| 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 | 42.6 | Very low | 64.8 | Low | 212 Ų | 212 | 168.6 Ų | 168.6 | 100% | 1.044 | 81% | 0.81 | S | S | * | * | 0 | 111.8 | 0 | -88.4 | 155.2 | 168.9 | 0 | 0 | 108.5 | |||||
| 2 | S | 50 | Low | 66.6 | Low | 108 Ų | 108 | 164.4 Ų | 164.4 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -91.6 | 113.2 | -178.6 | -175.1 | 0 | 0 | 0 | 0 | 110 | R4 | S2-R4 PolarHBondContact O-N 3.32Š| ||
| 3 | Y | 53.8 | Low | 68.1 | Low | 213 Ų | 213 | 163.6 Ų | 163.6 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | trans | -84.6 | 37.1 | -177.7 | -64.6 | -79 | 0 | 0 | 0 | 113.8 | ||||
| 4 | R | 58.4 | Low | 69.7 | Low | 218 Ų | 218 | 158.5 Ų | 158.5 | 82% | 0.823 | 78% | 0.778 | S | S | * | * | trans | -117.3 | 4 | -170 | -87.9 | -162.2 | -89.7 | 156.9 | -9.6 | 118.1 | S2 | S2-R4 PolarHBondContact O-N 3.32Š| ||
| 5 | N | 59.6 | Low | 71.1 | Confident | 142 Ų | 142 | 160.4 Ų | 160.4 | 76% | 0.759 | 78% | 0.784 | S | S | * | * | trans | -124.9 | 146.5 | 175.6 | -74 | 13.7 | 0 | 0 | 0 | 110.7 | ||||
| 6 | N | 60.7 | Low | 72.3 | Confident | 142 Ų | 142 | 156.4 Ų | 156.4 | 76% | 0.759 | 76% | 0.763 | S | S | * | * | trans | 114.8 | 23.4 | 165.1 | -50.5 | -8.1 | 0 | 0 | 0 | 116.7 | ||||
| 7 | R | 67 | Low | 73.6 | Confident | 231 Ų | 231 | 151.7 Ų | 151.7 | 87% | 0.872 | 75% | 0.748 | S | S | * | * | trans | -122.6 | 79.4 | 157.7 | -67 | 174.2 | -167.7 | -145.7 | 0.8 | 107.1 | V9 | R7-V9 HydrophobicContact CB-CG2 4.02Å; R7-V9 PolarHBondContact O-N 2.74Å | ||
| 8 | N | 73.5 | Confident | 74.8 | Confident | 154 Ų | 154 | 151.1 Ų | 151.1 | 82% | 0.824 | 74% | 0.74 | S | S | * | * | trans | -65.9 | 55.8 | 166.7 | -65.8 | 79 | 0 | 0 | 0 | 109.6 | T10 | N8-T10 PolarHBondContact O-N 3.19Š| ||
| 9 | V | 77.9 | Confident | 75.8 | Confident | 122 Ų | 122 | 150.6 Ų | 150.6 | 74% | 0.739 | 73% | 0.734 | S | S | * | * | trans | -83.8 | 105 | 176.6 | 176.7 | 0 | 0 | 0 | 0 | 105.9 | R7 | R7-V9 HydrophobicContact CB-CG2 4.02Å; R7-V9 PolarHBondContact O-N 2.74Å | ||
| 10 | T | 84.4 | Confident | 76.8 | Confident | 123 Ų | 123 | 146.9 Ų | 146.9 | 76% | 0.755 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 133.8 | 167.5 | 52.4 | 0 | 0 | 0 | 0 | 108.1 | N8 | N8-T10 PolarHBondContact O-N 3.19Š|
| 11 | Y | 84.8 | Confident | 77.5 | Confident | 190 Ų | 190 | 146.4 Ų | 146.4 | 75% | 0.745 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -102.9 | 118.7 | 171.6 | 174.2 | -109.1 | 0 | 0 | 0 | 108.4 | K13 | Y11-K13 HydrophobicContact CE1-CB 4.06Š|
| 12 | V | 86.9 | Confident | 80.1 | Confident | 118 Ų | 118 | 139.4 Ų | 139.4 | 72% | 0.715 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -103 | 118.3 | 170.7 | -178.1 | 0 | 0 | 0 | 0 | 106.9 | P14 | V12-P14 WeakPolarHBondContact O-CD 3.07Š|
| 13 | K | 85.5 | Confident | 82.3 | Confident | 154 Ų | 154 | 137.2 Ų | 137.2 | 67% | 0.67 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 118.4 | 177.1 | -172.5 | 178.8 | 179.8 | -175.6 | 0 | 108.3 | Y11 | Y11-K13 HydrophobicContact CE1-CB 4.06Š|
| 14 | P | 90.7 | Very high | 84.2 | Confident | 92 Ų | 92 | 129.9 Ų | 129.9 | 60% | 0.597 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 160.5 | 178.4 | 29.4 | -34.7 | 0 | 0 | 0 | 110.9 | V12 | V12-P14 WeakPolarHBondContact O-CD 3.07Š|
| 15 | E | 91.2 | Very high | 85.9 | Confident | 187 Ų | 187 | 125.9 Ų | 125.9 | 87% | 0.874 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 146.8 | 170.2 | -67 | -171.3 | 167.3 | 0 | 0 | 111.1 | ||
| 16 | E | 90.6 | Very high | 87.6 | Confident | 96 Ų | 96 | 128.4 Ų | 128.4 | 45% | 0.449 | 61% | 0.614 | S | S | . | * | P | Polyproline II helix | trans | -67.9 | 129.6 | 179 | -63 | -165.7 | 161.7 | 0 | 0 | 110.3 | K24 | E16-K24 IonicContact OE1-NZ 3.99Å; E16-K24 PolarHBondContact OE1-NZ 2.75Å; E16-K24 IonicContact OE2-NZ 3.3Å; E16-K24 PolarHBondContact OE2-NZ 2.72Å |
| 17 | P | 94.5 | Very high | 89.2 | Confident | 77 Ų | 77 | 127.2 Ų | 127.2 | 50% | 0.5 | 61% | 0.606 | S | S | . | * | P | Polyproline II helix | trans | -63.5 | 148.5 | 179.8 | 26.5 | -35.2 | 0 | 0 | 0 | 111.4 | F19 L20 R21 | P17-F19 PolarHBondContact O-N 3.45Å; P17-F19 VanDerWaalsContact O-N 3.07Å; P17-L20 HydrophobicContact CG-CB 4.26Å; P17-L20 HydrophobicContact CG-CD1 3.79Å; P17-L20 HydrophobicContact CG-CG 3.96Å; P17-L20 PolarHBondContact O-N 3.34Å; P17-R21 PolarHBondContact O-N 3.3Å |
| 18 | K | 94.5 | Very high | 90.5 | Very high | 140 Ų | 140 | 118.5 Ų | 118.5 | 61% | 0.609 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -47.4 | -42.3 | -177.5 | -174.6 | -179.3 | 177.9 | -171.9 | 0 | 113.5 | R21 E22 | K18-R21 PolarHBondContact O-N 2.99Å; K18-E22 WeakPolarHBondContact CE-OE1 3.39Å; K18-E22 IonicContact NZ-OE1 3.66Å; K18-E22 WeakPolarHBondContact O-CG 3.32Å; K18-E22 PolarHBondContact O-N 3.1Å |
| 19 | F | 94.6 | Very high | 91.4 | Very high | 143 Ų | 143 | 116.5 Ų | 116.5 | 63% | 0.627 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -59.3 | -45.9 | 178.9 | 170.6 | -105.9 | 0 | 0 | 0 | 113.4 | P17 R21 E22 I23 | P17-F19 PolarHBondContact O-N 3.45Å; P17-F19 VanDerWaalsContact O-N 3.07Å; F19-R21 VanDerWaalsContact C-N 3.34Å; F19-E22 PolarHBondContact O-N 3.07Å; F19-I23 HydrophobicContact CD1-CD1 4.09Å; F19-I23 HydrophobicContact CD2-CD1 3.98Å; F19-I23 HydrophobicContact CE1-CD1 3.5Å; F19-I23 VanDerWaalsContact CE1-CD1 3.5Å; F19-I23 HydrophobicContact CE2-CD1 3.39Å; F19-I23 HydrophobicContact CE2-CG1 4.27Å; F19-I23 HydrophobicContact CG-CD1 4.32Å; F19-I23 HydrophobicContact CZ-CD1 3.13Å; F19-I23 HydrophobicContact CZ-CG1 4.4Å; F19-I23 WeakPolarHBondContact O-CG1 3.46Å; F19-I23 PolarHBondContact O-N 3.02Å; F19-I23 VanDerWaalsContact O-N 3.1Å |
| 20 | L | 94.1 | Very high | 91.9 | Very high | 76 Ų | 76 | 118.4 Ų | 118.4 | 40% | 0.398 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -68.1 | -38 | 179.6 | -73.1 | -179.4 | 0 | 0 | 0 | 111.3 | P17 I23 K24 | P17-L20 HydrophobicContact CG-CB 4.26Å; P17-L20 HydrophobicContact CG-CD1 3.79Å; P17-L20 HydrophobicContact CG-CG 3.96Å; P17-L20 PolarHBondContact O-N 3.34Å; L20-I23 PolarHBondContact O-N 3.29Å; L20-K24 WeakPolarHBondContact O-CB 3.36Å; L20-K24 VanDerWaalsContact O-CG 3.26Å; L20-K24 WeakPolarHBondContact O-CG 3.21Å; L20-K24 PolarHBondContact O-N 3.38Å |
| 21 | R | 93.1 | Very high | 91.9 | Very high | 136 Ų | 136 | 116.2 Ų | 116.2 | 51% | 0.513 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -59.7 | -50.1 | 175.5 | -177.9 | 175.8 | 61.1 | 172 | 0.4 | 111.3 | P17 K18 F19 I23 K24 E25 | P17-R21 PolarHBondContact O-N 3.3Å; K18-R21 PolarHBondContact O-N 2.99Å; F19-R21 VanDerWaalsContact C-N 3.34Å; R21-I23 VanDerWaalsContact C-N 3.33Å; R21-I23 PolarHBondContact O-N 2.93Å; R21-K24 PolarHBondContact O-N 2.97Å; R21-E25 VanDerWaalsContact CG-OE1 3.27Å; R21-E25 WeakPolarHBondContact CG-OE1 3.49Å; R21-E25 WeakPolarHBondContact O-CB 3.27Å; R21-E25 VanDerWaalsContact O-CG 3.32Å; R21-E25 WeakPolarHBondContact O-CG 3.49Å; R21-E25 PolarHBondContact O-N 3.26Å |
| 22 | E | 96 | Very high | 91.9 | Very high | 66 Ų | 66 | 111.4 Ų | 111.4 | 31% | 0.308 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -61.1 | -39.1 | 178.4 | -72.8 | -178.3 | -159.5 | 0 | 0 | 112.9 | K18 F19 R26 | K18-E22 WeakPolarHBondContact CE-OE1 3.39Å; K18-E22 IonicContact NZ-OE1 3.66Å; K18-E22 WeakPolarHBondContact O-CG 3.32Å; K18-E22 PolarHBondContact O-N 3.1Å; F19-E22 PolarHBondContact O-N 3.07Å; E22-R26 WeakPolarHBondContact O-CB 3.39Å; E22-R26 WeakPolarHBondContact O-CG 3.49Å; E22-R26 PolarHBondContact O-N 3.06Å; E22-R26 IonicContact OE2-NH2 3.62Å; E22-R26 PolarHBondContact OE2-NH2 3.39Å |
| 23 | I | 96.4 | Very high | 91.9 | Very high | 62 Ų | 62 | 110.4 Ų | 110.4 | 32% | 0.318 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -66.6 | -47.6 | 177.1 | -73.2 | 175.1 | 0 | 0 | 0 | 111 | F19 L20 R21 E25 R26 I27 | F19-I23 HydrophobicContact CD1-CD1 4.09Å; F19-I23 HydrophobicContact CD2-CD1 3.98Å; F19-I23 HydrophobicContact CE1-CD1 3.5Å; F19-I23 VanDerWaalsContact CE1-CD1 3.5Å; F19-I23 HydrophobicContact CE2-CD1 3.39Å; F19-I23 HydrophobicContact CE2-CG1 4.27Å; F19-I23 HydrophobicContact CG-CD1 4.32Å; F19-I23 HydrophobicContact CZ-CD1 3.13Å; F19-I23 HydrophobicContact CZ-CG1 4.4Å; F19-I23 WeakPolarHBondContact O-CG1 3.46Å; F19-I23 PolarHBondContact O-N 3.02Å; F19-I23 VanDerWaalsContact O-N 3.1Å; L20-I23 PolarHBondContact O-N 3.29Å; R21-I23 VanDerWaalsContact C-N 3.33Å; R21-I23 PolarHBondContact O-N 2.93Å; I23-E25 VanDerWaalsContact C-N 3.28Å; I23-E25 PolarHBondContact O-N 3.37Å; I23-R26 PolarHBondContact O-N 3.45Å; I23-I27 HydrophobicContact CG2-CD1 4.28Å; I23-I27 WeakPolarHBondContact O-CG1 3.26Å; I23-I27 PolarHBondContact O-N 3.18Å |
| 24 | K | 94.9 | Very high | 91.9 | Very high | 59 Ų | 59 | 107.5 Ų | 107.5 | 26% | 0.257 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -58.8 | -42.3 | 179.4 | -76.2 | 178.7 | 176.9 | -176.4 | 0 | 111.5 | E16 L20 R21 G28 Y29 | E16-K24 IonicContact OE1-NZ 3.99Å; E16-K24 PolarHBondContact OE1-NZ 2.75Å; E16-K24 IonicContact OE2-NZ 3.3Å; E16-K24 PolarHBondContact OE2-NZ 2.72Å; L20-K24 WeakPolarHBondContact O-CB 3.36Å; L20-K24 VanDerWaalsContact O-CG 3.26Å; L20-K24 WeakPolarHBondContact O-CG 3.21Å; L20-K24 PolarHBondContact O-N 3.38Å; R21-K24 PolarHBondContact O-N 2.97Å; K24-G28 PolarHBondContact O-N 3.49Å; K24-Y29 HydrophobicContact CD-CD1 3.95Å; K24-Y29 HydrophobicContact CG-CD1 3.92Å; K24-Y29 HydrophobicContact CG-CG 4.09Å; K24-Y29 PolarHBondContact O-N 3.02Å |
| 25 | E | 93.2 | Very high | 91.5 | Very high | 134 Ų | 134 | 107.8 Ų | 107.8 | 63% | 0.626 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.8 | -45.2 | 175.9 | -73.5 | 170.6 | -172.8 | 0 | 0 | 111.7 | R21 I23 I27 G28 | R21-E25 VanDerWaalsContact CG-OE1 3.27Å; R21-E25 WeakPolarHBondContact CG-OE1 3.49Å; R21-E25 WeakPolarHBondContact O-CB 3.27Å; R21-E25 VanDerWaalsContact O-CG 3.32Å; R21-E25 WeakPolarHBondContact O-CG 3.49Å; R21-E25 PolarHBondContact O-N 3.26Å; I23-E25 VanDerWaalsContact C-N 3.28Å; I23-E25 PolarHBondContact O-N 3.37Å; E25-I27 PolarHBondContact O-N 3.34Å; E25-G28 PolarHBondContact O-N 3.02Å |
| 26 | R | 95.3 | Very high | 91.1 | Very high | 195 Ų | 195 | 103 Ų | 103 | 74% | 0.736 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65 | -36.7 | 179.9 | -72.5 | 172.9 | -165.3 | -172.9 | 9.7 | 113.7 | E22 I23 | E22-R26 WeakPolarHBondContact O-CB 3.39Å; E22-R26 WeakPolarHBondContact O-CG 3.49Å; E22-R26 PolarHBondContact O-N 3.06Å; E22-R26 IonicContact OE2-NH2 3.62Å; E22-R26 PolarHBondContact OE2-NH2 3.39Å; I23-R26 PolarHBondContact O-N 3.45Å |
| 27 | I | 94.8 | Very high | 90.7 | Very high | 117 Ų | 117 | 101.9 Ų | 101.9 | 60% | 0.6 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -91.4 | -4 | -179.4 | 72.5 | -177.4 | 0 | 0 | 0 | 113.1 | I23 E25 Y29 | I23-I27 HydrophobicContact CG2-CD1 4.28Å; I23-I27 WeakPolarHBondContact O-CG1 3.26Å; I23-I27 PolarHBondContact O-N 3.18Å; E25-I27 PolarHBondContact O-N 3.34Å; I27-Y29 VanDerWaalsContact C-N 3.32Å; I27-Y29 HydrophobicContact CD1-CD2 4.49Å; I27-Y29 PolarHBondContact O-N 3.24Å |
| 28 | G | 94 | Very high | 89.9 | Confident | 48 Ų | 48 | 106.5 Ų | 106.5 | 50% | 0.495 | 54% | 0.537 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.3 | 36.6 | -174 | 0 | 0 | 0 | 0 | 0 | 113 | K24 E25 Q30 | K24-G28 PolarHBondContact O-N 3.49Å; E25-G28 PolarHBondContact O-N 3.02Å; G28-Q30 PolarHBondContact O-N 2.88Å |
| 29 | Y | 92.5 | Very high | 89.4 | Confident | 111 Ų | 111 | 109.1 Ų | 109.1 | 44% | 0.435 | 54% | 0.543 | S | S | . | . | P | Polyproline II helix | trans | -61.6 | 122.8 | -176.6 | -179.7 | -98.1 | 0 | 0 | 0 | 111.5 | K24 I27 P32 | K24-Y29 HydrophobicContact CD-CD1 3.95Å; K24-Y29 HydrophobicContact CG-CD1 3.92Å; K24-Y29 HydrophobicContact CG-CG 4.09Å; K24-Y29 PolarHBondContact O-N 3.02Å; I27-Y29 VanDerWaalsContact C-N 3.32Å; I27-Y29 HydrophobicContact CD1-CD2 4.49Å; I27-Y29 PolarHBondContact O-N 3.24Å; Y29-P32 WeakPolarHBondContact OH-CD 3.39Å |
| 30 | Q | 88.4 | Confident | 88.5 | Confident | 162 Ų | 162 | 106.8 Ų | 106.8 | 76% | 0.757 | 54% | 0.541 | S | S | * | . | P | Polyproline II helix | trans | -101.4 | 132.2 | 169.6 | -62.7 | -61.4 | -24.6 | 0 | 0 | 109.3 | G28 | G28-Q30 PolarHBondContact O-N 2.88Š|
| 31 | A | 84.9 | Confident | 87.4 | Confident | 77 Ų | 77 | 113.6 Ų | 113.6 | 64% | 0.636 | 56% | 0.563 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 142 | 176.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 32 | P | 84.5 | Confident | 86.4 | Confident | 90 Ų | 90 | 112.5 Ų | 112.5 | 58% | 0.584 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 152.1 | 178.7 | 26.6 | -35.2 | 0 | 0 | 0 | 110.7 | Y29 D34 | Y29-P32 WeakPolarHBondContact OH-CD 3.39Å; P32-D34 PolarHBondContact O-N 3.25Å |
| 33 | P | 85.2 | Confident | 85.1 | Confident | 97 Ų | 97 | 117.2 Ų | 117.2 | 63% | 0.63 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 126.5 | 176.8 | 24.9 | -33.4 | 0 | 0 | 0 | 109.8 | T37 | P33-T37 HydrophobicContact CB-CG2 3.77Š|
| 34 | D | 85.5 | Confident | 83.8 | Confident | 93 Ų | 93 | 123 Ų | 123 | 50% | 0.497 | 62% | 0.624 | S | S | . | * | P | Polyproline II helix | trans | -83.5 | 173 | 175 | -171.4 | 25.8 | 0 | 0 | 0 | 110 | P32 N36 T37 | P32-D34 PolarHBondContact O-N 3.25Å; D34-N36 PolarHBondContact O-N 3.38Å; D34-N36 VanDerWaalsContact O-N 3.15Å; D34-T37 PolarHBondContact N-OG1 3.05Å; D34-T37 VanDerWaalsContact O-CB 3.3Å; D34-T37 WeakPolarHBondContact O-CB 3.33Å; D34-T37 PolarHBondContact O-N 2.94Å; D34-T37 PolarHBondContact O-OG1 2.95Å |
| 35 | V | 82.7 | Confident | 82.4 | Confident | 98 Ų | 98 | 124.6 Ų | 124.6 | 59% | 0.594 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -32.4 | 176.3 | -165.4 | 0 | 0 | 0 | 0 | 111.3 | K38 | V35-K38 PolarHBondContact O-N 2.92Š|
| 36 | N | 83.7 | Confident | 81.1 | Confident | 87 Ų | 87 | 121.7 Ų | 121.7 | 47% | 0.465 | 64% | 0.638 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.9 | -27.8 | 176 | -65.6 | -51.3 | 0 | 0 | 0 | 113.5 | D34 K38 R39 | D34-N36 PolarHBondContact O-N 3.38Å; D34-N36 VanDerWaalsContact O-N 3.15Å; N36-K38 PolarHBondContact O-N 2.85Å; N36-R39 WeakPolarHBondContact O-CB 3.3Å; N36-R39 PolarHBondContact O-N 3.26Å; N36-R39 PolarHBondContact OD1-NH1 3.44Å |
| 37 | T | 81 | Confident | 79.7 | Confident | 71 Ų | 71 | 119.3 Ų | 119.3 | 44% | 0.436 | 64% | 0.64 | S | S | . | * | G | 310 helix | trans | -64 | -25.6 | 174.7 | -46.9 | 0 | 0 | 0 | 0 | 111.3 | P33 D34 R39 T40 | P33-T37 HydrophobicContact CB-CG2 3.77Å; D34-T37 PolarHBondContact N-OG1 3.05Å; D34-T37 VanDerWaalsContact O-CB 3.3Å; D34-T37 WeakPolarHBondContact O-CB 3.33Å; D34-T37 PolarHBondContact O-N 2.94Å; D34-T37 PolarHBondContact O-OG1 2.95Å; T37-R39 PolarHBondContact O-N 3.15Å; T37-T40 PolarHBondContact O-OG1 3.43Å |
| 38 | K | 79.3 | Confident | 78.4 | Confident | 174 Ų | 174 | 119.2 Ų | 119.2 | 76% | 0.757 | 64% | 0.64 | S | S | * | * | G | 310 helix | trans | -75.3 | -14.1 | 173.5 | -57.2 | -177.9 | -179.3 | -178.5 | 0 | 113.6 | V35 N36 | V35-K38 PolarHBondContact O-N 2.92Å; N36-K38 PolarHBondContact O-N 2.85Å |
| 39 | R | 82.6 | Confident | 77 | Confident | 196 Ų | 196 | 120.5 Ų | 120.5 | 74% | 0.74 | 65% | 0.646 | S | S | * | * | G | 310 helix | trans | -88.1 | -12.1 | 179 | -64.8 | -179.4 | 157.4 | 144.7 | -6.8 | 112.7 | N36 T37 | N36-R39 WeakPolarHBondContact O-CB 3.3Å; N36-R39 PolarHBondContact O-N 3.26Å; N36-R39 PolarHBondContact OD1-NH1 3.44Å; T37-R39 PolarHBondContact O-N 3.15Å |
| 40 | T | 77.2 | Confident | 75.9 | Confident | 94 Ų | 94 | 122.4 Ų | 122.4 | 58% | 0.577 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -69.9 | 160.5 | 173.1 | 61.2 | 0 | 0 | 0 | 0 | 109.9 | T37 | T37-T40 PolarHBondContact O-OG1 3.43Š|
| 41 | Y | 71.1 | Confident | 75.3 | Confident | 218 Ų | 218 | 119.7 Ų | 119.7 | 86% | 0.855 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 150 | 176 | -75.9 | -85.9 | 0 | 0 | 0 | 111.5 | I43 | Y41-I43 PolarHBondContact O-N 2.61Š|
| 42 | P | 71.8 | Confident | 74.8 | Confident | 114 Ų | 114 | 122.7 Ų | 122.7 | 74% | 0.74 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -47.1 | 135.7 | 169.7 | -21.8 | 31 | 0 | 0 | 0 | 109 | E44 | P42-E44 PolarHBondContact O-N 2.87Š|
| 43 | I | 68.5 | Low | 74.6 | Confident | 164 Ų | 164 | 124.9 Ų | 124.9 | 84% | 0.841 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 127.8 | 164.8 | -58.5 | 162.7 | 0 | 0 | 0 | 104.9 | Y41 S45 | Y41-I43 PolarHBondContact O-N 2.61Å; I43-S45 PolarHBondContact O-N 3.19Å |
| 44 | E | 69.1 | Low | 74.3 | Confident | 183 Ų | 183 | 126.7 Ų | 126.7 | 86% | 0.855 | 66% | 0.661 | S | S | * | * | trans | -46 | 113.1 | 170.8 | -76.7 | 174.5 | 178.1 | 0 | 0 | 106 | P42 S46 | P42-E44 PolarHBondContact O-N 2.87Å; E44-S46 PolarHBondContact O-N 3.32Å | ||
| 45 | S | 65.5 | Low | 74.2 | Confident | 94 Ų | 94 | 127.7 Ų | 127.7 | 66% | 0.657 | 67% | 0.666 | S | S | * | * | trans | -54 | 117 | 176.8 | 45 | 0 | 0 | 0 | 0 | 105.2 | I43 D47 | I43-S45 PolarHBondContact O-N 3.19Å; S45-D47 PolarHBondContact O-N 3.12Å; S45-D47 VanDerWaalsContact O-N 3.17Å | ||
| 46 | S | 66.3 | Low | 74.4 | Confident | 72 Ų | 72 | 128.8 Ų | 128.8 | 50% | 0.503 | 67% | 0.665 | S | S | . | * | trans | -54.1 | 127.2 | 173.1 | 52.4 | 0 | 0 | 0 | 0 | 107 | E44 D48 A49 | E44-S46 PolarHBondContact O-N 3.32Å; S46-D48 PolarHBondContact O-N 2.88Å; S46-A49 WeakPolarHBondContact O-CB 3.04Å; S46-A49 PolarHBondContact O-N 2.74Å | ||
| 47 | D | 66 | Low | 74.4 | Confident | 145 Ų | 145 | 127.1 Ų | 127.1 | 78% | 0.775 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -53.3 | -16.8 | 175.8 | -65 | -26.8 | 0 | 0 | 0 | 111.9 | S45 A49 D50 | S45-D47 PolarHBondContact O-N 3.12Å; S45-D47 VanDerWaalsContact O-N 3.17Å; D47-A49 PolarHBondContact O-N 3.18Å; D47-D50 PolarHBondContact O-N 2.91Å |
| 48 | D | 65.7 | Low | 74.6 | Confident | 115 Ų | 115 | 127.9 Ų | 127.9 | 62% | 0.615 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -61.2 | -15.2 | 171.6 | -60.2 | -36.6 | 0 | 0 | 0 | 114.8 | S46 D50 I51 | S46-D48 PolarHBondContact O-N 2.88Å; D48-D50 PolarHBondContact O-N 3.17Å; D48-I51 HydrophobicContact CB-CD1 4.25Å; D48-I51 PolarHBondContact O-N 2.93Å |
| 49 | A | 65.8 | Low | 75 | Confident | 75 Ų | 75 | 125.7 Ų | 125.7 | 62% | 0.62 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -66.5 | -25.4 | 180 | 0 | 0 | 0 | 0 | 0 | 113.2 | S46 D47 | S46-A49 WeakPolarHBondContact O-CB 3.04Å; S46-A49 PolarHBondContact O-N 2.74Å; D47-A49 PolarHBondContact O-N 3.18Å |
| 50 | D | 69.9 | Low | 75.2 | Confident | 151 Ų | 151 | 119.5 Ų | 119.5 | 81% | 0.807 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -95.2 | 2 | -177.9 | -63.6 | -25.2 | 0 | 0 | 0 | 112.8 | D47 D48 E52 | D47-D50 PolarHBondContact O-N 2.91Å; D48-D50 PolarHBondContact O-N 3.17Å; D50-E52 PolarHBondContact O-N 3.37Å; D50-E52 VanDerWaalsContact O-N 3.17Å |
| 51 | I | 74.2 | Confident | 75.8 | Confident | 105 Ų | 105 | 119.8 Ų | 119.8 | 54% | 0.538 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -77.1 | 105.8 | 177 | -57.8 | 176.6 | 0 | 0 | 0 | 108.7 | D48 R53 | D48-I51 HydrophobicContact CB-CD1 4.25Å; D48-I51 PolarHBondContact O-N 2.93Å; I51-R53 PolarHBondContact O-N 3.36Å |
| 52 | E | 74.3 | Confident | 76.6 | Confident | 141 Ų | 141 | 113 Ų | 113 | 66% | 0.659 | 64% | 0.64 | S | S | * | * | trans | -53.9 | 115.9 | 172.6 | -79.3 | -157.4 | 179 | 0 | 0 | 109.9 | D50 R77 | D50-E52 PolarHBondContact O-N 3.37Å; D50-E52 VanDerWaalsContact O-N 3.17Å; E52-R77 IonicContact OE1-NH2 3.62Å; E52-R77 IonicContact OE2-NH2 3.8Å | ||
| 53 | R | 81 | Confident | 77.3 | Confident | 136 Ų | 136 | 114.7 Ų | 114.7 | 51% | 0.513 | 64% | 0.642 | S | S | . | * | trans | -80.6 | 136.3 | 179.7 | -49.9 | -170.4 | -68.1 | 144.8 | 3.8 | 109.5 | I51 D55 E56 | I51-R53 PolarHBondContact O-N 3.36Å; R53-D55 WeakPolarHBondContact CB-OD1 3.45Å; R53-D55 IonicContact CZ-OD2 3.53Å; R53-D55 IonicContact NH1-OD2 2.61Å; R53-D55 IonicContact NH2-OD2 3.05Å; R53-D55 PolarHBondContact O-N 3.48Å; R53-D55 VanDerWaalsContact O-N 3.12Å; R53-E56 HydrophobicContact CB-CG 4.27Å; R53-E56 IonicContact CZ-OE1 2.75Å; R53-E56 IonicContact NE-OE1 2.74Å; R53-E56 PolarHBondContact NE-OE1 3.17Å; R53-E56 IonicContact NH2-OE1 2.72Å; R53-E56 PolarHBondContact NH2-OE1 2.97Å; R53-E56 WeakPolarHBondContact O-CB 3.49Å; R53-E56 PolarHBondContact O-N 3.04Å | ||
| 54 | T | 79.8 | Confident | 78.3 | Confident | 135 Ų | 135 | 114.2 Ų | 114.2 | 83% | 0.828 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -62.2 | -24.3 | -175.8 | 57 | 0 | 0 | 0 | 0 | 113.7 | E56 A57 | T54-E56 VanDerWaalsContact C-N 3.28Å; T54-A57 WeakPolarHBondContact O-CB 3.48Å; T54-A57 PolarHBondContact O-N 3.49Å |
| 55 | D | 83.2 | Confident | 79.1 | Confident | 113 Ų | 113 | 112.1 Ų | 112.1 | 60% | 0.604 | 64% | 0.636 | S | S | * | * | G | 310 helix | trans | -73.2 | -18.1 | 174.7 | 57.4 | -54.6 | 0 | 0 | 0 | 113.5 | R53 | R53-D55 WeakPolarHBondContact CB-OD1 3.45Å; R53-D55 IonicContact CZ-OD2 3.53Å; R53-D55 IonicContact NH1-OD2 2.61Å; R53-D55 IonicContact NH2-OD2 3.05Å; R53-D55 PolarHBondContact O-N 3.48Å; R53-D55 VanDerWaalsContact O-N 3.12Å |
| 56 | E | 85.5 | Confident | 80.2 | Confident | 122 Ų | 122 | 111.4 Ų | 111.4 | 57% | 0.57 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -92.9 | -4.7 | 177 | -61.6 | -177.2 | -168.6 | 0 | 0 | 112.9 | R53 T54 | R53-E56 HydrophobicContact CB-CG 4.27Å; R53-E56 IonicContact CZ-OE1 2.75Å; R53-E56 IonicContact NE-OE1 2.74Å; R53-E56 PolarHBondContact NE-OE1 3.17Å; R53-E56 IonicContact NH2-OE1 2.72Å; R53-E56 PolarHBondContact NH2-OE1 2.97Å; R53-E56 WeakPolarHBondContact O-CB 3.49Å; R53-E56 PolarHBondContact O-N 3.04Å; T54-E56 VanDerWaalsContact C-N 3.28Å |
| 57 | A | 83.9 | Confident | 81.3 | Confident | 52 Ų | 52 | 111.4 Ų | 111.4 | 43% | 0.43 | 64% | 0.638 | S | S | . | * | S | Bend | trans | -64.7 | 140.8 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | T54 | T54-A57 WeakPolarHBondContact O-CB 3.48Å; T54-A57 PolarHBondContact O-N 3.49Å |
| 58 | P | 85.6 | Confident | 82.2 | Confident | 87 Ų | 87 | 109 Ų | 109 | 57% | 0.565 | 62% | 0.624 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 139.9 | -178.6 | 26.1 | -34.1 | 0 | 0 | 0 | 111.7 | V60 | P58-V60 PolarHBondContact O-N 3.46Š|
| 59 | T | 87.8 | Confident | 83.2 | Confident | 127 Ų | 127 | 106.6 Ų | 106.6 | 78% | 0.779 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 123.1 | 172.7 | -59.3 | 0 | 0 | 0 | 0 | 110 | V61 | T59-V61 HydrophobicContact CG2-CG2 4.11Š|
| 60 | V | 86.4 | Confident | 84.2 | Confident | 67 Ų | 67 | 105.4 Ų | 105.4 | 41% | 0.406 | 60% | 0.604 | S | S | . | * | P | Polyproline II helix | trans | -94.1 | 122.7 | 177.2 | -177.9 | 0 | 0 | 0 | 0 | 109.4 | P58 A70 A73 | P58-V60 PolarHBondContact O-N 3.46Å; V60-A70 HydrophobicContact CB-CB 4.22Å; V60-A73 HydrophobicContact CG1-CB 4.34Å; V60-A73 HydrophobicContact CG2-CB 4.21Å |
| 61 | V | 89.5 | Confident | 85 | Confident | 99 Ų | 99 | 106 Ų | 106 | 60% | 0.6 | 60% | 0.602 | S | S | * | * | trans | -122.3 | 125.2 | 178.4 | -177.7 | 0 | 0 | 0 | 0 | 108.8 | T59 L63 | T59-V61 HydrophobicContact CG2-CG2 4.11Å; V61-L63 HydrophobicContact CG1-CD2 3.87Å; V61-L63 HydrophobicContact CG1-CG 4.24Å | ||
| 62 | S | 87.9 | Confident | 85.7 | Confident | 75 Ų | 75 | 105.8 Ų | 105.8 | 52% | 0.524 | 60% | 0.599 | S | S | . | * | trans | -97 | 128.1 | 172.4 | 53.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 63 | L | 87.8 | Confident | 86.4 | Confident | 150 Ų | 150 | 100 Ų | 100 | 79% | 0.785 | 58% | 0.575 | S | S | * | * | trans | -116.4 | -33.7 | -178.3 | -63.6 | 177.6 | 0 | 0 | 0 | 111.8 | V61 D67 | V61-L63 HydrophobicContact CG1-CD2 3.87Å; V61-L63 HydrophobicContact CG1-CG 4.24Å; L63-D67 PolarHBondContact N-OD2 2.87Å | ||
| 64 | K | 89.8 | Confident | 86.7 | Confident | 154 Ų | 154 | 100.4 Ų | 100.4 | 67% | 0.67 | 58% | 0.58 | S | S | * | * | S | Bend | trans | -122.5 | 151.8 | -173.7 | -65.4 | 179.5 | -176.4 | 174.8 | 0 | 111.4 | G66 D67 | K64-G66 PolarHBondContact O-N 3.2Å; K64-D67 PolarHBondContact N-OD2 2.88Å; K64-D67 WeakPolarHBondContact O-CB 3.28Å; K64-D67 PolarHBondContact O-N 3.18Å; K64-D67 VanDerWaalsContact O-N 3.13Å |
| 65 | P | 85.6 | Confident | 87.1 | Confident | 140 Ų | 140 | 99.9 Ų | 99.9 | 91% | 0.909 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | 124 | 168 | 26.9 | -32.8 | 0 | 0 | 0 | 109.4 | ||
| 66 | G | 87.4 | Confident | 87.4 | Confident | 79 Ų | 79 | 96.8 Ų | 96.8 | 81% | 0.814 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 110.9 | -14.6 | -174 | 0 | 0 | 0 | 0 | 0 | 114.2 | K64 | K64-G66 PolarHBondContact O-N 3.2Š|
| 67 | D | 89.7 | Confident | 87.4 | Confident | 71 Ų | 71 | 96.8 Ų | 96.8 | 38% | 0.38 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -69.1 | 143.8 | 171.7 | -65.5 | -17.4 | 0 | 0 | 0 | 110.5 | L63 K64 | L63-D67 PolarHBondContact N-OD2 2.87Å; K64-D67 PolarHBondContact N-OD2 2.88Å; K64-D67 WeakPolarHBondContact O-CB 3.28Å; K64-D67 PolarHBondContact O-N 3.18Å; K64-D67 VanDerWaalsContact O-N 3.13Å |
| 68 | L | 85.3 | Confident | 87.6 | Confident | 94 Ų | 94 | 99 Ų | 99 | 49% | 0.492 | 56% | 0.556 | S | S | . | * | P | Polyproline II helix | trans | -69.4 | 139.3 | 177.8 | -63 | 178.5 | 0 | 0 | 0 | 111 | E72 A73 | L68-E72 HydrophobicContact CB-CB 4.36Å; L68-E72 HydrophobicContact CD2-CB 4.19Å; L68-A73 HydrophobicContact CB-CB 4.38Å |
| 69 | T | 87.4 | Confident | 87.8 | Confident | 66 Ų | 66 | 101.4 Ų | 101.4 | 41% | 0.405 | 55% | 0.554 | S | S | . | * | P | Polyproline II helix | trans | -73 | 162.3 | 168 | 59.7 | 0 | 0 | 0 | 0 | 110.9 | E71 E72 A73 | T69-E71 PolarHBondContact O-N 3.04Å; T69-E72 PolarHBondContact N-OE2 3.02Å; T69-E72 PolarHBondContact O-N 3.17Å; T69-E72 VanDerWaalsContact OG1-CD 3.27Å; T69-E72 WeakPolarHBondContact OG1-CG 3.33Å; T69-E72 PolarHBondContact OG1-OE2 3.32Å; T69-A73 WeakPolarHBondContact O-CB 3.39Å; T69-A73 PolarHBondContact O-N 3.45Å |
| 70 | A | 86.1 | Confident | 87.9 | Confident | 49 Ų | 49 | 101.2 Ų | 101.2 | 41% | 0.405 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -57 | -33.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | V60 K74 | V60-A70 HydrophobicContact CB-CB 4.22Å; A70-K74 VanDerWaalsContact O-CG 3.28Å; A70-K74 WeakPolarHBondContact O-CG 3.45Å; A70-K74 PolarHBondContact O-N 3.37Å; A70-K74 VanDerWaalsContact O-N 3.17Å |
| 71 | E | 87.1 | Confident | 87.9 | Confident | 164 Ų | 164 | 103.4 Ų | 103.4 | 77% | 0.766 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -73 | -44 | 178.2 | -62.8 | -172.7 | 170.1 | 0 | 0 | 112.2 | T69 K74 K75 | T69-E71 PolarHBondContact O-N 3.04Å; E71-K74 PolarHBondContact O-N 2.91Å; E71-K75 PolarHBondContact O-N 3.35Å |
| 72 | E | 89.3 | Confident | 87.7 | Confident | 100 Ų | 100 | 104.8 Ų | 104.8 | 47% | 0.467 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.9 | -39.7 | 177.3 | -67.9 | 167.9 | 148.7 | 0 | 0 | 111.5 | L68 T69 K75 A76 | L68-E72 HydrophobicContact CB-CB 4.36Å; L68-E72 HydrophobicContact CD2-CB 4.19Å; T69-E72 PolarHBondContact N-OE2 3.02Å; T69-E72 PolarHBondContact O-N 3.17Å; T69-E72 VanDerWaalsContact OG1-CD 3.27Å; T69-E72 WeakPolarHBondContact OG1-CG 3.33Å; T69-E72 PolarHBondContact OG1-OE2 3.32Å; E72-K75 PolarHBondContact O-N 2.98Å; E72-A76 WeakPolarHBondContact O-CB 3.36Å; E72-A76 PolarHBondContact O-N 3.25Å |
| 73 | A | 87.8 | Confident | 87.6 | Confident | 19 Ų | 19 | 107.5 Ų | 107.5 | 16% | 0.157 | 55% | 0.552 | C | S | . | * | H | α-helix | trans | -61.9 | -44.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | V60 L68 T69 A76 R77 | V60-A73 HydrophobicContact CG1-CB 4.34Å; V60-A73 HydrophobicContact CG2-CB 4.21Å; L68-A73 HydrophobicContact CB-CB 4.38Å; T69-A73 WeakPolarHBondContact O-CB 3.39Å; T69-A73 PolarHBondContact O-N 3.45Å; A73-A76 PolarHBondContact O-N 3.03Å; A73-R77 WeakPolarHBondContact O-CG 3.42Å; A73-R77 PolarHBondContact O-N 3.27Å |
| 74 | K | 87.6 | Confident | 87.4 | Confident | 145 Ų | 145 | 105.6 Ų | 105.6 | 63% | 0.63 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -60.9 | -45.1 | 174.9 | -76.4 | 176.4 | -178.8 | -173.6 | 0 | 111.8 | A70 E71 A76 R77 L78 | A70-K74 VanDerWaalsContact O-CG 3.28Å; A70-K74 WeakPolarHBondContact O-CG 3.45Å; A70-K74 PolarHBondContact O-N 3.37Å; A70-K74 VanDerWaalsContact O-N 3.17Å; E71-K74 PolarHBondContact O-N 2.91Å; K74-A76 VanDerWaalsContact C-N 3.33Å; K74-A76 PolarHBondContact O-N 3.33Å; K74-R77 PolarHBondContact O-N 2.98Å; K74-L78 PolarHBondContact O-N 3.09Å |
| 75 | K | 89.3 | Confident | 86.9 | Confident | 124 Ų | 124 | 103 Ų | 103 | 54% | 0.539 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.9 | -38.2 | 177.9 | -169.9 | 178.5 | -173.6 | 178.7 | 0 | 112.4 | E71 E72 R79 | E71-K75 PolarHBondContact O-N 3.35Å; E72-K75 PolarHBondContact O-N 2.98Å; K75-R79 VanDerWaalsContact CE-NH2 3.33Å; K75-R79 WeakPolarHBondContact O-CG 3.5Å; K75-R79 PolarHBondContact O-N 3.17Å |
| 76 | A | 88.3 | Confident | 86.6 | Confident | 49 Ų | 49 | 100.1 Ų | 100.1 | 41% | 0.405 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.1 | -39 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | E72 A73 K74 K80 | E72-A76 WeakPolarHBondContact O-CB 3.36Å; E72-A76 PolarHBondContact O-N 3.25Å; A73-A76 PolarHBondContact O-N 3.03Å; K74-A76 VanDerWaalsContact C-N 3.33Å; K74-A76 PolarHBondContact O-N 3.33Å; A76-K80 WeakPolarHBondContact O-CB 3.37Å; A76-K80 PolarHBondContact O-N 3.43Å; A76-K80 VanDerWaalsContact O-N 3.17Å |
| 77 | R | 86.9 | Confident | 86.1 | Confident | 122 Ų | 122 | 101.2 Ų | 101.2 | 46% | 0.46 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.6 | -50.3 | 174.5 | -72.9 | -172.7 | 73.3 | -167 | -3.4 | 111.9 | E52 A73 K74 R79 K80 E81 | E52-R77 IonicContact OE1-NH2 3.62Å; E52-R77 IonicContact OE2-NH2 3.8Å; A73-R77 WeakPolarHBondContact O-CG 3.42Å; A73-R77 PolarHBondContact O-N 3.27Å; K74-R77 PolarHBondContact O-N 2.98Å; R77-R79 VanDerWaalsContact C-N 3.33Å; R77-R79 PolarHBondContact O-N 3.13Å; R77-K80 PolarHBondContact O-N 2.83Å; R77-K80 VanDerWaalsContact O-N 3.09Å; R77-E81 PolarHBondContact O-N 2.87Å |
| 78 | L | 87.1 | Confident | 85.4 | Confident | 99 Ų | 99 | 101.6 Ų | 101.6 | 52% | 0.518 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -54.7 | -46.1 | 178 | -93.7 | 147.3 | 0 | 0 | 0 | 112.5 | K74 K80 E81 E82 | K74-L78 PolarHBondContact O-N 3.09Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.19Å; L78-E81 PolarHBondContact O-N 3.34Å; L78-E82 WeakPolarHBondContact O-CG 3.48Å; L78-E82 PolarHBondContact O-N 3.48Å |
| 79 | R | 90.8 | Very high | 84.6 | Confident | 136 Ų | 136 | 106.3 Ų | 106.3 | 51% | 0.513 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.3 | -40.6 | 177.5 | -73.2 | 172.3 | 174.1 | -177.4 | -7.3 | 112.8 | K75 R77 E82 E83 | K75-R79 VanDerWaalsContact CE-NH2 3.33Å; K75-R79 WeakPolarHBondContact O-CG 3.5Å; K75-R79 PolarHBondContact O-N 3.17Å; R77-R79 VanDerWaalsContact C-N 3.33Å; R77-R79 PolarHBondContact O-N 3.13Å; R79-E82 PolarHBondContact O-N 3.02Å; R79-E83 WeakPolarHBondContact O-CG 3.36Å; R79-E83 PolarHBondContact O-N 3.2Å |
| 80 | K | 88.6 | Confident | 83.7 | Confident | 123 Ų | 123 | 106.9 Ų | 106.9 | 54% | 0.535 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.8 | -40.5 | -179.7 | -176.7 | 176 | 170.2 | -176.9 | 0 | 111.3 | A76 R77 L78 E83 E84 | A76-K80 WeakPolarHBondContact O-CB 3.37Å; A76-K80 PolarHBondContact O-N 3.43Å; A76-K80 VanDerWaalsContact O-N 3.17Å; R77-K80 PolarHBondContact O-N 2.83Å; R77-K80 VanDerWaalsContact O-N 3.09Å; L78-K80 VanDerWaalsContact C-N 3.33Å; L78-K80 PolarHBondContact O-N 3.19Å; K80-E83 PolarHBondContact O-N 2.91Å; K80-E84 WeakPolarHBondContact CE-OE1 3.49Å; K80-E84 IonicContact NZ-OE1 3.77Å; K80-E84 WeakPolarHBondContact O-CB 2.88Å; K80-E84 WeakPolarHBondContact O-CG 3.34Å; K80-E84 PolarHBondContact O-N 3.12Å |
| 81 | E | 86.6 | Confident | 82 | Confident | 114 Ų | 114 | 113.7 Ų | 113.7 | 53% | 0.533 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.9 | -45.5 | 175.9 | -169.5 | 173.3 | -175.1 | 0 | 0 | 111.3 | R77 L78 E83 E84 D85 | R77-E81 PolarHBondContact O-N 2.87Å; L78-E81 PolarHBondContact O-N 3.34Å; E81-E83 VanDerWaalsContact C-N 3.3Å; E81-E83 PolarHBondContact O-N 3.36Å; E81-E84 PolarHBondContact O-N 3.03Å; E81-D85 WeakPolarHBondContact O-CB 3.33Å; E81-D85 PolarHBondContact O-N 3.35Å |
| 82 | E | 86.2 | Confident | 81.8 | Confident | 127 Ų | 127 | 111.2 Ų | 111.2 | 59% | 0.593 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -58.6 | -39.5 | 174 | -71.9 | 172.7 | -176.3 | 0 | 0 | 112.6 | L78 R79 S86 | L78-E82 WeakPolarHBondContact O-CG 3.48Å; L78-E82 PolarHBondContact O-N 3.48Å; R79-E82 PolarHBondContact O-N 3.02Å; E82-S86 WeakPolarHBondContact O-CB 3.42Å; E82-S86 PolarHBondContact O-N 3.27Å; E82-S86 VanDerWaalsContact O-N 3.12Å |
| 83 | E | 86.2 | Confident | 81.4 | Confident | 132 Ų | 132 | 111.7 Ų | 111.7 | 62% | 0.617 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -68.2 | -42.8 | 176.5 | -75.2 | 173.4 | -166.2 | 0 | 0 | 111.9 | R79 K80 E81 S86 N87 | R79-E83 WeakPolarHBondContact O-CG 3.36Å; R79-E83 PolarHBondContact O-N 3.2Å; K80-E83 PolarHBondContact O-N 2.91Å; E81-E83 VanDerWaalsContact C-N 3.3Å; E81-E83 PolarHBondContact O-N 3.36Å; E83-S86 PolarHBondContact O-N 3.4Å; E83-S86 PolarHBondContact O-OG 3.46Å; E83-N87 PolarHBondContact O-N 3.44Å; E83-N87 VanDerWaalsContact O-N 3.15Å |
| 84 | E | 82.4 | Confident | 81 | Confident | 111 Ų | 111 | 116.9 Ų | 116.9 | 52% | 0.519 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64.6 | -43.1 | 177.9 | -75 | 176.7 | -179.3 | 0 | 0 | 111.9 | K80 E81 S86 N87 S88 | K80-E84 WeakPolarHBondContact CE-OE1 3.49Å; K80-E84 IonicContact NZ-OE1 3.77Å; K80-E84 WeakPolarHBondContact O-CB 2.88Å; K80-E84 WeakPolarHBondContact O-CG 3.34Å; K80-E84 PolarHBondContact O-N 3.12Å; E81-E84 PolarHBondContact O-N 3.03Å; E84-S86 VanDerWaalsContact C-N 3.33Å; E84-S86 PolarHBondContact O-N 2.97Å; E84-N87 PolarHBondContact O-N 3.36Å; E84-S88 PolarHBondContact O-N 3.46Å; E84-S88 PolarHBondContact O-OG 3.33Å |
| 85 | D | 79.4 | Confident | 80.7 | Confident | 99 Ų | 99 | 115.2 Ų | 115.2 | 53% | 0.529 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -64.6 | -36.5 | 175.8 | -78.9 | -17.3 | 0 | 0 | 0 | 112.7 | E81 N87 S88 K89 | E81-D85 WeakPolarHBondContact O-CB 3.33Å; E81-D85 PolarHBondContact O-N 3.35Å; D85-N87 VanDerWaalsContact C-N 3.33Å; D85-S88 PolarHBondContact O-OG 3.1Å; D85-S88 VanDerWaalsContact O-OG 3.1Å; D85-K89 WeakPolarHBondContact O-CB 3.49Å; D85-K89 PolarHBondContact O-N 2.94Å |
| 86 | S | 79.3 | Confident | 80.1 | Confident | 80 Ų | 80 | 114.7 Ų | 114.7 | 56% | 0.559 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -68.2 | -34.1 | 177 | 77.9 | 0 | 0 | 0 | 0 | 112.5 | E82 E83 E84 | E82-S86 WeakPolarHBondContact O-CB 3.42Å; E82-S86 PolarHBondContact O-N 3.27Å; E82-S86 VanDerWaalsContact O-N 3.12Å; E83-S86 PolarHBondContact O-N 3.4Å; E83-S86 PolarHBondContact O-OG 3.46Å; E84-S86 VanDerWaalsContact C-N 3.33Å; E84-S86 PolarHBondContact O-N 2.97Å |
| 87 | N | 76.8 | Confident | 79.6 | Confident | 101 Ų | 101 | 119.1 Ų | 119.1 | 54% | 0.54 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -82.3 | -35.1 | -177.5 | -165.9 | 9.6 | 0 | 0 | 0 | 112.3 | E83 E84 D85 K89 A90 N91 | E83-N87 PolarHBondContact O-N 3.44Å; E83-N87 VanDerWaalsContact O-N 3.15Å; E84-N87 PolarHBondContact O-N 3.36Å; D85-N87 VanDerWaalsContact C-N 3.33Å; N87-K89 VanDerWaalsContact C-N 3.29Å; N87-K89 PolarHBondContact O-N 3.32Å; N87-A90 PolarHBondContact O-N 3.31Å; N87-N91 PolarHBondContact O-ND2 2.76Å |
| 88 | S | 74.4 | Confident | 79.1 | Confident | 79 Ų | 79 | 118.9 Ų | 118.9 | 55% | 0.552 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -65.9 | -33.5 | 174.8 | 67.8 | 0 | 0 | 0 | 0 | 111.9 | E84 D85 A90 | E84-S88 PolarHBondContact O-N 3.46Å; E84-S88 PolarHBondContact O-OG 3.33Å; D85-S88 PolarHBondContact O-OG 3.1Å; D85-S88 VanDerWaalsContact O-OG 3.1Å; S88-A90 VanDerWaalsContact C-N 3.29Å; S88-A90 PolarHBondContact O-N 3.15Å |
| 89 | K | 69.6 | Low | 78.4 | Confident | 193 Ų | 193 | 120.4 Ų | 120.4 | 84% | 0.839 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -13.4 | 178.5 | -157.4 | 164.9 | -168.3 | 166 | 0 | 114.2 | D85 N87 | D85-K89 WeakPolarHBondContact O-CB 3.49Å; D85-K89 PolarHBondContact O-N 2.94Å; N87-K89 VanDerWaalsContact C-N 3.29Å; N87-K89 PolarHBondContact O-N 3.32Å |
| 90 | A | 67.5 | Low | 77.4 | Confident | 79 Ų | 79 | 119.1 Ų | 119.1 | 65% | 0.653 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | -13.6 | -179 | 0 | 0 | 0 | 0 | 0 | 114.2 | N87 S88 | N87-A90 PolarHBondContact O-N 3.31Å; S88-A90 VanDerWaalsContact C-N 3.29Å; S88-A90 PolarHBondContact O-N 3.15Å |
| 91 | N | 52.1 | Low | 76.4 | Confident | 191 Ų | 191 | 118.7 Ų | 118.7 | 100% | 1.021 | 63% | 0.632 | S | S | * | * | trans | -103.6 | 0 | -179.5 | -75.9 | -60.8 | 0 | 0 | 0 | 113.5 | N87 | N87-N91 PolarHBondContact O-ND2 2.76Š|
Retrieved 91 of 91 residues in 132.9 ms
(Link to these results)