| 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 | 57.7 | Low | 80.1 | Confident | 254 Ų | 254 | 105.6 Ų | 105.6 | 100% | 1.251 | 65% | 0.646 | S | S | * | * | 0 | 107.8 | 0 | -67.6 | -170.1 | 177.3 | 0 | 0 | 107.7 | |||||
| 2 | G | 64.2 | Low | 81.3 | Confident | 87 Ų | 87 | 111.1 Ų | 111.1 | 90% | 0.897 | 65% | 0.646 | S | S | * | * | trans | 175.9 | 70.8 | -173.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 3 | G | 62.7 | Low | 82.4 | Confident | 76 Ų | 76 | 104.3 Ų | 104.3 | 78% | 0.784 | 60% | 0.604 | S | S | * | * | trans | -138.8 | 74 | 175.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 4 | G | 78.9 | Confident | 83.2 | Confident | 69 Ų | 69 | 103 Ų | 103 | 71% | 0.711 | 60% | 0.601 | S | S | * | * | trans | -60.3 | 150.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | L6 | G4-L6 PolarHBondContact O-N 3.08Å; G4-L6 VanDerWaalsContact O-N 3.11Å | ||
| 5 | D | 84.2 | Confident | 83.9 | Confident | 74 Ų | 74 | 105.4 Ų | 105.4 | 40% | 0.396 | 60% | 0.604 | S | S | . | * | trans | -52.2 | 117.9 | -177 | -179.6 | 6.5 | 0 | 0 | 0 | 111.2 | N7 L8 | D5-N7 PolarHBondContact O-N 2.96Å; D5-N7 VanDerWaalsContact OD1-CB 3.29Å; D5-N7 WeakPolarHBondContact OD1-CB 3.3Å; D5-N7 PolarHBondContact OD1-N 3.41Å; D5-N7 PolarHBondContact OD1-ND2 3.34Å; D5-N7 VanDerWaalsContact OD1-ND2 3.07Å; D5-L8 HydrophobicContact CB-CD1 4.06Å; D5-L8 HydrophobicContact CB-CG 4.09Å; D5-L8 WeakPolarHBondContact O-CB 3.48Å; D5-L8 PolarHBondContact O-N 3.3Å; D5-L8 VanDerWaalsContact O-N 3.11Å | ||
| 6 | L | 85.9 | Confident | 84.6 | Confident | 110 Ų | 110 | 100.1 Ų | 100.1 | 58% | 0.576 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -59.5 | -26.9 | 179.9 | -175.9 | 64.6 | 0 | 0 | 0 | 111.5 | G4 L8 K9 | G4-L6 PolarHBondContact O-N 3.08Å; G4-L6 VanDerWaalsContact O-N 3.11Å; L6-L8 VanDerWaalsContact C-N 3.29Å; L6-L8 PolarHBondContact O-N 2.87Å; L6-K9 HydrophobicContact CD1-CD 4.39Å; L6-K9 PolarHBondContact O-N 3Å |
| 7 | N | 87.3 | Confident | 85.2 | Confident | 69 Ų | 69 | 103.4 Ų | 103.4 | 37% | 0.369 | 59% | 0.589 | S | S | . | * | G | 310 helix | trans | -67.6 | -29.6 | 179.4 | -63.8 | -47.5 | 0 | 0 | 0 | 112.4 | D5 K9 K10 H13 | D5-N7 PolarHBondContact O-N 2.96Å; D5-N7 VanDerWaalsContact OD1-CB 3.29Å; D5-N7 WeakPolarHBondContact OD1-CB 3.3Å; D5-N7 PolarHBondContact OD1-N 3.41Å; D5-N7 PolarHBondContact OD1-ND2 3.34Å; D5-N7 VanDerWaalsContact OD1-ND2 3.07Å; N7-K9 PolarHBondContact O-N 2.91Å; N7-K9 VanDerWaalsContact O-N 3.14Å; N7-K10 VanDerWaalsContact O-CB 3.28Å; N7-K10 WeakPolarHBondContact O-CB 3.25Å; N7-K10 WeakPolarHBondContact O-CG 3.4Å; N7-K10 PolarHBondContact O-N 3.45Å; N7-H13 WeakPolarHBondContact O-CB 3.44Å |
| 8 | L | 86.8 | Confident | 85.8 | Confident | 87 Ų | 87 | 106.1 Ų | 106.1 | 46% | 0.455 | 59% | 0.588 | S | S | . | * | G | 310 helix | trans | -66.1 | -16.2 | 176.8 | -65.4 | 174.4 | 0 | 0 | 0 | 113.3 | D5 L6 Q15 T16 | D5-L8 HydrophobicContact CB-CD1 4.06Å; D5-L8 HydrophobicContact CB-CG 4.09Å; D5-L8 WeakPolarHBondContact O-CB 3.48Å; D5-L8 PolarHBondContact O-N 3.3Å; D5-L8 VanDerWaalsContact O-N 3.11Å; L6-L8 VanDerWaalsContact C-N 3.29Å; L6-L8 PolarHBondContact O-N 2.87Å; L8-Q15 HydrophobicContact CD2-CB 4.42Å; L8-T16 WeakPolarHBondContact O-CG2 3.37Å |
| 9 | K | 87.9 | Confident | 86.3 | Confident | 173 Ų | 173 | 101.8 Ų | 101.8 | 75% | 0.752 | 56% | 0.564 | S | S | * | * | G | 310 helix | trans | -85.4 | -9.8 | 172.6 | -60.1 | -179.3 | -178 | 177.8 | 0 | 112.7 | L6 N7 | L6-K9 HydrophobicContact CD1-CD 4.39Å; L6-K9 PolarHBondContact O-N 3Å; N7-K9 PolarHBondContact O-N 2.91Å; N7-K9 VanDerWaalsContact O-N 3.14Å |
| 10 | K | 93.7 | Very high | 86.9 | Confident | 86 Ų | 86 | 100.7 Ų | 100.7 | 37% | 0.374 | 56% | 0.56 | S | S | . | * | S | Bend | trans | -82.2 | 130.4 | -179.6 | -55 | -62.4 | -179.3 | -178.6 | 0 | 109.7 | N7 W12 H13 | N7-K10 VanDerWaalsContact O-CB 3.28Å; N7-K10 WeakPolarHBondContact O-CB 3.25Å; N7-K10 WeakPolarHBondContact O-CG 3.4Å; N7-K10 PolarHBondContact O-N 3.45Å; K10-W12 HydrophobicContact CB-CD2 4.11Å; K10-W12 HydrophobicContact CB-CG 4.38Å; K10-W12 HydrophobicContact CB-CZ2 3.94Å; K10-W12 HydrophobicContact CG-CZ2 3.9Å; K10-W12 PolarHBondContact O-N 3.32Å; K10-W12 VanDerWaalsContact O-N 3.16Å; K10-H13 HydrophobicContact CB-CB 4.41Å; K10-H13 WeakPolarHBondContact O-CB 3.36Å; K10-H13 PolarHBondContact O-N 2.98Å; K10-H13 VanDerWaalsContact O-N 3.08Å |
| 11 | S | 91.9 | Very high | 87.4 | Confident | 77 Ų | 77 | 100.2 Ų | 100.2 | 54% | 0.538 | 55% | 0.553 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61 | -25.2 | -177.8 | 55.7 | 0 | 0 | 0 | 0 | 113.9 | R18 N19 | S11-R18 PolarHBondContact O-NH2 3.14Å; S11-N19 PolarHBondContact O-ND2 2.95Å |
| 12 | W | 94.1 | Very high | 89.3 | Confident | 171 Ų | 171 | 95.4 Ų | 95.4 | 65% | 0.648 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.8 | -9 | 179.5 | 55.2 | -104.3 | 0 | 0 | 0 | 113.7 | K10 | K10-W12 HydrophobicContact CB-CD2 4.11Å; K10-W12 HydrophobicContact CB-CG 4.38Å; K10-W12 HydrophobicContact CB-CZ2 3.94Å; K10-W12 HydrophobicContact CG-CZ2 3.9Å; K10-W12 PolarHBondContact O-N 3.32Å; K10-W12 VanDerWaalsContact O-N 3.16Å |
| 13 | H | 95.4 | Very high | 90.9 | Very high | 23 Ų | 23 | 95.1 Ų | 95.1 | 11% | 0.106 | 51% | 0.506 | C | S | . | . | trans | -67.6 | 126.4 | -173.9 | -170.8 | -90 | 0 | 0 | 0 | 111.1 | N7 K10 Q15 T16 N19 | N7-H13 WeakPolarHBondContact O-CB 3.44Å; K10-H13 HydrophobicContact CB-CB 4.41Å; K10-H13 WeakPolarHBondContact O-CB 3.36Å; K10-H13 PolarHBondContact O-N 2.98Å; K10-H13 VanDerWaalsContact O-N 3.08Å; H13-Q15 VanDerWaalsContact C-N 3.27Å; H13-Q15 PolarHBondContact ND1-N 3.31Å; H13-Q15 PolarHBondContact O-N 3.04Å; H13-T16 HydrophobicContact CB-CG2 3.94Å; H13-T16 WeakPolarHBondContact O-CG2 3.48Å; H13-T16 PolarHBondContact O-N 2.9Å; H13-T16 VanDerWaalsContact O-N 3.12Å; H13-T16 PolarHBondContact O-OG1 3.42Å; H13-N19 PolarHBondContact O-ND2 3.25Å | ||
| 14 | P | 94.1 | Very high | 92.6 | Very high | 86 Ų | 86 | 98.1 Ų | 98.1 | 56% | 0.558 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.1 | -30.7 | -169.3 | 24.9 | -34.3 | 0 | 0 | 0 | 112.6 | T16 V20 | P14-T16 VanDerWaalsContact C-N 3.27Å; P14-T16 PolarHBondContact O-N 3.47Å; P14-V20 WeakPolarHBondContact O-CG2 3.36Å |
| 15 | Q | 94.4 | Very high | 93.5 | Very high | 139 Ų | 139 | 100.4 Ų | 100.4 | 65% | 0.65 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.4 | 5.4 | 179.6 | -57.1 | 178.5 | -24.6 | 0 | 0 | 113.8 | L8 H13 | L8-Q15 HydrophobicContact CD2-CB 4.42Å; H13-Q15 VanDerWaalsContact C-N 3.27Å; H13-Q15 PolarHBondContact ND1-N 3.31Å; H13-Q15 PolarHBondContact O-N 3.04Å |
| 16 | T | 94.4 | Very high | 94.2 | Very high | 21 Ų | 21 | 99.8 Ų | 99.8 | 13% | 0.129 | 49% | 0.489 | C | S | . | . | S | Bend | trans | -66.2 | 140.3 | 167.2 | 61.4 | 0 | 0 | 0 | 0 | 109.4 | L8 H13 P14 R18 N19 V20 | L8-T16 WeakPolarHBondContact O-CG2 3.37Å; H13-T16 HydrophobicContact CB-CG2 3.94Å; H13-T16 WeakPolarHBondContact O-CG2 3.48Å; H13-T16 PolarHBondContact O-N 2.9Å; H13-T16 VanDerWaalsContact O-N 3.12Å; H13-T16 PolarHBondContact O-OG1 3.42Å; P14-T16 VanDerWaalsContact C-N 3.27Å; P14-T16 PolarHBondContact O-N 3.47Å; T16-R18 PolarHBondContact O-N 3.43Å; T16-R18 VanDerWaalsContact O-N 3.1Å; T16-N19 PolarHBondContact O-N 3.41Å; T16-N19 WeakPolarHBondContact OG1-CB 3.46Å; T16-N19 VanDerWaalsContact OG1-CG 3.23Å; T16-N19 PolarHBondContact OG1-N 2.9Å; T16-N19 PolarHBondContact OG1-ND2 3.18Å; T16-V20 WeakPolarHBondContact O-CG2 3.39Å; T16-V20 PolarHBondContact O-N 3.29Å |
| 17 | L | 94.6 | Very high | 94.8 | Very high | 155 Ų | 155 | 100 Ų | 100 | 81% | 0.812 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -51.2 | -39.9 | -179.2 | -68.5 | 175.5 | 0 | 0 | 0 | 112.4 | N19 V20 E21 | L17-N19 PolarHBondContact O-N 3.27Å; L17-V20 PolarHBondContact O-N 2.96Å; L17-E21 VanDerWaalsContact O-CB 3.3Å; L17-E21 WeakPolarHBondContact O-CB 3.3Å; L17-E21 PolarHBondContact O-N 3.08Å |
| 18 | R | 95.4 | Very high | 95.3 | Very high | 152 Ų | 152 | 101.1 Ų | 101.1 | 57% | 0.574 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -59.5 | -42.9 | 176.5 | -173.8 | -175.9 | 72 | 173 | 4.4 | 112.9 | S11 T16 K22 | S11-R18 PolarHBondContact O-NH2 3.14Å; T16-R18 PolarHBondContact O-N 3.43Å; T16-R18 VanDerWaalsContact O-N 3.1Å; R18-K22 WeakPolarHBondContact O-CB 3.37Å; R18-K22 PolarHBondContact O-N 3.27Å |
| 19 | N | 96.8 | Very high | 95.8 | Very high | 26 Ų | 26 | 103.3 Ų | 103.3 | 14% | 0.139 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -78.4 | -36.7 | -176.7 | -68.3 | -10.6 | 0 | 0 | 0 | 110.9 | S11 H13 T16 L17 K22 V23 | S11-N19 PolarHBondContact O-ND2 2.95Å; H13-N19 PolarHBondContact O-ND2 3.25Å; T16-N19 PolarHBondContact O-N 3.41Å; T16-N19 WeakPolarHBondContact OG1-CB 3.46Å; T16-N19 VanDerWaalsContact OG1-CG 3.23Å; T16-N19 PolarHBondContact OG1-N 2.9Å; T16-N19 PolarHBondContact OG1-ND2 3.18Å; L17-N19 PolarHBondContact O-N 3.27Å; N19-K22 WeakPolarHBondContact O-CB 3.48Å; N19-K22 PolarHBondContact O-N 2.94Å; N19-V23 WeakPolarHBondContact O-CG2 3.4Å; N19-V23 PolarHBondContact O-N 3.13Å |
| 20 | V | 97.7 | Very high | 96.3 | Very high | 78 Ų | 78 | 100.1 Ų | 100.1 | 47% | 0.473 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.6 | -46.9 | 170.5 | 177.9 | 0 | 0 | 0 | 0 | 110.5 | P14 T16 L17 K22 V23 W24 | P14-V20 WeakPolarHBondContact O-CG2 3.36Å; T16-V20 WeakPolarHBondContact O-CG2 3.39Å; T16-V20 PolarHBondContact O-N 3.29Å; L17-V20 PolarHBondContact O-N 2.96Å; V20-K22 VanDerWaalsContact C-N 3.32Å; V20-K22 PolarHBondContact O-N 3.38Å; V20-V23 PolarHBondContact O-N 2.96Å; V20-W24 WeakPolarHBondContact O-CB 3.43Å; V20-W24 PolarHBondContact O-N 3.5Å |
| 21 | E | 97.6 | Very high | 96.5 | Very high | 91 Ų | 91 | 99.9 Ų | 99.9 | 43% | 0.425 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.7 | -39.5 | 176.4 | -172.1 | -171.2 | 170.7 | 0 | 0 | 112 | L17 W24 K25 | L17-E21 VanDerWaalsContact O-CB 3.3Å; L17-E21 WeakPolarHBondContact O-CB 3.3Å; L17-E21 PolarHBondContact O-N 3.08Å; E21-W24 PolarHBondContact O-N 2.85Å; E21-K25 HydrophobicContact CG-CD 4.42Å; E21-K25 WeakPolarHBondContact O-CG 3.48Å; E21-K25 PolarHBondContact O-N 3.36Å; E21-K25 WeakPolarHBondContact OE1-CE 3.36Å; E21-K25 IonicContact OE1-NZ 3.8Å; E21-K25 PolarHBondContact OE1-NZ 2.92Å |
| 22 | K | 97.6 | Very high | 96.8 | Very high | 154 Ų | 154 | 99.1 Ų | 99.1 | 67% | 0.67 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.9 | -45.1 | 176.4 | -173.5 | -177.5 | 179.1 | -176.6 | 0 | 111.8 | R18 N19 V20 A26 | R18-K22 WeakPolarHBondContact O-CB 3.37Å; R18-K22 PolarHBondContact O-N 3.27Å; N19-K22 WeakPolarHBondContact O-CB 3.48Å; N19-K22 PolarHBondContact O-N 2.94Å; V20-K22 VanDerWaalsContact C-N 3.32Å; V20-K22 PolarHBondContact O-N 3.38Å; K22-A26 PolarHBondContact O-N 3.48Å; K22-A26 VanDerWaalsContact O-N 3.16Å |
| 23 | V | 98.2 | Very high | 97 | Very high | 81 Ų | 81 | 95.6 Ų | 95.6 | 49% | 0.491 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.9 | -48.3 | 176.8 | 171.9 | 0 | 0 | 0 | 0 | 110 | N19 V20 K25 A26 E27 | N19-V23 WeakPolarHBondContact O-CG2 3.4Å; N19-V23 PolarHBondContact O-N 3.13Å; V20-V23 PolarHBondContact O-N 2.96Å; V23-K25 VanDerWaalsContact C-N 3.35Å; V23-K25 PolarHBondContact O-N 3.06Å; V23-A26 WeakPolarHBondContact O-CA 3.38Å; V23-A26 WeakPolarHBondContact O-CB 3.33Å; V23-A26 PolarHBondContact O-N 3.37Å; V23-E27 HydrophobicContact CG1-CG 4.25Å; V23-E27 WeakPolarHBondContact O-CG 3.46Å; V23-E27 PolarHBondContact O-N 3.42Å |
| 24 | W | 98 | Very high | 97.1 | Very high | 139 Ų | 139 | 102.2 Ų | 102.2 | 53% | 0.527 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.1 | -45.2 | 179 | 176.7 | 63.5 | 0 | 0 | 0 | 112.6 | V20 E21 A26 E27 Q28 | V20-W24 WeakPolarHBondContact O-CB 3.43Å; V20-W24 PolarHBondContact O-N 3.5Å; E21-W24 PolarHBondContact O-N 2.85Å; W24-A26 VanDerWaalsContact C-N 3.3Å; W24-A26 PolarHBondContact O-N 3.49Å; W24-E27 PolarHBondContact O-N 2.8Å; W24-Q28 HydrophobicContact CD2-CG 4.34Å; W24-Q28 HydrophobicContact CZ2-CG 4.1Å; W24-Q28 WeakPolarHBondContact O-CG 3.49Å; W24-Q28 PolarHBondContact O-N 3.01Å |
| 25 | K | 98.3 | Very high | 97.3 | Very high | 116 Ų | 116 | 103.9 Ų | 103.9 | 50% | 0.504 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.5 | -37.8 | 175.1 | -74.5 | 177.9 | -176.2 | 171.1 | 0 | 112.7 | E21 V23 K29 | E21-K25 HydrophobicContact CG-CD 4.42Å; E21-K25 WeakPolarHBondContact O-CG 3.48Å; E21-K25 PolarHBondContact O-N 3.36Å; E21-K25 WeakPolarHBondContact OE1-CE 3.36Å; E21-K25 IonicContact OE1-NZ 3.8Å; E21-K25 PolarHBondContact OE1-NZ 2.92Å; V23-K25 VanDerWaalsContact C-N 3.35Å; V23-K25 PolarHBondContact O-N 3.06Å; K25-K29 PolarHBondContact O-N 3.17Å; K25-K29 VanDerWaalsContact O-N 3.09Å |
| 26 | A | 98.1 | Very high | 97.5 | Very high | 61 Ų | 61 | 104 Ų | 104 | 50% | 0.504 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.7 | -41.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | K22 V23 W24 K29 H30 | K22-A26 PolarHBondContact O-N 3.48Å; K22-A26 VanDerWaalsContact O-N 3.16Å; V23-A26 WeakPolarHBondContact O-CA 3.38Å; V23-A26 WeakPolarHBondContact O-CB 3.33Å; V23-A26 PolarHBondContact O-N 3.37Å; W24-A26 VanDerWaalsContact C-N 3.3Å; W24-A26 PolarHBondContact O-N 3.49Å; A26-K29 PolarHBondContact O-N 3.35Å; A26-H30 WeakPolarHBondContact O-CB 3.36Å; A26-H30 PolarHBondContact O-N 3.01Å |
| 27 | E | 97.8 | Very high | 97.7 | Very high | 115 Ų | 115 | 107.3 Ų | 107.3 | 54% | 0.537 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.8 | -45.5 | 175.9 | -71.2 | 175.6 | 161.9 | 0 | 0 | 111.7 | V23 W24 K29 H30 E31 | V23-E27 HydrophobicContact CG1-CG 4.25Å; V23-E27 WeakPolarHBondContact O-CG 3.46Å; V23-E27 PolarHBondContact O-N 3.42Å; W24-E27 PolarHBondContact O-N 2.8Å; E27-K29 VanDerWaalsContact C-N 3.34Å; E27-K29 PolarHBondContact O-N 3.35Å; E27-H30 PolarHBondContact O-N 3.04Å; E27-E31 WeakPolarHBondContact O-CB 3.33Å; E27-E31 PolarHBondContact O-N 2.97Å |
| 28 | Q | 98.1 | Very high | 97.8 | Very high | 92 Ų | 92 | 106 Ų | 106 | 43% | 0.43 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.3 | -43.7 | 175.4 | -72.6 | -61.4 | 120.7 | 0 | 0 | 112 | W24 E31 A32 | W24-Q28 HydrophobicContact CD2-CG 4.34Å; W24-Q28 HydrophobicContact CZ2-CG 4.1Å; W24-Q28 WeakPolarHBondContact O-CG 3.49Å; W24-Q28 PolarHBondContact O-N 3.01Å; Q28-E31 PolarHBondContact O-N 3.32Å; Q28-A32 PolarHBondContact O-N 2.96Å |
| 29 | K | 98.2 | Very high | 98 | Very high | 134 Ų | 134 | 103.3 Ų | 103.3 | 58% | 0.583 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.9 | -46.2 | 176.8 | -175.9 | -176.5 | 173.2 | -169.6 | 0 | 111 | K25 A26 E27 E31 A32 E33 | K25-K29 PolarHBondContact O-N 3.17Å; K25-K29 VanDerWaalsContact O-N 3.09Å; A26-K29 PolarHBondContact O-N 3.35Å; E27-K29 VanDerWaalsContact C-N 3.34Å; E27-K29 PolarHBondContact O-N 3.35Å; K29-E31 VanDerWaalsContact C-N 3.33Å; K29-E31 PolarHBondContact O-N 3.1Å; K29-A32 PolarHBondContact O-N 2.89Å; K29-E33 WeakPolarHBondContact CE-OE1 3.48Å; K29-E33 IonicContact NZ-OE1 2.64Å; K29-E33 WeakPolarHBondContact O-CG 3.35Å; K29-E33 PolarHBondContact O-N 2.7Å |
| 30 | H | 98.1 | Very high | 98 | Very high | 106 Ų | 106 | 106.1 Ų | 106.1 | 49% | 0.491 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 179.3 | 176.9 | -104.4 | 0 | 0 | 0 | 112 | A26 E27 E33 R34 | A26-H30 WeakPolarHBondContact O-CB 3.36Å; A26-H30 PolarHBondContact O-N 3.01Å; E27-H30 PolarHBondContact O-N 3.04Å; H30-E33 PolarHBondContact O-N 3.42Å; H30-R34 WeakPolarHBondContact CE1-CD 3.46Å; H30-R34 WeakPolarHBondContact O-CB 3.35Å; H30-R34 WeakPolarHBondContact O-CG 3.5Å; H30-R34 PolarHBondContact O-N 2.98Å |
| 31 | E | 98.1 | Very high | 98 | Very high | 81 Ų | 81 | 107.1 Ų | 107.1 | 38% | 0.379 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 175.5 | -164.6 | -168.5 | 168.2 | 0 | 0 | 111.9 | E27 Q28 K29 R34 K35 | E27-E31 WeakPolarHBondContact O-CB 3.33Å; E27-E31 PolarHBondContact O-N 2.97Å; Q28-E31 PolarHBondContact O-N 3.32Å; K29-E31 VanDerWaalsContact C-N 3.33Å; K29-E31 PolarHBondContact O-N 3.1Å; E31-R34 PolarHBondContact O-N 3.41Å; E31-K35 HydrophobicContact CG-CD 4.49Å; E31-K35 WeakPolarHBondContact O-CG 3.33Å; E31-K35 PolarHBondContact O-N 3.43Å; E31-K35 WeakPolarHBondContact OE1-CE 3.35Å; E31-K35 IonicContact OE1-NZ 2.7Å; E31-K35 PolarHBondContact OE1-NZ 3.48Å |
| 32 | A | 98.1 | Very high | 98 | Very high | 61 Ų | 61 | 108.4 Ų | 108.4 | 50% | 0.504 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.8 | -42.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q28 K29 K35 K36 | Q28-A32 PolarHBondContact O-N 2.96Å; K29-A32 PolarHBondContact O-N 2.89Å; A32-K35 PolarHBondContact O-N 3.33Å; A32-K36 PolarHBondContact O-N 3.49Å; A32-K36 VanDerWaalsContact O-N 3.07Å |
| 33 | E | 97.9 | Very high | 98 | Very high | 96 Ų | 96 | 105.8 Ų | 105.8 | 45% | 0.449 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 175.5 | -74 | 175.6 | 153.2 | 0 | 0 | 111.4 | K29 H30 K36 I37 | K29-E33 WeakPolarHBondContact CE-OE1 3.48Å; K29-E33 IonicContact NZ-OE1 2.64Å; K29-E33 WeakPolarHBondContact O-CG 3.35Å; K29-E33 PolarHBondContact O-N 2.7Å; H30-E33 PolarHBondContact O-N 3.42Å; E33-K36 PolarHBondContact O-N 2.92Å; E33-I37 VanDerWaalsContact O-CG1 3.3Å; E33-I37 WeakPolarHBondContact O-CG1 3.49Å; E33-I37 PolarHBondContact O-N 3.23Å |
| 34 | R | 98.1 | Very high | 98 | Very high | 163 Ų | 163 | 106.1 Ų | 106.1 | 62% | 0.615 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.9 | -45.9 | 176.1 | -78 | -176.1 | 62.3 | -169.5 | 2.4 | 112.7 | H30 E31 K36 I37 E38 | H30-R34 WeakPolarHBondContact CE1-CD 3.46Å; H30-R34 WeakPolarHBondContact O-CB 3.35Å; H30-R34 WeakPolarHBondContact O-CG 3.5Å; H30-R34 PolarHBondContact O-N 2.98Å; E31-R34 PolarHBondContact O-N 3.41Å; R34-K36 VanDerWaalsContact C-N 3.32Å; R34-K36 PolarHBondContact O-N 3.39Å; R34-I37 PolarHBondContact O-N 3.01Å; R34-E38 PolarHBondContact O-N 3.34Å |
| 35 | K | 98.1 | Very high | 98 | Very high | 120 Ų | 120 | 106.4 Ų | 106.4 | 52% | 0.522 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.2 | -42.8 | 177.5 | -77.2 | 171.8 | 170.3 | 162.8 | 0 | 111.6 | E31 A32 I37 E38 E39 | E31-K35 HydrophobicContact CG-CD 4.49Å; E31-K35 WeakPolarHBondContact O-CG 3.33Å; E31-K35 PolarHBondContact O-N 3.43Å; E31-K35 WeakPolarHBondContact OE1-CE 3.35Å; E31-K35 IonicContact OE1-NZ 2.7Å; E31-K35 PolarHBondContact OE1-NZ 3.48Å; A32-K35 PolarHBondContact O-N 3.33Å; K35-I37 PolarHBondContact O-N 3.29Å; K35-E38 PolarHBondContact O-N 3.47Å; K35-E39 PolarHBondContact O-N 3.02Å |
| 36 | K | 98 | Very high | 97.9 | Very high | 141 Ų | 141 | 105.1 Ų | 105.1 | 61% | 0.613 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62.6 | -41 | 176.1 | -174.8 | 172.5 | -177 | 175.2 | 0 | 112.4 | A32 E33 R34 E39 L40 | A32-K36 PolarHBondContact O-N 3.49Å; A32-K36 VanDerWaalsContact O-N 3.07Å; E33-K36 PolarHBondContact O-N 2.92Å; R34-K36 VanDerWaalsContact C-N 3.32Å; R34-K36 PolarHBondContact O-N 3.39Å; K36-E39 PolarHBondContact O-N 3.07Å; K36-L40 HydrophobicContact CG-CD1 4.38Å; K36-L40 WeakPolarHBondContact O-CG 3.47Å; K36-L40 PolarHBondContact O-N 2.97Å; K36-L40 VanDerWaalsContact O-N 3.1Å |
| 37 | I | 98.2 | Very high | 97.7 | Very high | 92 Ų | 92 | 107.3 Ų | 107.3 | 47% | 0.472 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.7 | -42.6 | 176.8 | -68.7 | 164.7 | 0 | 0 | 0 | 110.7 | E33 R34 K35 E39 L40 Q41 | E33-I37 VanDerWaalsContact O-CG1 3.3Å; E33-I37 WeakPolarHBondContact O-CG1 3.49Å; E33-I37 PolarHBondContact O-N 3.23Å; R34-I37 PolarHBondContact O-N 3.01Å; K35-I37 PolarHBondContact O-N 3.29Å; I37-E39 VanDerWaalsContact C-N 3.35Å; I37-E39 PolarHBondContact O-N 3.38Å; I37-L40 PolarHBondContact O-N 3.1Å; I37-Q41 HydrophobicContact CG2-CG 4.4Å; I37-Q41 WeakPolarHBondContact O-CB 3.35Å; I37-Q41 WeakPolarHBondContact O-CG 3.45Å; I37-Q41 PolarHBondContact O-N 3.45Å |
| 38 | E | 98.3 | Very high | 97.7 | Very high | 128 Ų | 128 | 109.2 Ų | 109.2 | 60% | 0.598 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.7 | -41.3 | 178.7 | -176.1 | 174.7 | -167.8 | 0 | 0 | 112.2 | R34 K35 Q41 R42 | R34-E38 PolarHBondContact O-N 3.34Å; K35-E38 PolarHBondContact O-N 3.47Å; E38-Q41 PolarHBondContact O-N 3.01Å; E38-R42 PolarHBondContact O-N 2.86Å |
| 39 | E | 98.1 | Very high | 97.5 | Very high | 95 Ų | 95 | 107 Ų | 107 | 44% | 0.444 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.5 | -49.6 | 174.3 | 178.6 | 165.3 | -129.3 | 0 | 0 | 111.8 | K35 K36 I37 Q41 R42 E43 | K35-E39 PolarHBondContact O-N 3.02Å; K36-E39 PolarHBondContact O-N 3.07Å; I37-E39 VanDerWaalsContact C-N 3.35Å; I37-E39 PolarHBondContact O-N 3.38Å; E39-Q41 VanDerWaalsContact C-N 3.29Å; E39-Q41 PolarHBondContact O-N 2.87Å; E39-R42 WeakPolarHBondContact O-CB 3.35Å; E39-R42 PolarHBondContact O-N 3.46Å; E39-R42 IonicContact OE1-NH2 3.63Å; E39-E43 PolarHBondContact O-N 3.25Å |
| 40 | L | 98.1 | Very high | 97.2 | Very high | 84 Ų | 84 | 107.9 Ų | 107.9 | 44% | 0.44 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.9 | -38.5 | 176.8 | -70.2 | 170.5 | 0 | 0 | 0 | 112.2 | K36 I37 R42 E43 L44 | K36-L40 HydrophobicContact CG-CD1 4.38Å; K36-L40 WeakPolarHBondContact O-CG 3.47Å; K36-L40 PolarHBondContact O-N 2.97Å; K36-L40 VanDerWaalsContact O-N 3.1Å; I37-L40 PolarHBondContact O-N 3.1Å; L40-R42 VanDerWaalsContact C-N 3.31Å; L40-R42 PolarHBondContact O-N 3.42Å; L40-E43 PolarHBondContact O-N 2.92Å; L40-L44 WeakPolarHBondContact O-CG 3.3Å; L40-L44 PolarHBondContact O-N 3.34Å |
| 41 | Q | 97.9 | Very high | 97 | Very high | 99 Ų | 99 | 107.1 Ų | 107.1 | 46% | 0.463 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.9 | -34.6 | 174.9 | -75.4 | -178.3 | 3 | 0 | 0 | 112.4 | I37 E38 E39 R45 | I37-Q41 HydrophobicContact CG2-CG 4.4Å; I37-Q41 WeakPolarHBondContact O-CB 3.35Å; I37-Q41 WeakPolarHBondContact O-CG 3.45Å; I37-Q41 PolarHBondContact O-N 3.45Å; E38-Q41 PolarHBondContact O-N 3.01Å; E39-Q41 VanDerWaalsContact C-N 3.29Å; E39-Q41 PolarHBondContact O-N 2.87Å; Q41-R45 WeakPolarHBondContact O-CG 3.21Å; Q41-R45 PolarHBondContact O-N 3.45Å; Q41-R45 VanDerWaalsContact O-N 3.17Å |
| 42 | R | 97.9 | Very high | 96.7 | Very high | 118 Ų | 118 | 109.8 Ų | 109.8 | 45% | 0.445 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.2 | -48.5 | 174.3 | -177.8 | -176.4 | 65.4 | -154.1 | -4.9 | 110.5 | E38 E39 L40 L44 R45 E46 | E38-R42 PolarHBondContact O-N 2.86Å; E39-R42 WeakPolarHBondContact O-CB 3.35Å; E39-R42 PolarHBondContact O-N 3.46Å; E39-R42 IonicContact OE1-NH2 3.63Å; L40-R42 VanDerWaalsContact C-N 3.31Å; L40-R42 PolarHBondContact O-N 3.42Å; R42-L44 VanDerWaalsContact C-N 3.34Å; R42-L44 PolarHBondContact O-N 3.36Å; R42-R45 PolarHBondContact O-N 3.24Å; R42-R45 VanDerWaalsContact O-N 3.1Å; R42-E46 WeakPolarHBondContact CG-OE1 3.39Å; R42-E46 PolarHBondContact O-N 3.11Å |
| 43 | E | 97.5 | Very high | 96.3 | Very high | 100 Ų | 100 | 112.9 Ų | 112.9 | 47% | 0.467 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57 | -46.8 | 178.1 | -70.1 | 178.7 | 172.5 | 0 | 0 | 111.7 | E39 L40 R45 E46 E47 | E39-E43 PolarHBondContact O-N 3.25Å; L40-E43 PolarHBondContact O-N 2.92Å; E43-R45 VanDerWaalsContact C-N 3.29Å; E43-R45 PolarHBondContact O-N 3.25Å; E43-E46 PolarHBondContact O-N 3.11Å; E43-E47 WeakPolarHBondContact O-CB 3.47Å; E43-E47 PolarHBondContact O-N 3.09Å |
| 44 | L | 97.4 | Very high | 95.8 | Very high | 88 Ų | 88 | 114.2 Ų | 114.2 | 46% | 0.461 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.7 | -36.2 | 176.4 | -74.8 | 170.8 | 0 | 0 | 0 | 113.1 | L40 R42 R48 | L40-L44 WeakPolarHBondContact O-CG 3.3Å; L40-L44 PolarHBondContact O-N 3.34Å; R42-L44 VanDerWaalsContact C-N 3.34Å; R42-L44 PolarHBondContact O-N 3.36Å; L44-R48 WeakPolarHBondContact O-CB 3.41Å; L44-R48 VanDerWaalsContact O-CG 3.3Å; L44-R48 WeakPolarHBondContact O-CG 3.37Å; L44-R48 PolarHBondContact O-N 3.06Å; L44-R48 VanDerWaalsContact O-N 3.08Å |
| 45 | R | 96.8 | Very high | 95.4 | Very high | 144 Ų | 144 | 114.4 Ų | 114.4 | 54% | 0.543 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69.9 | -40.9 | 176.2 | -76.4 | -171 | -60.1 | -105.2 | 1 | 111.6 | Q41 R42 E43 R48 A49 | Q41-R45 WeakPolarHBondContact O-CG 3.21Å; Q41-R45 PolarHBondContact O-N 3.45Å; Q41-R45 VanDerWaalsContact O-N 3.17Å; R42-R45 PolarHBondContact O-N 3.24Å; R42-R45 VanDerWaalsContact O-N 3.1Å; E43-R45 VanDerWaalsContact C-N 3.29Å; E43-R45 PolarHBondContact O-N 3.25Å; R45-R48 PolarHBondContact O-N 2.93Å; R45-A49 WeakPolarHBondContact O-CB 3.45Å; R45-A49 PolarHBondContact O-N 2.95Å |
| 46 | E | 96.6 | Very high | 95 | Very high | 89 Ų | 89 | 116.3 Ų | 116.3 | 42% | 0.416 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.4 | -41 | 177.1 | -71.5 | 179.1 | -159.7 | 0 | 0 | 111.8 | R42 E43 A49 R50 | R42-E46 WeakPolarHBondContact CG-OE1 3.39Å; R42-E46 PolarHBondContact O-N 3.11Å; E43-E46 PolarHBondContact O-N 3.11Å; E46-A49 PolarHBondContact O-N 3.07Å; E46-R50 WeakPolarHBondContact O-CG 3.4Å; E46-R50 PolarHBondContact O-N 3.32Å |
| 47 | E | 95.4 | Very high | 94.3 | Very high | 107 Ų | 107 | 110.8 Ų | 110.8 | 50% | 0.5 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -50.5 | 175.3 | -170.1 | 178.3 | 174.7 | 0 | 0 | 110.9 | E43 A49 R50 E51 | E43-E47 WeakPolarHBondContact O-CB 3.47Å; E43-E47 PolarHBondContact O-N 3.09Å; E47-A49 VanDerWaalsContact C-N 3.35Å; E47-A49 PolarHBondContact O-N 2.91Å; E47-R50 WeakPolarHBondContact O-CB 3.29Å; E47-R50 PolarHBondContact O-N 2.91Å; E47-R50 VanDerWaalsContact O-N 3.13Å; E47-E51 WeakPolarHBondContact O-CG 3.49Å; E47-E51 PolarHBondContact O-N 3.1Å |
| 48 | R | 95.9 | Very high | 93.7 | Very high | 156 Ų | 156 | 111.6 Ų | 111.6 | 59% | 0.589 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -58.4 | -43.6 | 176.1 | -75.2 | 177.9 | -174 | 174.3 | 2.6 | 112.9 | L44 R45 R50 E51 E52 | L44-R48 WeakPolarHBondContact O-CB 3.41Å; L44-R48 VanDerWaalsContact O-CG 3.3Å; L44-R48 WeakPolarHBondContact O-CG 3.37Å; L44-R48 PolarHBondContact O-N 3.06Å; L44-R48 VanDerWaalsContact O-N 3.08Å; R45-R48 PolarHBondContact O-N 2.93Å; R48-R50 VanDerWaalsContact C-N 3.28Å; R48-R50 PolarHBondContact O-N 3.5Å; R48-E51 PolarHBondContact O-N 2.99Å; R48-E52 WeakPolarHBondContact O-CB 3.42Å; R48-E52 WeakPolarHBondContact O-CG 3.43Å; R48-E52 PolarHBondContact O-N 3.44Å |
| 49 | A | 95 | Very high | 92.9 | Very high | 45 Ų | 45 | 112.3 Ų | 112.3 | 37% | 0.372 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.7 | -36.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | R45 E46 E47 M53 | R45-A49 WeakPolarHBondContact O-CB 3.45Å; R45-A49 PolarHBondContact O-N 2.95Å; E46-A49 PolarHBondContact O-N 3.07Å; E47-A49 VanDerWaalsContact C-N 3.35Å; E47-A49 PolarHBondContact O-N 2.91Å; A49-M53 WeakPolarHBondContact O-CB 3.5Å; A49-M53 WeakPolarHBondContact O-CG 3.2Å; A49-M53 PolarHBondContact O-N 3.27Å |
| 50 | R | 92.3 | Very high | 92.2 | Very high | 152 Ų | 152 | 111.9 Ų | 111.9 | 57% | 0.574 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -68.3 | -45.5 | 174.3 | -72.1 | 175.1 | -173.6 | 162.4 | 7.9 | 111.8 | E46 E47 R48 E52 M53 Q54 | E46-R50 WeakPolarHBondContact O-CG 3.4Å; E46-R50 PolarHBondContact O-N 3.32Å; E47-R50 WeakPolarHBondContact O-CB 3.29Å; E47-R50 PolarHBondContact O-N 2.91Å; E47-R50 VanDerWaalsContact O-N 3.13Å; R48-R50 VanDerWaalsContact C-N 3.28Å; R48-R50 PolarHBondContact O-N 3.5Å; R50-E52 VanDerWaalsContact C-N 3.33Å; R50-E52 PolarHBondContact O-N 3.43Å; R50-M53 PolarHBondContact O-N 3.4Å; R50-Q54 WeakPolarHBondContact O-CG 3.48Å; R50-Q54 PolarHBondContact O-N 3.26Å |
| 51 | E | 93.3 | Very high | 90.8 | Very high | 91 Ų | 91 | 110.7 Ų | 110.7 | 43% | 0.425 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.5 | -43 | 176.7 | -70.9 | -173.4 | 158.7 | 0 | 0 | 111.6 | E47 R48 Q54 R55 | E47-E51 WeakPolarHBondContact O-CG 3.49Å; E47-E51 PolarHBondContact O-N 3.1Å; R48-E51 PolarHBondContact O-N 2.99Å; E51-Q54 PolarHBondContact O-N 2.87Å; E51-R55 WeakPolarHBondContact O-CB 3.42Å; E51-R55 WeakPolarHBondContact O-CG 3.48Å; E51-R55 PolarHBondContact O-N 3.27Å |
| 52 | E | 92 | Very high | 89.1 | Confident | 137 Ų | 137 | 109.9 Ų | 109.9 | 64% | 0.64 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.9 | -43.6 | 176.1 | -75.7 | 176.4 | -178.8 | 0 | 0 | 111.8 | R48 R50 R55 Y56 | R48-E52 WeakPolarHBondContact O-CB 3.42Å; R48-E52 WeakPolarHBondContact O-CG 3.43Å; R48-E52 PolarHBondContact O-N 3.44Å; R50-E52 VanDerWaalsContact C-N 3.33Å; R50-E52 PolarHBondContact O-N 3.43Å; E52-R55 PolarHBondContact O-N 3.39Å; E52-Y56 VanDerWaalsContact O-CB 3.3Å; E52-Y56 WeakPolarHBondContact O-CB 3.48Å; E52-Y56 PolarHBondContact O-N 3.12Å |
| 53 | M | 88.9 | Confident | 87.2 | Confident | 125 Ų | 125 | 108 Ų | 108 | 62% | 0.616 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.3 | -40.7 | 175 | -78.5 | -170 | -69.4 | 0 | 0 | 112.4 | A49 R50 A57 | A49-M53 WeakPolarHBondContact O-CB 3.5Å; A49-M53 WeakPolarHBondContact O-CG 3.2Å; A49-M53 PolarHBondContact O-N 3.27Å; R50-M53 PolarHBondContact O-N 3.4Å; M53-A57 WeakPolarHBondContact O-CB 3.28Å; M53-A57 PolarHBondContact O-N 3.01Å |
| 54 | Q | 88.1 | Confident | 85.3 | Confident | 125 Ų | 125 | 112.4 Ų | 112.4 | 58% | 0.584 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.7 | -49.8 | 176.7 | -75.1 | 177.8 | 9.1 | 0 | 0 | 111.1 | R50 E51 Y56 A57 E58 | R50-Q54 WeakPolarHBondContact O-CG 3.48Å; R50-Q54 PolarHBondContact O-N 3.26Å; E51-Q54 PolarHBondContact O-N 2.87Å; Q54-Y56 VanDerWaalsContact C-N 3.33Å; Q54-Y56 PolarHBondContact O-N 2.9Å; Q54-A57 PolarHBondContact O-N 3.42Å; Q54-A57 VanDerWaalsContact O-N 3.14Å; Q54-E58 WeakPolarHBondContact O-CG 3.46Å; Q54-E58 PolarHBondContact O-N 2.81Å |
| 55 | R | 90.1 | Very high | 83.3 | Confident | 167 Ų | 167 | 112.2 Ų | 112.2 | 63% | 0.63 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -57.8 | -45.2 | 176.3 | -75.3 | -178.3 | 178.3 | -172.1 | 3.2 | 112 | E51 E52 A57 E58 D59 | E51-R55 WeakPolarHBondContact O-CB 3.42Å; E51-R55 WeakPolarHBondContact O-CG 3.48Å; E51-R55 PolarHBondContact O-N 3.27Å; E52-R55 PolarHBondContact O-N 3.39Å; R55-A57 VanDerWaalsContact C-N 3.33Å; R55-A57 PolarHBondContact O-N 2.9Å; R55-E58 PolarHBondContact O-N 3Å; R55-D59 WeakPolarHBondContact O-CB 3.3Å; R55-D59 PolarHBondContact O-N 2.98Å |
| 56 | Y | 88.3 | Confident | 81.2 | Confident | 159 Ų | 159 | 110.8 Ų | 110.8 | 62% | 0.624 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -62 | -40.5 | 177.2 | -179 | -101.8 | 0 | 0 | 0 | 112.1 | E52 Q54 D59 V60 | E52-Y56 VanDerWaalsContact O-CB 3.3Å; E52-Y56 WeakPolarHBondContact O-CB 3.48Å; E52-Y56 PolarHBondContact O-N 3.12Å; Q54-Y56 VanDerWaalsContact C-N 3.33Å; Q54-Y56 PolarHBondContact O-N 2.9Å; Y56-D59 PolarHBondContact O-N 3.46Å; Y56-V60 HydrophobicContact CD1-CG2 4.25Å; Y56-V60 HydrophobicContact CD2-CG2 4.14Å; Y56-V60 HydrophobicContact CE1-CG2 3.85Å; Y56-V60 HydrophobicContact CE2-CG2 3.72Å; Y56-V60 HydrophobicContact CG-CG2 4.39Å; Y56-V60 WeakPolarHBondContact O-CB 3.42Å; Y56-V60 VanDerWaalsContact O-CG2 3.25Å; Y56-V60 WeakPolarHBondContact O-CG2 3.13Å; Y56-V60 PolarHBondContact O-N 2.94Å |
| 57 | A | 85.2 | Confident | 79.2 | Confident | 25 Ų | 25 | 117.9 Ų | 117.9 | 21% | 0.207 | 59% | 0.592 | C | S | . | * | H | α-helix | trans | -67.7 | -34.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | M53 Q54 R55 G61 A62 V63 | M53-A57 WeakPolarHBondContact O-CB 3.28Å; M53-A57 PolarHBondContact O-N 3.01Å; Q54-A57 PolarHBondContact O-N 3.42Å; Q54-A57 VanDerWaalsContact O-N 3.14Å; R55-A57 VanDerWaalsContact C-N 3.33Å; R55-A57 PolarHBondContact O-N 2.9Å; A57-G61 PolarHBondContact O-N 3.08Å; A57-A62 PolarHBondContact O-N 3.14Å; A57-A62 VanDerWaalsContact O-N 3.08Å; A57-V63 HydrophobicContact CB-CG2 3.82Å; A57-V63 PolarHBondContact O-N 3.18Å |
| 58 | E | 84.6 | Confident | 76.7 | Confident | 109 Ų | 109 | 125.8 Ų | 125.8 | 51% | 0.509 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -66.6 | -48.1 | 171.2 | -71.2 | 176.3 | 174.6 | 0 | 0 | 111.3 | Q54 R55 V60 G61 | Q54-E58 WeakPolarHBondContact O-CG 3.46Å; Q54-E58 PolarHBondContact O-N 2.81Å; R55-E58 PolarHBondContact O-N 3Å; E58-V60 PolarHBondContact O-N 3.24Å; E58-G61 WeakPolarHBondContact O-CA 3.4Å; E58-G61 PolarHBondContact O-N 2.94Å |
| 59 | D | 81.9 | Confident | 75.7 | Confident | 143 Ų | 143 | 124.3 Ų | 124.3 | 77% | 0.765 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -63.6 | -39.6 | -179.1 | -78 | -13.2 | 0 | 0 | 0 | 112.6 | R55 Y56 G61 | R55-D59 WeakPolarHBondContact O-CB 3.3Å; R55-D59 PolarHBondContact O-N 2.98Å; Y56-D59 PolarHBondContact O-N 3.46Å; D59-G61 PolarHBondContact O-N 3.16Å |
| 60 | V | 82.9 | Confident | 74.7 | Confident | 87 Ų | 87 | 128.5 Ų | 128.5 | 53% | 0.527 | 64% | 0.641 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.5 | -6.8 | 176.2 | 177.2 | 0 | 0 | 0 | 0 | 111.7 | Y56 E58 A62 | Y56-V60 HydrophobicContact CD1-CG2 4.25Å; Y56-V60 HydrophobicContact CD2-CG2 4.14Å; Y56-V60 HydrophobicContact CE1-CG2 3.85Å; Y56-V60 HydrophobicContact CE2-CG2 3.72Å; Y56-V60 HydrophobicContact CG-CG2 4.39Å; Y56-V60 WeakPolarHBondContact O-CB 3.42Å; Y56-V60 VanDerWaalsContact O-CG2 3.25Å; Y56-V60 WeakPolarHBondContact O-CG2 3.13Å; Y56-V60 PolarHBondContact O-N 2.94Å; E58-V60 PolarHBondContact O-N 3.24Å; V60-A62 PolarHBondContact O-N 3.17Å |
| 61 | G | 68.8 | Low | 73.7 | Confident | 59 Ų | 59 | 127.2 Ų | 127.2 | 61% | 0.608 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 72 | 13.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | A57 E58 D59 V63 | A57-G61 PolarHBondContact O-N 3.08Å; E58-G61 WeakPolarHBondContact O-CA 3.4Å; E58-G61 PolarHBondContact O-N 2.94Å; D59-G61 PolarHBondContact O-N 3.16Å; G61-V63 VanDerWaalsContact C-N 3.33Å |
| 62 | A | 61.1 | Low | 72.5 | Confident | 81 Ų | 81 | 129.3 Ų | 129.3 | 67% | 0.669 | 66% | 0.657 | S | S | * | * | trans | -75.6 | -24 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | A57 V60 | A57-A62 PolarHBondContact O-N 3.14Å; A57-A62 VanDerWaalsContact O-N 3.08Å; V60-A62 PolarHBondContact O-N 3.17Å | ||
| 63 | V | 58.6 | Low | 71.3 | Confident | 79 Ų | 79 | 128.8 Ų | 128.8 | 48% | 0.479 | 66% | 0.658 | S | S | . | * | S | Bend | trans | -115.3 | 109.2 | 175.2 | 179.9 | 0 | 0 | 0 | 0 | 108.5 | A57 G61 S65 | A57-V63 HydrophobicContact CB-CG2 3.82Å; A57-V63 PolarHBondContact O-N 3.18Å; G61-V63 VanDerWaalsContact C-N 3.33Å; V63-S65 PolarHBondContact O-N 3.16Å |
| 64 | K | 57.8 | Low | 70.2 | Confident | 193 Ų | 193 | 129.1 Ų | 129.1 | 84% | 0.839 | 66% | 0.661 | S | S | * | * | trans | -63.1 | 121.5 | 160.7 | -94.2 | -174.3 | -170.8 | 178.9 | 0 | 106.7 | S66 | K64-S66 VanDerWaalsContact C-N 3.27Å; K64-S66 PolarHBondContact O-N 2.64Å | ||
| 65 | S | 54.9 | Low | 68.9 | Low | 83 Ų | 83 | 129.4 Ų | 129.4 | 58% | 0.58 | 67% | 0.666 | S | S | * | * | trans | -55.6 | 99.3 | 159.9 | -173.5 | 0 | 0 | 0 | 0 | 107.4 | V63 W67 | V63-S65 PolarHBondContact O-N 3.16Å; S65-W67 PolarHBondContact O-N 2.83Å | ||
| 66 | S | 54.1 | Low | 67.2 | Low | 115 Ų | 115 | 126.5 Ų | 126.5 | 80% | 0.804 | 67% | 0.669 | S | S | * | * | trans | -81.8 | 58.3 | 171.7 | 68.2 | 0 | 0 | 0 | 0 | 108.2 | K64 | K64-S66 VanDerWaalsContact C-N 3.27Å; K64-S66 PolarHBondContact O-N 2.64Å | ||
| 67 | W | 52.8 | Low | 65.5 | Low | 237 Ų | 237 | 123.8 Ų | 123.8 | 90% | 0.898 | 67% | 0.673 | S | S | * | * | trans | -88.9 | 109.6 | 155.1 | -89.7 | 73.8 | 0 | 0 | 0 | 106.3 | S65 | S65-W67 PolarHBondContact O-N 2.83Š| ||
| 68 | K | 43 | Very low | 63.7 | Low | 274 Ų | 274 | 132.7 Ų | 132.7 | 100% | 1.191 | 72% | 0.716 | S | S | * | * | trans | -118.2 | 0 | 165 | -154.5 | -173.4 | -167.4 | -174.9 | 0 | 107.5 |
Retrieved 68 of 68 residues in 18.1 ms
(Link to these results)