| 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 | 52.6 | Low | 78.9 | Confident | 232 Ų | 232 | 112.4 Ų | 112.4 | 100% | 1.143 | 63% | 0.626 | S | S | * | * | 0 | -6.7 | 0 | -71.4 | -175.6 | -112.2 | 0 | 0 | 114.3 | |||||
| 2 | A | 58.6 | Low | 79.8 | Confident | 74 Ų | 74 | 109.9 Ų | 109.9 | 61% | 0.612 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -81.7 | -25.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 115 | R4 S5 V6 | A2-R4 PolarHBondContact O-N 2.99Å; A2-S5 PolarHBondContact O-N 3.14Å; A2-V6 VanDerWaalsContact O-CG2 3.31Å; A2-V6 WeakPolarHBondContact O-CG2 3.3Å; A2-V6 PolarHBondContact O-N 2.84Å; A2-V6 VanDerWaalsContact O-N 3.16Å |
| 3 | T | 70.8 | Confident | 80.2 | Confident | 107 Ų | 107 | 108.4 Ų | 108.4 | 66% | 0.656 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -68.7 | -37.8 | -172.2 | 51.6 | 0 | 0 | 0 | 0 | 113.9 | L7 | T3-L7 WeakPolarHBondContact O-CB 3.45Å; T3-L7 WeakPolarHBondContact O-CD1 3.13Å; T3-L7 WeakPolarHBondContact O-CG 2.98Å; T3-L7 PolarHBondContact O-N 3.01Å |
| 4 | R | 75.6 | Confident | 80.5 | Confident | 202 Ų | 202 | 108.7 Ų | 108.7 | 76% | 0.762 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -69 | -37.5 | 177.1 | -81 | -174.3 | 148 | -168.9 | -6.3 | 112.9 | A2 L7 L8 | A2-R4 PolarHBondContact O-N 2.99Å; R4-L7 PolarHBondContact O-N 2.81Å; R4-L8 VanDerWaalsContact O-CG 3.31Å; R4-L8 WeakPolarHBondContact O-CG 3.26Å; R4-L8 PolarHBondContact O-N 3.49Å |
| 5 | S | 81.6 | Confident | 80.7 | Confident | 82 Ų | 82 | 109.3 Ų | 109.3 | 57% | 0.573 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -69 | -39.4 | 178 | -178.3 | 0 | 0 | 0 | 0 | 111.3 | A2 L8 A9 | A2-S5 PolarHBondContact O-N 3.14Å; S5-L8 PolarHBondContact O-N 2.88Å; S5-A9 PolarHBondContact O-N 3.02Å |
| 6 | V | 85.9 | Confident | 80.5 | Confident | 84 Ų | 84 | 109.9 Ų | 109.9 | 51% | 0.509 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.6 | -44.6 | 174.1 | 174.2 | 0 | 0 | 0 | 0 | 111.3 | A2 L8 A9 L10 | A2-V6 VanDerWaalsContact O-CG2 3.31Å; A2-V6 WeakPolarHBondContact O-CG2 3.3Å; A2-V6 PolarHBondContact O-N 2.84Å; A2-V6 VanDerWaalsContact O-N 3.16Å; V6-L8 VanDerWaalsContact C-N 3.33Å; V6-L8 PolarHBondContact O-N 3.13Å; V6-A9 PolarHBondContact O-N 3.47Å; V6-L10 HydrophobicContact CG1-CD1 4.2Å; V6-L10 WeakPolarHBondContact O-CG 3.17Å; V6-L10 PolarHBondContact O-N 3.13Å |
| 7 | L | 86.1 | Confident | 80.3 | Confident | 107 Ų | 107 | 113.1 Ų | 113.1 | 56% | 0.56 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -59 | -42.4 | 175.6 | -84.1 | 160 | 0 | 0 | 0 | 112.4 | T3 R4 L10 V11 | T3-L7 WeakPolarHBondContact O-CB 3.45Å; T3-L7 WeakPolarHBondContact O-CD1 3.13Å; T3-L7 WeakPolarHBondContact O-CG 2.98Å; T3-L7 PolarHBondContact O-N 3.01Å; R4-L7 PolarHBondContact O-N 2.81Å; L7-L10 PolarHBondContact O-N 2.92Å; L7-V11 VanDerWaalsContact O-CG2 3.31Å; L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 2.95Å |
| 8 | L | 88.4 | Confident | 79.9 | Confident | 118 Ų | 118 | 117.4 Ų | 117.4 | 62% | 0.618 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65.4 | -41.1 | 176.4 | -72.6 | 170.2 | 0 | 0 | 0 | 112 | R4 S5 V6 L10 V11 V12 | R4-L8 VanDerWaalsContact O-CG 3.31Å; R4-L8 WeakPolarHBondContact O-CG 3.26Å; R4-L8 PolarHBondContact O-N 3.49Å; S5-L8 PolarHBondContact O-N 2.88Å; V6-L8 VanDerWaalsContact C-N 3.33Å; V6-L8 PolarHBondContact O-N 3.13Å; L8-L10 VanDerWaalsContact C-N 3.33Å; L8-L10 PolarHBondContact O-N 3.16Å; L8-V11 PolarHBondContact O-N 3.05Å; L8-V12 VanDerWaalsContact O-CG2 3.27Å; L8-V12 WeakPolarHBondContact O-CG2 3.48Å; L8-V12 PolarHBondContact O-N 3.2Å |
| 9 | A | 90.8 | Very high | 79 | Confident | 61 Ų | 61 | 116.7 Ų | 116.7 | 50% | 0.504 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -62.4 | -40.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | S5 V6 V12 L13 | S5-A9 PolarHBondContact O-N 3.02Å; V6-A9 PolarHBondContact O-N 3.47Å; A9-V12 PolarHBondContact O-N 2.82Å; A9-L13 WeakPolarHBondContact O-CB 3.47Å; A9-L13 PolarHBondContact O-N 2.85Å |
| 10 | L | 87.3 | Confident | 78.1 | Confident | 91 Ų | 91 | 115.5 Ų | 115.5 | 48% | 0.476 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -64.7 | -45.6 | 175.4 | -69.1 | 172.3 | 0 | 0 | 0 | 111.8 | V6 L7 L8 V12 L13 D14 | V6-L10 HydrophobicContact CG1-CD1 4.2Å; V6-L10 WeakPolarHBondContact O-CG 3.17Å; V6-L10 PolarHBondContact O-N 3.13Å; L7-L10 PolarHBondContact O-N 2.92Å; L8-L10 VanDerWaalsContact C-N 3.33Å; L8-L10 PolarHBondContact O-N 3.16Å; L10-V12 VanDerWaalsContact C-N 3.3Å; L10-V12 PolarHBondContact O-N 2.72Å; L10-L13 WeakPolarHBondContact O-CB 3.46Å; L10-L13 PolarHBondContact O-N 2.72Å; L10-L13 VanDerWaalsContact O-N 3.1Å; L10-D14 PolarHBondContact O-N 2.96Å |
| 11 | V | 90.2 | Very high | 77.2 | Confident | 78 Ų | 78 | 115.9 Ų | 115.9 | 47% | 0.473 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -60.4 | -40.4 | 176.3 | 171.3 | 0 | 0 | 0 | 0 | 111.8 | L7 L8 D14 L15 | L7-V11 VanDerWaalsContact O-CG2 3.31Å; L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 2.95Å; L8-V11 PolarHBondContact O-N 3.05Å; V11-D14 PolarHBondContact O-N 2.02Å; V11-L15 HydrophobicContact CG1-CD1 4.1Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.14Å; V11-L15 PolarHBondContact O-N 3.39Å |
| 12 | V | 89.3 | Confident | 77.3 | Confident | 83 Ų | 83 | 107.2 Ų | 107.2 | 50% | 0.503 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65.5 | -40.2 | 175.5 | 171.6 | 0 | 0 | 0 | 0 | 111 | L8 A9 L10 L15 L16 | L8-V12 VanDerWaalsContact O-CG2 3.27Å; L8-V12 WeakPolarHBondContact O-CG2 3.48Å; L8-V12 PolarHBondContact O-N 3.2Å; A9-V12 PolarHBondContact O-N 2.82Å; L10-V12 VanDerWaalsContact C-N 3.3Å; L10-V12 PolarHBondContact O-N 2.72Å; V12-L15 PolarHBondContact O-N 2.95Å; V12-L16 HydrophobicContact CG1-CD1 4.12Å; V12-L16 VanDerWaalsContact O-CG 3.32Å; V12-L16 WeakPolarHBondContact O-CG 3.4Å; V12-L16 PolarHBondContact O-N 3.45Å |
| 13 | L | 85.8 | Confident | 77.4 | Confident | 90 Ų | 90 | 116.1 Ų | 116.1 | 47% | 0.471 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -63.6 | -46.2 | 176.7 | -170.2 | 68.2 | 0 | 0 | 0 | 111.4 | A9 L10 L15 L16 F17 | A9-L13 WeakPolarHBondContact O-CB 3.47Å; A9-L13 PolarHBondContact O-N 2.85Å; L10-L13 WeakPolarHBondContact O-CB 3.46Å; L10-L13 PolarHBondContact O-N 2.72Å; L10-L13 VanDerWaalsContact O-N 3.1Å; L13-L15 VanDerWaalsContact C-N 3.33Å; L13-L15 PolarHBondContact O-N 3.37Å; L13-L16 PolarHBondContact O-N 2.04Å; L13-F17 HydrophobicContact CD1-CD2 4.13Å; L13-F17 HydrophobicContact CD1-CE2 3.88Å; L13-F17 HydrophobicContact CG-CD2 4.05Å; L13-F17 HydrophobicContact CG-CE2 4.1Å; L13-F17 WeakPolarHBondContact O-CD2 3.45Å; L13-F17 PolarHBondContact O-N 3Å |
| 14 | D | 84.9 | Confident | 76.9 | Confident | 113 Ų | 113 | 116.3 Ų | 116.3 | 60% | 0.604 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -58.5 | -43.7 | 175.5 | -82.3 | -58.3 | 0 | 0 | 0 | 111.6 | L10 V11 L16 F17 Y18 | L10-D14 PolarHBondContact O-N 2.96Å; V11-D14 PolarHBondContact O-N 2.02Å; D14-L16 VanDerWaalsContact C-N 3.33Å; D14-L16 PolarHBondContact O-N 2.97Å; D14-F17 PolarHBondContact O-N 3.3Å; D14-Y18 VanDerWaalsContact O-CB 3.3Å; D14-Y18 WeakPolarHBondContact O-CB 3.32Å; D14-Y18 PolarHBondContact O-N 3.35Å |
| 15 | L | 82.7 | Confident | 76.7 | Confident | 118 Ų | 118 | 109.1 Ų | 109.1 | 62% | 0.618 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -64.2 | -34.5 | 176.6 | -74.1 | 167.3 | 0 | 0 | 0 | 113.1 | V11 V12 L13 | V11-L15 HydrophobicContact CG1-CD1 4.1Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.14Å; V11-L15 PolarHBondContact O-N 3.39Å; V12-L15 PolarHBondContact O-N 2.95Å; L13-L15 VanDerWaalsContact C-N 3.33Å; L13-L15 PolarHBondContact O-N 3.37Å |
| 16 | L | 77.2 | Confident | 76.3 | Confident | 118 Ų | 118 | 109.1 Ų | 109.1 | 62% | 0.618 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -73.2 | -32.1 | 175.6 | -72.2 | 169.9 | 0 | 0 | 0 | 112.6 | V12 L13 D14 V19 | V12-L16 HydrophobicContact CG1-CD1 4.12Å; V12-L16 VanDerWaalsContact O-CG 3.32Å; V12-L16 WeakPolarHBondContact O-CG 3.4Å; V12-L16 PolarHBondContact O-N 3.45Å; L13-L16 PolarHBondContact O-N 2.04Å; D14-L16 VanDerWaalsContact C-N 3.33Å; D14-L16 PolarHBondContact O-N 2.97Å; L16-V19 VanDerWaalsContact O-CG2 3.32Å; L16-V19 WeakPolarHBondContact O-CG2 3.02Å |
| 17 | F | 77.2 | Confident | 76 | Confident | 164 Ų | 164 | 109.3 Ų | 109.3 | 72% | 0.719 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -77.8 | -28.4 | 172.6 | -89.7 | -82.9 | 0 | 0 | 0 | 112.4 | L13 D14 V19 | L13-F17 HydrophobicContact CD1-CD2 4.13Å; L13-F17 HydrophobicContact CD1-CE2 3.88Å; L13-F17 HydrophobicContact CG-CD2 4.05Å; L13-F17 HydrophobicContact CG-CE2 4.1Å; L13-F17 WeakPolarHBondContact O-CD2 3.45Å; L13-F17 PolarHBondContact O-N 3Å; D14-F17 PolarHBondContact O-N 3.3Å; F17-V19 PolarHBondContact O-N 3.48Å |
| 18 | Y | 73 | Confident | 75.8 | Confident | 191 Ų | 191 | 109.9 Ų | 109.9 | 75% | 0.749 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | 30 | 173.5 | -151.1 | -93.7 | 0 | 0 | 0 | 112.3 | D14 P20 | D14-Y18 VanDerWaalsContact O-CB 3.3Å; D14-Y18 WeakPolarHBondContact O-CB 3.32Å; D14-Y18 PolarHBondContact O-N 3.35Å; Y18-P20 WeakPolarHBondContact O-CD 3.04Å; Y18-P20 VanDerWaalsContact O-N 3.13Å |
| 19 | V | 63.7 | Low | 75.5 | Confident | 105 Ų | 105 | 112.4 Ų | 112.4 | 64% | 0.636 | 61% | 0.612 | S | S | * | * | trans | -69.4 | 103.5 | 160.2 | 175.1 | 0 | 0 | 0 | 0 | 105.4 | L16 F17 | L16-V19 VanDerWaalsContact O-CG2 3.32Å; L16-V19 WeakPolarHBondContact O-CG2 3.02Å; F17-V19 PolarHBondContact O-N 3.48Å | ||
| 20 | P | 59.6 | Low | 75.1 | Confident | 91 Ų | 91 | 113.3 Ų | 113.3 | 59% | 0.591 | 61% | 0.608 | S | S | * | * | trans | -60.9 | 133.7 | 175.5 | 28.3 | -30.4 | 0 | 0 | 0 | 106 | Y18 G22 | Y18-P20 WeakPolarHBondContact O-CD 3.04Å; Y18-P20 VanDerWaalsContact O-N 3.13Å; P20-G22 PolarHBondContact O-N 2.03Å | ||
| 21 | P | 59.1 | Low | 74.8 | Confident | 124 Ų | 124 | 114.2 Ų | 114.2 | 81% | 0.805 | 61% | 0.61 | S | S | * | * | trans | -53.1 | 112.8 | 172.1 | 22.9 | -31.6 | 0 | 0 | 0 | 105.8 | R23 | P21-R23 PolarHBondContact O-N 2.98Š| ||
| 22 | G | 56.5 | Low | 74.4 | Confident | 51 Ų | 51 | 118.3 Ų | 118.3 | 53% | 0.526 | 62% | 0.621 | S | S | . | * | trans | -50.4 | 134 | -178.9 | 0 | 0 | 0 | 0 | 0 | 107.4 | P20 S24 | P20-G22 PolarHBondContact O-N 2.03Å; G22-S24 PolarHBondContact O-N 2.82Å | ||
| 23 | R | 59 | Low | 74.2 | Confident | 261 Ų | 261 | 119.2 Ų | 119.2 | 99% | 0.985 | 62% | 0.623 | S | S | * | * | S | Bend | trans | -56.4 | 2.7 | 177.6 | -78.2 | -168 | 179.8 | 166.6 | 0.4 | 114.3 | P21 G25 | P21-R23 PolarHBondContact O-N 2.98Å; R23-G25 PolarHBondContact O-N 3.29Å |
| 24 | S | 61.6 | Low | 74 | Confident | 110 Ų | 110 | 122.8 Ų | 122.8 | 77% | 0.769 | 64% | 0.635 | S | S | * | * | trans | -61.2 | 79.2 | 163.2 | -31.6 | 0 | 0 | 0 | 0 | 109.6 | G22 | G22-S24 PolarHBondContact O-N 2.82Š| ||
| 25 | G | 70.1 | Confident | 74.1 | Confident | 52 Ų | 52 | 119.2 Ų | 119.2 | 54% | 0.536 | 62% | 0.621 | S | S | . | * | P | Polyproline II helix | trans | -52.5 | 159.6 | 164.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | R23 N27 | R23-G25 PolarHBondContact O-N 3.29Å; G25-N27 PolarHBondContact O-N 3.15Å |
| 26 | P | 73.6 | Confident | 74.4 | Confident | 81 Ų | 81 | 115 Ų | 115 | 53% | 0.526 | 60% | 0.602 | S | S | . | * | P | Polyproline II helix | trans | -52.6 | 133.5 | -179.6 | 18.7 | -29.2 | 0 | 0 | 0 | 110.2 | I30 Q31 | P26-I30 HydrophobicContact CB-CB 4.47Å; P26-I30 HydrophobicContact CB-CG2 4.36Å; P26-Q31 HydrophobicContact CB-CG 4.26Å; P26-Q31 HydrophobicContact CG-CG 4.05Å; P26-Q31 PolarHBondContact O-NE2 3.08Å |
| 27 | N | 80.9 | Confident | 75 | Confident | 89 Ų | 89 | 110.1 Ų | 110.1 | 48% | 0.476 | 58% | 0.577 | S | S | . | * | P | Polyproline II helix | trans | -50.9 | 143.9 | 179.5 | -172 | -12.6 | 0 | 0 | 0 | 110.2 | G25 Y29 I30 Q31 | G25-N27 PolarHBondContact O-N 3.15Å; N27-Y29 PolarHBondContact O-N 3.22Å; N27-Y29 VanDerWaalsContact OD1-CD2 3.27Å; N27-Y29 WeakPolarHBondContact OD1-CD2 2.98Å; N27-I30 HydrophobicContact CB-CD1 4.04Å; N27-I30 HydrophobicContact CB-CG1 4.21Å; N27-I30 WeakPolarHBondContact O-CA 3.19Å; N27-I30 WeakPolarHBondContact O-CB 3.46Å; N27-I30 PolarHBondContact O-N 3.35Å; N27-Q31 PolarHBondContact O-N 3.13Å; N27-Q31 VanDerWaalsContact O-N 3.08Å |
| 28 | I | 81.2 | Confident | 75.6 | Confident | 118 Ų | 118 | 106.6 Ų | 106.6 | 61% | 0.605 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -51.4 | -32.5 | -179.3 | 62.9 | 157.7 | 0 | 0 | 0 | 112.4 | Q31 K32 | I28-Q31 PolarHBondContact O-N 3.33Å; I28-K32 WeakPolarHBondContact O-CB 3.44Å; I28-K32 PolarHBondContact O-N 2.65Å |
| 29 | Y | 81.6 | Confident | 76.2 | Confident | 171 Ų | 171 | 108.8 Ų | 108.8 | 67% | 0.671 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.6 | -40.1 | 177.2 | -63.2 | -76.3 | 0 | 0 | 0 | 112 | N27 K32 L33 | N27-Y29 PolarHBondContact O-N 3.22Å; N27-Y29 VanDerWaalsContact OD1-CD2 3.27Å; N27-Y29 WeakPolarHBondContact OD1-CD2 2.98Å; Y29-K32 PolarHBondContact O-N 3.06Å; Y29-L33 PolarHBondContact O-N 3.08Å |
| 30 | I | 82 | Confident | 77.3 | Confident | 80 Ų | 80 | 109.6 Ų | 109.6 | 41% | 0.41 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -69.1 | -43.9 | 178.3 | -59.6 | 172.1 | 0 | 0 | 0 | 109.6 | P26 N27 K32 L33 F34 | P26-I30 HydrophobicContact CB-CB 4.47Å; P26-I30 HydrophobicContact CB-CG2 4.36Å; N27-I30 HydrophobicContact CB-CD1 4.04Å; N27-I30 HydrophobicContact CB-CG1 4.21Å; N27-I30 WeakPolarHBondContact O-CA 3.19Å; N27-I30 WeakPolarHBondContact O-CB 3.46Å; N27-I30 PolarHBondContact O-N 3.35Å; I30-K32 VanDerWaalsContact C-N 3.28Å; I30-K32 PolarHBondContact O-N 2.95Å; I30-L33 WeakPolarHBondContact O-CB 3.03Å; I30-L33 PolarHBondContact O-N 3.39Å; I30-F34 HydrophobicContact CG2-CD2 3.83Å; I30-F34 HydrophobicContact CG2-CE2 3.53Å; I30-F34 WeakPolarHBondContact O-CD2 3.18Å; I30-F34 PolarHBondContact O-N 3.49Å; I30-F34 VanDerWaalsContact O-N 3.13Å |
| 31 | Q | 80.9 | Confident | 78.7 | Confident | 110 Ų | 110 | 112.2 Ų | 112.2 | 51% | 0.514 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -59.5 | -41.3 | 175.1 | -66.9 | -171.2 | -0.4 | 0 | 0 | 112 | P26 N27 I28 L33 F34 A35 | P26-Q31 HydrophobicContact CB-CG 4.26Å; P26-Q31 HydrophobicContact CG-CG 4.05Å; P26-Q31 PolarHBondContact O-NE2 3.08Å; N27-Q31 PolarHBondContact O-N 3.13Å; N27-Q31 VanDerWaalsContact O-N 3.08Å; I28-Q31 PolarHBondContact O-N 3.33Å; Q31-L33 VanDerWaalsContact C-N 3.3Å; Q31-L33 PolarHBondContact O-N 3.2Å; Q31-F34 PolarHBondContact O-N 3.18Å; Q31-A35 WeakPolarHBondContact O-CB 3.27Å; Q31-A35 PolarHBondContact O-N 3.37Å |
| 32 | K | 82.6 | Confident | 80.2 | Confident | 165 Ų | 165 | 106.5 Ų | 106.5 | 72% | 0.717 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66.3 | -33.6 | 179 | -151.5 | 172.6 | -170.2 | 176.2 | 0 | 112.2 | I28 Y29 I30 A35 S36 | I28-K32 WeakPolarHBondContact O-CB 3.44Å; I28-K32 PolarHBondContact O-N 2.65Å; Y29-K32 PolarHBondContact O-N 3.06Å; I30-K32 VanDerWaalsContact C-N 3.28Å; I30-K32 PolarHBondContact O-N 2.95Å; K32-A35 PolarHBondContact O-N 2.99Å; K32-S36 PolarHBondContact O-N 3.44Å |
| 33 | L | 84.2 | Confident | 81.9 | Confident | 101 Ų | 101 | 106.6 Ų | 106.6 | 53% | 0.529 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.8 | -48.8 | 173.6 | -172.4 | 69.8 | 0 | 0 | 0 | 111.2 | Y29 I30 Q31 A35 S36 L40 | Y29-L33 PolarHBondContact O-N 3.08Å; I30-L33 WeakPolarHBondContact O-CB 3.03Å; I30-L33 PolarHBondContact O-N 3.39Å; Q31-L33 VanDerWaalsContact C-N 3.3Å; Q31-L33 PolarHBondContact O-N 3.2Å; L33-A35 VanDerWaalsContact C-N 3.25Å; L33-A35 PolarHBondContact O-N 3.4Å; L33-S36 PolarHBondContact O-N 3.43Å; L33-S36 VanDerWaalsContact O-N 3.08Å; L33-S36 PolarHBondContact O-OG 2.85Å; L33-L40 HydrophobicContact CD1-CD2 3.55Å |
| 34 | F | 83.3 | Confident | 83.4 | Confident | 165 Ų | 165 | 95.2 Ų | 95.2 | 72% | 0.724 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -68.1 | -24.1 | 177 | -72.9 | -69.8 | 0 | 0 | 0 | 113.6 | I30 Q31 S36 | I30-F34 HydrophobicContact CG2-CD2 3.83Å; I30-F34 HydrophobicContact CG2-CE2 3.53Å; I30-F34 WeakPolarHBondContact O-CD2 3.18Å; I30-F34 PolarHBondContact O-N 3.49Å; I30-F34 VanDerWaalsContact O-N 3.13Å; Q31-F34 PolarHBondContact O-N 3.18Å; F34-S36 VanDerWaalsContact C-N 3.28Å |
| 35 | A | 86.3 | Confident | 84.9 | Confident | 39 Ų | 39 | 95.2 Ų | 95.2 | 32% | 0.322 | 46% | 0.464 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.2 | -2.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q31 K32 L33 C44 | Q31-A35 WeakPolarHBondContact O-CB 3.27Å; Q31-A35 PolarHBondContact O-N 3.37Å; K32-A35 PolarHBondContact O-N 2.99Å; L33-A35 VanDerWaalsContact C-N 3.25Å; L33-A35 PolarHBondContact O-N 3.4Å; A35-C44 WeakPolarHBondContact O-CB 3.42Å; A35-C44 PolarHBondContact O-N 3.49Å |
| 36 | S | 89.7 | Confident | 85.9 | Confident | 30 Ų | 30 | 99.5 Ų | 99.5 | 21% | 0.21 | 47% | 0.47 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.5 | 149.5 | 178 | 71.4 | 0 | 0 | 0 | 0 | 111 | K32 L33 F34 L40 G42 | K32-S36 PolarHBondContact O-N 3.44Å; L33-S36 PolarHBondContact O-N 3.43Å; L33-S36 VanDerWaalsContact O-N 3.08Å; L33-S36 PolarHBondContact O-OG 2.85Å; F34-S36 VanDerWaalsContact C-N 3.28Å; S36-L40 WeakPolarHBondContact OG-CD2 3.29Å; S36-G42 WeakPolarHBondContact CA-O 3.03Å |
| 37 | C | 89.1 | Confident | 86.7 | Confident | 15 Ų | 15 | 104.1 Ų | 104.1 | 10% | 0.101 | 48% | 0.482 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.6 | 176.7 | 180 | 64.8 | 0 | 0 | 0 | 0 | 110.1 | R39 L40 R41 G42 C64 | C37-R39 PolarHBondContact O-N 3.26Å; C37-L40 PolarHBondContact O-N 3.01Å; C37-L40 VanDerWaalsContact O-N 3.15Å; C37-R41 PolarHBondContact O-N 3.27Å; C37-G42 PolarHBondContact N-O 2.83Å; C37-G42 PolarHBondContact O-N 3.42Å; C37-C64 HydrophobicContact CB-CB 3.77Å; C37-C64 WeakPolarHBondContact CB-SG 3.27Å; C37-C64 WeakPolarHBondContact SG-CA 3.39Å; C37-C64 WeakPolarHBondContact SG-CB 3.31Å; C37-C64 CovalentContact SG-SG 2.02Å; C37-C64 PolarHBondContact SG-SG 2.95Å |
| 38 | W | 89 | Confident | 87.1 | Confident | 89 Ų | 89 | 101.7 Ų | 101.7 | 34% | 0.337 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.6 | 56.1 | 177.9 | -161 | -115.8 | 0 | 0 | 0 | 113.5 | L40 R41 H55 V66 H70 | W38-L40 VanDerWaalsContact C-N 3.32Å; W38-L40 PolarHBondContact O-N 2.73Å; W38-R41 VanDerWaalsContact O-CB 3.29Å; W38-R41 WeakPolarHBondContact O-CB 3.45Å; W38-R41 PolarHBondContact O-N 2.86Å; W38-H55 AromaticContact CD2-CD2 3.96Å; W38-H55 AromaticContact CE3-CD2 3.34Å; W38-H55 AromaticContact CE3-NE2 3.61Å; W38-H55 AromaticContact CH2-CD2 3.79Å; W38-H55 AromaticContact CH2-CE1 3.99Å; W38-H55 AromaticContact CH2-NE2 3.13Å; W38-H55 WeakPolarHBondContact CH2-NE2 3.46Å; W38-H55 AromaticContact CZ2-NE2 3.88Å; W38-H55 AromaticContact CZ3-CD2 3.26Å; W38-H55 WeakPolarHBondContact CZ3-CD2 2.96Å; W38-H55 AromaticContact CZ3-NE2 2.98Å; W38-H55 WeakPolarHBondContact CZ3-NE2 3.27Å; W38-V66 HydrophobicContact CB-CG2 3.65Å; W38-V66 HydrophobicContact CG-CG1 4.23Å; W38-V66 HydrophobicContact CG-CG2 3.9Å; W38-H70 PolarHBondContact NE1-O 3.03Å |
| 39 | R | 87.2 | Confident | 87.5 | Confident | 237 Ų | 237 | 100.6 Ų | 100.6 | 89% | 0.894 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.6 | 47 | -176.3 | -60.9 | -177.6 | 176.6 | -178.3 | -0.7 | 113.3 | C37 R41 | C37-R39 PolarHBondContact O-N 3.26Å; R39-R41 PolarHBondContact O-N 2.97Å |
| 40 | L | 86.7 | Confident | 87.7 | Confident | 122 Ų | 122 | 103.1 Ų | 103.1 | 64% | 0.639 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68 | 6.1 | -178.5 | -44.3 | 175.1 | 0 | 0 | 0 | 115.3 | L33 S36 C37 W38 | L33-L40 HydrophobicContact CD1-CD2 3.55Å; S36-L40 WeakPolarHBondContact OG-CD2 3.29Å; C37-L40 PolarHBondContact O-N 3.01Å; C37-L40 VanDerWaalsContact O-N 3.15Å; W38-L40 VanDerWaalsContact C-N 3.32Å; W38-L40 PolarHBondContact O-N 2.73Å |
| 41 | R | 88.4 | Confident | 87.9 | Confident | 147 Ų | 147 | 108 Ų | 108 | 56% | 0.555 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -9.3 | 178.5 | -60.1 | 178.8 | 172.8 | -146.7 | -3.3 | 113.1 | C37 W38 R39 H70 | C37-R41 PolarHBondContact O-N 3.27Å; W38-R41 VanDerWaalsContact O-CB 3.29Å; W38-R41 WeakPolarHBondContact O-CB 3.45Å; W38-R41 PolarHBondContact O-N 2.86Å; R39-R41 PolarHBondContact O-N 2.97Å; R41-H70 HydrophobicContact CB-CB 4.27Å |
| 42 | G | 90.1 | Very high | 88.3 | Confident | 4 Ų | 4 | 105.1 Ų | 105.1 | 4% | 0.041 | 49% | 0.485 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 167.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S36 C37 C65 | S36-G42 WeakPolarHBondContact CA-O 3.03Å; C37-G42 PolarHBondContact N-O 2.83Å; C37-G42 PolarHBondContact O-N 3.42Å; G42-C65 CarbonylContact C-O 3.54Å; G42-C65 WeakPolarHBondContact CA-O 3.32Å |
| 43 | S | 91.8 | Very high | 88.6 | Confident | 52 Ų | 52 | 102.1 Ų | 102.1 | 36% | 0.364 | 47% | 0.474 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.9 | 140.5 | 175 | -67.7 | 0 | 0 | 0 | 0 | 111 | R45 C65 | S43-R45 PolarHBondContact O-N 2.87Å; S43-C65 PolarHBondContact N-O 3.43Å; S43-C65 PolarHBondContact O-N 3.36Å |
| 44 | C | 92.1 | Very high | 88.9 | Confident | 22 Ų | 22 | 102.9 Ų | 102.9 | 15% | 0.149 | 47% | 0.47 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.4 | 117.1 | 175.2 | -59.8 | 0 | 0 | 0 | 0 | 110 | A35 C58 L63 | A35-C44 WeakPolarHBondContact O-CB 3.42Å; A35-C44 PolarHBondContact O-N 3.49Å; C44-C58 VanDerWaalsContact CA-SG 3.58Å; C44-C58 HydrophobicContact CB-CB 3.65Å; C44-C58 WeakPolarHBondContact CB-SG 3.3Å; C44-C58 WeakPolarHBondContact SG-CB 3.41Å; C44-C58 CovalentContact SG-SG 2.03Å; C44-C58 PolarHBondContact SG-SG 3.4Å; C44-L63 CarbonylContact C-O 3.55Å; C44-L63 WeakPolarHBondContact CA-O 3.32Å |
| 45 | R | 91.4 | Very high | 89 | Confident | 110 Ų | 110 | 98.3 Ų | 98.3 | 42% | 0.415 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134 | 159.4 | -179.6 | -60.7 | 179.5 | -178.7 | -95.1 | 0.1 | 109.9 | S43 K47 E52 R62 L63 | S43-R45 PolarHBondContact O-N 2.87Å; R45-K47 VanDerWaalsContact C-N 3.33Å; R45-K47 WeakPolarHBondContact CB-O 3.39Å; R45-E52 IonicContact NE-OE1 3.98Å; R45-E52 IonicContact NE-OE2 3.71Å; R45-R62 CarbonylContact O-C 3.57Å; R45-R62 WeakPolarHBondContact O-CA 3.02Å; R45-L63 PolarHBondContact N-O 2.99Å; R45-L63 PolarHBondContact O-N 3.22Å; R45-L63 VanDerWaalsContact O-O 3.14Å |
| 46 | Q | 91.4 | Very high | 89.1 | Confident | 143 Ų | 143 | 100.3 Ų | 100.3 | 67% | 0.668 | 46% | 0.455 | S | S | * | . | S | Bend | trans | -70 | -31.7 | 172.7 | -75.7 | -161 | -15.7 | 0 | 0 | 113.1 | L63 | Q46-L63 WeakPolarHBondContact O-CD1 3.45Š|
| 47 | K | 90.6 | Very high | 89.1 | Confident | 178 Ų | 178 | 103.5 Ų | 103.5 | 77% | 0.774 | 47% | 0.47 | S | S | * | . | S | Bend | trans | -140.2 | 140.5 | 173.2 | -74.3 | -174.8 | 177.2 | 178.8 | 0 | 109.3 | R45 | R45-K47 VanDerWaalsContact C-N 3.33Å; R45-K47 WeakPolarHBondContact CB-O 3.39Å |
| 48 | C | 90.1 | Very high | 89.1 | Confident | 37 Ų | 37 | 104.8 Ų | 104.8 | 25% | 0.25 | 48% | 0.478 | C | S | . | . | trans | -76.8 | 149.7 | 175 | -57.3 | 0 | 0 | 0 | 0 | 111.3 | E52 C65 | C48-E52 HydrophobicContact CB-CB 4.26Å; C48-C65 WeakPolarHBondContact CA-SG 3.07Å; C48-C65 HydrophobicContact CB-CB 3.7Å; C48-C65 WeakPolarHBondContact CB-SG 3.19Å; C48-C65 VanDerWaalsContact SG-CA 3.52Å; C48-C65 WeakPolarHBondContact SG-CB 3.37Å; C48-C65 CovalentContact SG-SG 2.04Å; C48-C65 PolarHBondContact SG-SG 3.43Å | ||
| 49 | L | 89.1 | Confident | 88.9 | Confident | 95 Ų | 95 | 105.1 Ų | 105.1 | 50% | 0.497 | 49% | 0.487 | S | S | . | . | trans | -71.7 | 157.2 | 172.8 | -73.8 | 146.2 | 0 | 0 | 0 | 110 | K51 E52 | L49-K51 PolarHBondContact O-N 3.17Å; L49-E52 HydrophobicContact CB-CG 4.26Å; L49-E52 PolarHBondContact N-OE2 2.81Å; L49-E52 PolarHBondContact O-N 2.97Å; L49-E52 VanDerWaalsContact O-O 3.09Å | ||
| 50 | K | 85 | Confident | 88.8 | Confident | 225 Ų | 225 | 100.4 Ų | 100.4 | 98% | 0.978 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.7 | -18.7 | 179 | -69 | -174 | 178.4 | -175.5 | 0 | 114.8 | ||
| 51 | K | 86.4 | Confident | 88.8 | Confident | 183 Ų | 183 | 98.6 Ų | 98.6 | 80% | 0.796 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.2 | -1.3 | 179.9 | -62 | -177.5 | 179.6 | -178.3 | 0 | 113.1 | L49 P68 | L49-K51 PolarHBondContact O-N 3.17Å; K51-P68 WeakPolarHBondContact O-CD 3.44Å |
| 52 | E | 89.3 | Confident | 88.9 | Confident | 49 Ų | 49 | 97.4 Ų | 97.4 | 23% | 0.229 | 47% | 0.474 | C | S | . | . | S | Bend | trans | -110.9 | 147.6 | 177.4 | -66.4 | 174.4 | 156.5 | 0 | 0 | 108.4 | R45 C48 L49 C65 V66 | R45-E52 IonicContact NE-OE1 3.98Å; R45-E52 IonicContact NE-OE2 3.71Å; C48-E52 HydrophobicContact CB-CB 4.26Å; L49-E52 HydrophobicContact CB-CG 4.26Å; L49-E52 PolarHBondContact N-OE2 2.81Å; L49-E52 PolarHBondContact O-N 2.97Å; L49-E52 VanDerWaalsContact O-O 3.09Å; E52-C65 HydrophobicContact CB-CB 4.04Å; E52-C65 VanDerWaalsContact OE2-CB 3.27Å; E52-C65 WeakPolarHBondContact OE2-CB 3.31Å; E52-V66 WeakPolarHBondContact CA-O 3.36Å |
| 53 | E | 89.6 | Confident | 89 | Confident | 101 Ų | 101 | 99.3 Ų | 99.3 | 47% | 0.472 | 48% | 0.483 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.6 | 141.9 | 177.3 | -163 | 164.2 | -169.6 | 0 | 0 | 109.8 | V66 L71 | E53-V66 PolarHBondContact N-O 3.22Å; E53-V66 PolarHBondContact O-N 3.48Å; E53-L71 HydrophobicContact CB-CD1 3.91Å |
| 54 | Y | 90.1 | Very high | 89.1 | Confident | 118 Ų | 118 | 96.9 Ų | 96.9 | 46% | 0.463 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.4 | 129.4 | 173.4 | 164.4 | -103.8 | 0 | 0 | 0 | 109.2 | I56 L63 | Y54-I56 VanDerWaalsContact CE2-C 3.46Å; Y54-I56 VanDerWaalsContact CE2-O 3.3Å; Y54-I56 WeakPolarHBondContact CE2-O 3.4Å; Y54-L63 HydrophobicContact CD2-CB 3.96Å; Y54-L63 HydrophobicContact CD2-CD2 3.62Å; Y54-L63 HydrophobicContact CD2-CG 4.24Å; Y54-L63 HydrophobicContact CE2-CB 4.26Å; Y54-L63 HydrophobicContact CE2-CD2 3.35Å; Y54-L63 HydrophobicContact CE2-CG 4.35Å |
| 55 | H | 85.1 | Confident | 89.1 | Confident | 68 Ų | 68 | 95.8 Ų | 95.8 | 32% | 0.315 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | -55.9 | 176.5 | -160.3 | 54.4 | 0 | 0 | 0 | 113.3 | W38 C64 V66 L71 | W38-H55 AromaticContact CD2-CD2 3.96Å; W38-H55 AromaticContact CE3-CD2 3.34Å; W38-H55 AromaticContact CE3-NE2 3.61Å; W38-H55 AromaticContact CH2-CD2 3.79Å; W38-H55 AromaticContact CH2-CE1 3.99Å; W38-H55 AromaticContact CH2-NE2 3.13Å; W38-H55 WeakPolarHBondContact CH2-NE2 3.46Å; W38-H55 AromaticContact CZ2-NE2 3.88Å; W38-H55 AromaticContact CZ3-CD2 3.26Å; W38-H55 WeakPolarHBondContact CZ3-CD2 2.96Å; W38-H55 AromaticContact CZ3-NE2 2.98Å; W38-H55 WeakPolarHBondContact CZ3-NE2 3.27Å; H55-C64 PolarHBondContact N-O 3.02Å; H55-C64 VanDerWaalsContact N-O 3.13Å; H55-V66 HydrophobicContact CB-CG2 4.21Å; H55-L71 WeakPolarHBondContact ND1-CD2 3.31Å |
| 56 | I | 88.9 | Confident | 89.1 | Confident | 81 Ų | 81 | 90.6 Ų | 90.6 | 42% | 0.415 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.2 | 167.2 | -177.4 | 60.9 | 172.3 | 0 | 0 | 0 | 111 | Y54 C64 | Y54-I56 VanDerWaalsContact CE2-C 3.46Å; Y54-I56 VanDerWaalsContact CE2-O 3.3Å; Y54-I56 WeakPolarHBondContact CE2-O 3.4Å; I56-C64 HydrophobicContact CG1-CB 3.54Å; I56-C64 WeakPolarHBondContact O-CA 3.4Å; I56-C64 WeakPolarHBondContact O-CB 3.44Å; I56-C64 PolarHBondContact O-N 3.1Å |
| 57 | L | 89.7 | Confident | 89 | Confident | 98 Ų | 98 | 86.5 Ų | 86.5 | 51% | 0.513 | 42% | 0.422 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.2 | 131.7 | 168.7 | -75.3 | 158.2 | 0 | 0 | 0 | 110 | L63 | L57-L63 HydrophobicContact CD2-CD2 3.49Å; L57-L63 VanDerWaalsContact CD2-CD2 3.49Å; L57-L63 HydrophobicContact CD2-CG 4.49Å; L57-L63 HydrophobicContact CG-CD2 4.33Å |
| 58 | C | 88.2 | Confident | 88.8 | Confident | 42 Ų | 42 | 81 Ų | 81 | 28% | 0.284 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -82.3 | -31.6 | 170.7 | -63.7 | 0 | 0 | 0 | 0 | 112.2 | C44 R62 | C44-C58 VanDerWaalsContact CA-SG 3.58Å; C44-C58 HydrophobicContact CB-CB 3.65Å; C44-C58 WeakPolarHBondContact CB-SG 3.3Å; C44-C58 WeakPolarHBondContact SG-CB 3.41Å; C44-C58 CovalentContact SG-SG 2.03Å; C44-C58 PolarHBondContact SG-SG 3.4Å; C58-R62 HydrophobicContact CB-CB 4.27Å; C58-R62 PolarHBondContact N-O 3.03Å |
| 59 | D | 84.9 | Confident | 88.5 | Confident | 96 Ų | 96 | 87 Ų | 87 | 51% | 0.513 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -154.5 | -174 | -176.3 | -105.5 | -33.2 | 0 | 0 | 0 | 108.6 | T61 R62 | D59-T61 PolarHBondContact O-N 2.98Å; D59-R62 HydrophobicContact CB-CB 4.26Å; D59-R62 PolarHBondContact N-O 3.47Å |
| 60 | T | 85.3 | Confident | 88.1 | Confident | 137 Ų | 137 | 86.2 Ų | 86.2 | 84% | 0.84 | 42% | 0.422 | S | S | * | . | S | Bend | trans | -59.5 | -27.8 | 177.6 | 53.7 | 0 | 0 | 0 | 0 | 114.5 | ||
| 61 | T | 87.6 | Confident | 88 | Confident | 85 Ų | 85 | 76.7 Ų | 76.7 | 52% | 0.521 | 38% | 0.382 | S | S | . | . | S | Bend | trans | -127.4 | -4.6 | -175.2 | 58.9 | 0 | 0 | 0 | 0 | 114.3 | D59 | D59-T61 PolarHBondContact O-N 2.98Š|
| 62 | R | 90.9 | Very high | 87.6 | Confident | 121 Ų | 121 | 72.2 Ų | 72.2 | 46% | 0.457 | 37% | 0.372 | S | S | . | . | trans | -112.4 | 130.7 | -175.1 | -63.1 | 177.9 | -179.9 | 170.6 | -0.8 | 110.3 | R45 C58 D59 | R45-R62 CarbonylContact O-C 3.57Å; R45-R62 WeakPolarHBondContact O-CA 3.02Å; C58-R62 HydrophobicContact CB-CB 4.27Å; C58-R62 PolarHBondContact N-O 3.03Å; D59-R62 HydrophobicContact CB-CB 4.26Å; D59-R62 PolarHBondContact N-O 3.47Å | ||
| 63 | L | 92.1 | Very high | 86.9 | Confident | 45 Ų | 45 | 77.1 Ų | 77.1 | 24% | 0.236 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 138.9 | 177.9 | -57.8 | 169.1 | 0 | 0 | 0 | 109.5 | C44 R45 Q46 Y54 L57 C65 | C44-L63 CarbonylContact C-O 3.55Å; C44-L63 WeakPolarHBondContact CA-O 3.32Å; R45-L63 PolarHBondContact N-O 2.99Å; R45-L63 PolarHBondContact O-N 3.22Å; R45-L63 VanDerWaalsContact O-O 3.14Å; Q46-L63 WeakPolarHBondContact O-CD1 3.45Å; Y54-L63 HydrophobicContact CD2-CB 3.96Å; Y54-L63 HydrophobicContact CD2-CD2 3.62Å; Y54-L63 HydrophobicContact CD2-CG 4.24Å; Y54-L63 HydrophobicContact CE2-CB 4.26Å; Y54-L63 HydrophobicContact CE2-CD2 3.35Å; Y54-L63 HydrophobicContact CE2-CG 4.35Å; L57-L63 HydrophobicContact CD2-CD2 3.49Å; L57-L63 VanDerWaalsContact CD2-CD2 3.49Å; L57-L63 HydrophobicContact CD2-CG 4.49Å; L57-L63 HydrophobicContact CG-CD2 4.33Å; L63-C65 PolarHBondContact O-N 3.41Å |
| 64 | C | 92.4 | Very high | 85.7 | Confident | 0 Ų | 0 | 79.9 Ų | 79.9 | 0% | 0 | 42% | 0.415 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | 112.6 | 166.7 | 177.1 | 0 | 0 | 0 | 0 | 108.9 | C37 H55 I56 | C37-C64 HydrophobicContact CB-CB 3.77Å; C37-C64 WeakPolarHBondContact CB-SG 3.27Å; C37-C64 WeakPolarHBondContact SG-CA 3.39Å; C37-C64 WeakPolarHBondContact SG-CB 3.31Å; C37-C64 CovalentContact SG-SG 2.02Å; C37-C64 PolarHBondContact SG-SG 2.95Å; H55-C64 PolarHBondContact N-O 3.02Å; H55-C64 VanDerWaalsContact N-O 3.13Å; I56-C64 HydrophobicContact CG1-CB 3.54Å; I56-C64 WeakPolarHBondContact O-CA 3.4Å; I56-C64 WeakPolarHBondContact O-CB 3.44Å; I56-C64 PolarHBondContact O-N 3.1Å |
| 65 | C | 92.8 | Very high | 83.8 | Confident | 0 Ų | 0 | 80.7 Ų | 80.7 | 0% | 0 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.6 | 121.9 | 179.5 | -53.4 | 0 | 0 | 0 | 0 | 108.9 | G42 S43 C48 E52 L63 | G42-C65 CarbonylContact C-O 3.54Å; G42-C65 WeakPolarHBondContact CA-O 3.32Å; S43-C65 PolarHBondContact N-O 3.43Å; S43-C65 PolarHBondContact O-N 3.36Å; C48-C65 WeakPolarHBondContact CA-SG 3.07Å; C48-C65 HydrophobicContact CB-CB 3.7Å; C48-C65 WeakPolarHBondContact CB-SG 3.19Å; C48-C65 VanDerWaalsContact SG-CA 3.52Å; C48-C65 WeakPolarHBondContact SG-CB 3.37Å; C48-C65 CovalentContact SG-SG 2.04Å; C48-C65 PolarHBondContact SG-SG 3.43Å; E52-C65 HydrophobicContact CB-CB 4.04Å; E52-C65 VanDerWaalsContact OE2-CB 3.27Å; E52-C65 WeakPolarHBondContact OE2-CB 3.31Å; L63-C65 PolarHBondContact O-N 3.41Å |
| 66 | V | 92 | Very high | 81.8 | Confident | 0 Ų | 0 | 84.3 Ų | 84.3 | 0% | 0 | 49% | 0.488 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.9 | 141.9 | -176.1 | -173.2 | 0 | 0 | 0 | 0 | 108.7 | W38 E52 E53 H55 H70 L71 | W38-V66 HydrophobicContact CB-CG2 3.65Å; W38-V66 HydrophobicContact CG-CG1 4.23Å; W38-V66 HydrophobicContact CG-CG2 3.9Å; E52-V66 WeakPolarHBondContact CA-O 3.36Å; E53-V66 PolarHBondContact N-O 3.22Å; E53-V66 PolarHBondContact O-N 3.48Å; H55-V66 HydrophobicContact CB-CG2 4.21Å; V66-H70 HydrophobicContact CG1-CB 4.17Å; V66-L71 HydrophobicContact CB-CD1 3.98Å; V66-L71 HydrophobicContact CB-CG 4.34Å; V66-L71 HydrophobicContact CG1-CD1 4.09Å; V66-L71 HydrophobicContact CG1-CG 4.05Å |
| 67 | N | 89.3 | Confident | 81.4 | Confident | 58 Ų | 58 | 84.5 Ų | 84.5 | 31% | 0.31 | 49% | 0.492 | S | S | . | . | trans | -69.5 | 129.6 | 172.6 | -177.6 | -34.9 | 0 | 0 | 0 | 109.4 | Q69 H70 | N67-Q69 PolarHBondContact O-N 2.96Å; N67-Q69 WeakPolarHBondContact OD1-CB 3.46Å; N67-Q69 WeakPolarHBondContact OD1-CG 3.31Å; N67-Q69 PolarHBondContact OD1-N 3.39Å; N67-H70 WeakPolarHBondContact O-CB 3.48Å; N67-H70 PolarHBondContact O-N 3.35Å | ||
| 68 | P | 85.4 | Confident | 81 | Confident | 62 Ų | 62 | 83.8 Ų | 83.8 | 40% | 0.403 | 49% | 0.491 | S | S | . | . | G | 310 helix | trans | -54 | -27.2 | -177.9 | 21.3 | -34 | 0 | 0 | 0 | 113.9 | K51 H70 L71 | K51-P68 WeakPolarHBondContact O-CD 3.44Å; P68-H70 PolarHBondContact O-N 3.03Å; P68-H70 VanDerWaalsContact O-N 3.16Å; P68-L71 PolarHBondContact O-N 3.49Å; P68-L71 VanDerWaalsContact O-N 3.13Å |
| 69 | Q | 83.8 | Confident | 80.6 | Confident | 162 Ų | 162 | 86.1 Ų | 86.1 | 76% | 0.757 | 50% | 0.503 | S | S | * | . | G | 310 helix | trans | -62.4 | -21.9 | 175.4 | -63.7 | 174.6 | 2.9 | 0 | 0 | 113.9 | N67 | N67-Q69 PolarHBondContact O-N 2.96Å; N67-Q69 WeakPolarHBondContact OD1-CB 3.46Å; N67-Q69 WeakPolarHBondContact OD1-CG 3.31Å; N67-Q69 PolarHBondContact OD1-N 3.39Å |
| 70 | H | 82.4 | Confident | 80.3 | Confident | 79 Ų | 79 | 85.5 Ų | 85.5 | 37% | 0.366 | 50% | 0.502 | S | S | . | . | G | 310 helix | trans | -101 | -4.9 | -179.4 | -62.2 | 79.4 | 0 | 0 | 0 | 112.6 | W38 R41 V66 N67 P68 | W38-H70 PolarHBondContact NE1-O 3.03Å; R41-H70 HydrophobicContact CB-CB 4.27Å; V66-H70 HydrophobicContact CG1-CB 4.17Å; N67-H70 WeakPolarHBondContact O-CB 3.48Å; N67-H70 PolarHBondContact O-N 3.35Å; P68-H70 PolarHBondContact O-N 3.03Å; P68-H70 VanDerWaalsContact O-N 3.16Å |
| 71 | L | 81.2 | Confident | 80 | Confident | 25 Ų | 25 | 82.3 Ų | 82.3 | 13% | 0.131 | 48% | 0.481 | C | S | . | . | S | Bend | trans | -86.5 | 144 | 172.4 | -78.2 | 143.3 | 0 | 0 | 0 | 108.4 | E53 H55 V66 P68 I73 | E53-L71 HydrophobicContact CB-CD1 3.91Å; H55-L71 WeakPolarHBondContact ND1-CD2 3.31Å; V66-L71 HydrophobicContact CB-CD1 3.98Å; V66-L71 HydrophobicContact CB-CG 4.34Å; V66-L71 HydrophobicContact CG1-CD1 4.09Å; V66-L71 HydrophobicContact CG1-CG 4.05Å; P68-L71 PolarHBondContact O-N 3.49Å; P68-L71 VanDerWaalsContact O-N 3.13Å; L71-I73 PolarHBondContact O-N 3.42Å |
| 72 | P | 79.7 | Confident | 79.5 | Confident | 89 Ų | 89 | 82.1 Ų | 82.1 | 58% | 0.578 | 48% | 0.478 | S | S | * | . | trans | -60.4 | 140.4 | 170.1 | 26.8 | -32 | 0 | 0 | 0 | 108.8 | L74 | P72-L74 PolarHBondContact O-N 3.16Š| ||
| 73 | I | 73.2 | Confident | 78.7 | Confident | 153 Ų | 153 | 79.4 Ų | 79.4 | 79% | 0.785 | 48% | 0.48 | S | S | * | . | trans | -60.7 | 112.1 | 172.3 | -53.7 | 165.7 | 0 | 0 | 0 | 105.9 | L71 T75 | L71-I73 PolarHBondContact O-N 3.42Å; I73-T75 HydrophobicContact CG2-CG2 4.29Å; I73-T75 PolarHBondContact O-N 3.03Å | ||
| 74 | L | 65.4 | Low | 77.6 | Confident | 159 Ų | 159 | 82 Ų | 82 | 83% | 0.832 | 50% | 0.498 | S | S | * | . | trans | -68.5 | 85.8 | 171.5 | -74.7 | 161 | 0 | 0 | 0 | 107.3 | P72 G76 | P72-L74 PolarHBondContact O-N 3.16Å; L74-G76 VanDerWaalsContact C-N 3.35Å; L74-G76 PolarHBondContact O-N 3.39Å; L74-G76 VanDerWaalsContact O-N 3.14Å | ||
| 75 | T | 50.3 | Low | 76.4 | Confident | 134 Ų | 134 | 88.8 Ų | 88.8 | 82% | 0.822 | 54% | 0.54 | S | S | * | . | trans | -73.2 | 93.3 | 163.4 | 46.5 | 0 | 0 | 0 | 0 | 107.5 | I73 | I73-T75 HydrophobicContact CG2-CG2 4.29Å; I73-T75 PolarHBondContact O-N 3.03Å | ||
| 76 | G | 41.3 | Very low | 74.9 | Confident | 145 Ų | 145 | 96.9 Ų | 96.9 | 100% | 1.495 | 59% | 0.589 | S | S | * | * | trans | -122.3 | 0 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | L74 | L74-G76 VanDerWaalsContact C-N 3.35Å; L74-G76 PolarHBondContact O-N 3.39Å; L74-G76 VanDerWaalsContact O-N 3.14Å |
Retrieved 76 of 76 residues in 41.7 ms
(Link to these results)