171.2 | -78.4 | 168.6 | 0 | 0 | 0 | 110.1 | G378 | G378-L380 PolarHBondContact O-N 2.95Å; G378-L380 VanDerWaalsContact O-N 3.09Å | ||
| 381 | A | 42.9 | Very low | 50.7 | Low | 96 Ų | 96 | 115.3 Ų | 115.3 | 79% | 0.793 | 73% | 0.726 | S | S | * | * | trans | -63.5 | 146.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | G383 | A381-G383 PolarHBondContact O-N 2.68Š| ||
| 382 | G | 40.6 | Very low | 52.5 | Low | 81 Ų | 81 | 112.4 Ų | 112.4 | 84% | 0.835 | 72% | 0.717 | S | S | * | * | trans | -61.9 | 100.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | Q384 | G382-Q384 PolarHBondContact O-N 3.39Š| ||
| 383 | G | 37.5 | Very low | 54.6 | Low | 67 Ų | 67 | 112.7 Ų | 112.7 | 69% | 0.691 | 71% | 0.707 | S | S | * | * | trans | -66.7 | 94.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | A381 I385 | A381-G383 PolarHBondContact O-N 2.68Å; G383-I385 VanDerWaalsContact C-N 3.29Å; G383-I385 PolarHBondContact O-N 2.97Å | ||
| 384 | Q | 42.4 | Very low | 56.6 | Low | 167 Ų | 167 | 112.4 Ų | 112.4 | 78% | 0.78 | 71% | 0.705 | S | S | * | * | trans | -69 | 88.5 | 173.7 | -172.6 | -178.3 | -11.3 | 0 | 0 | 108.8 | G382 T386 | G382-Q384 PolarHBondContact O-N 3.39Å; Q384-T386 VanDerWaalsContact C-N 3.25Å; Q384-T386 HydrophobicContact CG-CG2 4.02Å; Q384-T386 PolarHBondContact O-N 3.41Å | ||
| 385 | I | 46.4 | Very low | 58.8 | Low | 147 Ų | 147 | 111.1 Ų | 111.1 | 75% | 0.754 | 69% | 0.693 | S | S | * | * | trans | -70.2 | 87.3 | 173.8 | -53.6 | 178.9 | 0 | 0 | 0 | 107.7 | G383 L387 | G383-I385 VanDerWaalsContact C-N 3.29Å; G383-I385 PolarHBondContact O-N 2.97Å; I385-L387 HydrophobicContact CG2-CG 4.24Å; I385-L387 PolarHBondContact O-N 3.09Å | ||
| 386 | T | 49.4 | Very low | 61.1 | Low | 108 Ų | 108 | 110.5 Ų | 110.5 | 66% | 0.663 | 67% | 0.672 | S | S | * | * | trans | -71.2 | 78.2 | 168.5 | 54.5 | 0 | 0 | 0 | 0 | 109.1 | Q384 N388 | Q384-T386 VanDerWaalsContact C-N 3.25Å; Q384-T386 HydrophobicContact CG-CG2 4.02Å; Q384-T386 PolarHBondContact O-N 3.41Å; T386-N388 PolarHBondContact O-N 3.07Å | ||
| 387 | L | 54.7 | Low | 63.8 | Low | 120 Ų | 120 | 107.6 Ų | 107.6 | 63% | 0.628 | 66% | 0.655 | S | S | * | * | trans | -51.7 | 135.8 | 155 | -73.5 | 171.5 | 0 | 0 | 0 | 107.6 | I385 I389 | I385-L387 HydrophobicContact CG2-CG 4.24Å; I385-L387 PolarHBondContact O-N 3.09Å; L387-I389 PolarHBondContact O-N 2.95Å; L387-I389 VanDerWaalsContact O-N 3.11Å | ||
| 388 | N | 65.4 | Low | 65.7 | Low | 101 Ų | 101 | 107.1 Ų | 107.1 | 54% | 0.54 | 64% | 0.638 | S | S | . | * | trans | -54.9 | 121.7 | -179.3 | -179.5 | 23.7 | 0 | 0 | 0 | 109.3 | T386 Q390 K391 F392 | T386-N388 PolarHBondContact O-N 3.07Å; N388-Q390 VanDerWaalsContact C-N 3.27Å; N388-Q390 PolarHBondContact O-N 2.92Å; N388-K391 HydrophobicContact CB-CB 4.35Å; N388-K391 WeakPolarHBondContact O-CA 3.37Å; N388-K391 WeakPolarHBondContact O-CB 3.31Å; N388-K391 PolarHBondContact O-N 3.41Å; N388-F392 PolarHBondContact O-N 2.81Å | ||
| 389 | I | 78.9 | Confident | 68.2 | Low | 119 Ų | 119 | 109.2 Ų | 109.2 | 61% | 0.61 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -54.5 | -45 | -169 | -69.4 | 171.4 | 0 | 0 | 0 | 110.9 | L387 K391 F392 E393 | L387-I389 PolarHBondContact O-N 2.95Å; L387-I389 VanDerWaalsContact O-N 3.11Å; I389-K391 PolarHBondContact O-N 3.35Å; I389-K391 VanDerWaalsContact O-N 3.16Å; I389-F392 WeakPolarHBondContact O-CA 3.32Å; I389-F392 WeakPolarHBondContact O-CB 3.45Å; I389-F392 PolarHBondContact O-N 3.46Å; I389-E393 HydrophobicContact CG2-CG 4.26Å; I389-E393 WeakPolarHBondContact CG2-OE1 3.48Å; I389-E393 WeakPolarHBondContact O-CG 3.48Å; I389-E393 PolarHBondContact O-N 3.03Å |
| 390 | Q | 80.4 | Confident | 70.4 | Confident | 136 Ų | 136 | 110.4 Ų | 110.4 | 64% | 0.636 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -56.4 | -31.8 | 175.5 | -65.6 | 173.8 | -28.6 | 0 | 0 | 114.1 | N388 E393 S394 | N388-Q390 VanDerWaalsContact C-N 3.27Å; N388-Q390 PolarHBondContact O-N 2.92Å; Q390-E393 WeakPolarHBondContact CA-OE2 3.48Å; Q390-S394 VanDerWaalsContact O-CB 3.31Å; Q390-S394 WeakPolarHBondContact O-CB 3.39Å; Q390-S394 PolarHBondContact O-N 3.04Å |
| 391 | K | 84.3 | Confident | 73.1 | Confident | 142 Ų | 142 | 107.7 Ų | 107.7 | 62% | 0.617 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -80.5 | -29.2 | 177.7 | -167.3 | 168 | -175.1 | 174.4 | 0 | 112 | N388 I389 L395 | N388-K391 HydrophobicContact CB-CB 4.35Å; N388-K391 WeakPolarHBondContact O-CA 3.37Å; N388-K391 WeakPolarHBondContact O-CB 3.31Å; N388-K391 PolarHBondContact O-N 3.41Å; I389-K391 PolarHBondContact O-N 3.35Å; I389-K391 VanDerWaalsContact O-N 3.16Å; K391-L395 HydrophobicContact CG-CD1 4.49Å; K391-L395 WeakPolarHBondContact O-CB 3.48Å; K391-L395 WeakPolarHBondContact O-CG 3.43Å; K391-L395 PolarHBondContact O-N 2.96Å; K391-L395 VanDerWaalsContact O-N 3.08Å |
| 392 | F | 86.3 | Confident | 75.5 | Confident | 130 Ų | 130 | 107.3 Ų | 107.3 | 57% | 0.57 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -70.1 | -44.8 | 169.8 | -175.3 | -91.7 | 0 | 0 | 0 | 110.9 | N388 I389 S394 L395 N396 | N388-F392 PolarHBondContact O-N 2.81Å; I389-F392 WeakPolarHBondContact O-CA 3.32Å; I389-F392 WeakPolarHBondContact O-CB 3.45Å; I389-F392 PolarHBondContact O-N 3.46Å; F392-S394 PolarHBondContact O-N 3.35Å; F392-L395 PolarHBondContact O-N 3.41Å; F392-N396 WeakPolarHBondContact O-CB 3.36Å; F392-N396 PolarHBondContact O-N 2.94Å |
| 393 | E | 88.4 | Confident | 78.1 | Confident | 114 Ų | 114 | 109.1 Ų | 109.1 | 53% | 0.533 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -58 | -45.7 | 173.5 | -68.6 | 166.6 | 163.1 | 0 | 0 | 111.5 | I389 Q390 L395 N396 A397 | I389-E393 HydrophobicContact CG2-CG 4.26Å; I389-E393 WeakPolarHBondContact CG2-OE1 3.48Å; I389-E393 WeakPolarHBondContact O-CG 3.48Å; I389-E393 PolarHBondContact O-N 3.03Å; Q390-E393 WeakPolarHBondContact CA-OE2 3.48Å; E393-L395 PolarHBondContact O-N 3.49Å; E393-N396 PolarHBondContact O-N 2.68Å; E393-A397 PolarHBondContact O-N 3.44Å |
| 394 | S | 87.9 | Confident | 80.9 | Confident | 74 Ų | 74 | 112 Ų | 112 | 52% | 0.517 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62 | -41.6 | 175.3 | -174 | 0 | 0 | 0 | 0 | 113.2 | Q390 F392 N396 E398 | Q390-S394 VanDerWaalsContact O-CB 3.31Å; Q390-S394 WeakPolarHBondContact O-CB 3.39Å; Q390-S394 PolarHBondContact O-N 3.04Å; F392-S394 PolarHBondContact O-N 3.35Å; S394-N396 VanDerWaalsContact C-N 3.34Å; S394-E398 WeakPolarHBondContact O-CB 3.29Å; S394-E398 PolarHBondContact O-N 3.24Å |
| 395 | L | 89.9 | Confident | 83.4 | Confident | 98 Ų | 98 | 107 Ų | 107 | 51% | 0.513 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -68.8 | -33 | 176.6 | -86.2 | 162.2 | 0 | 0 | 0 | 112.1 | K391 F392 E393 L399 | K391-L395 HydrophobicContact CG-CD1 4.49Å; K391-L395 WeakPolarHBondContact O-CB 3.48Å; K391-L395 WeakPolarHBondContact O-CG 3.43Å; K391-L395 PolarHBondContact O-N 2.96Å; K391-L395 VanDerWaalsContact O-N 3.08Å; F392-L395 PolarHBondContact O-N 3.41Å; E393-L395 PolarHBondContact O-N 3.49Å; L395-L399 VanDerWaalsContact O-CB 3.31Å; L395-L399 WeakPolarHBondContact O-CB 3.37Å; L395-L399 PolarHBondContact O-N 3.47Å |
| 396 | N | 90.3 | Very high | 85.7 | Confident | 62 Ų | 62 | 102.4 Ų | 102.4 | 33% | 0.332 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.6 | -44.9 | 175 | -169 | 93 | 0 | 0 | 0 | 111.2 | F392 E393 S394 E398 L399 E400 | F392-N396 WeakPolarHBondContact O-CB 3.36Å; F392-N396 PolarHBondContact O-N 2.94Å; E393-N396 PolarHBondContact O-N 2.68Å; S394-N396 VanDerWaalsContact C-N 3.34Å; N396-E398 VanDerWaalsContact C-N 3.34Å; N396-E398 PolarHBondContact O-N 2.8Å; N396-L399 WeakPolarHBondContact O-CB 3.5Å; N396-L399 PolarHBondContact O-N 3.21Å; N396-E400 PolarHBondContact ND2-OE1 2.94Å; N396-E400 PolarHBondContact ND2-OE2 2.93Å; N396-E400 WeakPolarHBondContact O-CG 3.4Å; N396-E400 PolarHBondContact O-N 3.22Å |
| 397 | A | 93.5 | Very high | 87.9 | Confident | 54 Ų | 54 | 101.6 Ų | 101.6 | 45% | 0.446 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.7 | -38.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | E393 H401 | E393-A397 PolarHBondContact O-N 3.44Å; A397-H401 WeakPolarHBondContact O-CB 3.39Å; A397-H401 PolarHBondContact O-N 3.05Å |
| 398 | E | 93.8 | Very high | 89.9 | Confident | 116 Ų | 116 | 99.5 Ų | 99.5 | 54% | 0.542 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.1 | -34.2 | 174.6 | -172.8 | 170.3 | -148.2 | 0 | 0 | 112.2 | S394 N396 N402 | S394-E398 WeakPolarHBondContact O-CB 3.29Å; S394-E398 PolarHBondContact O-N 3.24Å; N396-E398 VanDerWaalsContact C-N 3.34Å; N396-E398 PolarHBondContact O-N 2.8Å; E398-N402 WeakPolarHBondContact O-CB 3.5Å; E398-N402 PolarHBondContact O-N 2.95Å; E398-N402 PolarHBondContact O-ND2 3.38Å |
| 399 | L | 93.4 | Very high | 91.4 | Very high | 106 Ų | 106 | 101.7 Ų | 101.7 | 56% | 0.555 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -68.4 | -47.3 | 172.7 | 178.3 | 63.6 | 0 | 0 | 0 | 111.9 | L395 N396 H401 N402 Q403 | L395-L399 VanDerWaalsContact O-CB 3.31Å; L395-L399 WeakPolarHBondContact O-CB 3.37Å; L395-L399 PolarHBondContact O-N 3.47Å; N396-L399 WeakPolarHBondContact O-CB 3.5Å; N396-L399 PolarHBondContact O-N 3.21Å; L399-H401 PolarHBondContact O-N 2.91Å; L399-N402 PolarHBondContact O-N 3.39Å; L399-Q403 WeakPolarHBondContact O-CB 3.44Å; L399-Q403 PolarHBondContact O-N 2.84Å |
| 400 | E | 94.5 | Very high | 92.2 | Very high | 111 Ų | 111 | 101.4 Ų | 101.4 | 52% | 0.519 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.2 | -48 | 176.5 | -76.1 | 170 | 175.4 | 0 | 0 | 110.7 | N396 N402 Q403 E404 | N396-E400 PolarHBondContact ND2-OE1 2.94Å; N396-E400 PolarHBondContact ND2-OE2 2.93Å; N396-E400 WeakPolarHBondContact O-CG 3.4Å; N396-E400 PolarHBondContact O-N 3.22Å; E400-N402 PolarHBondContact O-N 3.4Å; E400-Q403 PolarHBondContact O-N 3.39Å; E400-Q403 VanDerWaalsContact O-N 3.08Å; E400-E404 WeakPolarHBondContact O-CG 3.46Å; E400-E404 PolarHBondContact O-N 3.39Å |
| 401 | H | 95.1 | Very high | 93 | Very high | 113 Ų | 113 | 97.5 Ų | 97.5 | 52% | 0.523 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63 | -39.1 | 176.9 | -175.2 | 54.4 | 0 | 0 | 0 | 113.3 | A397 L399 Q403 E404 L405 | A397-H401 WeakPolarHBondContact O-CB 3.39Å; A397-H401 PolarHBondContact O-N 3.05Å; L399-H401 PolarHBondContact O-N 2.91Å; H401-Q403 VanDerWaalsContact C-N 3.29Å; H401-Q403 PolarHBondContact O-N 3.35Å; H401-E404 IonicContact ND1-OE2 3.55Å; H401-E404 PolarHBondContact O-N 2.88Å; H401-L405 WeakPolarHBondContact O-CB 3.38Å; H401-L405 PolarHBondContact O-N 3.04Å |
| 402 | N | 91.9 | Very high | 93.5 | Very high | 88 Ų | 88 | 96.3 Ų | 96.3 | 47% | 0.471 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.9 | -34.2 | 173.2 | -89.2 | -81.4 | 0 | 0 | 0 | 112.3 | E398 L399 E400 L405 A406 | E398-N402 WeakPolarHBondContact O-CB 3.5Å; E398-N402 PolarHBondContact O-N 2.95Å; E398-N402 PolarHBondContact O-ND2 3.38Å; L399-N402 PolarHBondContact O-N 3.39Å; E400-N402 PolarHBondContact O-N 3.4Å; N402-L405 PolarHBondContact O-N 2.77Å; N402-A406 WeakPolarHBondContact O-CB 3.46Å; N402-A406 PolarHBondContact O-N 3.39Å |
| 403 | Q | 95.7 | Very high | 94 | Very high | 119 Ų | 119 | 95.7 Ų | 95.7 | 56% | 0.556 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -74.7 | -37 | 177.9 | -168.7 | 155.8 | -6.7 | 0 | 0 | 112 | L399 E400 H401 A406 N407 | L399-Q403 WeakPolarHBondContact O-CB 3.44Å; L399-Q403 PolarHBondContact O-N 2.84Å; E400-Q403 PolarHBondContact O-N 3.39Å; E400-Q403 VanDerWaalsContact O-N 3.08Å; H401-Q403 VanDerWaalsContact C-N 3.29Å; H401-Q403 PolarHBondContact O-N 3.35Å; Q403-A406 PolarHBondContact O-N 3.38Å; Q403-N407 WeakPolarHBondContact O-CB 3.49Å; Q403-N407 PolarHBondContact O-N 3.35Å; Q403-N407 PolarHBondContact O-ND2 2.82Å; Q403-N407 PolarHBondContact O-OD1 3.14Å |
| 404 | E | 95.8 | Very high | 94.4 | Very high | 126 Ų | 126 | 96 Ų | 96 | 59% | 0.589 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.6 | -47.1 | 167.1 | -70.5 | 179.8 | 154.3 | 0 | 0 | 111.7 | E400 H401 A406 N407 S408 | E400-E404 WeakPolarHBondContact O-CG 3.46Å; E400-E404 PolarHBondContact O-N 3.39Å; H401-E404 IonicContact ND1-OE2 3.55Å; H401-E404 PolarHBondContact O-N 2.88Å; E404-A406 VanDerWaalsContact C-N 3.34Å; E404-A406 PolarHBondContact O-N 2.93Å; E404-N407 PolarHBondContact O-N 2.93Å; E404-S408 WeakPolarHBondContact O-CB 3.5Å; E404-S408 PolarHBondContact O-N 3.38Å |
| 405 | L | 95.6 | Very high | 94.9 | Very high | 62 Ų | 62 | 98 Ų | 98 | 33% | 0.325 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.5 | -38.2 | 178.3 | -179.2 | 61.3 | 0 | 0 | 0 | 112.3 | H401 N402 R409 | H401-L405 WeakPolarHBondContact O-CB 3.38Å; H401-L405 PolarHBondContact O-N 3.04Å; N402-L405 PolarHBondContact O-N 2.77Å; L405-R409 WeakPolarHBondContact O-CB 3.45Å; L405-R409 WeakPolarHBondContact O-CG 3.37Å; L405-R409 PolarHBondContact O-N 2.93Å |
| 406 | A | 94.3 | Very high | 95.2 | Very high | 51 Ų | 51 | 97.6 Ų | 97.6 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.4 | -44.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | N402 Q403 E404 R409 M410 | N402-A406 WeakPolarHBondContact O-CB 3.46Å; N402-A406 PolarHBondContact O-N 3.39Å; Q403-A406 PolarHBondContact O-N 3.38Å; E404-A406 VanDerWaalsContact C-N 3.34Å; E404-A406 PolarHBondContact O-N 2.93Å; A406-R409 PolarHBondContact O-N 3.01Å; A406-M410 PolarHBondContact O-N 3.23Å |
| 407 | N | 95.5 | Very high | 95.5 | Very high | 92 Ų | 92 | 100.4 Ų | 100.4 | 49% | 0.492 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 175.9 | -66.4 | -19.3 | 0 | 0 | 0 | 111.7 | Q403 E404 M410 A411 | Q403-N407 WeakPolarHBondContact O-CB 3.49Å; Q403-N407 PolarHBondContact O-N 3.35Å; Q403-N407 PolarHBondContact O-ND2 2.82Å; Q403-N407 PolarHBondContact O-OD1 3.14Å; E404-N407 PolarHBondContact O-N 2.93Å; N407-M410 WeakPolarHBondContact O-CB 3.17Å; N407-M410 PolarHBondContact O-N 3.3Å; N407-A411 PolarHBondContact O-N 3.42Å |
| 408 | S | 97.4 | Very high | 95.7 | Very high | 75 Ų | 75 | 102.5 Ų | 102.5 | 52% | 0.524 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.1 | -44.4 | 176.9 | -170.4 | 0 | 0 | 0 | 0 | 111.8 | E404 M410 A411 E412 | E404-S408 WeakPolarHBondContact O-CB 3.5Å; E404-S408 PolarHBondContact O-N 3.38Å; S408-M410 VanDerWaalsContact C-N 3.32Å; S408-M410 PolarHBondContact O-N 2.97Å; S408-A411 PolarHBondContact O-N 2.88Å; S408-E412 WeakPolarHBondContact O-CB 3.43Å; S408-E412 PolarHBondContact O-N 2.98Å |
| 409 | R | 97.4 | Very high | 95.9 | Very high | 147 Ų | 147 | 101 Ų | 101 | 56% | 0.555 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.6 | -35.1 | 175.2 | -74.6 | 169.8 | 173.2 | 164 | -1.1 | 112.4 | L405 A406 E412 L413 | L405-R409 WeakPolarHBondContact O-CB 3.45Å; L405-R409 WeakPolarHBondContact O-CG 3.37Å; L405-R409 PolarHBondContact O-N 2.93Å; A406-R409 PolarHBondContact O-N 3.01Å; R409-E412 PolarHBondContact O-N 2.89Å; R409-L413 VanDerWaalsContact O-CG 3.29Å; R409-L413 WeakPolarHBondContact O-CG 3.43Å; R409-L413 PolarHBondContact O-N 3.39Å |
| 410 | M | 95.1 | Very high | 96.1 | Very high | 113 Ų | 113 | 101.2 Ų | 101.2 | 56% | 0.557 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.5 | -49 | 175.5 | -170.5 | 174.6 | -65.6 | 0 | 0 | 111.1 | A406 N407 S408 E412 L413 E414 | A406-M410 PolarHBondContact O-N 3.23Å; N407-M410 WeakPolarHBondContact O-CB 3.17Å; N407-M410 PolarHBondContact O-N 3.3Å; S408-M410 VanDerWaalsContact C-N 3.32Å; S408-M410 PolarHBondContact O-N 2.97Å; M410-E412 VanDerWaalsContact C-N 3.31Å; M410-E412 PolarHBondContact O-N 3.15Å; M410-L413 PolarHBondContact O-N 2.93Å; M410-E414 WeakPolarHBondContact O-CG 3.29Å; M410-E414 PolarHBondContact O-N 3.49Å |
| 411 | A | 96.6 | Very high | 96.2 | Very high | 54 Ų | 54 | 101.5 Ų | 101.5 | 45% | 0.446 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.7 | -34.1 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | N407 S408 K415 | N407-A411 PolarHBondContact O-N 3.42Å; S408-A411 PolarHBondContact O-N 2.88Å; A411-K415 WeakPolarHBondContact O-CB 3.5Å; A411-K415 PolarHBondContact O-N 3.04Å |
| 412 | E | 96.4 | Very high | 96.3 | Very high | 117 Ų | 117 | 100.5 Ų | 100.5 | 55% | 0.547 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.7 | -43.3 | 173.1 | -174.9 | 174.5 | -160.1 | 0 | 0 | 111.8 | S408 R409 M410 K415 L416 | S408-E412 WeakPolarHBondContact O-CB 3.43Å; S408-E412 PolarHBondContact O-N 2.98Å; R409-E412 PolarHBondContact O-N 2.89Å; M410-E412 VanDerWaalsContact C-N 3.31Å; M410-E412 PolarHBondContact O-N 3.15Å; E412-K415 PolarHBondContact O-N 3.43Å; E412-L416 HydrophobicContact CG-CD1 4.19Å; E412-L416 WeakPolarHBondContact O-CB 3.41Å; E412-L416 VanDerWaalsContact O-CG 3.32Å; E412-L416 WeakPolarHBondContact O-CG 3.42Å; E412-L416 PolarHBondContact O-N 3.45Å |
| 413 | L | 96.4 | Very high | 96.4 | Very high | 117 Ų | 117 | 99 Ų | 99 | 61% | 0.613 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.5 | -41.1 | 175.1 | -72 | 169 | 0 | 0 | 0 | 112.4 | R409 M410 K415 L416 Q417 | R409-L413 VanDerWaalsContact O-CG 3.29Å; R409-L413 WeakPolarHBondContact O-CG 3.43Å; R409-L413 PolarHBondContact O-N 3.39Å; M410-L413 PolarHBondContact O-N 2.93Å; L413-K415 VanDerWaalsContact C-N 3.34Å; L413-K415 PolarHBondContact O-N 3.24Å; L413-L416 PolarHBondContact O-N 3.48Å; L413-Q417 VanDerWaalsContact O-CB 3.28Å; L413-Q417 WeakPolarHBondContact O-CB 3.49Å; L413-Q417 PolarHBondContact O-N 3.27Å |
| 414 | E | 96.6 | Very high | 96.5 | Very high | 121 Ų | 121 | 96.8 Ų | 96.8 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61 | -42.6 | 174.4 | -72.8 | 176.1 | 162.3 | 0 | 0 | 111.7 | M410 Q417 L418 | M410-E414 WeakPolarHBondContact O-CG 3.29Å; M410-E414 PolarHBondContact O-N 3.49Å; E414-Q417 PolarHBondContact O-N 2.72Å; E414-L418 PolarHBondContact O-N 3.39Å |
| 415 | K | 97.7 | Very high | 96.5 | Very high | 116 Ų | 116 | 97 Ų | 97 | 50% | 0.504 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.4 | -48.5 | 174.7 | 177.5 | -177.8 | 171 | -63.5 | 0 | 111.8 | A411 E412 L413 Q417 L418 E419 | A411-K415 WeakPolarHBondContact O-CB 3.5Å; A411-K415 PolarHBondContact O-N 3.04Å; E412-K415 PolarHBondContact O-N 3.43Å; L413-K415 VanDerWaalsContact C-N 3.34Å; L413-K415 PolarHBondContact O-N 3.24Å; K415-Q417 VanDerWaalsContact C-N 3.32Å; K415-Q417 PolarHBondContact O-N 3.23Å; K415-L418 PolarHBondContact O-N 3.39Å; K415-E419 VanDerWaalsContact CE-OE1 3.29Å; K415-E419 WeakPolarHBondContact CE-OE1 3.31Å; K415-E419 IonicContact NZ-OE1 2.67Å; K415-E419 PolarHBondContact NZ-OE1 3.16Å; K415-E419 IonicContact NZ-OE2 2.8Å; K415-E419 PolarHBondContact NZ-OE2 2.96Å; K415-E419 WeakPolarHBondContact O-CG 3.19Å; K415-E419 PolarHBondContact O-N 3.05Å |
| 416 | L | 97.3 | Very high | 96.6 | Very high | 89 Ų | 89 | 99.7 Ų | 99.7 | 47% | 0.466 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64 | -36.1 | 178.1 | -72.2 | 169.2 | 0 | 0 | 0 | 112.2 | E412 L413 E419 L420 | E412-L416 HydrophobicContact CG-CD1 4.19Å; E412-L416 WeakPolarHBondContact O-CB 3.41Å; E412-L416 VanDerWaalsContact O-CG 3.32Å; E412-L416 WeakPolarHBondContact O-CG 3.42Å; E412-L416 PolarHBondContact O-N 3.45Å; L413-L416 PolarHBondContact O-N 3.48Å; L416-E419 PolarHBondContact O-N 3.11Å; L416-L420 WeakPolarHBondContact O-CB 3.38Å; L416-L420 PolarHBondContact O-N 2.85Å |
| 417 | Q | 96.6 | Very high | 96.4 | Very high | 121 Ų | 121 | 100.8 Ų | 100.8 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.5 | -37.6 | 175 | -177 | 175 | -4 | 0 | 0 | 111.9 | L413 E414 K415 Q421 | L413-Q417 VanDerWaalsContact O-CB 3.28Å; L413-Q417 WeakPolarHBondContact O-CB 3.49Å; L413-Q417 PolarHBondContact O-N 3.27Å; E414-Q417 PolarHBondContact O-N 2.72Å; K415-Q417 VanDerWaalsContact C-N 3.32Å; K415-Q417 PolarHBondContact O-N 3.23Å; Q417-Q421 WeakPolarHBondContact O-CG 3.47Å; Q417-Q421 PolarHBondContact O-N 3.32Å; Q417-Q421 VanDerWaalsContact O-N 3.08Å |
| 418 | L | 97.8 | Very high | 96.4 | Very high | 98 Ų | 98 | 102.1 Ų | 102.1 | 51% | 0.513 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.1 | -47.4 | 174.4 | -171.3 | 145.6 | 0 | 0 | 0 | 111.2 | E414 K415 L420 Q421 E422 | E414-L418 PolarHBondContact O-N 3.39Å; K415-L418 PolarHBondContact O-N 3.39Å; L418-L420 VanDerWaalsContact C-N 3.29Å; L418-L420 PolarHBondContact O-N 2.91Å; L418-Q421 WeakPolarHBondContact O-CB 3.34Å; L418-Q421 PolarHBondContact O-N 2.75Å; L418-E422 HydrophobicContact CD2-CG 3.97Å; L418-E422 WeakPolarHBondContact O-CG 3.49Å; L418-E422 PolarHBondContact O-N 2.99Å |
| 419 | E | 97.4 | Very high | 96.3 | Very high | 84 Ų | 84 | 104.6 Ų | 104.6 | 39% | 0.393 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -57.9 | -39.7 | 175.7 | -73.7 | 170.8 | 170.5 | 0 | 0 | 112 | K415 L416 E422 A423 | K415-E419 VanDerWaalsContact CE-OE1 3.29Å; K415-E419 WeakPolarHBondContact CE-OE1 3.31Å; K415-E419 IonicContact NZ-OE1 2.67Å; K415-E419 PolarHBondContact NZ-OE1 3.16Å; K415-E419 IonicContact NZ-OE2 2.8Å; K415-E419 PolarHBondContact NZ-OE2 2.96Å; K415-E419 WeakPolarHBondContact O-CG 3.19Å; K415-E419 PolarHBondContact O-N 3.05Å; L416-E419 PolarHBondContact O-N 3.11Å; E419-E422 PolarHBondContact O-N 2.97Å; E419-A423 PolarHBondContact O-N 3.45Å |
| 420 | L | 96.3 | Very high | 96.1 | Very high | 112 Ų | 112 | 101.8 Ų | 101.8 | 59% | 0.586 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.9 | -43.3 | 172.7 | 179.4 | 61.8 | 0 | 0 | 0 | 112.4 | L416 L418 E422 A423 V424 | L416-L420 WeakPolarHBondContact O-CB 3.38Å; L416-L420 PolarHBondContact O-N 2.85Å; L418-L420 VanDerWaalsContact C-N 3.29Å; L418-L420 PolarHBondContact O-N 2.91Å; L420-E422 VanDerWaalsContact C-N 3.27Å; L420-E422 PolarHBondContact O-N 2.9Å; L420-A423 PolarHBondContact O-N 3.27Å; L420-V424 HydrophobicContact CD1-CG2 4.32Å; L420-V424 WeakPolarHBondContact O-CB 3.26Å; L420-V424 VanDerWaalsContact O-CG2 3.3Å; L420-V424 WeakPolarHBondContact O-CG2 3.35Å; L420-V424 PolarHBondContact O-N 2.97Å |
| 421 | Q | 96.9 | Very high | 96.1 | Very high | 117 Ų | 117 | 102.5 Ų | 102.5 | 55% | 0.547 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.9 | -30.3 | 175.1 | -76.4 | -171.3 | -2.7 | 0 | 0 | 112.8 | Q417 L418 R425 | Q417-Q421 WeakPolarHBondContact O-CG 3.47Å; Q417-Q421 PolarHBondContact O-N 3.32Å; Q417-Q421 VanDerWaalsContact O-N 3.08Å; L418-Q421 WeakPolarHBondContact O-CB 3.34Å; L418-Q421 PolarHBondContact O-N 2.75Å; Q421-R425 VanDerWaalsContact O-CB 3.31Å; Q421-R425 WeakPolarHBondContact O-CB 3.35Å; Q421-R425 PolarHBondContact O-N 3.33Å |
| 422 | E | 97.4 | Very high | 95.9 | Very high | 92 Ų | 92 | 105.4 Ų | 105.4 | 43% | 0.43 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -71.2 | -47.3 | 175.2 | -51 | -127.1 | 98.6 | 0 | 0 | 110.9 | L418 E419 L420 V424 R425 E426 | L418-E422 HydrophobicContact CD2-CG 3.97Å; L418-E422 WeakPolarHBondContact O-CG 3.49Å; L418-E422 PolarHBondContact O-N 2.99Å; E419-E422 PolarHBondContact O-N 2.97Å; L420-E422 VanDerWaalsContact C-N 3.27Å; L420-E422 PolarHBondContact O-N 2.9Å; E422-V424 PolarHBondContact O-N 2.95Å; E422-R425 WeakPolarHBondContact O-CB 3.46Å; E422-R425 PolarHBondContact O-N 3.17Å; E422-R425 IonicContact OE1-CZ 3.94Å; E422-R425 IonicContact OE1-NH1 3.41Å; E422-R425 PolarHBondContact OE1-NH1 2.95Å; E422-R425 IonicContact OE1-NH2 3.27Å; E422-R425 PolarHBondContact OE1-NH2 3.28Å; E422-E426 PolarHBondContact O-N 2.91Å |
| 423 | A | 94.9 | Very high | 95.6 | Very high | 56 Ų | 56 | 103.8 Ų | 103.8 | 46% | 0.463 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.6 | -39.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | E419 L420 E426 S427 | E419-A423 PolarHBondContact O-N 3.45Å; L420-A423 PolarHBondContact O-N 3.27Å; A423-E426 PolarHBondContact O-N 3.43Å; A423-S427 VanDerWaalsContact O-CB 3.3Å; A423-S427 WeakPolarHBondContact O-CB 3.26Å; A423-S427 PolarHBondContact O-N 3.04Å |
| 424 | V | 97 | Very high | 95.1 | Very high | 73 Ų | 73 | 104.3 Ų | 104.3 | 44% | 0.442 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62 | -46.4 | 173.4 | 168.1 | 0 | 0 | 0 | 0 | 110.8 | L420 E422 E426 S427 E428 | L420-V424 HydrophobicContact CD1-CG2 4.32Å; L420-V424 WeakPolarHBondContact O-CB 3.26Å; L420-V424 VanDerWaalsContact O-CG2 3.3Å; L420-V424 WeakPolarHBondContact O-CG2 3.35Å; L420-V424 PolarHBondContact O-N 2.97Å; E422-V424 PolarHBondContact O-N 2.95Å; V424-E426 PolarHBondContact O-N 2.8Å; V424-S427 WeakPolarHBondContact O-CB 3.35Å; V424-S427 PolarHBondContact O-N 2.91Å; V424-E428 WeakPolarHBondContact O-CG 3.38Å; V424-E428 PolarHBondContact O-N 3.41Å |
| 425 | R | 96.3 | Very high | 94.7 | Very high | 130 Ų | 130 | 107.8 Ų | 107.8 | 49% | 0.491 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64 | -37.9 | 179.9 | -166 | -164.5 | -43.9 | 126 | 4.1 | 112.6 | Q421 E422 K429 | Q421-R425 VanDerWaalsContact O-CB 3.31Å; Q421-R425 WeakPolarHBondContact O-CB 3.35Å; Q421-R425 PolarHBondContact O-N 3.33Å; E422-R425 WeakPolarHBondContact O-CB 3.46Å; E422-R425 PolarHBondContact O-N 3.17Å; E422-R425 IonicContact OE1-CZ 3.94Å; E422-R425 IonicContact OE1-NH1 3.41Å; E422-R425 PolarHBondContact OE1-NH1 2.95Å; E422-R425 IonicContact OE1-NH2 3.27Å; E422-R425 PolarHBondContact OE1-NH2 3.28Å; R425-K429 WeakPolarHBondContact O-CB 3.4Å; R425-K429 PolarHBondContact O-N 3.24Å |
| 426 | E | 96.7 | Very high | 94.3 | Very high | 118 Ų | 118 | 107.5 Ų | 107.5 | 55% | 0.551 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -69.5 | -41 | 173.8 | -177.5 | 160.4 | -137.3 | 0 | 0 | 111.8 | E422 A423 V424 E428 K429 L430 | E422-E426 PolarHBondContact O-N 2.91Å; A423-E426 PolarHBondContact O-N 3.43Å; V424-E426 PolarHBondContact O-N 2.8Å; E426-E428 PolarHBondContact O-N 2.67Å; E426-K429 WeakPolarHBondContact O-CB 3.49Å; E426-K429 PolarHBondContact O-N 2.81Å; E426-L430 HydrophobicContact CG-CD1 4.03Å; E426-L430 HydrophobicContact CG-CG 4.38Å; E426-L430 WeakPolarHBondContact O-CG 3.35Å; E426-L430 PolarHBondContact O-N 3.5Å |
| 427 | S | 90.8 | Very high | 93.9 | Very high | 75 Ų | 75 | 107.8 Ų | 107.8 | 52% | 0.524 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.9 | -43.9 | 173.2 | -175.8 | 0 | 0 | 0 | 0 | 112.1 | A423 V424 L430 K431 | A423-S427 VanDerWaalsContact O-CB 3.3Å; A423-S427 WeakPolarHBondContact O-CB 3.26Å; A423-S427 PolarHBondContact O-N 3.04Å; V424-S427 WeakPolarHBondContact O-CB 3.35Å; V424-S427 PolarHBondContact O-N 2.91Å; S427-L430 PolarHBondContact O-N 2.84Å; S427-K431 WeakPolarHBondContact O-CB 3.05Å; S427-K431 PolarHBondContact O-N 3.43Å |
| 428 | E | 95.2 | Very high | 93.4 | Very high | 120 Ų | 120 | 105.5 Ų | 105.5 | 56% | 0.561 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.4 | -41.5 | 174.3 | -73.7 | -172.1 | 144.5 | 0 | 0 | 112.7 | V424 E426 K431 M432 | V424-E428 WeakPolarHBondContact O-CG 3.38Å; V424-E428 PolarHBondContact O-N 3.41Å; E426-E428 PolarHBondContact O-N 2.67Å; E428-K431 PolarHBondContact O-N 3.33Å; E428-M432 PolarHBondContact O-N 2.98Å |
| 429 | K | 95.3 | Very high | 92.9 | Very high | 126 Ų | 126 | 106.5 Ų | 106.5 | 55% | 0.548 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.8 | -53.2 | 174.7 | -177.4 | -160 | 163.7 | -159.2 | 0 | 111.1 | R425 E426 K431 M432 D433 | R425-K429 WeakPolarHBondContact O-CB 3.4Å; R425-K429 PolarHBondContact O-N 3.24Å; E426-K429 WeakPolarHBondContact O-CB 3.49Å; E426-K429 PolarHBondContact O-N 2.81Å; K429-K431 PolarHBondContact O-N 3.03Å; K429-M432 CarbonylContact O-C 3.58Å; K429-M432 WeakPolarHBondContact O-CA 3.24Å; K429-M432 WeakPolarHBondContact O-CB 3.35Å; K429-M432 PolarHBondContact O-N 2.94Å; K429-D433 WeakPolarHBondContact CE-OD2 3.4Å; K429-D433 PolarHBondContact O-N 3.29Å |
| 430 | L | 93.6 | Very high | 92.5 | Very high | 88 Ų | 88 | 107.6 Ų | 107.6 | 46% | 0.461 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.5 | -35.3 | 178.5 | -69.2 | 170.8 | 0 | 0 | 0 | 111.7 | E426 S427 M432 D433 L434 | E426-L430 HydrophobicContact CG-CD1 4.03Å; E426-L430 HydrophobicContact CG-CG 4.38Å; E426-L430 WeakPolarHBondContact O-CG 3.35Å; E426-L430 PolarHBondContact O-N 3.5Å; S427-L430 PolarHBondContact O-N 2.84Å; L430-M432 VanDerWaalsContact C-N 3.34Å; L430-D433 PolarHBondContact O-N 2.92Å; L430-L434 VanDerWaalsContact O-CB 3.31Å; L430-L434 WeakPolarHBondContact O-CB 3.5Å; L430-L434 VanDerWaalsContact O-CG 3.26Å; L430-L434 WeakPolarHBondContact O-CG 3.4Å; L430-L434 PolarHBondContact O-N 3.38Å |
| 431 | K | 94.9 | Very high | 92.2 | Very high | 128 Ų | 128 | 106 Ų | 106 | 56% | 0.557 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -69.3 | -25.8 | 173.7 | -175.9 | 178.9 | -177.7 | 179.7 | 0 | 113.4 | S427 E428 K429 R435 | S427-K431 WeakPolarHBondContact O-CB 3.05Å; S427-K431 PolarHBondContact O-N 3.43Å; E428-K431 PolarHBondContact O-N 3.33Å; K429-K431 PolarHBondContact O-N 3.03Å; K431-R435 WeakPolarHBondContact O-CD 3.44Å; K431-R435 VanDerWaalsContact O-CG 3.3Å; K431-R435 WeakPolarHBondContact O-CG 3.46Å |
| 432 | M | 92.5 | Very high | 91.9 | Very high | 116 Ų | 116 | 103.6 Ų | 103.6 | 57% | 0.571 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -78.5 | -42 | 167.7 | -76.2 | -140.1 | 65.7 | 0 | 0 | 112.1 | E428 K429 L430 R435 N436 | E428-M432 PolarHBondContact O-N 2.98Å; K429-M432 CarbonylContact O-C 3.58Å; K429-M432 WeakPolarHBondContact O-CA 3.24Å; K429-M432 WeakPolarHBondContact O-CB 3.35Å; K429-M432 PolarHBondContact O-N 2.94Å; L430-M432 VanDerWaalsContact C-N 3.34Å; M432-R435 WeakPolarHBondContact O-CB 3.26Å; M432-R435 PolarHBondContact O-N 3.34Å; M432-R435 VanDerWaalsContact O-N 3.11Å; M432-N436 PolarHBondContact O-N 2.88Å; M432-N436 PolarHBondContact O-ND2 3.14Å |
| 433 | D | 89.7 | Confident | 91.7 | Very high | 82 Ų | 82 | 102.3 Ų | 102.3 | 44% | 0.439 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -45.3 | 178.5 | -64.4 | -25.3 | 0 | 0 | 0 | 110.5 | K429 L430 R435 N436 I437 | K429-D433 WeakPolarHBondContact CE-OD2 3.4Å; K429-D433 PolarHBondContact O-N 3.29Å; L430-D433 PolarHBondContact O-N 2.92Å; D433-R435 PolarHBondContact O-N 3.47Å; D433-N436 CarbonylContact O-C 3.53Å; D433-N436 PolarHBondContact O-N 3.27Å; D433-I437 PolarHBondContact O-N 2.99Å |
| 434 | L | 87.1 | Confident | 91.6 | Very high | 129 Ų | 129 | 106.3 Ų | 106.3 | 68% | 0.675 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.8 | -19.5 | 173.7 | -73.9 | 170.4 | 0 | 0 | 0 | 114.5 | L430 | L430-L434 VanDerWaalsContact O-CB 3.31Å; L430-L434 WeakPolarHBondContact O-CB 3.5Å; L430-L434 VanDerWaalsContact O-CG 3.26Å; L430-L434 WeakPolarHBondContact O-CG 3.4Å; L430-L434 PolarHBondContact O-N 3.38Å |
| 435 | R | 88.4 | Confident | 91.5 | Very high | 194 Ų | 194 | 105.4 Ų | 105.4 | 73% | 0.732 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.1 | -16.8 | 173.2 | -80.9 | 176.3 | 171.3 | -165.8 | -3.2 | 113.1 | K431 M432 D433 | K431-R435 WeakPolarHBondContact O-CD 3.44Å; K431-R435 VanDerWaalsContact O-CG 3.3Å; K431-R435 WeakPolarHBondContact O-CG 3.46Å; M432-R435 WeakPolarHBondContact O-CB 3.26Å; M432-R435 PolarHBondContact O-N 3.34Å; M432-R435 VanDerWaalsContact O-N 3.11Å; D433-R435 PolarHBondContact O-N 3.47Å |
| 436 | N | 88.8 | Confident | 91.3 | Very high | 109 Ų | 109 | 103.8 Ų | 103.8 | 58% | 0.583 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -127.8 | 43.6 | -172.5 | -60.8 | -76.6 | 0 | 0 | 0 | 111.2 | M432 D433 P438 | M432-N436 PolarHBondContact O-N 2.88Å; M432-N436 PolarHBondContact O-ND2 3.14Å; D433-N436 CarbonylContact O-C 3.53Å; D433-N436 PolarHBondContact O-N 3.27Å; N436-P438 WeakPolarHBondContact O-CD 3.33Å |
| 437 | I | 87.9 | Confident | 91.2 | Very high | 96 Ų | 96 | 105.5 Ų | 105.5 | 49% | 0.492 | 53% | 0.534 | S | S | . | . | trans | -58.7 | 123.5 | 179.8 | -57.6 | 174.1 | 0 | 0 | 0 | 109.5 | D433 V441 V442 | D433-I437 PolarHBondContact O-N 2.99Å; I437-V441 HydrophobicContact CG2-CB 4.16Å; I437-V441 HydrophobicContact CG2-CG1 4.29Å; I437-V442 HydrophobicContact CG2-CG2 4.09Å | ||
| 438 | P | 87.3 | Confident | 91.5 | Very high | 72 Ų | 72 | 106 Ų | 106 | 47% | 0.468 | 53% | 0.525 | S | S | . | . | trans | -62.8 | 146.2 | 178.6 | -23.6 | 34.2 | 0 | 0 | 0 | 112.9 | N436 E440 V441 V442 | N436-P438 WeakPolarHBondContact O-CD 3.33Å; P438-E440 PolarHBondContact O-N 3.26Å; P438-V441 HydrophobicContact CB-CG2 4.28Å; P438-V441 HydrophobicContact CG-CG2 4.35Å; P438-V441 PolarHBondContact O-N 2.9Å; P438-V441 VanDerWaalsContact O-N 3.13Å; P438-V442 PolarHBondContact O-N 2.91Å | ||
| 439 | E | 85.9 | Confident | 91.6 | Very high | 119 Ų | 119 | 105.3 Ų | 105.3 | 56% | 0.556 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.2 | -29 | -178.8 | -150.6 | -158 | 156.4 | 0 | 0 | 111.7 | V442 K443 | E439-V442 WeakPolarHBondContact O-CB 3.32Å; E439-V442 PolarHBondContact O-N 3.02Å; E439-K443 WeakPolarHBondContact O-CD 3.43Å; E439-K443 VanDerWaalsContact O-CG 3.23Å; E439-K443 WeakPolarHBondContact O-CG 3.42Å; E439-K443 PolarHBondContact O-N 3.5Å; E439-K443 WeakPolarHBondContact OE1-CE 3.32Å; E439-K443 IonicContact OE1-NZ 2.78Å; E439-K443 PolarHBondContact OE1-NZ 3.22Å; E439-K443 WeakPolarHBondContact OE2-CE 3.34Å; E439-K443 IonicContact OE2-NZ 3.67Å; E439-K443 PolarHBondContact OE2-NZ 3.38Å |
| 440 | E | 90.2 | Very high | 91.7 | Very high | 108 Ų | 108 | 102.7 Ų | 102.7 | 51% | 0.505 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.2 | -43.3 | 176.8 | -71.2 | 53.7 | -116.7 | 0 | 0 | 111.5 | P438 V442 K443 E444 | P438-E440 PolarHBondContact O-N 3.26Å; E440-V442 VanDerWaalsContact C-N 3.31Å; E440-V442 PolarHBondContact O-N 3.44Å; E440-K443 PolarHBondContact O-N 3.14Å; E440-K443 IonicContact OE1-NZ 2.87Å; E440-K443 PolarHBondContact OE1-NZ 3.2Å; E440-E444 WeakPolarHBondContact O-CG 3.45Å; E440-E444 PolarHBondContact O-N 3.13Å |
| 441 | V | 89.9 | Confident | 91.9 | Very high | 79 Ų | 79 | 103.8 Ų | 103.8 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.8 | -39.3 | 176.5 | -178.9 | 0 | 0 | 0 | 0 | 110.3 | I437 P438 E444 T445 | I437-V441 HydrophobicContact CG2-CB 4.16Å; I437-V441 HydrophobicContact CG2-CG1 4.29Å; P438-V441 HydrophobicContact CB-CG2 4.28Å; P438-V441 HydrophobicContact CG-CG2 4.35Å; P438-V441 PolarHBondContact O-N 2.9Å; P438-V441 VanDerWaalsContact O-N 3.13Å; V441-E444 PolarHBondContact O-N 3.43Å; V441-T445 PolarHBondContact O-N 3.24Å |
| 442 | V | 90.1 | Very high | 92 | Very high | 66 Ų | 66 | 102.7 Ų | 102.7 | 40% | 0.4 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.6 | -45.4 | 175.3 | -177.6 | 0 | 0 | 0 | 0 | 110.9 | I437 P438 E439 E440 E444 T445 Y448 | I437-V442 HydrophobicContact CG2-CG2 4.09Å; P438-V442 PolarHBondContact O-N 2.91Å; E439-V442 WeakPolarHBondContact O-CB 3.32Å; E439-V442 PolarHBondContact O-N 3.02Å; E440-V442 VanDerWaalsContact C-N 3.31Å; E440-V442 PolarHBondContact O-N 3.44Å; V442-E444 PolarHBondContact O-N 3.03Å; V442-T445 WeakPolarHBondContact O-CB 3.5Å; V442-T445 WeakPolarHBondContact O-CG2 3.47Å; V442-T445 PolarHBondContact O-N 3.35Å; V442-T445 VanDerWaalsContact O-N 3.13Å; V442-T445 PolarHBondContact O-OG1 3.44Å; V442-Y448 HydrophobicContact CG1-CD2 4.39Å; V442-Y448 WeakPolarHBondContact O-CB 3.28Å |
| 443 | K | 92.6 | Very high | 92.2 | Very high | 64 Ų | 64 | 100.5 Ų | 100.5 | 28% | 0.278 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.6 | -28.6 | 175.9 | -70.1 | 160.2 | -168.1 | 158.1 | 0 | 112.8 | E439 E440 Y448 K449 | E439-K443 WeakPolarHBondContact O-CD 3.43Å; E439-K443 VanDerWaalsContact O-CG 3.23Å; E439-K443 WeakPolarHBondContact O-CG 3.42Å; E439-K443 PolarHBondContact O-N 3.5Å; E439-K443 WeakPolarHBondContact OE1-CE 3.32Å; E439-K443 IonicContact OE1-NZ 2.78Å; E439-K443 PolarHBondContact OE1-NZ 3.22Å; E439-K443 WeakPolarHBondContact OE2-CE 3.34Å; E439-K443 IonicContact OE2-NZ 3.67Å; E439-K443 PolarHBondContact OE2-NZ 3.38Å; E440-K443 PolarHBondContact O-N 3.14Å; E440-K443 IonicContact OE1-NZ 2.87Å; E440-K443 PolarHBondContact OE1-NZ 3.2Å; K443-Y448 HydrophobicContact CB-CD1 4.28Å; K443-Y448 HydrophobicContact CB-CE1 4.2Å; K443-Y448 HydrophobicContact CG-CD1 4.43Å; K443-Y448 HydrophobicContact CG-CE1 3.96Å; K443-Y448 HydrophobicContact CG-CE2 4.35Å; K443-K449 WeakPolarHBondContact O-CE 3.47Å |
| 444 | E | 93.3 | Very high | 92.6 | Very high | 141 Ų | 141 | 101.4 Ų | 101.4 | 66% | 0.659 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -77.4 | -17 | 177.1 | -78.3 | -175.8 | -175 | 0 | 0 | 114.2 | E440 V441 V442 K449 | E440-E444 WeakPolarHBondContact O-CG 3.45Å; E440-E444 PolarHBondContact O-N 3.13Å; V441-E444 PolarHBondContact O-N 3.43Å; V442-E444 PolarHBondContact O-N 3.03Å; E444-K449 WeakPolarHBondContact O-CE 3.35Å; E444-K449 PolarHBondContact O-NZ 2.94Å |
| 445 | T | 94.3 | Very high | 93.1 | Very high | 54 Ų | 54 | 101.8 Ų | 101.8 | 33% | 0.331 | 51% | 0.513 | S | S | . | . | S | Bend | trans | -61.1 | 147.9 | 177.5 | 65.9 | 0 | 0 | 0 | 0 | 113.1 | V441 V442 E447 Y448 K449 | V441-T445 PolarHBondContact O-N 3.24Å; V442-T445 WeakPolarHBondContact O-CB 3.5Å; V442-T445 WeakPolarHBondContact O-CG2 3.47Å; V442-T445 PolarHBondContact O-N 3.35Å; V442-T445 VanDerWaalsContact O-N 3.13Å; V442-T445 PolarHBondContact O-OG1 3.44Å; T445-E447 VanDerWaalsContact C-N 3.25Å; T445-E447 PolarHBondContact O-N 3.22Å; T445-Y448 WeakPolarHBondContact OG1-CB 3.45Å; T445-Y448 PolarHBondContact OG1-N 3.11Å; T445-Y448 VanDerWaalsContact OG1-N 3.07Å; T445-K449 WeakPolarHBondContact O-CD 3.37Å; T445-K449 WeakPolarHBondContact O-CG 3.4Å; T445-K449 PolarHBondContact O-N 2.93Å; T445-K449 VanDerWaalsContact O-N 3.15Å |
| 446 | S | 93.3 | Very high | 93.6 | Very high | 95 Ų | 95 | 95.1 Ų | 95.1 | 66% | 0.664 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.1 | -35.9 | 171.1 | 46.8 | 0 | 0 | 0 | 0 | 112 | K449 C450 | S446-K449 PolarHBondContact O-N 2.93Å; S446-C450 WeakPolarHBondContact O-CB 3.43Å; S446-C450 PolarHBondContact O-N 2.98Å |
| 447 | E | 95.1 | Very high | 94 | Very high | 155 Ų | 155 | 94.8 Ų | 94.8 | 72% | 0.724 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.6 | -50.6 | 177.8 | -63.6 | 176.6 | -176.4 | 0 | 0 | 111.7 | T445 K449 C450 L451 | T445-E447 VanDerWaalsContact C-N 3.25Å; T445-E447 PolarHBondContact O-N 3.22Å; E447-K449 PolarHBondContact O-N 3.2Å; E447-C450 PolarHBondContact O-N 2.9Å; E447-L451 WeakPolarHBondContact O-CB 3.5Å; E447-L451 PolarHBondContact O-N 3.34Å |
| 448 | Y | 96.6 | Very high | 94.5 | Very high | 85 Ų | 85 | 95.4 Ų | 95.4 | 33% | 0.333 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61 | -46.1 | 176.2 | -177.3 | -85 | 0 | 0 | 0 | 111.5 | V442 K443 T445 C450 L451 Q452 | V442-Y448 HydrophobicContact CG1-CD2 4.39Å; V442-Y448 WeakPolarHBondContact O-CB 3.28Å; K443-Y448 HydrophobicContact CB-CD1 4.28Å; K443-Y448 HydrophobicContact CB-CE1 4.2Å; K443-Y448 HydrophobicContact CG-CD1 4.43Å; K443-Y448 HydrophobicContact CG-CE1 3.96Å; K443-Y448 HydrophobicContact CG-CE2 4.35Å; T445-Y448 WeakPolarHBondContact OG1-CB 3.45Å; T445-Y448 PolarHBondContact OG1-N 3.11Å; T445-Y448 VanDerWaalsContact OG1-N 3.07Å; Y448-C450 VanDerWaalsContact C-N 3.31Å; Y448-C450 PolarHBondContact O-N 3.25Å; Y448-L451 PolarHBondContact O-N 2.89Å; Y448-Q452 HydrophobicContact CE1-CB 4.4Å; Y448-Q452 VanDerWaalsContact O-CB 3.28Å; Y448-Q452 WeakPolarHBondContact O-CB 3.27Å; Y448-Q452 PolarHBondContact O-N 3.37Å |
| 449 | K | 96.8 | Very high | 95 | Very high | 106 Ų | 106 | 98.7 Ų | 98.7 | 46% | 0.461 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.2 | -38.3 | 178.3 | -71.2 | 165.2 | 179.4 | 164.6 | 0 | 112.1 | K443 E444 T445 S446 E447 S453 | K443-K449 WeakPolarHBondContact O-CE 3.47Å; E444-K449 WeakPolarHBondContact O-CE 3.35Å; E444-K449 PolarHBondContact O-NZ 2.94Å; T445-K449 WeakPolarHBondContact O-CD 3.37Å; T445-K449 WeakPolarHBondContact O-CG 3.4Å; T445-K449 PolarHBondContact O-N 2.93Å; T445-K449 VanDerWaalsContact O-N 3.15Å; S446-K449 PolarHBondContact O-N 2.93Å; E447-K449 PolarHBondContact O-N 3.2Å; K449-S453 WeakPolarHBondContact O-CB 3.43Å; K449-S453 PolarHBondContact O-N 3.47Å |
| 450 | C | 97.1 | Very high | 95.6 | Very high | 70 Ų | 70 | 97.8 Ų | 97.8 | 47% | 0.473 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.1 | -44.4 | 174.5 | -172.1 | 0 | 0 | 0 | 0 | 111.7 | S446 E447 Y448 S453 Q454 | S446-C450 WeakPolarHBondContact O-CB 3.43Å; S446-C450 PolarHBondContact O-N 2.98Å; E447-C450 PolarHBondContact O-N 2.9Å; Y448-C450 VanDerWaalsContact C-N 3.31Å; Y448-C450 PolarHBondContact O-N 3.25Å; C450-S453 PolarHBondContact O-N 2.82Å; C450-Q454 WeakPolarHBondContact O-CG 3.47Å; C450-Q454 PolarHBondContact O-N 2.84Å; C450-Q454 PolarHBondContact O-NE2 3.35Å; C450-Q454 PolarHBondContact SG-NE2 2.87Å |
| 451 | L | 97.6 | Very high | 95.9 | Very high | 111 Ų | 111 | 98.2 Ų | 98.2 | 58% | 0.581 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -67.2 | -38.4 | 177.2 | -175.2 | 62.5 | 0 | 0 | 0 | 112.2 | E447 Y448 S453 Q454 F455 | E447-L451 WeakPolarHBondContact O-CB 3.5Å; E447-L451 PolarHBondContact O-N 3.34Å; Y448-L451 PolarHBondContact O-N 2.89Å; L451-S453 VanDerWaalsContact C-N 3.34Å; L451-Q454 PolarHBondContact O-N 3.38Å; L451-F455 WeakPolarHBondContact O-CB 3.36Å; L451-F455 PolarHBondContact O-N 2.95Å |
| 452 | Q | 97.1 | Very high | 96.3 | Very high | 106 Ų | 106 | 98.3 Ų | 98.3 | 50% | 0.495 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.4 | -42.3 | 173.3 | -174.6 | -177.8 | 25.9 | 0 | 0 | 111.2 | Y448 S456 | Y448-Q452 HydrophobicContact CE1-CB 4.4Å; Y448-Q452 VanDerWaalsContact O-CB 3.28Å; Y448-Q452 WeakPolarHBondContact O-CB 3.27Å; Y448-Q452 PolarHBondContact O-N 3.37Å; Q452-S456 WeakPolarHBondContact O-CB 3.5Å; Q452-S456 PolarHBondContact O-N 2.97Å; Q452-S456 PolarHBondContact O-OG 3.3Å |
| 453 | S | 97.5 | Very high | 96.7 | Very high | 69 Ų | 69 | 99.2 Ų | 99.2 | 48% | 0.483 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.9 | -48.9 | 174.5 | -170.7 | 0 | 0 | 0 | 0 | 111.7 | K449 C450 L451 F455 S456 L457 | K449-S453 WeakPolarHBondContact O-CB 3.43Å; K449-S453 PolarHBondContact O-N 3.47Å; C450-S453 PolarHBondContact O-N 2.82Å; L451-S453 VanDerWaalsContact C-N 3.34Å; S453-F455 PolarHBondContact O-N 2.99Å; S453-S456 WeakPolarHBondContact O-CB 3.44Å; S453-S456 PolarHBondContact O-N 3.08Å; S453-S456 VanDerWaalsContact O-N 3.11Å; S453-L457 PolarHBondContact O-N 3.3Å |
| 454 | Q | 97.4 | Very high | 96.9 | Very high | 101 Ų | 101 | 97.7 Ų | 97.7 | 47% | 0.472 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.3 | -46.1 | 176.2 | -74 | 170.8 | 74.5 | 0 | 0 | 112.6 | C450 L451 S456 L457 L458 | C450-Q454 WeakPolarHBondContact O-CG 3.47Å; C450-Q454 PolarHBondContact O-N 2.84Å; C450-Q454 PolarHBondContact O-NE2 3.35Å; C450-Q454 PolarHBondContact SG-NE2 2.87Å; L451-Q454 PolarHBondContact O-N 3.38Å; Q454-S456 VanDerWaalsContact C-N 3.3Å; Q454-S456 PolarHBondContact O-N 2.82Å; Q454-L457 PolarHBondContact O-N 2.77Å; Q454-L458 WeakPolarHBondContact O-CG 3.19Å; Q454-L458 PolarHBondContact O-N 2.85Å |
| 455 | F | 98.2 | Very high | 97.1 | Very high | 138 Ų | 138 | 95.4 Ų | 95.4 | 61% | 0.605 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.5 | -40.4 | 175 | 180 | -93.7 | 0 | 0 | 0 | 111.8 | L451 S453 L458 Y459 | L451-F455 WeakPolarHBondContact O-CB 3.36Å; L451-F455 PolarHBondContact O-N 2.95Å; S453-F455 PolarHBondContact O-N 2.99Å; F455-L458 PolarHBondContact O-N 3.39Å; F455-Y459 WeakPolarHBondContact O-CB 3.21Å; F455-Y459 PolarHBondContact O-N 3.05Å |
| 456 | S | 98.1 | Very high | 97.3 | Very high | 54 Ų | 54 | 98.7 Ų | 98.7 | 38% | 0.378 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.8 | -38.8 | 177.9 | -57.8 | 0 | 0 | 0 | 0 | 112.2 | Q452 S453 Q454 N460 | Q452-S456 WeakPolarHBondContact O-CB 3.5Å; Q452-S456 PolarHBondContact O-N 2.97Å; Q452-S456 PolarHBondContact O-OG 3.3Å; S453-S456 WeakPolarHBondContact O-CB 3.44Å; S453-S456 PolarHBondContact O-N 3.08Å; S453-S456 VanDerWaalsContact O-N 3.11Å; Q454-S456 VanDerWaalsContact C-N 3.3Å; Q454-S456 PolarHBondContact O-N 2.82Å; S456-N460 PolarHBondContact O-N 2.86Å; S456-N460 PolarHBondContact O-ND2 3.29Å |
| 457 | L | 98 | Very high | 97.5 | Very high | 101 Ų | 101 | 97.4 Ų | 97.4 | 53% | 0.529 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.3 | -55.9 | 173.7 | -68.2 | 170.4 | 0 | 0 | 0 | 110.9 | S453 Q454 Y459 N460 E461 | S453-L457 PolarHBondContact O-N 3.3Å; Q454-L457 PolarHBondContact O-N 2.77Å; L457-Y459 PolarHBondContact O-N 3.48Å; L457-N460 PolarHBondContact O-N 3.18Å; L457-E461 WeakPolarHBondContact O-CG 3.45Å; L457-E461 PolarHBondContact O-N 3.14Å |
| 458 | L | 97.9 | Very high | 97.6 | Very high | 110 Ų | 110 | 96 Ų | 96 | 58% | 0.576 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.2 | -35 | -179.5 | -69.5 | 170.2 | 0 | 0 | 0 | 113 | Q454 F455 S462 | Q454-L458 WeakPolarHBondContact O-CG 3.19Å; Q454-L458 PolarHBondContact O-N 2.85Å; F455-L458 PolarHBondContact O-N 3.39Å; L458-S462 WeakPolarHBondContact O-CB 3.28Å; L458-S462 PolarHBondContact O-N 3.5Å |
| 459 | Y | 98.4 | Very high | 97.7 | Very high | 140 Ų | 140 | 96 Ų | 96 | 55% | 0.549 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.3 | -45.1 | 175.3 | -179 | -95.7 | 0 | 0 | 0 | 112.1 | F455 L457 S462 L463 | F455-Y459 WeakPolarHBondContact O-CB 3.21Å; F455-Y459 PolarHBondContact O-N 3.05Å; L457-Y459 PolarHBondContact O-N 3.48Å; Y459-S462 PolarHBondContact O-N 3.38Å; Y459-L463 WeakPolarHBondContact O-CB 3.28Å; Y459-L463 PolarHBondContact O-N 3.27Å |
| 460 | N | 97.9 | Very high | 97.7 | Very high | 100 Ų | 100 | 94.3 Ų | 94.3 | 54% | 0.535 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.6 | -39.3 | 177.8 | -75.9 | -61 | 0 | 0 | 0 | 112.1 | S456 L457 L463 G464 | S456-N460 PolarHBondContact O-N 2.86Å; S456-N460 PolarHBondContact O-ND2 3.29Å; L457-N460 PolarHBondContact O-N 3.18Å; N460-L463 PolarHBondContact O-N 2.91Å; N460-G464 PolarHBondContact O-N 3.41Å |
| 461 | E | 97.5 | Very high | 97.8 | Very high | 117 Ų | 117 | 96.9 Ų | 96.9 | 55% | 0.547 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 172.9 | -71.5 | 172.1 | -178.1 | 0 | 0 | 111.5 | L457 L463 G464 V465 | L457-E461 WeakPolarHBondContact O-CG 3.45Å; L457-E461 PolarHBondContact O-N 3.14Å; E461-L463 VanDerWaalsContact C-N 3.3Å; E461-L463 PolarHBondContact O-N 3.15Å; E461-G464 PolarHBondContact O-N 3.27Å; E461-G464 VanDerWaalsContact O-N 3.17Å; E461-V465 WeakPolarHBondContact O-CG2 3.44Å; E461-V465 PolarHBondContact O-N 2.97Å |
| 462 | S | 96.8 | Very high | 97.8 | Very high | 82 Ų | 82 | 94.3 Ų | 94.3 | 57% | 0.573 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.3 | -39.3 | 176.6 | -173 | 0 | 0 | 0 | 0 | 112.3 | L458 Y459 K466 | L458-S462 WeakPolarHBondContact O-CB 3.28Å; L458-S462 PolarHBondContact O-N 3.5Å; Y459-S462 PolarHBondContact O-N 3.38Å; S462-K466 WeakPolarHBondContact O-CB 3.43Å; S462-K466 PolarHBondContact O-N 3.45Å |
| 463 | L | 98.2 | Very high | 97.8 | Very high | 84 Ų | 84 | 96.1 Ų | 96.1 | 44% | 0.44 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 174.7 | -172.6 | 63 | 0 | 0 | 0 | 111.9 | Y459 N460 E461 K466 T467 | Y459-L463 WeakPolarHBondContact O-CB 3.28Å; Y459-L463 PolarHBondContact O-N 3.27Å; N460-L463 PolarHBondContact O-N 2.91Å; E461-L463 VanDerWaalsContact C-N 3.3Å; E461-L463 PolarHBondContact O-N 3.15Å; L463-K466 PolarHBondContact O-N 3.37Å; L463-T467 PolarHBondContact O-N 2.96Å; L463-T467 PolarHBondContact O-OG1 2.86Å |
| 464 | G | 97.8 | Very high | 97.9 | Very high | 32 Ų | 32 | 95.4 Ų | 95.4 | 33% | 0.33 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.8 | -47.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | N460 E461 K466 T467 Q468 | N460-G464 PolarHBondContact O-N 3.41Å; E461-G464 PolarHBondContact O-N 3.27Å; E461-G464 VanDerWaalsContact O-N 3.17Å; G464-K466 VanDerWaalsContact C-N 3.27Å; G464-K466 PolarHBondContact O-N 3.03Å; G464-T467 PolarHBondContact O-N 3.38Å; G464-T467 VanDerWaalsContact O-N 3.17Å; G464-Q468 WeakPolarHBondContact O-CG 3.42Å; G464-Q468 PolarHBondContact O-N 3.36Å |
| 465 | V | 97.6 | Very high | 97.9 | Very high | 93 Ų | 93 | 96.1 Ų | 96.1 | 56% | 0.564 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.4 | -36.4 | 175.7 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | E461 L469 | E461-V465 WeakPolarHBondContact O-CG2 3.44Å; E461-V465 PolarHBondContact O-N 2.97Å; V465-L469 WeakPolarHBondContact O-CB 3.45Å; V465-L469 PolarHBondContact O-N 3.19Å |
| 466 | K | 98.1 | Very high | 97.8 | Very high | 124 Ų | 124 | 95.4 Ų | 95.4 | 54% | 0.539 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.4 | -45.4 | 173.8 | -177.4 | -179.4 | 170.2 | -175.7 | 0 | 112 | S462 L463 G464 L469 D470 | S462-K466 WeakPolarHBondContact O-CB 3.43Å; S462-K466 PolarHBondContact O-N 3.45Å; L463-K466 PolarHBondContact O-N 3.37Å; G464-K466 VanDerWaalsContact C-N 3.27Å; G464-K466 PolarHBondContact O-N 3.03Å; K466-L469 WeakPolarHBondContact O-CB 3.44Å; K466-L469 PolarHBondContact O-N 2.98Å; K466-D470 PolarHBondContact O-N 3.38Å |
| 467 | T | 98.4 | Very high | 97.8 | Very high | 68 Ų | 68 | 97.7 Ų | 97.7 | 42% | 0.417 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.3 | -47.9 | 177.2 | -57.7 | 0 | 0 | 0 | 0 | 111.1 | L463 G464 L469 D470 E471 | L463-T467 PolarHBondContact O-N 2.96Å; L463-T467 PolarHBondContact O-OG1 2.86Å; G464-T467 PolarHBondContact O-N 3.38Å; G464-T467 VanDerWaalsContact O-N 3.17Å; T467-L469 VanDerWaalsContact C-N 3.29Å; T467-L469 PolarHBondContact O-N 3.44Å; T467-D470 PolarHBondContact O-N 2.7Å; T467-D470 VanDerWaalsContact O-N 3.13Å; T467-E471 HydrophobicContact CG2-CG 4.45Å; T467-E471 WeakPolarHBondContact O-CG 3.33Å; T467-E471 PolarHBondContact O-N 2.94Å |
| 468 | Q | 97.4 | Very high | 97.8 | Very high | 125 Ų | 125 | 97.2 Ų | 97.2 | 58% | 0.584 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -58.7 | -38.6 | 176.4 | -69.2 | 174.4 | -2.8 | 0 | 0 | 112.8 | G464 A472 | G464-Q468 WeakPolarHBondContact O-CG 3.42Å; G464-Q468 PolarHBondContact O-N 3.36Å; Q468-A472 VanDerWaalsContact O-CB 3.29Å; Q468-A472 WeakPolarHBondContact O-CB 3.43Å; Q468-A472 PolarHBondContact O-N 3.41Å |
| 469 | L | 97.3 | Very high | 97.8 | Very high | 85 Ų | 85 | 95 Ų | 95 | 45% | 0.445 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.4 | -40.9 | 176.2 | 176.8 | 62.4 | 0 | 0 | 0 | 112.1 | V465 K466 T467 R473 | V465-L469 WeakPolarHBondContact O-CB 3.45Å; V465-L469 PolarHBondContact O-N 3.19Å; K466-L469 WeakPolarHBondContact O-CB 3.44Å; K466-L469 PolarHBondContact O-N 2.98Å; T467-L469 VanDerWaalsContact C-N 3.29Å; T467-L469 PolarHBondContact O-N 3.44Å; L469-R473 WeakPolarHBondContact O-CB 3.37Å; L469-R473 WeakPolarHBondContact O-CD 3.4Å; L469-R473 WeakPolarHBondContact O-CG 2.81Å; L469-R473 PolarHBondContact O-N 2.92Å |
| 470 | D | 98.3 | Very high | 97.8 | Very high | 70 Ų | 70 | 94.2 Ų | 94.2 | 37% | 0.374 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -74.6 | -32.9 | 179.2 | -71.5 | -29.2 | 0 | 0 | 0 | 112.1 | K466 T467 R473 A474 | K466-D470 PolarHBondContact O-N 3.38Å; T467-D470 PolarHBondContact O-N 2.7Å; T467-D470 VanDerWaalsContact O-N 3.13Å; D470-R473 PolarHBondContact O-N 3.28Å; D470-R473 WeakPolarHBondContact OD1-CD 3.49Å; D470-R473 IonicContact OD1-CZ 3.32Å; D470-R473 IonicContact OD1-NH1 2.75Å; D470-R473 PolarHBondContact OD1-NH1 3.38Å; D470-A474 PolarHBondContact O-N 2.86Å |
| 471 | E | 98 | Very high | 97.7 | Very high | 124 Ų | 124 | 92.4 Ų | 92.4 | 58% | 0.579 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.1 | -48.7 | 167.8 | -73.1 | 172.2 | 176.5 | 0 | 0 | 112 | T467 R473 A474 L475 | T467-E471 HydrophobicContact CG2-CG 4.45Å; T467-E471 WeakPolarHBondContact O-CG 3.33Å; T467-E471 PolarHBondContact O-N 2.94Å; E471-R473 VanDerWaalsContact C-N 3.28Å; E471-R473 PolarHBondContact O-N 3.11Å; E471-A474 PolarHBondContact O-N 2.88Å; E471-A474 VanDerWaalsContact O-N 3.11Å; E471-L475 PolarHBondContact O-N 2.95Å |
| 472 | A | 97.4 | Very high | 97.7 | Very high | 57 Ų | 57 | 89.2 Ų | 89.2 | 47% | 0.471 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.8 | -35.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q468 L476 | Q468-A472 VanDerWaalsContact O-CB 3.29Å; Q468-A472 WeakPolarHBondContact O-CB 3.43Å; Q468-A472 PolarHBondContact O-N 3.41Å; A472-L476 VanDerWaalsContact O-CB 3.31Å; A472-L476 WeakPolarHBondContact O-CB 3.38Å; A472-L476 PolarHBondContact O-N 3.08Å |
| 473 | R | 98.2 | Very high | 97.7 | Very high | 145 Ų | 145 | 90 Ų | 90 | 55% | 0.547 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 171.5 | -75.7 | 162.1 | 170.8 | 169.2 | -2.4 | 112 | L469 D470 E471 L476 L477 | L469-R473 WeakPolarHBondContact O-CB 3.37Å; L469-R473 WeakPolarHBondContact O-CD 3.4Å; L469-R473 WeakPolarHBondContact O-CG 2.81Å; L469-R473 PolarHBondContact O-N 2.92Å; D470-R473 PolarHBondContact O-N 3.28Å; D470-R473 WeakPolarHBondContact OD1-CD 3.49Å; D470-R473 IonicContact OD1-CZ 3.32Å; D470-R473 IonicContact OD1-NH1 2.75Å; D470-R473 PolarHBondContact OD1-NH1 3.38Å; E471-R473 VanDerWaalsContact C-N 3.28Å; E471-R473 PolarHBondContact O-N 3.11Å; R473-L476 PolarHBondContact O-N 3.48Å; R473-L477 WeakPolarHBondContact O-CB 3.41Å; R473-L477 PolarHBondContact O-N 3.24Å |
| 474 | A | 98.1 | Very high | 97.7 | Very high | 53 Ų | 53 | 89.5 Ų | 89.5 | 44% | 0.438 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.1 | -40.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | D470 E471 T478 | D470-A474 PolarHBondContact O-N 2.86Å; E471-A474 PolarHBondContact O-N 2.88Å; E471-A474 VanDerWaalsContact O-N 3.11Å; A474-T478 WeakPolarHBondContact O-CB 3.46Å; A474-T478 PolarHBondContact O-N 2.87Å; A474-T478 PolarHBondContact O-OG1 3.33Å |
| 475 | L | 97.9 | Very high | 97.7 | Very high | 116 Ų | 116 | 95.7 Ų | 95.7 | 61% | 0.607 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.9 | -50.4 | 174 | -177.2 | 62.1 | 0 | 0 | 0 | 111.2 | E471 L477 T478 T479 | E471-L475 PolarHBondContact O-N 2.95Å; L475-L477 VanDerWaalsContact C-N 3.31Å; L475-L477 PolarHBondContact O-N 3.48Å; L475-T478 WeakPolarHBondContact O-CA 3.37Å; L475-T478 WeakPolarHBondContact O-CB 3.42Å; L475-T478 PolarHBondContact O-N 3.14Å; L475-T479 PolarHBondContact O-N 2.89Å; L475-T479 PolarHBondContact O-OG1 3.42Å |
| 476 | L | 97.4 | Very high | 97.6 | Very high | 124 Ų | 124 | 96.4 Ų | 96.4 | 65% | 0.649 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.5 | -40.9 | 178.7 | -174.8 | 153.2 | 0 | 0 | 0 | 112.2 | A472 R473 T478 K480 | A472-L476 VanDerWaalsContact O-CB 3.31Å; A472-L476 WeakPolarHBondContact O-CB 3.38Å; A472-L476 PolarHBondContact O-N 3.08Å; R473-L476 PolarHBondContact O-N 3.48Å; L476-T478 VanDerWaalsContact C-N 3.34Å; L476-K480 WeakPolarHBondContact O-CB 3.44Å; L476-K480 PolarHBondContact O-N 2.86Å |
| 477 | L | 97.8 | Very high | 97.5 | Very high | 101 Ų | 101 | 94.2 Ų | 94.2 | 53% | 0.529 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.8 | -41.6 | 174.3 | -173.3 | 70.3 | 0 | 0 | 0 | 111.5 | R473 L475 N481 | R473-L477 WeakPolarHBondContact O-CB 3.41Å; R473-L477 PolarHBondContact O-N 3.24Å; L475-L477 VanDerWaalsContact C-N 3.31Å; L475-L477 PolarHBondContact O-N 3.48Å; L477-N481 WeakPolarHBondContact O-CB 3.34Å; L477-N481 PolarHBondContact O-N 2.9Å; L477-N481 PolarHBondContact O-ND2 3.26Å |
| 478 | T | 98.1 | Very high | 97.4 | Very high | 92 Ų | 92 | 96.8 Ų | 96.8 | 56% | 0.564 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.3 | -48.5 | 178.6 | -57.6 | 0 | 0 | 0 | 0 | 111.3 | A474 L475 L476 N481 A482 | A474-T478 WeakPolarHBondContact O-CB 3.46Å; A474-T478 PolarHBondContact O-N 2.87Å; A474-T478 PolarHBondContact O-OG1 3.33Å; L475-T478 WeakPolarHBondContact O-CA 3.37Å; L475-T478 WeakPolarHBondContact O-CB 3.42Å; L475-T478 PolarHBondContact O-N 3.14Å; L476-T478 VanDerWaalsContact C-N 3.34Å; T478-N481 PolarHBondContact O-N 3.37Å; T478-A482 PolarHBondContact O-N 3.45Å |
| 479 | T | 96.7 | Very high | 97.4 | Very high | 62 Ų | 62 | 96.7 Ų | 96.7 | 38% | 0.38 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63 | -41.9 | 177.5 | -57.2 | 0 | 0 | 0 | 0 | 111.8 | L475 N481 A482 H483 | L475-T479 PolarHBondContact O-N 2.89Å; L475-T479 PolarHBondContact O-OG1 3.42Å; T479-N481 VanDerWaalsContact C-N 3.34Å; T479-N481 PolarHBondContact O-N 3.49Å; T479-A482 PolarHBondContact O-N 3.39Å; T479-H483 WeakPolarHBondContact CG2-NE2 3.27Å; T479-H483 PolarHBondContact O-CD2 3.41Å; T479-H483 VanDerWaalsContact O-CD2 3.22Å; T479-H483 PolarHBondContact O-N 3.29Å |
| 480 | K | 98 | Very high | 97.3 | Very high | 125 Ų | 125 | 97.2 Ų | 97.2 | 54% | 0.543 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.9 | -47.6 | 172.2 | -179.7 | -174.3 | 173.8 | -174.9 | 0 | 111.5 | L476 A482 H483 L484 | L476-K480 WeakPolarHBondContact O-CB 3.44Å; L476-K480 PolarHBondContact O-N 2.86Å; K480-A482 VanDerWaalsContact C-N 3.29Å; K480-A482 PolarHBondContact O-N 3.16Å; K480-H483 PolarHBondContact O-N 3.46Å; K480-L484 HydrophobicContact CG-CD1 4.21Å; K480-L484 WeakPolarHBondContact O-CG 3.49Å; K480-L484 PolarHBondContact O-N 2.75Å |
| 481 | N | 97.3 | Very high | 97.1 | Very high | 61 Ų | 61 | 99.6 Ų | 99.6 | 33% | 0.326 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -69.5 | -26.8 | -179.4 | -67.8 | -17.5 | 0 | 0 | 0 | 112.6 | L477 T478 T479 R485 | L477-N481 WeakPolarHBondContact O-CB 3.34Å; L477-N481 PolarHBondContact O-N 2.9Å; L477-N481 PolarHBondContact O-ND2 3.26Å; T478-N481 PolarHBondContact O-N 3.37Å; T479-N481 VanDerWaalsContact C-N 3.34Å; T479-N481 PolarHBondContact O-N 3.49Å; N481-R485 WeakPolarHBondContact O-CG 3.38Å; N481-R485 PolarHBondContact O-N 2.77Å |
| 482 | A | 97.6 | Very high | 97 | Very high | 51 Ų | 51 | 95.2 Ų | 95.2 | 42% | 0.421 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70.2 | -47.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | T478 T479 K480 L484 R485 Q486 | T478-A482 PolarHBondContact O-N 3.45Å; T479-A482 PolarHBondContact O-N 3.39Å; K480-A482 VanDerWaalsContact C-N 3.29Å; K480-A482 PolarHBondContact O-N 3.16Å; A482-L484 VanDerWaalsContact C-N 3.35Å; A482-L484 PolarHBondContact O-N 3.2Å; A482-R485 PolarHBondContact O-N 3.37Å; A482-Q486 PolarHBondContact O-N 3.35Å |
| 483 | H | 97.1 | Very high | 96.9 | Very high | 98 Ų | 98 | 96.3 Ų | 96.3 | 45% | 0.454 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.3 | -35.9 | 176.6 | -68.6 | -52 | 0 | 0 | 0 | 113.1 | T479 K480 R485 Q486 I487 | T479-H483 WeakPolarHBondContact CG2-NE2 3.27Å; T479-H483 PolarHBondContact O-CD2 3.41Å; T479-H483 VanDerWaalsContact O-CD2 3.22Å; T479-H483 PolarHBondContact O-N 3.29Å; K480-H483 PolarHBondContact O-N 3.46Å; H483-R485 PolarHBondContact O-N 2.88Å; H483-Q486 PolarHBondContact ND1-OE1 3.15Å; H483-Q486 WeakPolarHBondContact O-CB 3.45Å; H483-Q486 PolarHBondContact O-N 3.05Å; H483-I487 WeakPolarHBondContact O-CG1 3.29Å; H483-I487 PolarHBondContact O-N 3.32Å |
| 484 | L | 97.3 | Very high | 96.6 | Very high | 74 Ų | 74 | 93.1 Ų | 93.1 | 39% | 0.387 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.8 | -46 | 173.8 | -76.5 | 170.2 | 0 | 0 | 0 | 111.6 | K480 A482 Q486 I487 E488 | K480-L484 HydrophobicContact CG-CD1 4.21Å; K480-L484 WeakPolarHBondContact O-CG 3.49Å; K480-L484 PolarHBondContact O-N 2.75Å; A482-L484 VanDerWaalsContact C-N 3.35Å; A482-L484 PolarHBondContact O-N 3.2Å; L484-Q486 VanDerWaalsContact C-N 3.28Å; L484-Q486 PolarHBondContact O-N 3.11Å; L484-I487 WeakPolarHBondContact O-CB 3.4Å; L484-I487 PolarHBondContact O-N 3.08Å; L484-I487 VanDerWaalsContact O-N 3.15Å; L484-E488 WeakPolarHBondContact O-CG 3.36Å; L484-E488 PolarHBondContact O-N 2.86Å |
| 485 | R | 97.3 | Very high | 96.4 | Very high | 162 Ų | 162 | 94.5 Ų | 94.5 | 61% | 0.611 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.5 | -31.4 | 174.8 | -67 | 176.4 | -164 | 132.7 | 0.4 | 113.5 | N481 A482 H483 E488 H489 | N481-R485 WeakPolarHBondContact O-CG 3.38Å; N481-R485 PolarHBondContact O-N 2.77Å; A482-R485 PolarHBondContact O-N 3.37Å; H483-R485 PolarHBondContact O-N 2.88Å; R485-E488 WeakPolarHBondContact CA-OE2 3.38Å; R485-H489 WeakPolarHBondContact O-CB 3.37Å; R485-H489 PolarHBondContact O-N 2.9Å |
| 486 | Q | 96.8 | Very high | 96.2 | Very high | 108 Ų | 108 | 94 Ų | 94 | 51% | 0.505 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -67.7 | -38.2 | 174.4 | -171.5 | -178.4 | 2.2 | 0 | 0 | 111.3 | A482 H483 L484 H489 M490 | A482-Q486 PolarHBondContact O-N 3.35Å; H483-Q486 PolarHBondContact ND1-OE1 3.15Å; H483-Q486 WeakPolarHBondContact O-CB 3.45Å; H483-Q486 PolarHBondContact O-N 3.05Å; L484-Q486 VanDerWaalsContact C-N 3.28Å; L484-Q486 PolarHBondContact O-N 3.11Å; Q486-H489 PolarHBondContact O-N 3.2Å; Q486-M490 WeakPolarHBondContact O-CG 3.32Å; Q486-M490 PolarHBondContact O-N 3.44Å; Q486-M490 VanDerWaalsContact O-N 3.08Å |
| 487 | I | 95.9 | Very high | 96.1 | Very high | 77 Ų | 77 | 95 Ų | 95 | 40% | 0.395 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.3 | -48.9 | 172.8 | -65.7 | 162.2 | 0 | 0 | 0 | 110.2 | H483 L484 H489 M490 E491 | H483-I487 WeakPolarHBondContact O-CG1 3.29Å; H483-I487 PolarHBondContact O-N 3.32Å; L484-I487 WeakPolarHBondContact O-CB 3.4Å; L484-I487 PolarHBondContact O-N 3.08Å; L484-I487 VanDerWaalsContact O-N 3.15Å; I487-H489 PolarHBondContact O-N 3.46Å; I487-M490 HydrophobicContact CG1-CE 4.21Å; I487-M490 PolarHBondContact O-N 2.9Å; I487-M490 VanDerWaalsContact O-N 3.11Å; I487-E491 HydrophobicContact CG2-CG 4.26Å; I487-E491 WeakPolarHBondContact O-CB 3.5Å; I487-E491 WeakPolarHBondContact O-CG 3.39Å; I487-E491 PolarHBondContact O-N 3.31Å |
| 488 | E | 96 | Very high | 95.8 | Very high | 122 Ų | 122 | 97.3 Ų | 97.3 | 57% | 0.57 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -54.1 | -37.1 | 175.4 | -69 | 164.5 | 175.2 | 0 | 0 | 112.1 | L484 R485 G492 | L484-E488 WeakPolarHBondContact O-CG 3.36Å; L484-E488 PolarHBondContact O-N 2.86Å; R485-E488 WeakPolarHBondContact CA-OE2 3.38Å; E488-G492 PolarHBondContact O-N 3.4Å; E488-G492 VanDerWaalsContact O-N 3.16Å |
| 489 | H | 96 | Very high | 95.6 | Very high | 124 Ų | 124 | 96.8 Ų | 96.8 | 57% | 0.574 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68.2 | -50.4 | 174.8 | -164.2 | -57.1 | 0 | 0 | 0 | 112.2 | R485 Q486 I487 E491 G492 D493 | R485-H489 WeakPolarHBondContact O-CB 3.37Å; R485-H489 PolarHBondContact O-N 2.9Å; Q486-H489 PolarHBondContact O-N 3.2Å; I487-H489 PolarHBondContact O-N 3.46Å; H489-E491 VanDerWaalsContact C-N 3.29Å; H489-E491 PolarHBondContact O-N 2.88Å; H489-G492 CarbonylContact O-C 3.51Å; H489-G492 WeakPolarHBondContact O-CA 3.34Å; H489-G492 PolarHBondContact O-N 3.05Å; H489-D493 IonicContact CE1-OD1 3.43Å; H489-D493 PolarHBondContact CE1-OD1 2.97Å; H489-D493 VanDerWaalsContact CE1-OD1 3.27Å; H489-D493 IonicContact CE1-OD2 2.76Å; H489-D493 PolarHBondContact CE1-OD2 3.1Å; H489-D493 IonicContact CG-OD2 2.81Å; H489-D493 IonicContact ND1-OD1 3.86Å; H489-D493 PolarHBondContact ND1-OD1 3Å; H489-D493 IonicContact ND1-OD2 2.68Å; H489-D493 PolarHBondContact ND1-OD2 2.94Å; H489-D493 VanDerWaalsContact O-CG 3.3Å; H489-D493 PolarHBondContact O-N 3.39Å; H489-D493 VanDerWaalsContact O-OD2 3.09Å |
| 490 | M | 96 | Very high | 95.5 | Very high | 95 Ų | 95 | 99.5 Ų | 99.5 | 47% | 0.468 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.3 | -33.1 | 179.9 | -68 | -177 | -56 | 0 | 0 | 112.7 | Q486 I487 S494 | Q486-M490 WeakPolarHBondContact O-CG 3.32Å; Q486-M490 PolarHBondContact O-N 3.44Å; Q486-M490 VanDerWaalsContact O-N 3.08Å; I487-M490 HydrophobicContact CG1-CE 4.21Å; I487-M490 PolarHBondContact O-N 2.9Å; I487-M490 VanDerWaalsContact O-N 3.11Å; M490-S494 WeakPolarHBondContact O-CB 3.43Å; M490-S494 PolarHBondContact O-N 2.72Å; M490-S494 PolarHBondContact O-OG 3.04Å |
| 491 | E | 94.7 | Very high | 95.1 | Very high | 121 Ų | 121 | 95.5 Ų | 95.5 | 57% | 0.565 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.1 | -40.9 | 171.7 | -72.7 | 178.6 | 171.6 | 0 | 0 | 110.9 | I487 H489 S494 V495 | I487-E491 HydrophobicContact CG2-CG 4.26Å; I487-E491 WeakPolarHBondContact O-CB 3.5Å; I487-E491 WeakPolarHBondContact O-CG 3.39Å; I487-E491 PolarHBondContact O-N 3.31Å; H489-E491 VanDerWaalsContact C-N 3.29Å; H489-E491 PolarHBondContact O-N 2.88Å; E491-S494 PolarHBondContact O-N 3.03Å; E491-V495 WeakPolarHBondContact O-CG2 3.35Å; E491-V495 PolarHBondContact O-N 3.2Å; E491-V495 VanDerWaalsContact O-N 3.11Å |
| 492 | G | 95.1 | Very high | 94.9 | Very high | 31 Ų | 31 | 96.4 Ų | 96.4 | 32% | 0.32 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.2 | -54 | 171 | 0 | 0 | 0 | 0 | 0 | 113.1 | E488 H489 S494 V495 D496 | E488-G492 PolarHBondContact O-N 3.4Å; E488-G492 VanDerWaalsContact O-N 3.16Å; H489-G492 CarbonylContact O-C 3.51Å; H489-G492 WeakPolarHBondContact O-CA 3.34Å; H489-G492 PolarHBondContact O-N 3.05Å; G492-S494 PolarHBondContact O-N 3.11Å; G492-V495 PolarHBondContact O-N 3.48Å; G492-D496 PolarHBondContact O-N 2.68Å |
| 493 | D | 95.1 | Very high | 94.6 | Very high | 80 Ų | 80 | 99.5 Ų | 99.5 | 43% | 0.428 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -54.8 | -39 | 178.2 | -60.5 | -47.9 | 0 | 0 | 0 | 111.6 | H489 F497 | H489-D493 IonicContact CE1-OD1 3.43Å; H489-D493 PolarHBondContact CE1-OD1 2.97Å; H489-D493 VanDerWaalsContact CE1-OD1 3.27Å; H489-D493 IonicContact CE1-OD2 2.76Å; H489-D493 PolarHBondContact CE1-OD2 3.1Å; H489-D493 IonicContact CG-OD2 2.81Å; H489-D493 IonicContact ND1-OD1 3.86Å; H489-D493 PolarHBondContact ND1-OD1 3Å; H489-D493 IonicContact ND1-OD2 2.68Å; H489-D493 PolarHBondContact ND1-OD2 2.94Å; H489-D493 VanDerWaalsContact O-CG 3.3Å; H489-D493 PolarHBondContact O-N 3.39Å; H489-D493 VanDerWaalsContact O-OD2 3.09Å; D493-F497 WeakPolarHBondContact O-CB 3.39Å; D493-F497 PolarHBondContact O-N 2.78Å |
| 494 | S | 91.6 | Very high | 94.3 | Very high | 78 Ų | 78 | 99.7 Ų | 99.7 | 55% | 0.545 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.9 | -38.3 | 178.1 | -60.5 | 0 | 0 | 0 | 0 | 112.7 | M490 E491 G492 Y498 | M490-S494 WeakPolarHBondContact O-CB 3.43Å; M490-S494 PolarHBondContact O-N 2.72Å; M490-S494 PolarHBondContact O-OG 3.04Å; E491-S494 PolarHBondContact O-N 3.03Å; G492-S494 PolarHBondContact O-N 3.11Å; S494-Y498 WeakPolarHBondContact O-CB 3.47Å; S494-Y498 PolarHBondContact O-N 2.96Å; S494-Y498 VanDerWaalsContact O-N 3.15Å |
| 495 | V | 95.1 | Very high | 93.8 | Very high | 82 Ų | 82 | 101.7 Ų | 101.7 | 50% | 0.497 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -70.1 | -41.9 | 175.6 | 167.2 | 0 | 0 | 0 | 0 | 110.8 | E491 G492 Y498 N499 | E491-V495 WeakPolarHBondContact O-CG2 3.35Å; E491-V495 PolarHBondContact O-N 3.2Å; E491-V495 VanDerWaalsContact O-N 3.11Å; G492-V495 PolarHBondContact O-N 3.48Å; V495-Y498 PolarHBondContact O-N 3.08Å; V495-N499 WeakPolarHBondContact CG1-ND2 3.42Å; V495-N499 VanDerWaalsContact O-CG 3.3Å; V495-N499 PolarHBondContact O-N 3.09Å; V495-N499 PolarHBondContact O-ND2 3.42Å; V495-N499 VanDerWaalsContact O-ND2 3.09Å |
| 496 | D | 94.1 | Very high | 93.3 | Very high | 106 Ų | 106 | 100.1 Ų | 100.1 | 57% | 0.567 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.3 | -41.6 | 178.5 | -76.2 | -14.8 | 0 | 0 | 0 | 111.9 | G492 Y498 N499 Q500 | G492-D496 PolarHBondContact O-N 2.68Å; D496-Y498 VanDerWaalsContact C-N 3.31Å; D496-Y498 PolarHBondContact O-N 3.3Å; D496-N499 PolarHBondContact O-N 2.9Å; D496-Q500 WeakPolarHBondContact O-CB 3.42Å; D496-Q500 PolarHBondContact O-N 2.96Å |
| 497 | F | 93.7 | Very high | 92.6 | Very high | 145 Ų | 145 | 101 Ų | 101 | 64% | 0.636 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60 | -39.8 | 171.9 | -179.6 | -96.2 | 0 | 0 | 0 | 112.6 | D493 S501 | D493-F497 WeakPolarHBondContact O-CB 3.39Å; D493-F497 PolarHBondContact O-N 2.78Å; F497-S501 WeakPolarHBondContact O-CB 3.43Å; F497-S501 PolarHBondContact O-N 3.41Å; F497-S501 PolarHBondContact O-OG 2.81Å |
| 498 | Y | 93.1 | Very high | 91.8 | Very high | 149 Ų | 149 | 104.4 Ų | 104.4 | 58% | 0.584 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67 | -43.2 | 176.1 | 180 | -105.3 | 0 | 0 | 0 | 112.2 | S494 V495 D496 S501 L502 | S494-Y498 WeakPolarHBondContact O-CB 3.47Å; S494-Y498 PolarHBondContact O-N 2.96Å; S494-Y498 VanDerWaalsContact O-N 3.15Å; V495-Y498 PolarHBondContact O-N 3.08Å; D496-Y498 VanDerWaalsContact C-N 3.31Å; D496-Y498 PolarHBondContact O-N 3.3Å; Y498-S501 PolarHBondContact O-N 3.15Å; Y498-L502 HydrophobicContact CD1-CD1 3.94Å; Y498-L502 HydrophobicContact CE1-CD1 3.37Å; Y498-L502 HydrophobicContact CE1-CG 4.33Å; Y498-L502 WeakPolarHBondContact O-CB 3.35Å; Y498-L502 PolarHBondContact O-N 2.79Å |
| 499 | N | 93.8 | Very high | 90.6 | Very high | 82 Ų | 82 | 106.6 Ų | 106.6 | 44% | 0.439 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.7 | -43.1 | 175.1 | -73.2 | -40.1 | 0 | 0 | 0 | 111.9 | V495 D496 L502 Q503 | V495-N499 WeakPolarHBondContact CG1-ND2 3.42Å; V495-N499 VanDerWaalsContact O-CG 3.3Å; V495-N499 PolarHBondContact O-N 3.09Å; V495-N499 PolarHBondContact O-ND2 3.42Å; V495-N499 VanDerWaalsContact O-ND2 3.09Å; D496-N499 PolarHBondContact O-N 2.9Å; N499-L502 WeakPolarHBondContact O-CB 3.5Å; N499-L502 PolarHBondContact O-N 3.29Å; N499-Q503 PolarHBondContact O-N 3.28Å |
| 500 | Q | 93.9 | Very high | 89.1 | Confident | 119 Ų | 119 | 103.8 Ų | 103.8 | 56% | 0.556 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.9 | -47.1 | 176.2 | -176.3 | 176.4 | -18 | 0 | 0 | 111.2 | D496 L502 Q503 E504 | D496-Q500 WeakPolarHBondContact O-CB 3.42Å; D496-Q500 PolarHBondContact O-N 2.96Å; Q500-L502 VanDerWaalsContact C-N 3.26Å; Q500-L502 PolarHBondContact O-N 3.32Å; Q500-Q503 PolarHBondContact O-N 3.37Å; Q500-Q503 VanDerWaalsContact O-N 3.08Å; Q500-E504 PolarHBondContact NE2-OE1 2.87Å; Q500-E504 WeakPolarHBondContact O-CG 3.37Å; Q500-E504 PolarHBondContact O-N 2.91Å |
| 501 | S | 90.1 | Very high | 87.5 | Confident | 40 Ų | 40 | 105.3 Ų | 105.3 | 28% | 0.28 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -59 | -37 | 175.7 | -59.1 | 0 | 0 | 0 | 0 | 112.5 | F497 Y498 L505 | F497-S501 WeakPolarHBondContact O-CB 3.43Å; F497-S501 PolarHBondContact O-N 3.41Å; F497-S501 PolarHBondContact O-OG 2.81Å; Y498-S501 PolarHBondContact O-N 3.15Å; S501-L505 WeakPolarHBondContact O-CB 3.37Å; S501-L505 PolarHBondContact O-N 3.05Å; S501-L505 VanDerWaalsContact O-N 3.13Å |
| 502 | L | 92.4 | Very high | 85.6 | Confident | 80 Ų | 80 | 111.5 Ų | 111.5 | 42% | 0.419 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.3 | -41.2 | 173.7 | -97.5 | 170.1 | 0 | 0 | 0 | 112.4 | Y498 N499 Q500 L505 L506 | Y498-L502 HydrophobicContact CD1-CD1 3.94Å; Y498-L502 HydrophobicContact CE1-CD1 3.37Å; Y498-L502 HydrophobicContact CE1-CG 4.33Å; Y498-L502 WeakPolarHBondContact O-CB 3.35Å; Y498-L502 PolarHBondContact O-N 2.79Å; N499-L502 WeakPolarHBondContact O-CB 3.5Å; N499-L502 PolarHBondContact O-N 3.29Å; Q500-L502 VanDerWaalsContact C-N 3.26Å; Q500-L502 PolarHBondContact O-N 3.32Å; L502-L505 PolarHBondContact O-N 2.96Å; L502-L506 WeakPolarHBondContact O-CB 3.49Å; L502-L506 PolarHBondContact O-N 3.08Å |
| 503 | Q | 91.2 | Very high | 85.1 | Confident | 117 Ų | 117 | 115.5 Ų | 115.5 | 55% | 0.547 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -69.8 | -41.7 | 178.3 | 179.7 | 155.8 | -21.4 | 0 | 0 | 111.8 | N499 Q500 L505 L506 E507 | N499-Q503 PolarHBondContact O-N 3.28Å; Q500-Q503 PolarHBondContact O-N 3.37Å; Q500-Q503 VanDerWaalsContact O-N 3.08Å; Q503-L505 VanDerWaalsContact C-N 3.29Å; Q503-L505 PolarHBondContact O-N 2.94Å; Q503-L506 WeakPolarHBondContact O-CB 3.43Å; Q503-L506 PolarHBondContact O-N 3.44Å; Q503-E507 HydrophobicContact CG-CG 4.35Å; Q503-E507 WeakPolarHBondContact CG-OE1 3.39Å; Q503-E507 PolarHBondContact NE2-OE1 2.99Å; Q503-E507 WeakPolarHBondContact O-CG 3.5Å; Q503-E507 PolarHBondContact O-N 3.13Å |
| 504 | E | 90.3 | Very high | 84.6 | Confident | 102 Ų | 102 | 117.4 Ų | 117.4 | 48% | 0.477 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -58.5 | -41 | 173.2 | -70.8 | 176.5 | -161.1 | 0 | 0 | 111.3 | Q500 L508 | Q500-E504 PolarHBondContact NE2-OE1 2.87Å; Q500-E504 WeakPolarHBondContact O-CG 3.37Å; Q500-E504 PolarHBondContact O-N 2.91Å; E504-L508 WeakPolarHBondContact O-CB 3.45Å; E504-L508 VanDerWaalsContact O-CG 3.25Å; E504-L508 WeakPolarHBondContact O-CG 3.44Å; E504-L508 PolarHBondContact O-N 2.88Å |
| 505 | L | 86.9 | Confident | 84.2 | Confident | 115 Ų | 115 | 119.6 Ų | 119.6 | 60% | 0.602 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -64.3 | -37.2 | 172 | -92.5 | 167.6 | 0 | 0 | 0 | 113.6 | S501 L502 Q503 H509 | S501-L505 WeakPolarHBondContact O-CB 3.37Å; S501-L505 PolarHBondContact O-N 3.05Å; S501-L505 VanDerWaalsContact O-N 3.13Å; L502-L505 PolarHBondContact O-N 2.96Å; Q503-L505 VanDerWaalsContact C-N 3.29Å; Q503-L505 PolarHBondContact O-N 2.94Å; L505-H509 WeakPolarHBondContact O-CB 3.25Å; L505-H509 PolarHBondContact O-N 3.17Å; L505-H509 VanDerWaalsContact O-N 3.13Å |
| 506 | L | 87.9 | Confident | 83.6 | Confident | 130 Ų | 130 | 121.8 Ų | 121.8 | 68% | 0.681 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.6 | -42.3 | 178 | -161.3 | 85.6 | 0 | 0 | 0 | 111.2 | L502 Q503 H509 A510 | L502-L506 WeakPolarHBondContact O-CB 3.49Å; L502-L506 PolarHBondContact O-N 3.08Å; Q503-L506 WeakPolarHBondContact O-CB 3.43Å; Q503-L506 PolarHBondContact O-N 3.44Å; L506-H509 CarbonylContact O-C 3.57Å; L506-H509 PolarHBondContact O-N 3.47Å; L506-A510 PolarHBondContact O-N 3.38Å |
| 507 | E | 81.6 | Confident | 82.9 | Confident | 127 Ų | 127 | 122.8 Ų | 122.8 | 59% | 0.593 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.8 | -37.6 | 176.8 | -70.5 | 178.1 | -162.8 | 0 | 0 | 111.5 | Q503 H509 A510 | Q503-E507 HydrophobicContact CG-CG 4.35Å; Q503-E507 WeakPolarHBondContact CG-OE1 3.39Å; Q503-E507 PolarHBondContact NE2-OE1 2.99Å; Q503-E507 WeakPolarHBondContact O-CG 3.5Å; Q503-E507 PolarHBondContact O-N 3.13Å; E507-H509 VanDerWaalsContact C-N 3.26Å; E507-H509 PolarHBondContact O-N 3.02Å; E507-A510 PolarHBondContact O-N 3.13Å |
| 508 | L | 79.4 | Confident | 82.2 | Confident | 147 Ų | 147 | 121.3 Ų | 121.3 | 77% | 0.77 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -68.9 | -18.4 | 171.6 | -74.4 | 168.8 | 0 | 0 | 0 | 114.3 | E504 | E504-L508 WeakPolarHBondContact O-CB 3.45Å; E504-L508 VanDerWaalsContact O-CG 3.25Å; E504-L508 WeakPolarHBondContact O-CG 3.44Å; E504-L508 PolarHBondContact O-N 2.88Å |
| 509 | H | 71.4 | Confident | 81.4 | Confident | 168 Ų | 168 | 119.3 Ų | 119.3 | 78% | 0.778 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | 2.9 | 178.9 | -156.4 | 64.8 | 0 | 0 | 0 | 113.7 | L505 L506 E507 | L505-H509 WeakPolarHBondContact O-CB 3.25Å; L505-H509 PolarHBondContact O-N 3.17Å; L505-H509 VanDerWaalsContact O-N 3.13Å; L506-H509 CarbonylContact O-C 3.57Å; L506-H509 PolarHBondContact O-N 3.47Å; E507-H509 VanDerWaalsContact C-N 3.26Å; E507-H509 PolarHBondContact O-N 3.02Å |
| 510 | A | 64.3 | Low | 80.5 | Confident | 65 Ų | 65 | 122.2 Ų | 122.2 | 54% | 0.537 | 65% | 0.645 | S | S | . | * | trans | -69.5 | 127.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | L506 E507 | L506-A510 PolarHBondContact O-N 3.38Å; E507-A510 PolarHBondContact O-N 3.13Å | ||
| 511 | P | 62.3 | Low | 79.4 | Confident | 128 Ų | 128 | 122.4 Ų | 122.4 | 83% | 0.831 | 65% | 0.652 | S | S | * | * | trans | -72 | 138.4 | 176.3 | 29.3 | -33.8 | 0 | 0 | 0 | 111.6 | ||||
| 512 | L | 54.4 | Low | 78.4 | Confident | 250 Ų | 250 | 129.9 Ų | 129.9 | 100% | 1.309 | 69% | 0.686 | S | S | * | * | trans | -70.7 | 0 | 170.7 | -79.5 | 163.1 | 0 | 0 | 0 | 112.8 |
Retrieved 512 of 512 residues in 81.9 ms
(Link to these results)