| 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 | 60.9 | Low | 59.1 | Low | 247 Ų | 247 | 167.1 Ų | 167.1 | 100% | 1.217 | 87% | 0.867 | S | S | * | * | 0 | 104.1 | 0 | -75.6 | 174.9 | 158.9 | 0 | 0 | 107.4 | |||||
| 2 | A | 57.6 | Low | 59 | Low | 95 Ų | 95 | 167.8 Ų | 167.8 | 79% | 0.785 | 87% | 0.866 | S | S | * | * | trans | -85.7 | 135.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | L4 | A2-L4 PolarHBondContact O-N 3.39Š| ||
| 3 | P | 62.2 | Low | 59.1 | Low | 116 Ų | 116 | 162.7 Ų | 162.7 | 75% | 0.753 | 85% | 0.848 | S | S | * | * | trans | -78 | 122.7 | 177.8 | 30.3 | -28.9 | 0 | 0 | 0 | 109.7 | L5 | P3-L5 PolarHBondContact O-N 3.22Š| ||
| 4 | L | 54.7 | Low | 59.6 | Low | 172 Ų | 172 | 155.4 Ų | 155.4 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | trans | -68.7 | 113 | 168.7 | -67.8 | 169.7 | 0 | 0 | 0 | 108.4 | A2 | A2-L4 PolarHBondContact O-N 3.39Š| ||
| 5 | L | 60 | Low | 60.3 | Low | 157 Ų | 157 | 153.9 Ų | 153.9 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | -80.5 | 133.6 | 172.8 | -72.2 | 174.3 | 0 | 0 | 0 | 110.2 | P3 L7 | P3-L5 PolarHBondContact O-N 3.22Å; L5-L7 PolarHBondContact O-N 2.94Å | ||
| 6 | P | 59.4 | Low | 61 | Low | 114 Ų | 114 | 151.8 Ų | 151.8 | 74% | 0.74 | 80% | 0.796 | S | S | * | * | trans | -75.2 | 125.3 | -179.2 | 29.5 | -31.5 | 0 | 0 | 0 | 110.7 | R8 | P6-R8 PolarHBondContact O-N 3.47Å; P6-R8 VanDerWaalsContact O-N 3.15Å | ||
| 7 | L | 57.1 | Low | 61.6 | Low | 179 Ų | 179 | 151.7 Ų | 151.7 | 94% | 0.937 | 79% | 0.79 | S | S | * | * | trans | -60.2 | 111.3 | 169.6 | -70.5 | 164.3 | 0 | 0 | 0 | 109 | L5 | L5-L7 PolarHBondContact O-N 2.94Š| ||
| 8 | R | 61.2 | Low | 62.5 | Low | 227 Ų | 227 | 149.7 Ų | 149.7 | 86% | 0.857 | 78% | 0.78 | S | S | * | * | trans | -74.8 | 143.2 | 177.2 | -92.3 | -159.8 | 172.9 | 174.1 | 0.1 | 111.6 | P6 R10 | P6-R8 PolarHBondContact O-N 3.47Å; P6-R8 VanDerWaalsContact O-N 3.15Å; R8-R10 PolarHBondContact O-N 2.92Å; R8-R10 VanDerWaalsContact O-N 3.1Å | ||
| 9 | P | 57.6 | Low | 63.3 | Low | 133 Ų | 133 | 144.9 Ų | 144.9 | 86% | 0.864 | 76% | 0.764 | S | S | * | * | trans | -75.3 | 98.4 | 174.5 | 30.7 | -30.5 | 0 | 0 | 0 | 109.3 | ||||
| 10 | R | 58.4 | Low | 64.3 | Low | 223 Ų | 223 | 145.1 Ų | 145.1 | 84% | 0.842 | 76% | 0.758 | S | S | * | * | trans | -109.4 | 7.8 | -178.2 | -145.2 | -173.2 | 176 | 173.4 | -0.6 | 114.3 | R8 | R8-R10 PolarHBondContact O-N 2.92Å; R8-R10 VanDerWaalsContact O-N 3.1Å | ||
| 11 | E | 60.8 | Low | 65.3 | Low | 175 Ų | 175 | 139.9 Ų | 139.9 | 82% | 0.818 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -95.3 | -20.1 | -170.2 | -67 | -134.9 | 118.5 | 0 | 0 | 115.7 | ||
| 12 | M | 58.2 | Low | 66.5 | Low | 175 Ų | 175 | 130.1 Ų | 130.1 | 86% | 0.862 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -83.2 | -17.2 | -171.8 | -64.3 | -154.8 | 176 | 0 | 0 | 115.4 | ||
| 13 | T | 60.5 | Low | 68 | Low | 102 Ų | 102 | 133 Ų | 133 | 63% | 0.626 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -78.9 | -22.1 | 178.5 | 54.2 | 0 | 0 | 0 | 0 | 113 | Q17 | T13-Q17 PolarHBondContact O-N 3Å |
| 14 | S | 65.9 | Low | 69.3 | Low | 61 Ų | 61 | 134.3 Ų | 134.3 | 43% | 0.427 | 69% | 0.692 | S | S | . | * | H | α-helix | trans | -70.3 | -43.1 | -177.8 | -171.2 | 0 | 0 | 0 | 0 | 111.7 | M16 Q17 I18 | S14-M16 PolarHBondContact O-N 3.32Å; S14-Q17 PolarHBondContact O-N 3.11Å; S14-I18 WeakPolarHBondContact O-CD1 3.48Å; S14-I18 VanDerWaalsContact O-CG1 3.24Å; S14-I18 WeakPolarHBondContact O-CG1 3.43Å; S14-I18 PolarHBondContact O-N 3.46Å |
| 15 | L | 70.1 | Confident | 71 | Confident | 132 Ų | 132 | 130.2 Ų | 130.2 | 69% | 0.691 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -65.4 | -42.6 | -175.3 | -159.2 | 99.7 | 0 | 0 | 0 | 112.3 | I18 A19 | L15-I18 PolarHBondContact O-N 2.88Å; L15-A19 WeakPolarHBondContact O-CB 3.35Å; L15-A19 PolarHBondContact O-N 3.42Å |
| 16 | M | 71.3 | Confident | 72.5 | Confident | 121 Ų | 121 | 125.3 Ų | 125.3 | 60% | 0.596 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -64.1 | -46 | 176.9 | -76.5 | -76.5 | 163.8 | 0 | 0 | 110.8 | S14 I18 A19 F20 | S14-M16 PolarHBondContact O-N 3.32Å; M16-I18 VanDerWaalsContact C-N 3.34Å; M16-I18 PolarHBondContact O-N 2.77Å; M16-A19 PolarHBondContact O-N 2.92Å; M16-F20 WeakPolarHBondContact O-CB 3.29Å; M16-F20 VanDerWaalsContact O-CD2 3.25Å; M16-F20 WeakPolarHBondContact O-CD2 3.36Å; M16-F20 PolarHBondContact O-N 3.25Å; M16-F20 HydrophobicContact SD-CE2 4.08Å |
| 17 | Q | 71.2 | Confident | 74 | Confident | 150 Ų | 150 | 121.7 Ų | 121.7 | 70% | 0.701 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -61.2 | -40.8 | 177.2 | -81.6 | -173.6 | -16.2 | 0 | 0 | 113 | T13 S14 G21 | T13-Q17 PolarHBondContact O-N 3Å; S14-Q17 PolarHBondContact O-N 3.11Å; Q17-G21 PolarHBondContact O-N 3.28Å |
| 18 | I | 77.9 | Confident | 75.7 | Confident | 116 Ų | 116 | 116.9 Ų | 116.9 | 60% | 0.595 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65 | -42.2 | 176.7 | -66.7 | 164.7 | 0 | 0 | 0 | 110.6 | S14 L15 M16 G22 | S14-I18 WeakPolarHBondContact O-CD1 3.48Å; S14-I18 VanDerWaalsContact O-CG1 3.24Å; S14-I18 WeakPolarHBondContact O-CG1 3.43Å; S14-I18 PolarHBondContact O-N 3.46Å; L15-I18 PolarHBondContact O-N 2.88Å; M16-I18 VanDerWaalsContact C-N 3.34Å; M16-I18 PolarHBondContact O-N 2.77Å; I18-G22 PolarHBondContact O-N 3.13Å |
| 19 | A | 78.6 | Confident | 77.2 | Confident | 58 Ų | 58 | 110.3 Ų | 110.3 | 48% | 0.479 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.6 | -46.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L15 M16 G22 F23 | L15-A19 WeakPolarHBondContact O-CB 3.35Å; L15-A19 PolarHBondContact O-N 3.42Å; M16-A19 PolarHBondContact O-N 2.92Å; A19-G22 PolarHBondContact O-N 2.81Å; A19-F23 WeakPolarHBondContact O-CB 3.36Å; A19-F23 PolarHBondContact O-N 3.36Å |
| 20 | F | 81.9 | Confident | 78.8 | Confident | 149 Ų | 149 | 108 Ų | 108 | 65% | 0.654 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65.4 | -43.5 | 177.9 | -86.7 | -82 | 0 | 0 | 0 | 111.8 | M16 F23 F24 | M16-F20 WeakPolarHBondContact O-CB 3.29Å; M16-F20 VanDerWaalsContact O-CD2 3.25Å; M16-F20 WeakPolarHBondContact O-CD2 3.36Å; M16-F20 PolarHBondContact O-N 3.25Å; M16-F20 HydrophobicContact SD-CE2 4.08Å; F20-F23 PolarHBondContact O-N 3.38Å; F20-F24 WeakPolarHBondContact O-CB 3.46Å; F20-F24 PolarHBondContact O-N 2.95Å |
| 21 | G | 84.9 | Confident | 80.2 | Confident | 36 Ų | 36 | 100.6 Ų | 100.6 | 37% | 0.371 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -63.5 | -42 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q17 T25 | Q17-G21 PolarHBondContact O-N 3.28Å; G21-T25 WeakPolarHBondContact O-CB 3.31Å; G21-T25 PolarHBondContact O-N 3.17Å; G21-T25 PolarHBondContact O-OG1 3.18Å |
| 22 | G | 87.9 | Confident | 81.5 | Confident | 42 Ų | 42 | 98.1 Ų | 98.1 | 43% | 0.433 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.7 | -45.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | I18 A19 T25 A26 | I18-G22 PolarHBondContact O-N 3.13Å; A19-G22 PolarHBondContact O-N 2.81Å; G22-T25 PolarHBondContact O-N 2.84Å; G22-A26 WeakPolarHBondContact O-CB 3.19Å; G22-A26 PolarHBondContact O-N 3.43Å |
| 23 | F | 89.3 | Confident | 83 | Confident | 155 Ų | 155 | 96.4 Ų | 96.4 | 68% | 0.68 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.6 | -46.5 | 177.8 | -177 | -97.8 | 0 | 0 | 0 | 112.1 | A19 F20 T25 A26 A27 | A19-F23 WeakPolarHBondContact O-CB 3.36Å; A19-F23 PolarHBondContact O-N 3.36Å; F20-F23 PolarHBondContact O-N 3.38Å; F23-T25 VanDerWaalsContact C-N 3.35Å; F23-T25 PolarHBondContact O-N 3.17Å; F23-A26 PolarHBondContact O-N 3.31Å; F23-A27 WeakPolarHBondContact O-CB 3.3Å; F23-A27 PolarHBondContact O-N 2.95Å |
| 24 | F | 88.9 | Confident | 84.2 | Confident | 144 Ų | 144 | 95.8 Ų | 95.8 | 63% | 0.632 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.7 | -41.7 | 179.8 | -161.5 | -104.1 | 0 | 0 | 0 | 111.7 | F20 A27 I28 | F20-F24 WeakPolarHBondContact O-CB 3.46Å; F20-F24 PolarHBondContact O-N 2.95Å; F24-A27 PolarHBondContact O-N 3.34Å; F24-I28 HydrophobicContact CD1-CD1 3.55Å; F24-I28 HydrophobicContact CD1-CG1 4.4Å; F24-I28 HydrophobicContact CE1-CD1 3.45Å; F24-I28 VanDerWaalsContact CE1-CD1 3.45Å; F24-I28 HydrophobicContact CE1-CG1 4.34Å; F24-I28 HydrophobicContact CG-CD1 4.48Å; F24-I28 HydrophobicContact CZ-CD1 4.3Å; F24-I28 WeakPolarHBondContact O-CG1 3.34Å; F24-I28 PolarHBondContact O-N 3.28Å |
| 25 | T | 89.2 | Confident | 84.9 | Confident | 86 Ų | 86 | 97.9 Ų | 97.9 | 53% | 0.528 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.2 | -44 | 175.8 | -52.5 | 0 | 0 | 0 | 0 | 111.2 | G21 G22 F23 I28 V29 | G21-T25 WeakPolarHBondContact O-CB 3.31Å; G21-T25 PolarHBondContact O-N 3.17Å; G21-T25 PolarHBondContact O-OG1 3.18Å; G22-T25 PolarHBondContact O-N 2.84Å; F23-T25 VanDerWaalsContact C-N 3.35Å; F23-T25 PolarHBondContact O-N 3.17Å; T25-I28 PolarHBondContact O-N 3.12Å; T25-V29 VanDerWaalsContact O-CG2 3.29Å; T25-V29 WeakPolarHBondContact O-CG2 3.33Å; T25-V29 PolarHBondContact O-N 3.38Å |
| 26 | A | 91.9 | Very high | 84.7 | Confident | 53 Ų | 53 | 95 Ų | 95 | 44% | 0.438 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.5 | -43.3 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | G22 F23 I28 V29 V30 | G22-A26 WeakPolarHBondContact O-CB 3.19Å; G22-A26 PolarHBondContact O-N 3.43Å; F23-A26 PolarHBondContact O-N 3.31Å; A26-I28 PolarHBondContact O-N 3.03Å; A26-V29 PolarHBondContact O-N 3.14Å; A26-V30 WeakPolarHBondContact O-CB 3.49Å; A26-V30 VanDerWaalsContact O-CG2 3.32Å; A26-V30 WeakPolarHBondContact O-CG2 3.48Å; A26-V30 PolarHBondContact O-N 3.42Å |
| 27 | A | 91.4 | Very high | 84.5 | Confident | 39 Ų | 39 | 98.2 Ų | 98.2 | 32% | 0.322 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62 | -41 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F23 F24 S31 | F23-A27 WeakPolarHBondContact O-CB 3.3Å; F23-A27 PolarHBondContact O-N 2.95Å; F24-A27 PolarHBondContact O-N 3.34Å; A27-S31 VanDerWaalsContact O-CB 3.3Å; A27-S31 WeakPolarHBondContact O-CB 3.28Å; A27-S31 PolarHBondContact O-N 3.33Å; A27-S31 PolarHBondContact O-OG 2.84Å |
| 28 | I | 91.9 | Very high | 84.1 | Confident | 78 Ų | 78 | 100.5 Ų | 100.5 | 40% | 0.4 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -63.9 | -47 | 174.5 | -69.1 | 167.4 | 0 | 0 | 0 | 110.5 | F24 T25 A26 V30 S31 L32 | F24-I28 HydrophobicContact CD1-CD1 3.55Å; F24-I28 HydrophobicContact CD1-CG1 4.4Å; F24-I28 HydrophobicContact CE1-CD1 3.45Å; F24-I28 VanDerWaalsContact CE1-CD1 3.45Å; F24-I28 HydrophobicContact CE1-CG1 4.34Å; F24-I28 HydrophobicContact CG-CD1 4.48Å; F24-I28 HydrophobicContact CZ-CD1 4.3Å; F24-I28 WeakPolarHBondContact O-CG1 3.34Å; F24-I28 PolarHBondContact O-N 3.28Å; T25-I28 PolarHBondContact O-N 3.12Å; A26-I28 PolarHBondContact O-N 3.03Å; I28-V30 VanDerWaalsContact C-N 3.34Å; I28-V30 PolarHBondContact O-N 2.82Å; I28-S31 PolarHBondContact O-N 3.21Å; I28-L32 HydrophobicContact CG2-CD1 3.92Å; I28-L32 HydrophobicContact CG2-CG 4.29Å; I28-L32 WeakPolarHBondContact O-CG 3.35Å; I28-L32 PolarHBondContact O-N 2.76Å |
| 29 | V | 92.6 | Very high | 83.1 | Confident | 88 Ų | 88 | 98.1 Ų | 98.1 | 53% | 0.533 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -61.5 | -43.9 | 179.9 | 171.6 | 0 | 0 | 0 | 0 | 111 | T25 A26 L32 L33 | T25-V29 VanDerWaalsContact O-CG2 3.29Å; T25-V29 WeakPolarHBondContact O-CG2 3.33Å; T25-V29 PolarHBondContact O-N 3.38Å; A26-V29 PolarHBondContact O-N 3.14Å; V29-L32 PolarHBondContact O-N 3.47Å; V29-L33 VanDerWaalsContact O-CB 3.28Å; V29-L33 WeakPolarHBondContact O-CB 3.32Å; V29-L33 PolarHBondContact O-N 3.44Å |
| 30 | V | 91.8 | Very high | 82 | Confident | 85 Ų | 85 | 105.6 Ų | 105.6 | 52% | 0.515 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -63.1 | -44.4 | 175.2 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | A26 I28 L32 L33 C34 | A26-V30 WeakPolarHBondContact O-CB 3.49Å; A26-V30 VanDerWaalsContact O-CG2 3.32Å; A26-V30 WeakPolarHBondContact O-CG2 3.48Å; A26-V30 PolarHBondContact O-N 3.42Å; I28-V30 VanDerWaalsContact C-N 3.34Å; I28-V30 PolarHBondContact O-N 2.82Å; V30-L32 PolarHBondContact O-N 2.94Å; V30-L33 PolarHBondContact O-N 3.39Å; V30-C34 VanDerWaalsContact O-CB 3.31Å; V30-C34 WeakPolarHBondContact O-CB 3.5Å; V30-C34 PolarHBondContact O-N 3.35Å; V30-C34 PolarHBondContact O-SG 3.46Å; V30-C34 VanDerWaalsContact O-SG 3.33Å |
| 31 | S | 88 | Confident | 80.7 | Confident | 67 Ų | 67 | 102.8 Ų | 102.8 | 47% | 0.469 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -61.4 | -44.6 | 178.5 | -60.7 | 0 | 0 | 0 | 0 | 111.8 | A27 I28 C34 C35 | A27-S31 VanDerWaalsContact O-CB 3.3Å; A27-S31 WeakPolarHBondContact O-CB 3.28Å; A27-S31 PolarHBondContact O-N 3.33Å; A27-S31 PolarHBondContact O-OG 2.84Å; I28-S31 PolarHBondContact O-N 3.21Å; S31-C34 PolarHBondContact O-N 3.01Å; S31-C35 WeakPolarHBondContact O-CB 3.42Å; S31-C35 PolarHBondContact O-N 2.98Å; S31-C35 PolarHBondContact O-SG 3.2Å |
| 32 | L | 88.3 | Confident | 79.3 | Confident | 124 Ų | 124 | 110.9 Ų | 110.9 | 65% | 0.649 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -64.8 | -41 | 176.2 | -69.1 | 175 | 0 | 0 | 0 | 111.8 | I28 V29 V30 G36 | I28-L32 HydrophobicContact CG2-CD1 3.92Å; I28-L32 HydrophobicContact CG2-CG 4.29Å; I28-L32 WeakPolarHBondContact O-CG 3.35Å; I28-L32 PolarHBondContact O-N 2.76Å; V29-L32 PolarHBondContact O-N 3.47Å; V30-L32 PolarHBondContact O-N 2.94Å; L32-G36 PolarHBondContact O-N 3.48Å; L32-G36 VanDerWaalsContact O-N 3.14Å |
| 33 | L | 89.3 | Confident | 77.6 | Confident | 138 Ų | 138 | 119.8 Ų | 119.8 | 72% | 0.723 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -66.2 | -40.1 | 177.9 | -171.3 | 66.7 | 0 | 0 | 0 | 112 | V29 V30 | V29-L33 VanDerWaalsContact O-CB 3.28Å; V29-L33 WeakPolarHBondContact O-CB 3.32Å; V29-L33 PolarHBondContact O-N 3.44Å; V30-L33 PolarHBondContact O-N 3.39Å |
| 34 | C | 85.9 | Confident | 75.7 | Confident | 90 Ų | 90 | 115.9 Ų | 115.9 | 61% | 0.608 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -74.1 | -40.8 | 178.1 | -72.1 | 0 | 0 | 0 | 0 | 112.4 | V30 S31 G36 | V30-C34 VanDerWaalsContact O-CB 3.31Å; V30-C34 WeakPolarHBondContact O-CB 3.5Å; V30-C34 PolarHBondContact O-N 3.35Å; V30-C34 PolarHBondContact O-SG 3.46Å; V30-C34 VanDerWaalsContact O-SG 3.33Å; S31-C34 PolarHBondContact O-N 3.01Å; C34-G36 VanDerWaalsContact C-N 3.27Å; C34-G36 PolarHBondContact O-N 2.92Å |
| 35 | C | 80.4 | Confident | 73.8 | Confident | 104 Ų | 104 | 119.2 Ų | 119.2 | 70% | 0.703 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -68.7 | -25.4 | 178.9 | -72.3 | 0 | 0 | 0 | 0 | 112.7 | S31 K37 | S31-C35 WeakPolarHBondContact O-CB 3.42Å; S31-C35 PolarHBondContact O-N 2.98Å; S31-C35 PolarHBondContact O-SG 3.2Å; C35-K37 PolarHBondContact O-N 3.01Å; C35-K37 VanDerWaalsContact O-N 3.12Å |
| 36 | G | 66.8 | Low | 72 | Confident | 73 Ų | 73 | 123.1 Ų | 123.1 | 75% | 0.753 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | -8.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | L32 C34 | L32-G36 PolarHBondContact O-N 3.48Å; L32-G36 VanDerWaalsContact O-N 3.14Å; C34-G36 VanDerWaalsContact C-N 3.27Å; C34-G36 PolarHBondContact O-N 2.92Å |
| 37 | K | 67 | Low | 69.9 | Low | 187 Ų | 187 | 127.3 Ų | 127.3 | 81% | 0.813 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.8 | 7.1 | -170 | -154.7 | 162.3 | 179.9 | 176.1 | 0 | 116.6 | C35 G39 | C35-K37 PolarHBondContact O-N 3.01Å; C35-K37 VanDerWaalsContact O-N 3.12Å; K37-G39 PolarHBondContact O-N 3.28Å |
| 38 | K | 62.5 | Low | 68 | Low | 199 Ų | 199 | 134 Ų | 134 | 87% | 0.865 | 71% | 0.711 | S | S | * | * | trans | -91.4 | 89.5 | 172.8 | -97.7 | -175.6 | 176.3 | 175.2 | 0 | 112.3 | ||||
| 39 | G | 56.7 | Low | 66.2 | Low | 66 Ų | 66 | 135.6 Ų | 135.6 | 68% | 0.68 | 73% | 0.727 | S | S | * | * | trans | -63.2 | 134.2 | 163.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | K37 S41 | K37-G39 PolarHBondContact O-N 3.28Å; G39-S41 PolarHBondContact O-N 3.26Å | ||
| 40 | K | 56.1 | Low | 64.3 | Low | 214 Ų | 214 | 138.9 Ų | 138.9 | 93% | 0.93 | 74% | 0.736 | S | S | * | * | trans | 10.8 | 89.3 | 158.2 | -69.6 | -176.7 | 174 | 177.1 | 0 | 116.7 | ||||
| 41 | S | 54.9 | Low | 62.1 | Low | 90 Ų | 90 | 142 Ų | 142 | 63% | 0.629 | 75% | 0.751 | S | S | * | * | trans | -112.8 | 111.4 | 157.1 | 57.2 | 0 | 0 | 0 | 0 | 109.3 | G39 | G39-S41 PolarHBondContact O-N 3.26Š| ||
| 42 | K | 54 | Low | 60.3 | Low | 206 Ų | 206 | 143.7 Ų | 143.7 | 90% | 0.896 | 77% | 0.768 | S | S | * | * | trans | -89.8 | 94 | 179.5 | -165.7 | -171 | -168.9 | -173.3 | 0 | 107.6 | ||||
| 43 | W | 52.8 | Low | 58.4 | Low | 230 Ų | 230 | 143.1 Ų | 143.1 | 87% | 0.871 | 77% | 0.774 | S | S | * | * | trans | -140.8 | 117.6 | 171 | -59.6 | 81.5 | 0 | 0 | 0 | 104.6 | ||||
| 44 | G | 49.5 | Very low | 56.9 | Low | 72 Ų | 72 | 143.2 Ų | 143.2 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | cis | 97.8 | 91.1 | 44.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 45 | K | 47.9 | Very low | 55.1 | Low | 214 Ų | 214 | 147.9 Ų | 147.9 | 93% | 0.93 | 79% | 0.793 | S | S | * | * | trans | -56.6 | 146.1 | 171 | -107.9 | -179.8 | 172.3 | 178.3 | 0 | 111 | ||||
| 46 | K | 52.4 | Low | 53.3 | Low | 168 Ų | 168 | 146.3 Ų | 146.3 | 73% | 0.73 | 80% | 0.795 | S | S | * | * | trans | 119.8 | 137 | 168.7 | -80.5 | -179.5 | 158.3 | -107.9 | 0 | 109 | ||||
| 47 | E | 47.1 | Very low | 52.5 | Low | 141 Ų | 141 | 147.6 Ų | 147.6 | 66% | 0.659 | 80% | 0.798 | S | S | * | * | cis | -170.2 | 150.3 | 1.2 | -111.6 | 158.4 | 169.7 | 0 | 0 | 102.8 | ||||
| 48 | E | 51.9 | Low | 51.6 | Low | 179 Ų | 179 | 146 Ų | 146 | 84% | 0.836 | 79% | 0.794 | S | S | * | * | trans | -57.3 | 152.4 | 165.3 | -104.8 | -149.6 | 117.4 | 0 | 0 | 111.4 | ||||
| 49 | P | 53.9 | Low | 50.9 | Low | 112 Ų | 112 | 144.2 Ų | 144.2 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | -139.7 | 127.5 | 126.6 | 33.3 | -18.6 | 0 | 0 | 0 | 114.1 | |||||
| 50 | E | 53.6 | Low | 50.5 | Low | 157 Ų | 157 | 150.7 Ų | 150.7 | 73% | 0.734 | 80% | 0.796 | S | S | * | * | trans | 24 | 128.6 | 130.3 | -56.4 | -161.8 | 143.3 | 0 | 0 | 120.3 | ||||
| 51 | D | 45.6 | Very low | 50 | Low | 152 Ų | 152 | 147.3 Ų | 147.3 | 81% | 0.813 | 79% | 0.787 | S | S | * | * | trans | 60.9 | 101.8 | 136.6 | -58.5 | -34 | 0 | 0 | 0 | 119.7 | ||||
| 52 | A | 50.4 | Low | 50 | Low | 101 Ų | 101 | 148.5 Ų | 148.5 | 84% | 0.835 | 80% | 0.796 | S | S | * | * | trans | -138.7 | 99.5 | 149.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 53 | S | 47.1 | Very low | 49.8 | Very low | 112 Ų | 112 | 143.1 Ų | 143.1 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | trans | -59.8 | 129.1 | 162.2 | 171.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 54 | V | 59 | Low | 49.9 | Very low | 141 Ų | 141 | 137.7 Ų | 137.7 | 86% | 0.855 | 78% | 0.782 | S | S | * | * | trans | -138.9 | 111.1 | 152.5 | -178.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 55 | E | 46.7 | Very low | 49.5 | Very low | 187 Ų | 187 | 140.1 Ų | 140.1 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | trans | -74.9 | 142.3 | 168.6 | -164.7 | -169.5 | 150.1 | 0 | 0 | 110.1 | ||||
| 56 | G | 43.8 | Very low | 49.9 | Very low | 71 Ų | 71 | 137 Ų | 137 | 73% | 0.732 | 78% | 0.777 | S | S | * | * | trans | 166.1 | 100.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 57 | A | 50 | Low | 49.5 | Very low | 100 Ų | 100 | 140.3 Ų | 140.3 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | trans | 65.6 | 105.4 | 147 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 58 | E | 47.6 | Very low | 49.8 | Very low | 153 Ų | 153 | 137.6 Ų | 137.6 | 72% | 0.715 | 79% | 0.786 | S | S | * | * | 94.6 | 109.6 | 75.6 | -127.8 | -164.9 | 138.6 | 0 | 0 | 115 | |||||
| 59 | K | 47.4 | Very low | 50.4 | Low | 163 Ų | 163 | 135 Ų | 135 | 71% | 0.709 | 79% | 0.785 | S | S | * | * | trans | 41.9 | 125.3 | 145.4 | -69.6 | 176.1 | -164.8 | 141 | 0 | 121 | ||||
| 60 | K | 48.8 | Very low | 50 | Low | 202 Ų | 202 | 136.7 Ų | 136.7 | 88% | 0.878 | 79% | 0.788 | S | S | * | * | -170.7 | 136.1 | 101.9 | -105.9 | 173 | -179 | 174.8 | 0 | 113.3 | |||||
| 61 | D | 45.9 | Very low | 50.3 | Low | 142 Ų | 142 | 138.7 Ų | 138.7 | 76% | 0.759 | 80% | 0.795 | S | S | * | * | trans | -63.6 | 152 | 178.2 | -53 | -75.9 | 0 | 0 | 0 | 114.2 | ||||
| 62 | S | 54.9 | Low | 50.2 | Low | 115 Ų | 115 | 140.9 Ų | 140.9 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | 142.4 | 142.7 | 111.8 | 63.8 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 63 | A | 50.1 | Low | 50.6 | Low | 94 Ų | 94 | 141.7 Ų | 141.7 | 78% | 0.777 | 80% | 0.796 | S | S | * | * | trans | 75.8 | 132.1 | 155.8 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 64 | T | 53.7 | Low | 50.9 | Low | 116 Ų | 116 | 144.3 Ų | 144.3 | 71% | 0.712 | 80% | 0.796 | S | S | * | * | cis | -173.2 | 147.8 | -1.4 | -70.6 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 65 | P | 42.1 | Very low | 50.5 | Low | 122 Ų | 122 | 144.4 Ų | 144.4 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | trans | -91.2 | 135.1 | -177.6 | 34.8 | -30.8 | 0 | 0 | 0 | 112.4 | ||||
| 66 | I | 55 | Low | 51 | Low | 150 Ų | 150 | 143.1 Ų | 143.1 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -143.8 | 97.5 | 171.9 | -58.4 | -177.9 | 0 | 0 | 0 | 107.6 | ||||
| 67 | R | 45.9 | Very low | 51 | Low | 236 Ų | 236 | 144.7 Ų | 144.7 | 89% | 0.891 | 79% | 0.789 | S | S | * | * | 96.1 | 112 | 90.5 | -161.5 | 179 | -169.6 | 168.2 | 4 | 112.1 | |||||
| 68 | A | 52.9 | Low | 51 | Low | 84 Ų | 84 | 144.4 Ų | 144.4 | 69% | 0.694 | 79% | 0.787 | S | S | * | * | trans | -63.4 | 157 | 172 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 69 | P | 63.6 | Low | 51.1 | Low | 125 Ų | 125 | 142.6 Ų | 142.6 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | trans | -113.8 | 112.2 | 149.5 | 32.3 | -20.4 | 0 | 0 | 0 | 111 | ||||
| 70 | D | 45.6 | Very low | 51.5 | Low | 147 Ų | 147 | 140.2 Ų | 140.2 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | trans | -54.4 | 134.6 | 150.6 | -68.1 | -73.2 | 0 | 0 | 0 | 109.7 | ||||
| 71 | K | 60.4 | Low | 51.5 | Low | 200 Ų | 200 | 135.9 Ų | 135.9 | 87% | 0.87 | 79% | 0.79 | S | S | * | * | trans | 177.7 | 105.7 | 139.3 | -94.2 | 153.7 | -163.9 | -173.8 | 0 | 112.2 | ||||
| 72 | K | 42.6 | Very low | 52 | Low | 197 Ų | 197 | 135 Ų | 135 | 86% | 0.857 | 80% | 0.795 | S | S | * | * | 61.1 | 86.6 | 123.5 | -150.4 | 179.4 | -169.1 | -173.3 | 0 | 116.3 | |||||
| 73 | S | 59.2 | Low | 52.1 | Low | 119 Ų | 119 | 139.7 Ų | 139.7 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -93.9 | 120.1 | 157.3 | 53.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 74 | E | 53.5 | Low | 51.6 | Low | 167 Ų | 167 | 139.1 Ų | 139.1 | 78% | 0.78 | 80% | 0.804 | S | S | * | * | trans | -62.1 | 138.3 | 174.3 | -79.5 | 167.1 | 98.7 | 0 | 0 | 111.9 | I76 | E74-I76 PolarHBondContact O-N 2.94Š| ||
| 75 | N | 51.7 | Low | 51.7 | Low | 142 Ų | 142 | 139.1 Ų | 139.1 | 76% | 0.759 | 81% | 0.809 | S | S | * | * | trans | -68.6 | 110.7 | 166.9 | 50.1 | -13.4 | 0 | 0 | 0 | 110.6 | ||||
| 76 | I | 55.8 | Low | 52 | Low | 161 Ų | 161 | 142.4 Ų | 142.4 | 83% | 0.826 | 81% | 0.814 | S | S | * | * | trans | -102.9 | 93.7 | 166.1 | -53.3 | 178.3 | 0 | 0 | 0 | 107.9 | E74 A78 | E74-I76 PolarHBondContact O-N 2.94Å; I76-A78 PolarHBondContact O-N 3.46Å | ||
| 77 | S | 44.2 | Very low | 51.5 | Low | 103 Ų | 103 | 142.1 Ų | 142.1 | 72% | 0.72 | 82% | 0.819 | S | S | * | * | trans | -69.9 | 106.4 | 167.4 | -45.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 78 | A | 49.6 | Very low | 51.9 | Low | 94 Ų | 94 | 135.4 Ų | 135.4 | 78% | 0.777 | 81% | 0.814 | S | S | * | * | trans | -105.9 | 85.4 | 164.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | I76 S80 | I76-A78 PolarHBondContact O-N 3.46Å; A78-S80 PolarHBondContact O-N 3.46Å | ||
| 79 | S | 50 | Low | 51.4 | Low | 116 Ų | 116 | 141.4 Ų | 141.4 | 81% | 0.811 | 82% | 0.824 | S | S | * | * | trans | -81.5 | 105.6 | 165.8 | 54.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 80 | S | 57 | Low | 50.8 | Low | 112 Ų | 112 | 141.4 Ų | 141.4 | 78% | 0.783 | 83% | 0.827 | S | S | * | * | trans | -113.1 | 93.9 | 160.9 | 55.4 | 0 | 0 | 0 | 0 | 108.7 | A78 | A78-S80 PolarHBondContact O-N 3.46Š| ||
| 81 | S | 47.7 | Very low | 50.8 | Low | 112 Ų | 112 | 137.6 Ų | 137.6 | 78% | 0.783 | 82% | 0.823 | S | S | * | * | trans | -62 | 127.6 | 162.9 | 57 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 82 | S | 56 | Low | 50 | Low | 124 Ų | 124 | 136.6 Ų | 136.6 | 87% | 0.867 | 82% | 0.821 | S | S | * | * | trans | -145.2 | 123.5 | 154.5 | -79.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 83 | K | 56.7 | Low | 50.3 | Low | 212 Ų | 212 | 135.6 Ų | 135.6 | 92% | 0.922 | 82% | 0.816 | S | S | * | * | trans | -59.9 | 140.9 | -172.9 | -90.5 | 164.4 | 164.6 | 170 | 0 | 111.9 | ||||
| 84 | G | 39.8 | Very low | 50.1 | Low | 82 Ų | 82 | 139.7 Ų | 139.7 | 85% | 0.845 | 82% | 0.819 | S | S | * | * | trans | -65.3 | 153.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 85 | S | 55.5 | Low | 49.9 | Very low | 117 Ų | 117 | 138.7 Ų | 138.7 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | trans | -123.6 | 122.7 | 163.1 | 54.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 86 | E | 49 | Very low | 50.2 | Low | 191 Ų | 191 | 136.6 Ų | 136.6 | 89% | 0.893 | 82% | 0.822 | S | S | * | * | trans | -6 | 123.6 | 160.1 | -136.3 | 158.9 | 91.6 | 0 | 0 | 118.8 | ||||
| 87 | V | 45.6 | Very low | 50.1 | Low | 144 Ų | 144 | 134.1 Ų | 134.1 | 87% | 0.873 | 82% | 0.819 | S | S | * | * | trans | -86.9 | 116.2 | 163.5 | 166.3 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 88 | A | 52.9 | Low | 50.6 | Low | 94 Ų | 94 | 141 Ų | 141 | 78% | 0.777 | 83% | 0.829 | S | S | * | * | trans | -114.6 | 129 | 164 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 89 | K | 44.1 | Very low | 51.2 | Low | 211 Ų | 211 | 145 Ų | 145 | 92% | 0.917 | 83% | 0.829 | S | S | * | * | trans | -87.8 | 125.9 | -176.4 | -134.2 | 178 | -174.9 | 173.6 | 0 | 109.8 | ||||
| 90 | S | 50.7 | Low | 51.4 | Low | 125 Ų | 125 | 147 Ų | 147 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | trans | -170.2 | 146.6 | 149.1 | 67.3 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 91 | G | 44.4 | Very low | 51.5 | Low | 67 Ų | 67 | 148.7 Ų | 148.7 | 69% | 0.691 | 83% | 0.831 | S | S | * | * | cis | 160 | 136.8 | 9.8 | 0 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 92 | E | 44.9 | Very low | 52 | Low | 179 Ų | 179 | 148.7 Ų | 148.7 | 84% | 0.836 | 83% | 0.831 | S | S | * | * | trans | 70.8 | 113.8 | 154.2 | -85.2 | 175.4 | 83.8 | 0 | 0 | 123.5 | ||||
| 93 | K | 48.6 | Very low | 52 | Low | 175 Ų | 175 | 149.4 Ų | 149.4 | 76% | 0.761 | 83% | 0.829 | S | S | * | * | 50.3 | 118.1 | 122.2 | -85.2 | 178.2 | 172 | 171.2 | 0 | 119.3 | |||||
| 94 | K | 53.9 | Low | 51.6 | Low | 205 Ų | 205 | 149 Ų | 149 | 89% | 0.891 | 83% | 0.828 | S | S | * | * | -164 | 136.6 | 109.9 | -120.3 | 172.2 | 178.7 | 172.8 | 0 | 114.1 | |||||
| 95 | D | 50.9 | Low | 52 | Low | 147 Ų | 147 | 148.8 Ų | 148.8 | 79% | 0.786 | 83% | 0.826 | S | S | * | * | trans | -53.8 | 143.5 | 173.4 | -54.8 | -95.7 | 0 | 0 | 0 | 114.6 | ||||
| 96 | A | 57 | Low | 51.7 | Low | 97 Ų | 97 | 153.5 Ų | 153.5 | 80% | 0.802 | 83% | 0.831 | S | S | * | * | trans | -165 | 94.1 | 143.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 97 | S | 52.8 | Low | 51.8 | Low | 110 Ų | 110 | 148 Ų | 148 | 77% | 0.769 | 82% | 0.818 | S | S | * | * | trans | 21 | 107.5 | 136.6 | -152.9 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 98 | R | 55.2 | Low | 51.8 | Low | 247 Ų | 247 | 145.5 Ų | 145.5 | 93% | 0.932 | 82% | 0.822 | S | S | * | * | trans | -99.6 | 112.9 | 157.1 | -107.1 | -178.5 | 179.6 | 172.1 | 1.7 | 108.4 | ||||
| 99 | K | 61.6 | Low | 51.9 | Low | 177 Ų | 177 | 146.4 Ų | 146.4 | 77% | 0.77 | 82% | 0.818 | S | S | * | * | trans | -83.3 | 127.2 | 163 | -77.3 | -179.8 | 175.6 | 177 | 0 | 108.4 | D101 | K99-D101 PolarHBondContact O-N 2.87Š| ||
| 100 | D | 54.4 | Low | 52.6 | Low | 159 Ų | 159 | 141.3 Ų | 141.3 | 85% | 0.85 | 81% | 0.809 | S | S | * | * | trans | -73 | 113.7 | 166.2 | -72.5 | -67.6 | 0 | 0 | 0 | 109.6 | ||||
| 101 | D | 60.4 | Low | 53.5 | Low | 148 Ų | 148 | 145 Ų | 145 | 79% | 0.791 | 81% | 0.809 | S | S | * | * | trans | -112.6 | 94.8 | 165.2 | -80.8 | -56 | 0 | 0 | 0 | 110 | K99 | K99-D101 PolarHBondContact O-N 2.87Š| ||
| 102 | S | 57.1 | Low | 54.6 | Low | 112 Ų | 112 | 149.8 Ų | 149.8 | 78% | 0.783 | 81% | 0.814 | S | S | * | * | trans | 25.2 | 121.4 | 134.9 | -149 | 0 | 0 | 0 | 0 | 120 | ||||
| 103 | V | 55.9 | Low | 56.1 | Low | 138 Ų | 138 | 152.1 Ų | 152.1 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | trans | -37.1 | 130.9 | 157.7 | 172.8 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 104 | K | 49.8 | Very low | 57.8 | Low | 205 Ų | 205 | 150.7 Ų | 150.7 | 89% | 0.891 | 82% | 0.821 | S | S | * | * | 165.7 | 106.1 | 120.2 | -170 | 168.6 | -172.2 | 177 | 0 | 110.9 | |||||
| 105 | G | 48.3 | Very low | 59.5 | Low | 77 Ų | 77 | 143 Ų | 143 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | -169 | 111.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 106 | K | 47.4 | Very low | 61.5 | Low | 215 Ų | 215 | 140.1 Ų | 140.1 | 94% | 0.935 | 78% | 0.775 | S | S | * | * | trans | -68.8 | 128.4 | 175.4 | -73.4 | 171.3 | 169.7 | 177.5 | 0 | 110.6 | ||||
| 107 | A | 52.1 | Low | 63.2 | Low | 75 Ų | 75 | 138.6 Ų | 138.6 | 62% | 0.62 | 76% | 0.763 | S | S | * | * | S | Bend | trans | 154.7 | 124.2 | 150.1 | 0 | 0 | 0 | 0 | 0 | 105.8 | T109 | A107-T109 VanDerWaalsContact C-N 3.34Å; A107-T109 PolarHBondContact O-N 3.22Å |
| 108 | G | 45.5 | Very low | 65.2 | Low | 92 Ų | 92 | 138 Ų | 138 | 95% | 0.948 | 76% | 0.757 | S | S | * | * | trans | -64.9 | 93 | -178.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 109 | T | 54.1 | Low | 67 | Low | 114 Ų | 114 | 129.5 Ų | 129.5 | 70% | 0.699 | 73% | 0.732 | S | S | * | * | trans | -123.9 | 133.5 | 172.2 | 55.6 | 0 | 0 | 0 | 0 | 107.3 | A107 K111 | A107-T109 VanDerWaalsContact C-N 3.34Å; A107-T109 PolarHBondContact O-N 3.22Å; T109-K111 PolarHBondContact O-N 2.88Å | ||
| 110 | S | 60.3 | Low | 68.6 | Low | 104 Ų | 104 | 128 Ų | 128 | 73% | 0.727 | 72% | 0.722 | S | S | * | * | trans | -52 | 99.8 | -174.5 | 49.2 | 0 | 0 | 0 | 0 | 111.6 | Q112 | S110-Q112 PolarHBondContact O-N 2.89Š| ||
| 111 | K | 68.3 | Low | 70.4 | Confident | 202 Ų | 202 | 125.1 Ų | 125.1 | 88% | 0.878 | 71% | 0.706 | S | S | * | * | trans | -70.6 | 77.1 | 160.1 | -68.9 | -174.7 | 179.4 | -177.1 | 0 | 107.2 | T109 R113 | T109-K111 PolarHBondContact O-N 2.88Å; K111-R113 PolarHBondContact O-N 3.44Å | ||
| 112 | Q | 69.1 | Low | 72 | Confident | 168 Ų | 168 | 119.7 Ų | 119.7 | 79% | 0.785 | 68% | 0.684 | S | S | * | * | trans | -61.4 | 110.7 | 168.4 | -75.7 | -177.7 | -51 | 0 | 0 | 106.8 | S110 T114 | S110-Q112 PolarHBondContact O-N 2.89Å; Q112-T114 PolarHBondContact O-N 3.27Å | ||
| 113 | R | 75.3 | Confident | 73.7 | Confident | 228 Ų | 228 | 118.8 Ų | 118.8 | 86% | 0.86 | 67% | 0.669 | S | S | * | * | trans | -67.5 | 113.5 | 168 | -79.4 | -172 | -175.6 | -179.4 | 2 | 106.8 | K111 V115 | K111-R113 PolarHBondContact O-N 3.44Å; R113-V115 HydrophobicContact CB-CG2 4.1Å; R113-V115 PolarHBondContact O-N 3.03Å | ||
| 114 | T | 84.3 | Confident | 75.5 | Confident | 145 Ų | 145 | 115.1 Ų | 115.1 | 89% | 0.89 | 65% | 0.649 | S | S | * | * | trans | -69.7 | 113.3 | 164.2 | -47.4 | 0 | 0 | 0 | 0 | 107.3 | Q112 | Q112-T114 PolarHBondContact O-N 3.27Š| ||
| 115 | V | 89.8 | Confident | 77.5 | Confident | 42 Ų | 42 | 108.6 Ų | 108.6 | 26% | 0.255 | 62% | 0.622 | S | S | . | * | trans | -117.1 | 134.5 | 174.5 | -174.8 | 0 | 0 | 0 | 0 | 106.7 | R113 T119 R120 M123 | R113-V115 HydrophobicContact CB-CG2 4.1Å; R113-V115 PolarHBondContact O-N 3.03Å; V115-T119 HydrophobicContact CG1-CG2 3.46Å; V115-T119 VanDerWaalsContact CG1-CG2 3.46Å; V115-R120 HydrophobicContact CB-CG 3.6Å; V115-R120 HydrophobicContact CG1-CG 3.64Å; V115-R120 WeakPolarHBondContact O-CD 3.34Å; V115-M123 HydrophobicContact CG1-SD 4.31Å | ||
| 116 | D | 93.3 | Very high | 79.6 | Confident | 87 Ų | 87 | 110.9 Ų | 110.9 | 47% | 0.465 | 61% | 0.612 | S | S | . | * | trans | -63.1 | 155.9 | 177.1 | 58.2 | -74.6 | 0 | 0 | 0 | 111.5 | P118 T119 R120 | D116-P118 WeakPolarHBondContact OD2-CD 3.43Å; D116-T119 PolarHBondContact O-N 3.37Å; D116-T119 VanDerWaalsContact OD1-CB 3.3Å; D116-T119 WeakPolarHBondContact OD1-CB 3.39Å; D116-T119 PolarHBondContact OD1-OG1 3.02Å; D116-T119 VanDerWaalsContact OD2-CB 3.31Å; D116-T119 WeakPolarHBondContact OD2-CB 3.49Å; D116-T119 PolarHBondContact OD2-N 2.89Å; D116-T119 PolarHBondContact OD2-OG1 3.43Å; D116-R120 WeakPolarHBondContact O-CB 3.25Å; D116-R120 WeakPolarHBondContact O-CG 3.5Å; D116-R120 PolarHBondContact O-N 3.27Å | ||
| 117 | A | 92.2 | Very high | 81.8 | Confident | 66 Ų | 66 | 105.8 Ų | 105.8 | 55% | 0.545 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -60.4 | -43.7 | -174 | 0 | 0 | 0 | 0 | 0 | 113.8 | R120 L121 | A117-R120 PolarHBondContact O-N 3.46Å; A117-L121 PolarHBondContact O-N 2.97Å |
| 118 | P | 94.3 | Very high | 83.6 | Confident | 98 Ų | 98 | 105.9 Ų | 105.9 | 64% | 0.636 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -59.7 | -46.3 | 174.8 | -25.1 | 35.3 | 0 | 0 | 0 | 113 | D116 R120 L121 G122 | D116-P118 WeakPolarHBondContact OD2-CD 3.43Å; P118-R120 VanDerWaalsContact C-N 3.35Å; P118-R120 PolarHBondContact O-N 2.95Å; P118-L121 WeakPolarHBondContact O-CB 3.39Å; P118-L121 PolarHBondContact O-N 3.48Å; P118-G122 PolarHBondContact O-N 2.99Å |
| 119 | T | 94.3 | Very high | 85.7 | Confident | 68 Ų | 68 | 107.5 Ų | 107.5 | 42% | 0.417 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.1 | -40.8 | 178.3 | -59.1 | 0 | 0 | 0 | 0 | 111.5 | V115 D116 L121 G122 M123 | V115-T119 HydrophobicContact CG1-CG2 3.46Å; V115-T119 VanDerWaalsContact CG1-CG2 3.46Å; D116-T119 PolarHBondContact O-N 3.37Å; D116-T119 VanDerWaalsContact OD1-CB 3.3Å; D116-T119 WeakPolarHBondContact OD1-CB 3.39Å; D116-T119 PolarHBondContact OD1-OG1 3.02Å; D116-T119 VanDerWaalsContact OD2-CB 3.31Å; D116-T119 WeakPolarHBondContact OD2-CB 3.49Å; D116-T119 PolarHBondContact OD2-N 2.89Å; D116-T119 PolarHBondContact OD2-OG1 3.43Å; T119-L121 VanDerWaalsContact C-N 3.33Å; T119-L121 PolarHBondContact O-N 3.46Å; T119-G122 PolarHBondContact O-N 3.47Å; T119-M123 HydrophobicContact CG2-SD 4.45Å; T119-M123 WeakPolarHBondContact O-CG 3.32Å; T119-M123 PolarHBondContact O-N 3.31Å |
| 120 | R | 93.8 | Very high | 87.6 | Confident | 146 Ų | 146 | 109.4 Ų | 109.4 | 55% | 0.551 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60 | -42.3 | 174 | -74.6 | 173.7 | 56.1 | -126 | -6.4 | 112.3 | V115 D116 A117 P118 M123 C124 | V115-R120 HydrophobicContact CB-CG 3.6Å; V115-R120 HydrophobicContact CG1-CG 3.64Å; V115-R120 WeakPolarHBondContact O-CD 3.34Å; D116-R120 WeakPolarHBondContact O-CB 3.25Å; D116-R120 WeakPolarHBondContact O-CG 3.5Å; D116-R120 PolarHBondContact O-N 3.27Å; A117-R120 PolarHBondContact O-N 3.46Å; P118-R120 VanDerWaalsContact C-N 3.35Å; P118-R120 PolarHBondContact O-N 2.95Å; R120-M123 PolarHBondContact O-N 3Å; R120-C124 PolarHBondContact O-N 3.05Å; R120-C124 PolarHBondContact O-SG 3.4Å |
| 121 | L | 92.8 | Very high | 89 | Confident | 98 Ų | 98 | 107.2 Ų | 107.2 | 51% | 0.513 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -62.8 | -44.8 | 177 | -179 | 62.6 | 0 | 0 | 0 | 111 | A117 P118 T119 M123 C124 M125 | A117-L121 PolarHBondContact O-N 2.97Å; P118-L121 WeakPolarHBondContact O-CB 3.39Å; P118-L121 PolarHBondContact O-N 3.48Å; T119-L121 VanDerWaalsContact C-N 3.33Å; T119-L121 PolarHBondContact O-N 3.46Å; L121-M123 PolarHBondContact O-N 3.17Å; L121-C124 WeakPolarHBondContact O-CB 3.44Å; L121-C124 PolarHBondContact O-N 2.98Å; L121-C124 VanDerWaalsContact O-N 3.17Å; L121-M125 HydrophobicContact CD1-CE 3.67Å; L121-M125 WeakPolarHBondContact O-CG 3.34Å; L121-M125 PolarHBondContact O-N 3Å |
| 122 | G | 93.9 | Very high | 89.9 | Confident | 33 Ų | 33 | 101.1 Ų | 101.1 | 34% | 0.34 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -56.6 | -49.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | P118 T119 C124 M125 E126 | P118-G122 PolarHBondContact O-N 2.99Å; T119-G122 PolarHBondContact O-N 3.47Å; G122-C124 VanDerWaalsContact C-N 3.29Å; G122-C124 PolarHBondContact O-N 3.48Å; G122-M125 PolarHBondContact O-N 3.1Å; G122-M125 VanDerWaalsContact O-N 3.1Å; G122-E126 WeakPolarHBondContact O-CG 3.39Å; G122-E126 PolarHBondContact O-N 2.87Å |
| 123 | M | 94.2 | Very high | 90.8 | Very high | 93 Ų | 93 | 95.3 Ų | 95.3 | 46% | 0.458 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.6 | -39.4 | 176.2 | -66.1 | 176.1 | 73.6 | 0 | 0 | 112.4 | V115 T119 R120 L121 E126 M127 | V115-M123 HydrophobicContact CG1-SD 4.31Å; T119-M123 HydrophobicContact CG2-SD 4.45Å; T119-M123 WeakPolarHBondContact O-CG 3.32Å; T119-M123 PolarHBondContact O-N 3.31Å; R120-M123 PolarHBondContact O-N 3Å; L121-M123 PolarHBondContact O-N 3.17Å; M123-E126 PolarHBondContact O-N 3.03Å; M123-M127 WeakPolarHBondContact O-CE 3.3Å; M123-M127 WeakPolarHBondContact O-CG 3.34Å; M123-M127 PolarHBondContact O-N 2.73Å |
| 124 | C | 91.8 | Very high | 91.2 | Very high | 62 Ų | 62 | 89.8 Ų | 89.8 | 42% | 0.419 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 175.9 | -70 | 0 | 0 | 0 | 0 | 112.2 | R120 L121 G122 M127 M128 | R120-C124 PolarHBondContact O-N 3.05Å; R120-C124 PolarHBondContact O-SG 3.4Å; L121-C124 WeakPolarHBondContact O-CB 3.44Å; L121-C124 PolarHBondContact O-N 2.98Å; L121-C124 VanDerWaalsContact O-N 3.17Å; G122-C124 VanDerWaalsContact C-N 3.29Å; G122-C124 PolarHBondContact O-N 3.48Å; C124-M127 PolarHBondContact O-N 3.46Å; C124-M128 WeakPolarHBondContact O-CG 3.39Å; C124-M128 PolarHBondContact O-N 3.21Å |
| 125 | M | 92 | Very high | 91.3 | Very high | 67 Ų | 67 | 86.1 Ų | 86.1 | 33% | 0.33 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66.7 | -41.3 | 177.7 | -66 | -64.3 | 154.4 | 0 | 0 | 111.5 | L121 G122 M128 H129 | L121-M125 HydrophobicContact CD1-CE 3.67Å; L121-M125 WeakPolarHBondContact O-CG 3.34Å; L121-M125 PolarHBondContact O-N 3Å; G122-M125 PolarHBondContact O-N 3.1Å; G122-M125 VanDerWaalsContact O-N 3.1Å; M125-M128 PolarHBondContact O-N 2.94Å; M125-H129 WeakPolarHBondContact O-CB 3.29Å; M125-H129 PolarHBondContact O-N 2.84Å |
| 126 | E | 93.8 | Very high | 91.3 | Very high | 125 Ų | 125 | 87.5 Ų | 87.5 | 58% | 0.584 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -60.2 | -48 | 174.1 | -73.2 | 175.5 | 175.2 | 0 | 0 | 111.4 | G122 M123 M128 H129 E130 | G122-E126 WeakPolarHBondContact O-CG 3.39Å; G122-E126 PolarHBondContact O-N 2.87Å; M123-E126 PolarHBondContact O-N 3.03Å; E126-M128 VanDerWaalsContact C-N 3.33Å; E126-M128 PolarHBondContact O-N 3.49Å; E126-H129 PolarHBondContact O-N 2.96Å; E126-E130 WeakPolarHBondContact O-CB 3.31Å; E126-E130 WeakPolarHBondContact O-CG 3.5Å; E126-E130 PolarHBondContact O-N 2.9Å |
| 127 | M | 93 | Very high | 91.2 | Very high | 109 Ų | 109 | 91.1 Ų | 91.1 | 54% | 0.537 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.8 | -39.1 | 177.5 | -73.2 | -175.5 | -63.6 | 0 | 0 | 112.8 | M123 C124 H129 E130 A131 | M123-M127 WeakPolarHBondContact O-CE 3.3Å; M123-M127 WeakPolarHBondContact O-CG 3.34Å; M123-M127 PolarHBondContact O-N 2.73Å; C124-M127 PolarHBondContact O-N 3.46Å; M127-H129 VanDerWaalsContact C-N 3.34Å; M127-E130 PolarHBondContact O-N 3.04Å; M127-A131 WeakPolarHBondContact O-CB 3.35Å; M127-A131 PolarHBondContact O-N 2.96Å |
| 128 | M | 89.8 | Confident | 91.1 | Very high | 76 Ų | 76 | 94 Ų | 94 | 37% | 0.374 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.1 | -42.3 | 175.9 | -78.2 | -71.5 | -64.6 | 0 | 0 | 111.6 | C124 M125 E126 L133 | C124-M128 WeakPolarHBondContact O-CG 3.39Å; C124-M128 PolarHBondContact O-N 3.21Å; M125-M128 PolarHBondContact O-N 2.94Å; E126-M128 VanDerWaalsContact C-N 3.33Å; E126-M128 PolarHBondContact O-N 3.49Å; M128-L133 HydrophobicContact CE-CD1 4.35Å |
| 129 | H | 89.9 | Confident | 90.8 | Very high | 127 Ų | 127 | 90.4 Ų | 90.4 | 59% | 0.588 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -67.8 | -43.4 | 177 | -177.1 | -85.6 | 0 | 0 | 0 | 111.7 | M125 E126 M127 A131 N132 Q148 | M125-H129 WeakPolarHBondContact O-CB 3.29Å; M125-H129 PolarHBondContact O-N 2.84Å; E126-H129 PolarHBondContact O-N 2.96Å; M127-H129 VanDerWaalsContact C-N 3.34Å; H129-A131 VanDerWaalsContact C-N 3.31Å; H129-A131 PolarHBondContact O-N 3.39Å; H129-N132 PolarHBondContact O-N 2.97Å; H129-Q148 PolarHBondContact CD2-OE1 3.25Å |
| 130 | E | 92.8 | Very high | 90.6 | Very high | 154 Ų | 154 | 93 Ų | 93 | 72% | 0.72 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.7 | -34.6 | 176.4 | -74.8 | -178.6 | 178.5 | 0 | 0 | 113 | E126 M127 N132 | E126-E130 WeakPolarHBondContact O-CB 3.31Å; E126-E130 WeakPolarHBondContact O-CG 3.5Å; E126-E130 PolarHBondContact O-N 2.9Å; M127-E130 PolarHBondContact O-N 3.04Å; E130-N132 PolarHBondContact O-N 2.87Å |
| 131 | A | 89.6 | Confident | 90.5 | Very high | 57 Ų | 57 | 93.9 Ų | 93.9 | 47% | 0.471 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.6 | -22.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | M127 H129 L133 | M127-A131 WeakPolarHBondContact O-CB 3.35Å; M127-A131 PolarHBondContact O-N 2.96Å; H129-A131 VanDerWaalsContact C-N 3.31Å; H129-A131 PolarHBondContact O-N 3.39Å; A131-L133 HydrophobicContact CB-CD2 4Å; A131-L133 HydrophobicContact CB-CG 4.06Å; A131-L133 PolarHBondContact O-N 3.43Å; A131-L133 VanDerWaalsContact O-N 3.13Å |
| 132 | N | 87.8 | Confident | 90.4 | Very high | 74 Ų | 74 | 93.8 Ų | 93.8 | 40% | 0.396 | 48% | 0.482 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 42.7 | 49.4 | 176.3 | -163 | 25.8 | 0 | 0 | 0 | 113.7 | H129 E130 E134 S135 | H129-N132 PolarHBondContact O-N 2.97Å; E130-N132 PolarHBondContact O-N 2.87Å; N132-E134 PolarHBondContact O-N 3.39Å; N132-S135 VanDerWaalsContact CG-OG 3.32Å; N132-S135 WeakPolarHBondContact ND2-CB 3.4Å; N132-S135 PolarHBondContact ND2-OG 3.33Å; N132-S135 PolarHBondContact O-N 3.45Å; N132-S135 PolarHBondContact O-OG 2.76Å |
| 133 | L | 87.5 | Confident | 90.1 | Very high | 47 Ų | 47 | 95.2 Ų | 95.2 | 25% | 0.246 | 50% | 0.496 | C | S | . | . | G | 310 helix | trans | -59.5 | -20.9 | -172.8 | -61 | 177.4 | 0 | 0 | 0 | 113.2 | M128 A131 S135 D136 L139 F146 | M128-L133 HydrophobicContact CE-CD1 4.35Å; A131-L133 HydrophobicContact CB-CD2 4Å; A131-L133 HydrophobicContact CB-CG 4.06Å; A131-L133 PolarHBondContact O-N 3.43Å; A131-L133 VanDerWaalsContact O-N 3.13Å; L133-S135 VanDerWaalsContact C-N 3.26Å; L133-S135 PolarHBondContact O-N 2.91Å; L133-D136 PolarHBondContact O-N 3.43Å; L133-L139 HydrophobicContact CB-CD1 3.84Å; L133-L139 HydrophobicContact CD2-CD1 3.97Å; L133-L139 HydrophobicContact CG-CD1 4.4Å; L133-F146 HydrophobicContact CB-CB 4.39Å; L133-F146 HydrophobicContact CB-CD2 4.26Å; L133-F146 HydrophobicContact CB-CG 4.5Å; L133-F146 HydrophobicContact CD1-CB 4.35Å; L133-F146 HydrophobicContact CD1-CG 4.2Å |
| 134 | E | 85.5 | Confident | 89.7 | Confident | 112 Ų | 112 | 94.8 Ų | 94.8 | 52% | 0.523 | 50% | 0.495 | S | S | . | . | G | 310 helix | trans | -66.7 | -26.8 | 174.7 | -64.3 | 178.1 | -173.4 | 0 | 0 | 112.9 | N132 Q140 | N132-E134 PolarHBondContact O-N 3.39Å; E134-Q140 PolarHBondContact O-NE2 3.48Å |
| 135 | S | 86.4 | Confident | 89.4 | Confident | 67 Ų | 67 | 100.9 Ų | 100.9 | 47% | 0.469 | 52% | 0.518 | S | S | . | . | G | 310 helix | trans | -91.1 | -3.6 | 179.5 | 69.4 | 0 | 0 | 0 | 0 | 114.2 | N132 L133 E137 | N132-S135 VanDerWaalsContact CG-OG 3.32Å; N132-S135 WeakPolarHBondContact ND2-CB 3.4Å; N132-S135 PolarHBondContact ND2-OG 3.33Å; N132-S135 PolarHBondContact O-N 3.45Å; N132-S135 PolarHBondContact O-OG 2.76Å; L133-S135 VanDerWaalsContact C-N 3.26Å; L133-S135 PolarHBondContact O-N 2.91Å; S135-E137 PolarHBondContact O-N 3.26Å |
| 136 | D | 89.1 | Confident | 88.9 | Confident | 72 Ų | 72 | 101.3 Ų | 101.3 | 39% | 0.385 | 52% | 0.518 | S | S | . | . | trans | -75.9 | 114.3 | -177.7 | -170 | -52.1 | 0 | 0 | 0 | 110.2 | L133 F138 L139 Q140 | L133-D136 PolarHBondContact O-N 3.43Å; D136-F138 PolarHBondContact O-N 3.46Å; D136-F138 VanDerWaalsContact OD1-CB 3.29Å; D136-F138 WeakPolarHBondContact OD1-CB 3.24Å; D136-F138 PolarHBondContact OD1-N 3.27Å; D136-L139 HydrophobicContact CB-CB 4.13Å; D136-L139 HydrophobicContact CB-CD1 3.87Å; D136-L139 HydrophobicContact CB-CG 3.91Å; D136-L139 PolarHBondContact O-N 2.96Å; D136-L139 VanDerWaalsContact O-N 3.11Å; D136-L139 PolarHBondContact OD1-N 3.32Å; D136-Q140 WeakPolarHBondContact O-CG 3.49Å; D136-Q140 PolarHBondContact O-N 3.21Å | ||
| 137 | E | 90 | Very high | 88.4 | Confident | 162 Ų | 162 | 99.4 Ų | 99.4 | 76% | 0.757 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -56.8 | -34.2 | -177.7 | -64.6 | -177.7 | 170 | 0 | 0 | 112.5 | S135 Q140 E141 | S135-E137 PolarHBondContact O-N 3.26Å; E137-Q140 PolarHBondContact O-N 3.36Å; E137-E141 WeakPolarHBondContact O-CB 3.47Å; E137-E141 PolarHBondContact O-N 2.91Å |
| 138 | F | 90.5 | Very high | 88 | Confident | 126 Ų | 126 | 97 Ų | 97 | 55% | 0.553 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -71.6 | -39.2 | 179.5 | -179.5 | -99.6 | 0 | 0 | 0 | 111.4 | D136 Q140 E141 L142 | D136-F138 PolarHBondContact O-N 3.46Å; D136-F138 VanDerWaalsContact OD1-CB 3.29Å; D136-F138 WeakPolarHBondContact OD1-CB 3.24Å; D136-F138 PolarHBondContact OD1-N 3.27Å; F138-Q140 VanDerWaalsContact C-N 3.34Å; F138-E141 PolarHBondContact O-N 2.86Å; F138-L142 HydrophobicContact CD1-CD1 3.97Å; F138-L142 HydrophobicContact CE1-CD1 3.4Å; F138-L142 VanDerWaalsContact CE1-CD1 3.4Å; F138-L142 HydrophobicContact CE1-CG 4.38Å; F138-L142 HydrophobicContact CE2-CD1 4.44Å; F138-L142 HydrophobicContact CZ-CD1 3.68Å; F138-L142 HydrophobicContact CZ-CG 4.42Å; F138-L142 WeakPolarHBondContact O-CG 3.16Å; F138-L142 PolarHBondContact O-N 3.18Å |
| 139 | L | 89.3 | Confident | 87.9 | Confident | 23 Ų | 23 | 98.2 Ų | 98.2 | 12% | 0.12 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -69.1 | -36.6 | 176.4 | -60.8 | -178.7 | 0 | 0 | 0 | 111.3 | L133 D136 L142 G143 L144 F146 | L133-L139 HydrophobicContact CB-CD1 3.84Å; L133-L139 HydrophobicContact CD2-CD1 3.97Å; L133-L139 HydrophobicContact CG-CD1 4.4Å; D136-L139 HydrophobicContact CB-CB 4.13Å; D136-L139 HydrophobicContact CB-CD1 3.87Å; D136-L139 HydrophobicContact CB-CG 3.91Å; D136-L139 PolarHBondContact O-N 2.96Å; D136-L139 VanDerWaalsContact O-N 3.11Å; D136-L139 PolarHBondContact OD1-N 3.32Å; L139-L142 PolarHBondContact O-N 3.1Å; L139-G143 PolarHBondContact O-N 3Å; L139-L144 HydrophobicContact CD2-CD1 4.15Å; L139-L144 PolarHBondContact O-N 3.32Å; L139-F146 HydrophobicContact CB-CE2 4.39Å; L139-F146 HydrophobicContact CD1-CD2 4.01Å; L139-F146 HydrophobicContact CD1-CE2 3.68Å; L139-F146 HydrophobicContact CD2-CE2 3.94Å; L139-F146 HydrophobicContact CD2-CZ 4.45Å; L139-F146 HydrophobicContact CG-CE2 4.22Å |
| 140 | Q | 89.5 | Confident | 87.8 | Confident | 123 Ų | 123 | 96.2 Ų | 96.2 | 58% | 0.575 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.7 | -43.8 | 173 | -69.9 | -175.9 | 14.9 | 0 | 0 | 112.4 | E134 D136 E137 F138 L142 G143 | E134-Q140 PolarHBondContact O-NE2 3.48Å; D136-Q140 WeakPolarHBondContact O-CG 3.49Å; D136-Q140 PolarHBondContact O-N 3.21Å; E137-Q140 PolarHBondContact O-N 3.36Å; F138-Q140 VanDerWaalsContact C-N 3.34Å; Q140-L142 PolarHBondContact O-N 3.5Å; Q140-G143 PolarHBondContact O-N 3.48Å |
| 141 | E | 91.2 | Very high | 87.6 | Confident | 164 Ų | 164 | 94.4 Ų | 94.4 | 77% | 0.766 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.2 | -33.6 | 177.4 | -171.8 | 176.4 | -170.9 | 0 | 0 | 111.9 | E137 F138 G143 | E137-E141 WeakPolarHBondContact O-CB 3.47Å; E137-E141 PolarHBondContact O-N 2.91Å; F138-E141 PolarHBondContact O-N 2.86Å; E141-G143 VanDerWaalsContact C-N 3.31Å |
| 142 | L | 90.5 | Very high | 87.7 | Confident | 97 Ų | 97 | 100.7 Ų | 100.7 | 51% | 0.508 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -6.2 | 174.5 | -65.5 | 179.4 | 0 | 0 | 0 | 114.1 | F138 L139 Q140 L144 | F138-L142 HydrophobicContact CD1-CD1 3.97Å; F138-L142 HydrophobicContact CE1-CD1 3.4Å; F138-L142 VanDerWaalsContact CE1-CD1 3.4Å; F138-L142 HydrophobicContact CE1-CG 4.38Å; F138-L142 HydrophobicContact CE2-CD1 4.44Å; F138-L142 HydrophobicContact CZ-CD1 3.68Å; F138-L142 HydrophobicContact CZ-CG 4.42Å; F138-L142 WeakPolarHBondContact O-CG 3.16Å; F138-L142 PolarHBondContact O-N 3.18Å; L139-L142 PolarHBondContact O-N 3.1Å; Q140-L142 PolarHBondContact O-N 3.5Å; L142-L144 VanDerWaalsContact C-N 3.27Å; L142-L144 HydrophobicContact CB-CD1 3.98Å; L142-L144 HydrophobicContact CB-CG 3.9Å; L142-L144 HydrophobicContact CD1-CD1 4.01Å; L142-L144 PolarHBondContact O-N 3.15Å |
| 143 | G | 88 | Confident | 88 | Confident | 62 Ų | 62 | 102.8 Ų | 102.8 | 64% | 0.639 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65 | 29.5 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | L139 Q140 E141 | L139-G143 PolarHBondContact O-N 3Å; Q140-G143 PolarHBondContact O-N 3.48Å; E141-G143 VanDerWaalsContact C-N 3.31Å |
| 144 | L | 86.8 | Confident | 88.2 | Confident | 85 Ų | 85 | 106.2 Ų | 106.2 | 45% | 0.445 | 58% | 0.576 | S | S | . | * | trans | -92 | 113.6 | 179.4 | -64.6 | 175 | 0 | 0 | 0 | 110.1 | L139 L142 F146 | L139-L144 HydrophobicContact CD2-CD1 4.15Å; L139-L144 PolarHBondContact O-N 3.32Å; L142-L144 VanDerWaalsContact C-N 3.27Å; L142-L144 HydrophobicContact CB-CD1 3.98Å; L142-L144 HydrophobicContact CB-CG 3.9Å; L142-L144 HydrophobicContact CD1-CD1 4.01Å; L142-L144 PolarHBondContact O-N 3.15Å; L144-F146 HydrophobicContact CB-CD2 4.45Å; L144-F146 HydrophobicContact CB-CE2 3.64Å; L144-F146 HydrophobicContact CB-CZ 4.15Å; L144-F146 HydrophobicContact CD1-CE2 4.44Å; L144-F146 HydrophobicContact CD1-CZ 4.34Å | ||
| 145 | E | 84.6 | Confident | 88.6 | Confident | 189 Ų | 189 | 104 Ų | 104 | 88% | 0.883 | 58% | 0.583 | S | S | * | * | trans | -98.5 | 129.8 | 171.6 | -67.1 | -179.3 | 176 | 0 | 0 | 110.1 | ||||
| 146 | F | 82.3 | Confident | 89 | Confident | 77 Ų | 77 | 108.9 Ų | 108.9 | 34% | 0.338 | 60% | 0.598 | S | S | . | * | trans | -113.6 | 108.9 | 178.9 | -68 | -87.6 | 0 | 0 | 0 | 109.9 | L133 L139 L144 Q148 | L133-F146 HydrophobicContact CB-CB 4.39Å; L133-F146 HydrophobicContact CB-CD2 4.26Å; L133-F146 HydrophobicContact CB-CG 4.5Å; L133-F146 HydrophobicContact CD1-CB 4.35Å; L133-F146 HydrophobicContact CD1-CG 4.2Å; L139-F146 HydrophobicContact CB-CE2 4.39Å; L139-F146 HydrophobicContact CD1-CD2 4.01Å; L139-F146 HydrophobicContact CD1-CE2 3.68Å; L139-F146 HydrophobicContact CD2-CE2 3.94Å; L139-F146 HydrophobicContact CD2-CZ 4.45Å; L139-F146 HydrophobicContact CG-CE2 4.22Å; L144-F146 HydrophobicContact CB-CD2 4.45Å; L144-F146 HydrophobicContact CB-CE2 3.64Å; L144-F146 HydrophobicContact CB-CZ 4.15Å; L144-F146 HydrophobicContact CD1-CE2 4.44Å; L144-F146 HydrophobicContact CD1-CZ 4.34Å; F146-Q148 PolarHBondContact O-N 3.23Å | ||
| 147 | P | 83.5 | Confident | 89.1 | Confident | 84 Ų | 84 | 112.5 Ų | 112.5 | 55% | 0.545 | 62% | 0.623 | S | S | . | * | trans | -64.1 | 127.2 | 175 | 25.9 | -32.2 | 0 | 0 | 0 | 109.7 | T149 | P147-T149 PolarHBondContact O-N 3.31Š| ||
| 148 | Q | 84.2 | Confident | 89.2 | Confident | 60 Ų | 60 | 111.9 Ų | 111.9 | 28% | 0.28 | 62% | 0.624 | S | S | . | * | S | Bend | trans | -76.8 | 24.9 | 175.6 | -59.3 | -169.3 | 8.3 | 0 | 0 | 113.2 | H129 F146 | H129-Q148 PolarHBondContact CD2-OE1 3.25Å; F146-Q148 PolarHBondContact O-N 3.23Å |
| 149 | T | 88.1 | Confident | 89.1 | Confident | 101 Ų | 101 | 113.9 Ų | 113.9 | 62% | 0.62 | 64% | 0.639 | S | S | * | * | S | Bend | trans | -123.1 | 151.4 | -175.8 | 58.9 | 0 | 0 | 0 | 0 | 110.7 | P147 | P147-T149 PolarHBondContact O-N 3.31Š|
| 150 | S | 85.8 | Confident | 89.2 | Confident | 84 Ų | 84 | 119.5 Ų | 119.5 | 59% | 0.587 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 136.9 | 172.1 | 53.9 | 0 | 0 | 0 | 0 | 110.8 | ||
| 151 | V | 90.4 | Very high | 88.8 | Confident | 116 Ų | 116 | 117.7 Ų | 117.7 | 70% | 0.703 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 123 | 167.6 | -178.8 | 0 | 0 | 0 | 0 | 108.9 | V153 | V151-V153 HydrophobicContact CG1-CG2 4.3Š|
| 152 | E | 91.8 | Very high | 88.2 | Confident | 190 Ų | 190 | 117.2 Ų | 117.2 | 89% | 0.888 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 133.9 | 172.3 | -171.2 | 175.8 | 179.4 | 0 | 0 | 110.1 | ||
| 153 | V | 93 | Very high | 87.4 | Confident | 118 Ų | 118 | 121.6 Ų | 121.6 | 72% | 0.715 | 71% | 0.71 | S | S | * | * | trans | -131.4 | 131.2 | -177.5 | -175.9 | 0 | 0 | 0 | 0 | 109.7 | V151 G155 | V151-V153 HydrophobicContact CG1-CG2 4.3Å; V153-G155 PolarHBondContact O-N 3.46Å | ||
| 154 | C | 93 | Very high | 87.3 | Confident | 119 Ų | 119 | 124.6 Ų | 124.6 | 80% | 0.804 | 71% | 0.713 | S | S | * | * | trans | -72.8 | 108.1 | 174.5 | -66.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 155 | G | 93.8 | Very high | 87.4 | Confident | 65 Ų | 65 | 126.7 Ų | 126.7 | 67% | 0.67 | 73% | 0.728 | S | S | * | * | trans | -89.7 | 161.3 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V153 | V153-G155 PolarHBondContact O-N 3.46Š| ||
| 156 | H | 93.2 | Very high | 87.5 | Confident | 169 Ų | 169 | 123.2 Ų | 123.2 | 78% | 0.782 | 72% | 0.719 | S | S | * | * | trans | -120.7 | 131.6 | 170.3 | -64.8 | 12.2 | 0 | 0 | 0 | 108.8 | ||||
| 157 | V | 90.9 | Very high | 87.8 | Confident | 149 Ų | 149 | 125.9 Ų | 125.9 | 90% | 0.903 | 74% | 0.741 | S | S | * | * | trans | -94.3 | 113.4 | 174.4 | -178.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 158 | L | 92.8 | Very high | 88.1 | Confident | 148 Ų | 148 | 128.6 Ų | 128.6 | 78% | 0.775 | 75% | 0.754 | S | S | * | * | trans | -80.4 | 120.8 | 177.3 | -61 | 177.9 | 0 | 0 | 0 | 109.4 | I160 | L158-I160 PolarHBondContact O-N 3.44Š| ||
| 159 | L | 89.4 | Confident | 88.4 | Confident | 168 Ų | 168 | 133.1 Ų | 133.1 | 88% | 0.88 | 79% | 0.785 | S | S | * | * | trans | -81 | 112.5 | 169 | -165.5 | 96.9 | 0 | 0 | 0 | 108.4 | ||||
| 160 | I | 89.7 | Confident | 88.4 | Confident | 141 Ų | 141 | 135.4 Ų | 135.4 | 72% | 0.723 | 80% | 0.797 | S | S | * | * | trans | -95 | 107.2 | 170 | -56.3 | 175.2 | 0 | 0 | 0 | 106.7 | L158 I162 | L158-I160 PolarHBondContact O-N 3.44Å; I160-I162 HydrophobicContact CG2-CG1 4.5Å; I160-I162 PolarHBondContact O-N 3.31Å | ||
| 161 | A | 81.8 | Confident | 88.6 | Confident | 85 Ų | 85 | 139.4 Ų | 139.4 | 70% | 0.702 | 81% | 0.813 | S | S | * | * | trans | -74.1 | 110.7 | 166.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 162 | I | 77.8 | Confident | 88.4 | Confident | 154 Ų | 154 | 141.3 Ų | 141.3 | 79% | 0.79 | 82% | 0.822 | S | S | * | * | trans | -81 | 120.2 | 168.9 | -56.2 | 176.2 | 0 | 0 | 0 | 106.1 | I160 | I160-I162 HydrophobicContact CG2-CG1 4.5Å; I160-I162 PolarHBondContact O-N 3.31Å | ||
| 163 | P | 74.2 | Confident | 88.1 | Confident | 190 Ų | 190 | 136.9 Ų | 136.9 | 100% | 1.234 | 82% | 0.816 | S | S | * | * | trans | -68.9 | 0 | 177.8 | 29.8 | -34.9 | 0 | 0 | 0 | 113 |
Retrieved 163 of 163 residues in 31.2 ms
(Link to these results)