| 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 | 59.5 | Low | 81.5 | Confident | 243 Ų | 243 | 104.1 Ų | 104.1 | 100% | 1.197 | 59% | 0.59 | S | S | * | * | 0 | 129.7 | 0 | -72.6 | 166.2 | 125.8 | 0 | 0 | 108.3 | |||||
| 2 | S | 78.3 | Confident | 82.2 | Confident | 79 Ų | 79 | 107.3 Ų | 107.3 | 55% | 0.552 | 59% | 0.585 | S | S | * | * | trans | -71.4 | 140.1 | 179 | 178.6 | 0 | 0 | 0 | 0 | 110.7 | N4 G5 A6 | S2-N4 PolarHBondContact O-N 3.48Å; S2-N4 PolarHBondContact OG-N 3.07Å; S2-G5 WeakPolarHBondContact O-CA 3.34Å; S2-G5 PolarHBondContact O-N 2.96Å; S2-A6 PolarHBondContact O-N 3.06Å | ||
| 3 | V | 73.4 | Confident | 82.6 | Confident | 114 Ų | 114 | 104.9 Ų | 104.9 | 69% | 0.691 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -51.8 | -39.7 | 174.2 | 175.2 | 0 | 0 | 0 | 0 | 110.8 | G5 A6 V7 | V3-G5 VanDerWaalsContact C-N 3.32Å; V3-G5 PolarHBondContact O-N 2.72Å; V3-A6 PolarHBondContact O-N 3.43Å; V3-V7 WeakPolarHBondContact O-CG2 3.33Å; V3-V7 PolarHBondContact O-N 3.14Å; V3-V7 VanDerWaalsContact O-N 3.13Å |
| 4 | N | 78.1 | Confident | 82.8 | Confident | 111 Ų | 111 | 102.6 Ų | 102.6 | 59% | 0.594 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -62.4 | -38.5 | 176.2 | -67.5 | -27.3 | 0 | 0 | 0 | 112.1 | S2 A6 V7 W8 | S2-N4 PolarHBondContact O-N 3.48Å; S2-N4 PolarHBondContact OG-N 3.07Å; N4-A6 VanDerWaalsContact C-N 3.34Å; N4-A6 PolarHBondContact O-N 3.49Å; N4-V7 PolarHBondContact O-N 3.11Å; N4-W8 PolarHBondContact O-N 3.2Å |
| 5 | G | 84.4 | Confident | 83.1 | Confident | 47 Ų | 47 | 103.7 Ų | 103.7 | 49% | 0.485 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.7 | -38 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S2 V3 G9 | S2-G5 WeakPolarHBondContact O-CA 3.34Å; S2-G5 PolarHBondContact O-N 2.96Å; V3-G5 VanDerWaalsContact C-N 3.32Å; V3-G5 PolarHBondContact O-N 2.72Å; G5-G9 PolarHBondContact O-N 3.47Å |
| 6 | A | 84.5 | Confident | 83.5 | Confident | 68 Ų | 68 | 109 Ų | 109 | 56% | 0.562 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.8 | -39.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S2 V3 N4 G9 R10 | S2-A6 PolarHBondContact O-N 3.06Å; V3-A6 PolarHBondContact O-N 3.43Å; N4-A6 VanDerWaalsContact C-N 3.34Å; N4-A6 PolarHBondContact O-N 3.49Å; A6-G9 PolarHBondContact O-N 3.36Å; A6-R10 PolarHBondContact O-N 3.18Å; A6-R10 VanDerWaalsContact O-N 3.12Å |
| 7 | V | 86.4 | Confident | 83.8 | Confident | 79 Ų | 79 | 104.3 Ų | 104.3 | 48% | 0.479 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.3 | -51.3 | 175.6 | 174 | 0 | 0 | 0 | 0 | 110.9 | V3 N4 G9 R10 V11 | V3-V7 WeakPolarHBondContact O-CG2 3.33Å; V3-V7 PolarHBondContact O-N 3.14Å; V3-V7 VanDerWaalsContact O-N 3.13Å; N4-V7 PolarHBondContact O-N 3.11Å; V7-G9 VanDerWaalsContact C-N 3.29Å; V7-G9 PolarHBondContact O-N 3.31Å; V7-R10 PolarHBondContact O-N 3.38Å; V7-V11 WeakPolarHBondContact O-CG2 3.36Å; V7-V11 PolarHBondContact O-N 3.32Å |
| 8 | W | 87.9 | Confident | 83.9 | Confident | 170 Ų | 170 | 103.2 Ų | 103.2 | 64% | 0.644 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.9 | -34.8 | 178.7 | -78.8 | 109.4 | 0 | 0 | 0 | 112.9 | N4 R12 | N4-W8 PolarHBondContact O-N 3.2Å; W8-R12 WeakPolarHBondContact O-CB 3.13Å; W8-R12 PolarHBondContact O-N 3.02Å |
| 9 | G | 89 | Confident | 84.3 | Confident | 40 Ų | 40 | 102.2 Ų | 102.2 | 41% | 0.412 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.9 | -45.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G5 A6 V7 R12 S13 | G5-G9 PolarHBondContact O-N 3.47Å; A6-G9 PolarHBondContact O-N 3.36Å; V7-G9 VanDerWaalsContact C-N 3.29Å; V7-G9 PolarHBondContact O-N 3.31Å; G9-R12 PolarHBondContact O-N 2.77Å; G9-S13 WeakPolarHBondContact O-CB 3.35Å; G9-S13 PolarHBondContact O-N 3.27Å |
| 10 | R | 85.9 | Confident | 84.6 | Confident | 134 Ų | 134 | 105 Ų | 105 | 51% | 0.506 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.5 | -44.6 | 178.7 | -166.4 | -178.1 | -61.8 | -146 | 6.6 | 112 | A6 V7 S13 R14 G73 | A6-R10 PolarHBondContact O-N 3.18Å; A6-R10 VanDerWaalsContact O-N 3.12Å; V7-R10 PolarHBondContact O-N 3.38Å; R10-S13 PolarHBondContact O-N 3.38Å; R10-R14 WeakPolarHBondContact O-CG 3.47Å; R10-R14 PolarHBondContact O-N 3.08Å; R10-G73 PolarHBondContact NH1-O 3.44Å |
| 11 | V | 88.5 | Confident | 84.8 | Confident | 60 Ų | 60 | 102.8 Ų | 102.8 | 36% | 0.364 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.5 | -47.4 | 177.1 | 173.9 | 0 | 0 | 0 | 0 | 110.9 | V7 S13 R14 L15 | V7-V11 WeakPolarHBondContact O-CG2 3.36Å; V7-V11 PolarHBondContact O-N 3.32Å; V11-S13 VanDerWaalsContact C-N 3.34Å; V11-S13 PolarHBondContact O-N 3.39Å; V11-R14 PolarHBondContact O-N 2.99Å; V11-L15 HydrophobicContact CG1-CD1 4.09Å; V11-L15 WeakPolarHBondContact O-CG 3.3Å; V11-L15 PolarHBondContact O-N 3.4Å |
| 12 | R | 89.9 | Confident | 86.3 | Confident | 142 Ų | 142 | 93.1 Ų | 93.1 | 54% | 0.536 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64 | -38.8 | -179.8 | -167.3 | -179.6 | -60.1 | 163.7 | 2 | 112.5 | W8 G9 L15 R16 | W8-R12 WeakPolarHBondContact O-CB 3.13Å; W8-R12 PolarHBondContact O-N 3.02Å; G9-R12 PolarHBondContact O-N 2.77Å; R12-L15 PolarHBondContact O-N 3.46Å; R12-R16 WeakPolarHBondContact O-CG 3.05Å; R12-R16 PolarHBondContact O-N 2.04Å |
| 13 | S | 88 | Confident | 87 | Confident | 77 Ų | 77 | 92.8 Ų | 92.8 | 54% | 0.538 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.7 | -45.1 | 174.3 | 177.4 | 0 | 0 | 0 | 0 | 111.6 | G9 R10 V11 L15 R16 A17 | G9-S13 WeakPolarHBondContact O-CB 3.35Å; G9-S13 PolarHBondContact O-N 3.27Å; R10-S13 PolarHBondContact O-N 3.38Å; V11-S13 VanDerWaalsContact C-N 3.34Å; V11-S13 PolarHBondContact O-N 3.39Å; S13-L15 PolarHBondContact O-N 3.26Å; S13-R16 PolarHBondContact O-N 3.48Å; S13-A17 PolarHBondContact O-N 2.98Å |
| 14 | R | 85.1 | Confident | 88 | Confident | 72 Ų | 72 | 91.3 Ų | 91.3 | 27% | 0.272 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.9 | -45.3 | 176.3 | -71.4 | 174.7 | 178.9 | 177.6 | -0.7 | 112.4 | R10 V11 R16 A17 F18 T69 | R10-R14 WeakPolarHBondContact O-CG 3.47Å; R10-R14 PolarHBondContact O-N 3.08Å; V11-R14 PolarHBondContact O-N 2.99Å; R14-R16 VanDerWaalsContact C-N 3.31Å; R14-R16 PolarHBondContact O-N 3.45Å; R14-A17 PolarHBondContact O-N 2.97Å; R14-F18 PolarHBondContact O-N 3.36Å; R14-T69 HydrophobicContact CB-CG2 4.03Å; R14-T69 HydrophobicContact CG-CG2 4.18Å |
| 15 | L | 87.7 | Confident | 88.9 | Confident | 119 Ų | 119 | 86.1 Ų | 86.1 | 62% | 0.623 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -62.9 | -36.7 | 177.8 | -71.6 | 173 | 0 | 0 | 0 | 112.2 | V11 R12 S13 F18 P19 | V11-L15 HydrophobicContact CG1-CD1 4.09Å; V11-L15 WeakPolarHBondContact O-CG 3.3Å; V11-L15 PolarHBondContact O-N 3.4Å; R12-L15 PolarHBondContact O-N 3.46Å; S13-L15 PolarHBondContact O-N 3.26Å; L15-F18 WeakPolarHBondContact O-CB 3.01Å; L15-F18 PolarHBondContact O-N 2.94Å; L15-P19 WeakPolarHBondContact O-CD 3.49Å |
| 16 | R | 90.1 | Very high | 89.5 | Confident | 189 Ų | 189 | 85.7 Ų | 85.7 | 71% | 0.713 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -67.1 | -34.7 | 176.6 | -77.6 | 176.8 | 179.4 | 165.8 | -3.4 | 113.4 | R12 S13 R14 F18 P19 | R12-R16 WeakPolarHBondContact O-CG 3.05Å; R12-R16 PolarHBondContact O-N 2.04Å; S13-R16 PolarHBondContact O-N 3.48Å; R14-R16 VanDerWaalsContact C-N 3.31Å; R14-R16 PolarHBondContact O-N 3.45Å; R16-F18 VanDerWaalsContact C-N 3.29Å; R16-P19 WeakPolarHBondContact O-CD 2.98Å |
| 17 | A | 87.7 | Confident | 90.1 | Very high | 29 Ų | 29 | 86 Ų | 86 | 24% | 0.24 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -80.4 | -10.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | S13 R14 R21 | S13-A17 PolarHBondContact O-N 2.98Å; R14-A17 PolarHBondContact O-N 2.97Å; A17-R21 WeakPolarHBondContact O-CG 3.39Å; A17-R21 PolarHBondContact O-N 3.13Å |
| 18 | F | 86.3 | Confident | 90.7 | Very high | 84 Ų | 84 | 85.2 Ų | 85.2 | 37% | 0.368 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64 | -45.2 | -174.1 | -171.6 | -104.2 | 0 | 0 | 0 | 113.8 | R14 L15 R16 E20 R21 L22 A66 | R14-F18 PolarHBondContact O-N 3.36Å; L15-F18 WeakPolarHBondContact O-CB 3.01Å; L15-F18 PolarHBondContact O-N 2.94Å; R16-F18 VanDerWaalsContact C-N 3.29Å; F18-E20 PolarHBondContact O-N 2.93Å; F18-R21 PolarHBondContact O-N 3.38Å; F18-L22 HydrophobicContact CD1-CD1 3.87Å; F18-L22 HydrophobicContact CD1-CG 4.2Å; F18-L22 HydrophobicContact CE1-CD1 3.28Å; F18-L22 HydrophobicContact CE1-CD2 4.36Å; F18-L22 HydrophobicContact CE1-CG 3.87Å; F18-L22 HydrophobicContact CE2-CD2 4.28Å; F18-L22 HydrophobicContact CE2-CG 4.42Å; F18-L22 HydrophobicContact CZ-CD1 3.7Å; F18-L22 HydrophobicContact CZ-CD2 3.97Å; F18-L22 HydrophobicContact CZ-CG 3.98Å; F18-L22 PolarHBondContact O-N 3.39Å; F18-A66 HydrophobicContact CE2-CB 4.42Å |
| 19 | P | 90.9 | Very high | 91.2 | Very high | 85 Ų | 85 | 79 Ų | 79 | 55% | 0.552 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -60.4 | -44.4 | 179.7 | -23.7 | 35.1 | 0 | 0 | 0 | 113.2 | L15 R16 R21 L22 A23 | L15-P19 WeakPolarHBondContact O-CD 3.49Å; R16-P19 WeakPolarHBondContact O-CD 2.98Å; P19-R21 VanDerWaalsContact C-N 3.27Å; P19-R21 PolarHBondContact O-N 3.36Å; P19-L22 PolarHBondContact O-N 3.02Å; P19-A23 WeakPolarHBondContact O-CB 3.29Å; P19-A23 PolarHBondContact O-N 2.97Å |
| 20 | E | 90.6 | Very high | 91.6 | Very high | 158 Ų | 158 | 79 Ų | 79 | 74% | 0.738 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -61 | -37.8 | 178.3 | -171.5 | -176.1 | 172.6 | 0 | 0 | 111.6 | F18 A23 A24 | F18-E20 PolarHBondContact O-N 2.93Å; E20-A23 WeakPolarHBondContact O-CB 3.25Å; E20-A23 PolarHBondContact O-N 3.17Å; E20-A24 PolarHBondContact O-N 3.17Å |
| 21 | R | 88.4 | Confident | 92.2 | Very high | 58 Ų | 58 | 74.2 Ų | 74.2 | 22% | 0.219 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -72.3 | -36.3 | 178.1 | -70 | 177.2 | -179.1 | -116.6 | 13.5 | 113.1 | A17 F18 P19 A23 A24 A65 K68 T69 | A17-R21 WeakPolarHBondContact O-CG 3.39Å; A17-R21 PolarHBondContact O-N 3.13Å; F18-R21 PolarHBondContact O-N 3.38Å; P19-R21 VanDerWaalsContact C-N 3.27Å; P19-R21 PolarHBondContact O-N 3.36Å; R21-A23 VanDerWaalsContact C-N 3.32Å; R21-A24 WeakPolarHBondContact O-CB 3.48Å; R21-A24 PolarHBondContact O-N 2.86Å; R21-A65 HydrophobicContact CB-CB 4.44Å; R21-K68 PolarHBondContact NH1-O 3.13Å; R21-T69 WeakPolarHBondContact CD-OG1 3.44Å |
| 22 | L | 90.7 | Very high | 92.7 | Very high | 41 Ų | 41 | 75 Ų | 75 | 22% | 0.215 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -69.8 | -32.2 | 172.6 | -66.2 | -171.2 | 0 | 0 | 0 | 111.9 | F18 P19 A24 C25 F62 | F18-L22 HydrophobicContact CD1-CD1 3.87Å; F18-L22 HydrophobicContact CD1-CG 4.2Å; F18-L22 HydrophobicContact CE1-CD1 3.28Å; F18-L22 HydrophobicContact CE1-CD2 4.36Å; F18-L22 HydrophobicContact CE1-CG 3.87Å; F18-L22 HydrophobicContact CE2-CD2 4.28Å; F18-L22 HydrophobicContact CE2-CG 4.42Å; F18-L22 HydrophobicContact CZ-CD1 3.7Å; F18-L22 HydrophobicContact CZ-CD2 3.97Å; F18-L22 HydrophobicContact CZ-CG 3.98Å; F18-L22 PolarHBondContact O-N 3.39Å; P19-L22 PolarHBondContact O-N 3.02Å; L22-A24 PolarHBondContact O-N 3.4Å; L22-C25 WeakPolarHBondContact O-CB 3.48Å; L22-C25 PolarHBondContact O-N 3.41Å; L22-F62 HydrophobicContact CB-CE1 4.12Å; L22-F62 HydrophobicContact CD2-CB 4.16Å; L22-F62 HydrophobicContact CD2-CD1 3.51Å; L22-F62 HydrophobicContact CD2-CE1 3.91Å; L22-F62 HydrophobicContact CD2-CG 3.83Å; L22-F62 HydrophobicContact CG-CD1 4.49Å; L22-F62 HydrophobicContact CG-CE1 4.44Å |
| 23 | A | 93.6 | Very high | 93 | Very high | 72 Ų | 72 | 69.9 Ų | 69.9 | 60% | 0.595 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.4 | -25.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | P19 E20 R21 C25 G26 | P19-A23 WeakPolarHBondContact O-CB 3.29Å; P19-A23 PolarHBondContact O-N 2.97Å; E20-A23 WeakPolarHBondContact O-CB 3.25Å; E20-A23 PolarHBondContact O-N 3.17Å; R21-A23 VanDerWaalsContact C-N 3.32Å; A23-C25 PolarHBondContact O-N 2.79Å; A23-G26 PolarHBondContact O-N 3.49Å; A23-G26 VanDerWaalsContact O-N 3.15Å |
| 24 | A | 93.8 | Very high | 93.5 | Very high | 83 Ų | 83 | 73.5 Ų | 73.5 | 69% | 0.686 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -19.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | E20 R21 L22 G26 | E20-A24 PolarHBondContact O-N 3.17Å; R21-A24 WeakPolarHBondContact O-CB 3.48Å; R21-A24 PolarHBondContact O-N 2.86Å; L22-A24 PolarHBondContact O-N 3.4Å; A24-G26 VanDerWaalsContact C-N 3.26Å; A24-G26 PolarHBondContact O-N 3Å |
| 25 | C | 97.3 | Very high | 94.1 | Very high | 1 Ų | 1 | 71.3 Ų | 71.3 | 1% | 0.007 | 41% | 0.409 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | 22.4 | 175.7 | -58 | 0 | 0 | 0 | 0 | 112.8 | L22 A23 A27 E28 A29 L58 C61 F62 | L22-C25 WeakPolarHBondContact O-CB 3.48Å; L22-C25 PolarHBondContact O-N 3.41Å; A23-C25 PolarHBondContact O-N 2.79Å; C25-A27 VanDerWaalsContact C-N 3.27Å; C25-A27 PolarHBondContact O-N 3.25Å; C25-E28 WeakPolarHBondContact CA-OE2 3.38Å; C25-E28 PolarHBondContact O-N 3.31Å; C25-A29 WeakPolarHBondContact O-CB 3.48Å; C25-A29 PolarHBondContact O-N 2.99Å; C25-L58 HydrophobicContact CB-CD1 4.3Å; C25-C61 WeakPolarHBondContact CA-SG 3.5Å; C25-C61 HydrophobicContact CB-CB 3.73Å; C25-C61 WeakPolarHBondContact CB-SG 3.33Å; C25-C61 WeakPolarHBondContact SG-CB 3.34Å; C25-C61 CovalentContact SG-SG 2.03Å; C25-C61 PolarHBondContact SG-SG 3.26Å; C25-F62 HydrophobicContact CB-CD1 3.82Å; C25-F62 HydrophobicContact CB-CE1 3.75Å |
| 26 | G | 97.3 | Very high | 94.6 | Very high | 38 Ų | 38 | 67.3 Ų | 67.3 | 39% | 0.392 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.3 | -30.7 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | A23 A24 A30 | A23-G26 PolarHBondContact O-N 3.49Å; A23-G26 VanDerWaalsContact O-N 3.15Å; A24-G26 VanDerWaalsContact C-N 3.26Å; A24-G26 PolarHBondContact O-N 3Å; G26-A30 VanDerWaalsContact O-CB 3.29Å; G26-A30 WeakPolarHBondContact O-CB 3.43Å; G26-A30 PolarHBondContact O-N 3.41Å |
| 27 | A | 97.9 | Very high | 94.9 | Very high | 75 Ų | 75 | 65.1 Ų | 65.1 | 62% | 0.62 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -67.6 | -47.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | C25 A30 A31 | C25-A27 VanDerWaalsContact C-N 3.27Å; C25-A27 PolarHBondContact O-N 3.25Å; A27-A30 PolarHBondContact O-N 2.82Å; A27-A31 PolarHBondContact O-N 3.02Å |
| 28 | E | 98.2 | Very high | 95.3 | Very high | 63 Ų | 63 | 67 Ų | 67 | 29% | 0.294 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -65 | -40.9 | 176.2 | -62.1 | 85.5 | 164.4 | 0 | 0 | 110.8 | C25 A30 A31 Y32 A57 L58 C61 | C25-E28 WeakPolarHBondContact CA-OE2 3.38Å; C25-E28 PolarHBondContact O-N 3.31Å; E28-A30 PolarHBondContact O-N 3.33Å; E28-A31 PolarHBondContact O-N 3.46Å; E28-Y32 PolarHBondContact O-N 2.86Å; E28-A57 HydrophobicContact CG-CB 4.39Å; E28-L58 HydrophobicContact CB-CB 4.13Å; E28-L58 HydrophobicContact CB-CD1 4.1Å; E28-C61 HydrophobicContact CG-CB 4.32Å |
| 29 | A | 97.9 | Very high | 95.6 | Very high | 39 Ų | 39 | 63.9 Ų | 63.9 | 32% | 0.322 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | C25 Y32 G33 L58 | C25-A29 WeakPolarHBondContact O-CB 3.48Å; C25-A29 PolarHBondContact O-N 2.99Å; A29-Y32 PolarHBondContact O-N 3.45Å; A29-G33 PolarHBondContact O-N 2.81Å; A29-L58 HydrophobicContact CB-CD1 3.83Å; A29-L58 HydrophobicContact CB-CD2 4.46Å |
| 30 | A | 98.3 | Very high | 95.8 | Very high | 40 Ų | 40 | 63.9 Ų | 63.9 | 33% | 0.331 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.7 | -36.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G26 A27 E28 R34 | G26-A30 VanDerWaalsContact O-CB 3.29Å; G26-A30 WeakPolarHBondContact O-CB 3.43Å; G26-A30 PolarHBondContact O-N 3.41Å; A27-A30 PolarHBondContact O-N 2.82Å; E28-A30 PolarHBondContact O-N 3.33Å; A30-R34 WeakPolarHBondContact O-CB 3.33Å; A30-R34 WeakPolarHBondContact O-CG 3.39Å; A30-R34 PolarHBondContact O-N 3.39Å |
| 31 | A | 98.4 | Very high | 95.9 | Very high | 33 Ų | 33 | 58.4 Ų | 58.4 | 27% | 0.273 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -63.4 | -47.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | A27 E28 R34 C35 E54 | A27-A31 PolarHBondContact O-N 3.02Å; E28-A31 PolarHBondContact O-N 3.46Å; A31-R34 PolarHBondContact O-N 3.31Å; A31-C35 PolarHBondContact O-N 3.5Å; A31-C35 VanDerWaalsContact O-N 3.13Å; A31-E54 HydrophobicContact CB-CG 4.45Å |
| 32 | Y | 98.3 | Very high | 96.1 | Very high | 78 Ų | 78 | 62.3 Ų | 62.3 | 31% | 0.306 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.7 | -47.1 | 175.6 | 176.7 | -115.5 | 0 | 0 | 0 | 112 | E28 A29 R34 C35 V36 C51 E54 F55 L58 | E28-Y32 PolarHBondContact O-N 2.86Å; A29-Y32 PolarHBondContact O-N 3.45Å; Y32-R34 VanDerWaalsContact C-N 3.33Å; Y32-R34 PolarHBondContact O-N 3.01Å; Y32-C35 PolarHBondContact O-N 3.19Å; Y32-C35 VanDerWaalsContact O-N 3.17Å; Y32-V36 HydrophobicContact CD2-CG2 4.23Å; Y32-V36 HydrophobicContact CE1-CG2 4.12Å; Y32-V36 HydrophobicContact CE2-CG2 3.75Å; Y32-V36 WeakPolarHBondContact O-CG2 3.05Å; Y32-V36 PolarHBondContact O-N 3.13Å; Y32-C51 HydrophobicContact CD2-CB 3.93Å; Y32-C51 HydrophobicContact CE2-CB 3.76Å; Y32-E54 HydrophobicContact CD2-CB 4.08Å; Y32-F55 HydrophobicContact CD2-CB 3.88Å; Y32-F55 HydrophobicContact CE1-CD2 4.47Å; Y32-F55 HydrophobicContact CE2-CB 3.75Å; Y32-F55 HydrophobicContact CE2-CD2 4.18Å; Y32-F55 HydrophobicContact CE2-CG 4.4Å; Y32-L58 HydrophobicContact CD1-CD2 3.98Å; Y32-L58 HydrophobicContact CG-CD2 4.33Å |
| 33 | G | 97.3 | Very high | 96.1 | Very high | 33 Ų | 33 | 64.8 Ų | 64.8 | 34% | 0.34 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -58.5 | -42.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | A29 V36 Q37 | A29-G33 PolarHBondContact O-N 2.81Å; G33-V36 PolarHBondContact O-N 3.46Å; G33-Q37 VanDerWaalsContact O-CB 3.25Å; G33-Q37 WeakPolarHBondContact O-CB 3.26Å; G33-Q37 PolarHBondContact O-N 2.03Å |
| 34 | R | 98.1 | Very high | 95.9 | Very high | 153 Ų | 153 | 63.3 Ų | 63.3 | 58% | 0.577 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -62.2 | -42.4 | 175.3 | -77.5 | -171.7 | -62.4 | -89.7 | 1.5 | 112.5 | A30 A31 Y32 Q37 A38 | A30-R34 WeakPolarHBondContact O-CB 3.33Å; A30-R34 WeakPolarHBondContact O-CG 3.39Å; A30-R34 PolarHBondContact O-N 3.39Å; A31-R34 PolarHBondContact O-N 3.31Å; Y32-R34 VanDerWaalsContact C-N 3.33Å; Y32-R34 PolarHBondContact O-N 3.01Å; R34-Q37 PolarHBondContact O-N 2.96Å; R34-A38 WeakPolarHBondContact O-CB 3.3Å; R34-A38 PolarHBondContact O-N 3.23Å |
| 35 | C | 97.8 | Very high | 95.7 | Very high | 26 Ų | 26 | 64 Ų | 64 | 18% | 0.176 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -61.1 | -48.6 | 176.5 | 178 | 0 | 0 | 0 | 0 | 111.3 | A31 Y32 Q37 A38 S39 C51 E54 | A31-C35 PolarHBondContact O-N 3.5Å; A31-C35 VanDerWaalsContact O-N 3.13Å; Y32-C35 PolarHBondContact O-N 3.19Å; Y32-C35 VanDerWaalsContact O-N 3.17Å; C35-Q37 PolarHBondContact O-N 3.36Å; C35-A38 PolarHBondContact O-N 3.15Å; C35-S39 WeakPolarHBondContact O-CB 3.46Å; C35-S39 PolarHBondContact O-N 2.93Å; C35-S39 PolarHBondContact O-OG 3.42Å; C35-C51 HydrophobicContact CB-CB 3.83Å; C35-C51 WeakPolarHBondContact CB-SG 2.96Å; C35-C51 WeakPolarHBondContact SG-CA 3.34Å; C35-C51 WeakPolarHBondContact SG-CB 3.49Å; C35-C51 CovalentContact SG-SG 2.04Å; C35-C51 PolarHBondContact SG-SG 2.82Å; C35-E54 HydrophobicContact CB-CG 4.22Å |
| 36 | V | 97.5 | Very high | 95.6 | Very high | 36 Ų | 36 | 68.1 Ų | 68.1 | 22% | 0.218 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -60.6 | -49 | 178.5 | 173 | 0 | 0 | 0 | 0 | 110.5 | Y32 G33 A38 S39 T40 L46 C51 | Y32-V36 HydrophobicContact CD2-CG2 4.23Å; Y32-V36 HydrophobicContact CE1-CG2 4.12Å; Y32-V36 HydrophobicContact CE2-CG2 3.75Å; Y32-V36 WeakPolarHBondContact O-CG2 3.05Å; Y32-V36 PolarHBondContact O-N 3.13Å; G33-V36 PolarHBondContact O-N 3.46Å; V36-A38 PolarHBondContact O-N 3.12Å; V36-S39 WeakPolarHBondContact O-CB 3.4Å; V36-S39 PolarHBondContact O-N 2.95Å; V36-T40 HydrophobicContact CG1-CG2 4.48Å; V36-T40 WeakPolarHBondContact O-CG2 3.43Å; V36-T40 PolarHBondContact O-N 3.38Å; V36-T40 PolarHBondContact O-OG1 2.85Å; V36-L46 HydrophobicContact CG1-CD2 4.22Å; V36-C51 HydrophobicContact CG2-CB 4.44Å; V36-C51 PolarHBondContact N-SG 3.06Å |
| 37 | Q | 96.8 | Very high | 95.4 | Very high | 142 Ų | 142 | 69.7 Ų | 69.7 | 66% | 0.664 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -60.1 | -43.4 | -178.9 | -175.4 | -179.9 | -21.1 | 0 | 0 | 112.2 | G33 R34 C35 S39 T40 A41 | G33-Q37 VanDerWaalsContact O-CB 3.25Å; G33-Q37 WeakPolarHBondContact O-CB 3.26Å; G33-Q37 PolarHBondContact O-N 2.03Å; R34-Q37 PolarHBondContact O-N 2.96Å; C35-Q37 PolarHBondContact O-N 3.36Å; Q37-S39 VanDerWaalsContact C-N 3.27Å; Q37-S39 PolarHBondContact O-N 3.33Å; Q37-T40 PolarHBondContact O-N 3.18Å; Q37-T40 PolarHBondContact O-OG1 3.05Å; Q37-T40 VanDerWaalsContact O-OG1 3.11Å; Q37-A41 PolarHBondContact O-N 3.47Å |
| 38 | A | 95.7 | Very high | 95.2 | Very high | 68 Ų | 68 | 74.6 Ų | 74.6 | 56% | 0.562 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.5 | -36.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | R34 C35 V36 T40 A41 | R34-A38 WeakPolarHBondContact O-CB 3.3Å; R34-A38 PolarHBondContact O-N 3.23Å; C35-A38 PolarHBondContact O-N 3.15Å; V36-A38 PolarHBondContact O-N 3.12Å; A38-T40 VanDerWaalsContact C-N 3.31Å; A38-T40 PolarHBondContact O-N 3.4Å; A38-A41 VanDerWaalsContact O-CB 3.3Å; A38-A41 WeakPolarHBondContact O-CB 3.39Å; A38-A41 PolarHBondContact O-N 3.4Å |
| 39 | S | 93.4 | Very high | 95.1 | Very high | 19 Ų | 19 | 76.9 Ų | 76.9 | 13% | 0.133 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -76.7 | -19.3 | -179.1 | -51.9 | 0 | 0 | 0 | 0 | 113.4 | C35 V36 Q37 G44 S45 L50 | C35-S39 WeakPolarHBondContact O-CB 3.46Å; C35-S39 PolarHBondContact O-N 2.93Å; C35-S39 PolarHBondContact O-OG 3.42Å; V36-S39 WeakPolarHBondContact O-CB 3.4Å; V36-S39 PolarHBondContact O-N 2.95Å; Q37-S39 VanDerWaalsContact C-N 3.27Å; Q37-S39 PolarHBondContact O-N 3.33Å; S39-G44 CarbonylContact O-C 3.54Å; S39-G44 VanDerWaalsContact O-C 3.26Å; S39-G44 WeakPolarHBondContact O-CA 3.47Å; S39-S45 CarbonylContact O-C 3.26Å; S39-S45 PolarHBondContact O-N 3.35Å; S39-S45 VanDerWaalsContact O-N 3.14Å; S39-L50 WeakPolarHBondContact OG-CD2 3.49Å |
| 40 | T | 93.8 | Very high | 95.1 | Very high | 85 Ų | 85 | 78.7 Ų | 78.7 | 52% | 0.521 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.9 | 8.1 | 174.2 | 59 | 0 | 0 | 0 | 0 | 113.2 | V36 Q37 A38 L46 | V36-T40 HydrophobicContact CG1-CG2 4.48Å; V36-T40 WeakPolarHBondContact O-CG2 3.43Å; V36-T40 PolarHBondContact O-N 3.38Å; V36-T40 PolarHBondContact O-OG1 2.85Å; Q37-T40 PolarHBondContact O-N 3.18Å; Q37-T40 PolarHBondContact O-OG1 3.05Å; Q37-T40 VanDerWaalsContact O-OG1 3.11Å; A38-T40 VanDerWaalsContact C-N 3.31Å; A38-T40 PolarHBondContact O-N 3.4Å; T40-L46 HydrophobicContact CG2-CB 4.2Å; T40-L46 HydrophobicContact CG2-CD2 4.33Å |
| 41 | A | 93.2 | Very high | 95.1 | Very high | 43 Ų | 43 | 77.1 Ų | 77.1 | 36% | 0.355 | 47% | 0.47 | S | S | . | . | S | Bend | trans | -60.9 | 161.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q37 A38 G43 G44 | Q37-A41 PolarHBondContact O-N 3.47Å; A38-A41 VanDerWaalsContact O-CB 3.3Å; A38-A41 WeakPolarHBondContact O-CB 3.39Å; A38-A41 PolarHBondContact O-N 3.4Å; A41-G43 PolarHBondContact O-N 3.43Å; A41-G44 WeakPolarHBondContact O-CA 3.41Å; A41-G44 PolarHBondContact O-N 3.26Å |
| 42 | P | 93.8 | Very high | 95 | Very high | 141 Ų | 141 | 77.4 Ų | 77.4 | 92% | 0.916 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.5 | 124.7 | 177.8 | -26.3 | 35 | 0 | 0 | 0 | 111.9 | G44 | P42-G44 VanDerWaalsContact C-N 3.26Å; P42-G44 PolarHBondContact O-N 3.02Å |
| 43 | G | 89.4 | Confident | 95 | Very high | 92 Ų | 92 | 83.2 Ų | 83.2 | 95% | 0.948 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.1 | -4 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | A41 | A41-G43 PolarHBondContact O-N 3.43Š|
| 44 | G | 89.6 | Confident | 95.1 | Very high | 42 Ų | 42 | 83.8 Ų | 83.8 | 43% | 0.433 | 49% | 0.488 | S | S | . | . | trans | -76.8 | 156.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | S39 A41 P42 | S39-G44 CarbonylContact O-C 3.54Å; S39-G44 VanDerWaalsContact O-C 3.26Å; S39-G44 WeakPolarHBondContact O-CA 3.47Å; A41-G44 WeakPolarHBondContact O-CA 3.41Å; A41-G44 PolarHBondContact O-N 3.26Å; P42-G44 VanDerWaalsContact C-N 3.26Å; P42-G44 PolarHBondContact O-N 3.02Å | ||
| 45 | S | 90.9 | Very high | 95.1 | Very high | 96 Ų | 96 | 81.3 Ų | 81.3 | 67% | 0.671 | 48% | 0.481 | S | S | * | . | trans | -136.5 | 119.9 | 173.1 | -174.7 | 0 | 0 | 0 | 0 | 108.9 | S39 | S39-S45 CarbonylContact O-C 3.26Å; S39-S45 PolarHBondContact O-N 3.35Å; S39-S45 VanDerWaalsContact O-N 3.14Å | ||
| 46 | L | 93.9 | Very high | 95.1 | Very high | 88 Ų | 88 | 86.1 Ų | 86.1 | 46% | 0.461 | 50% | 0.502 | S | S | . | . | trans | -86.4 | 116.9 | 174.1 | -177.2 | 67.6 | 0 | 0 | 0 | 109 | V36 T40 L50 | V36-L46 HydrophobicContact CG1-CD2 4.22Å; T40-L46 HydrophobicContact CG2-CB 4.2Å; T40-L46 HydrophobicContact CG2-CD2 4.33Å; L46-L50 HydrophobicContact CD1-CB 4.45Å; L46-L50 HydrophobicContact CD1-CD2 4.39Å | ||
| 47 | S | 93.9 | Very high | 95.1 | Very high | 72 Ų | 72 | 86.7 Ų | 86.7 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | trans | -108.8 | 164.1 | 172.6 | 62.3 | 0 | 0 | 0 | 0 | 111 | D49 L50 | S47-D49 PolarHBondContact O-N 3.31Å; S47-L50 WeakPolarHBondContact O-CB 3.43Å; S47-L50 PolarHBondContact O-N 2.92Å | ||
| 48 | K | 93.8 | Very high | 95.2 | Very high | 177 Ų | 177 | 80.6 Ų | 80.6 | 77% | 0.77 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.1 | 139.6 | 176 | -157 | -171.9 | 83.1 | 179.3 | 0 | 109.5 | L50 | K48-L50 PolarHBondContact O-N 3.21Å; K48-L50 VanDerWaalsContact O-N 3.13Å |
| 49 | D | 95.7 | Very high | 95.3 | Very high | 111 Ų | 111 | 85.7 Ų | 85.7 | 59% | 0.594 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.8 | 3.6 | 176 | -49.4 | -41.6 | 0 | 0 | 0 | 116.1 | S47 C51 A52 | S47-D49 PolarHBondContact O-N 3.31Å; D49-C51 VanDerWaalsContact C-N 3.27Å; D49-C51 PolarHBondContact O-N 3.37Å; D49-A52 HydrophobicContact CB-CB 3.99Å; D49-A52 WeakPolarHBondContact O-CB 3.49Å; D49-A52 PolarHBondContact O-N 2.95Å |
| 50 | L | 97.1 | Very high | 95.5 | Very high | 77 Ų | 77 | 88 Ų | 88 | 40% | 0.403 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -37.9 | 178.5 | -173.2 | 148.6 | 0 | 0 | 0 | 112.7 | S39 L46 S47 K48 | S39-L50 WeakPolarHBondContact OG-CD2 3.49Å; L46-L50 HydrophobicContact CD1-CB 4.45Å; L46-L50 HydrophobicContact CD1-CD2 4.39Å; S47-L50 WeakPolarHBondContact O-CB 3.43Å; S47-L50 PolarHBondContact O-N 2.92Å; K48-L50 PolarHBondContact O-N 3.21Å; K48-L50 VanDerWaalsContact O-N 3.13Å |
| 51 | C | 97.8 | Very high | 95.6 | Very high | 7 Ų | 7 | 85.3 Ų | 85.3 | 5% | 0.047 | 49% | 0.487 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106 | 28.4 | 174.3 | -59.7 | 0 | 0 | 0 | 0 | 112.3 | Y32 C35 V36 D49 R53 E54 F55 | Y32-C51 HydrophobicContact CD2-CB 3.93Å; Y32-C51 HydrophobicContact CE2-CB 3.76Å; C35-C51 HydrophobicContact CB-CB 3.83Å; C35-C51 WeakPolarHBondContact CB-SG 2.96Å; C35-C51 WeakPolarHBondContact SG-CA 3.34Å; C35-C51 WeakPolarHBondContact SG-CB 3.49Å; C35-C51 CovalentContact SG-SG 2.04Å; C35-C51 PolarHBondContact SG-SG 2.82Å; V36-C51 HydrophobicContact CG2-CB 4.44Å; V36-C51 PolarHBondContact N-SG 3.06Å; D49-C51 VanDerWaalsContact C-N 3.27Å; D49-C51 PolarHBondContact O-N 3.37Å; C51-R53 VanDerWaalsContact C-N 3.29Å; C51-R53 PolarHBondContact O-N 3.41Å; C51-E54 PolarHBondContact O-N 3.25Å; C51-F55 WeakPolarHBondContact O-CB 3.46Å; C51-F55 PolarHBondContact O-N 3.43Å |
| 52 | A | 98 | Very high | 95.7 | Very high | 40 Ų | 40 | 86.8 Ų | 86.8 | 33% | 0.331 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.3 | -37.4 | -172.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | D49 F55 E56 | D49-A52 HydrophobicContact CB-CB 3.99Å; D49-A52 WeakPolarHBondContact O-CB 3.49Å; D49-A52 PolarHBondContact O-N 2.95Å; A52-F55 PolarHBondContact O-N 3.43Å; A52-E56 WeakPolarHBondContact O-CB 3.16Å; A52-E56 PolarHBondContact O-N 2.99Å |
| 53 | R | 98.2 | Very high | 95.7 | Very high | 199 Ų | 199 | 83 Ų | 83 | 75% | 0.751 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -63.8 | -48.6 | -179.7 | -179.6 | -175.5 | 173.2 | -123.3 | 2.5 | 111.5 | C51 F55 E56 A57 | C51-R53 VanDerWaalsContact C-N 3.29Å; C51-R53 PolarHBondContact O-N 3.41Å; R53-F55 VanDerWaalsContact C-N 3.31Å; R53-E56 PolarHBondContact O-N 3.49Å; R53-A57 PolarHBondContact O-N 2.99Å; R53-A57 VanDerWaalsContact O-N 3.08Å |
| 54 | E | 98.3 | Very high | 95.8 | Very high | 46 Ų | 46 | 81.1 Ų | 81.1 | 22% | 0.215 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -66.4 | -38.5 | 178.5 | -64.9 | 68 | -152.7 | 0 | 0 | 110.6 | A31 Y32 C35 C51 A57 L58 | A31-E54 HydrophobicContact CB-CG 4.45Å; Y32-E54 HydrophobicContact CD2-CB 4.08Å; C35-E54 HydrophobicContact CB-CG 4.22Å; C51-E54 PolarHBondContact O-N 3.25Å; E54-A57 PolarHBondContact O-N 3.39Å; E54-L58 WeakPolarHBondContact O-CB 3.26Å; E54-L58 PolarHBondContact O-N 3.49Å |
| 55 | F | 98 | Very high | 95.8 | Very high | 100 Ų | 100 | 79.8 Ų | 79.8 | 44% | 0.439 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 174.9 | 178.8 | -106.6 | 0 | 0 | 0 | 112.3 | Y32 C51 A52 R53 L58 R59 | Y32-F55 HydrophobicContact CD2-CB 3.88Å; Y32-F55 HydrophobicContact CE1-CD2 4.47Å; Y32-F55 HydrophobicContact CE2-CB 3.75Å; Y32-F55 HydrophobicContact CE2-CD2 4.18Å; Y32-F55 HydrophobicContact CE2-CG 4.4Å; C51-F55 WeakPolarHBondContact O-CB 3.46Å; C51-F55 PolarHBondContact O-N 3.43Å; A52-F55 PolarHBondContact O-N 3.43Å; R53-F55 VanDerWaalsContact C-N 3.31Å; F55-L58 PolarHBondContact O-N 2.87Å; F55-R59 VanDerWaalsContact O-CB 3.3Å; F55-R59 WeakPolarHBondContact O-CB 3.48Å; F55-R59 PolarHBondContact O-N 3.43Å |
| 56 | E | 98.3 | Very high | 95.6 | Very high | 128 Ų | 128 | 76.9 Ų | 76.9 | 60% | 0.598 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -64.3 | -41.1 | 178.5 | -172.3 | -178.3 | -165.6 | 0 | 0 | 111.5 | A52 R53 R59 S60 | A52-E56 WeakPolarHBondContact O-CB 3.16Å; A52-E56 PolarHBondContact O-N 2.99Å; R53-E56 PolarHBondContact O-N 3.49Å; E56-R59 PolarHBondContact O-N 3.33Å; E56-S60 VanDerWaalsContact O-CB 3.26Å; E56-S60 WeakPolarHBondContact O-CB 2.97Å; E56-S60 PolarHBondContact O-N 3.5Å; E56-S60 PolarHBondContact O-OG 3.21Å |
| 57 | A | 98.2 | Very high | 95 | Very high | 47 Ų | 47 | 78.8 Ų | 78.8 | 39% | 0.388 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60 | -47.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | E28 R53 E54 S60 C61 | E28-A57 HydrophobicContact CG-CB 4.39Å; R53-A57 PolarHBondContact O-N 2.99Å; R53-A57 VanDerWaalsContact O-N 3.08Å; E54-A57 PolarHBondContact O-N 3.39Å; A57-S60 PolarHBondContact O-N 3.08Å; A57-C61 PolarHBondContact O-N 3.38Å |
| 58 | L | 97.9 | Very high | 93.9 | Very high | 15 Ų | 15 | 81.6 Ų | 81.6 | 8% | 0.079 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -61.3 | -47.2 | 176.8 | 177.7 | 58.1 | 0 | 0 | 0 | 112 | C25 E28 A29 Y32 E54 F55 S60 C61 F62 | C25-L58 HydrophobicContact CB-CD1 4.3Å; E28-L58 HydrophobicContact CB-CB 4.13Å; E28-L58 HydrophobicContact CB-CD1 4.1Å; A29-L58 HydrophobicContact CB-CD1 3.83Å; A29-L58 HydrophobicContact CB-CD2 4.46Å; Y32-L58 HydrophobicContact CD1-CD2 3.98Å; Y32-L58 HydrophobicContact CG-CD2 4.33Å; E54-L58 WeakPolarHBondContact O-CB 3.26Å; E54-L58 PolarHBondContact O-N 3.49Å; F55-L58 PolarHBondContact O-N 2.87Å; L58-S60 VanDerWaalsContact C-N 3.31Å; L58-S60 PolarHBondContact O-N 3.23Å; L58-C61 PolarHBondContact O-N 3.17Å; L58-F62 HydrophobicContact CD1-CD1 4.05Å; L58-F62 HydrophobicContact CD1-CD2 4.49Å; L58-F62 HydrophobicContact CD1-CE1 3.57Å; L58-F62 HydrophobicContact CD1-CE2 4.04Å; L58-F62 HydrophobicContact CD1-CZ 3.56Å; L58-F62 HydrophobicContact CD2-CE2 4.46Å; L58-F62 HydrophobicContact CD2-CZ 4.5Å; L58-F62 HydrophobicContact CG-CD2 4.44Å; L58-F62 HydrophobicContact CG-CE1 4.46Å; L58-F62 HydrophobicContact CG-CE2 4.09Å; L58-F62 HydrophobicContact CG-CZ 4.11Å; L58-F62 PolarHBondContact O-N 3.49Å |
| 59 | R | 97.4 | Very high | 92.3 | Very high | 174 Ų | 174 | 73.8 Ų | 73.8 | 66% | 0.657 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -59.2 | -43.6 | 177.3 | -180 | -175.2 | 173.7 | -171.3 | -1.6 | 111.4 | F55 E56 C61 F62 A63 | F55-R59 VanDerWaalsContact O-CB 3.3Å; F55-R59 WeakPolarHBondContact O-CB 3.48Å; F55-R59 PolarHBondContact O-N 3.43Å; E56-R59 PolarHBondContact O-N 3.33Å; R59-C61 VanDerWaalsContact C-N 3.35Å; R59-F62 PolarHBondContact O-N 3.28Å; R59-A63 WeakPolarHBondContact O-CB 3.39Å; R59-A63 PolarHBondContact O-N 3.43Å |
| 60 | S | 97.4 | Very high | 90.6 | Very high | 69 Ų | 69 | 73.5 Ų | 73.5 | 48% | 0.483 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 178.4 | -64 | 0 | 0 | 0 | 0 | 111.2 | E56 A57 L58 A63 A64 | E56-S60 VanDerWaalsContact O-CB 3.26Å; E56-S60 WeakPolarHBondContact O-CB 2.97Å; E56-S60 PolarHBondContact O-N 3.5Å; E56-S60 PolarHBondContact O-OG 3.21Å; A57-S60 PolarHBondContact O-N 3.08Å; L58-S60 VanDerWaalsContact C-N 3.31Å; L58-S60 PolarHBondContact O-N 3.23Å; S60-A63 PolarHBondContact O-N 3.04Å; S60-A64 PolarHBondContact O-N 2.98Å |
| 61 | C | 96.9 | Very high | 88.8 | Confident | 27 Ų | 27 | 75.6 Ų | 75.6 | 18% | 0.182 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.8 | -46 | 175 | -172.6 | 0 | 0 | 0 | 0 | 111.9 | C25 E28 A57 L58 R59 A63 A64 A65 | C25-C61 WeakPolarHBondContact CA-SG 3.5Å; C25-C61 HydrophobicContact CB-CB 3.73Å; C25-C61 WeakPolarHBondContact CB-SG 3.33Å; C25-C61 WeakPolarHBondContact SG-CB 3.34Å; C25-C61 CovalentContact SG-SG 2.03Å; C25-C61 PolarHBondContact SG-SG 3.26Å; E28-C61 HydrophobicContact CG-CB 4.32Å; A57-C61 PolarHBondContact O-N 3.38Å; L58-C61 PolarHBondContact O-N 3.17Å; R59-C61 VanDerWaalsContact C-N 3.35Å; C61-A63 VanDerWaalsContact C-N 3.35Å; C61-A63 PolarHBondContact O-N 3.46Å; C61-A64 PolarHBondContact O-N 2.73Å; C61-A65 WeakPolarHBondContact O-CB 3.39Å; C61-A65 PolarHBondContact O-N 3Å |
| 62 | F | 94.8 | Very high | 86.7 | Confident | 74 Ų | 74 | 85.3 Ų | 85.3 | 33% | 0.325 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -59.7 | -42.6 | 176.7 | -74.6 | -5.7 | 0 | 0 | 0 | 112.7 | L22 C25 L58 R59 A64 A65 A66 | L22-F62 HydrophobicContact CB-CE1 4.12Å; L22-F62 HydrophobicContact CD2-CB 4.16Å; L22-F62 HydrophobicContact CD2-CD1 3.51Å; L22-F62 HydrophobicContact CD2-CE1 3.91Å; L22-F62 HydrophobicContact CD2-CG 3.83Å; L22-F62 HydrophobicContact CG-CD1 4.49Å; L22-F62 HydrophobicContact CG-CE1 4.44Å; C25-F62 HydrophobicContact CB-CD1 3.82Å; C25-F62 HydrophobicContact CB-CE1 3.75Å; L58-F62 HydrophobicContact CD1-CD1 4.05Å; L58-F62 HydrophobicContact CD1-CD2 4.49Å; L58-F62 HydrophobicContact CD1-CE1 3.57Å; L58-F62 HydrophobicContact CD1-CE2 4.04Å; L58-F62 HydrophobicContact CD1-CZ 3.56Å; L58-F62 HydrophobicContact CD2-CE2 4.46Å; L58-F62 HydrophobicContact CD2-CZ 4.5Å; L58-F62 HydrophobicContact CG-CD2 4.44Å; L58-F62 HydrophobicContact CG-CE1 4.46Å; L58-F62 HydrophobicContact CG-CE2 4.09Å; L58-F62 HydrophobicContact CG-CZ 4.11Å; L58-F62 PolarHBondContact O-N 3.49Å; R59-F62 PolarHBondContact O-N 3.28Å; F62-A64 VanDerWaalsContact C-N 3.34Å; F62-A64 PolarHBondContact O-N 3.39Å; F62-A65 PolarHBondContact O-N 3.43Å; F62-A66 VanDerWaalsContact O-CB 3.26Å; F62-A66 WeakPolarHBondContact O-CB 3.46Å; F62-A66 PolarHBondContact O-N 3.22Å |
| 63 | A | 93.8 | Very high | 84.6 | Confident | 62 Ų | 62 | 84.3 Ų | 84.3 | 51% | 0.512 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | R59 S60 C61 A66 K67 | R59-A63 WeakPolarHBondContact O-CB 3.39Å; R59-A63 PolarHBondContact O-N 3.43Å; S60-A63 PolarHBondContact O-N 3.04Å; C61-A63 VanDerWaalsContact C-N 3.35Å; C61-A63 PolarHBondContact O-N 3.46Å; A63-A66 PolarHBondContact O-N 3.03Å; A63-K67 WeakPolarHBondContact O-CB 3.36Å; A63-K67 PolarHBondContact O-N 3.48Å |
| 64 | A | 92.3 | Very high | 81.9 | Confident | 53 Ų | 53 | 83.1 Ų | 83.1 | 44% | 0.438 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.4 | -43.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S60 C61 F62 K67 K68 | S60-A64 PolarHBondContact O-N 2.98Å; C61-A64 PolarHBondContact O-N 2.73Å; F62-A64 VanDerWaalsContact C-N 3.34Å; F62-A64 PolarHBondContact O-N 3.39Å; A64-K67 PolarHBondContact O-N 3.05Å; A64-K68 PolarHBondContact O-N 3.06Å; A64-K68 VanDerWaalsContact O-N 3.12Å |
| 65 | A | 90.1 | Very high | 81.1 | Confident | 13 Ų | 13 | 85 Ų | 85 | 11% | 0.107 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -64.3 | -40.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | R21 C61 F62 K68 T69 | R21-A65 HydrophobicContact CB-CB 4.44Å; C61-A65 WeakPolarHBondContact O-CB 3.39Å; C61-A65 PolarHBondContact O-N 3Å; F62-A65 PolarHBondContact O-N 3.43Å; A65-K68 PolarHBondContact O-N 2.98Å; A65-T69 PolarHBondContact O-N 3.21Å; A65-T69 PolarHBondContact O-OG1 3.43Å; A65-T69 VanDerWaalsContact O-OG1 3.08Å |
| 66 | A | 85.3 | Confident | 80.2 | Confident | 36 Ų | 36 | 84.2 Ų | 84.2 | 30% | 0.298 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -64.8 | -44.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | F18 F62 A63 K68 T69 L70 | F18-A66 HydrophobicContact CE2-CB 4.42Å; F62-A66 VanDerWaalsContact O-CB 3.26Å; F62-A66 WeakPolarHBondContact O-CB 3.46Å; F62-A66 PolarHBondContact O-N 3.22Å; A63-A66 PolarHBondContact O-N 3.03Å; A66-K68 PolarHBondContact O-N 3.32Å; A66-T69 WeakPolarHBondContact O-CA 3.47Å; A66-T69 WeakPolarHBondContact O-CB 3.38Å; A66-T69 PolarHBondContact O-N 3.23Å; A66-T69 PolarHBondContact O-OG1 3.12Å; A66-L70 PolarHBondContact O-N 3.17Å |
| 67 | K | 81.9 | Confident | 79.2 | Confident | 128 Ų | 128 | 81.7 Ų | 81.7 | 56% | 0.557 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -59.9 | -43.2 | 177.1 | -170.8 | -179.7 | 177 | -172.8 | 0 | 112.3 | A63 A64 T69 L70 E71 | A63-K67 WeakPolarHBondContact O-CB 3.36Å; A63-K67 PolarHBondContact O-N 3.48Å; A64-K67 PolarHBondContact O-N 3.05Å; K67-T69 PolarHBondContact O-N 3.39Å; K67-L70 WeakPolarHBondContact O-CB 3.48Å; K67-L70 PolarHBondContact O-N 3.01Å; K67-E71 WeakPolarHBondContact CE-OE1 3.42Å; K67-E71 PolarHBondContact O-N 3.36Å |
| 68 | K | 69.7 | Low | 78.1 | Confident | 130 Ų | 130 | 83.8 Ų | 83.8 | 57% | 0.565 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -58.3 | -22.7 | 173.9 | -72.9 | 178.6 | 179.4 | 174.6 | 0 | 113.2 | R21 A64 A65 A66 R72 | R21-K68 PolarHBondContact NH1-O 3.13Å; A64-K68 PolarHBondContact O-N 3.06Å; A64-K68 VanDerWaalsContact O-N 3.12Å; A65-K68 PolarHBondContact O-N 2.98Å; A66-K68 PolarHBondContact O-N 3.32Å; K68-R72 PolarHBondContact O-N 3.46Å |
| 69 | T | 60.8 | Low | 76.9 | Confident | 13 Ų | 13 | 88.1 Ų | 88.1 | 8% | 0.08 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -76.2 | -30 | 178 | -49.9 | 0 | 0 | 0 | 0 | 111.6 | R14 R21 A65 A66 K67 | R14-T69 HydrophobicContact CB-CG2 4.03Å; R14-T69 HydrophobicContact CG-CG2 4.18Å; R21-T69 WeakPolarHBondContact CD-OG1 3.44Å; A65-T69 PolarHBondContact O-N 3.21Å; A65-T69 PolarHBondContact O-OG1 3.43Å; A65-T69 VanDerWaalsContact O-OG1 3.08Å; A66-T69 WeakPolarHBondContact O-CA 3.47Å; A66-T69 WeakPolarHBondContact O-CB 3.38Å; A66-T69 PolarHBondContact O-N 3.23Å; A66-T69 PolarHBondContact O-OG1 3.12Å; K67-T69 PolarHBondContact O-N 3.39Å |
| 70 | L | 60.6 | Low | 75.5 | Confident | 106 Ų | 106 | 82.3 Ų | 82.3 | 56% | 0.555 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -77 | -41.8 | 176.8 | -66.7 | 167.4 | 0 | 0 | 0 | 111.3 | A66 K67 G73 | A66-L70 PolarHBondContact O-N 3.17Å; K67-L70 WeakPolarHBondContact O-CB 3.48Å; K67-L70 PolarHBondContact O-N 3.01Å; L70-G73 PolarHBondContact O-N 3.21Å |
| 71 | E | 58.2 | Low | 73.9 | Confident | 121 Ų | 121 | 83.3 Ų | 83.3 | 57% | 0.565 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -71.9 | -35.3 | -175.8 | -68.4 | 177 | 161.8 | 0 | 0 | 113.5 | K67 G73 | K67-E71 WeakPolarHBondContact CE-OE1 3.42Å; K67-E71 PolarHBondContact O-N 3.36Å; E71-G73 PolarHBondContact O-N 2.89Å |
| 72 | R | 54.6 | Low | 72.2 | Confident | 211 Ų | 211 | 87.6 Ų | 87.6 | 80% | 0.796 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.2 | 7.3 | 176.7 | -75.1 | -172 | 175.7 | -133.9 | 2.2 | 114.4 | K68 | K68-R72 PolarHBondContact O-N 3.46Š|
| 73 | G | 53.6 | Low | 70.3 | Confident | 18 Ų | 18 | 88.8 Ų | 88.8 | 19% | 0.186 | 49% | 0.486 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -107.8 | 15.9 | -178 | 0 | 0 | 0 | 0 | 0 | 114.4 | R10 L70 E71 | R10-G73 PolarHBondContact NH1-O 3.44Å; L70-G73 PolarHBondContact O-N 3.21Å; E71-G73 PolarHBondContact O-N 2.89Å |
| 74 | C | 42.4 | Very low | 68.1 | Low | 174 Ų | 174 | 91.2 Ų | 91.2 | 100% | 1.176 | 48% | 0.484 | S | S | * | . | trans | -109.9 | 0 | 168.5 | -77.5 | 0 | 0 | 0 | 0 | 109.2 |
Retrieved 74 of 74 residues in 67.6 ms
(Link to these results)