| 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 | 58.2 | Low | 75.2 | Confident | 192 Ų | 192 | 138.5 Ų | 138.5 | 95% | 0.946 | 65% | 0.653 | S | S | * | * | 0 | -36.6 | 0 | -60 | -46.4 | -168.6 | 0 | 0 | 115 | Y5 | M1-Y5 WeakPolarHBondContact O-CD2 3.46Å; M1-Y5 WeakPolarHBondContact O-CE2 3.45Å | |||
| 2 | R | 65.6 | Low | 75.1 | Confident | 221 Ų | 221 | 134.2 Ų | 134.2 | 83% | 0.834 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -71.9 | -31.3 | -178 | -77.2 | -176.8 | 167.2 | 175.2 | -3.6 | 115.9 | H4 Y5 L6 | R2-H4 PolarHBondContact O-N 3.34Å; R2-Y5 PolarHBondContact O-N 3.2Å; R2-L6 PolarHBondContact O-N 3.3Å |
| 3 | L | 75.9 | Confident | 75 | Confident | 134 Ų | 134 | 135 Ų | 135 | 70% | 0.702 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -65.3 | -35.6 | -175.7 | -154.1 | 83 | 0 | 0 | 0 | 113.2 | Y5 L6 L7 | L3-Y5 VanDerWaalsContact C-N 3.32Å; L3-Y5 PolarHBondContact O-N 3.32Å; L3-L6 PolarHBondContact O-N 2.84Å; L3-L7 PolarHBondContact O-N 2.9Å |
| 4 | H | 76.3 | Confident | 74.5 | Confident | 139 Ų | 139 | 137.5 Ų | 137.5 | 64% | 0.644 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -65.5 | -35.8 | 179.2 | -62.2 | 92.1 | 0 | 0 | 0 | 111.9 | R2 L7 F8 | R2-H4 PolarHBondContact O-N 3.34Å; H4-L7 PolarHBondContact O-N 3.32Å; H4-F8 VanDerWaalsContact O-CB 3.29Å; H4-F8 WeakPolarHBondContact O-CB 3.43Å; H4-F8 PolarHBondContact O-N 2.92Å |
| 5 | Y | 76.4 | Confident | 73.9 | Confident | 179 Ų | 179 | 136.9 Ų | 136.9 | 70% | 0.702 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -67 | -37.8 | 175.4 | -66.6 | -77.9 | 0 | 0 | 0 | 112.2 | M1 R2 L3 F8 A9 | M1-Y5 WeakPolarHBondContact O-CD2 3.46Å; M1-Y5 WeakPolarHBondContact O-CE2 3.45Å; R2-Y5 PolarHBondContact O-N 3.2Å; L3-Y5 VanDerWaalsContact C-N 3.32Å; L3-Y5 PolarHBondContact O-N 3.32Å; Y5-F8 PolarHBondContact O-N 2.71Å; Y5-A9 VanDerWaalsContact O-CB 3.31Å; Y5-A9 WeakPolarHBondContact O-CB 3.05Å; Y5-A9 PolarHBondContact O-N 3.32Å |
| 6 | L | 79.1 | Confident | 73.3 | Confident | 120 Ų | 120 | 133.5 Ų | 133.5 | 63% | 0.628 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -66 | -45.1 | 175.3 | -75.3 | 166.8 | 0 | 0 | 0 | 111.3 | R2 L3 F8 A9 F10 | R2-L6 PolarHBondContact O-N 3.3Å; L3-L6 PolarHBondContact O-N 2.84Å; L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 PolarHBondContact O-N 3.1Å; L6-A9 PolarHBondContact O-N 3.43Å; L6-F10 WeakPolarHBondContact O-CB 3.27Å; L6-F10 PolarHBondContact O-N 3.15Å |
| 7 | L | 81.4 | Confident | 72.5 | Confident | 120 Ų | 120 | 132.2 Ų | 132.2 | 63% | 0.628 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -60.7 | -44.5 | 177 | -157.8 | 96 | 0 | 0 | 0 | 110.9 | L3 H4 F10 L11 | L3-L7 PolarHBondContact O-N 2.9Å; H4-L7 PolarHBondContact O-N 3.32Å; L7-F10 PolarHBondContact O-N 3.14Å; L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 PolarHBondContact O-N 2.03Å |
| 8 | F | 78.1 | Confident | 71.8 | Confident | 141 Ų | 141 | 128.3 Ų | 128.3 | 62% | 0.618 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -66.5 | -40.6 | 179.6 | -151.5 | -96.5 | 0 | 0 | 0 | 112 | H4 Y5 L6 F10 L11 I12 | H4-F8 VanDerWaalsContact O-CB 3.29Å; H4-F8 WeakPolarHBondContact O-CB 3.43Å; H4-F8 PolarHBondContact O-N 2.92Å; Y5-F8 PolarHBondContact O-N 2.71Å; L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 PolarHBondContact O-N 3.1Å; F8-F10 VanDerWaalsContact C-N 3.35Å; F8-F10 PolarHBondContact O-N 3.39Å; F8-L11 PolarHBondContact O-N 2.88Å; F8-I12 HydrophobicContact CD1-CD1 3.57Å; F8-I12 HydrophobicContact CD1-CG1 4.2Å; F8-I12 HydrophobicContact CE1-CD1 3.74Å; F8-I12 HydrophobicContact CE1-CG1 4.3Å; F8-I12 VanDerWaalsContact O-CG1 3.29Å; F8-I12 WeakPolarHBondContact O-CG1 3.05Å; F8-I12 PolarHBondContact O-N 2.03Å |
| 9 | A | 80.3 | Confident | 70.9 | Confident | 48 Ų | 48 | 128.1 Ų | 128.1 | 40% | 0.397 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -62.3 | -41.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | Y5 L6 L11 I12 L13 | Y5-A9 VanDerWaalsContact O-CB 3.31Å; Y5-A9 WeakPolarHBondContact O-CB 3.05Å; Y5-A9 PolarHBondContact O-N 3.32Å; L6-A9 PolarHBondContact O-N 3.43Å; A9-L11 VanDerWaalsContact C-N 3.33Å; A9-I12 PolarHBondContact O-N 2.83Å; A9-L13 WeakPolarHBondContact O-CB 3.31Å; A9-L13 PolarHBondContact O-N 2.81Å |
| 10 | F | 79.1 | Confident | 70.2 | Confident | 138 Ų | 138 | 123.5 Ų | 123.5 | 61% | 0.605 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -63.9 | -41.1 | 176.9 | -145 | -90 | 0 | 0 | 0 | 111.6 | L6 L7 F8 L13 F14 | L6-F10 WeakPolarHBondContact O-CB 3.27Å; L6-F10 PolarHBondContact O-N 3.15Å; L7-F10 PolarHBondContact O-N 3.14Å; F8-F10 VanDerWaalsContact C-N 3.35Å; F8-F10 PolarHBondContact O-N 3.39Å; F10-L13 PolarHBondContact O-N 3.41Å; F10-F14 AromaticContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CE2 4.13Å; F10-F14 AromaticContact CE1-CD2 3.64Å; F10-F14 HydrophobicContact CE1-CD2 3.64Å; F10-F14 AromaticContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CE2 3.43Å; F10-F14 VanDerWaalsContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CZ 4.48Å; F10-F14 HydrophobicContact CZ-CD2 4.48Å; F10-F14 AromaticContact CZ-CE2 3.99Å; F10-F14 HydrophobicContact CZ-CE2 3.99Å; F10-F14 PolarHBondContact O-N 3.14Å |
| 11 | L | 76.9 | Confident | 69.8 | Low | 92 Ų | 92 | 122.6 Ų | 122.6 | 48% | 0.482 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -65.9 | -42.7 | 178.2 | -145.5 | 150.5 | 0 | 0 | 0 | 110.7 | L7 F8 A9 L13 F14 L15 | L7-L11 WeakPolarHBondContact O-CB 3.37Å; L7-L11 PolarHBondContact O-N 2.03Å; F8-L11 PolarHBondContact O-N 2.88Å; A9-L11 VanDerWaalsContact C-N 3.33Å; L11-L13 PolarHBondContact O-N 3.49Å; L11-F14 PolarHBondContact O-N 2.94Å; L11-L15 HydrophobicContact CD2-CB 4.24Å; L11-L15 HydrophobicContact CD2-CD2 3.82Å; L11-L15 HydrophobicContact CD2-CG 4.49Å; L11-L15 WeakPolarHBondContact O-CA 3Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 PolarHBondContact O-N 3.41Å |
| 12 | I | 73.6 | Confident | 70.2 | Confident | 86 Ų | 86 | 116 Ų | 116 | 44% | 0.441 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -62.5 | -43.1 | 173.9 | -66.4 | 167.8 | 0 | 0 | 0 | 111.1 | F8 A9 F14 L15 V16 | F8-I12 HydrophobicContact CD1-CD1 3.57Å; F8-I12 HydrophobicContact CD1-CG1 4.2Å; F8-I12 HydrophobicContact CE1-CD1 3.74Å; F8-I12 HydrophobicContact CE1-CG1 4.3Å; F8-I12 VanDerWaalsContact O-CG1 3.29Å; F8-I12 WeakPolarHBondContact O-CG1 3.05Å; F8-I12 PolarHBondContact O-N 2.03Å; A9-I12 PolarHBondContact O-N 2.83Å; I12-F14 VanDerWaalsContact C-N 3.34Å; I12-F14 PolarHBondContact O-N 2.74Å; I12-L15 PolarHBondContact O-N 2.91Å; I12-V16 HydrophobicContact CG2-CG2 3.76Å; I12-V16 VanDerWaalsContact O-CB 3.25Å; I12-V16 WeakPolarHBondContact O-CB 3.09Å; I12-V16 WeakPolarHBondContact O-CG2 2.96Å; I12-V16 PolarHBondContact O-N 2.03Å |
| 13 | L | 73.8 | Confident | 70.5 | Confident | 145 Ų | 145 | 112.6 Ų | 112.6 | 76% | 0.759 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -63.9 | -37.7 | -179.5 | -116.7 | 141.4 | 0 | 0 | 0 | 113.2 | A9 F10 L11 | A9-L13 WeakPolarHBondContact O-CB 3.31Å; A9-L13 PolarHBondContact O-N 2.81Å; F10-L13 PolarHBondContact O-N 3.41Å; L11-L13 PolarHBondContact O-N 3.49Å |
| 14 | F | 67.9 | Low | 70.6 | Confident | 170 Ų | 170 | 110.9 Ų | 110.9 | 75% | 0.746 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -83.7 | -32.6 | 177.7 | -98.7 | -91.1 | 0 | 0 | 0 | 113.5 | F10 L11 I12 | F10-F14 AromaticContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CD2 3.84Å; F10-F14 HydrophobicContact CD1-CE2 4.13Å; F10-F14 AromaticContact CE1-CD2 3.64Å; F10-F14 HydrophobicContact CE1-CD2 3.64Å; F10-F14 AromaticContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CE2 3.43Å; F10-F14 VanDerWaalsContact CE1-CE2 3.43Å; F10-F14 HydrophobicContact CE1-CZ 4.48Å; F10-F14 HydrophobicContact CZ-CD2 4.48Å; F10-F14 AromaticContact CZ-CE2 3.99Å; F10-F14 HydrophobicContact CZ-CE2 3.99Å; F10-F14 PolarHBondContact O-N 3.14Å; L11-F14 PolarHBondContact O-N 2.94Å; I12-F14 VanDerWaalsContact C-N 3.34Å; I12-F14 PolarHBondContact O-N 2.74Å |
| 15 | L | 66.5 | Low | 70.6 | Confident | 129 Ų | 129 | 110.2 Ų | 110.2 | 68% | 0.675 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -88.4 | -22.3 | -173.8 | -156.9 | 76.1 | 0 | 0 | 0 | 112.6 | L11 I12 P17 | L11-L15 HydrophobicContact CD2-CB 4.24Å; L11-L15 HydrophobicContact CD2-CD2 3.82Å; L11-L15 HydrophobicContact CD2-CG 4.49Å; L11-L15 WeakPolarHBondContact O-CA 3Å; L11-L15 WeakPolarHBondContact O-CB 3.29Å; L11-L15 PolarHBondContact O-N 3.41Å; I12-L15 PolarHBondContact O-N 2.91Å; L15-P17 WeakPolarHBondContact O-CD 3.01Å |
| 16 | V | 64.3 | Low | 70.7 | Confident | 82 Ų | 82 | 105.7 Ų | 105.7 | 50% | 0.497 | 57% | 0.569 | S | S | . | * | S | Bend | trans | -79.2 | 107.6 | 172.8 | 178.6 | 0 | 0 | 0 | 0 | 108.2 | I12 A18 | I12-V16 HydrophobicContact CG2-CG2 3.76Å; I12-V16 VanDerWaalsContact O-CB 3.25Å; I12-V16 WeakPolarHBondContact O-CB 3.09Å; I12-V16 WeakPolarHBondContact O-CG2 2.96Å; I12-V16 PolarHBondContact O-N 2.03Å; V16-A18 PolarHBondContact O-N 2.89Å |
| 17 | P | 58.8 | Low | 70.9 | Confident | 111 Ų | 111 | 103.4 Ų | 103.4 | 72% | 0.721 | 56% | 0.56 | S | S | * | * | trans | -63 | 113.9 | 175.5 | 26.2 | -31.6 | 0 | 0 | 0 | 107.5 | L15 P19 | L15-P17 WeakPolarHBondContact O-CD 3.01Å; P17-P19 WeakPolarHBondContact O-CD 3.3Å | ||
| 18 | A | 60.9 | Low | 71.1 | Confident | 62 Ų | 62 | 102.5 Ų | 102.5 | 51% | 0.512 | 56% | 0.555 | S | S | . | * | trans | -47.2 | 108.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | V16 G20 | V16-A18 PolarHBondContact O-N 2.89Å; A18-G20 PolarHBondContact O-N 2.94Å | ||
| 19 | P | 54.5 | Low | 71.5 | Confident | 125 Ų | 125 | 98.9 Ų | 98.9 | 81% | 0.812 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | 0.1 | -168.9 | 26 | -31 | 0 | 0 | 0 | 113 | P17 | P17-P19 WeakPolarHBondContact O-CD 3.3Š|
| 20 | G | 56.8 | Low | 71.8 | Confident | 35 Ų | 35 | 101.2 Ų | 101.2 | 36% | 0.361 | 54% | 0.541 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88 | -18.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | A18 A22 F23 I24 | A18-G20 PolarHBondContact O-N 2.94Å; G20-A22 VanDerWaalsContact C-N 3.34Å; G20-A22 PolarHBondContact O-N 3.36Å; G20-F23 PolarHBondContact O-N 3.14Å; G20-I24 PolarHBondContact O-N 3.45Å |
| 21 | N | 61.1 | Low | 72.3 | Confident | 105 Ų | 105 | 99.7 Ų | 99.7 | 56% | 0.561 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -69 | -33.1 | -166.6 | -65.4 | -4.7 | 0 | 0 | 0 | 113 | F23 I24 Q25 | N21-F23 VanDerWaalsContact C-N 3.29Å; N21-F23 PolarHBondContact O-N 3.05Å; N21-I24 PolarHBondContact O-N 3.45Å; N21-Q25 WeakPolarHBondContact O-CG 3.36Å; N21-Q25 PolarHBondContact O-N 3.18Å; N21-Q25 VanDerWaalsContact O-N 3.09Å |
| 22 | A | 66.3 | Low | 72.8 | Confident | 55 Ų | 55 | 100.6 Ų | 100.6 | 46% | 0.455 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.2 | -29.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | G20 R26 | G20-A22 VanDerWaalsContact C-N 3.34Å; G20-A22 PolarHBondContact O-N 3.36Å; A22-R26 VanDerWaalsContact O-CD 3.3Å; A22-R26 WeakPolarHBondContact O-CD 3.48Å; A22-R26 WeakPolarHBondContact O-CG 3.16Å; A22-R26 PolarHBondContact O-N 3.31Å |
| 23 | F | 72.2 | Confident | 73.6 | Confident | 149 Ų | 149 | 96.7 Ų | 96.7 | 65% | 0.654 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -77.2 | -41.1 | 179.7 | -167 | -96.1 | 0 | 0 | 0 | 111.7 | G20 N21 R26 T27 | G20-F23 PolarHBondContact O-N 3.14Å; N21-F23 VanDerWaalsContact C-N 3.29Å; N21-F23 PolarHBondContact O-N 3.05Å; F23-R26 PolarHBondContact O-N 3.05Å; F23-T27 PolarHBondContact O-N 2.97Å; F23-T27 PolarHBondContact O-OG1 2.92Å |
| 24 | I | 78.4 | Confident | 74.3 | Confident | 97 Ų | 97 | 98.2 Ų | 98.2 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.7 | -48.7 | 177.6 | -62.2 | 167.4 | 0 | 0 | 0 | 109.7 | G20 N21 R26 T27 I28 | G20-I24 PolarHBondContact O-N 3.45Å; N21-I24 PolarHBondContact O-N 3.45Å; I24-R26 PolarHBondContact O-N 2.89Å; I24-T27 PolarHBondContact O-N 3.42Å; I24-T27 VanDerWaalsContact O-N 3.14Å; I24-I28 HydrophobicContact CG2-CD1 3.73Å; I24-I28 HydrophobicContact CG2-CG1 4.39Å; I24-I28 WeakPolarHBondContact O-CG1 3.43Å; I24-I28 PolarHBondContact O-N 2.81Å |
| 25 | Q | 76.9 | Confident | 75.4 | Confident | 125 Ų | 125 | 96.5 Ų | 96.5 | 58% | 0.584 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.1 | -40.3 | 179.5 | -72.6 | -143.1 | -29.8 | 0 | 0 | 113.4 | N21 T27 I28 Q29 | N21-Q25 WeakPolarHBondContact O-CG 3.36Å; N21-Q25 PolarHBondContact O-N 3.18Å; N21-Q25 VanDerWaalsContact O-N 3.09Å; Q25-T27 VanDerWaalsContact C-N 3.31Å; Q25-T27 PolarHBondContact O-N 3.4Å; Q25-I28 PolarHBondContact O-N 2.92Å; Q25-Q29 WeakPolarHBondContact O-CB 3.26Å; Q25-Q29 WeakPolarHBondContact O-CG 3.44Å; Q25-Q29 PolarHBondContact O-N 3.42Å |
| 26 | R | 77.3 | Confident | 76.4 | Confident | 84 Ų | 84 | 96.8 Ų | 96.8 | 32% | 0.317 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 174.9 | -74.7 | 170.2 | -173.7 | -176.9 | 7 | 111.6 | A22 F23 I24 K30 | A22-R26 VanDerWaalsContact O-CD 3.3Å; A22-R26 WeakPolarHBondContact O-CD 3.48Å; A22-R26 WeakPolarHBondContact O-CG 3.16Å; A22-R26 PolarHBondContact O-N 3.31Å; F23-R26 PolarHBondContact O-N 3.05Å; I24-R26 PolarHBondContact O-N 2.89Å; R26-K30 VanDerWaalsContact O-CB 3.22Å; R26-K30 WeakPolarHBondContact O-CB 3.47Å; R26-K30 PolarHBondContact O-N 3.38Å |
| 27 | T | 83.7 | Confident | 77.5 | Confident | 73 Ų | 73 | 95.6 Ų | 95.6 | 45% | 0.448 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.8 | -45.5 | 179.8 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | F23 I24 Q25 K30 L31 | F23-T27 PolarHBondContact O-N 2.97Å; F23-T27 PolarHBondContact O-OG1 2.92Å; I24-T27 PolarHBondContact O-N 3.42Å; I24-T27 VanDerWaalsContact O-N 3.14Å; Q25-T27 VanDerWaalsContact C-N 3.31Å; Q25-T27 PolarHBondContact O-N 3.4Å; T27-K30 PolarHBondContact O-N 2.79Å; T27-L31 WeakPolarHBondContact O-CB 3.03Å; T27-L31 PolarHBondContact O-N 2.76Å |
| 28 | I | 86.8 | Confident | 79 | Confident | 101 Ų | 101 | 90.9 Ų | 90.9 | 52% | 0.518 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61 | -51.2 | 177.3 | -66.1 | 169.9 | 0 | 0 | 0 | 110.9 | I24 Q25 K30 L31 F32 | I24-I28 HydrophobicContact CG2-CD1 3.73Å; I24-I28 HydrophobicContact CG2-CG1 4.39Å; I24-I28 WeakPolarHBondContact O-CG1 3.43Å; I24-I28 PolarHBondContact O-N 2.81Å; Q25-I28 PolarHBondContact O-N 2.92Å; I28-K30 VanDerWaalsContact C-N 3.28Å; I28-K30 PolarHBondContact O-N 3.47Å; I28-L31 PolarHBondContact O-N 2.95Å; I28-F32 WeakPolarHBondContact O-CB 3.22Å; I28-F32 PolarHBondContact O-N 3.24Å |
| 29 | Q | 85.3 | Confident | 80.2 | Confident | 64 Ų | 64 | 93.9 Ų | 93.9 | 30% | 0.299 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.1 | -40.3 | 179.8 | -73.7 | 179 | -4.7 | 0 | 0 | 112.1 | Q25 F32 C33 C55 S56 | Q25-Q29 WeakPolarHBondContact O-CB 3.26Å; Q25-Q29 WeakPolarHBondContact O-CG 3.44Å; Q25-Q29 PolarHBondContact O-N 3.42Å; Q29-F32 PolarHBondContact O-N 3.23Å; Q29-C33 WeakPolarHBondContact O-CB 3.44Å; Q29-C33 PolarHBondContact O-N 3.09Å; Q29-C55 PolarHBondContact OE1-O 3.32Å; Q29-S56 VanDerWaalsContact OE1-CA 3.32Å |
| 30 | K | 86.4 | Confident | 81.9 | Confident | 98 Ų | 98 | 90.2 Ų | 90.2 | 43% | 0.426 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -67.7 | -39.9 | 178.4 | -158.5 | 178.2 | -169.1 | -172.8 | 0 | 111.9 | R26 T27 I28 R34 | R26-K30 VanDerWaalsContact O-CB 3.22Å; R26-K30 WeakPolarHBondContact O-CB 3.47Å; R26-K30 PolarHBondContact O-N 3.38Å; T27-K30 PolarHBondContact O-N 2.79Å; I28-K30 VanDerWaalsContact C-N 3.28Å; I28-K30 PolarHBondContact O-N 3.47Å; K30-R34 PolarHBondContact O-N 3.45Å; K30-R34 VanDerWaalsContact O-N 3.14Å |
| 31 | L | 89 | Confident | 83.4 | Confident | 106 Ų | 106 | 89.1 Ų | 89.1 | 56% | 0.555 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -65.2 | -44.8 | 175.5 | -162.7 | 77.4 | 0 | 0 | 0 | 110.7 | T27 I28 C33 R34 L35 | T27-L31 WeakPolarHBondContact O-CB 3.03Å; T27-L31 PolarHBondContact O-N 2.76Å; I28-L31 PolarHBondContact O-N 2.95Å; L31-C33 VanDerWaalsContact C-N 3.34Å; L31-C33 PolarHBondContact O-N 3.42Å; L31-R34 PolarHBondContact O-N 3.3Å; L31-R34 VanDerWaalsContact O-N 3.15Å; L31-L35 HydrophobicContact CG-CD1 4.44Å; L31-L35 WeakPolarHBondContact O-CG 3.45Å; L31-L35 PolarHBondContact O-N 3.37Å |
| 32 | F | 89.1 | Confident | 84.5 | Confident | 111 Ų | 111 | 89.4 Ų | 89.4 | 49% | 0.487 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -62.9 | -39.9 | 178.8 | -144.7 | -104.6 | 0 | 0 | 0 | 112.4 | I28 Q29 L35 R36 | I28-F32 WeakPolarHBondContact O-CB 3.22Å; I28-F32 PolarHBondContact O-N 3.24Å; Q29-F32 PolarHBondContact O-N 3.23Å; F32-L35 PolarHBondContact O-N 3.16Å; F32-R36 VanDerWaalsContact CE1-CZ 3.49Å; F32-R36 PolarHBondContact O-N 3.3Å; F32-R36 VanDerWaalsContact O-N 3.14Å |
| 33 | C | 90.1 | Very high | 85.2 | Confident | 4 Ų | 4 | 95.1 Ų | 95.1 | 3% | 0.027 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -62 | -43 | 173.5 | -173.7 | 0 | 0 | 0 | 0 | 111.7 | Q29 L31 R36 G38 C62 | Q29-C33 WeakPolarHBondContact O-CB 3.44Å; Q29-C33 PolarHBondContact O-N 3.09Å; L31-C33 VanDerWaalsContact C-N 3.34Å; L31-C33 PolarHBondContact O-N 3.42Å; C33-R36 PolarHBondContact O-N 2.97Å; C33-G38 WeakPolarHBondContact O-CA 3.35Å; C33-G38 PolarHBondContact O-N 3.12Å; C33-C62 VanDerWaalsContact CA-SG 3.52Å; C33-C62 HydrophobicContact CB-CB 3.9Å; C33-C62 WeakPolarHBondContact CB-SG 3.29Å; C33-C62 VanDerWaalsContact SG-CA 3.6Å; C33-C62 WeakPolarHBondContact SG-CB 3.33Å; C33-C62 CovalentContact SG-SG 2.03Å; C33-C62 PolarHBondContact SG-SG 3.16Å |
| 34 | R | 88.3 | Confident | 85.8 | Confident | 177 Ų | 177 | 92 Ų | 92 | 67% | 0.668 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -64.5 | -43.4 | 175.8 | -78.5 | -155.6 | -119.4 | -173.5 | 1.2 | 112.8 | K30 L31 R36 G37 | K30-R34 PolarHBondContact O-N 3.45Å; K30-R34 VanDerWaalsContact O-N 3.14Å; L31-R34 PolarHBondContact O-N 3.3Å; L31-R34 VanDerWaalsContact O-N 3.15Å; R34-R36 PolarHBondContact O-N 2.99Å; R34-G37 WeakPolarHBondContact O-CA 3.3Å; R34-G37 PolarHBondContact O-N 2.98Å |
| 35 | L | 90.6 | Very high | 86.2 | Confident | 133 Ų | 133 | 88.6 Ų | 88.6 | 70% | 0.696 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -61.2 | -33.2 | 178.6 | -73.9 | 170.5 | 0 | 0 | 0 | 112.3 | L31 F32 G37 | L31-L35 HydrophobicContact CG-CD1 4.44Å; L31-L35 WeakPolarHBondContact O-CG 3.45Å; L31-L35 PolarHBondContact O-N 3.37Å; F32-L35 PolarHBondContact O-N 3.16Å; L35-G37 PolarHBondContact O-N 3.48Å |
| 36 | R | 87.4 | Confident | 86.8 | Confident | 135 Ų | 135 | 86.8 Ų | 86.8 | 51% | 0.509 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | 3.1 | 173.5 | -71 | 179.1 | 173 | -169.5 | -6.2 | 113.9 | F32 C33 R34 G38 | F32-R36 VanDerWaalsContact CE1-CZ 3.49Å; F32-R36 PolarHBondContact O-N 3.3Å; F32-R36 VanDerWaalsContact O-N 3.14Å; C33-R36 PolarHBondContact O-N 2.97Å; R34-R36 PolarHBondContact O-N 2.99Å; R36-G38 VanDerWaalsContact C-N 3.29Å |
| 37 | G | 87.6 | Confident | 87.2 | Confident | 57 Ų | 57 | 87.8 Ų | 87.8 | 59% | 0.588 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.9 | 23.2 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | R34 L35 | R34-G37 WeakPolarHBondContact O-CA 3.3Å; R34-G37 PolarHBondContact O-N 2.98Å; L35-G37 PolarHBondContact O-N 3.48Å |
| 38 | G | 89.6 | Confident | 87.3 | Confident | 12 Ų | 12 | 94.4 Ų | 94.4 | 12% | 0.124 | 48% | 0.477 | C | S | . | . | trans | -98 | 163 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | C33 R36 C63 | C33-G38 WeakPolarHBondContact O-CA 3.35Å; C33-G38 PolarHBondContact O-N 3.12Å; R36-G38 VanDerWaalsContact C-N 3.29Å; G38-C63 CarbonylContact C-O 3.45Å; G38-C63 WeakPolarHBondContact CA-O 3.15Å | ||
| 39 | R | 87.9 | Confident | 87.4 | Confident | 125 Ų | 125 | 90.5 Ų | 90.5 | 47% | 0.472 | 46% | 0.457 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 143.3 | 172.7 | 59.1 | -172.7 | -100.1 | -159 | 6.9 | 110.5 | E49 C63 | R39-E49 VanDerWaalsContact CD-OE1 3.27Å; R39-E49 WeakPolarHBondContact CD-OE1 3.1Å; R39-E49 IonicContact CZ-OE1 3.46Å; R39-E49 IonicContact CZ-OE2 3.71Å; R39-E49 IonicContact NE-OE1 3.64Å; R39-E49 IonicContact NE-OE2 3.61Å; R39-E49 IonicContact NH1-OE1 2.71Å; R39-E49 PolarHBondContact NH1-OE1 3.37Å; R39-E49 IonicContact NH1-OE2 3.64Å; R39-C63 HydrophobicContact CG-CB 4.18Å; R39-C63 PolarHBondContact N-O 3.46Å; R39-C63 PolarHBondContact O-N 2.92Å |
| 40 | C | 88.6 | Confident | 87.7 | Confident | 48 Ų | 48 | 91.1 Ų | 91.1 | 32% | 0.324 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.9 | 120.8 | 174.7 | -60.5 | 0 | 0 | 0 | 0 | 110.4 | C55 K61 | C40-C55 VanDerWaalsContact CA-SG 3.55Å; C40-C55 HydrophobicContact CB-CB 3.68Å; C40-C55 WeakPolarHBondContact CB-SG 3.47Å; C40-C55 WeakPolarHBondContact SG-CB 3.13Å; C40-C55 CovalentContact SG-SG 2.03Å; C40-C55 PolarHBondContact SG-SG 3.43Å; C40-K61 CarbonylContact C-O 3.56Å; C40-K61 VanDerWaalsContact CA-O 3.31Å; C40-K61 WeakPolarHBondContact CA-O 3.27Å |
| 41 | A | 88.9 | Confident | 87.8 | Confident | 12 Ų | 12 | 91.3 Ų | 91.3 | 10% | 0.099 | 46% | 0.462 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.4 | 148.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | S44 R60 K61 C63 | A41-S44 VanDerWaalsContact CB-O 3.26Å; A41-S44 WeakPolarHBondContact CB-O 3.47Å; A41-R60 CarbonylContact O-C 3.5Å; A41-R60 VanDerWaalsContact O-CA 3.29Å; A41-R60 WeakPolarHBondContact O-CA 3.29Å; A41-K61 PolarHBondContact N-O 2.97Å; A41-K61 PolarHBondContact O-N 2.93Å; A41-C63 VanDerWaalsContact CB-SG 3.57Å |
| 42 | L | 84.3 | Confident | 87.8 | Confident | 112 Ų | 112 | 88.9 Ų | 88.9 | 59% | 0.586 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -76.9 | -40.8 | -177.4 | -129.1 | 86.6 | 0 | 0 | 0 | 112.9 | R60 | L42-R60 HydrophobicContact CD1-CG 4.49Š|
| 43 | F | 81.2 | Confident | 87.7 | Confident | 175 Ų | 175 | 84.9 Ų | 84.9 | 77% | 0.768 | 44% | 0.439 | S | S | * | . | S | Bend | trans | -119 | -58.2 | -174.4 | -80.9 | -84.7 | 0 | 0 | 0 | 112.5 | ||
| 44 | S | 85.2 | Confident | 87.5 | Confident | 82 Ų | 82 | 90 Ų | 90 | 57% | 0.573 | 46% | 0.463 | S | S | * | . | trans | -145 | 157.3 | -175.9 | 53.9 | 0 | 0 | 0 | 0 | 111.4 | A41 | A41-S44 VanDerWaalsContact CB-O 3.26Å; A41-S44 WeakPolarHBondContact CB-O 3.47Å | ||
| 45 | C | 87.1 | Confident | 87.4 | Confident | 27 Ų | 27 | 81.9 Ų | 81.9 | 18% | 0.182 | 43% | 0.433 | C | S | . | . | trans | -77 | 152.7 | 170.5 | -58.3 | 0 | 0 | 0 | 0 | 110.2 | E49 C63 | C45-E49 HydrophobicContact CB-CB 4.27Å; C45-C63 WeakPolarHBondContact CA-SG 2.95Å; C45-C63 HydrophobicContact CB-CB 3.64Å; C45-C63 WeakPolarHBondContact CB-SG 3.46Å; C45-C63 VanDerWaalsContact SG-CA 3.55Å; C45-C63 WeakPolarHBondContact SG-CB 3.41Å; C45-C63 CovalentContact SG-SG 2.03Å; C45-C63 PolarHBondContact SG-SG 3.42Å | ||
| 46 | L | 88.8 | Confident | 86.9 | Confident | 87 Ų | 87 | 76 Ų | 76 | 46% | 0.455 | 40% | 0.402 | S | S | . | . | trans | -68.5 | 157.1 | 175.2 | -82.2 | 71.3 | 0 | 0 | 0 | 110.5 | R48 E49 | L46-R48 PolarHBondContact O-N 3.44Å; L46-R48 VanDerWaalsContact O-N 3.1Å; L46-E49 HydrophobicContact CB-CB 4.42Å; L46-E49 HydrophobicContact CB-CG 4.09Å; L46-E49 WeakPolarHBondContact O-CA 3.11Å; L46-E49 WeakPolarHBondContact O-CB 3.25Å; L46-E49 PolarHBondContact O-N 3.46Å; L46-E49 VanDerWaalsContact O-O 3.04Å | ||
| 47 | A | 85.2 | Confident | 86.1 | Confident | 104 Ų | 104 | 74.1 Ų | 74.1 | 86% | 0.86 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | -26.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | E49 | A47-E49 VanDerWaalsContact C-N 3.3Š|
| 48 | R | 86.4 | Confident | 85.5 | Confident | 212 Ų | 212 | 81.1 Ų | 81.1 | 80% | 0.8 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | -1.2 | 175.2 | -64.5 | -176.1 | 179.1 | 175.5 | 0.5 | 113.5 | L46 K66 | L46-R48 PolarHBondContact O-N 3.44Å; L46-R48 VanDerWaalsContact O-N 3.1Å; R48-K66 PolarHBondContact O-N 3.24Å |
| 49 | E | 89.3 | Confident | 84.9 | Confident | 20 Ų | 20 | 82.3 Ų | 82.3 | 9% | 0.093 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 148.7 | -176.9 | -60.3 | -176.4 | 164.8 | 0 | 0 | 110.4 | R39 C45 L46 A47 C63 R64 | R39-E49 VanDerWaalsContact CD-OE1 3.27Å; R39-E49 WeakPolarHBondContact CD-OE1 3.1Å; R39-E49 IonicContact CZ-OE1 3.46Å; R39-E49 IonicContact CZ-OE2 3.71Å; R39-E49 IonicContact NE-OE1 3.64Å; R39-E49 IonicContact NE-OE2 3.61Å; R39-E49 IonicContact NH1-OE1 2.71Å; R39-E49 PolarHBondContact NH1-OE1 3.37Å; R39-E49 IonicContact NH1-OE2 3.64Å; C45-E49 HydrophobicContact CB-CB 4.27Å; L46-E49 HydrophobicContact CB-CB 4.42Å; L46-E49 HydrophobicContact CB-CG 4.09Å; L46-E49 WeakPolarHBondContact O-CA 3.11Å; L46-E49 WeakPolarHBondContact O-CB 3.25Å; L46-E49 PolarHBondContact O-N 3.46Å; L46-E49 VanDerWaalsContact O-O 3.04Å; A47-E49 VanDerWaalsContact C-N 3.3Å; E49-C63 HydrophobicContact CB-CB 4.26Å; E49-C63 WeakPolarHBondContact OE2-CB 3.31Å; E49-R64 CarbonylContact C-O 3.4Å; E49-R64 WeakPolarHBondContact CA-O 3.37Å; E49-R64 WeakPolarHBondContact CB-O 3.14Å |
| 50 | E | 90.1 | Very high | 84.9 | Confident | 77 Ų | 77 | 81.5 Ų | 81.5 | 36% | 0.36 | 43% | 0.428 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.7 | 144.2 | 173.4 | 59.9 | 178.7 | 174.6 | 0 | 0 | 110.8 | I52 C63 R64 K66 | E50-I52 HydrophobicContact CG-CD1 4.26Å; E50-I52 HydrophobicContact CG-CG1 4.01Å; E50-I52 PolarHBondContact O-N 2.98Å; E50-C63 CarbonylContact O-C 3.5Å; E50-C63 VanDerWaalsContact O-CA 3.3Å; E50-C63 WeakPolarHBondContact O-CA 3.29Å; E50-R64 HydrophobicContact CG-CB 4.21Å; E50-R64 PolarHBondContact N-O 3Å; E50-R64 PolarHBondContact O-N 3.44Å; E50-K66 HydrophobicContact CB-CG 4.13Å; E50-K66 HydrophobicContact CG-CG 4.33Å |
| 51 | Q | 89.8 | Confident | 85 | Confident | 102 Ų | 102 | 82.3 Ų | 82.3 | 48% | 0.477 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.3 | 116.4 | 172.7 | -177.8 | -174.2 | -32.9 | 0 | 0 | 109.3 | K61 | Q51-K61 HydrophobicContact CG-CD 4.31Å |
| 52 | I | 87.6 | Confident | 85 | Confident | 55 Ų | 55 | 82 Ų | 82 | 28% | 0.282 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | -22.6 | 179.7 | -57.6 | -162.5 | 0 | 0 | 0 | 112 | E50 C62 R64 | E50-I52 HydrophobicContact CG-CD1 4.26Å; E50-I52 HydrophobicContact CG-CG1 4.01Å; E50-I52 PolarHBondContact O-N 2.98Å; I52-C62 PolarHBondContact N-O 3.32Å; I52-R64 HydrophobicContact CD1-CB 3.25Å; I52-R64 HydrophobicContact CD1-CG 3.9Å; I52-R64 HydrophobicContact CG1-CB 3.9Å |
| 53 | G | 86.8 | Confident | 85.4 | Confident | 26 Ų | 26 | 76.7 Ų | 76.7 | 27% | 0.268 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 175 | -149.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | C62 | G53-C62 PolarHBondContact N-O 3.32Å; G53-C62 PolarHBondContact O-N 2.8Å |
| 54 | Q | 86.8 | Confident | 85.9 | Confident | 113 Ų | 113 | 72.8 Ų | 72.8 | 53% | 0.528 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 144.3 | -179 | -57 | -178.4 | 23.7 | 0 | 0 | 110.5 | R60 | Q54-R60 CarbonylContact C-O 3.47Å; Q54-R60 VanDerWaalsContact CA-O 3.27Å; Q54-R60 WeakPolarHBondContact CA-O 3.48Å |
| 55 | C | 85.6 | Confident | 86 | Confident | 6 Ų | 6 | 73 Ų | 73 | 4% | 0.041 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.6 | -12.3 | 176.7 | -69.7 | 0 | 0 | 0 | 0 | 113.6 | Q29 C40 R60 | Q29-C55 PolarHBondContact OE1-O 3.32Å; C40-C55 VanDerWaalsContact CA-SG 3.55Å; C40-C55 HydrophobicContact CB-CB 3.68Å; C40-C55 WeakPolarHBondContact CB-SG 3.47Å; C40-C55 WeakPolarHBondContact SG-CB 3.13Å; C40-C55 CovalentContact SG-SG 2.03Å; C40-C55 PolarHBondContact SG-SG 3.43Å; C55-R60 HydrophobicContact CB-CB 4.1Å; C55-R60 PolarHBondContact N-O 3.03Å |
| 56 | S | 79.9 | Confident | 85.8 | Confident | 8 Ų | 8 | 77.4 Ų | 77.4 | 6% | 0.056 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -159 | 145.5 | 178.3 | 177.7 | 0 | 0 | 0 | 0 | 109.4 | Q29 R58 G59 | Q29-S56 VanDerWaalsContact OE1-CA 3.32Å; S56-R58 PolarHBondContact O-N 3.49Å; S56-R58 VanDerWaalsContact O-N 3.12Å; S56-R58 PolarHBondContact OG-N 2.91Å; S56-G59 PolarHBondContact O-N 3.49Å; S56-G59 VanDerWaalsContact O-N 3.16Å |
| 57 | S | 72.3 | Confident | 85.2 | Confident | 97 Ų | 97 | 82 Ų | 82 | 68% | 0.678 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -20.3 | 170.6 | 57.4 | 0 | 0 | 0 | 0 | 113.6 | G59 | S57-G59 PolarHBondContact O-N 3.4Å; S57-G59 VanDerWaalsContact O-N 3.16Å |
| 58 | R | 74.3 | Confident | 84.1 | Confident | 203 Ų | 203 | 90.2 Ų | 90.2 | 77% | 0.766 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.7 | 27.3 | 173.2 | -71.9 | -171.8 | 177.2 | 179.3 | -0.8 | 113.7 | S56 | S56-R58 PolarHBondContact O-N 3.49Å; S56-R58 VanDerWaalsContact O-N 3.12Å; S56-R58 PolarHBondContact OG-N 2.91Å |
| 59 | G | 77.9 | Confident | 84 | Confident | 37 Ų | 37 | 84.1 Ų | 84.1 | 38% | 0.381 | 40% | 0.403 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.5 | 8.2 | 170.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | S56 S57 K61 | S56-G59 PolarHBondContact O-N 3.49Å; S56-G59 VanDerWaalsContact O-N 3.16Å; S57-G59 PolarHBondContact O-N 3.4Å; S57-G59 VanDerWaalsContact O-N 3.16Å; G59-K61 PolarHBondContact O-N 3.31Å |
| 60 | R | 87.2 | Confident | 83.7 | Confident | 109 Ų | 109 | 87.5 Ų | 87.5 | 41% | 0.411 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.2 | 127.9 | 174.4 | -65.8 | -172.5 | 173.8 | 170.4 | -3.2 | 109.6 | A41 L42 Q54 C55 | A41-R60 CarbonylContact O-C 3.5Å; A41-R60 VanDerWaalsContact O-CA 3.29Å; A41-R60 WeakPolarHBondContact O-CA 3.29Å; L42-R60 HydrophobicContact CD1-CG 4.49Å; Q54-R60 CarbonylContact C-O 3.47Å; Q54-R60 VanDerWaalsContact CA-O 3.27Å; Q54-R60 WeakPolarHBondContact CA-O 3.48Å; C55-R60 HydrophobicContact CB-CB 4.1Å; C55-R60 PolarHBondContact N-O 3.03Å |
| 61 | K | 89.8 | Confident | 83.4 | Confident | 64 Ų | 64 | 88.1 Ų | 88.1 | 28% | 0.278 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.4 | 147.2 | -178.7 | -64.5 | -172.8 | 167.4 | -164.3 | 0 | 111.4 | C40 A41 Q51 G59 | C40-K61 CarbonylContact C-O 3.56Å; C40-K61 VanDerWaalsContact CA-O 3.31Å; C40-K61 WeakPolarHBondContact CA-O 3.27Å; A41-K61 PolarHBondContact N-O 2.97Å; A41-K61 PolarHBondContact O-N 2.93Å; Q51-K61 HydrophobicContact CG-CD 4.31Å; G59-K61 PolarHBondContact O-N 3.31Å |
| 62 | C | 90.6 | Very high | 83 | Confident | 6 Ų | 6 | 87.2 Ų | 87.2 | 4% | 0.041 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.4 | 121 | 170.1 | -178.6 | 0 | 0 | 0 | 0 | 108.8 | C33 I52 G53 | C33-C62 VanDerWaalsContact CA-SG 3.52Å; C33-C62 HydrophobicContact CB-CB 3.9Å; C33-C62 WeakPolarHBondContact CB-SG 3.29Å; C33-C62 VanDerWaalsContact SG-CA 3.6Å; C33-C62 WeakPolarHBondContact SG-CB 3.33Å; C33-C62 CovalentContact SG-SG 2.03Å; C33-C62 PolarHBondContact SG-SG 3.16Å; I52-C62 PolarHBondContact N-O 3.32Å; G53-C62 PolarHBondContact N-O 3.32Å; G53-C62 PolarHBondContact O-N 2.8Å |
| 63 | C | 91.7 | Very high | 82.7 | Confident | 0 Ų | 0 | 89.3 Ų | 89.3 | 0% | 0 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 136.7 | -173.8 | -52.3 | 0 | 0 | 0 | 0 | 109.8 | G38 R39 A41 C45 E49 E50 | G38-C63 CarbonylContact C-O 3.45Å; G38-C63 WeakPolarHBondContact CA-O 3.15Å; R39-C63 HydrophobicContact CG-CB 4.18Å; R39-C63 PolarHBondContact N-O 3.46Å; R39-C63 PolarHBondContact O-N 2.92Å; A41-C63 VanDerWaalsContact CB-SG 3.57Å; C45-C63 WeakPolarHBondContact CA-SG 2.95Å; C45-C63 HydrophobicContact CB-CB 3.64Å; C45-C63 WeakPolarHBondContact CB-SG 3.46Å; C45-C63 VanDerWaalsContact SG-CA 3.55Å; C45-C63 WeakPolarHBondContact SG-CB 3.41Å; C45-C63 CovalentContact SG-SG 2.03Å; C45-C63 PolarHBondContact SG-SG 3.42Å; E49-C63 HydrophobicContact CB-CB 4.26Å; E49-C63 WeakPolarHBondContact OE2-CB 3.31Å; E50-C63 CarbonylContact O-C 3.5Å; E50-C63 VanDerWaalsContact O-CA 3.3Å; E50-C63 WeakPolarHBondContact O-CA 3.29Å |
| 64 | R | 91 | Very high | 82.4 | Confident | 94 Ų | 94 | 93.5 Ų | 93.5 | 36% | 0.355 | 44% | 0.439 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 142.9 | 175.3 | -172.6 | -170.9 | -176.6 | -171.7 | 7.3 | 109.6 | E49 E50 I52 K66 | E49-R64 CarbonylContact C-O 3.4Å; E49-R64 WeakPolarHBondContact CA-O 3.37Å; E49-R64 WeakPolarHBondContact CB-O 3.14Å; E50-R64 HydrophobicContact CG-CB 4.21Å; E50-R64 PolarHBondContact N-O 3Å; E50-R64 PolarHBondContact O-N 3.44Å; I52-R64 HydrophobicContact CD1-CB 3.25Å; I52-R64 HydrophobicContact CD1-CG 3.9Å; I52-R64 HydrophobicContact CG1-CB 3.9Å; R64-K66 PolarHBondContact O-N 3.44Å |
| 65 | T | 88.4 | Confident | 82.1 | Confident | 87 Ų | 87 | 92.1 Ų | 92.1 | 53% | 0.534 | 43% | 0.432 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.7 | 127.1 | 172.8 | -40.6 | 0 | 0 | 0 | 0 | 109.4 | K67 | T65-K67 PolarHBondContact O-N 3.43Å |
| 66 | K | 83.1 | Confident | 81.8 | Confident | 119 Ų | 119 | 98.7 Ų | 98.7 | 52% | 0.517 | 46% | 0.463 | S | S | . | . | P | Polyproline II helix | trans | -61.2 | 128.7 | 173.1 | -68.7 | -176.4 | 178.7 | -179 | 0 | 107.9 | R48 E50 R64 K68 | R48-K66 PolarHBondContact O-N 3.24Å; E50-K66 HydrophobicContact CB-CG 4.13Å; E50-K66 HydrophobicContact CG-CG 4.33Å; R64-K66 PolarHBondContact O-N 3.44Å; K66-K68 PolarHBondContact O-N 2.93Å |
| 67 | K | 76 | Confident | 82 | Confident | 183 Ų | 183 | 106.3 Ų | 106.3 | 80% | 0.796 | 50% | 0.496 | S | S | * | . | P | Polyproline II helix | trans | -65.8 | 126.1 | 167.7 | -73.5 | -163.5 | 176.1 | -170.7 | 0 | 107 | T65 | T65-K67 PolarHBondContact O-N 3.43Š|
| 68 | K | 62 | Low | 82.9 | Confident | 276 Ų | 276 | 107.1 Ų | 107.1 | 100% | 1.2 | 48% | 0.48 | S | S | * | . | trans | -74.2 | 0 | -179.8 | -159 | -176.8 | -174.4 | -168.9 | 0 | 110 | K66 | K66-K68 PolarHBondContact O-N 2.93Š|
Retrieved 68 of 68 residues in 54.5 ms
(Link to these results)