| 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 | 49.6 | Very low | 71.8 | Confident | 233 Ų | 233 | 131.5 Ų | 131.5 | 100% | 1.148 | 67% | 0.674 | S | S | * | * | 0 | 29.2 | 0 | -65.7 | -159.5 | -68.7 | 0 | 0 | 113.7 | |||||
| 2 | L | 52.7 | Low | 73.6 | Confident | 149 Ų | 149 | 131.4 Ų | 131.4 | 78% | 0.78 | 67% | 0.669 | S | S | * | * | trans | -97.2 | -1.3 | -171.8 | -80.6 | 159 | 0 | 0 | 0 | 115.6 | I5 | L2-I5 HydrophobicContact CD2-CD1 3.89Š| ||
| 3 | Q | 57.5 | Low | 75.2 | Confident | 187 Ų | 187 | 130.6 Ų | 130.6 | 87% | 0.874 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | -11 | -173.1 | -77.5 | 176.9 | -20 | 0 | 0 | 115.4 | ||
| 4 | K | 56.6 | Low | 76.7 | Confident | 192 Ų | 192 | 128.4 Ų | 128.4 | 84% | 0.835 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -9.1 | -179.3 | -72.2 | -170.6 | 176.6 | -176 | 0 | 114.8 | ||
| 5 | I | 58.5 | Low | 77.9 | Confident | 100 Ų | 100 | 126.1 Ų | 126.1 | 51% | 0.513 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -80.5 | -30.5 | -172.7 | -57.2 | 177 | 0 | 0 | 0 | 111.6 | L2 Q9 | L2-I5 HydrophobicContact CD2-CD1 3.89Å; I5-Q9 WeakPolarHBondContact O-CB 3.32Å; I5-Q9 PolarHBondContact O-N 2.97Å |
| 6 | S | 71.8 | Confident | 79.1 | Confident | 88 Ų | 88 | 120.6 Ų | 120.6 | 62% | 0.615 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -66.3 | -44.4 | -174.4 | 167.1 | 0 | 0 | 0 | 0 | 115.5 | K10 | S6-K10 PolarHBondContact O-N 3.5Å |
| 7 | P | 86 | Confident | 80.2 | Confident | 79 Ų | 79 | 117.9 Ų | 117.9 | 51% | 0.513 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -71.5 | -36.2 | -177.8 | -20.8 | 33.8 | 0 | 0 | 0 | 113.6 | K10 C11 | P7-K10 PolarHBondContact O-N 3Å; P7-C11 PolarHBondContact O-N 3.45Å |
| 8 | L | 87 | Confident | 81.2 | Confident | 116 Ų | 116 | 117.8 Ų | 117.8 | 61% | 0.607 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -67.8 | -42.1 | -179.9 | -177.9 | 65.3 | 0 | 0 | 0 | 111.5 | K10 C11 Q12 | L8-K10 VanDerWaalsContact C-N 3.33Å; L8-C11 PolarHBondContact O-N 3.01Å; L8-Q12 PolarHBondContact O-N 3.34Å |
| 9 | Q | 89.6 | Confident | 82.1 | Confident | 103 Ų | 103 | 118.5 Ų | 118.5 | 48% | 0.481 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -62.5 | -42.8 | 176.9 | -170.7 | 171.8 | -8.7 | 0 | 0 | 111.1 | I5 C11 Q12 E13 | I5-Q9 WeakPolarHBondContact O-CB 3.32Å; I5-Q9 PolarHBondContact O-N 2.97Å; Q9-C11 PolarHBondContact O-N 3.16Å; Q9-Q12 WeakPolarHBondContact O-CB 3.39Å; Q9-Q12 PolarHBondContact O-N 3.27Å; Q9-Q12 VanDerWaalsContact O-N 3.16Å; Q9-E13 WeakPolarHBondContact O-CG 3.48Å; Q9-E13 PolarHBondContact O-N 3.37Å |
| 10 | K | 89.3 | Confident | 82.9 | Confident | 125 Ų | 125 | 115.8 Ų | 115.8 | 54% | 0.543 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -60.9 | -44.9 | 174.2 | -166.1 | 178.9 | -179.6 | -173.8 | 0 | 112.5 | S6 P7 L8 Q12 E13 E14 | S6-K10 PolarHBondContact O-N 3.5Å; P7-K10 PolarHBondContact O-N 3Å; L8-K10 VanDerWaalsContact C-N 3.33Å; K10-Q12 VanDerWaalsContact C-N 3.29Å; K10-Q12 PolarHBondContact O-N 3.31Å; K10-E13 PolarHBondContact O-N 3.24Å; K10-E14 WeakPolarHBondContact CE-OE1 3.47Å; K10-E14 WeakPolarHBondContact O-CG 3.5Å; K10-E14 PolarHBondContact O-N 2.91Å |
| 11 | C | 91.1 | Very high | 83.6 | Confident | 75 Ų | 75 | 114.8 Ų | 114.8 | 51% | 0.507 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -60.8 | -36.2 | 174.1 | -78.9 | 0 | 0 | 0 | 0 | 112.8 | P7 L8 Q9 L15 | P7-C11 PolarHBondContact O-N 3.45Å; L8-C11 PolarHBondContact O-N 3.01Å; Q9-C11 PolarHBondContact O-N 3.16Å; C11-L15 VanDerWaalsContact O-CB 3.24Å; C11-L15 WeakPolarHBondContact O-CB 3.36Å; C11-L15 PolarHBondContact O-N 3.43Å |
| 12 | Q | 93.9 | Very high | 85.9 | Confident | 130 Ų | 130 | 108.1 Ų | 108.1 | 61% | 0.607 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -67.7 | -41.2 | 176.2 | -86 | 179.4 | -32.2 | 0 | 0 | 112.4 | L8 Q9 K10 L15 G16 | L8-Q12 PolarHBondContact O-N 3.34Å; Q9-Q12 WeakPolarHBondContact O-CB 3.39Å; Q9-Q12 PolarHBondContact O-N 3.27Å; Q9-Q12 VanDerWaalsContact O-N 3.16Å; K10-Q12 VanDerWaalsContact C-N 3.29Å; K10-Q12 PolarHBondContact O-N 3.31Å; Q12-L15 PolarHBondContact O-N 3.46Å; Q12-G16 PolarHBondContact O-N 2.93Å |
| 13 | E | 94.1 | Very high | 88.1 | Confident | 121 Ų | 121 | 105.7 Ų | 105.7 | 57% | 0.565 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -64.1 | -46.8 | 175.8 | -71.8 | 168.9 | -170.2 | 0 | 0 | 111.5 | Q9 K10 L15 G16 S17 | Q9-E13 WeakPolarHBondContact O-CG 3.48Å; Q9-E13 PolarHBondContact O-N 3.37Å; K10-E13 PolarHBondContact O-N 3.24Å; E13-L15 VanDerWaalsContact C-N 3.33Å; E13-L15 PolarHBondContact O-N 2.97Å; E13-G16 PolarHBondContact O-N 3.42Å; E13-G16 VanDerWaalsContact O-N 3.14Å; E13-S17 PolarHBondContact O-N 3.35Å |
| 14 | E | 95.6 | Very high | 90 | Very high | 100 Ų | 100 | 102.4 Ų | 102.4 | 47% | 0.467 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60 | -43 | 175.8 | -72.7 | 173.2 | -171 | 0 | 0 | 111.5 | K10 G16 S17 L18 | K10-E14 WeakPolarHBondContact CE-OE1 3.47Å; K10-E14 WeakPolarHBondContact O-CG 3.5Å; K10-E14 PolarHBondContact O-N 2.91Å; E14-G16 VanDerWaalsContact C-N 3.32Å; E14-G16 PolarHBondContact O-N 3.27Å; E14-S17 PolarHBondContact O-N 3.44Å; E14-L18 WeakPolarHBondContact O-CG 3.29Å; E14-L18 PolarHBondContact O-N 3Å |
| 15 | L | 95.5 | Very high | 92 | Very high | 94 Ų | 94 | 98.9 Ų | 98.9 | 49% | 0.492 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.7 | -34.5 | 176.3 | -172.8 | 135.1 | 0 | 0 | 0 | 112.5 | C11 Q12 E13 K19 | C11-L15 VanDerWaalsContact O-CB 3.24Å; C11-L15 WeakPolarHBondContact O-CB 3.36Å; C11-L15 PolarHBondContact O-N 3.43Å; Q12-L15 PolarHBondContact O-N 3.46Å; E13-L15 VanDerWaalsContact C-N 3.33Å; E13-L15 PolarHBondContact O-N 2.97Å; L15-K19 HydrophobicContact CD2-CD 4.13Å; L15-K19 WeakPolarHBondContact O-CG 3.24Å; L15-K19 PolarHBondContact O-N 3.17Å |
| 16 | G | 97.3 | Very high | 93.9 | Very high | 37 Ų | 37 | 99 Ų | 99 | 38% | 0.381 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.9 | -45.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q12 E13 E14 K19 A20 | Q12-G16 PolarHBondContact O-N 2.93Å; E13-G16 PolarHBondContact O-N 3.42Å; E13-G16 VanDerWaalsContact O-N 3.14Å; E14-G16 VanDerWaalsContact C-N 3.32Å; E14-G16 PolarHBondContact O-N 3.27Å; G16-K19 PolarHBondContact O-N 2.94Å; G16-A20 PolarHBondContact O-N 3.38Å; G16-A20 VanDerWaalsContact O-N 3.12Å |
| 17 | S | 97.3 | Very high | 95.2 | Very high | 76 Ų | 76 | 98.7 Ų | 98.7 | 53% | 0.531 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -46.3 | 176.9 | 178.7 | 0 | 0 | 0 | 0 | 112 | E13 E14 K19 A20 E21 | E13-S17 PolarHBondContact O-N 3.35Å; E14-S17 PolarHBondContact O-N 3.44Å; S17-K19 VanDerWaalsContact C-N 3.3Å; S17-K19 PolarHBondContact O-N 3.12Å; S17-A20 PolarHBondContact O-N 3.32Å; S17-E21 PolarHBondContact O-N 3.2Å |
| 18 | L | 97.8 | Very high | 95.8 | Very high | 115 Ų | 115 | 97.6 Ų | 97.6 | 60% | 0.602 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.3 | -35.5 | 178.1 | -73.1 | 172.7 | 0 | 0 | 0 | 112.7 | E14 L22 | E14-L18 WeakPolarHBondContact O-CG 3.29Å; E14-L18 PolarHBondContact O-N 3Å; L18-L22 VanDerWaalsContact O-CB 3.29Å; L18-L22 WeakPolarHBondContact O-CB 3.3Å; L18-L22 PolarHBondContact O-N 2.7Å |
| 19 | K | 98 | Very high | 96.3 | Very high | 131 Ų | 131 | 96.9 Ų | 96.9 | 57% | 0.57 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.4 | -42.8 | 174.6 | -77.7 | 175 | 178 | 178.3 | 0 | 112.1 | L15 G16 S17 L22 E23 | L15-K19 HydrophobicContact CD2-CD 4.13Å; L15-K19 WeakPolarHBondContact O-CG 3.24Å; L15-K19 PolarHBondContact O-N 3.17Å; G16-K19 PolarHBondContact O-N 2.94Å; S17-K19 VanDerWaalsContact C-N 3.3Å; S17-K19 PolarHBondContact O-N 3.12Å; K19-L22 PolarHBondContact O-N 2.91Å; K19-E23 PolarHBondContact O-N 2.9Å; K19-E23 VanDerWaalsContact O-N 3.12Å |
| 20 | A | 98 | Very high | 96.7 | Very high | 65 Ų | 65 | 98.4 Ų | 98.4 | 54% | 0.537 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.1 | -46.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.1 | G16 S17 L22 E23 E24 | G16-A20 PolarHBondContact O-N 3.38Å; G16-A20 VanDerWaalsContact O-N 3.12Å; S17-A20 PolarHBondContact O-N 3.32Å; A20-L22 VanDerWaalsContact C-N 3.32Å; A20-L22 PolarHBondContact O-N 3.43Å; A20-E23 PolarHBondContact O-N 3.14Å; A20-E24 PolarHBondContact O-N 2.95Å |
| 21 | E | 97.9 | Very high | 97.2 | Very high | 94 Ų | 94 | 98 Ų | 98 | 44% | 0.439 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.8 | -40.8 | 176.8 | -171.1 | 175.4 | -176.2 | 0 | 0 | 111.4 | S17 E23 E24 K25 | S17-E21 PolarHBondContact O-N 3.2Å; E21-E23 PolarHBondContact O-N 2.97Å; E21-E24 PolarHBondContact O-N 3.12Å; E21-K25 HydrophobicContact CG-CG 4.36Å; E21-K25 VanDerWaalsContact O-CG 3.3Å; E21-K25 WeakPolarHBondContact O-CG 3.3Å; E21-K25 PolarHBondContact O-N 3.41Å |
| 22 | L | 98.2 | Very high | 97.5 | Very high | 93 Ų | 93 | 103.2 Ų | 103.2 | 49% | 0.487 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.2 | -44 | 176.2 | 179.9 | 64.2 | 0 | 0 | 0 | 112.2 | L18 K19 A20 K25 K26 | L18-L22 VanDerWaalsContact O-CB 3.29Å; L18-L22 WeakPolarHBondContact O-CB 3.3Å; L18-L22 PolarHBondContact O-N 2.7Å; K19-L22 PolarHBondContact O-N 2.91Å; A20-L22 VanDerWaalsContact C-N 3.32Å; A20-L22 PolarHBondContact O-N 3.43Å; L22-K25 PolarHBondContact O-N 3.01Å; L22-K26 HydrophobicContact CG-CD 4.48Å; L22-K26 VanDerWaalsContact O-CG 3.3Å; L22-K26 WeakPolarHBondContact O-CG 3.45Å; L22-K26 PolarHBondContact O-N 2.88Å |
| 23 | E | 98.3 | Very high | 97.7 | Very high | 99 Ų | 99 | 102 Ų | 102 | 46% | 0.463 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.6 | -35.5 | 177.6 | -69.3 | -51.6 | 137.1 | 0 | 0 | 112.7 | K19 A20 E21 K26 S27 | K19-E23 PolarHBondContact O-N 2.9Å; K19-E23 VanDerWaalsContact O-N 3.12Å; A20-E23 PolarHBondContact O-N 3.14Å; E21-E23 PolarHBondContact O-N 2.97Å; E23-K26 PolarHBondContact O-N 3.24Å; E23-K26 IonicContact OE1-NZ 2.7Å; E23-K26 PolarHBondContact OE1-NZ 3.02Å; E23-K26 IonicContact OE2-NZ 3.94Å; E23-S27 WeakPolarHBondContact O-CB 3.34Å; E23-S27 PolarHBondContact O-N 3.48Å; E23-S27 PolarHBondContact O-OG 3.25Å |
| 24 | E | 98.3 | Very high | 97.9 | Very high | 118 Ų | 118 | 99.8 Ų | 99.8 | 55% | 0.551 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.5 | -45.9 | 172.5 | -170.7 | -169.4 | 154.8 | 0 | 0 | 111.5 | A20 E21 K26 S27 S28 | A20-E24 PolarHBondContact O-N 2.95Å; E21-E24 PolarHBondContact O-N 3.12Å; E24-K26 PolarHBondContact O-N 3.18Å; E24-S27 PolarHBondContact O-N 3.32Å; E24-S28 WeakPolarHBondContact O-CB 3.48Å; E24-S28 PolarHBondContact O-N 3.12Å; E24-S28 PolarHBondContact O-OG 2.88Å |
| 25 | K | 98.4 | Very high | 98.1 | Very high | 117 Ų | 117 | 98.9 Ų | 98.9 | 51% | 0.509 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.1 | -38.4 | 177.9 | -65.7 | -59.1 | 178.2 | -165 | 0 | 112 | E21 L22 S28 L29 | E21-K25 HydrophobicContact CG-CG 4.36Å; E21-K25 VanDerWaalsContact O-CG 3.3Å; E21-K25 WeakPolarHBondContact O-CG 3.3Å; E21-K25 PolarHBondContact O-N 3.41Å; L22-K25 PolarHBondContact O-N 3.01Å; K25-S28 PolarHBondContact O-N 3.21Å; K25-L29 WeakPolarHBondContact O-CB 3.4Å; K25-L29 PolarHBondContact O-N 3.03Å |
| 26 | K | 98.5 | Very high | 98.2 | Very high | 104 Ų | 104 | 100.5 Ų | 100.5 | 45% | 0.452 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 173.1 | -76.6 | 172.1 | -177.3 | 172.4 | 0 | 111.7 | L22 E23 E24 L29 K30 | L22-K26 HydrophobicContact CG-CD 4.48Å; L22-K26 VanDerWaalsContact O-CG 3.3Å; L22-K26 WeakPolarHBondContact O-CG 3.45Å; L22-K26 PolarHBondContact O-N 2.88Å; E23-K26 PolarHBondContact O-N 3.24Å; E23-K26 IonicContact OE1-NZ 2.7Å; E23-K26 PolarHBondContact OE1-NZ 3.02Å; E23-K26 IonicContact OE2-NZ 3.94Å; E24-K26 PolarHBondContact O-N 3.18Å; K26-L29 PolarHBondContact O-N 3.33Å; K26-K30 PolarHBondContact O-N 3.26Å; K26-K30 VanDerWaalsContact O-N 3.12Å |
| 27 | S | 98.4 | Very high | 98.3 | Very high | 80 Ų | 80 | 103.6 Ų | 103.6 | 56% | 0.559 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.8 | -43.4 | 177.9 | -59.1 | 0 | 0 | 0 | 0 | 111.4 | E23 E24 L29 K30 L31 | E23-S27 WeakPolarHBondContact O-CB 3.34Å; E23-S27 PolarHBondContact O-N 3.48Å; E23-S27 PolarHBondContact O-OG 3.25Å; E24-S27 PolarHBondContact O-N 3.32Å; S27-L29 PolarHBondContact O-N 3.38Å; S27-K30 PolarHBondContact O-N 3.04Å; S27-L31 PolarHBondContact O-N 3.48Å; S27-L31 VanDerWaalsContact O-N 3.12Å |
| 28 | S | 98.4 | Very high | 98.3 | Very high | 56 Ų | 56 | 104.7 Ų | 104.7 | 39% | 0.392 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 176.2 | -60 | 0 | 0 | 0 | 0 | 112.5 | E24 K25 K30 L31 Y32 | E24-S28 WeakPolarHBondContact O-CB 3.48Å; E24-S28 PolarHBondContact O-N 3.12Å; E24-S28 PolarHBondContact O-OG 2.88Å; K25-S28 PolarHBondContact O-N 3.21Å; S28-K30 VanDerWaalsContact C-N 3.33Å; S28-K30 PolarHBondContact O-N 3.48Å; S28-L31 PolarHBondContact O-N 3.49Å; S28-Y32 PolarHBondContact O-N 3.38Å |
| 29 | L | 98.4 | Very high | 98.4 | Very high | 102 Ų | 102 | 106.3 Ų | 106.3 | 53% | 0.534 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.6 | -43.1 | 177.3 | 178 | 61.7 | 0 | 0 | 0 | 111.4 | K25 K26 S27 Y32 Q33 | K25-L29 WeakPolarHBondContact O-CB 3.4Å; K25-L29 PolarHBondContact O-N 3.03Å; K26-L29 PolarHBondContact O-N 3.33Å; S27-L29 PolarHBondContact O-N 3.38Å; L29-Y32 WeakPolarHBondContact O-CB 3.5Å; L29-Y32 PolarHBondContact O-N 2.88Å; L29-Q33 WeakPolarHBondContact O-CG 3.38Å; L29-Q33 PolarHBondContact O-N 3.06Å |
| 30 | K | 98.5 | Very high | 98.4 | Very high | 135 Ų | 135 | 102.4 Ų | 102.4 | 59% | 0.587 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.8 | -45.6 | 177 | -171.5 | 169.3 | -178.8 | 177.8 | 0 | 111.5 | K26 S27 S28 Y32 Q33 D34 | K26-K30 PolarHBondContact O-N 3.26Å; K26-K30 VanDerWaalsContact O-N 3.12Å; S27-K30 PolarHBondContact O-N 3.04Å; S28-K30 VanDerWaalsContact C-N 3.33Å; S28-K30 PolarHBondContact O-N 3.48Å; K30-Y32 VanDerWaalsContact C-N 3.28Å; K30-Y32 PolarHBondContact O-N 3.39Å; K30-Q33 WeakPolarHBondContact O-CB 3.49Å; K30-Q33 PolarHBondContact O-N 3.42Å; K30-D34 VanDerWaalsContact O-CG 3.31Å; K30-D34 PolarHBondContact O-N 3.28Å |
| 31 | L | 98.5 | Very high | 98.4 | Very high | 115 Ų | 115 | 104.5 Ų | 104.5 | 60% | 0.602 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.3 | -40.8 | 175.3 | -179.6 | 65.1 | 0 | 0 | 0 | 112.2 | S27 S28 D34 T35 | S27-L31 PolarHBondContact O-N 3.48Å; S27-L31 VanDerWaalsContact O-N 3.12Å; S28-L31 PolarHBondContact O-N 3.49Å; L31-D34 PolarHBondContact O-N 2.92Å; L31-T35 WeakPolarHBondContact O-CB 3.37Å; L31-T35 PolarHBondContact O-N 2.93Å; L31-T35 PolarHBondContact O-OG1 3.49Å |
| 32 | Y | 98.6 | Very high | 98.5 | Very high | 185 Ų | 185 | 103.6 Ų | 103.6 | 73% | 0.725 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.1 | -40.5 | 178.5 | -129.9 | -82.6 | 0 | 0 | 0 | 112.2 | S28 L29 K30 H36 | S28-Y32 PolarHBondContact O-N 3.38Å; L29-Y32 WeakPolarHBondContact O-CB 3.5Å; L29-Y32 PolarHBondContact O-N 2.88Å; K30-Y32 VanDerWaalsContact C-N 3.28Å; K30-Y32 PolarHBondContact O-N 3.39Å; Y32-H36 WeakPolarHBondContact O-CB 3.36Å; Y32-H36 PolarHBondContact O-N 3.42Å |
| 33 | Q | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 104.8 Ų | 104.8 | 50% | 0.495 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64 | -46.1 | 175.6 | -71.2 | 174.1 | -12.5 | 0 | 0 | 111.4 | L29 K30 T35 H36 Q37 | L29-Q33 WeakPolarHBondContact O-CG 3.38Å; L29-Q33 PolarHBondContact O-N 3.06Å; K30-Q33 WeakPolarHBondContact O-CB 3.49Å; K30-Q33 PolarHBondContact O-N 3.42Å; Q33-T35 VanDerWaalsContact C-N 3.35Å; Q33-T35 PolarHBondContact O-N 3.35Å; Q33-H36 PolarHBondContact O-N 3.33Å; Q33-Q37 WeakPolarHBondContact O-CG 3.4Å; Q33-Q37 PolarHBondContact O-N 3.3Å |
| 34 | D | 98.5 | Very high | 98.5 | Very high | 74 Ų | 74 | 105.2 Ų | 105.2 | 40% | 0.396 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.7 | -45.3 | 178.2 | -66.3 | -20.1 | 0 | 0 | 0 | 110.7 | K30 L31 H36 Q37 E38 | K30-D34 VanDerWaalsContact O-CG 3.31Å; K30-D34 PolarHBondContact O-N 3.28Å; L31-D34 PolarHBondContact O-N 2.92Å; D34-H36 VanDerWaalsContact C-N 3.35Å; D34-H36 PolarHBondContact O-N 3.12Å; D34-Q37 PolarHBondContact O-N 3.07Å; D34-E38 PolarHBondContact O-N 2.94Å |
| 35 | T | 98.4 | Very high | 98.5 | Very high | 81 Ų | 81 | 105.5 Ų | 105.5 | 50% | 0.497 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.6 | -41.4 | 177 | -55.3 | 0 | 0 | 0 | 0 | 111.9 | L31 Q33 Q37 E38 Y39 | L31-T35 WeakPolarHBondContact O-CB 3.37Å; L31-T35 PolarHBondContact O-N 2.93Å; L31-T35 PolarHBondContact O-OG1 3.49Å; Q33-T35 VanDerWaalsContact C-N 3.35Å; Q33-T35 PolarHBondContact O-N 3.35Å; T35-Q37 VanDerWaalsContact C-N 3.34Å; T35-Q37 PolarHBondContact O-N 3.5Å; T35-E38 PolarHBondContact O-N 2.74Å; T35-Y39 PolarHBondContact O-N 2.91Å |
| 36 | H | 98.4 | Very high | 98.5 | Very high | 128 Ų | 128 | 103.1 Ų | 103.1 | 59% | 0.593 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.3 | -39.3 | 176.6 | 177.5 | -88.7 | 0 | 0 | 0 | 112.1 | Y32 Q33 D34 Y39 A40 | Y32-H36 WeakPolarHBondContact O-CB 3.36Å; Y32-H36 PolarHBondContact O-N 3.42Å; Q33-H36 PolarHBondContact O-N 3.33Å; D34-H36 VanDerWaalsContact C-N 3.35Å; D34-H36 PolarHBondContact O-N 3.12Å; H36-Y39 PolarHBondContact O-N 3.13Å; H36-A40 PolarHBondContact O-N 3.34Å |
| 37 | Q | 98.5 | Very high | 98.5 | Very high | 102 Ų | 102 | 103.7 Ų | 103.7 | 48% | 0.477 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.3 | -41.7 | 175.2 | -70.4 | 179.2 | 16.5 | 0 | 0 | 112 | Q33 D34 T35 A40 R41 | Q33-Q37 WeakPolarHBondContact O-CG 3.4Å; Q33-Q37 PolarHBondContact O-N 3.3Å; D34-Q37 PolarHBondContact O-N 3.07Å; T35-Q37 VanDerWaalsContact C-N 3.34Å; T35-Q37 PolarHBondContact O-N 3.5Å; Q37-A40 PolarHBondContact O-N 2.96Å; Q37-R41 PolarHBondContact O-N 3.19Å; Q37-R41 VanDerWaalsContact O-N 3.07Å |
| 38 | E | 98.5 | Very high | 98.5 | Very high | 99 Ų | 99 | 105.4 Ų | 105.4 | 46% | 0.463 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 173.8 | -72.5 | -65 | 172.6 | 0 | 0 | 111.7 | D34 T35 A40 R41 V42 | D34-E38 PolarHBondContact O-N 2.94Å; T35-E38 PolarHBondContact O-N 2.74Å; E38-A40 VanDerWaalsContact C-N 3.29Å; E38-A40 PolarHBondContact O-N 3.31Å; E38-R41 WeakPolarHBondContact O-CB 3.26Å; E38-R41 PolarHBondContact O-N 3.26Å; E38-R41 VanDerWaalsContact O-N 3.15Å; E38-R41 IonicContact OE1-CZ 3.61Å; E38-R41 IonicContact OE1-NE 3.81Å; E38-R41 IonicContact OE1-NH2 2.65Å; E38-R41 PolarHBondContact OE1-NH2 2.93Å; E38-R41 IonicContact OE2-CZ 3.34Å; E38-R41 IonicContact OE2-NE 2.88Å; E38-R41 PolarHBondContact OE2-NE 3.42Å; E38-R41 IonicContact OE2-NH2 3.1Å; E38-R41 PolarHBondContact OE2-NH2 3.33Å; E38-R41 VanDerWaalsContact OE2-NH2 3.1Å; E38-V42 WeakPolarHBondContact O-CG2 3.4Å; E38-V42 PolarHBondContact O-N 3.48Å |
| 39 | Y | 98.6 | Very high | 98.5 | Very high | 148 Ų | 148 | 106.1 Ų | 106.1 | 58% | 0.58 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -57.8 | -43 | 176.3 | 177.3 | -96.6 | 0 | 0 | 0 | 111.9 | T35 H36 R41 V42 K43 | T35-Y39 PolarHBondContact O-N 2.91Å; H36-Y39 PolarHBondContact O-N 3.13Å; Y39-R41 PolarHBondContact O-N 3.01Å; Y39-V42 PolarHBondContact O-N 2.97Å; Y39-K43 HydrophobicContact CE1-CD 4.19Å; Y39-K43 VanDerWaalsContact O-CB 3.26Å; Y39-K43 WeakPolarHBondContact O-CB 3.5Å; Y39-K43 PolarHBondContact O-N 3.06Å |
| 40 | A | 98.6 | Very high | 98.5 | Very high | 50 Ų | 50 | 105 Ų | 105 | 41% | 0.413 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | H36 Q37 E38 K43 E44 | H36-A40 PolarHBondContact O-N 3.34Å; Q37-A40 PolarHBondContact O-N 2.96Å; E38-A40 VanDerWaalsContact C-N 3.29Å; E38-A40 PolarHBondContact O-N 3.31Å; A40-K43 PolarHBondContact O-N 3.42Å; A40-E44 PolarHBondContact O-N 2.88Å; A40-E44 VanDerWaalsContact O-N 3.13Å |
| 41 | R | 98.6 | Very high | 98.5 | Very high | 109 Ų | 109 | 101.4 Ų | 101.4 | 41% | 0.411 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61 | -52.9 | 175.4 | -75 | -170.3 | -77.5 | -91 | 16.1 | 112 | Q37 E38 Y39 K43 E44 E45 | Q37-R41 PolarHBondContact O-N 3.19Å; Q37-R41 VanDerWaalsContact O-N 3.07Å; E38-R41 WeakPolarHBondContact O-CB 3.26Å; E38-R41 PolarHBondContact O-N 3.26Å; E38-R41 VanDerWaalsContact O-N 3.15Å; E38-R41 IonicContact OE1-CZ 3.61Å; E38-R41 IonicContact OE1-NE 3.81Å; E38-R41 IonicContact OE1-NH2 2.65Å; E38-R41 PolarHBondContact OE1-NH2 2.93Å; E38-R41 IonicContact OE2-CZ 3.34Å; E38-R41 IonicContact OE2-NE 2.88Å; E38-R41 PolarHBondContact OE2-NE 3.42Å; E38-R41 IonicContact OE2-NH2 3.1Å; E38-R41 PolarHBondContact OE2-NH2 3.33Å; E38-R41 VanDerWaalsContact OE2-NH2 3.1Å; Y39-R41 PolarHBondContact O-N 3.01Å; R41-K43 VanDerWaalsContact C-N 3.27Å; R41-K43 PolarHBondContact O-N 3.25Å; R41-E44 WeakPolarHBondContact O-CB 3.49Å; R41-E44 PolarHBondContact O-N 2.99Å; R41-E44 VanDerWaalsContact O-N 3.09Å; R41-E45 PolarHBondContact O-N 3.09Å |
| 42 | V | 98.6 | Very high | 98.5 | Very high | 74 Ų | 74 | 102.3 Ų | 102.3 | 45% | 0.448 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60 | -40.2 | -179.6 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | E38 Y39 E44 E45 C46 | E38-V42 WeakPolarHBondContact O-CG2 3.4Å; E38-V42 PolarHBondContact O-N 3.48Å; Y39-V42 PolarHBondContact O-N 2.97Å; V42-E44 VanDerWaalsContact C-N 3.34Å; V42-E44 PolarHBondContact O-N 3.48Å; V42-E45 PolarHBondContact O-N 3.5Å; V42-C46 PolarHBondContact O-N 3.23Å; V42-C46 PolarHBondContact O-SG 3.03Å |
| 43 | K | 98.6 | Very high | 98.5 | Very high | 119 Ų | 119 | 99 Ų | 99 | 52% | 0.517 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.4 | -42.3 | 176.1 | -174.3 | 179 | 179.7 | 179.7 | 0 | 112.1 | Y39 A40 R41 C46 L47 | Y39-K43 HydrophobicContact CE1-CD 4.19Å; Y39-K43 VanDerWaalsContact O-CB 3.26Å; Y39-K43 WeakPolarHBondContact O-CB 3.5Å; Y39-K43 PolarHBondContact O-N 3.06Å; A40-K43 PolarHBondContact O-N 3.42Å; R41-K43 VanDerWaalsContact C-N 3.27Å; R41-K43 PolarHBondContact O-N 3.25Å; K43-C46 PolarHBondContact O-N 3.19Å; K43-L47 WeakPolarHBondContact O-CG 3.1Å; K43-L47 PolarHBondContact O-N 3.1Å |
| 44 | E | 98.4 | Very high | 98.5 | Very high | 107 Ų | 107 | 100.9 Ų | 100.9 | 50% | 0.5 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 176.3 | -167.2 | -169.4 | 152.7 | 0 | 0 | 111.8 | A40 R41 V42 L47 K48 | A40-E44 PolarHBondContact O-N 2.88Å; A40-E44 VanDerWaalsContact O-N 3.13Å; R41-E44 WeakPolarHBondContact O-CB 3.49Å; R41-E44 PolarHBondContact O-N 2.99Å; R41-E44 VanDerWaalsContact O-N 3.09Å; V42-E44 VanDerWaalsContact C-N 3.34Å; V42-E44 PolarHBondContact O-N 3.48Å; E44-L47 PolarHBondContact O-N 2.65Å; E44-K48 WeakPolarHBondContact O-CG 3.47Å; E44-K48 PolarHBondContact O-N 2.98Å; E44-K48 WeakPolarHBondContact OE1-CE 3.4Å; E44-K48 IonicContact OE1-NZ 2.66Å; E44-K48 PolarHBondContact OE1-NZ 2.85Å |
| 45 | E | 98.4 | Very high | 98.5 | Very high | 124 Ų | 124 | 104 Ų | 104 | 58% | 0.579 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.6 | -41.7 | 176.1 | -72.3 | -179.7 | -178.1 | 0 | 0 | 112.3 | R41 V42 L47 K48 S49 | R41-E45 PolarHBondContact O-N 3.09Å; V42-E45 PolarHBondContact O-N 3.5Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.88Å; E45-K48 PolarHBondContact O-N 3.43Å; E45-S49 WeakPolarHBondContact O-CB 3.41Å; E45-S49 PolarHBondContact O-N 3.31Å |
| 46 | C | 98.4 | Very high | 98.5 | Very high | 68 Ų | 68 | 105.2 Ų | 105.2 | 46% | 0.459 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.5 | -45.2 | 173.4 | -72.7 | 0 | 0 | 0 | 0 | 111.5 | V42 K43 K48 S49 D50 | V42-C46 PolarHBondContact O-N 3.23Å; V42-C46 PolarHBondContact O-SG 3.03Å; K43-C46 PolarHBondContact O-N 3.19Å; C46-K48 PolarHBondContact O-N 3.49Å; C46-S49 PolarHBondContact O-N 2.91Å; C46-D50 WeakPolarHBondContact O-CB 3.42Å; C46-D50 PolarHBondContact O-N 3.15Å |
| 47 | L | 98.6 | Very high | 98.5 | Very high | 116 Ų | 116 | 103.9 Ų | 103.9 | 61% | 0.607 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.3 | -40.4 | 177.9 | -69.3 | 172.5 | 0 | 0 | 0 | 112.3 | K43 E44 E45 A51 | K43-L47 WeakPolarHBondContact O-CG 3.1Å; K43-L47 PolarHBondContact O-N 3.1Å; E44-L47 PolarHBondContact O-N 2.65Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.88Å; L47-A51 WeakPolarHBondContact O-CB 3.46Å; L47-A51 PolarHBondContact O-N 2.66Å |
| 48 | K | 98.5 | Very high | 98.5 | Very high | 116 Ų | 116 | 101.6 Ų | 101.6 | 50% | 0.504 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.6 | -46.1 | 175.2 | -72.5 | 174.3 | -176 | 164.5 | 0 | 111.3 | E44 E45 C46 A51 Q52 | E44-K48 WeakPolarHBondContact O-CG 3.47Å; E44-K48 PolarHBondContact O-N 2.98Å; E44-K48 WeakPolarHBondContact OE1-CE 3.4Å; E44-K48 IonicContact OE1-NZ 2.66Å; E44-K48 PolarHBondContact OE1-NZ 2.85Å; E45-K48 PolarHBondContact O-N 3.43Å; C46-K48 PolarHBondContact O-N 3.49Å; K48-A51 PolarHBondContact O-N 3.06Å; K48-Q52 WeakPolarHBondContact O-CG 3.35Å; K48-Q52 PolarHBondContact O-N 3.34Å |
| 49 | S | 98.5 | Very high | 98.5 | Very high | 70 Ų | 70 | 102.4 Ų | 102.4 | 49% | 0.49 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 177.7 | -174.2 | 0 | 0 | 0 | 0 | 111.4 | E45 C46 A51 Q52 K53 | E45-S49 WeakPolarHBondContact O-CB 3.41Å; E45-S49 PolarHBondContact O-N 3.31Å; C46-S49 PolarHBondContact O-N 2.91Å; S49-A51 VanDerWaalsContact C-N 3.32Å; S49-A51 PolarHBondContact O-N 3.14Å; S49-Q52 PolarHBondContact O-N 2.8Å; S49-Q52 VanDerWaalsContact O-N 3.14Å; S49-K53 WeakPolarHBondContact O-CB 3.12Å; S49-K53 PolarHBondContact O-N 3.46Å |
| 50 | D | 98.6 | Very high | 98.5 | Very high | 80 Ų | 80 | 98.9 Ų | 98.9 | 43% | 0.428 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.6 | -39.3 | 177.5 | -82.9 | -14.8 | 0 | 0 | 0 | 112.5 | C46 K53 K54 | C46-D50 WeakPolarHBondContact O-CB 3.42Å; C46-D50 PolarHBondContact O-N 3.15Å; D50-K53 PolarHBondContact O-N 3.14Å; D50-K54 WeakPolarHBondContact O-CG 3.41Å; D50-K54 PolarHBondContact O-N 3.04Å |
| 51 | A | 98.5 | Very high | 98.5 | Very high | 59 Ų | 59 | 102.4 Ų | 102.4 | 49% | 0.488 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L47 K48 S49 K55 | L47-A51 WeakPolarHBondContact O-CB 3.46Å; L47-A51 PolarHBondContact O-N 2.66Å; K48-A51 PolarHBondContact O-N 3.06Å; S49-A51 VanDerWaalsContact C-N 3.32Å; S49-A51 PolarHBondContact O-N 3.14Å; A51-K55 PolarHBondContact O-N 3.37Å; A51-K55 VanDerWaalsContact O-N 3.14Å |
| 52 | Q | 98.6 | Very high | 98.5 | Very high | 133 Ų | 133 | 104.4 Ų | 104.4 | 62% | 0.621 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.3 | -42.8 | 175.7 | -71.1 | -176.8 | -7.6 | 0 | 0 | 111.9 | K48 S49 K55 L56 | K48-Q52 WeakPolarHBondContact O-CG 3.35Å; K48-Q52 PolarHBondContact O-N 3.34Å; S49-Q52 PolarHBondContact O-N 2.8Å; S49-Q52 VanDerWaalsContact O-N 3.14Å; Q52-K55 WeakPolarHBondContact O-CB 2.93Å; Q52-K55 PolarHBondContact O-N 3.3Å; Q52-L56 WeakPolarHBondContact O-CG 3.46Å; Q52-L56 PolarHBondContact O-N 2.94Å |
| 53 | K | 98.6 | Very high | 98.5 | Very high | 116 Ų | 116 | 106.8 Ų | 106.8 | 50% | 0.504 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -56.3 | -52.3 | 175.3 | 177.9 | 179.5 | 171.5 | -179.2 | 0 | 111.2 | S49 D50 K55 L56 E57 | S49-K53 WeakPolarHBondContact O-CB 3.12Å; S49-K53 PolarHBondContact O-N 3.46Å; D50-K53 PolarHBondContact O-N 3.14Å; K53-K55 VanDerWaalsContact C-N 3.27Å; K53-K55 PolarHBondContact O-N 2.87Å; K53-L56 PolarHBondContact O-N 3.36Å; K53-E57 WeakPolarHBondContact CE-OE1 3.45Å; K53-E57 HydrophobicContact CG-CG 4.4Å; K53-E57 WeakPolarHBondContact O-CG 3.46Å; K53-E57 PolarHBondContact O-N 3.42Å |
| 54 | K | 98.6 | Very high | 98.5 | Very high | 145 Ų | 145 | 106.9 Ų | 106.9 | 63% | 0.63 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -57.7 | -39.1 | 177.5 | -73.1 | 174.8 | -177.6 | 176.1 | 0 | 112.4 | D50 A58 | D50-K54 WeakPolarHBondContact O-CG 3.41Å; D50-K54 PolarHBondContact O-N 3.04Å; K54-A58 WeakPolarHBondContact O-CB 3.43Å; K54-A58 PolarHBondContact O-N 3.06Å |
| 55 | K | 98.6 | Very high | 98.5 | Very high | 140 Ų | 140 | 107 Ų | 107 | 61% | 0.609 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65 | -40.7 | 176.2 | -174.5 | 177.5 | -177.8 | 177 | 0 | 111.9 | A51 Q52 K53 K59 | A51-K55 PolarHBondContact O-N 3.37Å; A51-K55 VanDerWaalsContact O-N 3.14Å; Q52-K55 WeakPolarHBondContact O-CB 2.93Å; Q52-K55 PolarHBondContact O-N 3.3Å; K53-K55 VanDerWaalsContact C-N 3.27Å; K53-K55 PolarHBondContact O-N 2.87Å; K55-K59 WeakPolarHBondContact O-CG 3.41Å; K55-K59 PolarHBondContact O-N 2.96Å |
| 56 | L | 98.6 | Very high | 98.5 | Very high | 106 Ų | 106 | 103.2 Ų | 103.2 | 56% | 0.555 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -69.7 | -43.7 | 177.1 | -70.1 | 174.7 | 0 | 0 | 0 | 111.6 | Q52 K53 A58 K59 V60 | Q52-L56 WeakPolarHBondContact O-CG 3.46Å; Q52-L56 PolarHBondContact O-N 2.94Å; K53-L56 PolarHBondContact O-N 3.36Å; L56-A58 VanDerWaalsContact C-N 3.3Å; L56-A58 PolarHBondContact O-N 3.22Å; L56-K59 WeakPolarHBondContact O-CB 3.44Å; L56-K59 PolarHBondContact O-N 3.2Å; L56-V60 WeakPolarHBondContact O-CG2 3.37Å; L56-V60 PolarHBondContact O-N 3.49Å |
| 57 | E | 98.5 | Very high | 98.5 | Very high | 101 Ų | 101 | 102.3 Ų | 102.3 | 47% | 0.472 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -57.2 | -43.2 | 175.2 | -72.9 | 173.1 | 170.1 | 0 | 0 | 111.6 | K53 K59 V60 K61 | K53-E57 WeakPolarHBondContact CE-OE1 3.45Å; K53-E57 HydrophobicContact CG-CG 4.4Å; K53-E57 WeakPolarHBondContact O-CG 3.46Å; K53-E57 PolarHBondContact O-N 3.42Å; E57-K59 VanDerWaalsContact C-N 3.34Å; E57-K59 PolarHBondContact O-N 2.86Å; E57-V60 PolarHBondContact O-N 3.05Å; E57-K61 PolarHBondContact O-N 3.27Å |
| 58 | A | 98.6 | Very high | 98.5 | Very high | 53 Ų | 53 | 100.8 Ų | 100.8 | 44% | 0.438 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.1 | -37.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | K54 L56 K62 | K54-A58 WeakPolarHBondContact O-CB 3.43Å; K54-A58 PolarHBondContact O-N 3.06Å; L56-A58 VanDerWaalsContact C-N 3.3Å; L56-A58 PolarHBondContact O-N 3.22Å; A58-K62 WeakPolarHBondContact O-CG 3.41Å; A58-K62 PolarHBondContact O-N 3.23Å |
| 59 | K | 98.5 | Very high | 98.5 | Very high | 116 Ų | 116 | 101.5 Ų | 101.5 | 50% | 0.504 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67.4 | -43.9 | 174.8 | -73.4 | 178.4 | 176.8 | -171.6 | 0 | 111.5 | K55 L56 E57 K61 K62 L63 | K55-K59 WeakPolarHBondContact O-CG 3.41Å; K55-K59 PolarHBondContact O-N 2.96Å; L56-K59 WeakPolarHBondContact O-CB 3.44Å; L56-K59 PolarHBondContact O-N 3.2Å; E57-K59 VanDerWaalsContact C-N 3.34Å; E57-K59 PolarHBondContact O-N 2.86Å; K59-K61 VanDerWaalsContact C-N 3.33Å; K59-K61 PolarHBondContact O-N 3.47Å; K59-K62 PolarHBondContact O-N 3.42Å; K59-L63 WeakPolarHBondContact O-CG 3.44Å; K59-L63 PolarHBondContact O-N 3.01Å |
| 60 | V | 98.7 | Very high | 98.5 | Very high | 75 Ų | 75 | 104.6 Ų | 104.6 | 46% | 0.455 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -59.3 | -45.8 | 177.3 | 169.4 | 0 | 0 | 0 | 0 | 110.5 | L56 E57 K62 L63 Q64 | L56-V60 WeakPolarHBondContact O-CG2 3.37Å; L56-V60 PolarHBondContact O-N 3.49Å; E57-V60 PolarHBondContact O-N 3.05Å; V60-K62 PolarHBondContact O-N 2.97Å; V60-L63 PolarHBondContact O-N 3.28Å; V60-Q64 HydrophobicContact CG1-CG 4.33Å; V60-Q64 WeakPolarHBondContact O-CG 3.4Å; V60-Q64 PolarHBondContact O-N 3.43Å |
| 61 | K | 98.6 | Very high | 98.5 | Very high | 124 Ų | 124 | 104.4 Ų | 104.4 | 54% | 0.539 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -57.8 | -47.1 | 177.4 | -174.8 | 176.6 | 177.2 | -179.6 | 0 | 112.3 | E57 K59 L63 Q64 E65 | E57-K61 PolarHBondContact O-N 3.27Å; K59-K61 VanDerWaalsContact C-N 3.33Å; K59-K61 PolarHBondContact O-N 3.47Å; K61-L63 VanDerWaalsContact C-N 3.34Å; K61-L63 PolarHBondContact O-N 2.89Å; K61-Q64 PolarHBondContact O-N 3.21Å; K61-E65 WeakPolarHBondContact CE-OE1 3.44Å; K61-E65 WeakPolarHBondContact O-CG 3.41Å; K61-E65 PolarHBondContact O-N 2.88Å |
| 62 | K | 98.5 | Very high | 98.5 | Very high | 151 Ų | 151 | 107.4 Ų | 107.4 | 66% | 0.657 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.5 | -41.1 | 177.1 | -72.5 | -178.7 | 179.7 | -173.6 | 0 | 112.6 | A58 K59 V60 E65 A66 | A58-K62 WeakPolarHBondContact O-CG 3.41Å; A58-K62 PolarHBondContact O-N 3.23Å; K59-K62 PolarHBondContact O-N 3.42Å; V60-K62 PolarHBondContact O-N 2.97Å; K62-E65 PolarHBondContact O-N 3.33Å; K62-A66 WeakPolarHBondContact O-CB 3.42Å; K62-A66 PolarHBondContact O-N 2.99Å |
| 63 | L | 98.5 | Very high | 98.5 | Very high | 124 Ų | 124 | 104.4 Ų | 104.4 | 65% | 0.649 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -66.6 | -39.8 | 177.6 | -72.2 | 173.4 | 0 | 0 | 0 | 111.7 | K59 V60 K61 A66 A67 | K59-L63 WeakPolarHBondContact O-CG 3.44Å; K59-L63 PolarHBondContact O-N 3.01Å; V60-L63 PolarHBondContact O-N 3.28Å; K61-L63 VanDerWaalsContact C-N 3.34Å; K61-L63 PolarHBondContact O-N 2.89Å; L63-A66 PolarHBondContact O-N 3.03Å; L63-A67 WeakPolarHBondContact O-CB 3.48Å; L63-A67 PolarHBondContact O-N 3.23Å |
| 64 | Q | 98.5 | Very high | 98.5 | Very high | 120 Ų | 120 | 105.5 Ų | 105.5 | 56% | 0.561 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.5 | -47 | 174.9 | -74.6 | 172.9 | -24.5 | 0 | 0 | 111.5 | V60 K61 A66 A67 V68 | V60-Q64 HydrophobicContact CG1-CG 4.33Å; V60-Q64 WeakPolarHBondContact O-CG 3.4Å; V60-Q64 PolarHBondContact O-N 3.43Å; K61-Q64 PolarHBondContact O-N 3.21Å; Q64-A66 VanDerWaalsContact C-N 3.34Å; Q64-A66 PolarHBondContact O-N 3.31Å; Q64-A67 PolarHBondContact O-N 3.42Å; Q64-V68 WeakPolarHBondContact O-CG2 3.37Å; Q64-V68 PolarHBondContact O-N 2.97Å |
| 65 | E | 98.4 | Very high | 98.5 | Very high | 110 Ų | 110 | 104.8 Ų | 104.8 | 51% | 0.514 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.2 | -43.8 | 176 | -72 | 169.2 | -174.6 | 0 | 0 | 111.7 | K61 K62 V68 K69 | K61-E65 WeakPolarHBondContact CE-OE1 3.44Å; K61-E65 WeakPolarHBondContact O-CG 3.41Å; K61-E65 PolarHBondContact O-N 2.88Å; K62-E65 PolarHBondContact O-N 3.33Å; E65-V68 PolarHBondContact O-N 3.28Å; E65-K69 PolarHBondContact O-N 2.9Å |
| 66 | A | 98.6 | Very high | 98.5 | Very high | 45 Ų | 45 | 103.3 Ų | 103.3 | 37% | 0.372 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | K62 L63 Q64 K69 Q70 | K62-A66 WeakPolarHBondContact O-CB 3.42Å; K62-A66 PolarHBondContact O-N 2.99Å; L63-A66 PolarHBondContact O-N 3.03Å; Q64-A66 VanDerWaalsContact C-N 3.34Å; Q64-A66 PolarHBondContact O-N 3.31Å; A66-K69 PolarHBondContact O-N 3.4Å; A66-Q70 WeakPolarHBondContact O-CB 3.44Å; A66-Q70 WeakPolarHBondContact O-CG 3.35Å; A66-Q70 PolarHBondContact O-N 3.03Å |
| 67 | A | 98.4 | Very high | 98.5 | Very high | 48 Ų | 48 | 103.2 Ų | 103.2 | 40% | 0.397 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.5 | -39.9 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | L63 Q64 T71 | L63-A67 WeakPolarHBondContact O-CB 3.48Å; L63-A67 PolarHBondContact O-N 3.23Å; Q64-A67 PolarHBondContact O-N 3.42Å; A67-T71 WeakPolarHBondContact O-CB 3.31Å; A67-T71 PolarHBondContact O-N 2.83Å; A67-T71 PolarHBondContact O-OG1 3.18Å |
| 68 | V | 98.6 | Very high | 98.5 | Very high | 84 Ų | 84 | 106.9 Ų | 106.9 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.2 | -47.4 | 174.7 | 170.7 | 0 | 0 | 0 | 0 | 110.4 | Q64 E65 T71 Q72 | Q64-V68 WeakPolarHBondContact O-CG2 3.37Å; Q64-V68 PolarHBondContact O-N 2.97Å; E65-V68 PolarHBondContact O-N 3.28Å; V68-T71 WeakPolarHBondContact O-CB 3.37Å; V68-T71 PolarHBondContact O-N 2.91Å; V68-Q72 WeakPolarHBondContact O-CG 3.44Å; V68-Q72 PolarHBondContact O-N 3.44Å |
| 69 | K | 98.4 | Very high | 98.5 | Very high | 131 Ų | 131 | 109 Ų | 109 | 57% | 0.57 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -59.8 | -49.6 | 177.5 | -173.4 | 179.2 | 178 | -177.5 | 0 | 111.7 | E65 A66 T71 Q72 D73 | E65-K69 PolarHBondContact O-N 2.9Å; A66-K69 PolarHBondContact O-N 3.4Å; K69-T71 VanDerWaalsContact C-N 3.25Å; K69-T71 PolarHBondContact O-N 3.36Å; K69-Q72 WeakPolarHBondContact O-CB 3.47Å; K69-Q72 PolarHBondContact O-N 3.41Å; K69-D73 PolarHBondContact O-N 2.89Å |
| 70 | Q | 98.4 | Very high | 98.5 | Very high | 136 Ų | 136 | 107.5 Ų | 107.5 | 64% | 0.636 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -57.8 | -38.8 | 176.9 | -75.6 | 179.3 | 2 | 0 | 0 | 112.4 | A66 Q72 D73 F74 | A66-Q70 WeakPolarHBondContact O-CB 3.44Å; A66-Q70 WeakPolarHBondContact O-CG 3.35Å; A66-Q70 PolarHBondContact O-N 3.03Å; Q70-Q72 VanDerWaalsContact C-N 3.34Å; Q70-D73 PolarHBondContact O-N 2.98Å; Q70-F74 VanDerWaalsContact O-CB 3.3Å; Q70-F74 WeakPolarHBondContact O-CB 3.49Å; Q70-F74 PolarHBondContact O-N 3.27Å |
| 71 | T | 98.4 | Very high | 98.5 | Very high | 76 Ų | 76 | 109.9 Ų | 109.9 | 47% | 0.466 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.6 | -38.4 | 177.4 | -59.7 | 0 | 0 | 0 | 0 | 111.7 | A67 V68 K69 K75 | A67-T71 WeakPolarHBondContact O-CB 3.31Å; A67-T71 PolarHBondContact O-N 2.83Å; A67-T71 PolarHBondContact O-OG1 3.18Å; V68-T71 WeakPolarHBondContact O-CB 3.37Å; V68-T71 PolarHBondContact O-N 2.91Å; K69-T71 VanDerWaalsContact C-N 3.25Å; K69-T71 PolarHBondContact O-N 3.36Å; T71-K75 WeakPolarHBondContact O-CG 3.3Å; T71-K75 PolarHBondContact O-N 2.9Å; T71-K75 VanDerWaalsContact O-N 3.16Å |
| 72 | Q | 98.5 | Very high | 98.5 | Very high | 121 Ų | 121 | 109.8 Ų | 109.8 | 57% | 0.565 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -67.5 | -48.4 | 175.4 | -70.3 | 174.4 | -10 | 0 | 0 | 111.2 | V68 K69 Q70 F74 K75 Q76 | V68-Q72 WeakPolarHBondContact O-CG 3.44Å; V68-Q72 PolarHBondContact O-N 3.44Å; K69-Q72 WeakPolarHBondContact O-CB 3.47Å; K69-Q72 PolarHBondContact O-N 3.41Å; Q70-Q72 VanDerWaalsContact C-N 3.34Å; Q72-F74 VanDerWaalsContact C-N 3.3Å; Q72-F74 PolarHBondContact O-N 2.96Å; Q72-K75 WeakPolarHBondContact O-CB 3.36Å; Q72-K75 PolarHBondContact O-N 2.88Å; Q72-K75 VanDerWaalsContact O-N 3.11Å; Q72-Q76 PolarHBondContact O-N 3.46Å |
| 73 | D | 98.4 | Very high | 98.5 | Very high | 70 Ų | 70 | 107.5 Ų | 107.5 | 37% | 0.374 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -57.8 | -44.3 | 177.6 | -65.6 | -15.4 | 0 | 0 | 0 | 110.7 | K69 Q70 K75 Q76 L77 | K69-D73 PolarHBondContact O-N 2.89Å; Q70-D73 PolarHBondContact O-N 2.98Å; D73-K75 PolarHBondContact O-N 3.11Å; D73-Q76 WeakPolarHBondContact O-CB 3.35Å; D73-Q76 PolarHBondContact O-N 3.05Å; D73-L77 WeakPolarHBondContact O-CG 3.45Å; D73-L77 PolarHBondContact O-N 3.16Å |
| 74 | F | 98.4 | Very high | 98.5 | Very high | 139 Ų | 139 | 107.3 Ų | 107.3 | 61% | 0.61 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.8 | -41 | 177 | -176.2 | -98.3 | 0 | 0 | 0 | 112.7 | Q70 Q72 Q76 L77 R78 | Q70-F74 VanDerWaalsContact O-CB 3.3Å; Q70-F74 WeakPolarHBondContact O-CB 3.49Å; Q70-F74 PolarHBondContact O-N 3.27Å; Q72-F74 VanDerWaalsContact C-N 3.3Å; Q72-F74 PolarHBondContact O-N 2.96Å; F74-Q76 VanDerWaalsContact C-N 3.33Å; F74-L77 PolarHBondContact O-N 2.93Å; F74-R78 WeakPolarHBondContact O-CB 3.39Å; F74-R78 PolarHBondContact O-N 2.97Å |
| 75 | K | 98.5 | Very high | 98.5 | Very high | 131 Ų | 131 | 106.6 Ų | 106.6 | 57% | 0.57 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.7 | -41.7 | 175 | -76.1 | 175.1 | -179.6 | -179.7 | 0 | 111.3 | T71 Q72 D73 R78 N79 | T71-K75 WeakPolarHBondContact O-CG 3.3Å; T71-K75 PolarHBondContact O-N 2.9Å; T71-K75 VanDerWaalsContact O-N 3.16Å; Q72-K75 WeakPolarHBondContact O-CB 3.36Å; Q72-K75 PolarHBondContact O-N 2.88Å; Q72-K75 VanDerWaalsContact O-N 3.11Å; D73-K75 PolarHBondContact O-N 3.11Å; K75-R78 PolarHBondContact O-N 3.45Å; K75-N79 PolarHBondContact O-N 3.18Å; K75-N79 PolarHBondContact O-ND2 2.97Å |
| 76 | Q | 98.5 | Very high | 98.5 | Very high | 108 Ų | 108 | 107 Ų | 107 | 51% | 0.505 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -52 | 176.7 | -180 | 178.3 | -15.5 | 0 | 0 | 111.2 | Q72 D73 F74 R78 N79 E80 | Q72-Q76 PolarHBondContact O-N 3.46Å; D73-Q76 WeakPolarHBondContact O-CB 3.35Å; D73-Q76 PolarHBondContact O-N 3.05Å; F74-Q76 VanDerWaalsContact C-N 3.33Å; Q76-R78 PolarHBondContact O-N 2.79Å; Q76-N79 WeakPolarHBondContact O-CA 3.35Å; Q76-N79 WeakPolarHBondContact O-CB 3.28Å; Q76-N79 PolarHBondContact O-N 3.49Å; Q76-E80 HydrophobicContact CG-CG 4.48Å; Q76-E80 VanDerWaalsContact CG-OE1 3.31Å; Q76-E80 WeakPolarHBondContact CG-OE1 3.41Å; Q76-E80 PolarHBondContact NE2-OE1 3.43Å; Q76-E80 PolarHBondContact O-N 2.87Å |
| 77 | L | 98.6 | Very high | 98.5 | Very high | 104 Ų | 104 | 109 Ų | 109 | 55% | 0.545 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -58.3 | -37.6 | 178.5 | -69.8 | 173.7 | 0 | 0 | 0 | 112.2 | D73 F74 N79 E80 K81 | D73-L77 WeakPolarHBondContact O-CG 3.45Å; D73-L77 PolarHBondContact O-N 3.16Å; F74-L77 PolarHBondContact O-N 2.93Å; L77-N79 VanDerWaalsContact C-N 3.32Å; L77-N79 PolarHBondContact O-N 3.25Å; L77-E80 PolarHBondContact O-N 2.89Å; L77-K81 VanDerWaalsContact O-CB 3.28Å; L77-K81 WeakPolarHBondContact O-CB 3.49Å; L77-K81 PolarHBondContact O-N 3.43Å |
| 78 | R | 98.6 | Very high | 98.4 | Very high | 178 Ų | 178 | 113.5 Ų | 113.5 | 67% | 0.672 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63 | -38.5 | 175.3 | -172.4 | 178.5 | -177 | 176.6 | 2 | 112.2 | F74 K75 Q76 K82 | F74-R78 WeakPolarHBondContact O-CB 3.39Å; F74-R78 PolarHBondContact O-N 2.97Å; K75-R78 PolarHBondContact O-N 3.45Å; Q76-R78 PolarHBondContact O-N 2.79Å; R78-K82 PolarHBondContact O-N 3.39Å; R78-K82 VanDerWaalsContact O-N 3.15Å |
| 79 | N | 98.4 | Very high | 98.4 | Very high | 99 Ų | 99 | 115.7 Ų | 115.7 | 53% | 0.529 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -70.8 | -44.6 | 177 | -69.9 | -22.6 | 0 | 0 | 0 | 111.5 | K75 Q76 L77 K81 K82 I83 | K75-N79 PolarHBondContact O-N 3.18Å; K75-N79 PolarHBondContact O-ND2 2.97Å; Q76-N79 WeakPolarHBondContact O-CA 3.35Å; Q76-N79 WeakPolarHBondContact O-CB 3.28Å; Q76-N79 PolarHBondContact O-N 3.49Å; L77-N79 VanDerWaalsContact C-N 3.32Å; L77-N79 PolarHBondContact O-N 3.25Å; N79-K81 PolarHBondContact O-N 3.46Å; N79-K82 WeakPolarHBondContact O-CB 3.44Å; N79-K82 PolarHBondContact O-N 3.01Å; N79-I83 WeakPolarHBondContact O-CG1 3.32Å; N79-I83 PolarHBondContact O-N 3.1Å |
| 80 | E | 98.4 | Very high | 98.4 | Very high | 83 Ų | 83 | 113.8 Ų | 113.8 | 39% | 0.388 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.3 | -46.4 | 175.9 | -71.1 | 174.5 | -168.2 | 0 | 0 | 111.2 | Q76 L77 K82 I83 L84 | Q76-E80 HydrophobicContact CG-CG 4.48Å; Q76-E80 VanDerWaalsContact CG-OE1 3.31Å; Q76-E80 WeakPolarHBondContact CG-OE1 3.41Å; Q76-E80 PolarHBondContact NE2-OE1 3.43Å; Q76-E80 PolarHBondContact O-N 2.87Å; L77-E80 PolarHBondContact O-N 2.89Å; E80-K82 VanDerWaalsContact C-N 3.32Å; E80-K82 PolarHBondContact O-N 3.27Å; E80-I83 PolarHBondContact O-N 3.35Å; E80-I83 VanDerWaalsContact O-N 3.1Å; E80-L84 WeakPolarHBondContact O-CG 3.43Å; E80-L84 PolarHBondContact O-N 3.49Å |
| 81 | K | 98.4 | Very high | 98.3 | Very high | 125 Ų | 125 | 111.2 Ų | 111.2 | 54% | 0.543 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -54.2 | -47.9 | 173.2 | 176.8 | 177.5 | 170.4 | 173.3 | 0 | 111.7 | L77 N79 I83 L84 E85 | L77-K81 VanDerWaalsContact O-CB 3.28Å; L77-K81 WeakPolarHBondContact O-CB 3.49Å; L77-K81 PolarHBondContact O-N 3.43Å; N79-K81 PolarHBondContact O-N 3.46Å; K81-I83 VanDerWaalsContact C-N 3.28Å; K81-I83 PolarHBondContact O-N 3.02Å; K81-L84 PolarHBondContact O-N 2.88Å; K81-E85 WeakPolarHBondContact CE-OE1 3.38Å; K81-E85 HydrophobicContact CG-CG 4.39Å; K81-E85 IonicContact NZ-OE1 2.85Å; K81-E85 WeakPolarHBondContact O-CB 3.41Å; K81-E85 VanDerWaalsContact O-CG 3.32Å; K81-E85 WeakPolarHBondContact O-CG 3.42Å; K81-E85 PolarHBondContact O-N 3.08Å |
| 82 | K | 98.6 | Very high | 98.3 | Very high | 123 Ų | 123 | 111.2 Ų | 111.2 | 54% | 0.535 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62 | -34.9 | 179.1 | -174.8 | 179.6 | -178.6 | 179.8 | 0 | 112.5 | R78 N79 E80 K86 | R78-K82 PolarHBondContact O-N 3.39Å; R78-K82 VanDerWaalsContact O-N 3.15Å; N79-K82 WeakPolarHBondContact O-CB 3.44Å; N79-K82 PolarHBondContact O-N 3.01Å; E80-K82 VanDerWaalsContact C-N 3.32Å; E80-K82 PolarHBondContact O-N 3.27Å; K82-K86 WeakPolarHBondContact O-CG 3.47Å; K82-K86 PolarHBondContact O-N 3.3Å |
| 83 | I | 98.4 | Very high | 98.3 | Very high | 102 Ų | 102 | 109.6 Ų | 109.6 | 52% | 0.523 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70.1 | -48.6 | 176.1 | -68.2 | 164 | 0 | 0 | 0 | 109.9 | N79 E80 K81 E85 K86 E87 | N79-I83 WeakPolarHBondContact O-CG1 3.32Å; N79-I83 PolarHBondContact O-N 3.1Å; E80-I83 PolarHBondContact O-N 3.35Å; E80-I83 VanDerWaalsContact O-N 3.1Å; K81-I83 VanDerWaalsContact C-N 3.28Å; K81-I83 PolarHBondContact O-N 3.02Å; I83-E85 VanDerWaalsContact C-N 3.33Å; I83-E85 PolarHBondContact O-N 3.36Å; I83-K86 WeakPolarHBondContact O-CB 3.47Å; I83-K86 PolarHBondContact O-N 3.18Å; I83-K86 VanDerWaalsContact O-N 3.08Å; I83-E87 PolarHBondContact O-N 3.15Å |
| 84 | L | 98.5 | Very high | 98.2 | Very high | 120 Ų | 120 | 113.7 Ų | 113.7 | 63% | 0.628 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.2 | -41.4 | 178.9 | -71.2 | 173.7 | 0 | 0 | 0 | 112.1 | E80 K81 K86 E87 F88 | E80-L84 WeakPolarHBondContact O-CG 3.43Å; E80-L84 PolarHBondContact O-N 3.49Å; K81-L84 PolarHBondContact O-N 2.88Å; L84-K86 VanDerWaalsContact C-N 3.29Å; L84-K86 PolarHBondContact O-N 3.04Å; L84-E87 PolarHBondContact O-N 3.36Å; L84-F88 VanDerWaalsContact O-CB 3.26Å; L84-F88 WeakPolarHBondContact O-CB 3.39Å; L84-F88 PolarHBondContact O-N 2.78Å |
| 85 | E | 98.4 | Very high | 98 | Very high | 106 Ų | 106 | 111.7 Ų | 111.7 | 50% | 0.495 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.9 | -39.1 | 174.6 | -76.2 | 173.3 | 169 | 0 | 0 | 112.2 | K81 I83 K89 | K81-E85 WeakPolarHBondContact CE-OE1 3.38Å; K81-E85 HydrophobicContact CG-CG 4.39Å; K81-E85 IonicContact NZ-OE1 2.85Å; K81-E85 WeakPolarHBondContact O-CB 3.41Å; K81-E85 VanDerWaalsContact O-CG 3.32Å; K81-E85 WeakPolarHBondContact O-CG 3.42Å; K81-E85 PolarHBondContact O-N 3.08Å; I83-E85 VanDerWaalsContact C-N 3.33Å; I83-E85 PolarHBondContact O-N 3.36Å; E85-K89 PolarHBondContact O-N 2.73Å; E85-K89 VanDerWaalsContact O-N 3.08Å |
| 86 | K | 98.4 | Very high | 97.9 | Very high | 119 Ų | 119 | 109 Ų | 109 | 52% | 0.517 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.3 | -45.8 | 176.3 | -73.2 | 175.9 | 177 | -172.3 | 0 | 112.2 | K82 I83 L84 F88 K89 K90 | K82-K86 WeakPolarHBondContact O-CG 3.47Å; K82-K86 PolarHBondContact O-N 3.3Å; I83-K86 WeakPolarHBondContact O-CB 3.47Å; I83-K86 PolarHBondContact O-N 3.18Å; I83-K86 VanDerWaalsContact O-N 3.08Å; L84-K86 VanDerWaalsContact C-N 3.29Å; L84-K86 PolarHBondContact O-N 3.04Å; K86-F88 VanDerWaalsContact C-N 3.34Å; K86-K89 PolarHBondContact O-N 3.33Å; K86-K90 WeakPolarHBondContact O-CG 2.82Å; K86-K90 PolarHBondContact O-N 3.37Å |
| 87 | E | 98.2 | Very high | 97.8 | Very high | 86 Ų | 86 | 109.4 Ų | 109.4 | 40% | 0.402 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68 | -36 | 179.8 | -66.5 | -51.6 | 132 | 0 | 0 | 111.9 | I83 L84 K90 T91 | I83-E87 PolarHBondContact O-N 3.15Å; L84-E87 PolarHBondContact O-N 3.36Å; E87-K90 PolarHBondContact O-N 2.83Å; E87-K90 IonicContact OE1-NZ 2.73Å; E87-K90 PolarHBondContact OE1-NZ 3.44Å; E87-K90 IonicContact OE2-NZ 3.79Å; E87-T91 WeakPolarHBondContact O-CB 3.15Å; E87-T91 PolarHBondContact O-N 3.08Å; E87-T91 PolarHBondContact O-OG1 3.46Å |
| 88 | F | 98.1 | Very high | 97.5 | Very high | 142 Ų | 142 | 111 Ų | 111 | 62% | 0.623 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.7 | -48.8 | 171.6 | -178.7 | -100.7 | 0 | 0 | 0 | 111 | L84 K86 K90 T91 Q92 | L84-F88 VanDerWaalsContact O-CB 3.26Å; L84-F88 WeakPolarHBondContact O-CB 3.39Å; L84-F88 PolarHBondContact O-N 2.78Å; K86-F88 VanDerWaalsContact C-N 3.34Å; F88-K90 PolarHBondContact O-N 2.94Å; F88-T91 PolarHBondContact O-N 3.43Å; F88-Q92 WeakPolarHBondContact O-CB 3.13Å; F88-Q92 PolarHBondContact O-N 3.13Å |
| 89 | K | 98.3 | Very high | 97.2 | Very high | 130 Ų | 130 | 105.2 Ų | 105.2 | 57% | 0.565 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -58.9 | -46.9 | 177.7 | -168.8 | -175.3 | -177.3 | -160.2 | 0 | 112.2 | E85 K86 T91 Q92 E93 | E85-K89 PolarHBondContact O-N 2.73Å; E85-K89 VanDerWaalsContact O-N 3.08Å; K86-K89 PolarHBondContact O-N 3.33Å; K89-T91 VanDerWaalsContact C-N 3.29Å; K89-T91 PolarHBondContact O-N 3Å; K89-Q92 WeakPolarHBondContact O-CB 3.36Å; K89-Q92 PolarHBondContact O-N 3.42Å; K89-E93 WeakPolarHBondContact CE-OE1 3.26Å; K89-E93 IonicContact NZ-OE1 3.38Å; K89-E93 WeakPolarHBondContact O-CG 3.5Å; K89-E93 PolarHBondContact O-N 3.08Å |
| 90 | K | 97.9 | Very high | 96.8 | Very high | 91 Ų | 91 | 107.8 Ų | 107.8 | 40% | 0.396 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.2 | -39.8 | 176.7 | -70.8 | 173.6 | -175.2 | 170.5 | 0 | 112.3 | K86 E87 F88 R94 | K86-K90 WeakPolarHBondContact O-CG 2.82Å; K86-K90 PolarHBondContact O-N 3.37Å; E87-K90 PolarHBondContact O-N 2.83Å; E87-K90 IonicContact OE1-NZ 2.73Å; E87-K90 PolarHBondContact OE1-NZ 3.44Å; E87-K90 IonicContact OE2-NZ 3.79Å; F88-K90 PolarHBondContact O-N 2.94Å; K90-R94 WeakPolarHBondContact O-CG 3.41Å; K90-R94 PolarHBondContact O-N 3.39Å; K90-R94 VanDerWaalsContact O-N 3.08Å |
| 91 | T | 97.2 | Very high | 96.5 | Very high | 82 Ų | 82 | 108.2 Ų | 108.2 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.3 | -40.2 | 179.2 | -56 | 0 | 0 | 0 | 0 | 110.8 | E87 F88 K89 R94 L95 | E87-T91 WeakPolarHBondContact O-CB 3.15Å; E87-T91 PolarHBondContact O-N 3.08Å; E87-T91 PolarHBondContact O-OG1 3.46Å; F88-T91 PolarHBondContact O-N 3.43Å; K89-T91 VanDerWaalsContact C-N 3.29Å; K89-T91 PolarHBondContact O-N 3Å; T91-R94 PolarHBondContact O-N 2.93Å; T91-L95 PolarHBondContact O-N 3.25Å |
| 92 | Q | 97.7 | Very high | 95.9 | Very high | 77 Ų | 77 | 108.4 Ų | 108.4 | 36% | 0.36 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62 | -47.2 | 174.3 | -170.8 | 63.8 | 49.8 | 0 | 0 | 111.5 | F88 K89 R94 L95 D96 | F88-Q92 WeakPolarHBondContact O-CB 3.13Å; F88-Q92 PolarHBondContact O-N 3.13Å; K89-Q92 WeakPolarHBondContact O-CB 3.36Å; K89-Q92 PolarHBondContact O-N 3.42Å; Q92-R94 VanDerWaalsContact C-N 3.33Å; Q92-R94 PolarHBondContact O-N 3.39Å; Q92-L95 WeakPolarHBondContact O-CB 3.48Å; Q92-L95 PolarHBondContact O-N 2.88Å; Q92-L95 VanDerWaalsContact O-N 3.13Å; Q92-D96 PolarHBondContact NE2-OD1 3.35Å; Q92-D96 PolarHBondContact O-N 3.4Å |
| 93 | E | 97.4 | Very high | 95.1 | Very high | 86 Ų | 86 | 106.8 Ų | 106.8 | 40% | 0.402 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -57.3 | -45.4 | 177 | -72.7 | 166.6 | 177.6 | 0 | 0 | 111.4 | K89 L95 D96 E97 | K89-E93 WeakPolarHBondContact CE-OE1 3.26Å; K89-E93 IonicContact NZ-OE1 3.38Å; K89-E93 WeakPolarHBondContact O-CG 3.5Å; K89-E93 PolarHBondContact O-N 3.08Å; E93-L95 PolarHBondContact O-N 2.94Å; E93-D96 PolarHBondContact O-N 2.92Å; E93-E97 WeakPolarHBondContact O-CG 3.41Å; E93-E97 PolarHBondContact O-N 3.02Å |
| 94 | R | 96.6 | Very high | 94.3 | Very high | 157 Ų | 157 | 106.5 Ų | 106.5 | 59% | 0.592 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.6 | -41.7 | 175.2 | -73.1 | 174.4 | -178.6 | 176.4 | 0.5 | 112.5 | K90 T91 Q92 D96 E97 F98 | K90-R94 WeakPolarHBondContact O-CG 3.41Å; K90-R94 PolarHBondContact O-N 3.39Å; K90-R94 VanDerWaalsContact O-N 3.08Å; T91-R94 PolarHBondContact O-N 2.93Å; Q92-R94 VanDerWaalsContact C-N 3.33Å; Q92-R94 PolarHBondContact O-N 3.39Å; R94-D96 VanDerWaalsContact C-N 3.33Å; R94-E97 PolarHBondContact O-N 3.18Å; R94-F98 WeakPolarHBondContact O-CD2 3.49Å; R94-F98 PolarHBondContact O-N 3.33Å |
| 95 | L | 95.8 | Very high | 93.4 | Very high | 96 Ų | 96 | 106.9 Ų | 106.9 | 50% | 0.503 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.3 | -39.9 | 179.1 | -177.6 | 63.3 | 0 | 0 | 0 | 111.6 | T91 Q92 E93 F98 S99 | T91-L95 PolarHBondContact O-N 3.25Å; Q92-L95 WeakPolarHBondContact O-CB 3.48Å; Q92-L95 PolarHBondContact O-N 2.88Å; Q92-L95 VanDerWaalsContact O-N 3.13Å; E93-L95 PolarHBondContact O-N 2.94Å; L95-F98 PolarHBondContact O-N 2.97Å; L95-S99 WeakPolarHBondContact O-CB 3.44Å; L95-S99 PolarHBondContact O-N 2.95Å; L95-S99 PolarHBondContact O-OG 2.93Å |
| 96 | D | 96 | Very high | 92.2 | Very high | 76 Ų | 76 | 106.4 Ų | 106.4 | 41% | 0.406 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.5 | -41.2 | 176.4 | -66.5 | -11.9 | 0 | 0 | 0 | 111 | Q92 E93 R94 S99 K100 | Q92-D96 PolarHBondContact NE2-OD1 3.35Å; Q92-D96 PolarHBondContact O-N 3.4Å; E93-D96 PolarHBondContact O-N 2.92Å; R94-D96 VanDerWaalsContact C-N 3.33Å; D96-S99 PolarHBondContact O-N 3.29Å; D96-K100 WeakPolarHBondContact O-CG 3.35Å; D96-K100 PolarHBondContact O-N 3.4Å |
| 97 | E | 95.7 | Very high | 90.9 | Very high | 115 Ų | 115 | 106.5 Ų | 106.5 | 54% | 0.537 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.8 | -46.9 | 172.9 | -73.5 | 173.6 | -178.6 | 0 | 0 | 112.3 | E93 R94 S99 K100 Q101 | E93-E97 WeakPolarHBondContact O-CG 3.41Å; E93-E97 PolarHBondContact O-N 3.02Å; R94-E97 PolarHBondContact O-N 3.18Å; E97-S99 VanDerWaalsContact C-N 3.29Å; E97-S99 PolarHBondContact O-N 3.19Å; E97-K100 PolarHBondContact O-N 2.95Å; E97-Q101 WeakPolarHBondContact O-CG 3.39Å; E97-Q101 PolarHBondContact O-N 3.35Å |
| 98 | F | 92.9 | Very high | 89.6 | Confident | 138 Ų | 138 | 108.3 Ų | 108.3 | 61% | 0.605 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.9 | -41 | 175.9 | -85.1 | -64.7 | 0 | 0 | 0 | 111.8 | R94 L95 Q101 K102 | R94-F98 WeakPolarHBondContact O-CD2 3.49Å; R94-F98 PolarHBondContact O-N 3.33Å; L95-F98 PolarHBondContact O-N 2.97Å; F98-Q101 PolarHBondContact O-N 2.92Å; F98-K102 WeakPolarHBondContact O-CB 3.35Å; F98-K102 PolarHBondContact O-N 2.85Å |
| 99 | S | 90.9 | Very high | 88.2 | Confident | 56 Ų | 56 | 106.9 Ų | 106.9 | 39% | 0.392 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.8 | -43.9 | 178 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | L95 D96 E97 K102 N103 | L95-S99 WeakPolarHBondContact O-CB 3.44Å; L95-S99 PolarHBondContact O-N 2.95Å; L95-S99 PolarHBondContact O-OG 2.93Å; D96-S99 PolarHBondContact O-N 3.29Å; E97-S99 VanDerWaalsContact C-N 3.29Å; E97-S99 PolarHBondContact O-N 3.19Å; S99-K102 PolarHBondContact O-N 3.44Å; S99-N103 VanDerWaalsContact O-CG 3.27Å; S99-N103 PolarHBondContact O-N 3.38Å; S99-N103 PolarHBondContact O-OD1 3.17Å |
| 100 | K | 91.8 | Very high | 86.6 | Confident | 153 Ų | 153 | 104.9 Ų | 104.9 | 67% | 0.665 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.9 | -46.2 | 174.1 | -73.3 | 173.3 | -176.4 | 174.7 | 0 | 111.9 | D96 E97 K102 N103 E104 | D96-K100 WeakPolarHBondContact O-CG 3.35Å; D96-K100 PolarHBondContact O-N 3.4Å; E97-K100 PolarHBondContact O-N 2.95Å; K100-K102 VanDerWaalsContact C-N 3.33Å; K100-K102 PolarHBondContact O-N 2.85Å; K100-N103 PolarHBondContact O-N 3.38Å; K100-E104 WeakPolarHBondContact O-CB 3.47Å; K100-E104 PolarHBondContact O-N 3.4Å |
| 101 | Q | 90.1 | Very high | 84.8 | Confident | 93 Ų | 93 | 102.3 Ų | 102.3 | 44% | 0.435 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.7 | -40.1 | 177.6 | -74.4 | -177.7 | 12.1 | 0 | 0 | 112.3 | E97 F98 E104 K105 | E97-Q101 WeakPolarHBondContact O-CG 3.39Å; E97-Q101 PolarHBondContact O-N 3.35Å; F98-Q101 PolarHBondContact O-N 2.92Å; Q101-E104 PolarHBondContact O-N 3.35Å; Q101-K105 WeakPolarHBondContact O-CB 3.45Å; Q101-K105 VanDerWaalsContact O-CG 3.29Å; Q101-K105 WeakPolarHBondContact O-CG 3.48Å; Q101-K105 PolarHBondContact O-N 3.03Å |
| 102 | K | 86.8 | Confident | 83 | Confident | 128 Ų | 128 | 103.2 Ų | 103.2 | 56% | 0.557 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62 | -50.5 | 176 | -178.2 | -178.7 | 170.3 | -176.1 | 0 | 110.9 | F98 S99 K100 E104 K105 E106 | F98-K102 WeakPolarHBondContact O-CB 3.35Å; F98-K102 PolarHBondContact O-N 2.85Å; S99-K102 PolarHBondContact O-N 3.44Å; K100-K102 VanDerWaalsContact C-N 3.33Å; K100-K102 PolarHBondContact O-N 2.85Å; K102-E104 VanDerWaalsContact C-N 3.3Å; K102-E104 PolarHBondContact O-N 2.89Å; K102-K105 PolarHBondContact O-N 3.37Å; K102-E106 WeakPolarHBondContact CE-OE1 3.42Å; K102-E106 IonicContact NZ-OE1 3.8Å; K102-E106 WeakPolarHBondContact O-CG 3.29Å; K102-E106 PolarHBondContact O-N 3.34Å |
| 103 | N | 81.3 | Confident | 81.1 | Confident | 89 Ų | 89 | 105.4 Ų | 105.4 | 48% | 0.476 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.2 | -41 | 178.8 | -67.1 | -9.4 | 0 | 0 | 0 | 111.6 | S99 K100 E106 L107 | S99-N103 VanDerWaalsContact O-CG 3.27Å; S99-N103 PolarHBondContact O-N 3.38Å; S99-N103 PolarHBondContact O-OD1 3.17Å; K100-N103 PolarHBondContact O-N 3.38Å; N103-E106 PolarHBondContact O-N 3.48Å; N103-L107 WeakPolarHBondContact O-CB 3.42Å; N103-L107 VanDerWaalsContact O-CG 3.28Å; N103-L107 WeakPolarHBondContact O-CG 3.47Å; N103-L107 PolarHBondContact O-N 2.73Å |
| 104 | E | 82.8 | Confident | 79 | Confident | 97 Ų | 97 | 106.9 Ų | 106.9 | 45% | 0.453 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.7 | -39.9 | 176.9 | -164.7 | -161.1 | -176.6 | 0 | 0 | 112.2 | K100 Q101 K102 L107 R108 | K100-E104 WeakPolarHBondContact O-CB 3.47Å; K100-E104 PolarHBondContact O-N 3.4Å; Q101-E104 PolarHBondContact O-N 3.35Å; K102-E104 VanDerWaalsContact C-N 3.3Å; K102-E104 PolarHBondContact O-N 2.89Å; E104-L107 PolarHBondContact O-N 2.72Å; E104-R108 VanDerWaalsContact CD-CZ 3.43Å; E104-R108 VanDerWaalsContact CD-NH2 3.26Å; E104-R108 WeakPolarHBondContact O-CB 3.36Å; E104-R108 WeakPolarHBondContact O-CG 3.28Å; E104-R108 PolarHBondContact O-N 2.92Å; E104-R108 IonicContact OE1-CZ 3.64Å; E104-R108 IonicContact OE1-NH1 3.68Å; E104-R108 PolarHBondContact OE1-NH1 2.91Å; E104-R108 IonicContact OE1-NH2 3.51Å; E104-R108 IonicContact OE2-CZ 3.89Å; E104-R108 IonicContact OE2-NH1 2.73Å; E104-R108 PolarHBondContact OE2-NH1 2.95Å; E104-R108 IonicContact OE2-NH2 3.47Å; E104-R108 PolarHBondContact OE2-NH2 2.93Å |
| 105 | K | 78.8 | Confident | 76.9 | Confident | 127 Ų | 127 | 104 Ų | 104 | 55% | 0.552 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65 | -41.5 | 173.9 | -75.1 | 174.9 | -178 | 177.3 | 0 | 112 | Q101 K102 R108 H109 | Q101-K105 WeakPolarHBondContact O-CB 3.45Å; Q101-K105 VanDerWaalsContact O-CG 3.29Å; Q101-K105 WeakPolarHBondContact O-CG 3.48Å; Q101-K105 PolarHBondContact O-N 3.03Å; K102-K105 PolarHBondContact O-N 3.37Å; K105-R108 PolarHBondContact O-N 3.39Å; K105-H109 PolarHBondContact O-N 3.48Å |
| 106 | E | 74.3 | Confident | 74.8 | Confident | 96 Ų | 96 | 102.4 Ų | 102.4 | 45% | 0.449 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.2 | -45.5 | 175.1 | -75 | 177.2 | -178 | 0 | 0 | 111.3 | K102 N103 R108 H109 I110 | K102-E106 WeakPolarHBondContact CE-OE1 3.42Å; K102-E106 IonicContact NZ-OE1 3.8Å; K102-E106 WeakPolarHBondContact O-CG 3.29Å; K102-E106 PolarHBondContact O-N 3.34Å; N103-E106 PolarHBondContact O-N 3.48Å; E106-R108 VanDerWaalsContact C-N 3.34Å; E106-R108 PolarHBondContact O-N 2.87Å; E106-H109 PolarHBondContact O-N 2.89Å; E106-I110 WeakPolarHBondContact O-CG1 2.94Å; E106-I110 PolarHBondContact O-N 3.49Å |
| 107 | L | 70.5 | Confident | 72.6 | Confident | 121 Ų | 121 | 105.7 Ų | 105.7 | 63% | 0.634 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60.8 | -41 | 174.4 | -73.3 | 171.5 | 0 | 0 | 0 | 112.2 | N103 E104 I110 G111 | N103-L107 WeakPolarHBondContact O-CB 3.42Å; N103-L107 VanDerWaalsContact O-CG 3.28Å; N103-L107 WeakPolarHBondContact O-CG 3.47Å; N103-L107 PolarHBondContact O-N 2.73Å; E104-L107 PolarHBondContact O-N 2.72Å; L107-I110 PolarHBondContact O-N 3.18Å; L107-G111 PolarHBondContact O-N 3.03Å |
| 108 | R | 71.4 | Confident | 70.6 | Confident | 124 Ų | 124 | 104.9 Ų | 104.9 | 47% | 0.468 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 173.4 | -81.1 | -171.3 | -80.4 | -110.1 | -0.8 | 112.3 | E104 K105 E106 G111 T112 | E104-R108 VanDerWaalsContact CD-CZ 3.43Å; E104-R108 VanDerWaalsContact CD-NH2 3.26Å; E104-R108 WeakPolarHBondContact O-CB 3.36Å; E104-R108 WeakPolarHBondContact O-CG 3.28Å; E104-R108 PolarHBondContact O-N 2.92Å; E104-R108 IonicContact OE1-CZ 3.64Å; E104-R108 IonicContact OE1-NH1 3.68Å; E104-R108 PolarHBondContact OE1-NH1 2.91Å; E104-R108 IonicContact OE1-NH2 3.51Å; E104-R108 IonicContact OE2-CZ 3.89Å; E104-R108 IonicContact OE2-NH1 2.73Å; E104-R108 PolarHBondContact OE2-NH1 2.95Å; E104-R108 IonicContact OE2-NH2 3.47Å; E104-R108 PolarHBondContact OE2-NH2 2.93Å; K105-R108 PolarHBondContact O-N 3.39Å; E106-R108 VanDerWaalsContact C-N 3.34Å; E106-R108 PolarHBondContact O-N 2.87Å; R108-G111 PolarHBondContact O-N 3.44Å; R108-T112 WeakPolarHBondContact O-CB 3.32Å; R108-T112 PolarHBondContact O-N 3.35Å; R108-T112 PolarHBondContact O-OG1 2.84Å |
| 109 | H | 67.4 | Low | 69 | Low | 112 Ų | 112 | 107.4 Ų | 107.4 | 52% | 0.519 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63.9 | -45.3 | 178.1 | -175.1 | -81.9 | 0 | 0 | 0 | 111.4 | K105 E106 T112 Q113 | K105-H109 PolarHBondContact O-N 3.48Å; E106-H109 PolarHBondContact O-N 2.89Å; H109-T112 PolarHBondContact O-N 3.33Å; H109-Q113 PolarHBondContact CE1-NE2 3.16Å; H109-Q113 VanDerWaalsContact CE1-NE2 3.31Å; H109-Q113 PolarHBondContact O-N 3.31Å |
| 110 | I | 66 | Low | 67.5 | Low | 88 Ų | 88 | 107.4 Ų | 107.4 | 45% | 0.451 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62 | -46.4 | 174.8 | -66.2 | 166.9 | 0 | 0 | 0 | 110.5 | E106 L107 T112 Q113 I114 | E106-I110 WeakPolarHBondContact O-CG1 2.94Å; E106-I110 PolarHBondContact O-N 3.49Å; L107-I110 PolarHBondContact O-N 3.18Å; I110-T112 VanDerWaalsContact C-N 3.27Å; I110-T112 PolarHBondContact O-N 2.84Å; I110-Q113 PolarHBondContact O-N 3.47Å; I110-Q113 VanDerWaalsContact O-N 3.11Å; I110-I114 HydrophobicContact CG2-CD1 3.59Å; I110-I114 HydrophobicContact CG2-CG1 4.28Å; I110-I114 WeakPolarHBondContact O-CG1 3.43Å; I110-I114 PolarHBondContact O-N 2.9Å |
| 111 | G | 60 | Low | 66.2 | Low | 37 Ų | 37 | 105.6 Ų | 105.6 | 38% | 0.381 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -60.4 | -35.9 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | L107 R108 I114 S115 | L107-G111 PolarHBondContact O-N 3.03Å; R108-G111 PolarHBondContact O-N 3.44Å; G111-I114 PolarHBondContact O-N 3.21Å; G111-S115 WeakPolarHBondContact O-CB 3.22Å; G111-S115 PolarHBondContact O-N 3.29Å |
| 112 | T | 58.4 | Low | 65.5 | Low | 101 Ų | 101 | 106.5 Ų | 106.5 | 62% | 0.62 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -69.1 | -37.3 | 175.1 | -52.3 | 0 | 0 | 0 | 0 | 111.5 | R108 H109 I110 S116 | R108-T112 WeakPolarHBondContact O-CB 3.32Å; R108-T112 PolarHBondContact O-N 3.35Å; R108-T112 PolarHBondContact O-OG1 2.84Å; H109-T112 PolarHBondContact O-N 3.33Å; I110-T112 VanDerWaalsContact C-N 3.27Å; I110-T112 PolarHBondContact O-N 2.84Å; T112-S116 PolarHBondContact O-N 3.4Å |
| 113 | Q | 57.7 | Low | 65.1 | Low | 124 Ų | 124 | 104.4 Ų | 104.4 | 58% | 0.579 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -71.8 | -29 | 174.3 | -71 | -165.4 | -23.7 | 0 | 0 | 113.5 | H109 I110 S116 | H109-Q113 PolarHBondContact CE1-NE2 3.16Å; H109-Q113 VanDerWaalsContact CE1-NE2 3.31Å; H109-Q113 PolarHBondContact O-N 3.31Å; I110-Q113 PolarHBondContact O-N 3.47Å; I110-Q113 VanDerWaalsContact O-N 3.11Å; Q113-S116 PolarHBondContact O-OG 2.93Å |
| 114 | I | 54.9 | Low | 65.4 | Low | 117 Ų | 117 | 108.1 Ų | 108.1 | 60% | 0.6 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -81.8 | -37.1 | 176.4 | -63.2 | 169.9 | 0 | 0 | 0 | 111.1 | I110 G111 S116 | I110-I114 HydrophobicContact CG2-CD1 3.59Å; I110-I114 HydrophobicContact CG2-CG1 4.28Å; I110-I114 WeakPolarHBondContact O-CG1 3.43Å; I110-I114 PolarHBondContact O-N 2.9Å; G111-I114 PolarHBondContact O-N 3.21Å; I114-S116 VanDerWaalsContact C-N 3.27Å; I114-S116 PolarHBondContact O-N 3.44Å |
| 115 | S | 51.5 | Low | 65.4 | Low | 96 Ų | 96 | 113.4 Ų | 113.4 | 67% | 0.671 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -76.2 | -11.8 | 178.1 | -173.7 | 0 | 0 | 0 | 0 | 113.5 | G111 D117 | G111-S115 WeakPolarHBondContact O-CB 3.22Å; G111-S115 PolarHBondContact O-N 3.29Å; S115-D117 PolarHBondContact O-N 3.11Å |
| 116 | S | 51.5 | Low | 65.8 | Low | 62 Ų | 62 | 114.1 Ų | 114.1 | 43% | 0.434 | 60% | 0.598 | S | S | . | * | trans | -75 | 77.3 | 164.4 | 75.4 | 0 | 0 | 0 | 0 | 108.9 | T112 Q113 I114 S118 | T112-S116 PolarHBondContact O-N 3.4Å; Q113-S116 PolarHBondContact O-OG 2.93Å; I114-S116 VanDerWaalsContact C-N 3.27Å; I114-S116 PolarHBondContact O-N 3.44Å; S116-S118 PolarHBondContact O-N 2.74Å | ||
| 117 | D | 50 | Low | 66.4 | Low | 146 Ų | 146 | 112.5 Ų | 112.5 | 78% | 0.781 | 59% | 0.594 | S | S | * | * | trans | -67.6 | 44.2 | 163.5 | -82.8 | -30.6 | 0 | 0 | 0 | 111.3 | S115 Y119 | S115-D117 PolarHBondContact O-N 3.11Å; D117-Y119 VanDerWaalsContact C-N 3.32Å | ||
| 118 | S | 54.7 | Low | 67.4 | Low | 98 Ų | 98 | 114 Ų | 114 | 69% | 0.685 | 60% | 0.596 | S | S | * | * | trans | -102.1 | 48.5 | 156 | 86 | 0 | 0 | 0 | 0 | 109.3 | S116 G120 | S116-S118 PolarHBondContact O-N 2.74Å; S118-G120 PolarHBondContact O-N 2.79Å | ||
| 119 | Y | 58 | Low | 68.3 | Low | 191 Ų | 191 | 112.9 Ų | 112.9 | 75% | 0.749 | 60% | 0.598 | S | S | * | * | trans | -62.2 | 80.8 | 144.8 | -80 | -85.1 | 0 | 0 | 0 | 105.9 | D117 S121 | D117-Y119 VanDerWaalsContact C-N 3.32Å; Y119-S121 PolarHBondContact O-N 2.75Å | ||
| 120 | G | 59.3 | Low | 69.4 | Low | 55 Ų | 55 | 111.8 Ų | 111.8 | 57% | 0.567 | 60% | 0.596 | S | S | * | * | trans | -48.7 | 118.4 | 175 | 0 | 0 | 0 | 0 | 0 | 106.2 | S118 I122 | S118-G120 PolarHBondContact O-N 2.79Å; G120-I122 PolarHBondContact O-N 2.98Å | ||
| 121 | S | 65.8 | Low | 70.7 | Confident | 116 Ų | 116 | 112.8 Ų | 112.8 | 81% | 0.811 | 60% | 0.601 | S | S | * | * | trans | -34.9 | 98.6 | -174.3 | 158.2 | 0 | 0 | 0 | 0 | 110.2 | Y119 D123 | Y119-S121 PolarHBondContact O-N 2.75Å; S121-D123 PolarHBondContact O-N 3.01Å | ||
| 122 | I | 74.6 | Confident | 72.1 | Confident | 112 Ų | 112 | 118.3 Ų | 118.3 | 57% | 0.574 | 62% | 0.615 | S | S | * | * | trans | -63.9 | 116 | 179.4 | -66.3 | 176.4 | 0 | 0 | 0 | 105.6 | G120 K124 V127 | G120-I122 PolarHBondContact O-N 2.98Å; I122-K124 PolarHBondContact O-N 3.48Å; I122-V127 HydrophobicContact CG2-CG2 3.46Å; I122-V127 VanDerWaalsContact CG2-CG2 3.46Å | ||
| 123 | D | 79 | Confident | 73.5 | Confident | 84 Ų | 84 | 118.1 Ų | 118.1 | 45% | 0.449 | 61% | 0.607 | S | S | . | * | trans | -64.8 | 99.7 | -179.5 | -178.7 | -0.9 | 0 | 0 | 0 | 109.2 | S121 R125 K126 V127 | S121-D123 PolarHBondContact O-N 3.01Å; D123-R125 PolarHBondContact O-N 3.48Å; D123-R125 VanDerWaalsContact O-N 3.1Å; D123-R125 WeakPolarHBondContact OD1-CA 3.34Å; D123-R125 WeakPolarHBondContact OD1-CB 3.36Å; D123-R125 PolarHBondContact OD1-N 3.39Å; D123-K126 HydrophobicContact CB-CB 4.01Å; D123-K126 WeakPolarHBondContact O-CB 3.38Å; D123-K126 PolarHBondContact O-N 3.22Å; D123-V127 PolarHBondContact O-N 2.94Å | ||
| 124 | K | 86.4 | Confident | 75 | Confident | 167 Ų | 167 | 117.3 Ų | 117.3 | 73% | 0.726 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -58 | -25.2 | 179.9 | -62.3 | -176.5 | -178.4 | 179 | 0 | 111.7 | I122 K128 | I122-K124 PolarHBondContact O-N 3.48Å; K124-K128 WeakPolarHBondContact O-CB 3.23Å; K124-K128 VanDerWaalsContact O-CG 3.3Å; K124-K128 WeakPolarHBondContact O-CG 3.39Å; K124-K128 PolarHBondContact O-N 3.34Å |
| 125 | R | 84 | Confident | 76.6 | Confident | 207 Ų | 207 | 119.4 Ų | 119.4 | 78% | 0.781 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69.3 | -47.3 | 174.5 | -59.5 | -179.1 | -178.5 | 175 | 1.8 | 110.2 | D123 V127 K128 L129 | D123-R125 PolarHBondContact O-N 3.48Å; D123-R125 VanDerWaalsContact O-N 3.1Å; D123-R125 WeakPolarHBondContact OD1-CA 3.34Å; D123-R125 WeakPolarHBondContact OD1-CB 3.36Å; D123-R125 PolarHBondContact OD1-N 3.39Å; R125-V127 VanDerWaalsContact C-N 3.35Å; R125-V127 PolarHBondContact O-N 3.26Å; R125-K128 PolarHBondContact O-N 2.88Å; R125-L129 WeakPolarHBondContact O-CB 3.47Å; R125-L129 PolarHBondContact O-N 3.34Å |
| 126 | K | 85.8 | Confident | 78.1 | Confident | 143 Ų | 143 | 119.4 Ų | 119.4 | 62% | 0.622 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -62 | -42.1 | 177.3 | -160.7 | 171.3 | -174.6 | 177.1 | 0 | 111.7 | D123 L129 L130 | D123-K126 HydrophobicContact CB-CB 4.01Å; D123-K126 WeakPolarHBondContact O-CB 3.38Å; D123-K126 PolarHBondContact O-N 3.22Å; K126-L129 PolarHBondContact O-N 2.85Å; K126-L130 WeakPolarHBondContact O-CG 3.28Å; K126-L130 PolarHBondContact O-N 3.18Å |
| 127 | V | 88.5 | Confident | 79.6 | Confident | 62 Ų | 62 | 120 Ų | 120 | 38% | 0.376 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -61.5 | -45.8 | 174.2 | 176 | 0 | 0 | 0 | 0 | 111.7 | I122 D123 R125 L129 L130 L131 | I122-V127 HydrophobicContact CG2-CG2 3.46Å; I122-V127 VanDerWaalsContact CG2-CG2 3.46Å; D123-V127 PolarHBondContact O-N 2.94Å; R125-V127 VanDerWaalsContact C-N 3.35Å; R125-V127 PolarHBondContact O-N 3.26Å; V127-L129 VanDerWaalsContact C-N 3.26Å; V127-L129 PolarHBondContact O-N 2.83Å; V127-L130 PolarHBondContact O-N 3.44Å; V127-L131 HydrophobicContact CG1-CD1 4.01Å; V127-L131 WeakPolarHBondContact O-CB 3.48Å; V127-L131 WeakPolarHBondContact O-CG 3.39Å; V127-L131 PolarHBondContact O-N 2.95Å |
| 128 | K | 89.9 | Confident | 81 | Confident | 152 Ų | 152 | 116.7 Ų | 116.7 | 66% | 0.661 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -61.5 | -35.8 | 175.7 | -80.8 | 179.9 | 178 | -175.6 | 0 | 112.5 | K124 R125 K132 | K124-K128 WeakPolarHBondContact O-CB 3.23Å; K124-K128 VanDerWaalsContact O-CG 3.3Å; K124-K128 WeakPolarHBondContact O-CG 3.39Å; K124-K128 PolarHBondContact O-N 3.34Å; R125-K128 PolarHBondContact O-N 2.88Å; K128-K132 PolarHBondContact O-N 2.78Å |
| 129 | L | 90.3 | Very high | 81.7 | Confident | 100 Ų | 100 | 114.9 Ų | 114.9 | 52% | 0.524 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.5 | -46.8 | -179.6 | -148.7 | 135.2 | 0 | 0 | 0 | 110.7 | R125 K126 V127 L131 K132 E133 | R125-L129 WeakPolarHBondContact O-CB 3.47Å; R125-L129 PolarHBondContact O-N 3.34Å; K126-L129 PolarHBondContact O-N 2.85Å; V127-L129 VanDerWaalsContact C-N 3.26Å; V127-L129 PolarHBondContact O-N 2.83Å; L129-L131 VanDerWaalsContact C-N 3.32Å; L129-L131 PolarHBondContact O-N 3.25Å; L129-K132 WeakPolarHBondContact O-CB 3.31Å; L129-K132 PolarHBondContact O-N 3.44Å; L129-K132 VanDerWaalsContact O-N 3.09Å; L129-E133 HydrophobicContact CD2-CG 4.39Å; L129-E133 WeakPolarHBondContact CD2-OE1 3.48Å; L129-E133 WeakPolarHBondContact O-CG 3.21Å; L129-E133 PolarHBondContact O-N 3.46Å |
| 130 | L | 91.5 | Very high | 81.9 | Confident | 90 Ų | 90 | 110.2 Ų | 110.2 | 47% | 0.471 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.3 | -40.2 | 174.1 | -70.3 | 169.5 | 0 | 0 | 0 | 112.2 | K126 V127 K132 E133 L134 | K126-L130 WeakPolarHBondContact O-CG 3.28Å; K126-L130 PolarHBondContact O-N 3.18Å; V127-L130 PolarHBondContact O-N 3.44Å; L130-K132 VanDerWaalsContact C-N 3.33Å; L130-K132 PolarHBondContact O-N 3.28Å; L130-E133 PolarHBondContact O-N 2.95Å; L130-L134 WeakPolarHBondContact O-CB 3.45Å; L130-L134 WeakPolarHBondContact O-CG 3.3Å; L130-L134 PolarHBondContact O-N 2.79Å |
| 131 | L | 92.4 | Very high | 81.9 | Confident | 108 Ų | 108 | 112.8 Ų | 112.8 | 57% | 0.565 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -64.1 | -37.4 | 174.7 | -76.6 | 168 | 0 | 0 | 0 | 112.2 | V127 L129 W135 | V127-L131 HydrophobicContact CG1-CD1 4.01Å; V127-L131 WeakPolarHBondContact O-CB 3.48Å; V127-L131 WeakPolarHBondContact O-CG 3.39Å; V127-L131 PolarHBondContact O-N 2.95Å; L129-L131 VanDerWaalsContact C-N 3.32Å; L129-L131 PolarHBondContact O-N 3.25Å; L131-W135 VanDerWaalsContact O-CB 3.26Å; L131-W135 WeakPolarHBondContact O-CB 3.36Å; L131-W135 PolarHBondContact O-N 3.24Å |
| 132 | K | 89.1 | Confident | 81.6 | Confident | 153 Ų | 153 | 114.5 Ų | 114.5 | 67% | 0.665 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.6 | -44.1 | 173.4 | -84.1 | -175.3 | 173.1 | -171.8 | 0 | 111.9 | K128 L129 L130 W135 L136 | K128-K132 PolarHBondContact O-N 2.78Å; L129-K132 WeakPolarHBondContact O-CB 3.31Å; L129-K132 PolarHBondContact O-N 3.44Å; L129-K132 VanDerWaalsContact O-N 3.09Å; L130-K132 VanDerWaalsContact C-N 3.33Å; L130-K132 PolarHBondContact O-N 3.28Å; K132-W135 PolarHBondContact O-N 3.3Å; K132-L136 WeakPolarHBondContact O-CG 3.39Å; K132-L136 PolarHBondContact O-N 3.3Å |
| 133 | E | 88.3 | Confident | 80.8 | Confident | 97 Ų | 97 | 119.9 Ų | 119.9 | 45% | 0.453 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.7 | -46.2 | 177.4 | -72.8 | 176.1 | 166.3 | 0 | 0 | 111 | L129 L130 W135 L136 C137 | L129-E133 HydrophobicContact CD2-CG 4.39Å; L129-E133 WeakPolarHBondContact CD2-OE1 3.48Å; L129-E133 WeakPolarHBondContact O-CG 3.21Å; L129-E133 PolarHBondContact O-N 3.46Å; L130-E133 PolarHBondContact O-N 2.95Å; E133-W135 VanDerWaalsContact C-N 3.35Å; E133-W135 PolarHBondContact O-N 3.29Å; E133-L136 WeakPolarHBondContact O-CB 3.37Å; E133-L136 PolarHBondContact O-N 2.76Å; E133-C137 PolarHBondContact O-N 3.41Å; E133-C137 PolarHBondContact O-SG 3.23Å |
| 134 | L | 89.9 | Confident | 79.2 | Confident | 107 Ų | 107 | 123 Ų | 123 | 56% | 0.56 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -60.4 | -43.1 | 174.3 | -76.7 | 168.9 | 0 | 0 | 0 | 112 | L130 L136 C137 V138 | L130-L134 WeakPolarHBondContact O-CB 3.45Å; L130-L134 WeakPolarHBondContact O-CG 3.3Å; L130-L134 PolarHBondContact O-N 2.79Å; L134-L136 VanDerWaalsContact C-N 3.32Å; L134-L136 PolarHBondContact O-N 3.4Å; L134-C137 PolarHBondContact O-N 2.86Å; L134-V138 WeakPolarHBondContact O-CB 3.47Å; L134-V138 VanDerWaalsContact O-CG2 3.28Å; L134-V138 WeakPolarHBondContact O-CG2 3.43Å; L134-V138 PolarHBondContact O-N 3.01Å |
| 135 | W | 88.6 | Confident | 77.8 | Confident | 162 Ų | 162 | 124.5 Ų | 124.5 | 61% | 0.614 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -62.2 | -40 | 176 | -178 | 91.1 | 0 | 0 | 0 | 111.9 | L131 K132 E133 N139 | L131-W135 VanDerWaalsContact O-CB 3.26Å; L131-W135 WeakPolarHBondContact O-CB 3.36Å; L131-W135 PolarHBondContact O-N 3.24Å; K132-W135 PolarHBondContact O-N 3.3Å; E133-W135 VanDerWaalsContact C-N 3.35Å; E133-W135 PolarHBondContact O-N 3.29Å; W135-N139 WeakPolarHBondContact CH2-ND2 3.34Å; W135-N139 WeakPolarHBondContact CZ2-ND2 2.87Å; W135-N139 VanDerWaalsContact CZ3-ND2 3.34Å; W135-N139 WeakPolarHBondContact CZ3-ND2 3.1Å; W135-N139 PolarHBondContact NE1-ND2 3.47Å; W135-N139 VanDerWaalsContact O-CB 3.31Å; W135-N139 WeakPolarHBondContact O-CB 3.26Å; W135-N139 PolarHBondContact O-N 3.09Å |
| 136 | L | 83.4 | Confident | 77.4 | Confident | 95 Ų | 95 | 120.4 Ų | 120.4 | 50% | 0.497 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -64.6 | -46.6 | 173.7 | -73.3 | 169 | 0 | 0 | 0 | 110.9 | K132 E133 L134 V138 N139 T140 | K132-L136 WeakPolarHBondContact O-CG 3.39Å; K132-L136 PolarHBondContact O-N 3.3Å; E133-L136 WeakPolarHBondContact O-CB 3.37Å; E133-L136 PolarHBondContact O-N 2.76Å; L134-L136 VanDerWaalsContact C-N 3.32Å; L134-L136 PolarHBondContact O-N 3.4Å; L136-V138 PolarHBondContact O-N 2.86Å; L136-N139 PolarHBondContact O-N 2.84Å; L136-T140 WeakPolarHBondContact O-CB 3.4Å; L136-T140 VanDerWaalsContact O-CG2 3.23Å; L136-T140 WeakPolarHBondContact O-CG2 3.47Å; L136-T140 PolarHBondContact O-N 3.1Å; L136-T140 PolarHBondContact O-OG1 3.06Å |
| 137 | C | 81.8 | Confident | 77 | Confident | 75 Ų | 75 | 119.2 Ų | 119.2 | 51% | 0.507 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -55 | -51.9 | 175.6 | -69 | 0 | 0 | 0 | 0 | 111.1 | E133 L134 N139 T140 T141 | E133-C137 PolarHBondContact O-N 3.41Å; E133-C137 PolarHBondContact O-SG 3.23Å; L134-C137 PolarHBondContact O-N 2.86Å; C137-N139 VanDerWaalsContact C-N 3.34Å; C137-N139 PolarHBondContact O-N 3Å; C137-T140 WeakPolarHBondContact CA-OG1 3.31Å; C137-T140 PolarHBondContact O-N 2.97Å; C137-T140 PolarHBondContact O-OG1 2.87Å; C137-T141 PolarHBondContact O-N 3.24Å; C137-T141 PolarHBondContact O-OG1 3.02Å |
| 138 | V | 79.8 | Confident | 76.4 | Confident | 77 Ų | 77 | 122.4 Ų | 122.4 | 47% | 0.467 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -59.8 | -42.7 | 179.1 | 172.1 | 0 | 0 | 0 | 0 | 111.6 | L134 L136 T141 H142 | L134-V138 WeakPolarHBondContact O-CB 3.47Å; L134-V138 VanDerWaalsContact O-CG2 3.28Å; L134-V138 WeakPolarHBondContact O-CG2 3.43Å; L134-V138 PolarHBondContact O-N 3.01Å; L136-V138 PolarHBondContact O-N 2.86Å; V138-T141 VanDerWaalsContact C-OG1 3.29Å; V138-T141 VanDerWaalsContact CA-OG1 3.31Å; V138-T141 WeakPolarHBondContact CA-OG1 3.33Å; V138-T141 PolarHBondContact O-N 3.37Å; V138-T141 PolarHBondContact O-OG1 2.96Å; V138-H142 PolarHBondContact O-CD2 2.92Å; V138-H142 VanDerWaalsContact O-CD2 3.23Å; V138-H142 PolarHBondContact O-N 3.43Å |
| 139 | N | 69.4 | Low | 75.6 | Confident | 60 Ų | 60 | 120.6 Ų | 120.6 | 32% | 0.321 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -75 | -28.4 | 179 | -78.8 | -19 | 0 | 0 | 0 | 114.2 | W135 L136 C137 H142 | W135-N139 WeakPolarHBondContact CH2-ND2 3.34Å; W135-N139 WeakPolarHBondContact CZ2-ND2 2.87Å; W135-N139 VanDerWaalsContact CZ3-ND2 3.34Å; W135-N139 WeakPolarHBondContact CZ3-ND2 3.1Å; W135-N139 PolarHBondContact NE1-ND2 3.47Å; W135-N139 VanDerWaalsContact O-CB 3.31Å; W135-N139 WeakPolarHBondContact O-CB 3.26Å; W135-N139 PolarHBondContact O-N 3.09Å; L136-N139 PolarHBondContact O-N 2.84Å; C137-N139 VanDerWaalsContact C-N 3.34Å; C137-N139 PolarHBondContact O-N 3Å; N139-H142 PolarHBondContact O-N 2.89Å |
| 140 | T | 62.9 | Low | 74.6 | Confident | 92 Ų | 92 | 121.9 Ų | 121.9 | 56% | 0.564 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -72.5 | -30.5 | 172.8 | 54.4 | 0 | 0 | 0 | 0 | 111.8 | L136 C137 H142 R143 | L136-T140 WeakPolarHBondContact O-CB 3.4Å; L136-T140 VanDerWaalsContact O-CG2 3.23Å; L136-T140 WeakPolarHBondContact O-CG2 3.47Å; L136-T140 PolarHBondContact O-N 3.1Å; L136-T140 PolarHBondContact O-OG1 3.06Å; C137-T140 WeakPolarHBondContact CA-OG1 3.31Å; C137-T140 PolarHBondContact O-N 2.97Å; C137-T140 PolarHBondContact O-OG1 2.87Å; T140-H142 VanDerWaalsContact C-N 3.28Å; T140-H142 PolarHBondContact O-N 3.47Å; T140-R143 PolarHBondContact O-N 2.93Å |
| 141 | T | 59.3 | Low | 73.5 | Confident | 110 Ų | 110 | 124.1 Ų | 124.1 | 68% | 0.675 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -71.7 | -17.8 | 169.3 | 30.4 | 0 | 0 | 0 | 0 | 114.1 | C137 V138 | C137-T141 PolarHBondContact O-N 3.24Å; C137-T141 PolarHBondContact O-OG1 3.02Å; V138-T141 VanDerWaalsContact C-OG1 3.29Å; V138-T141 VanDerWaalsContact CA-OG1 3.31Å; V138-T141 WeakPolarHBondContact CA-OG1 3.33Å; V138-T141 PolarHBondContact O-N 3.37Å; V138-T141 PolarHBondContact O-OG1 2.96Å |
| 142 | H | 58 | Low | 72.2 | Confident | 151 Ų | 151 | 125.2 Ų | 125.2 | 70% | 0.699 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | 2.3 | 172.3 | -80.8 | -63.1 | 0 | 0 | 0 | 113.8 | V138 N139 T140 | V138-H142 PolarHBondContact O-CD2 2.92Å; V138-H142 VanDerWaalsContact O-CD2 3.23Å; V138-H142 PolarHBondContact O-N 3.43Å; N139-H142 PolarHBondContact O-N 2.89Å; T140-H142 VanDerWaalsContact C-N 3.28Å; T140-H142 PolarHBondContact O-N 3.47Å |
| 143 | R | 57.8 | Low | 70.9 | Confident | 225 Ų | 225 | 123.1 Ų | 123.1 | 85% | 0.849 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -133.2 | 45.5 | -174.6 | -138.4 | -173.1 | -150.8 | -115.3 | 6.5 | 113.6 | T140 | T140-R143 PolarHBondContact O-N 2.93Š|
| 144 | L | 46 | Very low | 69.4 | Low | 151 Ų | 151 | 125.3 Ų | 125.3 | 79% | 0.791 | 65% | 0.652 | S | S | * | * | trans | -133 | 137.2 | 148.6 | -83.3 | 162.3 | 0 | 0 | 0 | 107.1 | ||||
| 145 | P | 56.2 | Low | 67.6 | Low | 198 Ų | 198 | 126.9 Ų | 126.9 | 100% | 1.286 | 66% | 0.661 | S | S | * | * | trans | -63.8 | 0 | -164.1 | 26.6 | -35 | 0 | 0 | 0 | 114.8 |
Retrieved 145 of 145 residues in 136.4 ms
(Link to these results)