| 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 | 41 | Very low | 66.1 | Low | 241 Ų | 241 | 113.6 Ų | 113.6 | 100% | 1.187 | 64% | 0.644 | S | S | * | * | 0 | 99.1 | 0 | -65.7 | 172.6 | 80.4 | 0 | 0 | 106.4 | G3 | M1-G3 PolarHBondContact O-N 2.72Š| |||
| 2 | S | 52.4 | Low | 67.6 | Low | 133 Ų | 133 | 106.8 Ų | 106.8 | 93% | 0.93 | 60% | 0.604 | S | S | * | * | trans | -73.3 | 108.6 | -177.4 | -51 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 3 | G | 48.6 | Very low | 68.6 | Low | 72 Ų | 72 | 110.9 Ų | 110.9 | 74% | 0.742 | 60% | 0.604 | S | S | * | * | trans | -64.3 | 134.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | M1 A5 | M1-G3 PolarHBondContact O-N 2.72Å; G3-A5 VanDerWaalsContact C-N 3.33Å; G3-A5 PolarHBondContact O-N 2.99Å | ||
| 4 | W | 52.2 | Low | 69.6 | Low | 219 Ų | 219 | 115.8 Ų | 115.8 | 83% | 0.83 | 61% | 0.609 | S | S | * | * | trans | -68.2 | 94.5 | 169.3 | -154.8 | 9 | 0 | 0 | 0 | 107 | ||||
| 5 | A | 71.3 | Confident | 70.1 | Confident | 85 Ų | 85 | 109.1 Ų | 109.1 | 70% | 0.702 | 57% | 0.574 | S | S | * | * | trans | -65.4 | 129.2 | 158.6 | 0 | 0 | 0 | 0 | 0 | 105.4 | G3 | G3-A5 VanDerWaalsContact C-N 3.33Å; G3-A5 PolarHBondContact O-N 2.99Å | ||
| 6 | G | 69.9 | Low | 70.6 | Confident | 46 Ų | 46 | 110.6 Ų | 110.6 | 47% | 0.474 | 58% | 0.577 | S | S | . | * | trans | -54.9 | -175.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | S8 | G6-S8 PolarHBondContact O-N 3.35Š| ||
| 7 | F | 73.8 | Confident | 70.6 | Confident | 50 Ų | 50 | 111.8 Ų | 111.8 | 22% | 0.219 | 58% | 0.579 | C | S | . | * | trans | -62.2 | 134.9 | -178.7 | -67.1 | -72.6 | 0 | 0 | 0 | 111.1 | E11 L12 I15 D186 L190 | F7-E11 HydrophobicContact CB-CB 4.36Å; F7-E11 HydrophobicContact CD1-CB 4.32Å; F7-L12 HydrophobicContact CB-CD2 3.88Å; F7-L12 HydrophobicContact CB-CG 3.89Å; F7-L12 HydrophobicContact CG-CD2 4.45Å; F7-I15 HydrophobicContact CD1-CD1 4.25Å; F7-I15 HydrophobicContact CE1-CD1 4.34Å; F7-D186 HydrophobicContact CD2-CB 4.46Å; F7-L190 HydrophobicContact CE2-CD2 4.12Å; F7-L190 HydrophobicContact CE2-CG 4.28Å; F7-L190 HydrophobicContact CZ-CD2 4.07Å | ||
| 8 | S | 81.3 | Confident | 70.5 | Confident | 49 Ų | 49 | 114.6 Ų | 114.6 | 34% | 0.343 | 59% | 0.586 | S | S | . | * | trans | -66.4 | 152.1 | 170.1 | 56.6 | 0 | 0 | 0 | 0 | 110.8 | G6 E10 E11 L12 | G6-S8 PolarHBondContact O-N 3.35Å; S8-E10 PolarHBondContact O-N 3Å; S8-E11 PolarHBondContact N-OE2 3.46Å; S8-E11 WeakPolarHBondContact O-CA 3.23Å; S8-E11 WeakPolarHBondContact O-CB 3.49Å; S8-E11 PolarHBondContact O-N 2.84Å; S8-E11 WeakPolarHBondContact OG-CB 3.39Å; S8-E11 VanDerWaalsContact OG-CD 3.32Å; S8-E11 VanDerWaalsContact OG-CG 3.23Å; S8-E11 WeakPolarHBondContact OG-CG 3.49Å; S8-E11 PolarHBondContact OG-N 2.91Å; S8-E11 PolarHBondContact OG-OE2 3.48Å; S8-L12 PolarHBondContact O-N 3.39Å | ||
| 9 | E | 77.3 | Confident | 69.9 | Low | 135 Ų | 135 | 115.2 Ų | 115.2 | 63% | 0.631 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -54.7 | -36.6 | 175.9 | -171.3 | 82.2 | -153.1 | 0 | 0 | 111.3 | L12 R13 | E9-L12 PolarHBondContact O-N 3.33Å; E9-R13 PolarHBondContact O-N 2.85Å |
| 10 | E | 78.1 | Confident | 69.2 | Low | 132 Ų | 132 | 114.3 Ų | 114.3 | 62% | 0.617 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -65.5 | -38.8 | 172.4 | -76 | 80.3 | -158.6 | 0 | 0 | 113.4 | S8 R14 | S8-E10 PolarHBondContact O-N 3Å; E10-R14 WeakPolarHBondContact O-CB 3.49Å; E10-R14 PolarHBondContact O-N 2.91Å |
| 11 | E | 81.4 | Confident | 68.3 | Low | 88 Ų | 88 | 112.3 Ų | 112.3 | 41% | 0.411 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.5 | -47.5 | 174.4 | -80.7 | 167.3 | 143.1 | 0 | 0 | 110.4 | F7 S8 R13 R14 I15 | F7-E11 HydrophobicContact CB-CB 4.36Å; F7-E11 HydrophobicContact CD1-CB 4.32Å; S8-E11 PolarHBondContact N-OE2 3.46Å; S8-E11 WeakPolarHBondContact O-CA 3.23Å; S8-E11 WeakPolarHBondContact O-CB 3.49Å; S8-E11 PolarHBondContact O-N 2.84Å; S8-E11 WeakPolarHBondContact OG-CB 3.39Å; S8-E11 VanDerWaalsContact OG-CD 3.32Å; S8-E11 VanDerWaalsContact OG-CG 3.23Å; S8-E11 WeakPolarHBondContact OG-CG 3.49Å; S8-E11 PolarHBondContact OG-N 2.91Å; S8-E11 PolarHBondContact OG-OE2 3.48Å; E11-R13 VanDerWaalsContact C-N 3.31Å; E11-R13 PolarHBondContact O-N 2.87Å; E11-R14 WeakPolarHBondContact O-CB 3.47Å; E11-R14 PolarHBondContact O-N 3.24Å; E11-I15 WeakPolarHBondContact O-CG1 3.16Å; E11-I15 PolarHBondContact O-N 3.44Å |
| 12 | L | 84 | Confident | 68.7 | Low | 31 Ų | 31 | 103.5 Ų | 103.5 | 16% | 0.162 | 57% | 0.567 | C | S | . | * | H | α-helix | trans | -56.5 | -44.7 | 177.2 | -69.6 | 174 | 0 | 0 | 0 | 112 | F7 S8 E9 R14 I15 Q16 I189 | F7-L12 HydrophobicContact CB-CD2 3.88Å; F7-L12 HydrophobicContact CB-CG 3.89Å; F7-L12 HydrophobicContact CG-CD2 4.45Å; S8-L12 PolarHBondContact O-N 3.39Å; E9-L12 PolarHBondContact O-N 3.33Å; L12-R14 VanDerWaalsContact C-N 3.34Å; L12-R14 PolarHBondContact O-N 2.89Å; L12-I15 PolarHBondContact O-N 3.34Å; L12-Q16 WeakPolarHBondContact O-CB 3.09Å; L12-Q16 PolarHBondContact O-N 3.01Å; L12-I189 HydrophobicContact CD2-CD1 3.24Å |
| 13 | R | 80.9 | Confident | 68.5 | Low | 161 Ų | 161 | 103 Ų | 103 | 61% | 0.608 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -61.6 | -41.1 | 174.1 | -82.3 | -173.1 | 168.5 | -172.4 | -2 | 112.7 | E9 E11 I15 Q16 Q17 | E9-R13 PolarHBondContact O-N 2.85Å; E11-R13 VanDerWaalsContact C-N 3.31Å; E11-R13 PolarHBondContact O-N 2.87Å; R13-I15 VanDerWaalsContact C-N 3.33Å; R13-Q16 PolarHBondContact O-N 3.49Å; R13-Q17 VanDerWaalsContact O-CB 3.28Å; R13-Q17 WeakPolarHBondContact O-CB 3.32Å; R13-Q17 VanDerWaalsContact O-CG 3.24Å; R13-Q17 WeakPolarHBondContact O-CG 3.11Å; R13-Q17 PolarHBondContact O-N 2.72Å |
| 14 | R | 82 | Confident | 68.2 | Low | 179 Ų | 179 | 105.8 Ų | 105.8 | 68% | 0.675 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -67.4 | -36.6 | 179.3 | -160.5 | -179.8 | -61.9 | -175.8 | 1.3 | 111.6 | E10 E11 L12 K18 | E10-R14 WeakPolarHBondContact O-CB 3.49Å; E10-R14 PolarHBondContact O-N 2.91Å; E11-R14 WeakPolarHBondContact O-CB 3.47Å; E11-R14 PolarHBondContact O-N 3.24Å; L12-R14 VanDerWaalsContact C-N 3.34Å; L12-R14 PolarHBondContact O-N 2.89Å; R14-K18 VanDerWaalsContact O-CB 3.28Å; R14-K18 WeakPolarHBondContact O-CB 3.35Å; R14-K18 PolarHBondContact O-N 2.65Å |
| 15 | I | 78.1 | Confident | 67.8 | Low | 16 Ų | 16 | 100.5 Ų | 100.5 | 8% | 0.082 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -65.6 | -49.5 | 174.7 | -64 | 177 | 0 | 0 | 0 | 109.9 | F7 E11 L12 R13 Q17 K18 D19 I189 | F7-I15 HydrophobicContact CD1-CD1 4.25Å; F7-I15 HydrophobicContact CE1-CD1 4.34Å; E11-I15 WeakPolarHBondContact O-CG1 3.16Å; E11-I15 PolarHBondContact O-N 3.44Å; L12-I15 PolarHBondContact O-N 3.34Å; R13-I15 VanDerWaalsContact C-N 3.33Å; I15-Q17 PolarHBondContact O-N 2.93Å; I15-K18 WeakPolarHBondContact O-CB 3.37Å; I15-K18 PolarHBondContact O-N 2.84Å; I15-K18 VanDerWaalsContact O-N 3.17Å; I15-D19 PolarHBondContact O-N 3.27Å; I15-I189 HydrophobicContact CD1-CG2 4.49Å; I15-I189 HydrophobicContact CG2-CG2 3.96Å |
| 16 | Q | 77.8 | Confident | 66.1 | Low | 133 Ų | 133 | 100.9 Ų | 100.9 | 62% | 0.621 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -68.6 | -33.8 | -177.9 | -159.5 | 167.8 | 82.3 | 0 | 0 | 113.2 | L12 R13 S20 | L12-Q16 WeakPolarHBondContact O-CB 3.09Å; L12-Q16 PolarHBondContact O-N 3.01Å; R13-Q16 PolarHBondContact O-N 3.49Å; Q16-S20 PolarHBondContact O-N 3.44Å; Q16-S20 PolarHBondContact O-OG 3.3Å |
| 17 | Q | 71.1 | Confident | 64.9 | Low | 130 Ų | 130 | 104.7 Ų | 104.7 | 61% | 0.607 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -72.3 | -31.7 | 172.4 | -74.7 | 178.6 | 9 | 0 | 0 | 112.6 | R13 I15 D19 S20 A21 | R13-Q17 VanDerWaalsContact O-CB 3.28Å; R13-Q17 WeakPolarHBondContact O-CB 3.32Å; R13-Q17 VanDerWaalsContact O-CG 3.24Å; R13-Q17 WeakPolarHBondContact O-CG 3.11Å; R13-Q17 PolarHBondContact O-N 2.72Å; I15-Q17 PolarHBondContact O-N 2.93Å; Q17-D19 VanDerWaalsContact C-N 3.3Å; Q17-S20 CarbonylContact O-C 3.59Å; Q17-S20 PolarHBondContact O-N 3.36Å; Q17-A21 VanDerWaalsContact O-CB 3.31Å; Q17-A21 WeakPolarHBondContact O-CB 3.46Å; Q17-A21 PolarHBondContact O-N 2.84Å |
| 18 | K | 68.3 | Low | 63.8 | Low | 162 Ų | 162 | 114.5 Ų | 114.5 | 70% | 0.704 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67.4 | -33.1 | 175.3 | -173 | 125.6 | 178.4 | 176.8 | 0 | 111.9 | R14 I15 S20 | R14-K18 VanDerWaalsContact O-CB 3.28Å; R14-K18 WeakPolarHBondContact O-CB 3.35Å; R14-K18 PolarHBondContact O-N 2.65Å; I15-K18 WeakPolarHBondContact O-CB 3.37Å; I15-K18 PolarHBondContact O-N 2.84Å; I15-K18 VanDerWaalsContact O-N 3.17Å; K18-S20 VanDerWaalsContact C-N 3.35Å |
| 19 | D | 58.1 | Low | 61.7 | Low | 126 Ų | 126 | 115.8 Ų | 115.8 | 67% | 0.674 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -77.7 | -21.9 | 173.5 | -59.8 | -30.8 | 0 | 0 | 0 | 112.4 | I15 Q17 | I15-D19 PolarHBondContact O-N 3.27Å; Q17-D19 VanDerWaalsContact C-N 3.3Å |
| 20 | S | 56.2 | Low | 60.3 | Low | 97 Ų | 97 | 121.2 Ų | 121.2 | 68% | 0.678 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -89.8 | -25 | 177.1 | -57.5 | 0 | 0 | 0 | 0 | 113.8 | Q16 Q17 K18 G22 | Q16-S20 PolarHBondContact O-N 3.44Å; Q16-S20 PolarHBondContact O-OG 3.3Å; Q17-S20 CarbonylContact O-C 3.59Å; Q17-S20 PolarHBondContact O-N 3.36Å; K18-S20 VanDerWaalsContact C-N 3.35Å; S20-G22 PolarHBondContact O-N 2.93Å; S20-G22 VanDerWaalsContact O-N 3.15Å |
| 21 | A | 50.1 | Low | 59 | Low | 73 Ų | 73 | 124.4 Ų | 124.4 | 60% | 0.603 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -85.4 | 80 | 174.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | Q17 | Q17-A21 VanDerWaalsContact O-CB 3.31Å; Q17-A21 WeakPolarHBondContact O-CB 3.46Å; Q17-A21 PolarHBondContact O-N 2.84Å |
| 22 | G | 49.7 | Very low | 57.1 | Low | 57 Ų | 57 | 125.9 Ų | 125.9 | 59% | 0.588 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 156.7 | 168 | 0 | 0 | 0 | 0 | 0 | 112.2 | S20 | S20-G22 PolarHBondContact O-N 2.93Å; S20-G22 VanDerWaalsContact O-N 3.15Å |
| 23 | P | 48.1 | Very low | 55.1 | Low | 123 Ų | 123 | 130.4 Ų | 130.4 | 80% | 0.799 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 150.6 | -173.5 | 26.9 | -34.9 | 0 | 0 | 0 | 111.9 | A25 | P23-A25 PolarHBondContact O-N 3.02Š|
| 24 | P | 43.6 | Very low | 53.7 | Low | 130 Ų | 130 | 129.1 Ų | 129.1 | 84% | 0.844 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 136.6 | -178.2 | 27.7 | -33.1 | 0 | 0 | 0 | 110.6 | ||
| 25 | A | 42.1 | Very low | 52.1 | Low | 108 Ų | 108 | 126.1 Ų | 126.1 | 89% | 0.893 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 138.1 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114 | P23 | P23-A25 PolarHBondContact O-N 3.02Š|
| 26 | A | 36.1 | Very low | 50.7 | Low | 93 Ų | 93 | 130.9 Ų | 130.9 | 77% | 0.769 | 77% | 0.77 | S | S | * | * | trans | -126.8 | 155.4 | 157.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 27 | P | 44.6 | Very low | 49.9 | Very low | 125 Ų | 125 | 131.8 Ų | 131.8 | 81% | 0.812 | 77% | 0.768 | S | S | * | * | trans | -88.9 | 156.3 | -139.5 | 33.4 | -35.4 | 0 | 0 | 0 | 115.8 | ||||
| 28 | R | 51.2 | Low | 50.1 | Low | 257 Ų | 257 | 128.9 Ų | 128.9 | 97% | 0.97 | 76% | 0.762 | S | S | * | * | trans | 2.5 | 119.2 | 160.9 | -75.5 | 179.1 | 174.5 | -146.3 | -1.4 | 117.7 | ||||
| 29 | G | 36.7 | Very low | 50.3 | Low | 75 Ų | 75 | 131.2 Ų | 131.2 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | trans | -168.6 | 101.6 | 160.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 30 | R | 48.3 | Very low | 51 | Low | 249 Ų | 249 | 132.5 Ų | 132.5 | 94% | 0.94 | 77% | 0.768 | S | S | * | * | trans | 47.4 | 126 | 155.8 | -69.8 | -178.1 | 174.3 | -149.3 | -1.3 | 121.2 | ||||
| 31 | K | 50.4 | Low | 52 | Low | 200 Ų | 200 | 133 Ų | 133 | 87% | 0.87 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -58 | 142.5 | 169.4 | -57.8 | 176.4 | 178.3 | -178.9 | 0 | 111.9 | ||
| 32 | P | 41.2 | Very low | 53.3 | Low | 118 Ų | 118 | 134.1 Ų | 134.1 | 77% | 0.766 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 147.5 | 168.9 | 32.3 | -30.9 | 0 | 0 | 0 | 111.3 | ||
| 33 | P | 43.2 | Very low | 54.8 | Low | 127 Ų | 127 | 137.3 Ų | 137.3 | 83% | 0.825 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 145.9 | 175.4 | 30.7 | -32.7 | 0 | 0 | 0 | 111.6 | ||
| 34 | T | 50.9 | Low | 56.2 | Low | 134 Ų | 134 | 140.5 Ų | 140.5 | 82% | 0.822 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -68.2 | 146.4 | 168.2 | 55.7 | 0 | 0 | 0 | 0 | 110.8 | ||
| 35 | S | 48.6 | Very low | 57.9 | Low | 115 Ų | 115 | 137.6 Ų | 137.6 | 80% | 0.804 | 73% | 0.725 | S | S | * | * | trans | 83.5 | 96 | 160.5 | -169 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 36 | S | 49.5 | Very low | 59.7 | Low | 117 Ų | 117 | 140.6 Ų | 140.6 | 82% | 0.818 | 71% | 0.713 | S | S | * | * | trans | -140 | 90.8 | 132.7 | 54.5 | 0 | 0 | 0 | 0 | 108.8 | S38 | S36-S38 PolarHBondContact O-N 2.91Š| ||
| 37 | R | 59.9 | Low | 61.5 | Low | 151 Ų | 151 | 139 Ų | 139 | 57% | 0.57 | 70% | 0.7 | S | S | * | * | trans | -57.7 | 111.6 | 169.2 | -100.8 | 174.6 | 166.8 | -171.2 | -14.2 | 108 | E45 | R37-E45 IonicContact CZ-OE1 3.42Å; R37-E45 IonicContact CZ-OE2 2.72Å; R37-E45 IonicContact NH1-OE2 3.53Å; R37-E45 IonicContact NH2-OE1 3.68Å; R37-E45 PolarHBondContact NH2-OE1 3.44Å; R37-E45 IonicContact NH2-OE2 2.65Å; R37-E45 PolarHBondContact NH2-OE2 3.24Å; R37-E45 VanDerWaalsContact NH2-OE2 3.17Å | ||
| 38 | S | 74.4 | Confident | 62.9 | Low | 70 Ų | 70 | 138.7 Ų | 138.7 | 49% | 0.49 | 69% | 0.691 | S | S | . | * | trans | -61.3 | 142.3 | 177.7 | 176.3 | 0 | 0 | 0 | 0 | 110.3 | S36 Q40 Q41 M42 | S36-S38 PolarHBondContact O-N 2.91Å; S38-Q40 PolarHBondContact O-N 3.3Å; S38-Q41 WeakPolarHBondContact O-CA 3.39Å; S38-Q41 WeakPolarHBondContact O-CB 3.19Å; S38-Q41 PolarHBondContact O-N 3.47Å; S38-M42 PolarHBondContact O-N 2.95Å | ||
| 39 | R | 72.7 | Confident | 63.9 | Low | 211 Ų | 211 | 132.3 Ų | 132.3 | 80% | 0.796 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -51.4 | -29.5 | 179.1 | -172.7 | 177.1 | -114.5 | -122.6 | 0.4 | 112.7 | Q43 | R39-Q43 WeakPolarHBondContact O-CG 3.39Å; R39-Q43 PolarHBondContact O-N 3.45Å |
| 40 | Q | 73.1 | Confident | 65.4 | Low | 152 Ų | 152 | 135.3 Ų | 135.3 | 71% | 0.71 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -71.1 | -33.7 | 176.5 | -162.1 | 177.6 | 30.7 | 0 | 0 | 113 | S38 Q43 R44 | S38-Q40 PolarHBondContact O-N 3.3Å; Q40-Q43 PolarHBondContact O-N 3.29Å; Q40-R44 PolarHBondContact O-N 2.85Å; Q40-R44 VanDerWaalsContact O-N 3.14Å |
| 41 | Q | 78.7 | Confident | 66 | Low | 107 Ų | 107 | 127.4 Ų | 127.4 | 50% | 0.5 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -71.4 | -38.2 | 177.2 | -165.8 | 174.5 | 3.7 | 0 | 0 | 111.3 | S38 R44 E45 | S38-Q41 WeakPolarHBondContact O-CA 3.39Å; S38-Q41 WeakPolarHBondContact O-CB 3.19Å; S38-Q41 PolarHBondContact O-N 3.47Å; Q41-R44 PolarHBondContact O-N 3.47Å; Q41-E45 PolarHBondContact O-N 3Å |
| 42 | M | 77.5 | Confident | 66.1 | Low | 98 Ų | 98 | 121.1 Ų | 121.1 | 48% | 0.483 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -63.3 | -37.4 | 172.3 | -101.2 | -100.2 | -79.6 | 0 | 0 | 112.8 | S38 R46 | S38-M42 PolarHBondContact O-N 2.95Å; M42-R46 PolarHBondContact O-N 2.89Å |
| 43 | Q | 79.4 | Confident | 66.9 | Low | 124 Ų | 124 | 119.9 Ų | 119.9 | 58% | 0.579 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -67 | -40.7 | 175.5 | -75.5 | 178.4 | -11.4 | 0 | 0 | 112.1 | R39 Q40 R46 A47 | R39-Q43 WeakPolarHBondContact O-CG 3.39Å; R39-Q43 PolarHBondContact O-N 3.45Å; Q40-Q43 PolarHBondContact O-N 3.29Å; Q43-R46 PolarHBondContact O-N 3.48Å; Q43-A47 PolarHBondContact O-N 3Å; Q43-A47 VanDerWaalsContact O-N 3.07Å |
| 44 | R | 77.6 | Confident | 67.2 | Low | 190 Ų | 190 | 122.4 Ų | 122.4 | 72% | 0.717 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -65.1 | -40 | 175.9 | -173.5 | 176.4 | 175.5 | -179.8 | -1.6 | 112.3 | Q40 Q41 A47 L48 | Q40-R44 PolarHBondContact O-N 2.85Å; Q40-R44 VanDerWaalsContact O-N 3.14Å; Q41-R44 PolarHBondContact O-N 3.47Å; R44-A47 PolarHBondContact O-N 2.89Å; R44-L48 HydrophobicContact CG-CD1 4.5Å; R44-L48 WeakPolarHBondContact O-CG 3.39Å; R44-L48 PolarHBondContact O-N 3.49Å |
| 45 | E | 79.1 | Confident | 66.8 | Low | 69 Ų | 69 | 122.9 Ų | 122.9 | 32% | 0.322 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.3 | -38.8 | 178 | -142 | 172.7 | -172.9 | 0 | 0 | 111.5 | R37 Q41 L48 Q49 | R37-E45 IonicContact CZ-OE1 3.42Å; R37-E45 IonicContact CZ-OE2 2.72Å; R37-E45 IonicContact NH1-OE2 3.53Å; R37-E45 IonicContact NH2-OE1 3.68Å; R37-E45 PolarHBondContact NH2-OE1 3.44Å; R37-E45 IonicContact NH2-OE2 2.65Å; R37-E45 PolarHBondContact NH2-OE2 3.24Å; R37-E45 VanDerWaalsContact NH2-OE2 3.17Å; Q41-E45 PolarHBondContact O-N 3Å; E45-L48 PolarHBondContact O-N 3.22Å; E45-Q49 WeakPolarHBondContact O-CG 3.33Å; E45-Q49 PolarHBondContact O-N 2.83Å; E45-Q49 VanDerWaalsContact O-N 3.09Å |
| 46 | R | 80 | Confident | 66.7 | Low | 170 Ų | 170 | 125.1 Ų | 125.1 | 64% | 0.642 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -63.1 | -41.9 | 172.4 | -94.6 | -176.2 | 176.2 | 163.4 | -0.4 | 113.2 | M42 Q43 L48 Q49 L50 | M42-R46 PolarHBondContact O-N 2.89Å; Q43-R46 PolarHBondContact O-N 3.48Å; R46-L48 VanDerWaalsContact C-N 3.31Å; R46-L48 PolarHBondContact O-N 2.98Å; R46-Q49 PolarHBondContact O-N 2.87Å; R46-L50 PolarHBondContact O-N 2.84Å; R46-L50 VanDerWaalsContact O-N 3.13Å |
| 47 | A | 73.9 | Confident | 66.2 | Low | 60 Ų | 60 | 127.6 Ų | 127.6 | 50% | 0.496 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -63.6 | -37.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q43 R44 A51 | Q43-A47 PolarHBondContact O-N 3Å; Q43-A47 VanDerWaalsContact O-N 3.07Å; R44-A47 PolarHBondContact O-N 2.89Å; A47-A51 PolarHBondContact O-N 3.41Å |
| 48 | L | 74.5 | Confident | 65.7 | Low | 118 Ų | 118 | 126.1 Ų | 126.1 | 62% | 0.618 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -72.4 | -33.7 | 177.3 | -69.6 | 171.6 | 0 | 0 | 0 | 112.8 | R44 E45 R46 A51 G52 | R44-L48 HydrophobicContact CG-CD1 4.5Å; R44-L48 WeakPolarHBondContact O-CG 3.39Å; R44-L48 PolarHBondContact O-N 3.49Å; E45-L48 PolarHBondContact O-N 3.22Å; R46-L48 VanDerWaalsContact C-N 3.31Å; R46-L48 PolarHBondContact O-N 2.98Å; L48-A51 PolarHBondContact O-N 3.35Å; L48-G52 PolarHBondContact O-N 3.24Å |
| 49 | Q | 73.3 | Confident | 64.1 | Low | 124 Ų | 124 | 126.1 Ų | 126.1 | 58% | 0.579 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -69.3 | -35.9 | 175.4 | -74.3 | 175.7 | 17.6 | 0 | 0 | 112.8 | E45 R46 A51 G52 S53 | E45-Q49 WeakPolarHBondContact O-CG 3.33Å; E45-Q49 PolarHBondContact O-N 2.83Å; E45-Q49 VanDerWaalsContact O-N 3.09Å; R46-Q49 PolarHBondContact O-N 2.87Å; Q49-A51 VanDerWaalsContact C-N 3.34Å; Q49-G52 PolarHBondContact O-N 3.43Å; Q49-S53 PolarHBondContact O-OG 2.91Å; Q49-S53 VanDerWaalsContact O-OG 3.11Å |
| 50 | L | 66.5 | Low | 62.9 | Low | 137 Ų | 137 | 125.3 Ų | 125.3 | 72% | 0.717 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -67.7 | -32.8 | 174.3 | -83.4 | 153 | 0 | 0 | 0 | 112.6 | R46 G52 | R46-L50 PolarHBondContact O-N 2.84Å; R46-L50 VanDerWaalsContact O-N 3.13Å; L50-G52 VanDerWaalsContact C-N 3.34Å |
| 51 | A | 60.9 | Low | 61.2 | Low | 83 Ų | 83 | 126.7 Ų | 126.7 | 69% | 0.686 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -76 | -20.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | A47 L48 Q49 S53 | A47-A51 PolarHBondContact O-N 3.41Å; L48-A51 PolarHBondContact O-N 3.35Å; Q49-A51 VanDerWaalsContact C-N 3.34Å; A51-S53 PolarHBondContact O-N 3.48Å |
| 52 | G | 52.8 | Low | 59.3 | Low | 68 Ų | 68 | 128.9 Ų | 128.9 | 70% | 0.701 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | 1.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | L48 Q49 L50 | L48-G52 PolarHBondContact O-N 3.24Å; Q49-G52 PolarHBondContact O-N 3.43Å; L50-G52 VanDerWaalsContact C-N 3.34Å |
| 53 | S | 57.9 | Low | 57.3 | Low | 93 Ų | 93 | 129.9 Ų | 129.9 | 65% | 0.65 | 72% | 0.716 | S | S | * | * | trans | -124.1 | 34.1 | -166.7 | -47 | 0 | 0 | 0 | 0 | 114.4 | Q49 A51 | Q49-S53 PolarHBondContact O-OG 2.91Å; Q49-S53 VanDerWaalsContact O-OG 3.11Å; A51-S53 PolarHBondContact O-N 3.48Å | ||
| 54 | Q | 49.4 | Very low | 55.5 | Low | 180 Ų | 180 | 129.5 Ų | 129.5 | 84% | 0.841 | 72% | 0.722 | S | S | * | * | trans | -133 | 99.7 | 169.7 | -70.4 | -160.6 | 80.9 | 0 | 0 | 111.9 | ||||
| 55 | T | 42.5 | Very low | 53.5 | Low | 143 Ų | 143 | 126.1 Ų | 126.1 | 88% | 0.877 | 73% | 0.725 | S | S | * | * | trans | -60.1 | 134.7 | 154.7 | -54.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 56 | L | 47 | Very low | 51.7 | Low | 163 Ų | 163 | 128.7 Ų | 128.7 | 85% | 0.853 | 75% | 0.748 | S | S | * | * | trans | -58.1 | 146.6 | -175.1 | -62.3 | 164.7 | 0 | 0 | 0 | 114.6 | ||||
| 57 | L | 38.5 | Very low | 49.7 | Very low | 169 Ų | 169 | 128.9 Ų | 128.9 | 89% | 0.885 | 76% | 0.761 | S | S | * | * | trans | -141.6 | 156.5 | 153 | -90.6 | 175.9 | 0 | 0 | 0 | 110.2 | ||||
| 58 | P | 49.5 | Very low | 47.6 | Very low | 120 Ų | 120 | 132.1 Ų | 132.1 | 78% | 0.779 | 78% | 0.775 | S | S | * | * | trans | -115 | 137.1 | -134.8 | 34.6 | -19.2 | 0 | 0 | 0 | 112.3 | ||||
| 59 | G | 42.3 | Very low | 45.7 | Very low | 69 Ų | 69 | 134.8 Ų | 134.8 | 71% | 0.711 | 79% | 0.786 | S | S | * | * | trans | 153.7 | 72.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 60 | Q | 45.9 | Very low | 43.7 | Very low | 195 Ų | 195 | 137.4 Ų | 137.4 | 91% | 0.911 | 80% | 0.798 | S | S | * | * | trans | -179.4 | 85.5 | 149.3 | -100.5 | 166.9 | 107 | 0 | 0 | 107.7 | ||||
| 61 | Q | 38.4 | Very low | 42 | Very low | 180 Ų | 180 | 136.7 Ų | 136.7 | 84% | 0.841 | 80% | 0.804 | S | S | * | * | trans | -128.7 | 149.6 | 162.3 | -74.3 | -168.1 | 0.1 | 0 | 0 | 108.6 | ||||
| 62 | L | 37.7 | Very low | 40.6 | Very low | 154 Ų | 154 | 141.7 Ų | 141.7 | 81% | 0.806 | 81% | 0.814 | S | S | * | * | trans | 94 | 127 | 173 | -50.1 | 169.9 | 0 | 0 | 0 | 113.4 | ||||
| 63 | S | 35.9 | Very low | 40.4 | Very low | 118 Ų | 118 | 143.5 Ų | 143.5 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | cis | -144.1 | 150.8 | 44.2 | -76.7 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 64 | T | 41.1 | Very low | 39.8 | Very low | 116 Ų | 116 | 144.5 Ų | 144.5 | 71% | 0.712 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 153.1 | 164.6 | 41.9 | 0 | 0 | 0 | 0 | 116.1 | ||
| 65 | P | 36.1 | Very low | 38.8 | Very low | 120 Ų | 120 | 142.1 Ų | 142.1 | 78% | 0.779 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 147.6 | 156.7 | 34.3 | -29.4 | 0 | 0 | 0 | 111.6 | ||
| 66 | P | 41.8 | Very low | 38.4 | Very low | 122 Ų | 122 | 142.8 Ų | 142.8 | 79% | 0.792 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 148.4 | -175.8 | 35.6 | -32.2 | 0 | 0 | 0 | 113.4 | ||
| 67 | L | 38.1 | Very low | 37.7 | Very low | 174 Ų | 174 | 141.7 Ų | 141.7 | 91% | 0.911 | 80% | 0.804 | S | S | * | * | trans | -123.9 | 128 | 159.4 | -79.7 | 171.5 | 0 | 0 | 0 | 108.3 | ||||
| 68 | T | 30.3 | Very low | 37.3 | Very low | 129 Ų | 129 | 137.4 Ų | 137.4 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | -157.4 | 107.7 | 161.7 | -25.5 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 69 | M | 34.5 | Very low | 36.8 | Very low | 174 Ų | 174 | 136.5 Ų | 136.5 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | 45.6 | 122.8 | 91.1 | -67.3 | -86.7 | 149.2 | 0 | 0 | 112 | |||||
| 70 | E | 30.3 | Very low | 36.9 | Very low | 179 Ų | 179 | 139.5 Ų | 139.5 | 84% | 0.836 | 81% | 0.81 | S | S | * | * | -175.2 | 145 | 54.6 | -150.1 | 173.2 | 121.2 | 0 | 0 | 108.3 | |||||
| 71 | S | 30.5 | Very low | 36.2 | Very low | 121 Ų | 121 | 133.5 Ų | 133.5 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | 154.1 | 164 | 105.4 | 48.8 | 0 | 0 | 0 | 0 | 112 | |||||
| 72 | Q | 31.9 | Very low | 35.8 | Very low | 189 Ų | 189 | 130.5 Ų | 130.5 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | -100.9 | -169.7 | -151 | -125.1 | -167.2 | -26.4 | 0 | 0 | 115.6 | ||||
| 73 | P | 48.9 | Very low | 35.5 | Very low | 106 Ų | 106 | 126.2 Ų | 126.2 | 69% | 0.688 | 80% | 0.799 | S | S | * | * | trans | -105 | -170.9 | -136.8 | 47 | -32.4 | 0 | 0 | 0 | 115.9 | ||||
| 74 | P | 44.6 | Very low | 35.4 | Very low | 113 Ų | 113 | 129.5 Ų | 129.5 | 73% | 0.734 | 80% | 0.801 | S | S | * | * | -156.5 | 175.6 | 81 | 39.6 | -16.7 | 0 | 0 | 0 | 119.4 | |||||
| 75 | D | 28.1 | Very low | 35 | Very low | 130 Ų | 130 | 130.2 Ų | 130.2 | 70% | 0.695 | 80% | 0.801 | S | S | * | * | trans | 91.3 | 110.7 | 148.3 | -79.9 | -8.8 | 0 | 0 | 0 | 126.4 | ||||
| 76 | Q | 35.8 | Very low | 35 | Very low | 158 Ų | 158 | 134 Ų | 134 | 74% | 0.738 | 81% | 0.805 | S | S | * | * | 55.3 | 132.5 | 129.5 | -54.1 | -173.4 | 78.5 | 0 | 0 | 119.4 | |||||
| 77 | T | 30.7 | Very low | 34.5 | Very low | 140 Ų | 140 | 137.6 Ų | 137.6 | 86% | 0.859 | 81% | 0.812 | S | S | * | * | cis | -175.3 | 147.7 | 48.8 | -28.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 78 | G | 31.1 | Very low | 34.3 | Very low | 78 Ų | 78 | 138.9 Ų | 138.9 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | 139.7 | 92 | 157.7 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 79 | A | 38.3 | Very low | 34.5 | Very low | 101 Ų | 101 | 142.4 Ų | 142.4 | 84% | 0.835 | 82% | 0.817 | S | S | * | * | trans | -75 | 179 | 165.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 80 | P | 44.5 | Very low | 34.6 | Very low | 133 Ų | 133 | 140 Ų | 140 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | cis | -130.8 | 177.4 | 13.7 | 38.6 | -18.4 | 0 | 0 | 0 | 114.1 | ||||
| 81 | G | 31.1 | Very low | 34.7 | Very low | 69 Ų | 69 | 136.1 Ų | 136.1 | 71% | 0.711 | 81% | 0.813 | S | S | * | * | cis | 178.1 | 167.1 | 3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 82 | A | 30.6 | Very low | 34.6 | Very low | 116 Ų | 116 | 137.5 Ų | 137.5 | 96% | 0.959 | 81% | 0.811 | S | S | * | * | trans | 64.9 | 128.3 | 167 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 83 | G | 30.8 | Very low | 34.7 | Very low | 64 Ų | 64 | 135.3 Ų | 135.3 | 66% | 0.66 | 80% | 0.802 | S | S | * | * | cis | 169.5 | 119.4 | 0.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 84 | Q | 34.2 | Very low | 34 | Very low | 187 Ų | 187 | 138.1 Ų | 138.1 | 87% | 0.874 | 80% | 0.804 | S | S | * | * | 61.2 | 134 | 120.9 | -61.6 | 179.3 | -23.3 | 0 | 0 | 116.3 | |||||
| 85 | D | 33.3 | Very low | 33.4 | Very low | 132 Ų | 132 | 142.4 Ų | 142.4 | 71% | 0.706 | 81% | 0.814 | S | S | * | * | cis | -155.1 | 135.5 | 37.6 | -100.2 | -54.2 | 0 | 0 | 0 | 110.2 | ||||
| 86 | K | 34.6 | Very low | 33.6 | Very low | 200 Ų | 200 | 143.3 Ų | 143.3 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | 58.6 | 113.7 | 87.3 | -70.6 | -169.9 | 177.8 | -177.3 | 0 | 117.7 | |||||
| 87 | Q | 31.3 | Very low | 33.8 | Very low | 197 Ų | 197 | 144.5 Ų | 144.5 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | trans | -138.6 | 114.7 | 151.8 | -167.3 | 156.4 | 1.6 | 0 | 0 | 109.7 | ||||
| 88 | Q | 34.2 | Very low | 33.9 | Very low | 201 Ų | 201 | 146.2 Ų | 146.2 | 94% | 0.939 | 82% | 0.82 | S | S | * | * | trans | -136.1 | 141.5 | 165.8 | -86.1 | -173.5 | -13.6 | 0 | 0 | 110.3 | ||||
| 89 | K | 35.2 | Very low | 34 | Very low | 203 Ų | 203 | 149.9 Ų | 149.9 | 88% | 0.883 | 82% | 0.821 | S | S | * | * | trans | -95.4 | 139.4 | -177.1 | -175.4 | -175.2 | -175.7 | -173.5 | 0 | 109 | ||||
| 90 | P | 36.7 | Very low | 33.9 | Very low | 124 Ų | 124 | 152.5 Ų | 152.5 | 81% | 0.805 | 82% | 0.82 | S | S | * | * | trans | -93 | 145.7 | 178.2 | 34.7 | -30.2 | 0 | 0 | 0 | 111.8 | ||||
| 91 | A | 32.3 | Very low | 33.7 | Very low | 97 Ų | 97 | 152.1 Ų | 152.1 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | trans | -140.3 | 134 | 159.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 92 | N | 29.4 | Very low | 33.7 | Very low | 149 Ų | 149 | 158.3 Ų | 158.3 | 80% | 0.797 | 83% | 0.825 | S | S | * | * | trans | 79.5 | 113.4 | 156.1 | -153 | 23.3 | 0 | 0 | 0 | 118.5 | ||||
| 93 | M | 32.7 | Very low | 33.8 | Very low | 143 Ų | 143 | 156.7 Ų | 156.7 | 70% | 0.704 | 81% | 0.812 | S | S | * | * | -174.9 | 135 | 114.5 | -102.4 | -168.9 | 176.5 | 0 | 0 | 113.6 | |||||
| 94 | K | 33.6 | Very low | 33.9 | Very low | 166 Ų | 166 | 163 Ų | 163 | 72% | 0.722 | 82% | 0.824 | S | S | * | * | trans | 70.8 | 96.9 | 139.1 | -71.5 | 168.4 | 177.8 | 170.6 | 0 | 119.2 | ||||
| 95 | Q | 33.8 | Very low | 34.1 | Very low | 202 Ų | 202 | 162.2 Ų | 162.2 | 94% | 0.944 | 82% | 0.821 | S | S | * | * | trans | -62.3 | 131.3 | 136.9 | -67.5 | 169.1 | -49.5 | 0 | 0 | 109.2 | ||||
| 96 | N | 31.1 | Very low | 34.1 | Very low | 150 Ų | 150 | 164.4 Ų | 164.4 | 80% | 0.802 | 83% | 0.827 | S | S | * | * | trans | -121.6 | 131.2 | 162 | -156.6 | 21.5 | 0 | 0 | 0 | 108.6 | ||||
| 97 | K | 39.8 | Very low | 34.2 | Very low | 183 Ų | 183 | 164.1 Ų | 164.1 | 80% | 0.796 | 83% | 0.825 | S | S | * | * | trans | -80.3 | 131.2 | 176.6 | -89.8 | 171.7 | 161.1 | 178.1 | 0 | 109 | ||||
| 98 | E | 33.3 | Very low | 34.4 | Very low | 175 Ų | 175 | 163.9 Ų | 163.9 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | trans | -133.6 | 101 | 152.3 | -74 | -175.7 | 169.4 | 0 | 0 | 107.4 | ||||
| 99 | D | 32.9 | Very low | 34.5 | Very low | 156 Ų | 156 | 161.3 Ų | 161.3 | 83% | 0.834 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -103 | 116.9 | 160.3 | -88.3 | -51.6 | 0 | 0 | 0 | 106.1 | ||
| 100 | L | 35.9 | Very low | 34.7 | Very low | 155 Ų | 155 | 159.4 Ų | 159.4 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 156.2 | 163 | -105.8 | 89 | 0 | 0 | 0 | 110.1 | ||
| 101 | P | 40.2 | Very low | 35 | Very low | 125 Ų | 125 | 159.1 Ų | 159.1 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 169.8 | -158.1 | 36.1 | -36.2 | 0 | 0 | 0 | 114.8 | ||
| 102 | K | 31.6 | Very low | 36 | Very low | 199 Ų | 199 | 159.5 Ų | 159.5 | 87% | 0.865 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 140.3 | -174 | -177.8 | 175.6 | 179.5 | -176.1 | 0 | 113.4 | ||
| 103 | A | 33.8 | Very low | 36.8 | Very low | 83 Ų | 83 | 157.6 Ų | 157.6 | 69% | 0.686 | 79% | 0.787 | S | S | * | * | trans | 60.9 | 114.9 | 146.8 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 104 | E | 33 | Very low | 37.3 | Very low | 197 Ų | 197 | 156.4 Ų | 156.4 | 92% | 0.921 | 79% | 0.787 | S | S | * | * | trans | -120.5 | 117.4 | 138.7 | -70.7 | -171.1 | 163.7 | 0 | 0 | 108.6 | ||||
| 105 | E | 37 | Very low | 38.2 | Very low | 170 Ų | 170 | 155.5 Ų | 155.5 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | trans | -57.6 | 151.6 | 149.1 | -70.8 | 179.2 | 154.1 | 0 | 0 | 107.6 | ||||
| 106 | E | 34.9 | Very low | 39.1 | Very low | 178 Ų | 178 | 152.9 Ų | 152.9 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | cis | -169.9 | 146.7 | 38.3 | -142.5 | 174.5 | -165.9 | 0 | 0 | 108.3 | ||||
| 107 | K | 35.1 | Very low | 40 | Very low | 193 Ų | 193 | 151.4 Ų | 151.4 | 84% | 0.839 | 76% | 0.763 | S | S | * | * | trans | -75.6 | 138.8 | 172.9 | -101.5 | 170.9 | 165.8 | -178.1 | 0 | 110.8 | ||||
| 108 | K | 35.1 | Very low | 40.7 | Very low | 193 Ų | 193 | 148.2 Ų | 148.2 | 84% | 0.839 | 75% | 0.75 | S | S | * | * | trans | -164.2 | 134.3 | 142.4 | -101.4 | 169.5 | -167.6 | -175.5 | 0 | 104.8 | ||||
| 109 | E | 36.7 | Very low | 42 | Very low | 147 Ų | 147 | 147 Ų | 147 | 69% | 0.687 | 74% | 0.743 | S | S | * | * | cis | -170.3 | 148 | 28.9 | -162.9 | 151.9 | -154 | 0 | 0 | 105.9 | ||||
| 110 | E | 39.3 | Very low | 43.5 | Very low | 163 Ų | 163 | 145.9 Ų | 145.9 | 76% | 0.762 | 73% | 0.732 | S | S | * | * | trans | 52.8 | 109.7 | 151 | -67.1 | 175.7 | 177.8 | 0 | 0 | 120.6 | ||||
| 111 | V | 44.5 | Very low | 45 | Very low | 118 Ų | 118 | 143 Ų | 143 | 72% | 0.715 | 72% | 0.715 | S | S | * | * | -175.6 | 115.9 | 105.4 | 177.4 | 0 | 0 | 0 | 0 | 106.4 | |||||
| 112 | P | 52.4 | Low | 46.5 | Very low | 105 Ų | 105 | 140.1 Ų | 140.1 | 68% | 0.682 | 69% | 0.694 | S | S | * | * | trans | -83.8 | 166.9 | -176.2 | 34.4 | -30.9 | 0 | 0 | 0 | 110.7 | ||||
| 113 | V | 45.4 | Very low | 48.6 | Very low | 108 Ų | 108 | 135.1 Ų | 135.1 | 66% | 0.655 | 67% | 0.674 | S | S | * | * | S | Bend | trans | 97.5 | -21.9 | 164.2 | -167.5 | 0 | 0 | 0 | 0 | 118 | ||
| 114 | V | 44.7 | Very low | 50.6 | Low | 118 Ų | 118 | 136.8 Ų | 136.8 | 72% | 0.715 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -97.4 | -26.6 | 170.9 | -172.2 | 0 | 0 | 0 | 0 | 113.3 | ||
| 115 | K | 51.9 | Low | 52.6 | Low | 147 Ų | 147 | 134.8 Ų | 134.8 | 64% | 0.639 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -81.8 | -16.8 | -177.1 | -73.2 | 173.5 | 177.5 | 168.3 | 0 | 115.7 | K119 | K115-K119 WeakPolarHBondContact O-CB 3.31Å; K115-K119 WeakPolarHBondContact O-CG 3.31Å; K115-K119 PolarHBondContact O-N 3.25Å |
| 116 | E | 51.8 | Low | 54.6 | Low | 147 Ų | 147 | 132.3 Ų | 132.3 | 69% | 0.687 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -82 | -38.2 | -179.3 | -109.3 | 173.4 | 174.8 | 0 | 0 | 112.4 | E118 K119 Q120 | E116-E118 VanDerWaalsContact C-N 3.28Å; E116-K119 PolarHBondContact O-N 3.24Å; E116-Q120 PolarHBondContact O-N 3.06Å |
| 117 | L | 50.3 | Low | 56.5 | Low | 120 Ų | 120 | 128.8 Ų | 128.8 | 63% | 0.628 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -63.2 | -39 | 168.6 | -67.7 | 170.8 | 0 | 0 | 0 | 110.4 | E121 | L117-E121 WeakPolarHBondContact O-CB 3.44Å; L117-E121 PolarHBondContact O-N 3.3Å |
| 118 | E | 54.3 | Low | 58.8 | Low | 115 Ų | 115 | 122.8 Ų | 122.8 | 54% | 0.537 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -68.8 | -35.7 | 176.5 | -150.8 | 171.4 | -150.2 | 0 | 0 | 112.5 | E116 V122 | E116-E118 VanDerWaalsContact C-N 3.28Å; E118-V122 VanDerWaalsContact O-CB 3.32Å; E118-V122 WeakPolarHBondContact O-CB 3.4Å; E118-V122 WeakPolarHBondContact O-CG2 3.45Å; E118-V122 PolarHBondContact O-N 2.96Å |
| 119 | K | 61.7 | Low | 61.3 | Low | 151 Ų | 151 | 121.8 Ų | 121.8 | 66% | 0.657 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68.8 | -45.6 | 173.2 | -88.8 | -176.2 | 175.1 | -170 | 0 | 113.5 | K115 E116 E121 V122 E123 | K115-K119 WeakPolarHBondContact O-CB 3.31Å; K115-K119 WeakPolarHBondContact O-CG 3.31Å; K115-K119 PolarHBondContact O-N 3.25Å; E116-K119 PolarHBondContact O-N 3.24Å; K119-E121 VanDerWaalsContact C-N 3.28Å; K119-V122 PolarHBondContact O-N 2.98Å; K119-E123 WeakPolarHBondContact O-CB 3.4Å; K119-E123 PolarHBondContact O-N 3.49Å |
| 120 | Q | 63.6 | Low | 63.7 | Low | 131 Ų | 131 | 119.7 Ų | 119.7 | 61% | 0.612 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.4 | -39.1 | 174.4 | -101.8 | -177.4 | -9.8 | 0 | 0 | 110.8 | E116 E123 M124 | E116-Q120 PolarHBondContact O-N 3.06Å; Q120-E123 PolarHBondContact O-N 3.3Å; Q120-M124 WeakPolarHBondContact O-CB 3.4Å; Q120-M124 WeakPolarHBondContact O-CG 3.42Å; Q120-M124 PolarHBondContact O-N 3.44Å |
| 121 | E | 67.7 | Low | 66 | Low | 95 Ų | 95 | 118 Ų | 118 | 44% | 0.444 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.3 | -39.3 | 175.8 | -171.4 | 173.5 | -175.7 | 0 | 0 | 112 | L117 K119 M124 R125 | L117-E121 WeakPolarHBondContact O-CB 3.44Å; L117-E121 PolarHBondContact O-N 3.3Å; K119-E121 VanDerWaalsContact C-N 3.28Å; E121-M124 PolarHBondContact O-N 2.9Å; E121-R125 WeakPolarHBondContact O-CB 3.37Å; E121-R125 WeakPolarHBondContact O-CG 3.39Å; E121-R125 PolarHBondContact O-N 3.28Å; E121-R125 IonicContact OE1-CZ 3.55Å; E121-R125 IonicContact OE1-NE 2.79Å; E121-R125 IonicContact OE1-NH2 3.87Å; E121-R125 PolarHBondContact OE1-NH2 3.43Å |
| 122 | V | 71.9 | Confident | 68.1 | Low | 64 Ų | 64 | 118 Ų | 118 | 39% | 0.388 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -64.4 | -44.2 | 172.8 | 168 | 0 | 0 | 0 | 0 | 111.3 | E118 K119 M124 R125 E126 | E118-V122 VanDerWaalsContact O-CB 3.32Å; E118-V122 WeakPolarHBondContact O-CB 3.4Å; E118-V122 WeakPolarHBondContact O-CG2 3.45Å; E118-V122 PolarHBondContact O-N 2.96Å; K119-V122 PolarHBondContact O-N 2.98Å; V122-M124 PolarHBondContact O-N 3.06Å; V122-R125 PolarHBondContact O-N 2.91Å; V122-E126 HydrophobicContact CG1-CG 4.47Å; V122-E126 WeakPolarHBondContact O-CB 3.37Å; V122-E126 WeakPolarHBondContact O-CG 3.33Å; V122-E126 PolarHBondContact O-N 3.39Å |
| 123 | E | 75.7 | Confident | 69.9 | Low | 94 Ų | 94 | 117.3 Ų | 117.3 | 44% | 0.439 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.4 | -37.9 | 177.8 | -165.1 | -171.9 | 158.3 | 0 | 0 | 112 | K119 Q120 E126 K127 | K119-E123 WeakPolarHBondContact O-CB 3.4Å; K119-E123 PolarHBondContact O-N 3.49Å; Q120-E123 PolarHBondContact O-N 3.3Å; E123-E126 PolarHBondContact O-N 2.84Å; E123-K127 WeakPolarHBondContact O-CB 3.36Å; E123-K127 WeakPolarHBondContact O-CG 3.3Å; E123-K127 PolarHBondContact O-N 2.93Å; E123-K127 VanDerWaalsContact OE1-CE 3.23Å; E123-K127 WeakPolarHBondContact OE1-CE 3.47Å; E123-K127 IonicContact OE1-NZ 2.83Å; E123-K127 PolarHBondContact OE1-NZ 3.34Å |
| 124 | M | 75.1 | Confident | 72 | Confident | 119 Ų | 119 | 118.1 Ų | 118.1 | 59% | 0.586 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -67.6 | -39.1 | 174.9 | -71.4 | -67.1 | -72.6 | 0 | 0 | 111.8 | Q120 E121 V122 E126 T128 | Q120-M124 WeakPolarHBondContact O-CB 3.4Å; Q120-M124 WeakPolarHBondContact O-CG 3.42Å; Q120-M124 PolarHBondContact O-N 3.44Å; E121-M124 PolarHBondContact O-N 2.9Å; V122-M124 PolarHBondContact O-N 3.06Å; M124-E126 VanDerWaalsContact C-N 3.34Å; M124-T128 WeakPolarHBondContact O-CB 3.29Å; M124-T128 PolarHBondContact O-N 3.42Å; M124-T128 PolarHBondContact O-OG1 2.98Å |
| 125 | R | 75.3 | Confident | 74.3 | Confident | 154 Ų | 154 | 118.5 Ų | 118.5 | 58% | 0.581 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -64.8 | -38.7 | 172.1 | -73.4 | 170.7 | -177.2 | 179.6 | 4.1 | 111.4 | E121 V122 R129 | E121-R125 WeakPolarHBondContact O-CB 3.37Å; E121-R125 WeakPolarHBondContact O-CG 3.39Å; E121-R125 PolarHBondContact O-N 3.28Å; E121-R125 IonicContact OE1-CZ 3.55Å; E121-R125 IonicContact OE1-NE 2.79Å; E121-R125 IonicContact OE1-NH2 3.87Å; E121-R125 PolarHBondContact OE1-NH2 3.43Å; V122-R125 PolarHBondContact O-N 2.91Å; R125-R129 VanDerWaalsContact O-CB 3.31Å; R125-R129 WeakPolarHBondContact O-CB 3.25Å; R125-R129 PolarHBondContact O-N 3.41Å |
| 126 | E | 78.4 | Confident | 76.2 | Confident | 118 Ų | 118 | 116.8 Ų | 116.8 | 55% | 0.551 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -69.1 | -42.8 | 176.6 | -75.8 | -178.4 | 173 | 0 | 0 | 112.6 | V122 E123 M124 T128 R129 L130 | V122-E126 HydrophobicContact CG1-CG 4.47Å; V122-E126 WeakPolarHBondContact O-CB 3.37Å; V122-E126 WeakPolarHBondContact O-CG 3.33Å; V122-E126 PolarHBondContact O-N 3.39Å; E123-E126 PolarHBondContact O-N 2.84Å; M124-E126 VanDerWaalsContact C-N 3.34Å; E126-T128 VanDerWaalsContact C-N 3.35Å; E126-T128 PolarHBondContact O-N 3.23Å; E126-R129 PolarHBondContact O-N 2.89Å; E126-L130 WeakPolarHBondContact O-CB 3.47Å; E126-L130 PolarHBondContact O-N 3.44Å |
| 127 | K | 75.6 | Confident | 78.2 | Confident | 105 Ų | 105 | 115.4 Ų | 115.4 | 46% | 0.457 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.7 | -45.3 | 172.8 | -76.5 | 174.2 | -175.1 | 162.3 | 0 | 111.4 | E123 R129 L130 E131 | E123-K127 WeakPolarHBondContact O-CB 3.36Å; E123-K127 WeakPolarHBondContact O-CG 3.3Å; E123-K127 PolarHBondContact O-N 2.93Å; E123-K127 VanDerWaalsContact OE1-CE 3.23Å; E123-K127 WeakPolarHBondContact OE1-CE 3.47Å; E123-K127 IonicContact OE1-NZ 2.83Å; E123-K127 PolarHBondContact OE1-NZ 3.34Å; K127-R129 VanDerWaalsContact C-N 3.34Å; K127-R129 PolarHBondContact O-N 2.92Å; K127-L130 PolarHBondContact O-N 2.94Å; K127-E131 WeakPolarHBondContact O-CB 3.43Å; K127-E131 WeakPolarHBondContact O-CG 3.38Å; K127-E131 PolarHBondContact O-N 3.41Å |
| 128 | T | 84.1 | Confident | 80.3 | Confident | 67 Ų | 67 | 115.6 Ų | 115.6 | 41% | 0.411 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.9 | -41.2 | 176.1 | -53 | 0 | 0 | 0 | 0 | 111.7 | M124 E126 Q132 | M124-T128 WeakPolarHBondContact O-CB 3.29Å; M124-T128 PolarHBondContact O-N 3.42Å; M124-T128 PolarHBondContact O-OG1 2.98Å; E126-T128 VanDerWaalsContact C-N 3.35Å; E126-T128 PolarHBondContact O-N 3.23Å; T128-Q132 WeakPolarHBondContact O-CG 3.29Å; T128-Q132 PolarHBondContact O-N 3.49Å |
| 129 | R | 87.9 | Confident | 82.2 | Confident | 172 Ų | 172 | 113.6 Ų | 113.6 | 65% | 0.649 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.3 | -39.9 | 176.1 | -174.3 | -178.8 | 179.5 | -171.6 | 0.4 | 111.9 | R125 E126 K127 Q132 L133 | R125-R129 VanDerWaalsContact O-CB 3.31Å; R125-R129 WeakPolarHBondContact O-CB 3.25Å; R125-R129 PolarHBondContact O-N 3.41Å; E126-R129 PolarHBondContact O-N 2.89Å; K127-R129 VanDerWaalsContact C-N 3.34Å; K127-R129 PolarHBondContact O-N 2.92Å; R129-Q132 PolarHBondContact O-N 3.26Å; R129-L133 HydrophobicContact CG-CD1 4.5Å; R129-L133 VanDerWaalsContact O-CG 3.31Å; R129-L133 WeakPolarHBondContact O-CG 3.35Å; R129-L133 PolarHBondContact O-N 2.89Å |
| 130 | L | 85.2 | Confident | 83.8 | Confident | 103 Ų | 103 | 111 Ų | 111 | 54% | 0.539 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.2 | -41.8 | 177.8 | -133 | 110 | 0 | 0 | 0 | 111.4 | E126 K127 L133 Q134 | E126-L130 WeakPolarHBondContact O-CB 3.47Å; E126-L130 PolarHBondContact O-N 3.44Å; K127-L130 PolarHBondContact O-N 2.94Å; L130-L133 PolarHBondContact O-N 2.94Å; L130-Q134 WeakPolarHBondContact O-CG 3.3Å; L130-Q134 PolarHBondContact O-N 2.92Å |
| 131 | E | 88.3 | Confident | 85.2 | Confident | 128 Ų | 128 | 110.3 Ų | 110.3 | 60% | 0.598 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.8 | -41.2 | 174.5 | -75.8 | 176 | 178.6 | 0 | 0 | 111.8 | K127 Q134 H135 | K127-E131 WeakPolarHBondContact O-CB 3.43Å; K127-E131 WeakPolarHBondContact O-CG 3.38Å; K127-E131 PolarHBondContact O-N 3.41Å; E131-Q134 PolarHBondContact O-N 3.49Å; E131-H135 WeakPolarHBondContact O-CB 3.48Å; E131-H135 PolarHBondContact O-N 3.34Å |
| 132 | Q | 88.6 | Confident | 86.5 | Confident | 116 Ų | 116 | 110.9 Ų | 110.9 | 54% | 0.542 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 172.7 | -80.3 | 173.5 | -2.6 | 0 | 0 | 111.8 | T128 R129 Q134 H135 E136 | T128-Q132 WeakPolarHBondContact O-CG 3.29Å; T128-Q132 PolarHBondContact O-N 3.49Å; R129-Q132 PolarHBondContact O-N 3.26Å; Q132-Q134 VanDerWaalsContact C-N 3.34Å; Q132-Q134 PolarHBondContact O-N 3.41Å; Q132-H135 PolarHBondContact O-N 2.81Å; Q132-E136 WeakPolarHBondContact O-CB 3.24Å; Q132-E136 WeakPolarHBondContact O-CG 3.39Å; Q132-E136 PolarHBondContact O-N 2.99Å |
| 133 | L | 89.8 | Confident | 87.6 | Confident | 92 Ų | 92 | 116.7 Ų | 116.7 | 48% | 0.482 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.6 | -40 | 177.5 | -71.2 | 169.9 | 0 | 0 | 0 | 112.3 | R129 L130 E136 Q137 | R129-L133 HydrophobicContact CG-CD1 4.5Å; R129-L133 VanDerWaalsContact O-CG 3.31Å; R129-L133 WeakPolarHBondContact O-CG 3.35Å; R129-L133 PolarHBondContact O-N 2.89Å; L130-L133 PolarHBondContact O-N 2.94Å; L133-E136 PolarHBondContact O-N 3.44Å; L133-Q137 VanDerWaalsContact O-CB 3.29Å; L133-Q137 WeakPolarHBondContact O-CB 3.19Å; L133-Q137 PolarHBondContact O-N 3.44Å |
| 134 | Q | 90.2 | Very high | 88.6 | Confident | 124 Ų | 124 | 116.1 Ų | 116.1 | 58% | 0.579 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65.2 | -40.9 | 174.8 | -75 | -178 | -6 | 0 | 0 | 111.9 | L130 E131 Q132 Q137 K138 | L130-Q134 WeakPolarHBondContact O-CG 3.3Å; L130-Q134 PolarHBondContact O-N 2.92Å; E131-Q134 PolarHBondContact O-N 3.49Å; Q132-Q134 VanDerWaalsContact C-N 3.34Å; Q132-Q134 PolarHBondContact O-N 3.41Å; Q134-Q137 PolarHBondContact O-N 2.96Å; Q134-K138 WeakPolarHBondContact O-CB 3.4Å; Q134-K138 PolarHBondContact O-N 3.36Å |
| 135 | H | 92.6 | Very high | 89.6 | Confident | 127 Ų | 127 | 118 Ų | 118 | 59% | 0.588 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.6 | -47.5 | 175.8 | -173.9 | 67.7 | 0 | 0 | 0 | 111.4 | E131 Q132 Q137 K138 V139 | E131-H135 WeakPolarHBondContact O-CB 3.48Å; E131-H135 PolarHBondContact O-N 3.34Å; Q132-H135 PolarHBondContact O-N 2.81Å; H135-Q137 PolarHBondContact O-N 3.1Å; H135-K138 PolarHBondContact O-N 2.89Å; H135-V139 WeakPolarHBondContact O-CG2 3.49Å; H135-V139 PolarHBondContact O-N 2.99Å |
| 136 | E | 92.5 | Very high | 90.6 | Very high | 111 Ų | 111 | 116.9 Ų | 116.9 | 52% | 0.519 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59.7 | -44.7 | 175.9 | -74.7 | 177.6 | -180 | 0 | 0 | 111.8 | Q132 L133 K138 V139 I140 | Q132-E136 WeakPolarHBondContact O-CB 3.24Å; Q132-E136 WeakPolarHBondContact O-CG 3.39Å; Q132-E136 PolarHBondContact O-N 2.99Å; L133-E136 PolarHBondContact O-N 3.44Å; E136-K138 VanDerWaalsContact C-N 3.35Å; E136-K138 PolarHBondContact O-N 2.9Å; E136-V139 PolarHBondContact O-N 3.15Å; E136-I140 VanDerWaalsContact O-CG1 3.25Å; E136-I140 WeakPolarHBondContact O-CG1 3.47Å; E136-I140 PolarHBondContact O-N 3.37Å |
| 137 | Q | 93.6 | Very high | 91.5 | Very high | 118 Ų | 118 | 114.3 Ų | 114.3 | 55% | 0.551 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.6 | -43.2 | 177.9 | -173.2 | 154.8 | 33.7 | 0 | 0 | 111.8 | L133 Q134 H135 V139 I140 E141 | L133-Q137 VanDerWaalsContact O-CB 3.29Å; L133-Q137 WeakPolarHBondContact O-CB 3.19Å; L133-Q137 PolarHBondContact O-N 3.44Å; Q134-Q137 PolarHBondContact O-N 2.96Å; H135-Q137 PolarHBondContact O-N 3.1Å; Q137-V139 PolarHBondContact O-N 3.02Å; Q137-I140 PolarHBondContact O-N 3.37Å; Q137-E141 WeakPolarHBondContact O-CG 3.47Å; Q137-E141 PolarHBondContact O-N 2.98Å |
| 138 | K | 94.6 | Very high | 92.5 | Very high | 123 Ų | 123 | 116.5 Ų | 116.5 | 54% | 0.535 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.7 | -43 | 175.5 | -173.1 | 177.3 | 179.1 | -177.5 | 0 | 112.1 | Q134 H135 E136 I140 E141 E142 | Q134-K138 WeakPolarHBondContact O-CB 3.4Å; Q134-K138 PolarHBondContact O-N 3.36Å; H135-K138 PolarHBondContact O-N 2.89Å; E136-K138 VanDerWaalsContact C-N 3.35Å; E136-K138 PolarHBondContact O-N 2.9Å; K138-I140 VanDerWaalsContact C-N 3.33Å; K138-I140 PolarHBondContact O-N 3.42Å; K138-E141 PolarHBondContact O-N 3.39Å; K138-E142 WeakPolarHBondContact CE-OE1 3.38Å; K138-E142 WeakPolarHBondContact O-CG 3.31Å; K138-E142 PolarHBondContact O-N 2.92Å |
| 139 | V | 94.4 | Very high | 93.2 | Very high | 73 Ų | 73 | 116.1 Ų | 116.1 | 44% | 0.442 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.6 | -40.8 | 175.8 | 171.5 | 0 | 0 | 0 | 0 | 111.2 | H135 E136 Q137 R143 | H135-V139 WeakPolarHBondContact O-CG2 3.49Å; H135-V139 PolarHBondContact O-N 2.99Å; E136-V139 PolarHBondContact O-N 3.15Å; Q137-V139 PolarHBondContact O-N 3.02Å; V139-R143 WeakPolarHBondContact O-CB 3.37Å; V139-R143 PolarHBondContact O-N 3.12Å |
| 140 | I | 94 | Very high | 93.6 | Very high | 96 Ų | 96 | 113.3 Ų | 113.3 | 49% | 0.492 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64.9 | -42.8 | 176.4 | -69.1 | 164.7 | 0 | 0 | 0 | 111.1 | E136 Q137 K138 R143 N144 | E136-I140 VanDerWaalsContact O-CG1 3.25Å; E136-I140 WeakPolarHBondContact O-CG1 3.47Å; E136-I140 PolarHBondContact O-N 3.37Å; Q137-I140 PolarHBondContact O-N 3.37Å; K138-I140 VanDerWaalsContact C-N 3.33Å; K138-I140 PolarHBondContact O-N 3.42Å; I140-R143 PolarHBondContact O-N 3.23Å; I140-N144 VanDerWaalsContact O-CB 3.3Å; I140-N144 WeakPolarHBondContact O-CB 3.31Å; I140-N144 PolarHBondContact O-N 3.07Å; I140-N144 PolarHBondContact O-ND2 3.11Å |
| 141 | E | 94.4 | Very high | 94.2 | Very high | 118 Ų | 118 | 113.2 Ų | 113.2 | 55% | 0.551 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -63.3 | -44.5 | 177.3 | -76.2 | 177.9 | -174.5 | 0 | 0 | 112.2 | Q137 K138 N144 K145 | Q137-E141 WeakPolarHBondContact O-CG 3.47Å; Q137-E141 PolarHBondContact O-N 2.98Å; K138-E141 PolarHBondContact O-N 3.39Å; E141-N144 PolarHBondContact O-N 3.09Å; E141-K145 WeakPolarHBondContact O-CB 3.4Å; E141-K145 PolarHBondContact O-N 3.31Å |
| 142 | E | 95.4 | Very high | 94.6 | Very high | 107 Ų | 107 | 110 Ų | 110 | 50% | 0.5 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.9 | -44.1 | 176.1 | -73.2 | 179.1 | -175.9 | 0 | 0 | 111.2 | K138 K145 L146 | K138-E142 WeakPolarHBondContact CE-OE1 3.38Å; K138-E142 WeakPolarHBondContact O-CG 3.31Å; K138-E142 PolarHBondContact O-N 2.92Å; E142-K145 WeakPolarHBondContact O-CB 3.44Å; E142-K145 PolarHBondContact O-N 3.42Å; E142-L146 WeakPolarHBondContact O-CG 3.36Å; E142-L146 PolarHBondContact O-N 3.31Å |
| 143 | R | 93.8 | Very high | 95 | Very high | 186 Ų | 186 | 111.4 Ų | 111.4 | 70% | 0.702 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.7 | -45.9 | 174.6 | -170.8 | -177.4 | 179.5 | 108.3 | -0.9 | 111.6 | V139 I140 K145 L146 T147 | V139-R143 WeakPolarHBondContact O-CB 3.37Å; V139-R143 PolarHBondContact O-N 3.12Å; I140-R143 PolarHBondContact O-N 3.23Å; R143-K145 VanDerWaalsContact C-N 3.31Å; R143-K145 PolarHBondContact O-N 3.33Å; R143-L146 PolarHBondContact O-N 3.42Å; R143-T147 PolarHBondContact O-N 2.99Å; R143-T147 PolarHBondContact O-OG1 2.97Å; R143-T147 VanDerWaalsContact O-OG1 3.06Å |
| 144 | N | 96.2 | Very high | 95.4 | Very high | 81 Ų | 81 | 110.3 Ų | 110.3 | 43% | 0.433 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.9 | -36.5 | 177.6 | -82.1 | -25.4 | 0 | 0 | 0 | 112.3 | I140 E141 T147 K148 | I140-N144 VanDerWaalsContact O-CB 3.3Å; I140-N144 WeakPolarHBondContact O-CB 3.31Å; I140-N144 PolarHBondContact O-N 3.07Å; I140-N144 PolarHBondContact O-ND2 3.11Å; E141-N144 PolarHBondContact O-N 3.09Å; N144-T147 PolarHBondContact O-N 3.11Å; N144-K148 VanDerWaalsContact O-CB 3.29Å; N144-K148 WeakPolarHBondContact O-CB 3.34Å; N144-K148 VanDerWaalsContact O-CG 3.24Å; N144-K148 WeakPolarHBondContact O-CG 3.33Å; N144-K148 PolarHBondContact O-N 3.07Å |
| 145 | K | 97.3 | Very high | 95.7 | Very high | 160 Ų | 160 | 110 Ų | 110 | 70% | 0.696 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -62 | -45.3 | 174.7 | -176.4 | 179.1 | 179.3 | -177.8 | 0 | 110.8 | E141 E142 R143 A149 | E141-K145 WeakPolarHBondContact O-CB 3.4Å; E141-K145 PolarHBondContact O-N 3.31Å; E142-K145 WeakPolarHBondContact O-CB 3.44Å; E142-K145 PolarHBondContact O-N 3.42Å; R143-K145 VanDerWaalsContact C-N 3.31Å; R143-K145 PolarHBondContact O-N 3.33Å; K145-A149 WeakPolarHBondContact O-CB 3.47Å; K145-A149 PolarHBondContact O-N 3.29Å |
| 146 | L | 96.3 | Very high | 96 | Very high | 129 Ų | 129 | 106.9 Ų | 106.9 | 68% | 0.675 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -63.9 | -46.2 | 175.6 | -67.3 | 173.9 | 0 | 0 | 0 | 111.8 | E142 R143 A149 L150 | E142-L146 WeakPolarHBondContact O-CG 3.36Å; E142-L146 PolarHBondContact O-N 3.31Å; R143-L146 PolarHBondContact O-N 3.42Å; L146-A149 PolarHBondContact O-N 2.85Å; L146-L150 WeakPolarHBondContact O-CB 3.4Å; L146-L150 PolarHBondContact O-N 3.16Å |
| 147 | T | 96.4 | Very high | 96.2 | Very high | 65 Ų | 65 | 106.9 Ų | 106.9 | 40% | 0.399 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 178.1 | -54.9 | 0 | 0 | 0 | 0 | 111.8 | R143 N144 A149 L150 L151 | R143-T147 PolarHBondContact O-N 2.99Å; R143-T147 PolarHBondContact O-OG1 2.97Å; R143-T147 VanDerWaalsContact O-OG1 3.06Å; N144-T147 PolarHBondContact O-N 3.11Å; T147-A149 PolarHBondContact O-N 3.4Å; T147-L150 PolarHBondContact O-N 2.99Å; T147-L151 HydrophobicContact CG2-CD1 4.17Å; T147-L151 WeakPolarHBondContact O-CB 3.36Å; T147-L151 VanDerWaalsContact O-CG 3.3Å; T147-L151 WeakPolarHBondContact O-CG 3.48Å; T147-L151 PolarHBondContact O-N 2.89Å |
| 148 | K | 97.8 | Very high | 96.4 | Very high | 151 Ų | 151 | 107.2 Ų | 107.2 | 66% | 0.657 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -61.2 | -43.6 | 175.2 | -76.6 | 175.8 | -178.3 | 178.5 | 0 | 111.8 | N144 L151 A152 | N144-K148 VanDerWaalsContact O-CB 3.29Å; N144-K148 WeakPolarHBondContact O-CB 3.34Å; N144-K148 VanDerWaalsContact O-CG 3.24Å; N144-K148 WeakPolarHBondContact O-CG 3.33Å; N144-K148 PolarHBondContact O-N 3.07Å; K148-L151 PolarHBondContact O-N 2.83Å; K148-A152 WeakPolarHBondContact O-CB 3.49Å; K148-A152 PolarHBondContact O-N 3.15Å |
| 149 | A | 97.1 | Very high | 96.5 | Very high | 58 Ų | 58 | 104.9 Ų | 104.9 | 48% | 0.479 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.6 | -42.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | K145 L146 T147 A152 K153 | K145-A149 WeakPolarHBondContact O-CB 3.47Å; K145-A149 PolarHBondContact O-N 3.29Å; L146-A149 PolarHBondContact O-N 2.85Å; T147-A149 PolarHBondContact O-N 3.4Å; A149-A152 PolarHBondContact O-N 3.38Å; A149-K153 WeakPolarHBondContact O-CB 3.41Å; A149-K153 PolarHBondContact O-N 3.33Å |
| 150 | L | 96.9 | Very high | 96.6 | Very high | 113 Ų | 113 | 108.8 Ų | 108.8 | 59% | 0.592 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -62.7 | -45.7 | 175.9 | -176.8 | 63.2 | 0 | 0 | 0 | 111.5 | L146 T147 K153 T154 | L146-L150 WeakPolarHBondContact O-CB 3.4Å; L146-L150 PolarHBondContact O-N 3.16Å; T147-L150 PolarHBondContact O-N 2.99Å; L150-K153 PolarHBondContact O-N 3.35Å; L150-T154 PolarHBondContact O-N 2.97Å; L150-T154 PolarHBondContact O-OG1 2.94Å; L150-T154 VanDerWaalsContact O-OG1 3.1Å |
| 151 | L | 97.5 | Very high | 96.8 | Very high | 102 Ų | 102 | 108.3 Ų | 108.3 | 53% | 0.534 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.6 | -45.9 | 176.4 | -72.8 | 171.2 | 0 | 0 | 0 | 111.8 | T147 K148 K153 T154 I155 | T147-L151 HydrophobicContact CG2-CD1 4.17Å; T147-L151 WeakPolarHBondContact O-CB 3.36Å; T147-L151 VanDerWaalsContact O-CG 3.3Å; T147-L151 WeakPolarHBondContact O-CG 3.48Å; T147-L151 PolarHBondContact O-N 2.89Å; K148-L151 PolarHBondContact O-N 2.83Å; L151-K153 VanDerWaalsContact C-N 3.31Å; L151-K153 PolarHBondContact O-N 2.94Å; L151-T154 PolarHBondContact O-N 2.89Å; L151-I155 VanDerWaalsContact O-CG1 3.31Å; L151-I155 WeakPolarHBondContact O-CG1 3.44Å; L151-I155 PolarHBondContact O-N 3.25Å |
| 152 | A | 97.5 | Very high | 97 | Very high | 59 Ų | 59 | 106.9 Ų | 106.9 | 49% | 0.488 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.1 | -41.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | K148 A149 I155 A156 | K148-A152 WeakPolarHBondContact O-CB 3.49Å; K148-A152 PolarHBondContact O-N 3.15Å; A149-A152 PolarHBondContact O-N 3.38Å; A152-I155 PolarHBondContact O-N 3.45Å; A152-A156 WeakPolarHBondContact O-CB 3.42Å; A152-A156 PolarHBondContact O-N 2.86Å |
| 153 | K | 97.1 | Very high | 97.1 | Very high | 146 Ų | 146 | 107.8 Ų | 107.8 | 64% | 0.635 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.2 | -46.5 | 175.1 | -171.8 | -177.5 | 177.7 | -174.9 | 0 | 111.5 | A149 L150 L151 A156 E157 | A149-K153 WeakPolarHBondContact O-CB 3.41Å; A149-K153 PolarHBondContact O-N 3.33Å; L150-K153 PolarHBondContact O-N 3.35Å; L151-K153 VanDerWaalsContact C-N 3.31Å; L151-K153 PolarHBondContact O-N 2.94Å; K153-A156 PolarHBondContact O-N 3.25Å; K153-E157 WeakPolarHBondContact O-CB 3.45Å; K153-E157 PolarHBondContact O-N 3.02Å |
| 154 | T | 97.6 | Very high | 97.2 | Very high | 69 Ų | 69 | 101.4 Ų | 101.4 | 42% | 0.423 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 178.1 | -56.7 | 0 | 0 | 0 | 0 | 112 | L150 L151 E157 K158 | L150-T154 PolarHBondContact O-N 2.97Å; L150-T154 PolarHBondContact O-OG1 2.94Å; L150-T154 VanDerWaalsContact O-OG1 3.1Å; L151-T154 PolarHBondContact O-N 2.89Å; T154-E157 PolarHBondContact O-N 3.01Å; T154-K158 HydrophobicContact CG2-CG 4.44Å; T154-K158 WeakPolarHBondContact O-CB 3.46Å; T154-K158 VanDerWaalsContact O-CG 3.31Å; T154-K158 WeakPolarHBondContact O-CG 3.4Å; T154-K158 PolarHBondContact O-N 3.29Å |
| 155 | I | 97.8 | Very high | 97.3 | Very high | 118 Ų | 118 | 103 Ų | 103 | 61% | 0.605 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.2 | -44.9 | 176.4 | -69 | 166.9 | 0 | 0 | 0 | 110.6 | L151 A152 E157 K158 S159 | L151-I155 VanDerWaalsContact O-CG1 3.31Å; L151-I155 WeakPolarHBondContact O-CG1 3.44Å; L151-I155 PolarHBondContact O-N 3.25Å; A152-I155 PolarHBondContact O-N 3.45Å; I155-E157 PolarHBondContact O-N 3.02Å; I155-K158 PolarHBondContact O-N 2.9Å; I155-S159 WeakPolarHBondContact O-CB 3.28Å; I155-S159 PolarHBondContact O-N 3.18Å |
| 156 | A | 97.1 | Very high | 97.3 | Very high | 61 Ų | 61 | 97.2 Ų | 97.2 | 50% | 0.504 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.4 | -40.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A152 K153 S159 K160 | A152-A156 WeakPolarHBondContact O-CB 3.42Å; A152-A156 PolarHBondContact O-N 2.86Å; K153-A156 PolarHBondContact O-N 3.25Å; A156-S159 PolarHBondContact O-N 3.44Å; A156-K160 WeakPolarHBondContact O-CB 3.44Å; A156-K160 PolarHBondContact O-N 3.48Å |
| 157 | E | 97.1 | Very high | 97.4 | Very high | 111 Ų | 111 | 94.7 Ų | 94.7 | 52% | 0.519 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.4 | -45.8 | 177 | -179.4 | 153.2 | -149.8 | 0 | 0 | 112.2 | K153 T154 I155 S159 K160 Q161 | K153-E157 WeakPolarHBondContact O-CB 3.45Å; K153-E157 PolarHBondContact O-N 3.02Å; T154-E157 PolarHBondContact O-N 3.01Å; I155-E157 PolarHBondContact O-N 3.02Å; E157-S159 VanDerWaalsContact C-N 3.35Å; E157-S159 PolarHBondContact O-N 3.33Å; E157-K160 PolarHBondContact O-N 3.24Å; E157-Q161 WeakPolarHBondContact O-CG 3.24Å; E157-Q161 PolarHBondContact O-N 3.49Å |
| 158 | K | 97.8 | Very high | 97.5 | Very high | 126 Ų | 126 | 98.2 Ų | 98.2 | 55% | 0.548 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 173.7 | -72.2 | -71.1 | -176.1 | 174.5 | 0 | 111.6 | T154 I155 K160 Q161 T162 | T154-K158 HydrophobicContact CG2-CG 4.44Å; T154-K158 WeakPolarHBondContact O-CB 3.46Å; T154-K158 VanDerWaalsContact O-CG 3.31Å; T154-K158 WeakPolarHBondContact O-CG 3.4Å; T154-K158 PolarHBondContact O-N 3.29Å; I155-K158 PolarHBondContact O-N 2.9Å; K158-K160 VanDerWaalsContact C-N 3.34Å; K158-K160 PolarHBondContact O-N 3.42Å; K158-Q161 PolarHBondContact O-N 3.45Å; K158-T162 PolarHBondContact O-N 2.81Å; K158-T162 PolarHBondContact O-OG1 2.89Å; K158-T162 VanDerWaalsContact O-OG1 3.07Å |
| 159 | S | 96.8 | Very high | 97.5 | Very high | 73 Ų | 73 | 96.2 Ų | 96.2 | 51% | 0.51 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.5 | -43.5 | 175.3 | 179.1 | 0 | 0 | 0 | 0 | 111.9 | I155 A156 E157 T162 Q163 | I155-S159 WeakPolarHBondContact O-CB 3.28Å; I155-S159 PolarHBondContact O-N 3.18Å; A156-S159 PolarHBondContact O-N 3.44Å; E157-S159 VanDerWaalsContact C-N 3.35Å; E157-S159 PolarHBondContact O-N 3.33Å; S159-T162 PolarHBondContact O-N 3.2Å; S159-Q163 WeakPolarHBondContact O-CB 3.44Å; S159-Q163 PolarHBondContact O-N 3.05Å |
| 160 | K | 97.8 | Very high | 97.6 | Very high | 156 Ų | 156 | 100 Ų | 100 | 68% | 0.678 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.1 | -42.5 | 175.4 | -175.5 | -178.6 | 178.8 | -177 | 0 | 112.1 | A156 E157 K158 Q163 A164 | A156-K160 WeakPolarHBondContact O-CB 3.44Å; A156-K160 PolarHBondContact O-N 3.48Å; E157-K160 PolarHBondContact O-N 3.24Å; K158-K160 VanDerWaalsContact C-N 3.34Å; K158-K160 PolarHBondContact O-N 3.42Å; K160-Q163 PolarHBondContact O-N 3.17Å; K160-A164 PolarHBondContact O-N 3.45Å |
| 161 | Q | 97.4 | Very high | 97.7 | Very high | 86 Ų | 86 | 102.7 Ų | 102.7 | 40% | 0.402 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.8 | -49.5 | 175.5 | -71.9 | 172.6 | 2.7 | 0 | 0 | 110.9 | E157 K158 Q163 A164 E165 | E157-Q161 WeakPolarHBondContact O-CG 3.24Å; E157-Q161 PolarHBondContact O-N 3.49Å; K158-Q161 PolarHBondContact O-N 3.45Å; Q161-Q163 VanDerWaalsContact C-N 3.31Å; Q161-Q163 PolarHBondContact O-N 3.42Å; Q161-A164 PolarHBondContact O-N 2.99Å; Q161-A164 VanDerWaalsContact O-N 3.15Å; Q161-E165 PolarHBondContact O-N 3.44Å |
| 162 | T | 97.8 | Very high | 97.7 | Very high | 88 Ų | 88 | 102.2 Ų | 102.2 | 54% | 0.54 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -59.6 | -40.2 | 176.5 | -56.4 | 0 | 0 | 0 | 0 | 112.1 | K158 S159 E165 A166 | K158-T162 PolarHBondContact O-N 2.81Å; K158-T162 PolarHBondContact O-OG1 2.89Å; K158-T162 VanDerWaalsContact O-OG1 3.07Å; S159-T162 PolarHBondContact O-N 3.2Å; T162-E165 PolarHBondContact O-N 3.17Å; T162-A166 WeakPolarHBondContact O-CB 3.47Å; T162-A166 PolarHBondContact O-N 3.18Å |
| 163 | Q | 97.4 | Very high | 97.7 | Very high | 126 Ų | 126 | 105.6 Ų | 105.6 | 59% | 0.589 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.8 | -40.9 | 176.7 | -169.7 | 179.8 | 15.1 | 0 | 0 | 111.9 | S159 K160 Q161 A166 V167 | S159-Q163 WeakPolarHBondContact O-CB 3.44Å; S159-Q163 PolarHBondContact O-N 3.05Å; K160-Q163 PolarHBondContact O-N 3.17Å; Q161-Q163 VanDerWaalsContact C-N 3.31Å; Q161-Q163 PolarHBondContact O-N 3.42Å; Q163-A166 PolarHBondContact O-N 2.91Å; Q163-V167 WeakPolarHBondContact O-CG2 3.31Å; Q163-V167 PolarHBondContact O-N 3.31Å |
| 164 | A | 97.1 | Very high | 97.8 | Very high | 51 Ų | 51 | 106.2 Ų | 106.2 | 42% | 0.421 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | K160 Q161 V167 K168 | K160-A164 PolarHBondContact O-N 3.45Å; Q161-A164 PolarHBondContact O-N 2.99Å; Q161-A164 VanDerWaalsContact O-N 3.15Å; A164-V167 PolarHBondContact O-N 2.97Å; A164-K168 WeakPolarHBondContact O-CG 3.35Å; A164-K168 PolarHBondContact O-N 3.22Å; A164-K168 VanDerWaalsContact O-N 3.11Å |
| 165 | E | 97.8 | Very high | 97.8 | Very high | 114 Ų | 114 | 107.5 Ų | 107.5 | 53% | 0.533 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 174 | -71.1 | 173.7 | -175.2 | 0 | 0 | 111.7 | Q161 T162 V167 K168 L169 | Q161-E165 PolarHBondContact O-N 3.44Å; T162-E165 PolarHBondContact O-N 3.17Å; E165-V167 VanDerWaalsContact C-N 3.26Å; E165-V167 PolarHBondContact O-N 3.33Å; E165-K168 WeakPolarHBondContact O-CB 3.33Å; E165-K168 PolarHBondContact O-N 3.04Å; E165-L169 WeakPolarHBondContact O-CG 3.47Å; E165-L169 PolarHBondContact O-N 3.4Å |
| 166 | A | 98.1 | Very high | 97.8 | Very high | 40 Ų | 40 | 106.6 Ų | 106.6 | 33% | 0.331 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.5 | -32.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T162 Q163 R170 | T162-A166 WeakPolarHBondContact O-CB 3.47Å; T162-A166 PolarHBondContact O-N 3.18Å; Q163-A166 PolarHBondContact O-N 2.91Å; A166-R170 WeakPolarHBondContact O-CB 3.32Å; A166-R170 WeakPolarHBondContact O-CG 3.45Å; A166-R170 PolarHBondContact O-N 2.84Å; A166-R170 VanDerWaalsContact O-N 3.12Å; A166-R170 PolarHBondContact O-NE 2.86Å |
| 167 | V | 98.1 | Very high | 97.9 | Very high | 76 Ų | 76 | 108.6 Ų | 108.6 | 46% | 0.461 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.9 | -42.8 | 172.2 | 172.6 | 0 | 0 | 0 | 0 | 111.1 | Q163 A164 E165 R170 R171 | Q163-V167 WeakPolarHBondContact O-CG2 3.31Å; Q163-V167 PolarHBondContact O-N 3.31Å; A164-V167 PolarHBondContact O-N 2.97Å; E165-V167 VanDerWaalsContact C-N 3.26Å; E165-V167 PolarHBondContact O-N 3.33Å; V167-R170 VanDerWaalsContact CG2-NH2 3.33Å; V167-R170 PolarHBondContact O-N 2.91Å; V167-R171 PolarHBondContact O-N 2.96Å |
| 168 | K | 98.3 | Very high | 97.9 | Very high | 139 Ų | 139 | 105.8 Ų | 105.8 | 60% | 0.604 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.6 | -46.5 | 176.5 | -68.8 | 176.5 | -175.1 | 177.5 | 0 | 111.5 | A164 E165 R170 R171 I172 | A164-K168 WeakPolarHBondContact O-CG 3.35Å; A164-K168 PolarHBondContact O-N 3.22Å; A164-K168 VanDerWaalsContact O-N 3.11Å; E165-K168 WeakPolarHBondContact O-CB 3.33Å; E165-K168 PolarHBondContact O-N 3.04Å; K168-R170 VanDerWaalsContact C-N 3.33Å; K168-R170 PolarHBondContact O-N 2.91Å; K168-R171 WeakPolarHBondContact O-CB 3.44Å; K168-R171 PolarHBondContact O-N 3.36Å; K168-R171 VanDerWaalsContact O-N 3.11Å; K168-I172 WeakPolarHBondContact O-CG1 3.46Å; K168-I172 PolarHBondContact O-N 2.95Å |
| 169 | L | 98.3 | Very high | 98 | Very high | 109 Ų | 109 | 104.5 Ų | 104.5 | 57% | 0.571 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59 | -44.3 | 176.5 | -69.8 | 176 | 0 | 0 | 0 | 111.6 | E165 R171 I172 Q173 | E165-L169 WeakPolarHBondContact O-CG 3.47Å; E165-L169 PolarHBondContact O-N 3.4Å; L169-R171 VanDerWaalsContact C-N 3.29Å; L169-R171 PolarHBondContact O-N 2.9Å; L169-I172 PolarHBondContact O-N 3.03Å; L169-Q173 WeakPolarHBondContact O-CG 3.28Å; L169-Q173 PolarHBondContact O-N 3.1Å |
| 170 | R | 98.2 | Very high | 98.1 | Very high | 137 Ų | 137 | 105.5 Ų | 105.5 | 52% | 0.517 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.6 | -36.2 | 175.3 | -79.1 | -174.8 | -71.9 | 165.3 | -6.4 | 112.9 | A166 V167 K168 K174 | A166-R170 WeakPolarHBondContact O-CB 3.32Å; A166-R170 WeakPolarHBondContact O-CG 3.45Å; A166-R170 PolarHBondContact O-N 2.84Å; A166-R170 VanDerWaalsContact O-N 3.12Å; A166-R170 PolarHBondContact O-NE 2.86Å; V167-R170 VanDerWaalsContact CG2-NH2 3.33Å; V167-R170 PolarHBondContact O-N 2.91Å; K168-R170 VanDerWaalsContact C-N 3.33Å; K168-R170 PolarHBondContact O-N 2.91Å; R170-K174 WeakPolarHBondContact O-CG 3.45Å; R170-K174 PolarHBondContact O-N 3.21Å; R170-K174 VanDerWaalsContact O-N 3.09Å |
| 171 | R | 98.4 | Very high | 98.1 | Very high | 170 Ų | 170 | 102.4 Ų | 102.4 | 64% | 0.642 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.6 | -47.7 | 175.1 | -179 | 179 | 174 | 171.7 | 1.8 | 111 | V167 K168 L169 Q173 K174 E175 | V167-R171 PolarHBondContact O-N 2.96Å; K168-R171 WeakPolarHBondContact O-CB 3.44Å; K168-R171 PolarHBondContact O-N 3.36Å; K168-R171 VanDerWaalsContact O-N 3.11Å; L169-R171 VanDerWaalsContact C-N 3.29Å; L169-R171 PolarHBondContact O-N 2.9Å; R171-Q173 VanDerWaalsContact C-N 3.32Å; R171-Q173 PolarHBondContact O-N 2.98Å; R171-K174 PolarHBondContact O-N 2.96Å; R171-K174 VanDerWaalsContact O-N 3.16Å; R171-E175 WeakPolarHBondContact CG-OE1 3.42Å; R171-E175 IonicContact CZ-OE1 3.06Å; R171-E175 IonicContact NE-OE1 2.66Å; R171-E175 PolarHBondContact NE-OE1 3.33Å; R171-E175 IonicContact NH2-OE1 3.32Å; R171-E175 WeakPolarHBondContact O-CG 3.37Å; R171-E175 PolarHBondContact O-N 3.4Å |
| 172 | I | 98.2 | Very high | 98.1 | Very high | 91 Ų | 91 | 103.5 Ų | 103.5 | 47% | 0.467 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.2 | -44.7 | 177.5 | -65.8 | 165.7 | 0 | 0 | 0 | 110.5 | K168 L169 K174 E175 L176 | K168-I172 WeakPolarHBondContact O-CG1 3.46Å; K168-I172 PolarHBondContact O-N 2.95Å; L169-I172 PolarHBondContact O-N 3.03Å; I172-K174 VanDerWaalsContact C-N 3.33Å; I172-K174 PolarHBondContact O-N 3.01Å; I172-E175 PolarHBondContact O-N 2.94Å; I172-L176 HydrophobicContact CG2-CD1 4.15Å; I172-L176 HydrophobicContact CG2-CG 4.49Å; I172-L176 WeakPolarHBondContact O-CG 3.45Å; I172-L176 PolarHBondContact O-N 2.92Å |
| 173 | Q | 98.2 | Very high | 98.1 | Very high | 131 Ų | 131 | 103.1 Ų | 103.1 | 61% | 0.612 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.7 | -40.9 | 176.2 | -77.8 | 177.5 | -31.8 | 0 | 0 | 112.8 | L169 R171 Q177 | L169-Q173 WeakPolarHBondContact O-CG 3.28Å; L169-Q173 PolarHBondContact O-N 3.1Å; R171-Q173 VanDerWaalsContact C-N 3.32Å; R171-Q173 PolarHBondContact O-N 2.98Å; Q173-Q177 WeakPolarHBondContact O-CB 3.41Å; Q173-Q177 PolarHBondContact O-N 3.46Å |
| 174 | K | 98.4 | Very high | 98.2 | Very high | 158 Ų | 158 | 100.7 Ų | 100.7 | 69% | 0.687 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.2 | -40.7 | 176.4 | -75 | 177.9 | 178.4 | -170.2 | 0 | 112.5 | R170 R171 I172 Q177 A178 | R170-K174 WeakPolarHBondContact O-CG 3.45Å; R170-K174 PolarHBondContact O-N 3.21Å; R170-K174 VanDerWaalsContact O-N 3.09Å; R171-K174 PolarHBondContact O-N 2.96Å; R171-K174 VanDerWaalsContact O-N 3.16Å; I172-K174 VanDerWaalsContact C-N 3.33Å; I172-K174 PolarHBondContact O-N 3.01Å; K174-Q177 PolarHBondContact O-N 2.72Å; K174-A178 WeakPolarHBondContact O-CB 3.43Å; K174-A178 PolarHBondContact O-N 2.94Å |
| 175 | E | 98.3 | Very high | 98.3 | Very high | 97 Ų | 97 | 102.3 Ų | 102.3 | 45% | 0.453 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.6 | -41.9 | 177.7 | -71.4 | 172.6 | -167.9 | 0 | 0 | 110.8 | R171 I172 A178 L179 | R171-E175 WeakPolarHBondContact CG-OE1 3.42Å; R171-E175 IonicContact CZ-OE1 3.06Å; R171-E175 IonicContact NE-OE1 2.66Å; R171-E175 PolarHBondContact NE-OE1 3.33Å; R171-E175 IonicContact NH2-OE1 3.32Å; R171-E175 WeakPolarHBondContact O-CG 3.37Å; R171-E175 PolarHBondContact O-N 3.4Å; I172-E175 PolarHBondContact O-N 2.94Å; E175-A178 PolarHBondContact O-N 3.35Å; E175-L179 WeakPolarHBondContact O-CG 3.16Å; E175-L179 PolarHBondContact O-N 3.48Å |
| 176 | L | 98.4 | Very high | 98.3 | Very high | 98 Ų | 98 | 98 Ų | 98 | 51% | 0.513 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.9 | -47.2 | 173.1 | -72.2 | 174.2 | 0 | 0 | 0 | 112.1 | I172 A178 L179 D180 | I172-L176 HydrophobicContact CG2-CD1 4.15Å; I172-L176 HydrophobicContact CG2-CG 4.49Å; I172-L176 WeakPolarHBondContact O-CG 3.45Å; I172-L176 PolarHBondContact O-N 2.92Å; L176-A178 VanDerWaalsContact C-N 3.27Å; L176-A178 PolarHBondContact O-N 3.42Å; L176-L179 WeakPolarHBondContact O-CB 3.23Å; L176-L179 PolarHBondContact O-N 2.97Å; L176-L179 VanDerWaalsContact O-N 3.1Å; L176-D180 PolarHBondContact O-N 3.19Å |
| 177 | Q | 98.1 | Very high | 98.3 | Very high | 103 Ų | 103 | 99.3 Ų | 99.3 | 48% | 0.481 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.2 | -39.8 | 177.3 | -173.7 | 64.3 | 58.3 | 0 | 0 | 111.8 | Q173 K174 L179 D180 D181 | Q173-Q177 WeakPolarHBondContact O-CB 3.41Å; Q173-Q177 PolarHBondContact O-N 3.46Å; K174-Q177 PolarHBondContact O-N 2.72Å; Q177-L179 VanDerWaalsContact C-N 3.31Å; Q177-L179 PolarHBondContact O-N 3.33Å; Q177-D180 PolarHBondContact O-N 2.89Å; Q177-D181 PolarHBondContact NE2-OD1 2.93Å; Q177-D181 WeakPolarHBondContact O-CB 3.37Å; Q177-D181 PolarHBondContact O-N 3.17Å |
| 178 | A | 98.3 | Very high | 98.4 | Very high | 52 Ų | 52 | 97.7 Ų | 97.7 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64 | -35.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | K174 E175 L176 M182 | K174-A178 WeakPolarHBondContact O-CB 3.43Å; K174-A178 PolarHBondContact O-N 2.94Å; E175-A178 PolarHBondContact O-N 3.35Å; L176-A178 VanDerWaalsContact C-N 3.27Å; L176-A178 PolarHBondContact O-N 3.42Å; A178-M182 WeakPolarHBondContact O-CB 3.24Å; A178-M182 PolarHBondContact O-N 3.45Å |
| 179 | L | 98.4 | Very high | 98.4 | Very high | 99 Ų | 99 | 92.6 Ų | 92.6 | 52% | 0.518 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -67.4 | -43.2 | 173.4 | -67.2 | 172.8 | 0 | 0 | 0 | 111.4 | E175 L176 Q177 D181 M182 V183 | E175-L179 WeakPolarHBondContact O-CG 3.16Å; E175-L179 PolarHBondContact O-N 3.48Å; L176-L179 WeakPolarHBondContact O-CB 3.23Å; L176-L179 PolarHBondContact O-N 2.97Å; L176-L179 VanDerWaalsContact O-N 3.1Å; Q177-L179 VanDerWaalsContact C-N 3.31Å; Q177-L179 PolarHBondContact O-N 3.33Å; L179-D181 VanDerWaalsContact C-N 3.33Å; L179-D181 PolarHBondContact O-N 2.83Å; L179-M182 PolarHBondContact O-N 3.42Å; L179-V183 WeakPolarHBondContact O-CG2 3.41Å; L179-V183 PolarHBondContact O-N 3.33Å |
| 180 | D | 98.5 | Very high | 98.4 | Very high | 95 Ų | 95 | 90.3 Ų | 90.3 | 51% | 0.508 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62 | -41.6 | 176.6 | -70.8 | -27.1 | 0 | 0 | 0 | 111.7 | L176 Q177 S184 | L176-D180 PolarHBondContact O-N 3.19Å; Q177-D180 PolarHBondContact O-N 2.89Å; D180-S184 VanDerWaalsContact O-CB 3.24Å; D180-S184 WeakPolarHBondContact O-CB 3.5Å; D180-S184 PolarHBondContact O-N 3.27Å; D180-S184 PolarHBondContact O-OG 2.9Å |
| 181 | D | 98.3 | Very high | 98.4 | Very high | 91 Ų | 91 | 91.4 Ų | 91.4 | 49% | 0.487 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -66 | -40.8 | 177.8 | -66.8 | -14.9 | 0 | 0 | 0 | 111.4 | Q177 L179 S184 N185 | Q177-D181 PolarHBondContact NE2-OD1 2.93Å; Q177-D181 WeakPolarHBondContact O-CB 3.37Å; Q177-D181 PolarHBondContact O-N 3.17Å; L179-D181 VanDerWaalsContact C-N 3.33Å; L179-D181 PolarHBondContact O-N 2.83Å; D181-S184 PolarHBondContact O-N 3.24Å; D181-N185 WeakPolarHBondContact O-CB 3.36Å; D181-N185 PolarHBondContact O-N 2.99Å |
| 182 | M | 97.9 | Very high | 98.4 | Very high | 108 Ų | 108 | 85 Ų | 85 | 53% | 0.532 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.7 | -48.5 | 177.1 | -173.3 | -175.1 | -56.5 | 0 | 0 | 111.5 | A178 L179 S184 N185 D186 | A178-M182 WeakPolarHBondContact O-CB 3.24Å; A178-M182 PolarHBondContact O-N 3.45Å; L179-M182 PolarHBondContact O-N 3.42Å; M182-S184 VanDerWaalsContact C-N 3.31Å; M182-S184 PolarHBondContact O-N 3.36Å; M182-N185 WeakPolarHBondContact O-CB 3.2Å; M182-N185 PolarHBondContact O-N 2.89Å; M182-D186 PolarHBondContact O-N 3.17Å |
| 183 | V | 98.3 | Very high | 98.4 | Very high | 80 Ų | 80 | 85.7 Ų | 85.7 | 49% | 0.485 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 176.9 | 171 | 0 | 0 | 0 | 0 | 110.8 | L179 N185 D186 I187 | L179-V183 WeakPolarHBondContact O-CG2 3.41Å; L179-V183 PolarHBondContact O-N 3.33Å; V183-N185 VanDerWaalsContact C-N 3.3Å; V183-N185 PolarHBondContact O-N 2.9Å; V183-D186 PolarHBondContact O-N 3.34Å; V183-I187 HydrophobicContact CG1-CD1 3.64Å; V183-I187 HydrophobicContact CG1-CG1 4.24Å; V183-I187 WeakPolarHBondContact O-CB 3.32Å; V183-I187 WeakPolarHBondContact O-CG1 3.46Å; V183-I187 PolarHBondContact O-N 3.39Å |
| 184 | S | 98.6 | Very high | 98.5 | Very high | 75 Ų | 75 | 84.5 Ų | 84.5 | 52% | 0.524 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.9 | -38.7 | 176.7 | -63.4 | 0 | 0 | 0 | 0 | 112.1 | D180 D181 M182 G188 | D180-S184 VanDerWaalsContact O-CB 3.24Å; D180-S184 WeakPolarHBondContact O-CB 3.5Å; D180-S184 PolarHBondContact O-N 3.27Å; D180-S184 PolarHBondContact O-OG 2.9Å; D181-S184 PolarHBondContact O-N 3.24Å; M182-S184 VanDerWaalsContact C-N 3.31Å; M182-S184 PolarHBondContact O-N 3.36Å; S184-G188 PolarHBondContact O-N 3.11Å |
| 185 | N | 98.6 | Very high | 98.5 | Very high | 86 Ų | 86 | 83.6 Ų | 83.6 | 46% | 0.46 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -65.1 | -50.8 | 174.5 | -171.5 | -18.8 | 0 | 0 | 0 | 111.5 | D181 M182 V183 I187 G188 I189 | D181-N185 WeakPolarHBondContact O-CB 3.36Å; D181-N185 PolarHBondContact O-N 2.99Å; M182-N185 WeakPolarHBondContact O-CB 3.2Å; M182-N185 PolarHBondContact O-N 2.89Å; V183-N185 VanDerWaalsContact C-N 3.3Å; V183-N185 PolarHBondContact O-N 2.9Å; N185-I187 VanDerWaalsContact C-N 3.3Å; N185-I187 PolarHBondContact O-N 3.38Å; N185-G188 WeakPolarHBondContact O-CA 3.35Å; N185-G188 PolarHBondContact O-N 3.5Å; N185-I189 PolarHBondContact O-N 3.22Å; N185-I189 WeakPolarHBondContact OD1-CD1 3.29Å |
| 186 | D | 98.4 | Very high | 98.5 | Very high | 23 Ų | 23 | 83.7 Ų | 83.7 | 12% | 0.123 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -57.9 | -43.2 | 178.5 | -75.8 | -10.2 | 0 | 0 | 0 | 111.8 | F7 M182 V183 G188 I189 L190 | F7-D186 HydrophobicContact CD2-CB 4.46Å; M182-D186 PolarHBondContact O-N 3.17Å; V183-D186 PolarHBondContact O-N 3.34Å; D186-G188 VanDerWaalsContact C-N 3.32Å; D186-G188 PolarHBondContact O-N 3.33Å; D186-I189 PolarHBondContact O-N 3.42Å; D186-L190 WeakPolarHBondContact O-CB 3.39Å; D186-L190 WeakPolarHBondContact O-CG 3.41Å; D186-L190 PolarHBondContact O-N 2.91Å |
| 187 | I | 98.7 | Very high | 98.5 | Very high | 68 Ų | 68 | 81.8 Ų | 81.8 | 35% | 0.349 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.3 | -43.4 | 173.8 | -70.7 | 168.5 | 0 | 0 | 0 | 110.7 | V183 N185 L190 R191 | V183-I187 HydrophobicContact CG1-CD1 3.64Å; V183-I187 HydrophobicContact CG1-CG1 4.24Å; V183-I187 WeakPolarHBondContact O-CB 3.32Å; V183-I187 WeakPolarHBondContact O-CG1 3.46Å; V183-I187 PolarHBondContact O-N 3.39Å; N185-I187 VanDerWaalsContact C-N 3.3Å; N185-I187 PolarHBondContact O-N 3.38Å; I187-L190 PolarHBondContact O-N 3.27Å; I187-R191 HydrophobicContact CG2-CG 4.36Å; I187-R191 WeakPolarHBondContact O-CB 3.43Å; I187-R191 VanDerWaalsContact O-CG 3.3Å; I187-R191 WeakPolarHBondContact O-CG 3.36Å; I187-R191 PolarHBondContact O-N 2.92Å |
| 188 | G | 98.6 | Very high | 98.5 | Very high | 41 Ų | 41 | 79.8 Ų | 79.8 | 42% | 0.423 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -58.6 | -46.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | S184 N185 D186 R191 G192 | S184-G188 PolarHBondContact O-N 3.11Å; N185-G188 WeakPolarHBondContact O-CA 3.35Å; N185-G188 PolarHBondContact O-N 3.5Å; D186-G188 VanDerWaalsContact C-N 3.32Å; D186-G188 PolarHBondContact O-N 3.33Å; G188-R191 PolarHBondContact O-N 3.35Å; G188-G192 PolarHBondContact O-N 3.09Å |
| 189 | I | 98.5 | Very high | 98.6 | Very high | 32 Ų | 32 | 85.7 Ų | 85.7 | 16% | 0.164 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 177.8 | -67.3 | 171.1 | 0 | 0 | 0 | 111 | L12 I15 N185 D186 R191 G192 R193 | L12-I189 HydrophobicContact CD2-CD1 3.24Å; I15-I189 HydrophobicContact CD1-CG2 4.49Å; I15-I189 HydrophobicContact CG2-CG2 3.96Å; N185-I189 PolarHBondContact O-N 3.22Å; N185-I189 WeakPolarHBondContact OD1-CD1 3.29Å; D186-I189 PolarHBondContact O-N 3.42Å; I189-R191 PolarHBondContact O-N 3.41Å; I189-G192 PolarHBondContact O-N 3.46Å; I189-R193 WeakPolarHBondContact O-CB 3.3Å; I189-R193 WeakPolarHBondContact O-CG 3.44Å; I189-R193 PolarHBondContact O-N 3.23Å |
| 190 | L | 98.8 | Very high | 98.6 | Very high | 61 Ų | 61 | 84.5 Ų | 84.5 | 32% | 0.319 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63 | -42.3 | 178.8 | -72.6 | 177 | 0 | 0 | 0 | 111.6 | F7 D186 I187 R193 I194 | F7-L190 HydrophobicContact CE2-CD2 4.12Å; F7-L190 HydrophobicContact CE2-CG 4.28Å; F7-L190 HydrophobicContact CZ-CD2 4.07Å; D186-L190 WeakPolarHBondContact O-CB 3.39Å; D186-L190 WeakPolarHBondContact O-CG 3.41Å; D186-L190 PolarHBondContact O-N 2.91Å; I187-L190 PolarHBondContact O-N 3.27Å; L190-R193 PolarHBondContact O-N 3.49Å; L190-I194 WeakPolarHBondContact O-CB 3.44Å; L190-I194 WeakPolarHBondContact O-CD1 3.46Å; L190-I194 WeakPolarHBondContact O-CG1 3.2Å; L190-I194 PolarHBondContact O-N 2.86Å |
| 191 | R | 98.8 | Very high | 98.6 | Very high | 160 Ų | 160 | 86.9 Ų | 86.9 | 60% | 0.604 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -60.5 | -49.3 | 175.1 | -75.2 | 174.7 | -178.7 | 175.3 | 3.1 | 111.5 | I187 G188 I189 R193 I194 E195 | I187-R191 HydrophobicContact CG2-CG 4.36Å; I187-R191 WeakPolarHBondContact O-CB 3.43Å; I187-R191 VanDerWaalsContact O-CG 3.3Å; I187-R191 WeakPolarHBondContact O-CG 3.36Å; I187-R191 PolarHBondContact O-N 2.92Å; G188-R191 PolarHBondContact O-N 3.35Å; I189-R191 PolarHBondContact O-N 3.41Å; R191-R193 VanDerWaalsContact C-N 3.29Å; R191-R193 PolarHBondContact O-N 2.94Å; R191-I194 PolarHBondContact O-N 3.17Å; R191-I194 VanDerWaalsContact O-N 3.17Å; R191-E195 WeakPolarHBondContact O-CG 3.46Å; R191-E195 PolarHBondContact O-N 3.26Å |
| 192 | G | 98.6 | Very high | 98.6 | Very high | 35 Ų | 35 | 85.2 Ų | 85.2 | 36% | 0.361 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -58.8 | -40.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G188 I189 E195 Q196 | G188-G192 PolarHBondContact O-N 3.09Å; I189-G192 PolarHBondContact O-N 3.46Å; G192-E195 PolarHBondContact O-N 2.83Å; G192-Q196 WeakPolarHBondContact O-CB 3.42Å; G192-Q196 PolarHBondContact O-N 2.68Å |
| 193 | R | 98.6 | Very high | 98.6 | Very high | 107 Ų | 107 | 81.2 Ų | 81.2 | 40% | 0.404 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.2 | -42.2 | 175.3 | -75.6 | 176.3 | 168.3 | -134 | -26 | 113.2 | I189 L190 R191 E195 Q196 A197 | I189-R193 WeakPolarHBondContact O-CB 3.3Å; I189-R193 WeakPolarHBondContact O-CG 3.44Å; I189-R193 PolarHBondContact O-N 3.23Å; L190-R193 PolarHBondContact O-N 3.49Å; R191-R193 VanDerWaalsContact C-N 3.29Å; R191-R193 PolarHBondContact O-N 2.94Å; R193-E195 VanDerWaalsContact C-N 3.32Å; R193-Q196 PolarHBondContact O-N 2.87Å; R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.47Å; R193-A197 PolarHBondContact O-N 2.92Å |
| 194 | I | 98.7 | Very high | 98.7 | Very high | 106 Ų | 106 | 80.1 Ų | 80.1 | 54% | 0.544 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.7 | -44 | 176.4 | -71.1 | 163.7 | 0 | 0 | 0 | 109.8 | L190 R191 A197 S198 | L190-I194 WeakPolarHBondContact O-CB 3.44Å; L190-I194 WeakPolarHBondContact O-CD1 3.46Å; L190-I194 WeakPolarHBondContact O-CG1 3.2Å; L190-I194 PolarHBondContact O-N 2.86Å; R191-I194 PolarHBondContact O-N 3.17Å; R191-I194 VanDerWaalsContact O-N 3.17Å; I194-A197 PolarHBondContact O-N 3.46Å; I194-S198 VanDerWaalsContact O-CB 3.25Å; I194-S198 WeakPolarHBondContact O-CB 3.36Å; I194-S198 PolarHBondContact O-N 3.43Å; I194-S198 PolarHBondContact O-OG 3.01Å |
| 195 | E | 98.8 | Very high | 98.7 | Very high | 138 Ų | 138 | 82.8 Ų | 82.8 | 65% | 0.645 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -61.2 | -48.4 | 177.1 | -73.3 | 171.8 | -166.1 | 0 | 0 | 111.6 | R191 G192 R193 S198 W199 | R191-E195 WeakPolarHBondContact O-CG 3.46Å; R191-E195 PolarHBondContact O-N 3.26Å; G192-E195 PolarHBondContact O-N 2.83Å; R193-E195 VanDerWaalsContact C-N 3.32Å; E195-S198 PolarHBondContact O-N 3.34Å; E195-W199 PolarHBondContact O-N 3.07Å |
| 196 | Q | 98.6 | Very high | 98.7 | Very high | 100 Ų | 100 | 85.9 Ų | 85.9 | 47% | 0.467 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.9 | -49.8 | 177.1 | -176.8 | 58.2 | 47.6 | 0 | 0 | 111.6 | G192 R193 S198 W199 D200 | G192-Q196 WeakPolarHBondContact O-CB 3.42Å; G192-Q196 PolarHBondContact O-N 2.68Å; R193-Q196 PolarHBondContact O-N 2.87Å; Q196-S198 VanDerWaalsContact C-N 3.28Å; Q196-S198 PolarHBondContact O-N 3.47Å; Q196-W199 WeakPolarHBondContact O-CB 3.23Å; Q196-W199 PolarHBondContact O-N 3.42Å; Q196-W199 VanDerWaalsContact O-N 3.17Å; Q196-D200 PolarHBondContact NE2-OD1 3.24Å; Q196-D200 PolarHBondContact NE2-OD2 3.13Å; Q196-D200 PolarHBondContact O-N 3.4Å |
| 197 | A | 98.8 | Very high | 98.7 | Very high | 57 Ų | 57 | 93 Ų | 93 | 47% | 0.471 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61.6 | -36.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | R193 I194 D200 Y201 | R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.47Å; R193-A197 PolarHBondContact O-N 2.92Å; I194-A197 PolarHBondContact O-N 3.46Å; A197-D200 PolarHBondContact O-N 3.35Å; A197-Y201 VanDerWaalsContact O-CB 3.23Å; A197-Y201 WeakPolarHBondContact O-CB 3.25Å; A197-Y201 PolarHBondContact O-N 3.27Å |
| 198 | S | 98.7 | Very high | 98.7 | Very high | 61 Ų | 61 | 96.8 Ų | 96.8 | 43% | 0.427 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -67.5 | -38.1 | 176.9 | -60.9 | 0 | 0 | 0 | 0 | 111.9 | I194 E195 Q196 S202 | I194-S198 VanDerWaalsContact O-CB 3.25Å; I194-S198 WeakPolarHBondContact O-CB 3.36Å; I194-S198 PolarHBondContact O-N 3.43Å; I194-S198 PolarHBondContact O-OG 3.01Å; E195-S198 PolarHBondContact O-N 3.34Å; Q196-S198 VanDerWaalsContact C-N 3.28Å; Q196-S198 PolarHBondContact O-N 3.47Å; S198-S202 WeakPolarHBondContact O-CB 3.36Å; S198-S202 PolarHBondContact O-N 3.06Å; S198-S202 PolarHBondContact O-OG 3.34Å |
| 199 | W | 98.7 | Very high | 98.7 | Very high | 176 Ų | 176 | 98.7 Ų | 98.7 | 67% | 0.667 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -66.2 | -47.9 | 175 | -170.9 | 82.1 | 0 | 0 | 0 | 111.3 | E195 Q196 S202 A203 | E195-W199 PolarHBondContact O-N 3.07Å; Q196-W199 WeakPolarHBondContact O-CB 3.23Å; Q196-W199 PolarHBondContact O-N 3.42Å; Q196-W199 VanDerWaalsContact O-N 3.17Å; W199-S202 PolarHBondContact O-N 3.23Å; W199-A203 WeakPolarHBondContact O-CB 3.49Å; W199-A203 PolarHBondContact O-N 3.18Å |
| 200 | D | 98.6 | Very high | 98.7 | Very high | 74 Ų | 74 | 103.7 Ų | 103.7 | 40% | 0.396 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 177.8 | -71.3 | -31.8 | 0 | 0 | 0 | 111.8 | Q196 A197 S202 A203 A204 | Q196-D200 PolarHBondContact NE2-OD1 3.24Å; Q196-D200 PolarHBondContact NE2-OD2 3.13Å; Q196-D200 PolarHBondContact O-N 3.4Å; A197-D200 PolarHBondContact O-N 3.35Å; D200-S202 PolarHBondContact O-N 2.83Å; D200-A203 PolarHBondContact O-N 3.14Å; D200-A204 WeakPolarHBondContact O-CB 3.47Å; D200-A204 PolarHBondContact O-N 3.01Å |
| 201 | Y | 98.8 | Very high | 98.7 | Very high | 146 Ų | 146 | 103.3 Ų | 103.3 | 57% | 0.573 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -56.6 | -49.8 | 174.2 | 169.4 | -99.2 | 0 | 0 | 0 | 111.4 | A197 A203 A204 R205 | A197-Y201 VanDerWaalsContact O-CB 3.23Å; A197-Y201 WeakPolarHBondContact O-CB 3.25Å; A197-Y201 PolarHBondContact O-N 3.27Å; Y201-A203 VanDerWaalsContact C-N 3.29Å; Y201-A203 PolarHBondContact O-N 3.26Å; Y201-A204 PolarHBondContact O-N 3.26Å; Y201-R205 VanDerWaalsContact O-CB 3.29Å; Y201-R205 WeakPolarHBondContact O-CB 3.35Å; Y201-R205 PolarHBondContact O-N 2.84Å |
| 202 | S | 98.7 | Very high | 98.7 | Very high | 56 Ų | 56 | 100 Ų | 100 | 39% | 0.392 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.6 | -38.7 | -179.8 | -62 | 0 | 0 | 0 | 0 | 111.8 | S198 W199 D200 K206 | S198-S202 WeakPolarHBondContact O-CB 3.36Å; S198-S202 PolarHBondContact O-N 3.06Å; S198-S202 PolarHBondContact O-OG 3.34Å; W199-S202 PolarHBondContact O-N 3.23Å; D200-S202 PolarHBondContact O-N 2.83Å; S202-K206 WeakPolarHBondContact O-CG 3.29Å; S202-K206 PolarHBondContact O-N 3.05Å; S202-K206 VanDerWaalsContact O-N 3.13Å |
| 203 | A | 98.6 | Very high | 98.7 | Very high | 24 Ų | 24 | 101.4 Ų | 101.4 | 20% | 0.198 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -69.1 | -41.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | W199 D200 Y201 R207 | W199-A203 WeakPolarHBondContact O-CB 3.49Å; W199-A203 PolarHBondContact O-N 3.18Å; D200-A203 PolarHBondContact O-N 3.14Å; Y201-A203 VanDerWaalsContact C-N 3.29Å; Y201-A203 PolarHBondContact O-N 3.26Å; A203-R207 WeakPolarHBondContact O-CG 3.5Å; A203-R207 PolarHBondContact O-N 3.38Å; A203-R207 PolarHBondContact O-NH1 3.27Å |
| 204 | A | 98.8 | Very high | 98.7 | Very high | 56 Ų | 56 | 101.6 Ų | 101.6 | 46% | 0.463 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.7 | -46.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | D200 Y201 K206 R207 Y208 | D200-A204 WeakPolarHBondContact O-CB 3.47Å; D200-A204 PolarHBondContact O-N 3.01Å; Y201-A204 PolarHBondContact O-N 3.26Å; A204-K206 PolarHBondContact O-N 3.13Å; A204-R207 PolarHBondContact O-N 2.82Å; A204-R207 VanDerWaalsContact O-N 3.13Å; A204-Y208 PolarHBondContact O-N 3.04Å |
| 205 | R | 98.7 | Very high | 98.7 | Very high | 131 Ų | 131 | 103.6 Ų | 103.6 | 49% | 0.494 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -56.5 | -47.8 | 177.4 | -176.6 | -179.2 | 169.8 | -169.9 | -2.2 | 112.2 | Y201 R207 Y208 E209 | Y201-R205 VanDerWaalsContact O-CB 3.29Å; Y201-R205 WeakPolarHBondContact O-CB 3.35Å; Y201-R205 PolarHBondContact O-N 2.84Å; R205-R207 VanDerWaalsContact C-N 3.31Å; R205-R207 PolarHBondContact O-N 3.13Å; R205-Y208 WeakPolarHBondContact O-CB 3.43Å; R205-Y208 PolarHBondContact O-N 3.11Å; R205-E209 IonicContact CZ-OE1 3.85Å; R205-E209 VanDerWaalsContact CZ-OE1 3.32Å; R205-E209 IonicContact NE-OE1 3.62Å; R205-E209 PolarHBondContact NE-OE1 3.41Å; R205-E209 IonicContact NH2-OE1 2.69Å; R205-E209 PolarHBondContact NH2-OE1 3Å; R205-E209 WeakPolarHBondContact O-CG 2.91Å; R205-E209 PolarHBondContact O-N 3.07Å |
| 206 | K | 98.7 | Very high | 98.7 | Very high | 151 Ų | 151 | 100.4 Ų | 100.4 | 66% | 0.657 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.3 | -38.6 | 177 | -75 | 175.9 | -178.4 | 179.1 | 0 | 112.9 | S202 A204 K210 | S202-K206 WeakPolarHBondContact O-CG 3.29Å; S202-K206 PolarHBondContact O-N 3.05Å; S202-K206 VanDerWaalsContact O-N 3.13Å; A204-K206 PolarHBondContact O-N 3.13Å; K206-K210 PolarHBondContact O-N 2.92Å; K206-K210 VanDerWaalsContact O-N 3.16Å |
| 207 | R | 98.6 | Very high | 98.7 | Very high | 174 Ų | 174 | 98.3 Ų | 98.3 | 66% | 0.657 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -68.1 | -40.7 | 176.5 | -72.5 | -174.4 | -169.9 | 92.1 | -6.8 | 111.6 | A203 A204 R205 K210 A211 | A203-R207 WeakPolarHBondContact O-CG 3.5Å; A203-R207 PolarHBondContact O-N 3.38Å; A203-R207 PolarHBondContact O-NH1 3.27Å; A204-R207 PolarHBondContact O-N 2.82Å; A204-R207 VanDerWaalsContact O-N 3.13Å; R205-R207 VanDerWaalsContact C-N 3.31Å; R205-R207 PolarHBondContact O-N 3.13Å; R207-K210 PolarHBondContact O-N 3.25Å; R207-A211 PolarHBondContact O-N 2.88Å |
| 208 | Y | 98.7 | Very high | 98.7 | Very high | 147 Ų | 147 | 98.5 Ų | 98.5 | 58% | 0.576 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -59.5 | -51.8 | 174.9 | 169.8 | -90.6 | 0 | 0 | 0 | 111.3 | A204 R205 K210 A211 E212 | A204-Y208 PolarHBondContact O-N 3.04Å; R205-Y208 WeakPolarHBondContact O-CB 3.43Å; R205-Y208 PolarHBondContact O-N 3.11Å; Y208-K210 PolarHBondContact O-N 3.4Å; Y208-A211 PolarHBondContact O-N 3.19Å; Y208-A211 VanDerWaalsContact O-N 3.07Å; Y208-E212 VanDerWaalsContact CE1-OE2 3.3Å; Y208-E212 WeakPolarHBondContact CE1-OE2 3.34Å; Y208-E212 PolarHBondContact O-N 3.16Å |
| 209 | E | 98.7 | Very high | 98.7 | Very high | 81 Ų | 81 | 100.4 Ų | 100.4 | 38% | 0.379 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.9 | -37.7 | 180 | -71.3 | 170.6 | 177.2 | 0 | 0 | 111.7 | R205 A213 | R205-E209 IonicContact CZ-OE1 3.85Å; R205-E209 VanDerWaalsContact CZ-OE1 3.32Å; R205-E209 IonicContact NE-OE1 3.62Å; R205-E209 PolarHBondContact NE-OE1 3.41Å; R205-E209 IonicContact NH2-OE1 2.69Å; R205-E209 PolarHBondContact NH2-OE1 3Å; R205-E209 WeakPolarHBondContact O-CG 2.91Å; R205-E209 PolarHBondContact O-N 3.07Å; E209-A213 PolarHBondContact O-N 2.79Å |
| 210 | K | 98.7 | Very high | 98.7 | Very high | 137 Ų | 137 | 96.1 Ų | 96.1 | 60% | 0.596 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.1 | -46.8 | 174.4 | -177.6 | 176.7 | 171.8 | -178.8 | 0 | 112.2 | K206 R207 Y208 E212 A213 E214 | K206-K210 PolarHBondContact O-N 2.92Å; K206-K210 VanDerWaalsContact O-N 3.16Å; R207-K210 PolarHBondContact O-N 3.25Å; Y208-K210 PolarHBondContact O-N 3.4Å; K210-E212 VanDerWaalsContact C-N 3.3Å; K210-E212 PolarHBondContact O-N 2.94Å; K210-A213 PolarHBondContact O-N 2.94Å; K210-E214 WeakPolarHBondContact CE-OE1 3.36Å; K210-E214 IonicContact NZ-OE1 3.72Å; K210-E214 WeakPolarHBondContact O-CG 3.38Å; K210-E214 PolarHBondContact O-N 2.96Å |
| 211 | A | 98.7 | Very high | 98.7 | Very high | 53 Ų | 53 | 95.8 Ų | 95.8 | 44% | 0.438 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.9 | -36.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | R207 Y208 E214 Y215 | R207-A211 PolarHBondContact O-N 2.88Å; Y208-A211 PolarHBondContact O-N 3.19Å; Y208-A211 VanDerWaalsContact O-N 3.07Å; A211-E214 PolarHBondContact O-N 2.9Å; A211-Y215 WeakPolarHBondContact O-CB 3.44Å; A211-Y215 PolarHBondContact O-N 3.44Å |
| 212 | E | 98.7 | Very high | 98.7 | Very high | 91 Ų | 91 | 94 Ų | 94 | 43% | 0.425 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 174.8 | -175.5 | 175.5 | -163.1 | 0 | 0 | 111.5 | Y208 K210 E214 Y215 V216 | Y208-E212 VanDerWaalsContact CE1-OE2 3.3Å; Y208-E212 WeakPolarHBondContact CE1-OE2 3.34Å; Y208-E212 PolarHBondContact O-N 3.16Å; K210-E212 VanDerWaalsContact C-N 3.3Å; K210-E212 PolarHBondContact O-N 2.94Å; E212-E214 VanDerWaalsContact C-N 3.34Å; E212-E214 PolarHBondContact O-N 3.38Å; E212-Y215 PolarHBondContact O-N 3.41Å; E212-V216 WeakPolarHBondContact O-CG2 3.43Å; E212-V216 PolarHBondContact O-N 3.36Å |
| 213 | A | 98.6 | Very high | 98.7 | Very high | 64 Ų | 64 | 95.8 Ų | 95.8 | 53% | 0.529 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -43 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | E209 K210 A217 | E209-A213 PolarHBondContact O-N 2.79Å; K210-A213 PolarHBondContact O-N 2.94Å; A213-A217 WeakPolarHBondContact O-CB 3.39Å; A213-A217 PolarHBondContact O-N 3.11Å |
| 214 | E | 98.7 | Very high | 98.7 | Very high | 111 Ų | 111 | 102 Ų | 102 | 52% | 0.519 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 175.8 | -73.1 | 174.1 | -173.1 | 0 | 0 | 111.8 | K210 A211 E212 A217 A218 | K210-E214 WeakPolarHBondContact CE-OE1 3.36Å; K210-E214 IonicContact NZ-OE1 3.72Å; K210-E214 WeakPolarHBondContact O-CG 3.38Å; K210-E214 PolarHBondContact O-N 2.96Å; A211-E214 PolarHBondContact O-N 2.9Å; E212-E214 VanDerWaalsContact C-N 3.34Å; E212-E214 PolarHBondContact O-N 3.38Å; E214-A217 PolarHBondContact O-N 3.27Å; E214-A218 WeakPolarHBondContact O-CB 3.21Å; E214-A218 PolarHBondContact O-N 2.87Å |
| 215 | Y | 98.8 | Very high | 98.7 | Very high | 148 Ų | 148 | 105.3 Ų | 105.3 | 58% | 0.58 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.2 | -47.5 | 176.5 | 169.9 | -104.5 | 0 | 0 | 0 | 112.1 | A211 E212 A217 A218 K219 | A211-Y215 WeakPolarHBondContact O-CB 3.44Å; A211-Y215 PolarHBondContact O-N 3.44Å; E212-Y215 PolarHBondContact O-N 3.41Å; Y215-A217 VanDerWaalsContact C-N 3.34Å; Y215-A217 PolarHBondContact O-N 3.31Å; Y215-A218 PolarHBondContact O-N 3.46Å; Y215-K219 HydrophobicContact CE1-CD 4.45Å; Y215-K219 WeakPolarHBondContact O-CB 3.48Å; Y215-K219 PolarHBondContact O-N 3.06Å |
| 216 | V | 98.8 | Very high | 98.7 | Very high | 70 Ų | 70 | 101.4 Ų | 101.4 | 42% | 0.424 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.5 | -43.5 | 178.4 | 173.1 | 0 | 0 | 0 | 0 | 110.7 | E212 K219 L220 | E212-V216 WeakPolarHBondContact O-CG2 3.43Å; E212-V216 PolarHBondContact O-N 3.36Å; V216-K219 PolarHBondContact O-N 3.01Å; V216-L220 HydrophobicContact CG1-CD1 4.25Å; V216-L220 WeakPolarHBondContact O-CG 3.3Å; V216-L220 PolarHBondContact O-N 3.02Å |
| 217 | A | 98.7 | Very high | 98.7 | Very high | 57 Ų | 57 | 98 Ų | 98 | 47% | 0.471 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | A213 E214 Y215 K219 L220 D221 | A213-A217 WeakPolarHBondContact O-CB 3.39Å; A213-A217 PolarHBondContact O-N 3.11Å; E214-A217 PolarHBondContact O-N 3.27Å; Y215-A217 VanDerWaalsContact C-N 3.34Å; Y215-A217 PolarHBondContact O-N 3.31Å; A217-K219 VanDerWaalsContact C-N 3.35Å; A217-K219 PolarHBondContact O-N 3.06Å; A217-L220 PolarHBondContact O-N 2.94Å; A217-D221 WeakPolarHBondContact O-CB 3.38Å; A217-D221 PolarHBondContact O-N 3.36Å |
| 218 | A | 98.7 | Very high | 98.7 | Very high | 60 Ų | 60 | 91.7 Ų | 91.7 | 50% | 0.496 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -63.4 | -39.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | E214 Y215 D221 L222 | E214-A218 WeakPolarHBondContact O-CB 3.21Å; E214-A218 PolarHBondContact O-N 2.87Å; Y215-A218 PolarHBondContact O-N 3.46Å; A218-D221 PolarHBondContact O-N 2.97Å; A218-L222 WeakPolarHBondContact O-CB 3.47Å; A218-L222 PolarHBondContact O-N 3.35Å |
| 219 | K | 98.8 | Very high | 98.7 | Very high | 101 Ų | 101 | 91.6 Ų | 91.6 | 44% | 0.439 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.6 | -45 | 176.1 | -175.5 | 174.6 | -179 | 178.6 | 0 | 111.7 | Y215 V216 A217 L222 H223 | Y215-K219 HydrophobicContact CE1-CD 4.45Å; Y215-K219 WeakPolarHBondContact O-CB 3.48Å; Y215-K219 PolarHBondContact O-N 3.06Å; V216-K219 PolarHBondContact O-N 3.01Å; A217-K219 VanDerWaalsContact C-N 3.35Å; A217-K219 PolarHBondContact O-N 3.06Å; K219-L222 PolarHBondContact O-N 3.49Å; K219-H223 PolarHBondContact O-CD2 3.34Å; K219-H223 PolarHBondContact O-N 3.04Å; K219-H223 VanDerWaalsContact O-N 3.12Å |
| 220 | L | 98.8 | Very high | 98.7 | Very high | 86 Ų | 86 | 92.6 Ų | 92.6 | 45% | 0.45 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.7 | -38.9 | 176.9 | -69.1 | 176.5 | 0 | 0 | 0 | 112.1 | V216 A217 H223 R224 | V216-L220 HydrophobicContact CG1-CD1 4.25Å; V216-L220 WeakPolarHBondContact O-CG 3.3Å; V216-L220 PolarHBondContact O-N 3.02Å; A217-L220 PolarHBondContact O-N 2.94Å; L220-H223 PolarHBondContact O-N 3.05Å; L220-R224 WeakPolarHBondContact O-CG 3.47Å; L220-R224 PolarHBondContact O-N 2.66Å |
| 221 | D | 98.6 | Very high | 98.7 | Very high | 67 Ų | 67 | 91.6 Ų | 91.6 | 36% | 0.358 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.7 | -41.6 | 175.3 | -176.2 | 60.4 | 0 | 0 | 0 | 112.1 | A217 A218 R224 K225 | A217-D221 WeakPolarHBondContact O-CB 3.38Å; A217-D221 PolarHBondContact O-N 3.36Å; A218-D221 PolarHBondContact O-N 2.97Å; D221-R224 PolarHBondContact O-N 3.35Å; D221-K225 WeakPolarHBondContact O-CG 3.33Å; D221-K225 PolarHBondContact O-N 2.91Å; D221-K225 WeakPolarHBondContact OD1-CE 3.37Å; D221-K225 IonicContact OD1-NZ 3.36Å; D221-K225 WeakPolarHBondContact OD2-CE 3.33Å; D221-K225 IonicContact OD2-NZ 2.83Å; D221-K225 PolarHBondContact OD2-NZ 2.86Å |
| 222 | L | 98.6 | Very high | 98.7 | Very high | 108 Ų | 108 | 95 Ų | 95 | 57% | 0.565 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -57.9 | -50.5 | 174.2 | 178.1 | 63.3 | 0 | 0 | 0 | 111.3 | A218 K219 R224 K225 T226 | A218-L222 WeakPolarHBondContact O-CB 3.47Å; A218-L222 PolarHBondContact O-N 3.35Å; K219-L222 PolarHBondContact O-N 3.49Å; L222-R224 PolarHBondContact O-N 3Å; L222-K225 PolarHBondContact O-N 3.39Å; L222-T226 PolarHBondContact O-N 3.19Å; L222-T226 PolarHBondContact O-OG1 3.27Å; L222-T226 VanDerWaalsContact O-OG1 3.09Å |
| 223 | H | 98.8 | Very high | 98.7 | Very high | 95 Ų | 95 | 94.6 Ų | 94.6 | 44% | 0.44 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.8 | -47.4 | 178.2 | -79.2 | -68 | 0 | 0 | 0 | 112.1 | K219 L220 K225 T226 D227 | K219-H223 PolarHBondContact O-CD2 3.34Å; K219-H223 PolarHBondContact O-N 3.04Å; K219-H223 VanDerWaalsContact O-N 3.12Å; L220-H223 PolarHBondContact O-N 3.05Å; H223-K225 VanDerWaalsContact C-N 3.28Å; H223-K225 PolarHBondContact O-N 3.19Å; H223-T226 WeakPolarHBondContact O-CB 3.38Å; H223-T226 PolarHBondContact O-N 3.12Å; H223-T226 VanDerWaalsContact O-N 3.09Å; H223-D227 PolarHBondContact O-N 3.47Å |
| 224 | R | 98.8 | Very high | 98.7 | Very high | 153 Ų | 153 | 97.6 Ų | 97.6 | 58% | 0.577 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -58.3 | -39.9 | 178 | -70.4 | 172.4 | -168.5 | 141.9 | 2 | 112.8 | L220 D221 L222 A228 | L220-R224 WeakPolarHBondContact O-CG 3.47Å; L220-R224 PolarHBondContact O-N 2.66Å; D221-R224 PolarHBondContact O-N 3.35Å; L222-R224 PolarHBondContact O-N 3Å; R224-A228 WeakPolarHBondContact O-CB 3.37Å; R224-A228 PolarHBondContact O-N 3.35Å |
| 225 | K | 98.7 | Very high | 98.7 | Very high | 127 Ų | 127 | 98.3 Ų | 98.3 | 55% | 0.552 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -69.8 | -37.6 | 177.8 | -73.7 | 172.2 | 176.9 | 167.4 | 0 | 111.7 | D221 L222 H223 K229 | D221-K225 WeakPolarHBondContact O-CG 3.33Å; D221-K225 PolarHBondContact O-N 2.91Å; D221-K225 WeakPolarHBondContact OD1-CE 3.37Å; D221-K225 IonicContact OD1-NZ 3.36Å; D221-K225 WeakPolarHBondContact OD2-CE 3.33Å; D221-K225 IonicContact OD2-NZ 2.83Å; D221-K225 PolarHBondContact OD2-NZ 2.86Å; L222-K225 PolarHBondContact O-N 3.39Å; H223-K225 VanDerWaalsContact C-N 3.28Å; H223-K225 PolarHBondContact O-N 3.19Å; K225-K229 WeakPolarHBondContact O-CB 3.4Å; K225-K229 PolarHBondContact O-N 3.12Å |
| 226 | T | 98.8 | Very high | 98.7 | Very high | 49 Ų | 49 | 96.1 Ų | 96.1 | 30% | 0.301 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.7 | -50.3 | 172.2 | -60.8 | 0 | 0 | 0 | 0 | 110.8 | L222 H223 A228 K229 E230 | L222-T226 PolarHBondContact O-N 3.19Å; L222-T226 PolarHBondContact O-OG1 3.27Å; L222-T226 VanDerWaalsContact O-OG1 3.09Å; H223-T226 WeakPolarHBondContact O-CB 3.38Å; H223-T226 PolarHBondContact O-N 3.12Å; H223-T226 VanDerWaalsContact O-N 3.09Å; T226-A228 VanDerWaalsContact C-N 3.33Å; T226-A228 PolarHBondContact O-N 3.11Å; T226-K229 WeakPolarHBondContact O-CB 3.29Å; T226-K229 PolarHBondContact O-N 3.27Å; T226-K229 VanDerWaalsContact O-N 3.11Å; T226-E230 WeakPolarHBondContact CG2-OE1 3.41Å; T226-E230 WeakPolarHBondContact O-CG 3.37Å; T226-E230 PolarHBondContact O-N 3.48Å |
| 227 | D | 98.8 | Very high | 98.7 | Very high | 78 Ų | 78 | 100.5 Ų | 100.5 | 42% | 0.417 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.4 | -44 | 179 | -60 | -12.3 | 0 | 0 | 0 | 111.2 | H223 K229 E230 Q231 | H223-D227 PolarHBondContact O-N 3.47Å; D227-K229 VanDerWaalsContact C-N 3.35Å; D227-K229 PolarHBondContact O-N 3.24Å; D227-E230 PolarHBondContact O-N 2.99Å; D227-Q231 VanDerWaalsContact O-CG 3.32Å; D227-Q231 WeakPolarHBondContact O-CG 3.41Å; D227-Q231 PolarHBondContact O-N 3.06Å |
| 228 | A | 98.6 | Very high | 98.7 | Very high | 42 Ų | 42 | 99.8 Ų | 99.8 | 35% | 0.347 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | R224 T226 L232 | R224-A228 WeakPolarHBondContact O-CB 3.37Å; R224-A228 PolarHBondContact O-N 3.35Å; T226-A228 VanDerWaalsContact C-N 3.33Å; T226-A228 PolarHBondContact O-N 3.11Å; A228-L232 VanDerWaalsContact O-CG 3.29Å; A228-L232 WeakPolarHBondContact O-CG 3.46Å; A228-L232 PolarHBondContact O-N 3.09Å; A228-L232 VanDerWaalsContact O-N 3.09Å |
| 229 | K | 98.8 | Very high | 98.7 | Very high | 145 Ų | 145 | 102 Ų | 102 | 63% | 0.63 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.9 | -45.6 | 174.5 | 177.2 | -158 | 164.7 | -165.7 | 0 | 110.7 | K225 T226 D227 L232 T233 | K225-K229 WeakPolarHBondContact O-CB 3.4Å; K225-K229 PolarHBondContact O-N 3.12Å; T226-K229 WeakPolarHBondContact O-CB 3.29Å; T226-K229 PolarHBondContact O-N 3.27Å; T226-K229 VanDerWaalsContact O-N 3.11Å; D227-K229 VanDerWaalsContact C-N 3.35Å; D227-K229 PolarHBondContact O-N 3.24Å; K229-L232 PolarHBondContact O-N 3.36Å; K229-T233 WeakPolarHBondContact O-CB 3.42Å; K229-T233 PolarHBondContact O-N 2.93Å; K229-T233 PolarHBondContact O-OG1 3.03Å |
| 230 | E | 98.6 | Very high | 98.7 | Very high | 103 Ų | 103 | 101.2 Ų | 101.2 | 48% | 0.481 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.6 | -49.2 | 179.1 | -72.4 | 172.5 | -178.6 | 0 | 0 | 110.9 | T226 D227 L232 T233 E234 | T226-E230 WeakPolarHBondContact CG2-OE1 3.41Å; T226-E230 WeakPolarHBondContact O-CG 3.37Å; T226-E230 PolarHBondContact O-N 3.48Å; D227-E230 PolarHBondContact O-N 2.99Å; E230-L232 VanDerWaalsContact C-N 3.35Å; E230-L232 PolarHBondContact O-N 2.9Å; E230-T233 WeakPolarHBondContact O-CA 3.44Å; E230-T233 WeakPolarHBondContact O-CB 3.36Å; E230-T233 PolarHBondContact O-N 2.99Å; E230-E234 WeakPolarHBondContact O-CG 3.46Å; E230-E234 PolarHBondContact O-N 3.38Å |
| 231 | Q | 98.8 | Very high | 98.7 | Very high | 115 Ų | 115 | 103.1 Ų | 103.1 | 54% | 0.537 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.4 | -43.8 | 177.4 | -73.3 | 175.5 | -1.3 | 0 | 0 | 113.1 | D227 T233 E234 H235 | D227-Q231 VanDerWaalsContact O-CG 3.32Å; D227-Q231 WeakPolarHBondContact O-CG 3.41Å; D227-Q231 PolarHBondContact O-N 3.06Å; Q231-T233 VanDerWaalsContact C-N 3.29Å; Q231-T233 PolarHBondContact O-N 3.46Å; Q231-E234 PolarHBondContact O-N 3.44Å; Q231-H235 WeakPolarHBondContact O-CB 3.32Å; Q231-H235 PolarHBondContact O-N 2.85Å; Q231-H235 PolarHBondContact O-ND1 3.02Å |
| 232 | L | 98.7 | Very high | 98.7 | Very high | 125 Ų | 125 | 104.9 Ų | 104.9 | 65% | 0.654 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65.1 | -36.3 | 176.8 | -72.3 | 171.8 | 0 | 0 | 0 | 111.7 | A228 K229 E230 H235 L236 | A228-L232 VanDerWaalsContact O-CG 3.29Å; A228-L232 WeakPolarHBondContact O-CG 3.46Å; A228-L232 PolarHBondContact O-N 3.09Å; A228-L232 VanDerWaalsContact O-N 3.09Å; K229-L232 PolarHBondContact O-N 3.36Å; E230-L232 VanDerWaalsContact C-N 3.35Å; E230-L232 PolarHBondContact O-N 2.9Å; L232-H235 PolarHBondContact O-N 3.11Å; L232-L236 WeakPolarHBondContact O-CB 3.3Å; L232-L236 PolarHBondContact O-N 3.09Å |
| 233 | T | 98.7 | Very high | 98.7 | Very high | 82 Ų | 82 | 102.9 Ų | 102.9 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.3 | -43.5 | 177.1 | -53.6 | 0 | 0 | 0 | 0 | 110.8 | K229 E230 Q231 L236 Y237 | K229-T233 WeakPolarHBondContact O-CB 3.42Å; K229-T233 PolarHBondContact O-N 2.93Å; K229-T233 PolarHBondContact O-OG1 3.03Å; E230-T233 WeakPolarHBondContact O-CA 3.44Å; E230-T233 WeakPolarHBondContact O-CB 3.36Å; E230-T233 PolarHBondContact O-N 2.99Å; Q231-T233 VanDerWaalsContact C-N 3.29Å; Q231-T233 PolarHBondContact O-N 3.46Å; T233-L236 PolarHBondContact O-N 3.02Å; T233-Y237 PolarHBondContact O-N 3.33Å |
| 234 | E | 98.6 | Very high | 98.6 | Very high | 128 Ų | 128 | 102.9 Ų | 102.9 | 60% | 0.598 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.6 | -45.1 | 173.9 | -70.2 | 174.3 | 177.7 | 0 | 0 | 111.7 | E230 Q231 L236 Y237 A238 | E230-E234 WeakPolarHBondContact O-CG 3.46Å; E230-E234 PolarHBondContact O-N 3.38Å; Q231-E234 PolarHBondContact O-N 3.44Å; E234-L236 PolarHBondContact O-N 2.94Å; E234-Y237 PolarHBondContact O-N 3.45Å; E234-A238 PolarHBondContact O-N 2.92Å |
| 235 | H | 98.7 | Very high | 98.6 | Very high | 125 Ų | 125 | 101.2 Ų | 101.2 | 58% | 0.579 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.2 | -44.1 | 176.7 | -82.2 | 61.2 | 0 | 0 | 0 | 111.8 | Q231 L232 Y237 A238 I239 | Q231-H235 WeakPolarHBondContact O-CB 3.32Å; Q231-H235 PolarHBondContact O-N 2.85Å; Q231-H235 PolarHBondContact O-ND1 3.02Å; L232-H235 PolarHBondContact O-N 3.11Å; H235-Y237 VanDerWaalsContact C-N 3.35Å; H235-Y237 PolarHBondContact O-N 3.16Å; H235-A238 PolarHBondContact O-N 3.46Å; H235-I239 VanDerWaalsContact O-CG1 3.3Å; H235-I239 WeakPolarHBondContact O-CG1 2.96Å; H235-I239 PolarHBondContact O-N 3.48Å |
| 236 | L | 98.7 | Very high | 98.6 | Very high | 102 Ų | 102 | 102.7 Ų | 102.7 | 53% | 0.534 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.8 | -46.3 | 176 | 177.2 | 61.8 | 0 | 0 | 0 | 111.1 | L232 T233 E234 A238 I239 I240 | L232-L236 WeakPolarHBondContact O-CB 3.3Å; L232-L236 PolarHBondContact O-N 3.09Å; T233-L236 PolarHBondContact O-N 3.02Å; E234-L236 PolarHBondContact O-N 2.94Å; L236-A238 VanDerWaalsContact C-N 3.33Å; L236-A238 PolarHBondContact O-N 3.46Å; L236-I239 PolarHBondContact O-N 2.87Å; L236-I240 HydrophobicContact CD1-CD1 3.92Å; L236-I240 HydrophobicContact CD1-CG1 4.19Å; L236-I240 HydrophobicContact CG-CD1 3.85Å; L236-I240 HydrophobicContact CG-CG1 4.5Å; L236-I240 WeakPolarHBondContact O-CG1 3.33Å; L236-I240 PolarHBondContact O-N 3.47Å |
| 237 | Y | 98.6 | Very high | 98.6 | Very high | 162 Ų | 162 | 105 Ų | 105 | 64% | 0.635 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.6 | -44.3 | 178.3 | -171 | -99.3 | 0 | 0 | 0 | 111.7 | T233 E234 H235 I239 I240 Q241 | T233-Y237 PolarHBondContact O-N 3.33Å; E234-Y237 PolarHBondContact O-N 3.45Å; H235-Y237 VanDerWaalsContact C-N 3.35Å; H235-Y237 PolarHBondContact O-N 3.16Å; Y237-I239 PolarHBondContact O-N 3.27Å; Y237-I240 PolarHBondContact O-N 3.33Å; Y237-Q241 WeakPolarHBondContact O-CB 3.49Å; Y237-Q241 PolarHBondContact O-N 3.09Å |
| 238 | A | 98.7 | Very high | 98.6 | Very high | 42 Ų | 42 | 103.9 Ų | 103.9 | 35% | 0.347 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.8 | -42.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | E234 H235 L236 Q241 Q242 | E234-A238 PolarHBondContact O-N 2.92Å; H235-A238 PolarHBondContact O-N 3.46Å; L236-A238 VanDerWaalsContact C-N 3.33Å; L236-A238 PolarHBondContact O-N 3.46Å; A238-Q241 PolarHBondContact O-N 3.49Å; A238-Q242 WeakPolarHBondContact O-CB 3.43Å; A238-Q242 VanDerWaalsContact O-CG 3.31Å; A238-Q242 WeakPolarHBondContact O-CG 3.36Å; A238-Q242 PolarHBondContact O-N 2.97Å |
| 239 | I | 98.7 | Very high | 98.6 | Very high | 107 Ų | 107 | 104.7 Ų | 104.7 | 55% | 0.549 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.1 | -45.7 | 176.9 | -69.8 | 166.5 | 0 | 0 | 0 | 110.8 | H235 L236 Y237 Q242 N243 | H235-I239 VanDerWaalsContact O-CG1 3.3Å; H235-I239 WeakPolarHBondContact O-CG1 2.96Å; H235-I239 PolarHBondContact O-N 3.48Å; L236-I239 PolarHBondContact O-N 2.87Å; Y237-I239 PolarHBondContact O-N 3.27Å; I239-Q242 PolarHBondContact O-N 2.72Å; I239-N243 WeakPolarHBondContact O-CB 3.49Å; I239-N243 PolarHBondContact O-N 3.46Å |
| 240 | I | 98.6 | Very high | 98.5 | Very high | 85 Ų | 85 | 102.3 Ų | 102.3 | 44% | 0.436 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.7 | -50 | 178.2 | -68.6 | 168.2 | 0 | 0 | 0 | 109.8 | L236 Y237 Q242 N243 E244 | L236-I240 HydrophobicContact CD1-CD1 3.92Å; L236-I240 HydrophobicContact CD1-CG1 4.19Å; L236-I240 HydrophobicContact CG-CD1 3.85Å; L236-I240 HydrophobicContact CG-CG1 4.5Å; L236-I240 WeakPolarHBondContact O-CG1 3.33Å; L236-I240 PolarHBondContact O-N 3.47Å; Y237-I240 PolarHBondContact O-N 3.33Å; I240-Q242 VanDerWaalsContact C-N 3.33Å; I240-Q242 PolarHBondContact O-N 3.34Å; I240-N243 WeakPolarHBondContact O-CA 3.38Å; I240-N243 WeakPolarHBondContact O-CB 3.4Å; I240-N243 PolarHBondContact O-N 2.87Å; I240-E244 HydrophobicContact CG2-CG 4.36Å; I240-E244 WeakPolarHBondContact O-CG 3.48Å; I240-E244 PolarHBondContact O-N 2.93Å |
| 241 | Q | 98.6 | Very high | 98.5 | Very high | 125 Ų | 125 | 102.6 Ų | 102.6 | 58% | 0.584 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -57.8 | -44.7 | 179.9 | -172 | -178.2 | 27 | 0 | 0 | 112 | Y237 A238 N243 E244 L245 | Y237-Q241 WeakPolarHBondContact O-CB 3.49Å; Y237-Q241 PolarHBondContact O-N 3.09Å; A238-Q241 PolarHBondContact O-N 3.49Å; Q241-N243 VanDerWaalsContact C-N 3.31Å; Q241-N243 PolarHBondContact O-N 3.4Å; Q241-E244 PolarHBondContact O-N 2.92Å; Q241-L245 PolarHBondContact O-N 2.96Å |
| 242 | Q | 98.6 | Very high | 98.4 | Very high | 104 Ų | 104 | 102.6 Ų | 102.6 | 49% | 0.486 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.2 | -37 | 175.4 | -72.4 | -178.4 | 9.4 | 0 | 0 | 112.3 | A238 I239 I240 R246 | A238-Q242 WeakPolarHBondContact O-CB 3.43Å; A238-Q242 VanDerWaalsContact O-CG 3.31Å; A238-Q242 WeakPolarHBondContact O-CG 3.36Å; A238-Q242 PolarHBondContact O-N 2.97Å; I239-Q242 PolarHBondContact O-N 2.72Å; I240-Q242 VanDerWaalsContact C-N 3.33Å; I240-Q242 PolarHBondContact O-N 3.34Å; Q242-R246 VanDerWaalsContact O-CG 3.28Å; Q242-R246 WeakPolarHBondContact O-CG 3.48Å; Q242-R246 PolarHBondContact O-N 2.94Å; Q242-R246 VanDerWaalsContact OE1-NH2 3.08Å |
| 243 | N | 98.6 | Very high | 98.4 | Very high | 66 Ų | 66 | 101.2 Ų | 101.2 | 35% | 0.353 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.1 | -45.3 | 178.4 | -167.1 | -95.8 | 0 | 0 | 0 | 111.5 | I239 I240 Q241 L245 R246 K247 | I239-N243 WeakPolarHBondContact O-CB 3.49Å; I239-N243 PolarHBondContact O-N 3.46Å; I240-N243 WeakPolarHBondContact O-CA 3.38Å; I240-N243 WeakPolarHBondContact O-CB 3.4Å; I240-N243 PolarHBondContact O-N 2.87Å; Q241-N243 VanDerWaalsContact C-N 3.31Å; Q241-N243 PolarHBondContact O-N 3.4Å; N243-L245 VanDerWaalsContact C-N 3.34Å; N243-L245 PolarHBondContact O-N 3.1Å; N243-R246 PolarHBondContact O-N 2.69Å; N243-K247 WeakPolarHBondContact O-CG 3.34Å; N243-K247 PolarHBondContact O-N 3.34Å; N243-K247 WeakPolarHBondContact OD1-CE 3.49Å; N243-K247 PolarHBondContact OD1-NZ 3.21Å; N243-K247 VanDerWaalsContact OD1-NZ 3.1Å |
| 244 | E | 98.3 | Very high | 98.3 | Very high | 95 Ų | 95 | 100.7 Ų | 100.7 | 44% | 0.444 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.5 | -40.4 | 176.4 | -65.1 | -47.2 | 125.5 | 0 | 0 | 112 | I240 Q241 R246 K247 A248 | I240-E244 HydrophobicContact CG2-CG 4.36Å; I240-E244 WeakPolarHBondContact O-CG 3.48Å; I240-E244 PolarHBondContact O-N 2.93Å; Q241-E244 PolarHBondContact O-N 2.92Å; E244-R246 PolarHBondContact O-N 3.43Å; E244-K247 PolarHBondContact O-N 2.96Å; E244-K247 IonicContact OE1-NZ 3.17Å; E244-K247 PolarHBondContact OE1-NZ 2.91Å; E244-K247 IonicContact OE2-NZ 3.74Å; E244-A248 WeakPolarHBondContact O-CB 3.47Å; E244-A248 PolarHBondContact O-N 3.27Å |
| 245 | L | 98.4 | Very high | 98.1 | Very high | 119 Ų | 119 | 100.1 Ų | 100.1 | 62% | 0.623 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62 | -44.6 | 174.6 | -171.6 | 69.6 | 0 | 0 | 0 | 111.9 | Q241 N243 K247 A248 C249 | Q241-L245 PolarHBondContact O-N 2.96Å; N243-L245 VanDerWaalsContact C-N 3.34Å; N243-L245 PolarHBondContact O-N 3.1Å; L245-K247 PolarHBondContact O-N 3.42Å; L245-A248 PolarHBondContact O-N 3.32Å; L245-C249 PolarHBondContact O-N 3.48Å; L245-C249 PolarHBondContact O-SG 2.93Å; L245-C249 VanDerWaalsContact O-SG 3.37Å |
| 246 | R | 98.5 | Very high | 97.9 | Very high | 157 Ų | 157 | 98.8 Ų | 98.8 | 59% | 0.592 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63 | -41.8 | 176.8 | -70.7 | 175.7 | -147.5 | 166 | 7.2 | 111.8 | Q242 N243 E244 C249 K250 | Q242-R246 VanDerWaalsContact O-CG 3.28Å; Q242-R246 WeakPolarHBondContact O-CG 3.48Å; Q242-R246 PolarHBondContact O-N 2.94Å; Q242-R246 VanDerWaalsContact OE1-NH2 3.08Å; N243-R246 PolarHBondContact O-N 2.69Å; E244-R246 PolarHBondContact O-N 3.43Å; R246-C249 PolarHBondContact O-N 2.91Å; R246-K250 WeakPolarHBondContact O-CB 3.27Å; R246-K250 PolarHBondContact O-N 3.47Å |
| 247 | K | 98.5 | Very high | 97.7 | Very high | 99 Ų | 99 | 98.3 Ų | 98.3 | 43% | 0.43 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59.3 | -48.5 | 174.7 | -75.2 | 171.7 | 178.4 | 160.8 | 0 | 110.7 | N243 E244 L245 C249 K250 L251 | N243-K247 WeakPolarHBondContact O-CG 3.34Å; N243-K247 PolarHBondContact O-N 3.34Å; N243-K247 WeakPolarHBondContact OD1-CE 3.49Å; N243-K247 PolarHBondContact OD1-NZ 3.21Å; N243-K247 VanDerWaalsContact OD1-NZ 3.1Å; E244-K247 PolarHBondContact O-N 2.96Å; E244-K247 IonicContact OE1-NZ 3.17Å; E244-K247 PolarHBondContact OE1-NZ 2.91Å; E244-K247 IonicContact OE2-NZ 3.74Å; L245-K247 PolarHBondContact O-N 3.42Å; K247-C249 PolarHBondContact O-N 3.47Å; K247-K250 PolarHBondContact O-N 3.06Å; K247-L251 WeakPolarHBondContact O-CB 3.28Å; K247-L251 VanDerWaalsContact O-CG 3.27Å; K247-L251 WeakPolarHBondContact O-CG 3.31Å; K247-L251 PolarHBondContact O-N 3.01Å |
| 248 | A | 98.4 | Very high | 97.5 | Very high | 53 Ų | 53 | 95.7 Ų | 95.7 | 44% | 0.438 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.1 | -48.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | E244 L245 K250 L251 Q252 | E244-A248 WeakPolarHBondContact O-CB 3.47Å; E244-A248 PolarHBondContact O-N 3.27Å; L245-A248 PolarHBondContact O-N 3.32Å; A248-K250 PolarHBondContact O-N 3.47Å; A248-L251 PolarHBondContact O-N 3.05Å; A248-Q252 WeakPolarHBondContact O-CB 3.38Å; A248-Q252 PolarHBondContact O-N 3.01Å |
| 249 | C | 97.9 | Very high | 97 | Very high | 60 Ų | 60 | 98.6 Ų | 98.6 | 41% | 0.405 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 176.7 | -67.7 | 0 | 0 | 0 | 0 | 112.4 | L245 R246 K247 Q252 Q253 | L245-C249 PolarHBondContact O-N 3.48Å; L245-C249 PolarHBondContact O-SG 2.93Å; L245-C249 VanDerWaalsContact O-SG 3.37Å; R246-C249 PolarHBondContact O-N 2.91Å; K247-C249 PolarHBondContact O-N 3.47Å; C249-Q252 PolarHBondContact O-N 3.24Å; C249-Q253 WeakPolarHBondContact O-CG 3.31Å; C249-Q253 PolarHBondContact O-N 3.47Å |
| 250 | K | 98.3 | Very high | 96.2 | Very high | 94 Ų | 94 | 98.6 Ų | 98.6 | 41% | 0.409 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69.8 | -38.5 | -179.2 | -174.5 | 55.1 | -177.4 | 164.4 | 0 | 112.2 | R246 K247 A248 Q252 Q253 L254 | R246-K250 WeakPolarHBondContact O-CB 3.27Å; R246-K250 PolarHBondContact O-N 3.47Å; K247-K250 PolarHBondContact O-N 3.06Å; A248-K250 PolarHBondContact O-N 3.47Å; K250-Q252 VanDerWaalsContact C-N 3.35Å; K250-Q253 PolarHBondContact O-N 2.91Å; K250-L254 HydrophobicContact CD-CG 4.4Å; K250-L254 HydrophobicContact CG-CD1 4.29Å; K250-L254 WeakPolarHBondContact O-CG 3.48Å; K250-L254 PolarHBondContact O-N 3.47Å |
| 251 | L | 98.1 | Very high | 95.4 | Very high | 109 Ų | 109 | 99.6 Ų | 99.6 | 57% | 0.571 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.1 | -44.9 | 173.3 | -73.9 | 170.7 | 0 | 0 | 0 | 111 | K247 A248 Q253 L254 M255 | K247-L251 WeakPolarHBondContact O-CB 3.28Å; K247-L251 VanDerWaalsContact O-CG 3.27Å; K247-L251 WeakPolarHBondContact O-CG 3.31Å; K247-L251 PolarHBondContact O-N 3.01Å; A248-L251 PolarHBondContact O-N 3.05Å; L251-Q253 VanDerWaalsContact C-N 3.35Å; L251-Q253 PolarHBondContact O-N 2.86Å; L251-L254 PolarHBondContact O-N 2.98Å; L251-M255 WeakPolarHBondContact O-CG 3.35Å; L251-M255 PolarHBondContact O-N 3.34Å |
| 252 | Q | 97.1 | Very high | 94.5 | Very high | 116 Ų | 116 | 101.4 Ų | 101.4 | 54% | 0.542 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 176.1 | -177.2 | -178.7 | -6.9 | 0 | 0 | 112.1 | A248 C249 K250 M255 Q256 | A248-Q252 WeakPolarHBondContact O-CB 3.38Å; A248-Q252 PolarHBondContact O-N 3.01Å; C249-Q252 PolarHBondContact O-N 3.24Å; K250-Q252 VanDerWaalsContact C-N 3.35Å; Q252-M255 PolarHBondContact O-N 3.45Å; Q252-Q256 WeakPolarHBondContact O-CG 3.35Å; Q252-Q256 PolarHBondContact O-N 2.95Å; Q252-Q256 VanDerWaalsContact O-N 3.1Å |
| 253 | Q | 97.3 | Very high | 93.5 | Very high | 96 Ų | 96 | 102.2 Ų | 102.2 | 45% | 0.449 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -48.2 | 175.5 | -72.6 | 171 | -3.4 | 0 | 0 | 111.8 | C249 K250 L251 M255 Q256 E257 | C249-Q253 WeakPolarHBondContact O-CG 3.31Å; C249-Q253 PolarHBondContact O-N 3.47Å; K250-Q253 PolarHBondContact O-N 2.91Å; L251-Q253 VanDerWaalsContact C-N 3.35Å; L251-Q253 PolarHBondContact O-N 2.86Å; Q253-M255 VanDerWaalsContact C-N 3.32Å; Q253-M255 PolarHBondContact O-N 3.42Å; Q253-Q256 WeakPolarHBondContact O-CB 3.45Å; Q253-Q256 PolarHBondContact O-N 3.35Å; Q253-Q256 VanDerWaalsContact O-N 3.17Å; Q253-E257 WeakPolarHBondContact O-CG 3.48Å; Q253-E257 PolarHBondContact O-N 3.46Å |
| 254 | L | 97.3 | Very high | 92.3 | Very high | 70 Ų | 70 | 103.1 Ų | 103.1 | 37% | 0.366 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.5 | -37.5 | 179.1 | -69.9 | 172.2 | 0 | 0 | 0 | 112.1 | K250 L251 Q256 E257 L258 | K250-L254 HydrophobicContact CD-CG 4.4Å; K250-L254 HydrophobicContact CG-CD1 4.29Å; K250-L254 WeakPolarHBondContact O-CG 3.48Å; K250-L254 PolarHBondContact O-N 3.47Å; L251-L254 PolarHBondContact O-N 2.98Å; L254-Q256 VanDerWaalsContact C-N 3.32Å; L254-Q256 PolarHBondContact O-N 3.24Å; L254-E257 PolarHBondContact O-N 3.44Å; L254-L258 WeakPolarHBondContact O-CG 3.46Å; L254-L258 PolarHBondContact O-N 3.49Å |
| 255 | M | 94 | Very high | 91.1 | Very high | 116 Ų | 116 | 104.7 Ų | 104.7 | 57% | 0.571 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.9 | -40.2 | 174.1 | -74.9 | -175.4 | 70.8 | 0 | 0 | 112.1 | L251 Q252 Q253 Q259 | L251-M255 WeakPolarHBondContact O-CG 3.35Å; L251-M255 PolarHBondContact O-N 3.34Å; Q252-M255 PolarHBondContact O-N 3.45Å; Q253-M255 VanDerWaalsContact C-N 3.32Å; Q253-M255 PolarHBondContact O-N 3.42Å; M255-Q259 VanDerWaalsContact O-CG 3.27Å; M255-Q259 WeakPolarHBondContact O-CG 3.35Å; M255-Q259 PolarHBondContact O-N 2.96Å |
| 256 | Q | 95.3 | Very high | 89.7 | Confident | 97 Ų | 97 | 104.5 Ų | 104.5 | 45% | 0.453 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.7 | -43.7 | 175.4 | -70.1 | 170.7 | 8.5 | 0 | 0 | 111.6 | Q252 Q253 L254 L258 Q259 L260 | Q252-Q256 WeakPolarHBondContact O-CG 3.35Å; Q252-Q256 PolarHBondContact O-N 2.95Å; Q252-Q256 VanDerWaalsContact O-N 3.1Å; Q253-Q256 WeakPolarHBondContact O-CB 3.45Å; Q253-Q256 PolarHBondContact O-N 3.35Å; Q253-Q256 VanDerWaalsContact O-N 3.17Å; L254-Q256 VanDerWaalsContact C-N 3.32Å; L254-Q256 PolarHBondContact O-N 3.24Å; Q256-L258 VanDerWaalsContact C-N 3.32Å; Q256-L258 PolarHBondContact O-N 3.37Å; Q256-Q259 PolarHBondContact O-N 2.89Å; Q256-L260 WeakPolarHBondContact O-CG 3.38Å; Q256-L260 PolarHBondContact O-N 3.42Å |
| 257 | E | 94.4 | Very high | 88.2 | Confident | 92 Ų | 92 | 99.1 Ų | 99.1 | 43% | 0.43 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -58.5 | -43.1 | 175.6 | -71.5 | 170 | -160.1 | 0 | 0 | 111.7 | Q253 L254 L260 Q261 | Q253-E257 WeakPolarHBondContact O-CG 3.48Å; Q253-E257 PolarHBondContact O-N 3.46Å; L254-E257 PolarHBondContact O-N 3.44Å; E257-L260 PolarHBondContact O-N 2.99Å; E257-Q261 WeakPolarHBondContact O-CB 3.27Å; E257-Q261 VanDerWaalsContact O-CG 3.31Å; E257-Q261 WeakPolarHBondContact O-CG 3.4Å; E257-Q261 PolarHBondContact O-N 3.32Å |
| 258 | L | 93.3 | Very high | 86.3 | Confident | 107 Ų | 107 | 100.8 Ų | 100.8 | 56% | 0.56 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.9 | -38.1 | 176.2 | -73.4 | 173.4 | 0 | 0 | 0 | 112.9 | L254 Q256 Q261 R262 | L254-L258 WeakPolarHBondContact O-CG 3.46Å; L254-L258 PolarHBondContact O-N 3.49Å; Q256-L258 VanDerWaalsContact C-N 3.32Å; Q256-L258 PolarHBondContact O-N 3.37Å; L258-Q261 PolarHBondContact O-N 2.97Å; L258-R262 PolarHBondContact O-N 2.93Å |
| 259 | Q | 88.1 | Confident | 84.5 | Confident | 104 Ų | 104 | 101.5 Ų | 101.5 | 49% | 0.486 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.6 | -46.4 | 175.6 | -75.1 | 168.3 | -11.4 | 0 | 0 | 111.1 | M255 Q256 Q261 R262 E263 | M255-Q259 VanDerWaalsContact O-CG 3.27Å; M255-Q259 WeakPolarHBondContact O-CG 3.35Å; M255-Q259 PolarHBondContact O-N 2.96Å; Q256-Q259 PolarHBondContact O-N 2.89Å; Q259-Q261 VanDerWaalsContact C-N 3.35Å; Q259-Q261 PolarHBondContact O-N 3.45Å; Q259-R262 PolarHBondContact O-N 3.36Å; Q259-E263 WeakPolarHBondContact O-CG 3.31Å; Q259-E263 PolarHBondContact O-N 2.96Å |
| 260 | L | 82.5 | Confident | 82.6 | Confident | 106 Ų | 106 | 102.7 Ų | 102.7 | 56% | 0.555 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.7 | -40.1 | 176 | -67.9 | 171.8 | 0 | 0 | 0 | 112 | Q256 E257 E263 V264 | Q256-L260 WeakPolarHBondContact O-CG 3.38Å; Q256-L260 PolarHBondContact O-N 3.42Å; E257-L260 PolarHBondContact O-N 2.99Å; L260-E263 PolarHBondContact O-N 3.48Å; L260-V264 VanDerWaalsContact O-CG2 3.31Å; L260-V264 WeakPolarHBondContact O-CG2 3.49Å; L260-V264 PolarHBondContact O-N 3.42Å |
| 261 | Q | 82.1 | Confident | 80.6 | Confident | 107 Ų | 107 | 102.5 Ų | 102.5 | 50% | 0.5 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.3 | -44.7 | 174.3 | -77.8 | 172.9 | 2.6 | 0 | 0 | 111.7 | E257 L258 Q259 E263 V264 E265 | E257-Q261 WeakPolarHBondContact O-CB 3.27Å; E257-Q261 VanDerWaalsContact O-CG 3.31Å; E257-Q261 WeakPolarHBondContact O-CG 3.4Å; E257-Q261 PolarHBondContact O-N 3.32Å; L258-Q261 PolarHBondContact O-N 2.97Å; Q259-Q261 VanDerWaalsContact C-N 3.35Å; Q259-Q261 PolarHBondContact O-N 3.45Å; Q261-E263 PolarHBondContact O-N 3.27Å; Q261-V264 PolarHBondContact O-N 3.03Å; Q261-E265 WeakPolarHBondContact O-CG 3.41Å; Q261-E265 PolarHBondContact O-N 2.99Å |
| 262 | R | 79.3 | Confident | 78.7 | Confident | 162 Ų | 162 | 100.7 Ų | 100.7 | 61% | 0.611 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.3 | -44.7 | 175.1 | -175.4 | -171.3 | -66.8 | -172.6 | -2.7 | 111.8 | L258 Q259 V264 E265 E266 | L258-R262 PolarHBondContact O-N 2.93Å; Q259-R262 PolarHBondContact O-N 3.36Å; R262-V264 VanDerWaalsContact C-N 3.31Å; R262-V264 PolarHBondContact O-N 3.44Å; R262-E265 PolarHBondContact O-N 3.23Å; R262-E266 WeakPolarHBondContact CD-OE1 3.31Å; R262-E266 HydrophobicContact CG-CG 4.19Å; R262-E266 WeakPolarHBondContact CG-OE1 3.29Å; R262-E266 WeakPolarHBondContact O-CB 3.33Å; R262-E266 WeakPolarHBondContact O-CG 3.35Å; R262-E266 PolarHBondContact O-N 3.1Å |
| 263 | E | 77.3 | Confident | 76.1 | Confident | 122 Ų | 122 | 103.4 Ų | 103.4 | 57% | 0.57 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.4 | -37.6 | 178.3 | -72.2 | 172.9 | -173 | 0 | 0 | 112.3 | Q259 L260 Q261 G267 | Q259-E263 WeakPolarHBondContact O-CG 3.31Å; Q259-E263 PolarHBondContact O-N 2.96Å; L260-E263 PolarHBondContact O-N 3.48Å; Q261-E263 PolarHBondContact O-N 3.27Å; E263-G267 PolarHBondContact O-N 3.17Å |
| 264 | V | 74.6 | Confident | 73.6 | Confident | 85 Ų | 85 | 104.4 Ų | 104.4 | 52% | 0.515 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.5 | -44 | 174.5 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | L260 Q261 R262 G267 Q268 | L260-V264 VanDerWaalsContact O-CG2 3.31Å; L260-V264 WeakPolarHBondContact O-CG2 3.49Å; L260-V264 PolarHBondContact O-N 3.42Å; Q261-V264 PolarHBondContact O-N 3.03Å; R262-V264 VanDerWaalsContact C-N 3.31Å; R262-V264 PolarHBondContact O-N 3.44Å; V264-G267 PolarHBondContact O-N 3.39Å; V264-Q268 WeakPolarHBondContact O-CB 3.36Å; V264-Q268 VanDerWaalsContact O-CG 3.29Å; V264-Q268 WeakPolarHBondContact O-CG 3.36Å; V264-Q268 PolarHBondContact O-N 3.24Å |
| 265 | E | 72.7 | Confident | 71.1 | Confident | 128 Ų | 128 | 110 Ų | 110 | 60% | 0.598 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -65 | -42.2 | 176.9 | -72.9 | 177.4 | 177.2 | 0 | 0 | 112 | Q261 R262 Q268 A269 | Q261-E265 WeakPolarHBondContact O-CG 3.41Å; Q261-E265 PolarHBondContact O-N 2.99Å; R262-E265 PolarHBondContact O-N 3.23Å; E265-Q268 PolarHBondContact O-N 3.05Å; E265-A269 VanDerWaalsContact O-CB 3.31Å; E265-A269 WeakPolarHBondContact O-CB 3.18Å; E265-A269 PolarHBondContact O-N 3.48Å |
| 266 | E | 69.8 | Low | 68.5 | Low | 114 Ų | 114 | 116.3 Ų | 116.3 | 53% | 0.533 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65.6 | -38.4 | 174.8 | -74.5 | 177.3 | -175.4 | 0 | 0 | 111.8 | R262 A269 A270 | R262-E266 WeakPolarHBondContact CD-OE1 3.31Å; R262-E266 HydrophobicContact CG-CG 4.19Å; R262-E266 WeakPolarHBondContact CG-OE1 3.29Å; R262-E266 WeakPolarHBondContact O-CB 3.33Å; R262-E266 WeakPolarHBondContact O-CG 3.35Å; R262-E266 PolarHBondContact O-N 3.1Å; E266-A269 PolarHBondContact O-N 3.44Å; E266-A270 WeakPolarHBondContact O-CB 3.34Å; E266-A270 PolarHBondContact O-N 3.39Å |
| 267 | G | 65.9 | Low | 65.9 | Low | 45 Ų | 45 | 119.8 Ų | 119.8 | 46% | 0.464 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -66.4 | -34.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | E263 V264 A271 | E263-G267 PolarHBondContact O-N 3.17Å; V264-G267 PolarHBondContact O-N 3.39Å; G267-A271 PolarHBondContact O-N 2.83Å |
| 268 | Q | 59.5 | Low | 63.2 | Low | 134 Ų | 134 | 118.9 Ų | 118.9 | 63% | 0.626 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -75.5 | -37.8 | 174.2 | -71.6 | 177.3 | 9 | 0 | 0 | 112.2 | V264 E265 A271 | V264-Q268 WeakPolarHBondContact O-CB 3.36Å; V264-Q268 VanDerWaalsContact O-CG 3.29Å; V264-Q268 WeakPolarHBondContact O-CG 3.36Å; V264-Q268 PolarHBondContact O-N 3.24Å; E265-Q268 PolarHBondContact O-N 3.05Å; Q268-A271 PolarHBondContact O-N 3.46Å |
| 269 | A | 60.3 | Low | 60.4 | Low | 67 Ų | 67 | 119.8 Ų | 119.8 | 55% | 0.554 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -69.3 | -38.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | E265 E266 A271 A272 | E265-A269 VanDerWaalsContact O-CB 3.31Å; E265-A269 WeakPolarHBondContact O-CB 3.18Å; E265-A269 PolarHBondContact O-N 3.48Å; E266-A269 PolarHBondContact O-N 3.44Å; A269-A271 PolarHBondContact O-N 3.42Å; A269-A272 PolarHBondContact O-N 2.8Å; A269-A272 VanDerWaalsContact O-N 3.1Å |
| 270 | A | 57.6 | Low | 57.8 | Low | 85 Ų | 85 | 118.4 Ų | 118.4 | 70% | 0.702 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -68.4 | -22.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | E266 A272 | E266-A270 WeakPolarHBondContact O-CB 3.34Å; E266-A270 PolarHBondContact O-N 3.39Å; A270-A272 VanDerWaalsContact C-N 3.29Å |
| 271 | A | 57.3 | Low | 55.5 | Low | 91 Ų | 91 | 123 Ų | 123 | 75% | 0.752 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | -7.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | G267 Q268 A269 | G267-A271 PolarHBondContact O-N 2.83Å; Q268-A271 PolarHBondContact O-N 3.46Å; A269-A271 PolarHBondContact O-N 3.42Å |
| 272 | A | 56.6 | Low | 53.3 | Low | 71 Ų | 71 | 122.3 Ų | 122.3 | 59% | 0.587 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -112.2 | -2.5 | -164.3 | 0 | 0 | 0 | 0 | 0 | 117.4 | A269 A270 | A269-A272 PolarHBondContact O-N 2.8Å; A269-A272 VanDerWaalsContact O-N 3.1Å; A270-A272 VanDerWaalsContact C-N 3.29Å |
| 273 | E | 43.1 | Very low | 51.3 | Low | 172 Ų | 172 | 119.5 Ų | 119.5 | 80% | 0.804 | 72% | 0.722 | S | S | * | * | trans | -151.5 | 139.2 | 170.3 | -81.1 | -143.6 | 157.5 | 0 | 0 | 117.1 | ||||
| 274 | P | 45.8 | Very low | 49.7 | Very low | 118 Ų | 118 | 118.1 Ų | 118.1 | 77% | 0.766 | 73% | 0.731 | S | S | * | * | trans | -103.2 | 129 | 151.4 | 34.5 | -22.4 | 0 | 0 | 0 | 112.7 | ||||
| 275 | Q | 44.2 | Very low | 48.9 | Very low | 187 Ų | 187 | 119.8 Ų | 119.8 | 87% | 0.874 | 74% | 0.744 | S | S | * | * | trans | 48.1 | 121.9 | 153.7 | -63.9 | -171.8 | 3 | 0 | 0 | 121.3 | ||||
| 276 | R | 39.5 | Very low | 47.4 | Very low | 249 Ų | 249 | 119.7 Ų | 119.7 | 94% | 0.94 | 76% | 0.757 | S | S | * | * | -162.3 | 135.6 | 118 | -112.5 | -179.1 | -173.3 | 175.2 | 3.3 | 114.4 | |||||
| 277 | N | 39.6 | Very low | 46.1 | Very low | 170 Ų | 170 | 118.8 Ų | 118.8 | 91% | 0.909 | 77% | 0.769 | S | S | * | * | trans | -71.2 | 157.2 | 172.8 | -69.4 | -27.3 | 0 | 0 | 0 | 113.2 | ||||
| 278 | G | 37.5 | Very low | 44.9 | Very low | 72 Ų | 72 | 125.2 Ų | 125.2 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | trans | 153.7 | 91.3 | 150.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 279 | S | 35.8 | Very low | 43.8 | Very low | 126 Ų | 126 | 122.2 Ų | 122.2 | 88% | 0.881 | 80% | 0.797 | S | S | * | * | trans | 28.5 | 129.7 | 141.2 | 59.9 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 280 | G | 33.4 | Very low | 42.9 | Very low | 75 Ų | 75 | 125.5 Ų | 125.5 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | 107 | 101.7 | 117.1 | 0 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 281 | E | 33.5 | Very low | 42.1 | Very low | 202 Ų | 202 | 126.7 Ų | 126.7 | 94% | 0.944 | 82% | 0.819 | S | S | * | * | trans | 77.4 | 114.1 | 133.1 | -150.4 | 174.9 | 157.6 | 0 | 0 | 122.7 | ||||
| 282 | A | 35.4 | Very low | 41.5 | Very low | 93 Ų | 93 | 130.6 Ų | 130.6 | 77% | 0.769 | 82% | 0.822 | S | S | * | * | trans | 176.8 | 115.9 | 132.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 283 | A | 37.5 | Very low | 40.7 | Very low | 103 Ų | 103 | 133.9 Ų | 133.9 | 85% | 0.851 | 83% | 0.834 | S | S | * | * | 51.3 | 130.1 | 105.1 | 0 | 0 | 0 | 0 | 0 | 115 | |||||
| 284 | A | 43.6 | Very low | 40.4 | Very low | 93 Ų | 93 | 132.3 Ų | 132.3 | 77% | 0.769 | 83% | 0.831 | S | S | * | * | cis | -165.4 | 176.9 | 18.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 285 | P | 58.9 | Low | 40 | Very low | 120 Ų | 120 | 136.2 Ų | 136.2 | 78% | 0.779 | 84% | 0.839 | S | S | * | * | trans | -94.7 | 156.9 | -163.4 | 37.3 | -31.8 | 0 | 0 | 0 | 113.7 | ||||
| 286 | S | 41.1 | Very low | 39.6 | Very low | 126 Ų | 126 | 134.9 Ų | 134.9 | 88% | 0.881 | 83% | 0.832 | S | S | * | * | trans | -151.7 | 126.5 | 162.2 | -69.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 287 | A | 42.4 | Very low | 39.7 | Very low | 95 Ų | 95 | 132.3 Ų | 132.3 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | trans | -55.1 | 160.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 288 | L | 40.9 | Very low | 39.6 | Very low | 181 Ų | 181 | 128.1 Ų | 128.1 | 95% | 0.948 | 82% | 0.82 | S | S | * | * | trans | 167.5 | 101.7 | 145.5 | -87.3 | 167.8 | 0 | 0 | 0 | 104.6 | ||||
| 289 | G | 35.5 | Very low | 39.7 | Very low | 71 Ų | 71 | 131.3 Ų | 131.3 | 73% | 0.732 | 82% | 0.819 | S | S | * | * | 124.6 | 84.8 | 68.8 | 0 | 0 | 0 | 0 | 0 | 107 | S291 | G289-S291 PolarHBondContact O-N 3.32Å; G289-S291 VanDerWaalsContact O-N 3.16Å | |||
| 290 | S | 42.8 | Very low | 39.9 | Very low | 135 Ų | 135 | 132.1 Ų | 132.1 | 94% | 0.944 | 82% | 0.819 | S | S | * | * | trans | -70.8 | 102.4 | 164.8 | -63.2 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 291 | S | 40 | Very low | 40.2 | Very low | 110 Ų | 110 | 135.3 Ų | 135.3 | 77% | 0.769 | 81% | 0.813 | S | S | * | * | trans | -102.2 | 117.7 | 167.8 | -159.3 | 0 | 0 | 0 | 0 | 108.8 | G289 | G289-S291 PolarHBondContact O-N 3.32Å; G289-S291 VanDerWaalsContact O-N 3.16Å | ||
| 292 | E | 44.4 | Very low | 40.5 | Very low | 174 Ų | 174 | 133.5 Ų | 133.5 | 81% | 0.813 | 81% | 0.809 | S | S | * | * | trans | -43 | 138.8 | 158.1 | -65.3 | 161.6 | 131.5 | 0 | 0 | 111.3 | ||||
| 293 | V | 39 | Very low | 40.6 | Very low | 140 Ų | 140 | 136 Ų | 136 | 85% | 0.848 | 81% | 0.81 | S | S | * | * | trans | -131.1 | 93.3 | 146.2 | -168 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 294 | L | 37.3 | Very low | 40.6 | Very low | 139 Ų | 139 | 137.4 Ų | 137.4 | 73% | 0.728 | 81% | 0.808 | S | S | * | * | trans | 3.9 | 110.9 | 147.8 | -62.1 | 163.2 | 0 | 0 | 0 | 116 | E296 | L294-E296 PolarHBondContact O-N 3.26Š| ||
| 295 | Q | 37.5 | Very low | 40.8 | Very low | 200 Ų | 200 | 141.7 Ų | 141.7 | 94% | 0.935 | 81% | 0.812 | S | S | * | * | trans | -74.5 | 106.5 | 144.3 | -86.3 | 169.3 | -14 | 0 | 0 | 107.6 | ||||
| 296 | E | 36.9 | Very low | 40.3 | Very low | 158 Ų | 158 | 142 Ų | 142 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | -123 | 82.6 | 164.4 | -160 | 176.2 | 162.8 | 0 | 0 | 107.6 | L294 A298 | L294-E296 PolarHBondContact O-N 3.26Å; E296-A298 PolarHBondContact O-N 2.93Å | ||
| 297 | E | 40 | Very low | 40.1 | Very low | 196 Ų | 196 | 142.9 Ų | 142.9 | 92% | 0.916 | 81% | 0.809 | S | S | * | * | trans | -81.8 | 91.6 | 163.4 | -74.7 | -161.4 | 135.3 | 0 | 0 | 108.3 | L299 | E297-L299 PolarHBondContact O-N 2.97Š| ||
| 298 | A | 38.4 | Very low | 39.8 | Very low | 81 Ų | 81 | 144.2 Ų | 144.2 | 67% | 0.669 | 81% | 0.811 | S | S | * | * | trans | -78.6 | 113.6 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | E296 | E296-A298 PolarHBondContact O-N 2.93Š| ||
| 299 | L | 38.3 | Very low | 39.7 | Very low | 139 Ų | 139 | 144.2 Ų | 144.2 | 73% | 0.728 | 80% | 0.803 | S | S | * | * | trans | 52.4 | 89.1 | 132.3 | -155 | 88.7 | 0 | 0 | 0 | 117.5 | E297 Q301 | E297-L299 PolarHBondContact O-N 2.97Å; L299-Q301 HydrophobicContact CD2-CG 3.98Å; L299-Q301 PolarHBondContact O-N 3.4Å | ||
| 300 | V | 41.1 | Very low | 40.3 | Very low | 144 Ų | 144 | 152.5 Ų | 152.5 | 87% | 0.873 | 81% | 0.813 | S | S | * | * | trans | -72.2 | 106.5 | 151.5 | 177.9 | 0 | 0 | 0 | 0 | 107.7 | L302 | V300-L302 PolarHBondContact O-N 3.42Å; V300-L302 VanDerWaalsContact O-N 3.11Å | ||
| 301 | Q | 38.9 | Very low | 40.2 | Very low | 141 Ų | 141 | 151.2 Ų | 151.2 | 66% | 0.659 | 80% | 0.804 | S | S | * | * | trans | -57.5 | 110.7 | 170.6 | -67.9 | 174.2 | 9.6 | 0 | 0 | 109.5 | L299 N303 | L299-Q301 HydrophobicContact CD2-CG 3.98Å; L299-Q301 PolarHBondContact O-N 3.4Å; Q301-N303 PolarHBondContact O-N 3.02Å; Q301-N303 VanDerWaalsContact O-N 3.12Å | ||
| 302 | L | 40 | Very low | 40.5 | Very low | 165 Ų | 165 | 154 Ų | 154 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | trans | -62.4 | 105.5 | 156 | -78.3 | 160.5 | 0 | 0 | 0 | 107 | V300 T304 | V300-L302 PolarHBondContact O-N 3.42Å; V300-L302 VanDerWaalsContact O-N 3.11Å; L302-T304 PolarHBondContact O-N 3.28Å | ||
| 303 | N | 37.4 | Very low | 40.1 | Very low | 145 Ų | 145 | 152.3 Ų | 152.3 | 78% | 0.775 | 80% | 0.801 | S | S | * | * | trans | -64.9 | 105.5 | 166.1 | -78.3 | -47.2 | 0 | 0 | 0 | 107.9 | Q301 E305 | Q301-N303 PolarHBondContact O-N 3.02Å; Q301-N303 VanDerWaalsContact O-N 3.12Å; N303-E305 PolarHBondContact O-N 2.92Å | ||
| 304 | T | 38.7 | Very low | 40.3 | Very low | 133 Ų | 133 | 152 Ų | 152 | 82% | 0.816 | 80% | 0.804 | S | S | * | * | trans | -59.5 | 115.6 | 162.6 | 26.2 | 0 | 0 | 0 | 0 | 109.3 | L302 | L302-T304 PolarHBondContact O-N 3.28Š| ||
| 305 | E | 47.6 | Very low | 40.3 | Very low | 183 Ų | 183 | 152.7 Ų | 152.7 | 86% | 0.855 | 81% | 0.808 | S | S | * | * | trans | -61.5 | 134.8 | 159.5 | -65.2 | -172.8 | 125.6 | 0 | 0 | 108.9 | N303 D307 | N303-E305 PolarHBondContact O-N 2.92Å; E305-D307 PolarHBondContact O-N 3.36Å | ||
| 306 | P | 48.4 | Very low | 40.8 | Very low | 126 Ų | 126 | 149.1 Ų | 149.1 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -74.4 | 99.1 | 164.9 | 28.9 | -29.4 | 0 | 0 | 0 | 108.5 | C308 | P306-C308 VanDerWaalsContact C-N 3.34Å; P306-C308 PolarHBondContact O-N 3.48Å | ||
| 307 | D | 37.4 | Very low | 41 | Very low | 144 Ų | 144 | 146.4 Ų | 146.4 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | trans | -55.9 | 97.6 | 159.6 | -163.9 | -31.9 | 0 | 0 | 0 | 108.4 | E305 K309 | E305-D307 PolarHBondContact O-N 3.36Å; D307-K309 VanDerWaalsContact C-N 3.28Å; D307-K309 PolarHBondContact O-N 2.97Å | ||
| 308 | C | 35.3 | Very low | 41.5 | Very low | 124 Ų | 124 | 148 Ų | 148 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -76.6 | 88.3 | 175.9 | -160.4 | 0 | 0 | 0 | 0 | 107.8 | P306 R310 | P306-C308 VanDerWaalsContact C-N 3.34Å; P306-C308 PolarHBondContact O-N 3.48Å; C308-R310 PolarHBondContact O-N 2.96Å; C308-R310 VanDerWaalsContact O-N 3.11Å | ||
| 309 | K | 39.6 | Very low | 42.4 | Very low | 180 Ų | 180 | 150.1 Ų | 150.1 | 78% | 0.783 | 81% | 0.809 | S | S | * | * | trans | -38.8 | 114.4 | 172.5 | -68.1 | 178.3 | 178.2 | 177.9 | 0 | 111.5 | D307 S311 | D307-K309 VanDerWaalsContact C-N 3.28Å; D307-K309 PolarHBondContact O-N 2.97Å; K309-S311 PolarHBondContact O-N 2.83Å; K309-S311 VanDerWaalsContact O-N 3.11Å | ||
| 310 | R | 48.2 | Very low | 43.3 | Very low | 246 Ų | 246 | 151.8 Ų | 151.8 | 93% | 0.928 | 82% | 0.817 | S | S | * | * | trans | -60.8 | 98.9 | 152.6 | -176.7 | 173.5 | -172.3 | 175 | 1.3 | 107.5 | C308 | C308-R310 PolarHBondContact O-N 2.96Å; C308-R310 VanDerWaalsContact O-N 3.11Å | ||
| 311 | S | 40.4 | Very low | 43.8 | Very low | 108 Ų | 108 | 151 Ų | 151 | 76% | 0.755 | 81% | 0.813 | S | S | * | * | trans | -96.6 | 118.7 | 164.7 | 66.3 | 0 | 0 | 0 | 0 | 109.6 | K309 | K309-S311 PolarHBondContact O-N 2.83Å; K309-S311 VanDerWaalsContact O-N 3.11Å | ||
| 312 | E | 45 | Very low | 44.8 | Very low | 167 Ų | 167 | 153.9 Ų | 153.9 | 78% | 0.78 | 85% | 0.849 | S | S | * | * | trans | -47.1 | 137.6 | 169.4 | -59.6 | 160.4 | 115.1 | 0 | 0 | 113.4 | ||||
| 313 | N | 36.9 | Very low | 45 | Very low | 140 Ų | 140 | 153.4 Ų | 153.4 | 75% | 0.749 | 85% | 0.848 | S | S | * | * | 155.3 | 116.8 | 116.3 | -84.5 | -22.6 | 0 | 0 | 0 | 111.7 | D315 | N313-D315 PolarHBondContact O-N 3.1Š| |||
| 314 | C | 42.8 | Very low | 45.4 | Very low | 133 Ų | 133 | 153.8 Ų | 153.8 | 90% | 0.899 | 85% | 0.852 | S | S | * | * | trans | -69.2 | 103.1 | 159.9 | -73.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 315 | D | 37.3 | Very low | 45.8 | Very low | 153 Ų | 153 | 154.9 Ų | 154.9 | 82% | 0.818 | 85% | 0.854 | S | S | * | * | trans | -94.3 | 122.5 | 164.4 | -109.7 | -51.2 | 0 | 0 | 0 | 110.4 | N313 A317 | N313-D315 PolarHBondContact O-N 3.1Å; D315-A317 PolarHBondContact O-N 3.36Å | ||
| 316 | V | 48.3 | Very low | 45.7 | Very low | 126 Ų | 126 | 153.3 Ų | 153.3 | 76% | 0.764 | 85% | 0.854 | S | S | * | * | trans | -74.9 | 108.7 | 179.6 | 171.4 | 0 | 0 | 0 | 0 | 108.4 | R318 | V316-R318 PolarHBondContact O-N 3.37Š| ||
| 317 | A | 40.9 | Very low | 45.5 | Very low | 101 Ų | 101 | 155 Ų | 155 | 84% | 0.835 | 86% | 0.856 | S | S | * | * | trans | -80.4 | 101.6 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | D315 | D315-A317 PolarHBondContact O-N 3.36Š| ||
| 318 | R | 50 | Low | 46 | Very low | 230 Ų | 230 | 155.7 Ų | 155.7 | 87% | 0.868 | 86% | 0.862 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 143 | 156.2 | -95.8 | -177.4 | 171.6 | -165.2 | -1.3 | 109.6 | V316 | V316-R318 PolarHBondContact O-N 3.37Š|
| 319 | P | 57.4 | Low | 46.8 | Very low | 124 Ų | 124 | 158 Ų | 158 | 81% | 0.805 | 86% | 0.864 | S | S | * | * | P | Polyproline II helix | trans | -83.3 | 138.5 | 170.8 | 32.3 | -30 | 0 | 0 | 0 | 111.5 | ||
| 320 | L | 57.2 | Low | 47.4 | Very low | 174 Ų | 174 | 156.3 Ų | 156.3 | 91% | 0.911 | 87% | 0.87 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 132.2 | 169.7 | -87.7 | 155.3 | 0 | 0 | 0 | 110.2 | ||
| 321 | T | 52.3 | Low | 47.3 | Very low | 128 Ų | 128 | 148.8 Ų | 148.8 | 79% | 0.785 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 126.9 | 168.6 | 47.7 | 0 | 0 | 0 | 0 | 111.2 | ||
| 322 | S | 59.2 | Low | 47.9 | Very low | 202 Ų | 202 | 152.5 Ų | 152.5 | 100% | 1.413 | 88% | 0.875 | S | S | * | * | trans | -166 | 0 | 140.8 | -82.7 | 0 | 0 | 0 | 0 | 109.3 |
Retrieved 322 of 322 residues in 315.6 ms
(Link to these results)