| 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 | 59.8 | Low | 85.1 | Confident | 184 Ų | 184 | 141.9 Ų | 141.9 | 91% | 0.906 | 62% | 0.615 | S | S | * | * | 0 | 144.6 | 0 | -90.8 | -167.8 | -76 | 0 | 0 | 108.4 | Q5 | M1-Q5 HydrophobicContact SD-CG 4.49Š| |||
| 2 | D | 84.3 | Confident | 85.7 | Confident | 108 Ų | 108 | 136.1 Ų | 136.1 | 58% | 0.578 | 60% | 0.604 | S | S | * | * | trans | -67.2 | 140.4 | 170 | 177.1 | 12.6 | 0 | 0 | 0 | 110 | R4 Q5 E6 | D2-R4 PolarHBondContact O-N 2.94Å; D2-R4 VanDerWaalsContact O-N 3.07Å; D2-R4 PolarHBondContact OD1-N 2.94Å; D2-R4 WeakPolarHBondContact OD2-CB 3.36Å; D2-Q5 WeakPolarHBondContact O-CA 3.46Å; D2-Q5 WeakPolarHBondContact O-CB 3.46Å; D2-Q5 PolarHBondContact O-N 3.48Å; D2-E6 PolarHBondContact O-N 3.15Å | ||
| 3 | R | 83.6 | Confident | 86.1 | Confident | 197 Ų | 197 | 131.8 Ų | 131.8 | 74% | 0.743 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -51.9 | -31.7 | 176.8 | -75 | -171 | -76.1 | -176.9 | -6.5 | 112.2 | R7 | R3-R7 WeakPolarHBondContact O-CG 3.2Å; R3-R7 PolarHBondContact O-N 3.01Å; R3-R7 VanDerWaalsContact O-N 3.09Å |
| 4 | R | 84 | Confident | 86.4 | Confident | 177 Ų | 177 | 128 Ų | 128 | 67% | 0.668 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -67.3 | -39.3 | 175.5 | -164.9 | 179.2 | -165.2 | -179 | 5.6 | 112.4 | D2 K8 | D2-R4 PolarHBondContact O-N 2.94Å; D2-R4 VanDerWaalsContact O-N 3.07Å; D2-R4 PolarHBondContact OD1-N 2.94Å; D2-R4 WeakPolarHBondContact OD2-CB 3.36Å; R4-K8 WeakPolarHBondContact O-CG 3.1Å; R4-K8 PolarHBondContact O-N 3Å |
| 5 | Q | 85.2 | Confident | 86.9 | Confident | 107 Ų | 107 | 124.3 Ų | 124.3 | 50% | 0.5 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -71.5 | -40.2 | 179.2 | -166.9 | 66.5 | 5.5 | 0 | 0 | 110.9 | M1 D2 K8 Y9 | M1-Q5 HydrophobicContact SD-CG 4.49Å; D2-Q5 WeakPolarHBondContact O-CA 3.46Å; D2-Q5 WeakPolarHBondContact O-CB 3.46Å; D2-Q5 PolarHBondContact O-N 3.48Å; Q5-K8 PolarHBondContact O-N 2.98Å; Q5-Y9 WeakPolarHBondContact O-CB 3.21Å; Q5-Y9 PolarHBondContact O-N 3.03Å |
| 6 | E | 84.9 | Confident | 87.2 | Confident | 96 Ų | 96 | 121.3 Ų | 121.3 | 45% | 0.449 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.6 | -47.8 | 174.3 | -173.5 | 179.4 | -173.4 | 0 | 0 | 111.8 | D2 K8 Y9 L10 | D2-E6 PolarHBondContact O-N 3.15Å; E6-K8 VanDerWaalsContact C-N 3.33Å; E6-K8 PolarHBondContact O-N 2.76Å; E6-Y9 PolarHBondContact O-N 2.99Å; E6-L10 HydrophobicContact CG-CD1 4.28Å; E6-L10 WeakPolarHBondContact O-CG 3.49Å; E6-L10 PolarHBondContact O-N 2.85Å |
| 7 | R | 90.5 | Very high | 87.3 | Confident | 199 Ų | 199 | 117.5 Ų | 117.5 | 75% | 0.751 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -59.4 | -40.9 | 175.3 | -77.3 | -176.9 | -177.7 | -176.6 | 1 | 113 | R3 K11 | R3-R7 WeakPolarHBondContact O-CG 3.2Å; R3-R7 PolarHBondContact O-N 3.01Å; R3-R7 VanDerWaalsContact O-N 3.09Å; R7-K11 WeakPolarHBondContact O-CB 3.4Å; R7-K11 PolarHBondContact O-N 3.46Å |
| 8 | K | 90.7 | Very high | 87.5 | Confident | 122 Ų | 122 | 116.9 Ų | 116.9 | 53% | 0.53 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.9 | -42.4 | 176.5 | -76.9 | 179.8 | -180 | -178.2 | 0 | 111.5 | R4 Q5 E6 K11 C12 | R4-K8 WeakPolarHBondContact O-CG 3.1Å; R4-K8 PolarHBondContact O-N 3Å; Q5-K8 PolarHBondContact O-N 2.98Å; E6-K8 VanDerWaalsContact C-N 3.33Å; E6-K8 PolarHBondContact O-N 2.76Å; K8-K11 PolarHBondContact O-N 3.4Å; K8-C12 WeakPolarHBondContact O-CB 3.47Å; K8-C12 PolarHBondContact O-N 3.07Å |
| 9 | Y | 90.4 | Very high | 87.6 | Confident | 136 Ų | 136 | 117.8 Ų | 117.8 | 53% | 0.533 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.5 | -48.5 | 178.2 | -179 | -104.3 | 0 | 0 | 0 | 111.4 | Q5 E6 K11 C12 L13 | Q5-Y9 WeakPolarHBondContact O-CB 3.21Å; Q5-Y9 PolarHBondContact O-N 3.03Å; E6-Y9 PolarHBondContact O-N 2.99Å; Y9-K11 VanDerWaalsContact C-N 3.34Å; Y9-K11 PolarHBondContact O-N 3.26Å; Y9-C12 WeakPolarHBondContact O-CB 3.21Å; Y9-C12 PolarHBondContact O-N 3.4Å; Y9-C12 VanDerWaalsContact O-N 3.12Å; Y9-L13 HydrophobicContact CD1-CD1 3.94Å; Y9-L13 HydrophobicContact CD1-CG 4.47Å; Y9-L13 HydrophobicContact CE1-CD1 3.42Å; Y9-L13 VanDerWaalsContact CE1-CD1 3.42Å; Y9-L13 HydrophobicContact CE1-CG 4.1Å; Y9-L13 PolarHBondContact O-N 3.24Å |
| 10 | L | 91 | Very high | 87.7 | Confident | 91 Ų | 91 | 116 Ų | 116 | 48% | 0.476 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.6 | -43.1 | 175.8 | -70.3 | 173.9 | 0 | 0 | 0 | 112 | E6 C12 L13 V14 | E6-L10 HydrophobicContact CG-CD1 4.28Å; E6-L10 WeakPolarHBondContact O-CG 3.49Å; E6-L10 PolarHBondContact O-N 2.85Å; L10-C12 VanDerWaalsContact C-N 3.3Å; L10-C12 PolarHBondContact O-N 3.48Å; L10-L13 WeakPolarHBondContact O-CB 3.46Å; L10-L13 PolarHBondContact O-N 2.97Å; L10-V14 WeakPolarHBondContact O-CG2 3.26Å; L10-V14 PolarHBondContact O-N 2.78Å |
| 11 | K | 91.9 | Very high | 87.6 | Confident | 144 Ų | 144 | 115.3 Ų | 115.3 | 63% | 0.626 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.8 | -38.3 | 175.5 | -171.8 | 171 | -175.6 | 174.1 | 0 | 112.3 | R7 K8 Y9 V14 N15 | R7-K11 WeakPolarHBondContact O-CB 3.4Å; R7-K11 PolarHBondContact O-N 3.46Å; K8-K11 PolarHBondContact O-N 3.4Å; Y9-K11 VanDerWaalsContact C-N 3.34Å; Y9-K11 PolarHBondContact O-N 3.26Å; K11-V14 PolarHBondContact O-N 3.37Å; K11-N15 WeakPolarHBondContact O-CB 3.49Å; K11-N15 PolarHBondContact O-N 3.23Å; K11-N15 PolarHBondContact O-OD1 3.16Å |
| 12 | C | 91.9 | Very high | 88.9 | Confident | 72 Ų | 72 | 112.4 Ų | 112.4 | 49% | 0.486 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64 | -41.9 | 175.4 | -167.8 | 0 | 0 | 0 | 0 | 111.7 | K8 Y9 L10 N15 T16 | K8-C12 WeakPolarHBondContact O-CB 3.47Å; K8-C12 PolarHBondContact O-N 3.07Å; Y9-C12 WeakPolarHBondContact O-CB 3.21Å; Y9-C12 PolarHBondContact O-N 3.4Å; Y9-C12 VanDerWaalsContact O-N 3.12Å; L10-C12 VanDerWaalsContact C-N 3.3Å; L10-C12 PolarHBondContact O-N 3.48Å; C12-N15 PolarHBondContact O-N 2.89Å; C12-T16 WeakPolarHBondContact O-CB 3.27Å; C12-T16 PolarHBondContact O-N 3.26Å; C12-T16 PolarHBondContact O-OG1 2.9Å |
| 13 | L | 90.7 | Very high | 88.9 | Confident | 81 Ų | 81 | 113 Ų | 113 | 42% | 0.424 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.3 | -46 | 176.2 | -70.5 | 178 | 0 | 0 | 0 | 112 | Y9 L10 T16 A17 | Y9-L13 HydrophobicContact CD1-CD1 3.94Å; Y9-L13 HydrophobicContact CD1-CG 4.47Å; Y9-L13 HydrophobicContact CE1-CD1 3.42Å; Y9-L13 VanDerWaalsContact CE1-CD1 3.42Å; Y9-L13 HydrophobicContact CE1-CG 4.1Å; Y9-L13 PolarHBondContact O-N 3.24Å; L10-L13 WeakPolarHBondContact O-CB 3.46Å; L10-L13 PolarHBondContact O-N 2.97Å; L13-T16 PolarHBondContact O-N 3.09Å; L13-A17 WeakPolarHBondContact O-CB 3.3Å; L13-A17 PolarHBondContact O-N 3.07Å |
| 14 | V | 91 | Very high | 88.8 | Confident | 78 Ų | 78 | 106.3 Ų | 106.3 | 47% | 0.473 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.4 | -50.1 | 176.5 | 173 | 0 | 0 | 0 | 0 | 110.7 | L10 K11 T16 A17 E18 | L10-V14 WeakPolarHBondContact O-CG2 3.26Å; L10-V14 PolarHBondContact O-N 2.78Å; K11-V14 PolarHBondContact O-N 3.37Å; V14-T16 VanDerWaalsContact C-N 3.26Å; V14-T16 PolarHBondContact O-N 3.47Å; V14-A17 WeakPolarHBondContact O-CB 3.44Å; V14-A17 PolarHBondContact O-N 3.36Å; V14-A17 VanDerWaalsContact O-N 3.13Å; V14-E18 HydrophobicContact CG1-CG 4.44Å; V14-E18 WeakPolarHBondContact O-CG 3.42Å; V14-E18 PolarHBondContact O-N 3.32Å |
| 15 | N | 93 | Very high | 88.5 | Confident | 72 Ų | 72 | 100.4 Ų | 100.4 | 39% | 0.385 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.7 | -36.6 | 178.3 | -70.1 | -1.3 | 0 | 0 | 0 | 112.6 | K11 C12 K19 | K11-N15 WeakPolarHBondContact O-CB 3.49Å; K11-N15 PolarHBondContact O-N 3.23Å; K11-N15 PolarHBondContact O-OD1 3.16Å; C12-N15 PolarHBondContact O-N 2.89Å; N15-K19 WeakPolarHBondContact O-CG 3.33Å; N15-K19 PolarHBondContact O-N 3.04Å; N15-K19 VanDerWaalsContact O-N 3.09Å |
| 16 | T | 92.5 | Very high | 88.3 | Confident | 76 Ų | 76 | 100.6 Ų | 100.6 | 47% | 0.466 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -70.9 | -40.6 | 178.5 | -57 | 0 | 0 | 0 | 0 | 110.8 | C12 L13 V14 T20 | C12-T16 WeakPolarHBondContact O-CB 3.27Å; C12-T16 PolarHBondContact O-N 3.26Å; C12-T16 PolarHBondContact O-OG1 2.9Å; L13-T16 PolarHBondContact O-N 3.09Å; V14-T16 VanDerWaalsContact C-N 3.26Å; V14-T16 PolarHBondContact O-N 3.47Å; T16-T20 WeakPolarHBondContact O-CB 3.45Å; T16-T20 PolarHBondContact O-N 3.06Å; T16-T20 PolarHBondContact O-OG1 3.22Å |
| 17 | A | 89 | Confident | 88 | Confident | 57 Ų | 57 | 101.9 Ų | 101.9 | 47% | 0.471 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.6 | -46.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | L13 V14 T20 V21 | L13-A17 WeakPolarHBondContact O-CB 3.3Å; L13-A17 PolarHBondContact O-N 3.07Å; V14-A17 WeakPolarHBondContact O-CB 3.44Å; V14-A17 PolarHBondContact O-N 3.36Å; V14-A17 VanDerWaalsContact O-N 3.13Å; A17-T20 PolarHBondContact O-N 2.89Å; A17-V21 WeakPolarHBondContact O-CG2 3.3Å; A17-V21 PolarHBondContact O-N 3.26Å |
| 18 | E | 89.8 | Confident | 86.9 | Confident | 107 Ų | 107 | 95.3 Ų | 95.3 | 50% | 0.5 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.2 | -51.8 | 176.7 | -75.2 | 175.1 | 172.5 | 0 | 0 | 111.7 | V14 T20 V21 E22 | V14-E18 HydrophobicContact CG1-CG 4.44Å; V14-E18 WeakPolarHBondContact O-CG 3.42Å; V14-E18 PolarHBondContact O-N 3.32Å; E18-T20 VanDerWaalsContact C-N 3.26Å; E18-T20 PolarHBondContact O-N 2.91Å; E18-V21 WeakPolarHBondContact O-CB 3.32Å; E18-V21 PolarHBondContact O-N 2.96Å; E18-V21 VanDerWaalsContact O-N 3.07Å; E18-E22 PolarHBondContact O-N 2.9Å |
| 19 | K | 90.3 | Very high | 85.8 | Confident | 135 Ų | 135 | 98 Ų | 98 | 59% | 0.587 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.1 | -37.5 | 177.4 | -76.6 | -177.6 | 177.8 | -173.2 | 0 | 113.1 | N15 V21 E22 Q23 | N15-K19 WeakPolarHBondContact O-CG 3.33Å; N15-K19 PolarHBondContact O-N 3.04Å; N15-K19 VanDerWaalsContact O-N 3.09Å; K19-V21 VanDerWaalsContact C-N 3.32Å; K19-E22 PolarHBondContact O-N 3.35Å; K19-Q23 WeakPolarHBondContact O-CB 3.46Å; K19-Q23 VanDerWaalsContact O-CG 3.3Å; K19-Q23 WeakPolarHBondContact O-CG 3.32Å; K19-Q23 PolarHBondContact O-N 2.84Å |
| 20 | T | 90 | Very high | 84.8 | Confident | 81 Ų | 81 | 98.7 Ų | 98.7 | 50% | 0.497 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.9 | -36.7 | 178.8 | -54.7 | 0 | 0 | 0 | 0 | 111 | T16 A17 E18 A24 | T16-T20 WeakPolarHBondContact O-CB 3.45Å; T16-T20 PolarHBondContact O-N 3.06Å; T16-T20 PolarHBondContact O-OG1 3.22Å; A17-T20 PolarHBondContact O-N 2.89Å; E18-T20 VanDerWaalsContact C-N 3.26Å; E18-T20 PolarHBondContact O-N 2.91Å; T20-A24 WeakPolarHBondContact O-CB 3.45Å; T20-A24 PolarHBondContact O-N 2.71Å; T20-A24 VanDerWaalsContact O-N 3.09Å |
| 21 | V | 86 | Confident | 83.6 | Confident | 102 Ų | 102 | 101 Ų | 101 | 62% | 0.618 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -68.4 | -44.7 | 175.1 | 173 | 0 | 0 | 0 | 0 | 110.9 | A17 E18 K19 A24 A25 | A17-V21 WeakPolarHBondContact O-CG2 3.3Å; A17-V21 PolarHBondContact O-N 3.26Å; E18-V21 WeakPolarHBondContact O-CB 3.32Å; E18-V21 PolarHBondContact O-N 2.96Å; E18-V21 VanDerWaalsContact O-N 3.07Å; K19-V21 VanDerWaalsContact C-N 3.32Å; V21-A24 PolarHBondContact O-N 3.09Å; V21-A25 PolarHBondContact O-N 3.26Å |
| 22 | E | 85.8 | Confident | 82.2 | Confident | 122 Ų | 122 | 103.1 Ų | 103.1 | 57% | 0.57 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -59.2 | -48.5 | 176 | -72.8 | 176.3 | 170.8 | 0 | 0 | 111.9 | E18 K19 A24 A25 E26 | E18-E22 PolarHBondContact O-N 2.9Å; K19-E22 PolarHBondContact O-N 3.35Å; E22-A24 VanDerWaalsContact C-N 3.29Å; E22-A24 PolarHBondContact O-N 3.35Å; E22-A25 WeakPolarHBondContact O-CB 3.36Å; E22-A25 PolarHBondContact O-N 2.97Å; E22-A25 VanDerWaalsContact O-N 3.13Å; E22-E26 PolarHBondContact O-N 3.46Å |
| 23 | Q | 84.4 | Confident | 80.5 | Confident | 121 Ų | 121 | 104.2 Ų | 104.2 | 57% | 0.565 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.2 | -36.6 | 177.5 | -74.2 | -179.8 | -14.4 | 0 | 0 | 112.6 | K19 A25 L27 | K19-Q23 WeakPolarHBondContact O-CB 3.46Å; K19-Q23 VanDerWaalsContact O-CG 3.3Å; K19-Q23 WeakPolarHBondContact O-CG 3.32Å; K19-Q23 PolarHBondContact O-N 2.84Å; Q23-A25 VanDerWaalsContact C-N 3.34Å; Q23-L27 WeakPolarHBondContact O-CB 2.82Å; Q23-L27 WeakPolarHBondContact O-CG 2.86Å; Q23-L27 PolarHBondContact O-N 2.88Å; Q23-L27 VanDerWaalsContact O-N 3.09Å |
| 24 | A | 82.2 | Confident | 79 | Confident | 56 Ų | 56 | 105.5 Ų | 105.5 | 46% | 0.463 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.6 | -39.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | T20 V21 E22 E28 | T20-A24 WeakPolarHBondContact O-CB 3.45Å; T20-A24 PolarHBondContact O-N 2.71Å; T20-A24 VanDerWaalsContact O-N 3.09Å; V21-A24 PolarHBondContact O-N 3.09Å; E22-A24 VanDerWaalsContact C-N 3.29Å; E22-A24 PolarHBondContact O-N 3.35Å; A24-E28 WeakPolarHBondContact O-CB 3.43Å; A24-E28 PolarHBondContact O-N 3.27Å |
| 25 | A | 77.7 | Confident | 77.5 | Confident | 53 Ų | 53 | 105.8 Ų | 105.8 | 44% | 0.438 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -68.1 | -43.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | V21 E22 Q23 L27 E28 E29 | V21-A25 PolarHBondContact O-N 3.26Å; E22-A25 WeakPolarHBondContact O-CB 3.36Å; E22-A25 PolarHBondContact O-N 2.97Å; E22-A25 VanDerWaalsContact O-N 3.13Å; Q23-A25 VanDerWaalsContact C-N 3.34Å; A25-L27 PolarHBondContact O-N 3.21Å; A25-E28 WeakPolarHBondContact O-CA 3.17Å; A25-E28 VanDerWaalsContact O-CB 3.27Å; A25-E28 WeakPolarHBondContact O-CB 3.48Å; A25-E28 PolarHBondContact O-N 3.04Å; A25-E29 PolarHBondContact O-N 2.91Å; A25-E29 VanDerWaalsContact O-N 3.07Å |
| 26 | E | 80.7 | Confident | 76 | Confident | 111 Ų | 111 | 105.6 Ų | 105.6 | 52% | 0.519 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -63.4 | -41.4 | 177.6 | -76.4 | -172.1 | -169 | 0 | 0 | 113.3 | E22 E28 K30 | E22-E26 PolarHBondContact O-N 3.46Å; E26-E28 PolarHBondContact O-N 3.13Å; E26-K30 WeakPolarHBondContact O-CG 3.34Å; E26-K30 PolarHBondContact O-N 3.41Å |
| 27 | L | 78.5 | Confident | 74.6 | Confident | 123 Ų | 123 | 109.4 Ų | 109.4 | 64% | 0.644 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -63.6 | -21.6 | 175.1 | -78.8 | 171.9 | 0 | 0 | 0 | 112.1 | Q23 A25 | Q23-L27 WeakPolarHBondContact O-CB 2.82Å; Q23-L27 WeakPolarHBondContact O-CG 2.86Å; Q23-L27 PolarHBondContact O-N 2.88Å; Q23-L27 VanDerWaalsContact O-N 3.09Å; A25-L27 PolarHBondContact O-N 3.21Å |
| 28 | E | 68.2 | Low | 73.7 | Confident | 62 Ų | 62 | 108.6 Ų | 108.6 | 29% | 0.29 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -84.6 | -45.8 | -179.5 | -172.1 | 163.6 | 163.2 | 0 | 0 | 113 | A24 A25 E26 K30 K31 W46 | A24-E28 WeakPolarHBondContact O-CB 3.43Å; A24-E28 PolarHBondContact O-N 3.27Å; A25-E28 WeakPolarHBondContact O-CA 3.17Å; A25-E28 VanDerWaalsContact O-CB 3.27Å; A25-E28 WeakPolarHBondContact O-CB 3.48Å; A25-E28 PolarHBondContact O-N 3.04Å; E26-E28 PolarHBondContact O-N 3.13Å; E28-K30 PolarHBondContact O-N 2.99Å; E28-K30 VanDerWaalsContact O-N 3.16Å; E28-K31 WeakPolarHBondContact O-CB 3.39Å; E28-K31 PolarHBondContact O-N 3.07Å; E28-W46 VanDerWaalsContact CD-NE1 3.29Å; E28-W46 WeakPolarHBondContact OE1-CH2 3.45Å; E28-W46 WeakPolarHBondContact OE1-CZ2 3.45Å; E28-W46 PolarHBondContact OE1-NE1 3.48Å; E28-W46 WeakPolarHBondContact OE2-CZ2 3.39Å; E28-W46 PolarHBondContact OE2-NE1 3.12Å |
| 29 | E | 66.3 | Low | 72.9 | Confident | 177 Ų | 177 | 109.2 Ų | 109.2 | 83% | 0.827 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -56.2 | -32.4 | 173.8 | -73.9 | -169.4 | 164.1 | 0 | 0 | 112 | A25 K31 | A25-E29 PolarHBondContact O-N 2.91Å; A25-E29 VanDerWaalsContact O-N 3.07Å; E29-K31 PolarHBondContact O-N 3.03Å |
| 30 | K | 71 | Confident | 72.5 | Confident | 151 Ų | 151 | 109.6 Ų | 109.6 | 66% | 0.657 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | -11.1 | 178.5 | -72.4 | 171.5 | -178.3 | 161.9 | 0 | 114.3 | E26 E28 K32 | E26-K30 WeakPolarHBondContact O-CG 3.34Å; E26-K30 PolarHBondContact O-N 3.41Å; E28-K30 PolarHBondContact O-N 2.99Å; E28-K30 VanDerWaalsContact O-N 3.16Å; K30-K32 PolarHBondContact O-N 3.48Å |
| 31 | K | 65.6 | Low | 72.3 | Confident | 141 Ų | 141 | 112.2 Ų | 112.2 | 61% | 0.613 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -76.2 | 95 | 175.3 | -71.3 | 179.4 | -176.4 | 167.2 | 0 | 110.2 | E28 E29 | E28-K31 WeakPolarHBondContact O-CB 3.39Å; E28-K31 PolarHBondContact O-N 3.07Å; E29-K31 PolarHBondContact O-N 3.03Å |
| 32 | K | 61.8 | Low | 72.3 | Confident | 187 Ų | 187 | 111.9 Ų | 111.9 | 81% | 0.813 | 58% | 0.58 | S | S | * | * | trans | -45.3 | 132.9 | 172.6 | -69.7 | -176.6 | 179 | -178.3 | 0 | 111.2 | K30 L34 | K30-K32 PolarHBondContact O-N 3.48Å; K32-L34 PolarHBondContact O-N 3.49Å | ||
| 33 | P | 56.5 | Low | 72.4 | Confident | 95 Ų | 95 | 108.1 Ų | 108.1 | 62% | 0.617 | 57% | 0.565 | S | S | * | * | trans | -68.2 | 106.2 | -179.7 | 23.9 | -29.3 | 0 | 0 | 0 | 110 | A35 Y39 | P33-A35 PolarHBondContact O-N 3.09Å; P33-Y39 HydrophobicContact CB-CD2 3.59Å; P33-Y39 HydrophobicContact CB-CE2 3.86Å; P33-Y39 HydrophobicContact CB-CG 4.13Å | ||
| 34 | L | 58.6 | Low | 72.6 | Confident | 108 Ų | 108 | 106.8 Ų | 106.8 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | trans | -71.3 | 97.3 | 172.5 | -90.5 | 143.6 | 0 | 0 | 0 | 109.3 | K32 S38 Y39 | K32-L34 PolarHBondContact O-N 3.49Å; L34-S38 WeakPolarHBondContact CB-OG 3.33Å; L34-S38 CarbonylContact O-C 3.58Å; L34-S38 WeakPolarHBondContact O-CB 3.48Å; L34-S38 PolarHBondContact O-OG 3.37Å; L34-Y39 PolarHBondContact O-N 2.85Å | ||
| 35 | A | 59.3 | Low | 72.9 | Confident | 85 Ų | 85 | 108.2 Ų | 108.2 | 70% | 0.702 | 56% | 0.558 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 27.2 | 100.1 | 164 | 0 | 0 | 0 | 0 | 0 | 116 | P33 L37 S38 | P33-A35 PolarHBondContact O-N 3.09Å; A35-L37 PolarHBondContact O-N 3.06Å; A35-S38 PolarHBondContact O-N 3.48Å; A35-S38 VanDerWaalsContact O-N 3.15Å |
| 36 | G | 61.6 | Low | 73.5 | Confident | 67 Ų | 67 | 109.1 Ų | 109.1 | 69% | 0.691 | 55% | 0.55 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 55.7 | -74.7 | 155.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||
| 37 | L | 63 | Low | 74 | Confident | 156 Ų | 156 | 108.2 Ų | 108.2 | 82% | 0.817 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -90.8 | -37.3 | -175.7 | -70.3 | 165 | 0 | 0 | 0 | 112.5 | A35 Y39 K41 | A35-L37 PolarHBondContact O-N 3.06Å; L37-Y39 VanDerWaalsContact C-N 3.28Å; L37-Y39 PolarHBondContact O-N 3.3Å; L37-K41 PolarHBondContact O-N 3.01Å |
| 38 | S | 70.3 | Confident | 74.7 | Confident | 41 Ų | 41 | 106.9 Ų | 106.9 | 29% | 0.287 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.7 | -35.8 | 175.6 | 135 | 0 | 0 | 0 | 0 | 110.5 | L34 A35 K42 | L34-S38 WeakPolarHBondContact CB-OG 3.33Å; L34-S38 CarbonylContact O-C 3.58Å; L34-S38 WeakPolarHBondContact O-CB 3.48Å; L34-S38 PolarHBondContact O-OG 3.37Å; A35-S38 PolarHBondContact O-N 3.48Å; A35-S38 VanDerWaalsContact O-N 3.15Å; S38-K42 VanDerWaalsContact O-CB 3.26Å; S38-K42 WeakPolarHBondContact O-CB 3.48Å; S38-K42 WeakPolarHBondContact O-CG 3.46Å; S38-K42 PolarHBondContact O-N 2.77Å; S38-K42 PolarHBondContact OG-NZ 2.9Å |
| 39 | Y | 73.8 | Confident | 75.9 | Confident | 120 Ų | 120 | 111.9 Ų | 111.9 | 47% | 0.471 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.7 | -55.8 | 177.3 | -177.6 | -105.6 | 0 | 0 | 0 | 111.3 | P33 L34 L37 K41 K42 T43 | P33-Y39 HydrophobicContact CB-CD2 3.59Å; P33-Y39 HydrophobicContact CB-CE2 3.86Å; P33-Y39 HydrophobicContact CB-CG 4.13Å; L34-Y39 PolarHBondContact O-N 2.85Å; L37-Y39 VanDerWaalsContact C-N 3.28Å; L37-Y39 PolarHBondContact O-N 3.3Å; Y39-K41 VanDerWaalsContact C-N 3.3Å; Y39-K41 PolarHBondContact O-N 3.07Å; Y39-K42 CarbonylContact O-C 3.59Å; Y39-K42 PolarHBondContact O-N 3.49Å; Y39-T43 WeakPolarHBondContact O-CB 3.36Å; Y39-T43 PolarHBondContact O-N 3.26Å; Y39-T43 PolarHBondContact O-OG1 2.85Å |
| 40 | K | 82.1 | Confident | 77.1 | Confident | 143 Ų | 143 | 105.7 Ų | 105.7 | 62% | 0.622 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -55.2 | -44.9 | 179.4 | -174.2 | 177.2 | -178.8 | 179.6 | 0 | 112 | T43 I44 | K40-T43 PolarHBondContact O-N 3.25Å; K40-I44 HydrophobicContact CG-CD1 4.08Å; K40-I44 VanDerWaalsContact O-CG1 3.3Å; K40-I44 WeakPolarHBondContact O-CG1 3.33Å; K40-I44 PolarHBondContact O-N 2.88Å |
| 41 | K | 85.4 | Confident | 78.2 | Confident | 136 Ų | 136 | 105 Ų | 105 | 59% | 0.591 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.1 | -47 | 176.7 | -175.1 | 176.3 | 175.6 | 179.7 | 0 | 111.8 | L37 Y39 T43 I44 E45 | L37-K41 PolarHBondContact O-N 3.01Å; Y39-K41 VanDerWaalsContact C-N 3.3Å; Y39-K41 PolarHBondContact O-N 3.07Å; K41-T43 VanDerWaalsContact C-N 3.34Å; K41-T43 PolarHBondContact O-N 3.09Å; K41-I44 PolarHBondContact O-N 3.31Å; K41-E45 WeakPolarHBondContact CE-OE1 3.33Å; K41-E45 WeakPolarHBondContact O-CG 3.41Å; K41-E45 PolarHBondContact O-N 3.29Å |
| 42 | K | 84.9 | Confident | 79.6 | Confident | 95 Ų | 95 | 100.5 Ų | 100.5 | 41% | 0.413 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.7 | -38.5 | 177.2 | -77.5 | 170.6 | 177.5 | 155.8 | 0 | 112.6 | S38 Y39 E45 W46 | S38-K42 VanDerWaalsContact O-CB 3.26Å; S38-K42 WeakPolarHBondContact O-CB 3.48Å; S38-K42 WeakPolarHBondContact O-CG 3.46Å; S38-K42 PolarHBondContact O-N 2.77Å; S38-K42 PolarHBondContact OG-NZ 2.9Å; Y39-K42 CarbonylContact O-C 3.59Å; Y39-K42 PolarHBondContact O-N 3.49Å; K42-E45 PolarHBondContact O-N 2.97Å; K42-W46 WeakPolarHBondContact O-CB 3.4Å; K42-W46 PolarHBondContact O-N 3.13Å |
| 43 | T | 88.2 | Confident | 81.1 | Confident | 43 Ų | 43 | 98.5 Ų | 98.5 | 26% | 0.264 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.7 | -44.5 | 175.3 | -55.8 | 0 | 0 | 0 | 0 | 110.7 | Y39 K40 K41 W46 L47 | Y39-T43 WeakPolarHBondContact O-CB 3.36Å; Y39-T43 PolarHBondContact O-N 3.26Å; Y39-T43 PolarHBondContact O-OG1 2.85Å; K40-T43 PolarHBondContact O-N 3.25Å; K41-T43 VanDerWaalsContact C-N 3.34Å; K41-T43 PolarHBondContact O-N 3.09Å; T43-W46 PolarHBondContact O-N 2.89Å; T43-L47 HydrophobicContact CG2-CD1 4.26Å; T43-L47 WeakPolarHBondContact O-CB 3.44Å; T43-L47 WeakPolarHBondContact O-CG 3.36Å; T43-L47 PolarHBondContact O-N 2.97Å |
| 44 | I | 88.4 | Confident | 82.9 | Confident | 92 Ų | 92 | 98.4 Ų | 98.4 | 47% | 0.472 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.1 | -47.5 | 175.7 | -68.2 | 167 | 0 | 0 | 0 | 110.7 | K40 K41 W46 L47 V48 | K40-I44 HydrophobicContact CG-CD1 4.08Å; K40-I44 VanDerWaalsContact O-CG1 3.3Å; K40-I44 WeakPolarHBondContact O-CG1 3.33Å; K40-I44 PolarHBondContact O-N 2.88Å; K41-I44 PolarHBondContact O-N 3.31Å; I44-W46 VanDerWaalsContact C-N 3.27Å; I44-W46 PolarHBondContact O-N 3.26Å; I44-L47 PolarHBondContact O-N 3.15Å; I44-V48 HydrophobicContact CG2-CG2 4.47Å; I44-V48 VanDerWaalsContact O-CG2 3.32Å; I44-V48 WeakPolarHBondContact O-CG2 3.02Å; I44-V48 PolarHBondContact O-N 3.34Å |
| 45 | E | 89.7 | Confident | 84.7 | Confident | 86 Ų | 86 | 98 Ų | 98 | 40% | 0.402 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -59.6 | -39.4 | 176.6 | -75 | 175.6 | -170.8 | 0 | 0 | 111.9 | K41 K42 R49 | K41-E45 WeakPolarHBondContact CE-OE1 3.33Å; K41-E45 WeakPolarHBondContact O-CG 3.41Å; K41-E45 PolarHBondContact O-N 3.29Å; K42-E45 PolarHBondContact O-N 2.97Å; E45-R49 WeakPolarHBondContact O-CG 3.47Å; E45-R49 PolarHBondContact O-N 3.33Å |
| 46 | W | 89.6 | Confident | 86.4 | Confident | 73 Ų | 73 | 100.6 Ų | 100.6 | 28% | 0.277 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.2 | -46.9 | 174.7 | 174.7 | 91.7 | 0 | 0 | 0 | 111.6 | E28 K42 T43 I44 V48 R49 Q50 | E28-W46 VanDerWaalsContact CD-NE1 3.29Å; E28-W46 WeakPolarHBondContact OE1-CH2 3.45Å; E28-W46 WeakPolarHBondContact OE1-CZ2 3.45Å; E28-W46 PolarHBondContact OE1-NE1 3.48Å; E28-W46 WeakPolarHBondContact OE2-CZ2 3.39Å; E28-W46 PolarHBondContact OE2-NE1 3.12Å; K42-W46 WeakPolarHBondContact O-CB 3.4Å; K42-W46 PolarHBondContact O-N 3.13Å; T43-W46 PolarHBondContact O-N 2.89Å; I44-W46 VanDerWaalsContact C-N 3.27Å; I44-W46 PolarHBondContact O-N 3.26Å; W46-V48 VanDerWaalsContact C-N 3.31Å; W46-V48 PolarHBondContact O-N 2.99Å; W46-R49 WeakPolarHBondContact O-CB 3.42Å; W46-R49 PolarHBondContact O-N 3.12Å; W46-R49 VanDerWaalsContact O-N 3.09Å; W46-Q50 HydrophobicContact CD2-CG 3.93Å; W46-Q50 VanDerWaalsContact CE2-NE2 3.33Å; W46-Q50 HydrophobicContact CE3-CG 4.34Å; W46-Q50 HydrophobicContact CH2-CG 3.8Å; W46-Q50 HydrophobicContact CZ2-CG 3.27Å; W46-Q50 HydrophobicContact CZ3-CG 4.31Å; W46-Q50 VanDerWaalsContact NE1-NE2 3.11Å; W46-Q50 WeakPolarHBondContact O-CG 3.48Å; W46-Q50 PolarHBondContact O-N 3.1Å |
| 47 | L | 92.3 | Very high | 88 | Confident | 92 Ų | 92 | 102.8 Ų | 102.8 | 48% | 0.482 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.8 | -41.6 | 176.4 | -76.3 | 170.6 | 0 | 0 | 0 | 111.7 | T43 I44 R49 Q50 K51 | T43-L47 HydrophobicContact CG2-CD1 4.26Å; T43-L47 WeakPolarHBondContact O-CB 3.44Å; T43-L47 WeakPolarHBondContact O-CG 3.36Å; T43-L47 PolarHBondContact O-N 2.97Å; I44-L47 PolarHBondContact O-N 3.15Å; L47-R49 VanDerWaalsContact C-N 3.35Å; L47-R49 PolarHBondContact O-N 3.41Å; L47-Q50 PolarHBondContact O-N 2.84Å; L47-K51 WeakPolarHBondContact O-CB 3.5Å; L47-K51 PolarHBondContact O-N 3.2Å |
| 48 | V | 92.8 | Very high | 89.5 | Confident | 95 Ų | 95 | 99.1 Ų | 99.1 | 58% | 0.576 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -62.1 | -42.9 | 175.5 | 170.3 | 0 | 0 | 0 | 0 | 111 | I44 W46 K51 S52 | I44-V48 HydrophobicContact CG2-CG2 4.47Å; I44-V48 VanDerWaalsContact O-CG2 3.32Å; I44-V48 WeakPolarHBondContact O-CG2 3.02Å; I44-V48 PolarHBondContact O-N 3.34Å; W46-V48 VanDerWaalsContact C-N 3.31Å; W46-V48 PolarHBondContact O-N 2.99Å; V48-K51 PolarHBondContact O-N 3.4Å; V48-S52 PolarHBondContact O-N 2.96Å |
| 49 | R | 93.2 | Very high | 90.7 | Very high | 167 Ų | 167 | 103.2 Ų | 103.2 | 63% | 0.63 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.7 | -40.6 | 176.1 | -72.7 | 174.8 | -176 | -173 | 3.2 | 112 | E45 W46 L47 S52 R53 | E45-R49 WeakPolarHBondContact O-CG 3.47Å; E45-R49 PolarHBondContact O-N 3.33Å; W46-R49 WeakPolarHBondContact O-CB 3.42Å; W46-R49 PolarHBondContact O-N 3.12Å; W46-R49 VanDerWaalsContact O-N 3.09Å; L47-R49 VanDerWaalsContact C-N 3.35Å; L47-R49 PolarHBondContact O-N 3.41Å; R49-S52 PolarHBondContact O-N 3.01Å; R49-R53 WeakPolarHBondContact O-CG 3.34Å; R49-R53 PolarHBondContact O-N 3.43Å |
| 50 | Q | 92.2 | Very high | 91.8 | Very high | 46 Ų | 46 | 103.4 Ų | 103.4 | 22% | 0.215 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -67.4 | -44.6 | 177 | -66 | -56.5 | -10.9 | 0 | 0 | 112 | W46 L47 S52 R53 I54 | W46-Q50 HydrophobicContact CD2-CG 3.93Å; W46-Q50 VanDerWaalsContact CE2-NE2 3.33Å; W46-Q50 HydrophobicContact CE3-CG 4.34Å; W46-Q50 HydrophobicContact CH2-CG 3.8Å; W46-Q50 HydrophobicContact CZ2-CG 3.27Å; W46-Q50 HydrophobicContact CZ3-CG 4.31Å; W46-Q50 VanDerWaalsContact NE1-NE2 3.11Å; W46-Q50 WeakPolarHBondContact O-CG 3.48Å; W46-Q50 PolarHBondContact O-N 3.1Å; L47-Q50 PolarHBondContact O-N 2.84Å; Q50-S52 VanDerWaalsContact C-N 3.28Å; Q50-S52 PolarHBondContact O-N 2.97Å; Q50-R53 WeakPolarHBondContact O-CB 3.44Å; Q50-R53 PolarHBondContact O-N 2.99Å; Q50-I54 WeakPolarHBondContact O-CG1 3.35Å; Q50-I54 PolarHBondContact O-N 3.48Å |
| 51 | K | 93.5 | Very high | 92.4 | Very high | 136 Ų | 136 | 101.2 Ų | 101.2 | 59% | 0.591 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -53 | -48.8 | 174.2 | -179.4 | 178.2 | 172.1 | -179.9 | 0 | 110.8 | L47 V48 R53 I54 E55 | L47-K51 WeakPolarHBondContact O-CB 3.5Å; L47-K51 PolarHBondContact O-N 3.2Å; V48-K51 PolarHBondContact O-N 3.4Å; K51-R53 VanDerWaalsContact C-N 3.35Å; K51-R53 PolarHBondContact O-N 3.07Å; K51-I54 PolarHBondContact O-N 3.18Å; K51-E55 WeakPolarHBondContact CE-OE1 3.48Å; K51-E55 WeakPolarHBondContact O-CG 3.36Å; K51-E55 PolarHBondContact O-N 2.93Å |
| 52 | S | 94.2 | Very high | 92.9 | Very high | 47 Ų | 47 | 98.5 Ų | 98.5 | 33% | 0.329 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.4 | -36.6 | 177.8 | -176.3 | 0 | 0 | 0 | 0 | 113.4 | V48 R49 Q50 K56 | V48-S52 PolarHBondContact O-N 2.96Å; R49-S52 PolarHBondContact O-N 3.01Å; Q50-S52 VanDerWaalsContact C-N 3.28Å; Q50-S52 PolarHBondContact O-N 2.97Å; S52-K56 WeakPolarHBondContact O-CG 3.3Å; S52-K56 PolarHBondContact O-N 3.27Å; S52-K56 VanDerWaalsContact O-N 3.15Å |
| 53 | R | 94.7 | Very high | 93.5 | Very high | 145 Ų | 145 | 95.6 Ų | 95.6 | 55% | 0.547 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -66.2 | -44.2 | 174.7 | -74.9 | 171.4 | 176.8 | -178 | -5.1 | 111.7 | R49 Q50 K51 K56 Q57 | R49-R53 WeakPolarHBondContact O-CG 3.34Å; R49-R53 PolarHBondContact O-N 3.43Å; Q50-R53 WeakPolarHBondContact O-CB 3.44Å; Q50-R53 PolarHBondContact O-N 2.99Å; K51-R53 VanDerWaalsContact C-N 3.35Å; K51-R53 PolarHBondContact O-N 3.07Å; R53-K56 PolarHBondContact O-N 2.98Å; R53-Q57 WeakPolarHBondContact O-CG 3.43Å; R53-Q57 PolarHBondContact O-N 3.48Å |
| 54 | I | 94.4 | Very high | 93.9 | Very high | 94 Ų | 94 | 98.6 Ų | 98.6 | 48% | 0.482 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63 | -44.9 | 177.8 | -68.1 | 166.9 | 0 | 0 | 0 | 109.9 | Q50 K51 K56 Q57 V58 | Q50-I54 WeakPolarHBondContact O-CG1 3.35Å; Q50-I54 PolarHBondContact O-N 3.48Å; K51-I54 PolarHBondContact O-N 3.18Å; I54-K56 VanDerWaalsContact C-N 3.31Å; I54-K56 PolarHBondContact O-N 3.22Å; I54-Q57 PolarHBondContact O-N 3.48Å; I54-Q57 VanDerWaalsContact O-N 3.12Å; I54-V58 HydrophobicContact CG2-CG2 4.28Å; I54-V58 WeakPolarHBondContact O-CG2 3.33Å; I54-V58 PolarHBondContact O-N 3.39Å |
| 55 | E | 94.5 | Very high | 94.2 | Very high | 98 Ų | 98 | 98.4 Ų | 98.4 | 46% | 0.458 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -56.3 | -44.2 | 175.4 | -75 | 168.9 | 173.2 | 0 | 0 | 111.9 | K51 V58 I59 | K51-E55 WeakPolarHBondContact CE-OE1 3.48Å; K51-E55 WeakPolarHBondContact O-CG 3.36Å; K51-E55 PolarHBondContact O-N 2.93Å; E55-V58 PolarHBondContact O-N 2.89Å; E55-I59 WeakPolarHBondContact O-CG1 3.45Å; E55-I59 PolarHBondContact O-N 3.25Å; E55-I59 VanDerWaalsContact O-N 3.07Å |
| 56 | K | 95.6 | Very high | 94.6 | Very high | 140 Ų | 140 | 97.7 Ų | 97.7 | 61% | 0.609 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.4 | -40.5 | 175.7 | -71.3 | 175.1 | -176.8 | -177.3 | 0 | 112.8 | S52 R53 I54 I59 M60 | S52-K56 WeakPolarHBondContact O-CG 3.3Å; S52-K56 PolarHBondContact O-N 3.27Å; S52-K56 VanDerWaalsContact O-N 3.15Å; R53-K56 PolarHBondContact O-N 2.98Å; I54-K56 VanDerWaalsContact C-N 3.31Å; I54-K56 PolarHBondContact O-N 3.22Å; K56-I59 PolarHBondContact O-N 3.38Å; K56-M60 PolarHBondContact O-N 3.01Å; K56-M60 VanDerWaalsContact O-N 3.1Å |
| 57 | Q | 95.6 | Very high | 95 | Very high | 114 Ų | 114 | 101.6 Ų | 101.6 | 53% | 0.533 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.7 | -41.8 | 176.7 | -73.7 | 176.6 | -2.9 | 0 | 0 | 111.5 | R53 I54 I59 M60 I61 | R53-Q57 WeakPolarHBondContact O-CG 3.43Å; R53-Q57 PolarHBondContact O-N 3.48Å; I54-Q57 PolarHBondContact O-N 3.48Å; I54-Q57 VanDerWaalsContact O-N 3.12Å; Q57-I59 PolarHBondContact O-N 2.88Å; Q57-M60 WeakPolarHBondContact O-CB 3.49Å; Q57-M60 PolarHBondContact O-N 3.04Å; Q57-I61 VanDerWaalsContact O-CG1 3.3Å; Q57-I61 WeakPolarHBondContact O-CG1 3.29Å; Q57-I61 PolarHBondContact O-N 3.13Å |
| 58 | V | 95 | Very high | 95.2 | Very high | 79 Ų | 79 | 99.6 Ų | 99.6 | 48% | 0.479 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.5 | -46.8 | 175.9 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | I54 E55 M60 I61 V62 | I54-V58 HydrophobicContact CG2-CG2 4.28Å; I54-V58 WeakPolarHBondContact O-CG2 3.33Å; I54-V58 PolarHBondContact O-N 3.39Å; E55-V58 PolarHBondContact O-N 2.89Å; V58-M60 VanDerWaalsContact C-N 3.31Å; V58-M60 PolarHBondContact O-N 3.28Å; V58-I61 PolarHBondContact O-N 3.42Å; V58-V62 HydrophobicContact CG1-CG2 4.33Å; V58-V62 VanDerWaalsContact O-CG2 3.29Å; V58-V62 WeakPolarHBondContact O-CG2 3.37Å; V58-V62 PolarHBondContact O-N 2.9Å |
| 59 | I | 95.7 | Very high | 95.4 | Very high | 126 Ų | 126 | 99 Ų | 99 | 65% | 0.646 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -58.7 | -43.9 | 176.9 | -67.9 | 164.9 | 0 | 0 | 0 | 111.1 | E55 K56 Q57 V62 G63 | E55-I59 WeakPolarHBondContact O-CG1 3.45Å; E55-I59 PolarHBondContact O-N 3.25Å; E55-I59 VanDerWaalsContact O-N 3.07Å; K56-I59 PolarHBondContact O-N 3.38Å; Q57-I59 PolarHBondContact O-N 2.88Å; I59-V62 PolarHBondContact O-N 3.09Å; I59-G63 PolarHBondContact O-N 3.37Å |
| 60 | M | 95.7 | Very high | 95.6 | Very high | 125 Ų | 125 | 97.1 Ų | 97.1 | 62% | 0.616 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.8 | -45.4 | 178.2 | -170.5 | -172.8 | -53.7 | 0 | 0 | 111.8 | K56 Q57 V58 G63 I64 | K56-M60 PolarHBondContact O-N 3.01Å; K56-M60 VanDerWaalsContact O-N 3.1Å; Q57-M60 WeakPolarHBondContact O-CB 3.49Å; Q57-M60 PolarHBondContact O-N 3.04Å; V58-M60 VanDerWaalsContact C-N 3.31Å; V58-M60 PolarHBondContact O-N 3.28Å; M60-G63 PolarHBondContact O-N 2.85Å; M60-I64 HydrophobicContact CG-CD1 4.25Å; M60-I64 WeakPolarHBondContact O-CG1 3.4Å; M60-I64 PolarHBondContact O-N 3.19Å |
| 61 | I | 95.3 | Very high | 95.8 | Very high | 96 Ų | 96 | 100.1 Ų | 100.1 | 49% | 0.492 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -45.4 | 178.9 | -70.1 | 166.3 | 0 | 0 | 0 | 110.6 | Q57 V58 G63 I64 I65 | Q57-I61 VanDerWaalsContact O-CG1 3.3Å; Q57-I61 WeakPolarHBondContact O-CG1 3.29Å; Q57-I61 PolarHBondContact O-N 3.13Å; V58-I61 PolarHBondContact O-N 3.42Å; I61-G63 VanDerWaalsContact C-N 3.29Å; I61-G63 PolarHBondContact O-N 2.92Å; I61-I64 PolarHBondContact O-N 2.9Å; I61-I64 VanDerWaalsContact O-N 3.13Å; I61-I65 HydrophobicContact CG2-CD1 3.74Å; I61-I65 HydrophobicContact CG2-CG1 4.35Å; I61-I65 WeakPolarHBondContact O-CG1 3.35Å; I61-I65 PolarHBondContact O-N 3.33Å |
| 62 | V | 95.7 | Very high | 96 | Very high | 80 Ų | 80 | 99 Ų | 99 | 49% | 0.485 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57.6 | -44.4 | 175.6 | 170.2 | 0 | 0 | 0 | 0 | 110.5 | V58 I59 I64 I65 S66 | V58-V62 HydrophobicContact CG1-CG2 4.33Å; V58-V62 VanDerWaalsContact O-CG2 3.29Å; V58-V62 WeakPolarHBondContact O-CG2 3.37Å; V58-V62 PolarHBondContact O-N 2.9Å; I59-V62 PolarHBondContact O-N 3.09Å; V62-I64 VanDerWaalsContact C-N 3.34Å; V62-I64 PolarHBondContact O-N 2.91Å; V62-I65 PolarHBondContact O-N 3.19Å; V62-S66 PolarHBondContact O-N 3.37Å; V62-S66 PolarHBondContact O-OG 3.13Å; V62-S66 VanDerWaalsContact O-OG 3.13Å |
| 63 | G | 96.7 | Very high | 96.1 | Very high | 34 Ų | 34 | 101.2 Ų | 101.2 | 35% | 0.351 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -36.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | I59 M60 I61 K67 | I59-G63 PolarHBondContact O-N 3.37Å; M60-G63 PolarHBondContact O-N 2.85Å; I61-G63 VanDerWaalsContact C-N 3.29Å; I61-G63 PolarHBondContact O-N 2.92Å; G63-K67 WeakPolarHBondContact O-CG 3.46Å; G63-K67 PolarHBondContact O-N 3.28Å |
| 64 | I | 96.8 | Very high | 96.1 | Very high | 106 Ų | 106 | 97.9 Ų | 97.9 | 54% | 0.544 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.8 | -46.2 | 174.5 | -68.8 | 165.3 | 0 | 0 | 0 | 110.5 | M60 I61 V62 S66 K67 A68 | M60-I64 HydrophobicContact CG-CD1 4.25Å; M60-I64 WeakPolarHBondContact O-CG1 3.4Å; M60-I64 PolarHBondContact O-N 3.19Å; I61-I64 PolarHBondContact O-N 2.9Å; I61-I64 VanDerWaalsContact O-N 3.13Å; V62-I64 VanDerWaalsContact C-N 3.34Å; V62-I64 PolarHBondContact O-N 2.91Å; I64-S66 PolarHBondContact O-N 3.47Å; I64-K67 PolarHBondContact O-N 3.35Å; I64-A68 PolarHBondContact O-N 3.07Å |
| 65 | I | 95.8 | Very high | 96.2 | Very high | 88 Ų | 88 | 98.6 Ų | 98.6 | 45% | 0.451 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.1 | -46 | 178.5 | -67.9 | 168.3 | 0 | 0 | 0 | 110.4 | I61 V62 K67 A68 N69 | I61-I65 HydrophobicContact CG2-CD1 3.74Å; I61-I65 HydrophobicContact CG2-CG1 4.35Å; I61-I65 WeakPolarHBondContact O-CG1 3.35Å; I61-I65 PolarHBondContact O-N 3.33Å; V62-I65 PolarHBondContact O-N 3.19Å; I65-K67 VanDerWaalsContact C-N 3.31Å; I65-K67 PolarHBondContact O-N 3.22Å; I65-A68 PolarHBondContact O-N 3.04Å; I65-N69 VanDerWaalsContact O-CG 3.31Å; I65-N69 PolarHBondContact O-N 3.35Å; I65-N69 PolarHBondContact O-OD1 3.3Å |
| 66 | S | 97.2 | Very high | 96.3 | Very high | 70 Ų | 70 | 99.2 Ų | 99.2 | 49% | 0.49 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.1 | -39.8 | 177.4 | -61.3 | 0 | 0 | 0 | 0 | 112.8 | V62 I64 K70 | V62-S66 PolarHBondContact O-N 3.37Å; V62-S66 PolarHBondContact O-OG 3.13Å; V62-S66 VanDerWaalsContact O-OG 3.13Å; I64-S66 PolarHBondContact O-N 3.47Å; S66-K70 PolarHBondContact O-N 2.65Å; S66-K70 VanDerWaalsContact O-N 3.11Å |
| 67 | K | 97.3 | Very high | 96.3 | Very high | 155 Ų | 155 | 98.2 Ų | 98.2 | 67% | 0.674 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.2 | -41.5 | 175.5 | -74.7 | 178.6 | -179.1 | -176.6 | 0 | 112 | G63 I64 I65 K70 L71 | G63-K67 WeakPolarHBondContact O-CG 3.46Å; G63-K67 PolarHBondContact O-N 3.28Å; I64-K67 PolarHBondContact O-N 3.35Å; I65-K67 VanDerWaalsContact C-N 3.31Å; I65-K67 PolarHBondContact O-N 3.22Å; K67-K70 PolarHBondContact O-N 3.11Å; K67-L71 WeakPolarHBondContact O-CG 3.39Å; K67-L71 PolarHBondContact O-N 2.99Å |
| 68 | A | 97.1 | Very high | 96.2 | Very high | 50 Ų | 50 | 95.8 Ų | 95.8 | 41% | 0.413 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | I64 I65 K70 L71 E72 | I64-A68 PolarHBondContact O-N 3.07Å; I65-A68 PolarHBondContact O-N 3.04Å; A68-K70 VanDerWaalsContact C-N 3.31Å; A68-K70 PolarHBondContact O-N 2.92Å; A68-L71 PolarHBondContact O-N 3.36Å; A68-E72 PolarHBondContact O-N 3.17Å |
| 69 | N | 96.7 | Very high | 96.2 | Very high | 83 Ų | 83 | 96.3 Ų | 96.3 | 44% | 0.444 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.5 | -38.5 | 177.5 | -66.4 | 2.7 | 0 | 0 | 0 | 112.1 | I65 E72 I73 | I65-N69 VanDerWaalsContact O-CG 3.31Å; I65-N69 PolarHBondContact O-N 3.35Å; I65-N69 PolarHBondContact O-OD1 3.3Å; N69-E72 PolarHBondContact O-N 3.37Å; N69-I73 WeakPolarHBondContact O-CG1 3.37Å; N69-I73 PolarHBondContact O-N 3.5Å; N69-I73 VanDerWaalsContact O-N 3.1Å |
| 70 | K | 97.1 | Very high | 96.1 | Very high | 128 Ų | 128 | 95.7 Ų | 95.7 | 56% | 0.557 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.9 | -44.6 | 175.4 | -169.8 | 178.1 | -171.3 | -87.3 | 0 | 111.7 | S66 K67 A68 E72 I73 E74 | S66-K70 PolarHBondContact O-N 2.65Å; S66-K70 VanDerWaalsContact O-N 3.11Å; K67-K70 PolarHBondContact O-N 3.11Å; A68-K70 VanDerWaalsContact C-N 3.31Å; A68-K70 PolarHBondContact O-N 2.92Å; K70-E72 VanDerWaalsContact C-N 3.31Å; K70-E72 PolarHBondContact O-N 2.91Å; K70-I73 PolarHBondContact O-N 3.37Å; K70-E74 IonicContact NZ-OE1 2.65Å; K70-E74 PolarHBondContact NZ-OE1 3.18Å; K70-E74 WeakPolarHBondContact O-CG 3.36Å; K70-E74 PolarHBondContact O-N 3.3Å |
| 71 | L | 97 | Very high | 95.9 | Very high | 109 Ų | 109 | 95.1 Ų | 95.1 | 57% | 0.571 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.4 | -35.3 | 177.5 | -72.1 | 170.5 | 0 | 0 | 0 | 112.2 | K67 A68 L75 | K67-L71 WeakPolarHBondContact O-CG 3.39Å; K67-L71 PolarHBondContact O-N 2.99Å; A68-L71 PolarHBondContact O-N 3.36Å; L71-L75 VanDerWaalsContact O-CB 3.31Å; L71-L75 WeakPolarHBondContact O-CB 3.29Å; L71-L75 PolarHBondContact O-N 3.04Å |
| 72 | E | 97.3 | Very high | 95.8 | Very high | 113 Ų | 113 | 93.6 Ų | 93.6 | 53% | 0.528 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.3 | -46.4 | 174.8 | -173.1 | 169.2 | -155.1 | 0 | 0 | 111 | A68 N69 K70 L75 E76 | A68-E72 PolarHBondContact O-N 3.17Å; N69-E72 PolarHBondContact O-N 3.37Å; K70-E72 VanDerWaalsContact C-N 3.31Å; K70-E72 PolarHBondContact O-N 2.91Å; E72-L75 WeakPolarHBondContact O-CB 3.47Å; E72-L75 PolarHBondContact O-N 2.98Å; E72-E76 WeakPolarHBondContact O-CG 3.41Å; E72-E76 PolarHBondContact O-N 3.1Å |
| 73 | I | 96.5 | Very high | 95.6 | Very high | 92 Ų | 92 | 95 Ų | 95 | 47% | 0.472 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.6 | -48.7 | 175.2 | -65.6 | 165.6 | 0 | 0 | 0 | 111.3 | N69 K70 L75 E76 E77 | N69-I73 WeakPolarHBondContact O-CG1 3.37Å; N69-I73 PolarHBondContact O-N 3.5Å; N69-I73 VanDerWaalsContact O-N 3.1Å; K70-I73 PolarHBondContact O-N 3.37Å; I73-L75 PolarHBondContact O-N 2.75Å; I73-E76 PolarHBondContact O-N 2.94Å; I73-E76 VanDerWaalsContact O-N 3.11Å; I73-E77 HydrophobicContact CG2-CG 4.4Å; I73-E77 WeakPolarHBondContact O-CG 3.46Å; I73-E77 PolarHBondContact O-N 3.39Å |
| 74 | E | 95.8 | Very high | 95.2 | Very high | 76 Ų | 76 | 97.3 Ų | 97.3 | 36% | 0.355 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.9 | -34.9 | 179.2 | -73.7 | 172.1 | -172 | 0 | 0 | 112 | K70 S78 | K70-E74 IonicContact NZ-OE1 2.65Å; K70-E74 PolarHBondContact NZ-OE1 3.18Å; K70-E74 WeakPolarHBondContact O-CG 3.36Å; K70-E74 PolarHBondContact O-N 3.3Å; E74-S78 WeakPolarHBondContact O-CB 3.36Å; E74-S78 PolarHBondContact O-N 2.98Å; E74-S78 PolarHBondContact O-OG 3.41Å |
| 75 | L | 96.5 | Very high | 94.8 | Very high | 109 Ų | 109 | 99.1 Ų | 99.1 | 57% | 0.571 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -69.1 | -43.4 | 175 | -179.8 | 63.7 | 0 | 0 | 0 | 111.8 | L71 E72 I73 S78 L79 | L71-L75 VanDerWaalsContact O-CB 3.31Å; L71-L75 WeakPolarHBondContact O-CB 3.29Å; L71-L75 PolarHBondContact O-N 3.04Å; E72-L75 WeakPolarHBondContact O-CB 3.47Å; E72-L75 PolarHBondContact O-N 2.98Å; I73-L75 PolarHBondContact O-N 2.75Å; L75-S78 PolarHBondContact O-N 3.11Å; L75-L79 HydrophobicContact CG-CD1 4.27Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 VanDerWaalsContact O-CG 3.29Å; L75-L79 WeakPolarHBondContact O-CG 3.31Å; L75-L79 PolarHBondContact O-N 2.93Å |
| 76 | E | 96 | Very high | 94.3 | Very high | 111 Ų | 111 | 102.1 Ų | 102.1 | 52% | 0.519 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.6 | -45.2 | 175.9 | -73.3 | -177.6 | 162.8 | 0 | 0 | 111.9 | E72 I73 S78 L79 H80 | E72-E76 WeakPolarHBondContact O-CG 3.41Å; E72-E76 PolarHBondContact O-N 3.1Å; I73-E76 PolarHBondContact O-N 2.94Å; I73-E76 VanDerWaalsContact O-N 3.11Å; E76-S78 PolarHBondContact O-N 3.41Å; E76-L79 PolarHBondContact O-N 3.26Å; E76-H80 PolarHBondContact O-CD2 3.26Å; E76-H80 PolarHBondContact O-N 3.33Å |
| 77 | E | 95.3 | Very high | 93.5 | Very high | 118 Ų | 118 | 108.5 Ų | 108.5 | 55% | 0.551 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.1 | -45.7 | 175.7 | -72 | 177.7 | 170.1 | 0 | 0 | 111.4 | I73 L79 H80 L81 | I73-E77 HydrophobicContact CG2-CG 4.4Å; I73-E77 WeakPolarHBondContact O-CG 3.46Å; I73-E77 PolarHBondContact O-N 3.39Å; E77-L79 VanDerWaalsContact C-N 3.33Å; E77-L79 PolarHBondContact O-N 3.49Å; E77-H80 WeakPolarHBondContact O-CB 3.45Å; E77-H80 PolarHBondContact O-N 3.26Å; E77-H80 VanDerWaalsContact O-N 3.15Å; E77-L81 WeakPolarHBondContact O-CG 3.46Å; E77-L81 PolarHBondContact O-N 3.08Å |
| 78 | S | 94.7 | Very high | 92.2 | Very high | 64 Ų | 64 | 112.2 Ų | 112.2 | 45% | 0.448 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.9 | -40.1 | 177 | -59.9 | 0 | 0 | 0 | 0 | 112.2 | E74 L75 E76 H80 L81 V82 | E74-S78 WeakPolarHBondContact O-CB 3.36Å; E74-S78 PolarHBondContact O-N 2.98Å; E74-S78 PolarHBondContact O-OG 3.41Å; L75-S78 PolarHBondContact O-N 3.11Å; E76-S78 PolarHBondContact O-N 3.41Å; S78-H80 VanDerWaalsContact C-N 3.31Å; S78-H80 PolarHBondContact O-N 3.49Å; S78-L81 PolarHBondContact O-N 3.15Å; S78-V82 WeakPolarHBondContact O-CG2 3.45Å; S78-V82 PolarHBondContact O-N 2.96Å; S78-V82 VanDerWaalsContact O-N 3.08Å |
| 79 | L | 95 | Very high | 92 | Very high | 90 Ų | 90 | 115.3 Ų | 115.3 | 47% | 0.471 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.2 | -32.6 | 176.1 | -75.1 | 171.7 | 0 | 0 | 0 | 112.4 | L75 E76 E77 K83 | L75-L79 HydrophobicContact CG-CD1 4.27Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 VanDerWaalsContact O-CG 3.29Å; L75-L79 WeakPolarHBondContact O-CG 3.31Å; L75-L79 PolarHBondContact O-N 2.93Å; E76-L79 PolarHBondContact O-N 3.26Å; E77-L79 VanDerWaalsContact C-N 3.33Å; E77-L79 PolarHBondContact O-N 3.49Å; L79-K83 WeakPolarHBondContact O-CD 3.25Å; L79-K83 VanDerWaalsContact O-CG 3.25Å; L79-K83 WeakPolarHBondContact O-CG 3.47Å; L79-K83 PolarHBondContact O-N 2.99Å |
| 80 | H | 92.7 | Very high | 91.7 | Very high | 112 Ų | 112 | 117 Ų | 117 | 52% | 0.519 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.8 | -48.2 | 173.1 | -91.7 | -74 | 0 | 0 | 0 | 111.4 | E76 E77 S78 V82 K83 D84 | E76-H80 PolarHBondContact O-CD2 3.26Å; E76-H80 PolarHBondContact O-N 3.33Å; E77-H80 WeakPolarHBondContact O-CB 3.45Å; E77-H80 PolarHBondContact O-N 3.26Å; E77-H80 VanDerWaalsContact O-N 3.15Å; S78-H80 VanDerWaalsContact C-N 3.31Å; S78-H80 PolarHBondContact O-N 3.49Å; H80-V82 PolarHBondContact O-N 3.1Å; H80-K83 WeakPolarHBondContact O-CB 3.45Å; H80-K83 PolarHBondContact O-N 3.4Å; H80-K83 VanDerWaalsContact O-N 3.1Å; H80-D84 PolarHBondContact O-N 2.98Å |
| 81 | L | 92 | Very high | 91.4 | Very high | 113 Ų | 113 | 116.4 Ų | 116.4 | 59% | 0.592 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -57.7 | -46.5 | 178.1 | -69.5 | 171.2 | 0 | 0 | 0 | 112.4 | E77 S78 K83 D84 E85 | E77-L81 WeakPolarHBondContact O-CG 3.46Å; E77-L81 PolarHBondContact O-N 3.08Å; S78-L81 PolarHBondContact O-N 3.15Å; L81-K83 VanDerWaalsContact C-N 3.28Å; L81-K83 PolarHBondContact O-N 3.15Å; L81-D84 PolarHBondContact O-N 3.34Å; L81-D84 VanDerWaalsContact O-N 3.15Å; L81-E85 PolarHBondContact O-N 3.03Å |
| 82 | V | 92.6 | Very high | 91.1 | Very high | 65 Ų | 65 | 116.8 Ų | 116.8 | 39% | 0.394 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62 | -36.2 | 177.6 | 172 | 0 | 0 | 0 | 0 | 111.9 | S78 H80 D84 M86 | S78-V82 WeakPolarHBondContact O-CG2 3.45Å; S78-V82 PolarHBondContact O-N 2.96Å; S78-V82 VanDerWaalsContact O-N 3.08Å; H80-V82 PolarHBondContact O-N 3.1Å; V82-D84 VanDerWaalsContact C-N 3.35Å; V82-M86 HydrophobicContact CG1-CE 3.87Å; V82-M86 HydrophobicContact CG1-SD 4.41Å; V82-M86 WeakPolarHBondContact O-CG 3.46Å; V82-M86 PolarHBondContact O-N 3.11Å; V82-M86 VanDerWaalsContact O-N 3.11Å |
| 83 | K | 91.6 | Very high | 90.7 | Very high | 109 Ų | 109 | 117.1 Ų | 117.1 | 47% | 0.474 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -69.3 | -34.4 | 176.9 | -76.1 | 169.9 | -175.6 | 170.4 | 0 | 112.3 | L79 H80 L81 R87 | L79-K83 WeakPolarHBondContact O-CD 3.25Å; L79-K83 VanDerWaalsContact O-CG 3.25Å; L79-K83 WeakPolarHBondContact O-CG 3.47Å; L79-K83 PolarHBondContact O-N 2.99Å; H80-K83 WeakPolarHBondContact O-CB 3.45Å; H80-K83 PolarHBondContact O-N 3.4Å; H80-K83 VanDerWaalsContact O-N 3.1Å; L81-K83 VanDerWaalsContact C-N 3.28Å; L81-K83 PolarHBondContact O-N 3.15Å; K83-R87 WeakPolarHBondContact O-CG 3.32Å; K83-R87 PolarHBondContact O-N 3.29Å |
| 84 | D | 88.6 | Confident | 90.3 | Very high | 83 Ų | 83 | 118.7 Ų | 118.7 | 44% | 0.444 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -71.4 | -43 | 177.6 | -67.8 | -21.1 | 0 | 0 | 0 | 110.3 | H80 L81 V82 M86 R87 E88 | H80-D84 PolarHBondContact O-N 2.98Å; L81-D84 PolarHBondContact O-N 3.34Å; L81-D84 VanDerWaalsContact O-N 3.15Å; V82-D84 VanDerWaalsContact C-N 3.35Å; D84-M86 VanDerWaalsContact C-N 3.26Å; D84-M86 PolarHBondContact O-N 3.36Å; D84-R87 PolarHBondContact O-N 3.38Å; D84-E88 PolarHBondContact O-N 3.05Å |
| 85 | E | 88.5 | Confident | 89.9 | Confident | 143 Ų | 143 | 121.8 Ų | 121.8 | 67% | 0.668 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -59.8 | -32.4 | 172.4 | -72.5 | -179.1 | 174.8 | 0 | 0 | 113.4 | L81 R87 | L81-E85 PolarHBondContact O-N 3.03Å; E85-R87 VanDerWaalsContact C-N 3.33Å |
| 86 | M | 85.6 | Confident | 89.4 | Confident | 151 Ų | 151 | 122.8 Ų | 122.8 | 74% | 0.744 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.3 | -12.2 | 176.7 | -74.3 | -174.8 | -179.2 | 0 | 0 | 114.1 | V82 D84 | V82-M86 HydrophobicContact CG1-CE 3.87Å; V82-M86 HydrophobicContact CG1-SD 4.41Å; V82-M86 WeakPolarHBondContact O-CG 3.46Å; V82-M86 PolarHBondContact O-N 3.11Å; V82-M86 VanDerWaalsContact O-N 3.11Å; D84-M86 VanDerWaalsContact C-N 3.26Å; D84-M86 PolarHBondContact O-N 3.36Å |
| 87 | R | 80.4 | Confident | 88.9 | Confident | 205 Ų | 205 | 123.8 Ų | 123.8 | 77% | 0.774 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | -22.8 | 177.9 | -78.8 | -177.8 | -165.2 | 175.8 | 6.7 | 113.3 | K83 D84 E85 | K83-R87 WeakPolarHBondContact O-CG 3.32Å; K83-R87 PolarHBondContact O-N 3.29Å; D84-R87 PolarHBondContact O-N 3.38Å; E85-R87 VanDerWaalsContact C-N 3.33Å |
| 88 | E | 69.5 | Low | 88.3 | Confident | 232 Ų | 232 | 124.3 Ų | 124.3 | 100% | 1.084 | 60% | 0.601 | S | S | * | * | trans | -74.6 | 0 | 171.1 | -68 | -172 | 170.7 | 0 | 0 | 111.6 | D84 | D84-E88 PolarHBondContact O-N 3.05Š|
Retrieved 88 of 88 residues in 227.1 ms
(Link to these results)