| 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 | 46.6 | Very low | 76.7 | Confident | 255 Ų | 255 | 108.4 Ų | 108.4 | 100% | 1.256 | 55% | 0.546 | S | S | * | . | 0 | 98.2 | 0 | -156.2 | 177.5 | -162.7 | 0 | 0 | 106.2 | |||||
| 2 | G | 55 | Low | 78 | Confident | 51 Ų | 51 | 104.3 Ų | 104.3 | 53% | 0.526 | 54% | 0.542 | S | S | . | . | trans | 154.7 | -32.5 | 171.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | E4 K5 Y6 | G2-E4 PolarHBondContact O-N 3.13Å; G2-K5 PolarHBondContact O-N 2.99Å; G2-Y6 PolarHBondContact O-N 3.18Å | ||
| 3 | E | 58.5 | Low | 79 | Confident | 163 Ų | 163 | 104.2 Ų | 104.2 | 76% | 0.762 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -70.1 | -36.8 | -167.6 | -66.6 | -177.4 | 168.8 | 0 | 0 | 114 | K5 Y6 | E3-K5 PolarHBondContact O-N 3.39Å; E3-Y6 PolarHBondContact O-N 2.82Å |
| 4 | E | 68.4 | Low | 79.7 | Confident | 189 Ų | 189 | 102.9 Ų | 102.9 | 88% | 0.883 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.5 | -24.9 | 178.7 | -68.2 | -179.2 | 165.9 | 0 | 0 | 113.3 | G2 P8 | G2-E4 PolarHBondContact O-N 3.13Å; E4-P8 WeakPolarHBondContact O-CD 3.32Å; E4-P8 WeakPolarHBondContact O-CG 3.24Å |
| 5 | K | 80.9 | Confident | 80.4 | Confident | 136 Ų | 136 | 104.8 Ų | 104.8 | 59% | 0.591 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -92.7 | -25.8 | -179.3 | -157.6 | -172.9 | -178.8 | -134.3 | 0 | 112.4 | G2 E3 P8 E9 | G2-K5 PolarHBondContact O-N 2.99Å; E3-K5 PolarHBondContact O-N 3.39Å; K5-P8 WeakPolarHBondContact O-CD 3.45Å; K5-E9 WeakPolarHBondContact CD-OE1 3.44Å; K5-E9 WeakPolarHBondContact CE-OE1 3.39Å; K5-E9 HydrophobicContact CG-CG 4.28Å; K5-E9 WeakPolarHBondContact CG-OE1 3.44Å; K5-E9 IonicContact NZ-OE1 2.64Å; K5-E9 PolarHBondContact NZ-OE1 3.1Å; K5-E9 WeakPolarHBondContact O-CB 3.38Å; K5-E9 WeakPolarHBondContact O-CG 3.44Å; K5-E9 PolarHBondContact O-N 3.35Å; K5-E9 VanDerWaalsContact O-N 3.16Å |
| 6 | Y | 86 | Confident | 81.2 | Confident | 87 Ų | 87 | 104.4 Ų | 104.4 | 34% | 0.341 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.2 | -45.9 | -172 | -175.1 | -115.1 | 0 | 0 | 0 | 113.3 | G2 E3 E9 L10 F35 | G2-Y6 PolarHBondContact O-N 3.18Å; E3-Y6 PolarHBondContact O-N 2.82Å; Y6-E9 PolarHBondContact O-N 2.95Å; Y6-L10 HydrophobicContact CD1-CD1 3.94Å; Y6-L10 HydrophobicContact CE1-CD1 3.5Å; Y6-L10 VanDerWaalsContact CE1-CD1 3.5Å; Y6-L10 HydrophobicContact CE1-CG 4.27Å; Y6-L10 HydrophobicContact CE2-CD1 4.39Å; Y6-L10 HydrophobicContact CE2-CD2 4.36Å; Y6-L10 HydrophobicContact CE2-CG 4.34Å; Y6-L10 WeakPolarHBondContact O-CG 3.46Å; Y6-L10 PolarHBondContact O-N 3.42Å; Y6-F35 AromaticContact CD1-CE1 3.81Å; Y6-F35 HydrophobicContact CD1-CE1 3.81Å; Y6-F35 AromaticContact CD1-CE2 3.79Å; Y6-F35 HydrophobicContact CD1-CE2 3.79Å; Y6-F35 AromaticContact CD1-CZ 3.35Å; Y6-F35 HydrophobicContact CD1-CZ 3.35Å; Y6-F35 HydrophobicContact CE1-CD2 4.24Å; Y6-F35 HydrophobicContact CE1-CE1 4.24Å; Y6-F35 AromaticContact CE1-CE2 3.36Å; Y6-F35 HydrophobicContact CE1-CE2 3.36Å; Y6-F35 AromaticContact CE1-CZ 3.35Å; Y6-F35 HydrophobicContact CE1-CZ 3.35Å |
| 7 | L | 87.6 | Confident | 81.9 | Confident | 48 Ų | 48 | 100.8 Ų | 100.8 | 25% | 0.251 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.2 | -46.6 | -179.7 | -179.6 | 67.7 | 0 | 0 | 0 | 112.8 | E9 L10 M11 I32 F35 | L7-E9 VanDerWaalsContact C-N 3.26Å; L7-E9 PolarHBondContact O-N 3.04Å; L7-L10 PolarHBondContact O-N 3Å; L7-M11 HydrophobicContact CG-SD 4.47Å; L7-M11 WeakPolarHBondContact O-CG 3.36Å; L7-M11 PolarHBondContact O-N 2.6Å; L7-M11 VanDerWaalsContact O-N 3.11Å; L7-I32 HydrophobicContact CD1-CB 4.49Å; L7-I32 HydrophobicContact CD1-CG1 4.36Å; L7-I32 HydrophobicContact CD1-CG2 4.08Å; L7-F35 HydrophobicContact CD1-CB 4.24Å |
| 8 | P | 90.6 | Very high | 82.5 | Confident | 76 Ų | 76 | 100.1 Ų | 100.1 | 49% | 0.494 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -56.7 | -37.6 | 171.8 | -27 | 34.2 | 0 | 0 | 0 | 113.8 | E4 K5 M11 A12 | E4-P8 WeakPolarHBondContact O-CD 3.32Å; E4-P8 WeakPolarHBondContact O-CG 3.24Å; K5-P8 WeakPolarHBondContact O-CD 3.45Å; P8-M11 PolarHBondContact O-N 3.3Å; P8-A12 WeakPolarHBondContact O-CB 3.47Å; P8-A12 PolarHBondContact O-N 3.24Å |
| 9 | E | 90.8 | Very high | 82.9 | Confident | 89 Ų | 89 | 100.6 Ų | 100.6 | 42% | 0.416 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.3 | -45.1 | 177.5 | -75.6 | 173.9 | 168.4 | 0 | 0 | 112.1 | K5 Y6 L7 M11 A12 E13 | K5-E9 WeakPolarHBondContact CD-OE1 3.44Å; K5-E9 WeakPolarHBondContact CE-OE1 3.39Å; K5-E9 HydrophobicContact CG-CG 4.28Å; K5-E9 WeakPolarHBondContact CG-OE1 3.44Å; K5-E9 IonicContact NZ-OE1 2.64Å; K5-E9 PolarHBondContact NZ-OE1 3.1Å; K5-E9 WeakPolarHBondContact O-CB 3.38Å; K5-E9 WeakPolarHBondContact O-CG 3.44Å; K5-E9 PolarHBondContact O-N 3.35Å; K5-E9 VanDerWaalsContact O-N 3.16Å; Y6-E9 PolarHBondContact O-N 2.95Å; L7-E9 VanDerWaalsContact C-N 3.26Å; L7-E9 PolarHBondContact O-N 3.04Å; E9-M11 VanDerWaalsContact C-N 3.31Å; E9-M11 PolarHBondContact O-N 2.9Å; E9-A12 PolarHBondContact O-N 3.06Å; E9-E13 WeakPolarHBondContact O-CB 3.35Å; E9-E13 PolarHBondContact O-N 3.07Å |
| 10 | L | 90 | Very high | 83.4 | Confident | 11 Ų | 11 | 99.8 Ų | 99.8 | 6% | 0.058 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -61 | -39.1 | 176.3 | -70.8 | 176.2 | 0 | 0 | 0 | 112.4 | Y6 L7 K14 L28 E31 I32 | Y6-L10 HydrophobicContact CD1-CD1 3.94Å; Y6-L10 HydrophobicContact CE1-CD1 3.5Å; Y6-L10 VanDerWaalsContact CE1-CD1 3.5Å; Y6-L10 HydrophobicContact CE1-CG 4.27Å; Y6-L10 HydrophobicContact CE2-CD1 4.39Å; Y6-L10 HydrophobicContact CE2-CD2 4.36Å; Y6-L10 HydrophobicContact CE2-CG 4.34Å; Y6-L10 WeakPolarHBondContact O-CG 3.46Å; Y6-L10 PolarHBondContact O-N 3.42Å; L7-L10 PolarHBondContact O-N 3Å; L10-K14 WeakPolarHBondContact O-CB 3.45Å; L10-K14 PolarHBondContact O-N 2.68Å; L10-L28 HydrophobicContact CD2-CD2 3.74Å; L10-E31 HydrophobicContact CD1-CB 4.46Å; L10-E31 HydrophobicContact CD1-CG 3.99Å; L10-I32 HydrophobicContact CB-CD1 4.14Å; L10-I32 HydrophobicContact CB-CG1 3.79Å; L10-I32 HydrophobicContact CD1-CG1 4.26Å |
| 11 | M | 88.8 | Confident | 83.9 | Confident | 87 Ų | 87 | 100.7 Ų | 100.7 | 43% | 0.429 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.3 | -45.1 | 176.9 | -68 | -179.5 | 71.6 | 0 | 0 | 111.3 | L7 P8 E9 E13 K14 D15 I32 | L7-M11 HydrophobicContact CG-SD 4.47Å; L7-M11 WeakPolarHBondContact O-CG 3.36Å; L7-M11 PolarHBondContact O-N 2.6Å; L7-M11 VanDerWaalsContact O-N 3.11Å; P8-M11 PolarHBondContact O-N 3.3Å; E9-M11 VanDerWaalsContact C-N 3.31Å; E9-M11 PolarHBondContact O-N 2.9Å; M11-E13 PolarHBondContact O-N 3Å; M11-K14 PolarHBondContact O-N 3.03Å; M11-D15 PolarHBondContact O-N 3.32Å; M11-I32 HydrophobicContact CG-CD1 4.16Å |
| 12 | A | 92.8 | Very high | 86.1 | Confident | 60 Ų | 60 | 93.2 Ų | 93.2 | 50% | 0.496 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64 | -39.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P8 E9 D15 S16 | P8-A12 WeakPolarHBondContact O-CB 3.47Å; P8-A12 PolarHBondContact O-N 3.24Å; E9-A12 PolarHBondContact O-N 3.06Å; A12-D15 PolarHBondContact O-N 3.4Å; A12-S16 WeakPolarHBondContact O-CB 3.24Å; A12-S16 PolarHBondContact O-N 3.1Å; A12-S16 VanDerWaalsContact O-N 3.12Å; A12-S16 PolarHBondContact O-OG 3.38Å |
| 13 | E | 90.7 | Very high | 87.9 | Confident | 103 Ų | 103 | 97.4 Ų | 97.4 | 48% | 0.481 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.2 | -47.1 | 175.2 | -171.7 | 177 | 170.8 | 0 | 0 | 110.9 | E9 M11 D15 S16 L17 L28 | E9-E13 WeakPolarHBondContact O-CB 3.35Å; E9-E13 PolarHBondContact O-N 3.07Å; M11-E13 PolarHBondContact O-N 3Å; E13-D15 VanDerWaalsContact C-N 3.3Å; E13-D15 PolarHBondContact O-N 2.79Å; E13-S16 PolarHBondContact O-N 3.44Å; E13-S16 PolarHBondContact O-OG 3.32Å; E13-L17 VanDerWaalsContact O-CB 3.31Å; E13-L17 WeakPolarHBondContact O-CB 3.35Å; E13-L17 PolarHBondContact O-N 2.75Å; E13-L28 HydrophobicContact CB-CD1 4.43Å; E13-L28 HydrophobicContact CG-CD1 3.99Å |
| 14 | K | 89.4 | Confident | 89.5 | Confident | 86 Ų | 86 | 91.6 Ų | 91.6 | 37% | 0.374 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.1 | -41.3 | 177.8 | -175.7 | -166.2 | 168.9 | -148.7 | 0 | 112.4 | L10 M11 L28 I32 | L10-K14 WeakPolarHBondContact O-CB 3.45Å; L10-K14 PolarHBondContact O-N 2.68Å; M11-K14 PolarHBondContact O-N 3.03Å; K14-L28 HydrophobicContact CB-CB 4.41Å; K14-L28 HydrophobicContact CB-CD1 4.3Å; K14-I32 HydrophobicContact CB-CD1 4.42Å; K14-I32 HydrophobicContact CD-CD1 3.99Å |
| 15 | D | 90.3 | Very high | 90.6 | Very high | 131 Ų | 131 | 84.5 Ų | 84.5 | 70% | 0.701 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -75.8 | -25.4 | -177.3 | -69.8 | -17.8 | 0 | 0 | 0 | 113.1 | M11 A12 E13 | M11-D15 PolarHBondContact O-N 3.32Å; A12-D15 PolarHBondContact O-N 3.4Å; E13-D15 VanDerWaalsContact C-N 3.3Å; E13-D15 PolarHBondContact O-N 2.79Å |
| 16 | S | 93.3 | Very high | 91.1 | Very high | 98 Ų | 98 | 84 Ų | 84 | 69% | 0.685 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -91.6 | -14.4 | 176.5 | 58.6 | 0 | 0 | 0 | 0 | 113.8 | A12 E13 | A12-S16 WeakPolarHBondContact O-CB 3.24Å; A12-S16 PolarHBondContact O-N 3.1Å; A12-S16 VanDerWaalsContact O-N 3.12Å; A12-S16 PolarHBondContact O-OG 3.38Å; E13-S16 PolarHBondContact O-N 3.44Å; E13-S16 PolarHBondContact O-OG 3.32Å |
| 17 | L | 93.1 | Very high | 91.4 | Very high | 44 Ų | 44 | 84.5 Ų | 84.5 | 23% | 0.23 | 46% | 0.464 | C | S | . | . | S | Bend | trans | -69.6 | 134.1 | -179.1 | -169.7 | 69.4 | 0 | 0 | 0 | 111.5 | E13 F21 A24 L28 | E13-L17 VanDerWaalsContact O-CB 3.31Å; E13-L17 WeakPolarHBondContact O-CB 3.35Å; E13-L17 PolarHBondContact O-N 2.75Å; L17-F21 HydrophobicContact CD1-CB 4.25Å; L17-F21 HydrophobicContact CD1-CD2 4.01Å; L17-F21 HydrophobicContact CD1-CG 4.36Å; L17-F21 HydrophobicContact CD2-CB 4.11Å; L17-F21 HydrophobicContact CG-CB 4.15Å; L17-F21 HydrophobicContact CG-CD2 4.4Å; L17-A24 HydrophobicContact CD2-CB 3.89Å; L17-L28 HydrophobicContact CD2-CD1 4.02Å |
| 18 | D | 92.9 | Very high | 91.6 | Very high | 88 Ų | 88 | 83.1 Ų | 83.1 | 47% | 0.471 | 46% | 0.457 | S | S | . | . | trans | -64.7 | 133.2 | 176.5 | 178.5 | 74.7 | 0 | 0 | 0 | 111.5 | S20 F21 | D18-S20 PolarHBondContact O-N 3.18Å; D18-S20 WeakPolarHBondContact OD2-CB 3.43Å; D18-S20 PolarHBondContact OD2-N 2.84Å; D18-S20 PolarHBondContact OD2-OG 3.06Å; D18-F21 HydrophobicContact CB-CD2 3.92Å; D18-F21 HydrophobicContact CB-CE2 4.09Å; D18-F21 PolarHBondContact O-N 3.38Å | ||
| 19 | P | 88.9 | Confident | 91.5 | Very high | 110 Ų | 110 | 81.3 Ų | 81.3 | 71% | 0.714 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.2 | -16.1 | -177.7 | -27.1 | 35.5 | 0 | 0 | 0 | 115.6 | F21 | P19-F21 PolarHBondContact O-N 3.32Š|
| 20 | S | 93.7 | Very high | 91.5 | Very high | 84 Ų | 84 | 80.4 Ų | 80.4 | 59% | 0.587 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.3 | -23.1 | 174.6 | 72.4 | 0 | 0 | 0 | 0 | 112.8 | D18 V22 | D18-S20 PolarHBondContact O-N 3.18Å; D18-S20 WeakPolarHBondContact OD2-CB 3.43Å; D18-S20 PolarHBondContact OD2-N 2.84Å; D18-S20 PolarHBondContact OD2-OG 3.06Å; S20-V22 PolarHBondContact O-N 3.06Å |
| 21 | F | 93.6 | Very high | 91.4 | Very high | 119 Ų | 119 | 82.5 Ų | 82.5 | 52% | 0.522 | 45% | 0.454 | S | S | . | . | trans | -81.6 | 59.8 | 176.1 | -62.9 | -72.3 | 0 | 0 | 0 | 111.8 | L17 D18 P19 H23 A24 S25 | L17-F21 HydrophobicContact CD1-CB 4.25Å; L17-F21 HydrophobicContact CD1-CD2 4.01Å; L17-F21 HydrophobicContact CD1-CG 4.36Å; L17-F21 HydrophobicContact CD2-CB 4.11Å; L17-F21 HydrophobicContact CG-CB 4.15Å; L17-F21 HydrophobicContact CG-CD2 4.4Å; D18-F21 HydrophobicContact CB-CD2 3.92Å; D18-F21 HydrophobicContact CB-CE2 4.09Å; D18-F21 PolarHBondContact O-N 3.38Å; P19-F21 PolarHBondContact O-N 3.32Å; F21-H23 VanDerWaalsContact C-N 3.25Å; F21-H23 PolarHBondContact O-N 3.06Å; F21-A24 HydrophobicContact CB-CB 4.14Å; F21-A24 PolarHBondContact O-N 2.92Å; F21-A24 VanDerWaalsContact O-N 3.17Å; F21-S25 WeakPolarHBondContact O-CB 3.31Å; F21-S25 PolarHBondContact O-N 3.22Å | ||
| 22 | V | 92.3 | Very high | 91.4 | Very high | 97 Ų | 97 | 79.1 Ų | 79.1 | 59% | 0.588 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -53.3 | -41.8 | -176.3 | -179 | 0 | 0 | 0 | 0 | 112.2 | S20 R26 | S20-V22 PolarHBondContact O-N 3.06Å; V22-R26 WeakPolarHBondContact O-CB 3.47Å; V22-R26 PolarHBondContact O-N 3.41Å |
| 23 | H | 93.4 | Very high | 91.2 | Very high | 140 Ų | 140 | 82.7 Ų | 82.7 | 65% | 0.648 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -72.4 | -41.4 | -178.6 | -61.6 | -39.8 | 0 | 0 | 0 | 113 | F21 R26 L27 | F21-H23 VanDerWaalsContact C-N 3.25Å; F21-H23 PolarHBondContact O-N 3.06Å; H23-R26 PolarHBondContact O-N 2.64Å; H23-L27 WeakPolarHBondContact O-CG 3.46Å; H23-L27 PolarHBondContact O-N 2.98Å |
| 24 | A | 91.4 | Very high | 90.9 | Very high | 41 Ų | 41 | 83.7 Ų | 83.7 | 34% | 0.339 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -68.7 | -42.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111 | L17 F21 R26 L27 L28 | L17-A24 HydrophobicContact CD2-CB 3.89Å; F21-A24 HydrophobicContact CB-CB 4.14Å; F21-A24 PolarHBondContact O-N 2.92Å; F21-A24 VanDerWaalsContact O-N 3.17Å; A24-R26 VanDerWaalsContact C-N 3.32Å; A24-R26 PolarHBondContact O-N 2.97Å; A24-L27 PolarHBondContact O-N 3.33Å; A24-L28 WeakPolarHBondContact O-CG 3.38Å; A24-L28 PolarHBondContact O-N 3.39Å |
| 25 | S | 91.5 | Very high | 90.5 | Very high | 40 Ų | 40 | 83.1 Ų | 83.1 | 28% | 0.28 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -58.7 | -42.2 | 173.9 | -171.1 | 0 | 0 | 0 | 0 | 112.1 | F21 A29 | F21-S25 WeakPolarHBondContact O-CB 3.31Å; F21-S25 PolarHBondContact O-N 3.22Å; S25-A29 WeakPolarHBondContact O-CB 3.33Å; S25-A29 PolarHBondContact O-N 3.46Å |
| 26 | R | 92.6 | Very high | 89.8 | Confident | 125 Ų | 125 | 83.1 Ų | 83.1 | 47% | 0.472 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.7 | -46.9 | 175 | -176.8 | -179.7 | 64.8 | 86.7 | 1.5 | 112.3 | V22 H23 A24 A29 E30 | V22-R26 WeakPolarHBondContact O-CB 3.47Å; V22-R26 PolarHBondContact O-N 3.41Å; H23-R26 PolarHBondContact O-N 2.64Å; A24-R26 VanDerWaalsContact C-N 3.32Å; A24-R26 PolarHBondContact O-N 2.97Å; R26-A29 PolarHBondContact O-N 3.3Å; R26-E30 IonicContact CZ-OE1 3.69Å; R26-E30 IonicContact NH1-OE1 2.8Å; R26-E30 PolarHBondContact NH1-OE1 3.14Å; R26-E30 IonicContact NH1-OE2 2.64Å; R26-E30 WeakPolarHBondContact O-CG 3.38Å; R26-E30 PolarHBondContact O-N 3.03Å |
| 27 | L | 92.7 | Very high | 88.3 | Confident | 98 Ų | 98 | 80.5 Ų | 80.5 | 51% | 0.513 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.2 | -40.2 | -179.1 | -70.2 | 171.7 | 0 | 0 | 0 | 112 | H23 A24 E30 E31 | H23-L27 WeakPolarHBondContact O-CG 3.46Å; H23-L27 PolarHBondContact O-N 2.98Å; A24-L27 PolarHBondContact O-N 3.33Å; L27-E30 PolarHBondContact O-N 2.96Å; L27-E31 WeakPolarHBondContact O-CB 3.46Å; L27-E31 PolarHBondContact O-N 3.26Å |
| 28 | L | 90.5 | Very high | 86.5 | Confident | 19 Ų | 19 | 82.5 Ų | 82.5 | 10% | 0.099 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -62.1 | -42.9 | 174.3 | -73.1 | 172 | 0 | 0 | 0 | 111.5 | L10 E13 K14 L17 A24 E31 I32 | L10-L28 HydrophobicContact CD2-CD2 3.74Å; E13-L28 HydrophobicContact CB-CD1 4.43Å; E13-L28 HydrophobicContact CG-CD1 3.99Å; K14-L28 HydrophobicContact CB-CB 4.41Å; K14-L28 HydrophobicContact CB-CD1 4.3Å; L17-L28 HydrophobicContact CD2-CD1 4.02Å; A24-L28 WeakPolarHBondContact O-CG 3.38Å; A24-L28 PolarHBondContact O-N 3.39Å; L28-E31 PolarHBondContact O-N 3.43Å; L28-I32 WeakPolarHBondContact O-CD1 3.43Å; L28-I32 VanDerWaalsContact O-CG1 3.24Å; L28-I32 WeakPolarHBondContact O-CG1 3.05Å; L28-I32 PolarHBondContact O-N 2.97Å |
| 29 | A | 89.3 | Confident | 84.5 | Confident | 37 Ų | 37 | 85.4 Ų | 85.4 | 31% | 0.306 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.5 | -44.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | S25 R26 E31 I32 E33 | S25-A29 WeakPolarHBondContact O-CB 3.33Å; S25-A29 PolarHBondContact O-N 3.46Å; R26-A29 PolarHBondContact O-N 3.3Å; A29-E31 VanDerWaalsContact C-N 3.3Å; A29-E31 PolarHBondContact O-N 3.49Å; A29-I32 PolarHBondContact O-N 3.07Å; A29-E33 WeakPolarHBondContact O-CB 3.31Å; A29-E33 PolarHBondContact O-N 3.39Å |
| 30 | E | 89.6 | Confident | 82.6 | Confident | 71 Ų | 71 | 81.5 Ų | 81.5 | 33% | 0.332 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.1 | -38.9 | 175.8 | -75.9 | 173.3 | -168.4 | 0 | 0 | 112 | R26 L27 E33 K34 | R26-E30 IonicContact CZ-OE1 3.69Å; R26-E30 IonicContact NH1-OE1 2.8Å; R26-E30 PolarHBondContact NH1-OE1 3.14Å; R26-E30 IonicContact NH1-OE2 2.64Å; R26-E30 WeakPolarHBondContact O-CG 3.38Å; R26-E30 PolarHBondContact O-N 3.03Å; L27-E30 PolarHBondContact O-N 2.96Å; E30-E33 PolarHBondContact O-N 3.38Å; E30-K34 WeakPolarHBondContact O-CG 3.48Å; E30-K34 PolarHBondContact O-N 3.4Å |
| 31 | E | 89.3 | Confident | 80.5 | Confident | 55 Ų | 55 | 87 Ų | 87 | 26% | 0.257 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -69.6 | -43.2 | 178.8 | -165.4 | 63.8 | -170.7 | 0 | 0 | 111.7 | L10 L27 L28 A29 E33 K34 F35 | L10-E31 HydrophobicContact CD1-CB 4.46Å; L10-E31 HydrophobicContact CD1-CG 3.99Å; L27-E31 WeakPolarHBondContact O-CB 3.46Å; L27-E31 PolarHBondContact O-N 3.26Å; L28-E31 PolarHBondContact O-N 3.43Å; A29-E31 VanDerWaalsContact C-N 3.3Å; A29-E31 PolarHBondContact O-N 3.49Å; E31-E33 VanDerWaalsContact C-N 3.29Å; E31-E33 PolarHBondContact O-N 2.97Å; E31-K34 PolarHBondContact O-N 3.31Å; E31-K34 IonicContact OE2-NZ 3.53Å; E31-K34 PolarHBondContact OE2-NZ 3.17Å; E31-F35 WeakPolarHBondContact O-CD2 3.49Å; E31-F35 PolarHBondContact O-N 3.26Å |
| 32 | I | 88.6 | Confident | 78.4 | Confident | 15 Ų | 15 | 89.6 Ų | 89.6 | 8% | 0.077 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -58.6 | -42.8 | 173.3 | -69.5 | 164.4 | 0 | 0 | 0 | 110.8 | L7 L10 M11 K14 L28 A29 K34 F35 Q36 | L7-I32 HydrophobicContact CD1-CB 4.49Å; L7-I32 HydrophobicContact CD1-CG1 4.36Å; L7-I32 HydrophobicContact CD1-CG2 4.08Å; L10-I32 HydrophobicContact CB-CD1 4.14Å; L10-I32 HydrophobicContact CB-CG1 3.79Å; L10-I32 HydrophobicContact CD1-CG1 4.26Å; M11-I32 HydrophobicContact CG-CD1 4.16Å; K14-I32 HydrophobicContact CB-CD1 4.42Å; K14-I32 HydrophobicContact CD-CD1 3.99Å; L28-I32 WeakPolarHBondContact O-CD1 3.43Å; L28-I32 VanDerWaalsContact O-CG1 3.24Å; L28-I32 WeakPolarHBondContact O-CG1 3.05Å; L28-I32 PolarHBondContact O-N 2.97Å; A29-I32 PolarHBondContact O-N 3.07Å; I32-K34 PolarHBondContact O-N 3.09Å; I32-F35 PolarHBondContact O-N 2.89Å; I32-Q36 VanDerWaalsContact CG2-NE2 3.26Å; I32-Q36 WeakPolarHBondContact O-CG 3.41Å; I32-Q36 PolarHBondContact O-N 2.5Å; I32-Q36 VanDerWaalsContact O-N 3.14Å |
| 33 | E | 87.8 | Confident | 76.5 | Confident | 136 Ų | 136 | 89.5 Ų | 89.5 | 64% | 0.636 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -64.5 | -38.3 | 179 | -171.6 | 177.5 | -173.8 | 0 | 0 | 112.2 | A29 E30 E31 F35 Q36 G37 | A29-E33 WeakPolarHBondContact O-CB 3.31Å; A29-E33 PolarHBondContact O-N 3.39Å; E30-E33 PolarHBondContact O-N 3.38Å; E31-E33 VanDerWaalsContact C-N 3.29Å; E31-E33 PolarHBondContact O-N 2.97Å; E33-F35 VanDerWaalsContact C-N 3.29Å; E33-F35 PolarHBondContact O-N 2.99Å; E33-Q36 PolarHBondContact O-N 3.01Å; E33-G37 WeakPolarHBondContact O-CA 3.44Å; E33-G37 PolarHBondContact O-N 3.18Å |
| 34 | K | 85.9 | Confident | 74.5 | Confident | 123 Ų | 123 | 89.2 Ų | 89.2 | 54% | 0.535 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.6 | -35.2 | 175.1 | -71.8 | 172.6 | -152.1 | 157.5 | 0 | 112.9 | E30 E31 I32 S38 | E30-K34 WeakPolarHBondContact O-CG 3.48Å; E30-K34 PolarHBondContact O-N 3.4Å; E31-K34 PolarHBondContact O-N 3.31Å; E31-K34 IonicContact OE2-NZ 3.53Å; E31-K34 PolarHBondContact OE2-NZ 3.17Å; I32-K34 PolarHBondContact O-N 3.09Å; K34-S38 WeakPolarHBondContact O-CA 3.35Å; K34-S38 VanDerWaalsContact O-CB 3.31Å; K34-S38 WeakPolarHBondContact O-CB 3.49Å; K34-S38 PolarHBondContact O-N 2.92Å; K34-S38 VanDerWaalsContact O-N 3.09Å |
| 35 | F | 80.1 | Confident | 72.6 | Confident | 74 Ų | 74 | 95 Ų | 95 | 33% | 0.325 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.1 | -46 | 176.4 | -88.6 | -99.7 | 0 | 0 | 0 | 111 | Y6 L7 E31 I32 E33 G37 S38 | Y6-F35 AromaticContact CD1-CE1 3.81Å; Y6-F35 HydrophobicContact CD1-CE1 3.81Å; Y6-F35 AromaticContact CD1-CE2 3.79Å; Y6-F35 HydrophobicContact CD1-CE2 3.79Å; Y6-F35 AromaticContact CD1-CZ 3.35Å; Y6-F35 HydrophobicContact CD1-CZ 3.35Å; Y6-F35 HydrophobicContact CE1-CD2 4.24Å; Y6-F35 HydrophobicContact CE1-CE1 4.24Å; Y6-F35 AromaticContact CE1-CE2 3.36Å; Y6-F35 HydrophobicContact CE1-CE2 3.36Å; Y6-F35 AromaticContact CE1-CZ 3.35Å; Y6-F35 HydrophobicContact CE1-CZ 3.35Å; L7-F35 HydrophobicContact CD1-CB 4.24Å; E31-F35 WeakPolarHBondContact O-CD2 3.49Å; E31-F35 PolarHBondContact O-N 3.26Å; I32-F35 PolarHBondContact O-N 2.89Å; E33-F35 VanDerWaalsContact C-N 3.29Å; E33-F35 PolarHBondContact O-N 2.99Å; F35-G37 VanDerWaalsContact C-N 3.34Å; F35-S38 PolarHBondContact O-OG 3.33Å |
| 36 | Q | 74.4 | Confident | 70.8 | Confident | 131 Ų | 131 | 100.5 Ų | 100.5 | 61% | 0.612 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -70.7 | -30 | 179.1 | -64.7 | 177.6 | 18.9 | 0 | 0 | 112.9 | I32 E33 | I32-Q36 VanDerWaalsContact CG2-NE2 3.26Å; I32-Q36 WeakPolarHBondContact O-CG 3.41Å; I32-Q36 PolarHBondContact O-N 2.5Å; I32-Q36 VanDerWaalsContact O-N 3.14Å; E33-Q36 PolarHBondContact O-N 3.01Å |
| 37 | G | 63.9 | Low | 69.3 | Low | 43 Ų | 43 | 101.4 Ų | 101.4 | 44% | 0.443 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.6 | 13.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | E33 F35 D39 G40 | E33-G37 WeakPolarHBondContact O-CA 3.44Å; E33-G37 PolarHBondContact O-N 3.18Å; F35-G37 VanDerWaalsContact C-N 3.34Å; G37-D39 PolarHBondContact O-N 2.95Å; G37-G40 PolarHBondContact O-N 2.94Å |
| 38 | S | 53.4 | Low | 68.1 | Low | 86 Ų | 86 | 104.1 Ų | 104.1 | 60% | 0.601 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68 | 0.1 | -177.3 | 58.1 | 0 | 0 | 0 | 0 | 115.2 | K34 F35 G40 | K34-S38 WeakPolarHBondContact O-CA 3.35Å; K34-S38 VanDerWaalsContact O-CB 3.31Å; K34-S38 WeakPolarHBondContact O-CB 3.49Å; K34-S38 PolarHBondContact O-N 2.92Å; K34-S38 VanDerWaalsContact O-N 3.09Å; F35-S38 PolarHBondContact O-OG 3.33Å; S38-G40 VanDerWaalsContact C-N 3.25Å |
| 39 | D | 51.5 | Low | 67.4 | Low | 150 Ų | 150 | 112 Ų | 112 | 80% | 0.802 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71 | -17.1 | 159.8 | -90.8 | -66.2 | 0 | 0 | 0 | 113.1 | G37 | G37-D39 PolarHBondContact O-N 2.95Š|
| 40 | G | 49.4 | Very low | 66.9 | Low | 27 Ų | 27 | 115.1 Ų | 115.1 | 28% | 0.278 | 56% | 0.559 | S | S | . | * | G | 310 helix | trans | -84.3 | -10.7 | -169.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | G37 S38 K42 E43 | G37-G40 PolarHBondContact O-N 2.94Å; S38-G40 VanDerWaalsContact C-N 3.25Å; G40-K42 PolarHBondContact O-N 3.14Å; G40-E43 PolarHBondContact O-N 3.25Å; G40-E43 VanDerWaalsContact O-N 3.1Å |
| 41 | K | 50.3 | Low | 66.5 | Low | 199 Ų | 199 | 115.5 Ų | 115.5 | 87% | 0.865 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -68.3 | -13.9 | -179.4 | -83.5 | -173.1 | 178.8 | 175.1 | 0 | 114.2 | ||
| 42 | K | 49.4 | Very low | 66.1 | Low | 175 Ų | 175 | 118.1 Ų | 118.1 | 76% | 0.761 | 58% | 0.582 | S | S | * | * | G | 310 helix | trans | -88.6 | -16.3 | 173.1 | -69.5 | -176.8 | -179.8 | 173.9 | 0 | 113.4 | G40 | G40-K42 PolarHBondContact O-N 3.14Š|
| 43 | E | 51.1 | Low | 66.1 | Low | 94 Ų | 94 | 124.6 Ų | 124.6 | 44% | 0.439 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -78.1 | -24.8 | -172.1 | -67.5 | -167 | 165.8 | 0 | 0 | 114.1 | G40 E45 E46 K47 | G40-E43 PolarHBondContact O-N 3.25Å; G40-E43 VanDerWaalsContact O-N 3.1Å; E43-E45 VanDerWaalsContact C-N 3.28Å; E43-E45 PolarHBondContact O-N 2.8Å; E43-E46 PolarHBondContact O-N 2.85Å; E43-K47 WeakPolarHBondContact O-CG 2.94Å; E43-K47 PolarHBondContact O-N 3.12Å; E43-K47 IonicContact OE2-NZ 2.68Å; E43-K47 PolarHBondContact OE2-NZ 3.49Å |
| 44 | D | 52.6 | Low | 65.8 | Low | 134 Ų | 134 | 120.5 Ų | 120.5 | 72% | 0.717 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -68.4 | -27.9 | -178.5 | -84.7 | -20 | 0 | 0 | 0 | 112.7 | ||
| 45 | E | 51.3 | Low | 65.5 | Low | 163 Ų | 163 | 121.5 Ų | 121.5 | 76% | 0.762 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -75.9 | -38.5 | 173.5 | -103.4 | -176.8 | 163.8 | 0 | 0 | 112.2 | E43 K48 | E43-E45 VanDerWaalsContact C-N 3.28Å; E43-E45 PolarHBondContact O-N 2.8Å; E45-K48 WeakPolarHBondContact O-CB 3.17Å; E45-K48 PolarHBondContact O-N 3.03Å |
| 46 | E | 53.9 | Low | 65.8 | Low | 156 Ų | 156 | 124.9 Ų | 124.9 | 73% | 0.729 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -72.7 | -32.7 | -179.9 | -77.1 | -173.9 | 162.4 | 0 | 0 | 113.1 | E43 K48 | E43-E46 PolarHBondContact O-N 2.85Å; E46-K48 PolarHBondContact O-N 3.34Å |
| 47 | K | 60.3 | Low | 66 | Low | 144 Ų | 144 | 126.7 Ų | 126.7 | 63% | 0.626 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | -8.3 | 177.4 | -70.4 | 171.5 | -171 | 158 | 0 | 113.8 | E43 Y49 | E43-K47 WeakPolarHBondContact O-CG 2.94Å; E43-K47 PolarHBondContact O-N 3.12Å; E43-K47 IonicContact OE2-NZ 2.68Å; E43-K47 PolarHBondContact OE2-NZ 3.49Å; K47-Y49 VanDerWaalsContact C-N 3.35Å |
| 48 | K | 67.8 | Low | 66.9 | Low | 155 Ų | 155 | 129.4 Ų | 129.4 | 67% | 0.674 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -27.2 | -178.5 | -169.4 | 176.3 | 178.8 | -178.5 | 0 | 112.9 | E45 E46 | E45-K48 WeakPolarHBondContact O-CB 3.17Å; E45-K48 PolarHBondContact O-N 3.03Å; E46-K48 PolarHBondContact O-N 3.34Å |
| 49 | Y | 75.5 | Confident | 68.3 | Low | 185 Ų | 185 | 135.2 Ų | 135.2 | 73% | 0.725 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -112.5 | 132.6 | -177.9 | -61.1 | -76.4 | 0 | 0 | 0 | 111.1 | K47 | K47-Y49 VanDerWaalsContact C-N 3.35Š|
| 50 | L | 79.3 | Confident | 69.8 | Low | 102 Ų | 102 | 135.7 Ų | 135.7 | 53% | 0.534 | 66% | 0.661 | S | S | . | * | trans | -89.7 | 126.3 | 176 | -179.3 | 63.7 | 0 | 0 | 0 | 110.2 | V52 I58 | L50-V52 HydrophobicContact CD2-CG1 4.12Å; L50-V52 HydrophobicContact CG-CG1 4.25Å; L50-V52 PolarHBondContact O-N 3.48Å; L50-I58 HydrophobicContact CD1-CD1 3.34Å; L50-I58 HydrophobicContact CD1-CG1 3.68Å; L50-I58 HydrophobicContact CD2-CD1 3.46Å; L50-I58 VanDerWaalsContact CD2-CD1 3.46Å; L50-I58 HydrophobicContact CG-CD1 4Å | ||
| 51 | D | 80.8 | Confident | 71.4 | Confident | 78 Ų | 78 | 140.2 Ų | 140.2 | 42% | 0.417 | 69% | 0.689 | S | S | . | * | trans | -79.1 | 103.1 | 163.3 | 176.6 | 9.7 | 0 | 0 | 0 | 109.7 | I53 S54 | D51-I53 VanDerWaalsContact C-N 3.27Å; D51-I53 PolarHBondContact O-N 3Å; D51-I53 PolarHBondContact OD1-N 2.89Å; D51-S54 VanDerWaalsContact OD2-CB 3.24Å; D51-S54 WeakPolarHBondContact OD2-CB 3.4Å; D51-S54 PolarHBondContact OD2-OG 3.27Å | ||
| 52 | V | 82.2 | Confident | 73.1 | Confident | 110 Ų | 110 | 139.1 Ų | 139.1 | 67% | 0.667 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | -11.1 | -177.9 | -66.1 | 0 | 0 | 0 | 0 | 113.8 | L50 | L50-V52 HydrophobicContact CD2-CG1 4.12Å; L50-V52 HydrophobicContact CG-CG1 4.25Å; L50-V52 PolarHBondContact O-N 3.48Å |
| 53 | I | 87.3 | Confident | 74.8 | Confident | 152 Ų | 152 | 142.7 Ų | 142.7 | 78% | 0.779 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.4 | -36.1 | -178.8 | -57.5 | 175.2 | 0 | 0 | 0 | 110.5 | D51 | D51-I53 VanDerWaalsContact C-N 3.27Å; D51-I53 PolarHBondContact O-N 3Å; D51-I53 PolarHBondContact OD1-N 2.89Å |
| 54 | S | 81.7 | Confident | 76.5 | Confident | 50 Ų | 50 | 143.6 Ų | 143.6 | 35% | 0.35 | 71% | 0.707 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.1 | -3.3 | -173.6 | 57.4 | 0 | 0 | 0 | 0 | 115.4 | D51 K56 | D51-S54 VanDerWaalsContact OD2-CB 3.24Å; D51-S54 WeakPolarHBondContact OD2-CB 3.4Å; D51-S54 PolarHBondContact OD2-OG 3.27Å; S54-K56 PolarHBondContact O-N 3.04Å; S54-K56 VanDerWaalsContact O-N 3.1Å; S54-K56 WeakPolarHBondContact OG-CE 3.21Å |
| 55 | N | 80 | Confident | 78.1 | Confident | 143 Ų | 143 | 144.8 Ų | 144.8 | 77% | 0.765 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 46.7 | 40.2 | 175.9 | -74.5 | -27.9 | 0 | 0 | 0 | 114.4 | ||
| 56 | K | 85.1 | Confident | 79.8 | Confident | 145 Ų | 145 | 140.2 Ų | 140.2 | 63% | 0.63 | 69% | 0.692 | S | S | * | * | trans | -72.7 | 145.6 | 178 | -65.1 | 175.6 | -176.5 | 172.6 | 0 | 110.9 | S54 | S54-K56 PolarHBondContact O-N 3.04Å; S54-K56 VanDerWaalsContact O-N 3.1Å; S54-K56 WeakPolarHBondContact OG-CE 3.21Å | ||
| 57 | N | 79.5 | Confident | 81.2 | Confident | 170 Ų | 170 | 135.3 Ų | 135.3 | 91% | 0.909 | 67% | 0.674 | S | S | * | * | trans | -64.9 | 134.9 | 173.8 | -60.7 | 82.1 | 0 | 0 | 0 | 111.2 | ||||
| 58 | I | 82.9 | Confident | 82.2 | Confident | 99 Ų | 99 | 132.5 Ų | 132.5 | 51% | 0.508 | 67% | 0.669 | S | S | . | * | trans | -109.9 | 140.7 | 179.9 | -50.6 | 167 | 0 | 0 | 0 | 108.6 | L50 L60 | L50-I58 HydrophobicContact CD1-CD1 3.34Å; L50-I58 HydrophobicContact CD1-CG1 3.68Å; L50-I58 HydrophobicContact CD2-CD1 3.46Å; L50-I58 VanDerWaalsContact CD2-CD1 3.46Å; L50-I58 HydrophobicContact CG-CD1 4Å; I58-L60 HydrophobicContact CG2-CD2 4.02Å; I58-L60 HydrophobicContact CG2-CG 4.12Å | ||
| 59 | K | 82.3 | Confident | 82.8 | Confident | 208 Ų | 208 | 134.9 Ų | 134.9 | 90% | 0.904 | 68% | 0.679 | S | S | * | * | trans | -97.9 | 119.7 | 168.9 | -65.2 | -177.9 | -178.6 | 178.7 | 0 | 108.8 | ||||
| 60 | L | 82.9 | Confident | 83.1 | Confident | 160 Ų | 160 | 133 Ų | 133 | 84% | 0.838 | 68% | 0.677 | S | S | * | * | trans | -116.6 | 135.1 | 174.8 | -64 | 174.2 | 0 | 0 | 0 | 109 | I58 | I58-L60 HydrophobicContact CG2-CD2 4.02Å; I58-L60 HydrophobicContact CG2-CG 4.12Å | ||
| 61 | S | 83.4 | Confident | 83 | Confident | 123 Ų | 123 | 134.7 Ų | 134.7 | 86% | 0.86 | 68% | 0.677 | S | S | * | * | trans | -141 | 125.8 | 176 | 63.1 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 62 | E | 85.6 | Confident | 82.7 | Confident | 175 Ų | 175 | 135.5 Ų | 135.5 | 82% | 0.818 | 69% | 0.687 | S | S | * | * | trans | -115 | 136.2 | 176 | -172.9 | 171.6 | 179.3 | 0 | 0 | 109.9 | V64 | E62-V64 HydrophobicContact CG-CG2 4.35Š| ||
| 63 | R | 85.9 | Confident | 82 | Confident | 250 Ų | 250 | 139.6 Ų | 139.6 | 94% | 0.943 | 70% | 0.696 | S | S | * | * | trans | -98.9 | 111.3 | 174.9 | -67.8 | -173.1 | 179.8 | -178.6 | 1.1 | 109 | ||||
| 64 | V | 87.1 | Confident | 80.8 | Confident | 114 Ų | 114 | 139.2 Ų | 139.2 | 69% | 0.691 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 137.3 | 178.1 | -177.8 | 0 | 0 | 0 | 0 | 110.2 | E62 | E62-V64 HydrophobicContact CG-CG2 4.35Š|
| 65 | L | 85.8 | Confident | 79.5 | Confident | 158 Ų | 158 | 137.8 Ų | 137.8 | 83% | 0.827 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 127.7 | 177.9 | -174.8 | 71.1 | 0 | 0 | 0 | 110.9 | ||
| 66 | I | 86 | Confident | 78.3 | Confident | 67 Ų | 67 | 134.1 Ų | 134.1 | 34% | 0.344 | 67% | 0.67 | S | S | . | * | P | Polyproline II helix | trans | -90.5 | 124.7 | 171.5 | -57 | 179.1 | 0 | 0 | 0 | 108.7 | V68 C75 L79 | I66-V68 HydrophobicContact CB-CG1 4.19Å; I66-V68 HydrophobicContact CG2-CG1 3.75Å; I66-V68 PolarHBondContact O-N 3.11Å; I66-C75 HydrophobicContact CG2-CB 3.49Å; I66-C75 VanDerWaalsContact CG2-CB 3.49Å; I66-L79 HydrophobicContact CD1-CB 4.5Å; I66-L79 HydrophobicContact CD1-CD1 4.26Å; I66-L79 HydrophobicContact CG1-CD1 4.4Å; I66-L79 HydrophobicContact CG2-CD1 4.23Å |
| 67 | P | 83.3 | Confident | 76.9 | Confident | 54 Ų | 54 | 130.5 Ų | 130.5 | 35% | 0.351 | 67% | 0.667 | S | S | . | * | trans | -78.1 | 55.7 | -174.6 | 33.7 | -37.2 | 0 | 0 | 0 | 112.7 | K69 Q70 Y71 | P67-K69 PolarHBondContact O-N 3.5Å; P67-K69 VanDerWaalsContact O-N 3.07Å; P67-Q70 HydrophobicContact CB-CB 4.48Å; P67-Q70 PolarHBondContact O-N 3.39Å; P67-Y71 HydrophobicContact CG-CD2 4.39Å; P67-Y71 PolarHBondContact O-N 3.31Å | ||
| 68 | V | 83 | Confident | 75.7 | Confident | 84 Ų | 84 | 128.7 Ų | 128.7 | 51% | 0.509 | 66% | 0.657 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59.4 | -24 | -176.3 | -62.1 | 0 | 0 | 0 | 0 | 113.8 | I66 P72 | I66-V68 HydrophobicContact CB-CG1 4.19Å; I66-V68 HydrophobicContact CG2-CG1 3.75Å; I66-V68 PolarHBondContact O-N 3.11Å; V68-P72 WeakPolarHBondContact O-CA 3.46Å |
| 69 | K | 80.1 | Confident | 74.5 | Confident | 206 Ų | 206 | 129.5 Ų | 129.5 | 90% | 0.896 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | -29.8 | 177.1 | -63.2 | -172.5 | 179.6 | -179.4 | 0 | 113 | P67 | P67-K69 PolarHBondContact O-N 3.5Å; P67-K69 VanDerWaalsContact O-N 3.07Å |
| 70 | Q | 81 | Confident | 73.2 | Confident | 146 Ų | 146 | 129.1 Ų | 129.1 | 68% | 0.682 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -36.4 | -178.6 | -66.4 | 169.8 | -0.1 | 0 | 0 | 110.8 | P67 | P67-Q70 HydrophobicContact CB-CB 4.48Å; P67-Q70 PolarHBondContact O-N 3.39Å |
| 71 | Y | 78.3 | Confident | 71.5 | Confident | 136 Ų | 136 | 128 Ų | 128 | 53% | 0.533 | 65% | 0.651 | S | S | . | * | trans | -132.5 | 73.9 | -177.6 | -56.5 | -76.5 | 0 | 0 | 0 | 111.7 | P67 K73 | P67-Y71 HydrophobicContact CG-CD2 4.39Å; P67-Y71 PolarHBondContact O-N 3.31Å; Y71-K73 VanDerWaalsContact C-N 3.27Å; Y71-K73 PolarHBondContact O-N 3Å | ||
| 72 | P | 73.4 | Confident | 69.7 | Low | 95 Ų | 95 | 128 Ų | 128 | 62% | 0.617 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -19.9 | -173.7 | 22.6 | -31.9 | 0 | 0 | 0 | 114.8 | V68 | V68-P72 WeakPolarHBondContact O-CA 3.46Š|
| 73 | K | 68.3 | Low | 67.5 | Low | 197 Ų | 197 | 123.6 Ų | 123.6 | 86% | 0.857 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | -25.7 | -173.6 | -64 | -177.7 | -178.8 | 178.3 | 0 | 114.8 | Y71 | Y71-K73 VanDerWaalsContact C-N 3.27Å; Y71-K73 PolarHBondContact O-N 3Å |
| 74 | E | 61.2 | Low | 65.2 | Low | 144 Ų | 144 | 116.3 Ų | 116.3 | 67% | 0.673 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.1 | -25.5 | -170.8 | -65.2 | -175.6 | -174.4 | 0 | 0 | 113.7 | ||
| 75 | C | 54.6 | Low | 62.9 | Low | 19 Ų | 19 | 116.5 Ų | 116.5 | 13% | 0.128 | 63% | 0.63 | C | S | . | * | H | α-helix | trans | -83.7 | -26.1 | -173.9 | -61.6 | 0 | 0 | 0 | 0 | 115.1 | I66 | I66-C75 HydrophobicContact CG2-CB 3.49Å; I66-C75 VanDerWaalsContact CG2-CB 3.49Å |
| 76 | A | 55.4 | Low | 60.6 | Low | 66 Ų | 66 | 115.6 Ų | 115.6 | 55% | 0.545 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -79.3 | -32.5 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 77 | A | 54.6 | Low | 58.4 | Low | 69 Ų | 69 | 117 Ų | 117 | 57% | 0.57 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -90 | -33.3 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 78 | N | 54.8 | Low | 56.2 | Low | 133 Ų | 133 | 122.7 Ų | 122.7 | 71% | 0.711 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -89.3 | -20.3 | -171.5 | -70.7 | -27.9 | 0 | 0 | 0 | 114.4 | ||
| 79 | L | 57.8 | Low | 54 | Low | 116 Ų | 116 | 124 Ų | 124 | 61% | 0.607 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -92.7 | -8.2 | 179.6 | -78.7 | 154.9 | 0 | 0 | 0 | 113.6 | I66 | I66-L79 HydrophobicContact CD1-CB 4.5Å; I66-L79 HydrophobicContact CD1-CD1 4.26Å; I66-L79 HydrophobicContact CG1-CD1 4.4Å; I66-L79 HydrophobicContact CG2-CD1 4.23Å |
| 80 | Y | 54.6 | Low | 51.7 | Low | 200 Ų | 200 | 119.8 Ų | 119.8 | 78% | 0.784 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -93.4 | -1.4 | -177.1 | -122.5 | -91.4 | 0 | 0 | 0 | 114.1 | P82 | Y80-P82 VanDerWaalsContact O-CD 3.32Å; Y80-P82 WeakPolarHBondContact O-CD 3.41Å |
| 81 | L | 47.4 | Very low | 49.6 | Very low | 137 Ų | 137 | 120.8 Ų | 120.8 | 72% | 0.717 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -84.5 | 112.9 | 166.4 | -89.2 | 128.6 | 0 | 0 | 0 | 108.3 | A83 | L81-A83 PolarHBondContact O-N 3.34Š|
| 82 | P | 45.3 | Very low | 47.7 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 79% | 0.792 | 70% | 0.699 | S | S | * | * | trans | -67.6 | 100.6 | 170.2 | 28.1 | -31.3 | 0 | 0 | 0 | 107.6 | Y80 S84 | Y80-P82 VanDerWaalsContact O-CD 3.32Å; Y80-P82 WeakPolarHBondContact O-CD 3.41Å; P82-S84 VanDerWaalsContact C-N 3.29Å; P82-S84 PolarHBondContact O-N 3.3Å | ||
| 83 | A | 38.8 | Very low | 46.5 | Very low | 82 Ų | 82 | 127 Ų | 127 | 68% | 0.678 | 70% | 0.703 | S | S | * | * | trans | -62.3 | 101.2 | 156.7 | 0 | 0 | 0 | 0 | 0 | 106.1 | L81 V85 | L81-A83 PolarHBondContact O-N 3.34Å; A83-V85 HydrophobicContact CB-CG2 4.02Å; A83-V85 PolarHBondContact O-N 3.26Å | ||
| 84 | S | 38.1 | Very low | 45.3 | Very low | 98 Ų | 98 | 123.3 Ų | 123.3 | 69% | 0.685 | 70% | 0.695 | S | S | * | * | trans | -62.8 | 86.8 | 162.9 | 179.7 | 0 | 0 | 0 | 0 | 106.9 | P82 N86 | P82-S84 VanDerWaalsContact C-N 3.29Å; P82-S84 PolarHBondContact O-N 3.3Å; S84-N86 PolarHBondContact O-N 3.16Å | ||
| 85 | V | 39.9 | Very low | 44.4 | Very low | 118 Ų | 118 | 122.1 Ų | 122.1 | 72% | 0.715 | 70% | 0.696 | S | S | * | * | trans | -89.3 | 87.5 | 167.7 | -173.7 | 0 | 0 | 0 | 0 | 105.7 | A83 S87 | A83-V85 HydrophobicContact CB-CG2 4.02Å; A83-V85 PolarHBondContact O-N 3.26Å; V85-S87 VanDerWaalsContact C-N 3.31Å; V85-S87 PolarHBondContact O-N 2.64Å | ||
| 86 | N | 36.8 | Very low | 43.8 | Very low | 139 Ų | 139 | 128.2 Ų | 128.2 | 74% | 0.743 | 73% | 0.729 | S | S | * | * | trans | -65.9 | 97.3 | 160.2 | -72.8 | -36.2 | 0 | 0 | 0 | 106.8 | S84 E88 | S84-N86 PolarHBondContact O-N 3.16Å; N86-E88 PolarHBondContact O-N 3.2Å; N86-E88 VanDerWaalsContact O-N 3.13Å | ||
| 87 | S | 39.8 | Very low | 43.1 | Very low | 96 Ų | 96 | 132.1 Ų | 132.1 | 67% | 0.671 | 74% | 0.741 | S | S | * | * | trans | -78.3 | 91.6 | 169.7 | 65.2 | 0 | 0 | 0 | 0 | 108.7 | V85 V89 | V85-S87 VanDerWaalsContact C-N 3.31Å; V85-S87 PolarHBondContact O-N 2.64Å; S87-V89 PolarHBondContact O-N 3.35Å | ||
| 88 | E | 38 | Very low | 42.3 | Very low | 173 Ų | 173 | 136.3 Ų | 136.3 | 81% | 0.808 | 75% | 0.752 | S | S | * | * | trans | -65 | 107.2 | 155.8 | -74.3 | -178.5 | 153.8 | 0 | 0 | 107.5 | N86 T90 | N86-E88 PolarHBondContact O-N 3.2Å; N86-E88 VanDerWaalsContact O-N 3.13Å; E88-T90 VanDerWaalsContact C-N 3.3Å; E88-T90 PolarHBondContact O-N 3.3Å | ||
| 89 | V | 35 | Very low | 41.4 | Very low | 113 Ų | 113 | 136.5 Ų | 136.5 | 69% | 0.685 | 76% | 0.755 | S | S | * | * | trans | -75 | 88.1 | 171.7 | -179 | 0 | 0 | 0 | 0 | 107.5 | S87 H91 | S87-V89 PolarHBondContact O-N 3.35Å; V89-H91 PolarHBondContact O-N 3.45Å | ||
| 90 | T | 31.9 | Very low | 40.2 | Very low | 117 Ų | 117 | 138.1 Ų | 138.1 | 72% | 0.718 | 77% | 0.767 | S | S | * | * | trans | -73.9 | 115.4 | 164.5 | -59.3 | 0 | 0 | 0 | 0 | 107.9 | E88 | E88-T90 VanDerWaalsContact C-N 3.3Å; E88-T90 PolarHBondContact O-N 3.3Å | ||
| 91 | H | 37.9 | Very low | 39 | Very low | 166 Ų | 166 | 132.9 Ų | 132.9 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | trans | -67.4 | 134.4 | 171.5 | -79 | 41.4 | 0 | 0 | 0 | 109.9 | V89 | V89-H91 PolarHBondContact O-N 3.45Š| ||
| 92 | I | 39 | Very low | 38.2 | Very low | 234 Ų | 234 | 132.5 Ų | 132.5 | 100% | 1.2 | 77% | 0.77 | S | S | * | * | trans | -122.4 | 0 | 154.7 | -48.9 | 179.1 | 0 | 0 | 0 | 106.6 |
Retrieved 92 of 92 residues in 24 ms
(Link to these results)