| 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 | 53.7 | Low | 61.5 | Low | 234 Ų | 234 | 121 Ų | 121 | 100% | 1.153 | 67% | 0.672 | S | S | * | * | 0 | 104.1 | 0 | -63.3 | 165.8 | 100.1 | 0 | 0 | 106.9 | |||||
| 2 | P | 54.1 | Low | 62.5 | Low | 102 Ų | 102 | 119.3 Ų | 119.3 | 66% | 0.662 | 66% | 0.66 | S | S | * | * | trans | -70.6 | 141.3 | -178.5 | 29 | -32.6 | 0 | 0 | 0 | 109.9 | S4 | P2-S4 PolarHBondContact O-N 3.14Š| ||
| 3 | P | 57.9 | Low | 63.6 | Low | 95 Ų | 95 | 118.8 Ų | 118.8 | 62% | 0.617 | 66% | 0.655 | S | S | * | * | trans | -64.4 | 129.1 | -175.7 | 26.3 | -33.3 | 0 | 0 | 0 | 110.2 | G5 L6 | P3-G5 PolarHBondContact O-N 2.98Å; P3-L6 HydrophobicContact CG-CD1 4.26Å; P3-L6 PolarHBondContact O-N 3.23Å | ||
| 4 | S | 61.3 | Low | 64.4 | Low | 102 Ų | 102 | 115.1 Ų | 115.1 | 71% | 0.713 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.3 | -9.7 | -172.4 | -48.5 | 0 | 0 | 0 | 0 | 115.5 | P2 | P2-S4 PolarHBondContact O-N 3.14Š|
| 5 | G | 61.2 | Low | 64.9 | Low | 52 Ų | 52 | 114.8 Ų | 114.8 | 54% | 0.536 | 64% | 0.635 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.5 | -30.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | P3 R7 | P3-G5 PolarHBondContact O-N 2.98Å; G5-R7 VanDerWaalsContact C-N 3.3Å; G5-R7 PolarHBondContact O-N 3Å |
| 6 | L | 59.3 | Low | 65.5 | Low | 128 Ų | 128 | 114.4 Ų | 114.4 | 67% | 0.67 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -16.8 | -178 | -91.1 | 89.5 | 0 | 0 | 0 | 113.8 | P3 L8 P10 | P3-L6 HydrophobicContact CG-CD1 4.26Å; P3-L6 PolarHBondContact O-N 3.23Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-P10 WeakPolarHBondContact O-CD 3.46Å |
| 7 | R | 63.7 | Low | 66.1 | Low | 207 Ų | 207 | 117.8 Ų | 117.8 | 78% | 0.781 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | -22.2 | 179.4 | -72.9 | -101.6 | 170.5 | 141.6 | -5.5 | 113 | G5 P10 | G5-R7 VanDerWaalsContact C-N 3.3Å; G5-R7 PolarHBondContact O-N 3Å; R7-P10 WeakPolarHBondContact O-CD 3.46Å |
| 8 | L | 62.2 | Low | 66.4 | Low | 98 Ų | 98 | 117.2 Ų | 117.2 | 51% | 0.513 | 63% | 0.628 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.1 | -20.4 | 177.1 | -80.3 | 140.8 | 0 | 0 | 0 | 112.6 | L6 L11 L12 | L6-L8 VanDerWaalsContact C-N 3.34Å; L8-L11 WeakPolarHBondContact O-CB 3.02Å; L8-L11 PolarHBondContact O-N 3.4Å; L8-L12 HydrophobicContact CB-CD1 4.13Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 3.2Å |
| 9 | L | 67.1 | Low | 66.6 | Low | 101 Ų | 101 | 117.6 Ų | 117.6 | 53% | 0.529 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -55.9 | -44.7 | 180 | -158.7 | 122.1 | 0 | 0 | 0 | 114.2 | L11 L12 L13 | L9-L11 PolarHBondContact O-N 2.93Å; L9-L12 PolarHBondContact O-N 3.09Å; L9-L13 HydrophobicContact CD2-CD1 4.13Å; L9-L13 PolarHBondContact O-N 2.78Å; L9-L13 VanDerWaalsContact O-N 3.09Å |
| 10 | P | 69.1 | Low | 66.8 | Low | 89 Ų | 89 | 117.3 Ų | 117.3 | 58% | 0.578 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -72.2 | -12.9 | 176.5 | 29.8 | -36.7 | 0 | 0 | 0 | 113.8 | L6 R7 P14 | L6-P10 WeakPolarHBondContact O-CD 3.46Å; R7-P10 WeakPolarHBondContact O-CD 3.46Å; P10-P14 WeakPolarHBondContact O-CD 3.3Å; P10-P14 VanDerWaalsContact O-CG 3.26Å; P10-P14 WeakPolarHBondContact O-CG 3.41Å |
| 11 | L | 67.4 | Low | 66.7 | Low | 123 Ų | 123 | 116.9 Ų | 116.9 | 64% | 0.644 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -91.7 | -33.5 | 174 | -163 | 87.3 | 0 | 0 | 0 | 111.4 | L8 L9 P14 L15 | L8-L11 WeakPolarHBondContact O-CB 3.02Å; L8-L11 PolarHBondContact O-N 3.4Å; L9-L11 PolarHBondContact O-N 2.93Å; L11-P14 WeakPolarHBondContact O-CD 3.46Å; L11-P14 WeakPolarHBondContact O-CG 3.39Å; L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 PolarHBondContact O-N 3.29Å |
| 12 | L | 73 | Confident | 67.3 | Low | 100 Ų | 100 | 109.1 Ų | 109.1 | 52% | 0.524 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -72.6 | -36.5 | 177.7 | -74.6 | 163.5 | 0 | 0 | 0 | 112.2 | L8 L9 L15 L16 | L8-L12 HydrophobicContact CB-CD1 4.13Å; L8-L12 WeakPolarHBondContact O-CG 3.49Å; L8-L12 PolarHBondContact O-N 3.2Å; L9-L12 PolarHBondContact O-N 3.09Å; L12-L15 PolarHBondContact O-N 2.91Å; L12-L16 VanDerWaalsContact O-CB 3.27Å; L12-L16 WeakPolarHBondContact O-CB 3.42Å; L12-L16 PolarHBondContact O-N 3.3Å |
| 13 | L | 76.8 | Confident | 67.5 | Low | 114 Ų | 114 | 109.6 Ų | 109.6 | 60% | 0.597 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -59.5 | -50.5 | 178.1 | -122.6 | 115 | 0 | 0 | 0 | 113.9 | L9 L15 L16 W17 | L9-L13 HydrophobicContact CD2-CD1 4.13Å; L9-L13 PolarHBondContact O-N 2.78Å; L9-L13 VanDerWaalsContact O-N 3.09Å; L13-L15 VanDerWaalsContact C-N 3.33Å; L13-L16 PolarHBondContact O-N 2.89Å; L13-W17 WeakPolarHBondContact O-CB 3.38Å; L13-W17 PolarHBondContact O-N 3.33Å |
| 14 | P | 74.9 | Confident | 67.5 | Low | 67 Ų | 67 | 108.3 Ų | 108.3 | 44% | 0.435 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70.2 | -29.6 | 176.7 | 26.7 | -34.1 | 0 | 0 | 0 | 112.1 | P10 L11 L18 | P10-P14 WeakPolarHBondContact O-CD 3.3Å; P10-P14 VanDerWaalsContact O-CG 3.26Å; P10-P14 WeakPolarHBondContact O-CG 3.41Å; L11-P14 WeakPolarHBondContact O-CD 3.46Å; L11-P14 WeakPolarHBondContact O-CG 3.39Å; P14-L18 WeakPolarHBondContact O-CB 3.24Å; P14-L18 PolarHBondContact O-N 2.98Å |
| 15 | L | 71.8 | Confident | 67.4 | Low | 110 Ų | 110 | 114.7 Ų | 114.7 | 58% | 0.576 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.8 | -42.3 | 174.5 | -174.2 | 66.8 | 0 | 0 | 0 | 111.6 | L11 L12 L13 L18 L19 | L11-L15 WeakPolarHBondContact O-CB 3.45Å; L11-L15 PolarHBondContact O-N 3.29Å; L12-L15 PolarHBondContact O-N 2.91Å; L13-L15 VanDerWaalsContact C-N 3.33Å; L15-L18 PolarHBondContact O-N 3.32Å; L15-L19 WeakPolarHBondContact O-CB 3.44Å; L15-L19 PolarHBondContact O-N 3.48Å |
| 16 | L | 74.3 | Confident | 66.9 | Low | 108 Ų | 108 | 117.4 Ų | 117.4 | 57% | 0.565 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -68.2 | -40.4 | 175.1 | -174.1 | 66.3 | 0 | 0 | 0 | 111 | L12 L13 L19 V20 | L12-L16 VanDerWaalsContact O-CB 3.27Å; L12-L16 WeakPolarHBondContact O-CB 3.42Å; L12-L16 PolarHBondContact O-N 3.3Å; L13-L16 PolarHBondContact O-N 2.89Å; L16-L19 PolarHBondContact O-N 2.89Å; L16-V20 VanDerWaalsContact O-CG2 3.32Å; L16-V20 WeakPolarHBondContact O-CG2 3.48Å; L16-V20 PolarHBondContact O-N 3.38Å |
| 17 | W | 76.4 | Confident | 66.7 | Low | 173 Ų | 173 | 116 Ų | 116 | 66% | 0.655 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -63.6 | -43.2 | 174.2 | -169.7 | 47.7 | 0 | 0 | 0 | 111.1 | L13 L19 V20 L21 | L13-W17 WeakPolarHBondContact O-CB 3.38Å; L13-W17 PolarHBondContact O-N 3.33Å; W17-L19 VanDerWaalsContact C-N 3.31Å; W17-L19 PolarHBondContact O-N 3.49Å; W17-V20 PolarHBondContact O-N 3.29Å; W17-L21 HydrophobicContact CZ2-CD2 4.34Å; W17-L21 VanDerWaalsContact O-CB 3.23Å; W17-L21 WeakPolarHBondContact O-CB 3.31Å; W17-L21 PolarHBondContact O-N 3.16Å |
| 18 | L | 71.3 | Confident | 66.2 | Low | 107 Ų | 107 | 109.4 Ų | 109.4 | 56% | 0.56 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -62.1 | -38.9 | 174.7 | -169.7 | 68.7 | 0 | 0 | 0 | 111.5 | P14 L15 L21 T22 | P14-L18 WeakPolarHBondContact O-CB 3.24Å; P14-L18 PolarHBondContact O-N 2.98Å; L15-L18 PolarHBondContact O-N 3.32Å; L18-L21 PolarHBondContact O-N 3.12Å; L18-T22 WeakPolarHBondContact O-CB 3.5Å; L18-T22 WeakPolarHBondContact O-CG2 3.37Å; L18-T22 PolarHBondContact O-N 3.38Å; L18-T22 PolarHBondContact O-OG1 2.93Å |
| 19 | L | 69.2 | Low | 65.6 | Low | 124 Ų | 124 | 107.9 Ų | 107.9 | 65% | 0.649 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67 | -37.3 | 176.6 | -171.7 | 65.8 | 0 | 0 | 0 | 112.7 | L15 L16 W17 T22 | L15-L19 WeakPolarHBondContact O-CB 3.44Å; L15-L19 PolarHBondContact O-N 3.48Å; L16-L19 PolarHBondContact O-N 2.89Å; W17-L19 VanDerWaalsContact C-N 3.31Å; W17-L19 PolarHBondContact O-N 3.49Å; L19-T22 WeakPolarHBondContact CA-OG1 3.3Å; L19-T22 PolarHBondContact O-OG1 3.13Å |
| 20 | V | 70.8 | Confident | 65.1 | Low | 112 Ų | 112 | 110.5 Ų | 110.5 | 68% | 0.679 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -73.4 | -35.1 | 174.8 | 169.8 | 0 | 0 | 0 | 0 | 111.5 | L16 W17 | L16-V20 VanDerWaalsContact O-CG2 3.32Å; L16-V20 WeakPolarHBondContact O-CG2 3.48Å; L16-V20 PolarHBondContact O-N 3.38Å; W17-V20 PolarHBondContact O-N 3.29Å |
| 21 | L | 66.3 | Low | 64 | Low | 109 Ų | 109 | 110.3 Ų | 110.3 | 57% | 0.571 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -86.6 | -15.4 | -178.1 | -141 | 76.3 | 0 | 0 | 0 | 113.2 | W17 L18 P23 | W17-L21 HydrophobicContact CZ2-CD2 4.34Å; W17-L21 VanDerWaalsContact O-CB 3.23Å; W17-L21 WeakPolarHBondContact O-CB 3.31Å; W17-L21 PolarHBondContact O-N 3.16Å; L18-L21 PolarHBondContact O-N 3.12Å; L21-P23 WeakPolarHBondContact O-CD 3.34Å |
| 22 | T | 65.4 | Low | 63.5 | Low | 70 Ų | 70 | 111 Ų | 111 | 43% | 0.429 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -73.7 | 104.2 | 163.5 | 44 | 0 | 0 | 0 | 0 | 107.7 | L18 L19 G24 | L18-T22 WeakPolarHBondContact O-CB 3.5Å; L18-T22 WeakPolarHBondContact O-CG2 3.37Å; L18-T22 PolarHBondContact O-N 3.38Å; L18-T22 PolarHBondContact O-OG1 2.93Å; L19-T22 WeakPolarHBondContact CA-OG1 3.3Å; L19-T22 PolarHBondContact O-OG1 3.13Å; T22-G24 PolarHBondContact O-N 3.48Å |
| 23 | P | 57.9 | Low | 62.6 | Low | 112 Ų | 112 | 110.8 Ų | 110.8 | 73% | 0.727 | 65% | 0.653 | S | S | * | * | trans | -55 | 120.7 | 162.6 | 25.5 | -32.8 | 0 | 0 | 0 | 104.9 | L21 R25 | L21-P23 WeakPolarHBondContact O-CD 3.34Å; P23-R25 PolarHBondContact O-N 3.32Å | ||
| 24 | G | 58.6 | Low | 61.6 | Low | 69 Ų | 69 | 113.6 Ų | 113.6 | 71% | 0.711 | 66% | 0.66 | S | S | * | * | trans | -46.2 | 106.8 | -176.9 | 0 | 0 | 0 | 0 | 0 | 107.4 | T22 P26 | T22-G24 PolarHBondContact O-N 3.48Å; G24-P26 WeakPolarHBondContact O-CD 3.46Å | ||
| 25 | R | 58 | Low | 60.9 | Low | 235 Ų | 235 | 117.2 Ų | 117.2 | 89% | 0.887 | 68% | 0.681 | S | S | * | * | trans | -56.9 | 114.1 | 167.8 | -92.8 | 176.6 | 144.2 | 158.6 | -5.7 | 101.7 | P23 A27 | P23-R25 PolarHBondContact O-N 3.32Å; R25-A27 VanDerWaalsContact C-N 3.27Å; R25-A27 PolarHBondContact O-N 3Å | ||
| 26 | P | 51 | Low | 60.5 | Low | 110 Ų | 110 | 116.6 Ų | 116.6 | 71% | 0.714 | 68% | 0.677 | S | S | * | * | trans | -55.2 | 116.4 | 161 | 25.4 | -29.3 | 0 | 0 | 0 | 102.3 | G24 A28 | G24-P26 WeakPolarHBondContact O-CD 3.46Å; P26-A28 PolarHBondContact O-N 3.19Å | ||
| 27 | A | 55.7 | Low | 60.9 | Low | 98 Ų | 98 | 115.4 Ų | 115.4 | 81% | 0.81 | 67% | 0.672 | S | S | * | * | trans | -57.9 | 80.8 | 145.6 | 0 | 0 | 0 | 0 | 0 | 102.8 | R25 G29 | R25-A27 VanDerWaalsContact C-N 3.27Å; R25-A27 PolarHBondContact O-N 3Å; A27-G29 PolarHBondContact O-N 3.45Å | ||
| 28 | A | 53 | Low | 61.4 | Low | 69 Ų | 69 | 111.8 Ų | 111.8 | 57% | 0.57 | 66% | 0.663 | S | S | * | * | trans | -56.7 | 95.1 | 158.1 | 0 | 0 | 0 | 0 | 0 | 100.3 | P26 L30 | P26-A28 PolarHBondContact O-N 3.19Å; A28-L30 VanDerWaalsContact C-N 3.32Å; A28-L30 PolarHBondContact O-N 3.12Å | ||
| 29 | G | 50.1 | Low | 62.2 | Low | 65 Ų | 65 | 111 Ų | 111 | 67% | 0.67 | 66% | 0.657 | S | S | * | * | trans | -45.6 | 114.4 | 169.1 | 0 | 0 | 0 | 0 | 0 | 103.1 | A27 S31 | A27-G29 PolarHBondContact O-N 3.45Å; G29-S31 PolarHBondContact O-N 3.44Å | ||
| 30 | L | 56.3 | Low | 63.1 | Low | 157 Ų | 157 | 109.6 Ų | 109.6 | 82% | 0.822 | 65% | 0.65 | S | S | * | * | trans | -70.8 | 61.6 | 174.2 | -64 | 173.2 | 0 | 0 | 0 | 105.7 | A28 T32 | A28-L30 VanDerWaalsContact C-N 3.32Å; A28-L30 PolarHBondContact O-N 3.12Å; L30-T32 PolarHBondContact O-N 3.18Å | ||
| 31 | S | 46.8 | Very low | 64.2 | Low | 84 Ų | 84 | 107 Ų | 107 | 59% | 0.587 | 63% | 0.633 | S | S | * | * | trans | -60.6 | 99.1 | 146.5 | -172 | 0 | 0 | 0 | 0 | 103 | G29 C33 | G29-S31 PolarHBondContact O-N 3.44Å; S31-C33 PolarHBondContact O-N 2.79Å; S31-C33 PolarHBondContact OG-SG 3.29Å | ||
| 32 | T | 55.6 | Low | 65.5 | Low | 137 Ų | 137 | 107 Ų | 107 | 84% | 0.84 | 63% | 0.629 | S | S | * | * | trans | -62.4 | 30.9 | 168.7 | 50.3 | 0 | 0 | 0 | 0 | 111.3 | L30 K34 | L30-T32 PolarHBondContact O-N 3.18Å; T32-K34 PolarHBondContact O-N 2.81Å | ||
| 33 | C | 55 | Low | 66.9 | Low | 97 Ų | 97 | 111.6 Ų | 111.6 | 66% | 0.655 | 64% | 0.639 | S | S | * | * | trans | -77.3 | 84.2 | 165.1 | -65.8 | 0 | 0 | 0 | 0 | 107.2 | S31 T35 | S31-C33 PolarHBondContact O-N 2.79Å; S31-C33 PolarHBondContact OG-SG 3.29Å; C33-T35 PolarHBondContact O-N 3.06Å; C33-T35 VanDerWaalsContact O-N 3.1Å | ||
| 34 | K | 55.4 | Low | 68.7 | Low | 173 Ų | 173 | 113.9 Ų | 113.9 | 75% | 0.752 | 64% | 0.637 | S | S | * | * | trans | -34.1 | 120.4 | 154.7 | -173.7 | 166.3 | 179.6 | 66.7 | 0 | 107.7 | T32 I36 | T32-K34 PolarHBondContact O-N 2.81Å; K34-I36 PolarHBondContact O-N 3.15Å | ||
| 35 | T | 59.5 | Low | 70.5 | Confident | 143 Ų | 143 | 118.6 Ų | 118.6 | 88% | 0.877 | 63% | 0.633 | S | S | * | * | trans | -64.7 | 76.2 | 166 | 44.7 | 0 | 0 | 0 | 0 | 106.9 | C33 D37 | C33-T35 PolarHBondContact O-N 3.06Å; C33-T35 VanDerWaalsContact O-N 3.1Å; T35-D37 PolarHBondContact O-N 3.24Å | ||
| 36 | I | 63.3 | Low | 72.4 | Confident | 96 Ų | 96 | 112.8 Ų | 112.8 | 49% | 0.492 | 62% | 0.619 | S | S | . | * | trans | -71.5 | 120.3 | 177 | -175.8 | 162.8 | 0 | 0 | 0 | 105.6 | K34 M38 V41 | K34-I36 PolarHBondContact O-N 3.15Å; I36-M38 HydrophobicContact CB-CE 4.24Å; I36-M38 HydrophobicContact CG1-CE 4.19Å; I36-M38 HydrophobicContact CG2-CE 3.27Å; I36-M38 PolarHBondContact O-N 2.86Å; I36-V41 HydrophobicContact CD1-CG2 3.6Å; I36-V41 HydrophobicContact CG1-CG2 3.7Å | ||
| 37 | D | 82.6 | Confident | 74.6 | Confident | 83 Ų | 83 | 112.9 Ų | 112.9 | 44% | 0.444 | 61% | 0.61 | S | S | . | * | trans | -63.5 | 103.1 | 176.1 | -175.3 | -6.4 | 0 | 0 | 0 | 107.9 | T35 E39 L40 V41 | T35-D37 PolarHBondContact O-N 3.24Å; D37-E39 PolarHBondContact O-N 3.18Å; D37-E39 VanDerWaalsContact OD1-CB 3.23Å; D37-E39 WeakPolarHBondContact OD1-CB 3.43Å; D37-E39 PolarHBondContact OD1-N 2.97Å; D37-L40 HydrophobicContact CB-CB 4.23Å; D37-L40 HydrophobicContact CB-CD1 3.93Å; D37-L40 HydrophobicContact CB-CG 3.91Å; D37-L40 WeakPolarHBondContact O-CB 3.33Å; D37-L40 PolarHBondContact O-N 2.72Å; D37-V41 PolarHBondContact O-N 3Å | ||
| 38 | M | 88.4 | Confident | 76.6 | Confident | 98 Ų | 98 | 111.3 Ų | 111.3 | 48% | 0.483 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -58.2 | -26.4 | 178.4 | -78 | -66.1 | 107.2 | 0 | 0 | 111.4 | I36 V41 K42 | I36-M38 HydrophobicContact CB-CE 4.24Å; I36-M38 HydrophobicContact CG1-CE 4.19Å; I36-M38 HydrophobicContact CG2-CE 3.27Å; I36-M38 PolarHBondContact O-N 2.86Å; M38-V41 HydrophobicContact CE-CB 4.38Å; M38-V41 HydrophobicContact CE-CG2 3.95Å; M38-V41 PolarHBondContact O-N 3.34Å; M38-K42 WeakPolarHBondContact O-CB 3.21Å; M38-K42 VanDerWaalsContact O-CG 3.22Å; M38-K42 WeakPolarHBondContact O-CG 3.41Å; M38-K42 PolarHBondContact O-N 3.18Å |
| 39 | E | 88 | Confident | 78.7 | Confident | 90 Ų | 90 | 110.4 Ų | 110.4 | 42% | 0.421 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -67.5 | -38 | 174.9 | -62.7 | -59.1 | 114.5 | 0 | 0 | 111.2 | D37 K42 R43 | D37-E39 PolarHBondContact O-N 3.18Å; D37-E39 VanDerWaalsContact OD1-CB 3.23Å; D37-E39 WeakPolarHBondContact OD1-CB 3.43Å; D37-E39 PolarHBondContact OD1-N 2.97Å; E39-K42 PolarHBondContact O-N 3.47Å; E39-K42 IonicContact OE1-NZ 3.61Å; E39-K42 PolarHBondContact OE1-NZ 3.01Å; E39-R43 WeakPolarHBondContact O-CB 3.26Å; E39-R43 WeakPolarHBondContact O-CG 3.35Å; E39-R43 PolarHBondContact O-N 2.89Å |
| 40 | L | 88.4 | Confident | 80.9 | Confident | 95 Ų | 95 | 113.7 Ų | 113.7 | 50% | 0.497 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -67.3 | -38.7 | 173.6 | -65.8 | -179.9 | 0 | 0 | 0 | 112.1 | D37 R43 K44 | D37-L40 HydrophobicContact CB-CB 4.23Å; D37-L40 HydrophobicContact CB-CD1 3.93Å; D37-L40 HydrophobicContact CB-CG 3.91Å; D37-L40 WeakPolarHBondContact O-CB 3.33Å; D37-L40 PolarHBondContact O-N 2.72Å; L40-R43 PolarHBondContact O-N 2.92Å; L40-K44 WeakPolarHBondContact O-CG 3.4Å; L40-K44 PolarHBondContact O-N 3.48Å |
| 41 | V | 92.6 | Very high | 82.8 | Confident | 56 Ų | 56 | 108 Ų | 108 | 34% | 0.339 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65 | -45.9 | 176.1 | 176.1 | 0 | 0 | 0 | 0 | 110.7 | I36 D37 M38 R43 K44 R45 | I36-V41 HydrophobicContact CD1-CG2 3.6Å; I36-V41 HydrophobicContact CG1-CG2 3.7Å; D37-V41 PolarHBondContact O-N 3Å; M38-V41 HydrophobicContact CE-CB 4.38Å; M38-V41 HydrophobicContact CE-CG2 3.95Å; M38-V41 PolarHBondContact O-N 3.34Å; V41-R43 PolarHBondContact O-N 2.96Å; V41-K44 PolarHBondContact O-N 3.34Å; V41-R45 WeakPolarHBondContact O-CB 3.47Å; V41-R45 PolarHBondContact O-N 3.39Å |
| 42 | K | 93.6 | Very high | 85.2 | Confident | 111 Ų | 111 | 108.4 Ų | 108.4 | 48% | 0.483 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.3 | -46.3 | 175.6 | -72.2 | 170.9 | -169.6 | 170 | 0 | 111.2 | M38 E39 K44 R45 I46 | M38-K42 WeakPolarHBondContact O-CB 3.21Å; M38-K42 VanDerWaalsContact O-CG 3.22Å; M38-K42 WeakPolarHBondContact O-CG 3.41Å; M38-K42 PolarHBondContact O-N 3.18Å; E39-K42 PolarHBondContact O-N 3.47Å; E39-K42 IonicContact OE1-NZ 3.61Å; E39-K42 PolarHBondContact OE1-NZ 3.01Å; K42-K44 PolarHBondContact O-N 2.83Å; K42-R45 PolarHBondContact O-N 2.69Å; K42-I46 VanDerWaalsContact O-CG1 3.24Å; K42-I46 WeakPolarHBondContact O-CG1 3.33Å; K42-I46 PolarHBondContact O-N 3Å |
| 43 | R | 94.4 | Very high | 87.2 | Confident | 166 Ų | 166 | 106.1 Ų | 106.1 | 63% | 0.626 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.3 | -46.4 | 176.9 | -73.9 | 173.5 | -168.7 | -161.9 | 4.6 | 112.2 | E39 L40 V41 R45 I46 E47 | E39-R43 WeakPolarHBondContact O-CB 3.26Å; E39-R43 WeakPolarHBondContact O-CG 3.35Å; E39-R43 PolarHBondContact O-N 2.89Å; L40-R43 PolarHBondContact O-N 2.92Å; V41-R43 PolarHBondContact O-N 2.96Å; R43-R45 VanDerWaalsContact C-N 3.31Å; R43-R45 PolarHBondContact O-N 2.98Å; R43-I46 PolarHBondContact O-N 3.24Å; R43-E47 PolarHBondContact O-N 3.11Å; R43-E47 VanDerWaalsContact O-N 3.09Å |
| 44 | K | 96.4 | Very high | 89.2 | Confident | 160 Ų | 160 | 102.9 Ų | 102.9 | 70% | 0.696 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.3 | -40.8 | 175.3 | -74.9 | -177.3 | 177.1 | -174.2 | 0 | 112 | L40 V41 K42 E47 A48 | L40-K44 WeakPolarHBondContact O-CG 3.4Å; L40-K44 PolarHBondContact O-N 3.48Å; V41-K44 PolarHBondContact O-N 3.34Å; K42-K44 PolarHBondContact O-N 2.83Å; K44-E47 PolarHBondContact O-N 3.35Å; K44-A48 WeakPolarHBondContact O-CB 3.46Å; K44-A48 PolarHBondContact O-N 3.04Å |
| 45 | R | 97.2 | Very high | 91.1 | Very high | 168 Ų | 168 | 96.8 Ų | 96.8 | 63% | 0.634 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -66.1 | -39.5 | 177.1 | -170.7 | 174.9 | -174.5 | -91.1 | -0.5 | 111.9 | V41 K42 R43 A48 I49 | V41-R45 WeakPolarHBondContact O-CB 3.47Å; V41-R45 PolarHBondContact O-N 3.39Å; K42-R45 PolarHBondContact O-N 2.69Å; R43-R45 VanDerWaalsContact C-N 3.31Å; R43-R45 PolarHBondContact O-N 2.98Å; R45-A48 PolarHBondContact O-N 2.86Å; R45-I49 HydrophobicContact CG-CD1 3.82Å; R45-I49 HydrophobicContact CG-CG1 4.37Å; R45-I49 WeakPolarHBondContact O-CB 3.35Å; R45-I49 VanDerWaalsContact O-CG1 3.24Å; R45-I49 WeakPolarHBondContact O-CG1 3.43Å; R45-I49 PolarHBondContact O-N 3.46Å |
| 46 | I | 96.9 | Very high | 92.9 | Very high | 113 Ų | 113 | 93.3 Ų | 93.3 | 58% | 0.579 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -60.3 | -47.6 | 175.7 | -70.5 | 162.1 | 0 | 0 | 0 | 110.2 | K42 R43 A48 I49 R50 | K42-I46 VanDerWaalsContact O-CG1 3.24Å; K42-I46 WeakPolarHBondContact O-CG1 3.33Å; K42-I46 PolarHBondContact O-N 3Å; R43-I46 PolarHBondContact O-N 3.24Å; I46-A48 PolarHBondContact O-N 2.87Å; I46-I49 PolarHBondContact O-N 2.88Å; I46-R50 WeakPolarHBondContact O-CB 3.43Å; I46-R50 PolarHBondContact O-N 2.9Å |
| 47 | E | 97.2 | Very high | 94.4 | Very high | 112 Ų | 112 | 93.2 Ų | 93.2 | 52% | 0.523 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.5 | -38.7 | 179.9 | -165.1 | 59.1 | -146.9 | 0 | 0 | 112.1 | R43 K44 R50 G51 | R43-E47 PolarHBondContact O-N 3.11Å; R43-E47 VanDerWaalsContact O-N 3.09Å; K44-E47 PolarHBondContact O-N 3.35Å; E47-R50 WeakPolarHBondContact O-CB 3.24Å; E47-R50 PolarHBondContact O-N 2.91Å; E47-R50 IonicContact OE1-NH1 2.76Å; E47-R50 IonicContact OE2-NH1 2.78Å; E47-G51 PolarHBondContact O-N 3.18Å; E47-G51 VanDerWaalsContact O-N 3.13Å |
| 48 | A | 97.3 | Very high | 95.1 | Very high | 64 Ų | 64 | 97.8 Ų | 97.8 | 53% | 0.529 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.4 | -45.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112 | K44 R45 I46 R50 G51 Q52 | K44-A48 WeakPolarHBondContact O-CB 3.46Å; K44-A48 PolarHBondContact O-N 3.04Å; R45-A48 PolarHBondContact O-N 2.86Å; I46-A48 PolarHBondContact O-N 2.87Å; A48-R50 VanDerWaalsContact C-N 3.33Å; A48-R50 PolarHBondContact O-N 3.3Å; A48-G51 PolarHBondContact O-N 3.4Å; A48-Q52 WeakPolarHBondContact O-CB 3.41Å; A48-Q52 PolarHBondContact O-N 3.48Å |
| 49 | I | 97.6 | Very high | 95.3 | Very high | 51 Ų | 51 | 96.5 Ų | 96.5 | 26% | 0.262 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.5 | -38 | 177.9 | -71 | 170.6 | 0 | 0 | 0 | 110.9 | R45 I46 G51 Q52 I53 | R45-I49 HydrophobicContact CG-CD1 3.82Å; R45-I49 HydrophobicContact CG-CG1 4.37Å; R45-I49 WeakPolarHBondContact O-CB 3.35Å; R45-I49 VanDerWaalsContact O-CG1 3.24Å; R45-I49 WeakPolarHBondContact O-CG1 3.43Å; R45-I49 PolarHBondContact O-N 3.46Å; I46-I49 PolarHBondContact O-N 2.88Å; I49-G51 PolarHBondContact O-N 3.35Å; I49-Q52 WeakPolarHBondContact O-CB 3.38Å; I49-Q52 PolarHBondContact O-N 2.85Å; I49-I53 HydrophobicContact CG2-CD1 3.7Å; I49-I53 HydrophobicContact CG2-CG1 4.18Å; I49-I53 WeakPolarHBondContact O-CG1 3.39Å; I49-I53 PolarHBondContact O-N 3.46Å |
| 50 | R | 96.8 | Very high | 95.6 | Very high | 133 Ų | 133 | 97.3 Ų | 97.3 | 50% | 0.502 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -57.5 | -49.2 | 175.5 | -174.9 | -173.6 | -177.7 | -166.7 | 1.8 | 111.2 | I46 E47 A48 Q52 I53 L54 | I46-R50 WeakPolarHBondContact O-CB 3.43Å; I46-R50 PolarHBondContact O-N 2.9Å; E47-R50 WeakPolarHBondContact O-CB 3.24Å; E47-R50 PolarHBondContact O-N 2.91Å; E47-R50 IonicContact OE1-NH1 2.76Å; E47-R50 IonicContact OE2-NH1 2.78Å; A48-R50 VanDerWaalsContact C-N 3.33Å; A48-R50 PolarHBondContact O-N 3.3Å; R50-Q52 VanDerWaalsContact C-N 3.33Å; R50-I53 PolarHBondContact O-N 3.13Å; R50-L54 HydrophobicContact CG-CD1 4.48Å; R50-L54 WeakPolarHBondContact O-CG 3.24Å; R50-L54 PolarHBondContact O-N 3.47Å |
| 51 | G | 96.3 | Very high | 95.8 | Very high | 37 Ų | 37 | 96.5 Ų | 96.5 | 38% | 0.381 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64 | -38 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | E47 A48 I49 S55 | E47-G51 PolarHBondContact O-N 3.18Å; E47-G51 VanDerWaalsContact O-N 3.13Å; A48-G51 PolarHBondContact O-N 3.4Å; I49-G51 PolarHBondContact O-N 3.35Å; G51-S55 VanDerWaalsContact O-CB 3.3Å; G51-S55 WeakPolarHBondContact O-CB 3.2Å; G51-S55 PolarHBondContact O-N 2.9Å; G51-S55 PolarHBondContact O-OG 3.4Å |
| 52 | Q | 96.8 | Very high | 95.9 | Very high | 94 Ų | 94 | 97.8 Ų | 97.8 | 44% | 0.439 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.8 | -44.2 | 177.3 | -172 | 179.8 | -1.3 | 0 | 0 | 112.4 | A48 I49 R50 S55 K56 | A48-Q52 WeakPolarHBondContact O-CB 3.41Å; A48-Q52 PolarHBondContact O-N 3.48Å; I49-Q52 WeakPolarHBondContact O-CB 3.38Å; I49-Q52 PolarHBondContact O-N 2.85Å; R50-Q52 VanDerWaalsContact C-N 3.33Å; Q52-S55 WeakPolarHBondContact CA-OG 3.4Å; Q52-S55 PolarHBondContact O-OG 3Å; Q52-K56 HydrophobicContact CG-CD 4.33Å; Q52-K56 VanDerWaalsContact O-CB 3.31Å; Q52-K56 WeakPolarHBondContact O-CB 3.42Å; Q52-K56 VanDerWaalsContact O-CG 3.24Å; Q52-K56 WeakPolarHBondContact O-CG 3.44Å; Q52-K56 PolarHBondContact O-N 3.43Å |
| 53 | I | 96.8 | Very high | 95.8 | Very high | 89 Ų | 89 | 97 Ų | 97 | 46% | 0.456 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -48.5 | 178.4 | -68 | 167.7 | 0 | 0 | 0 | 110.1 | I49 R50 S55 K56 L57 | I49-I53 HydrophobicContact CG2-CD1 3.7Å; I49-I53 HydrophobicContact CG2-CG1 4.18Å; I49-I53 WeakPolarHBondContact O-CG1 3.39Å; I49-I53 PolarHBondContact O-N 3.46Å; R50-I53 PolarHBondContact O-N 3.13Å; I53-S55 PolarHBondContact O-N 3.31Å; I53-K56 PolarHBondContact O-N 3.09Å; I53-L57 HydrophobicContact CG2-CD1 3.89Å; I53-L57 WeakPolarHBondContact O-CB 3.23Å; I53-L57 WeakPolarHBondContact O-CG 3.22Å; I53-L57 PolarHBondContact O-N 3.28Å |
| 54 | L | 97.1 | Very high | 95.6 | Very high | 29 Ų | 29 | 94 Ų | 94 | 15% | 0.152 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -63.1 | -43 | -179.1 | -71.6 | 177.8 | 0 | 0 | 0 | 112.3 | R50 L57 R58 L59 | R50-L54 HydrophobicContact CG-CD1 4.48Å; R50-L54 WeakPolarHBondContact O-CG 3.24Å; R50-L54 PolarHBondContact O-N 3.47Å; L54-L57 CarbonylContact O-C 3.56Å; L54-L57 PolarHBondContact O-N 3.35Å; L54-R58 PolarHBondContact O-N 2.88Å; L54-L59 WeakPolarHBondContact CB-O 3.04Å; L54-L59 HydrophobicContact CD2-CB 3.99Å; L54-L59 PolarHBondContact O-N 3.46Å |
| 55 | S | 96.4 | Very high | 95.2 | Very high | 44 Ų | 44 | 94.2 Ų | 94.2 | 31% | 0.308 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.1 | -40.5 | 176.3 | 53.8 | 0 | 0 | 0 | 0 | 112.7 | G51 Q52 I53 L57 R58 Y103 Y104 | G51-S55 VanDerWaalsContact O-CB 3.3Å; G51-S55 WeakPolarHBondContact O-CB 3.2Å; G51-S55 PolarHBondContact O-N 2.9Å; G51-S55 PolarHBondContact O-OG 3.4Å; Q52-S55 WeakPolarHBondContact CA-OG 3.4Å; Q52-S55 PolarHBondContact O-OG 3Å; I53-S55 PolarHBondContact O-N 3.31Å; S55-L57 VanDerWaalsContact C-N 3.32Å; S55-L57 PolarHBondContact O-N 2.89Å; S55-R58 PolarHBondContact O-N 3.48Å; S55-Y103 PolarHBondContact OG-OH 3.37Å; S55-Y103 VanDerWaalsContact OG-OH 3.12Å; S55-Y104 WeakPolarHBondContact O-CD1 3.47Å; S55-Y104 WeakPolarHBondContact O-CE1 3.38Å |
| 56 | K | 96.8 | Very high | 94.5 | Very high | 71 Ų | 71 | 90 Ų | 90 | 31% | 0.309 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.5 | -38.4 | 173.8 | -78.5 | -173.5 | 165.6 | -73.8 | 0 | 112.6 | Q52 I53 R58 Y103 A105 | Q52-K56 HydrophobicContact CG-CD 4.33Å; Q52-K56 VanDerWaalsContact O-CB 3.31Å; Q52-K56 WeakPolarHBondContact O-CB 3.42Å; Q52-K56 VanDerWaalsContact O-CG 3.24Å; Q52-K56 WeakPolarHBondContact O-CG 3.44Å; Q52-K56 PolarHBondContact O-N 3.43Å; I53-K56 PolarHBondContact O-N 3.09Å; K56-R58 VanDerWaalsContact C-N 3.32Å; K56-Y103 HydrophobicContact CG-CE1 4.45Å; K56-Y103 WeakPolarHBondContact CG-O 3.46Å; K56-Y103 PolarHBondContact NZ-O 2.89Å; K56-A105 PolarHBondContact O-N 2.83Å |
| 57 | L | 95.9 | Very high | 93.8 | Very high | 93 Ų | 93 | 93.4 Ų | 93.4 | 49% | 0.487 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | -3.6 | 177.7 | -64.2 | 176.4 | 0 | 0 | 0 | 113.8 | I53 L54 S55 L59 A105 | I53-L57 HydrophobicContact CG2-CD1 3.89Å; I53-L57 WeakPolarHBondContact O-CB 3.23Å; I53-L57 WeakPolarHBondContact O-CG 3.22Å; I53-L57 PolarHBondContact O-N 3.28Å; L54-L57 CarbonylContact O-C 3.56Å; L54-L57 PolarHBondContact O-N 3.35Å; S55-L57 VanDerWaalsContact C-N 3.32Å; S55-L57 PolarHBondContact O-N 2.89Å; L57-L59 VanDerWaalsContact C-N 3.26Å; L57-L59 HydrophobicContact CB-CD1 3.94Å; L57-L59 HydrophobicContact CB-CG 3.93Å; L57-L59 HydrophobicContact CD1-CD1 4.17Å; L57-L59 PolarHBondContact O-N 2.97Å; L57-A105 HydrophobicContact CD2-CB 3.8Å |
| 58 | R | 95.5 | Very high | 93.3 | Very high | 180 Ų | 180 | 92.7 Ų | 92.7 | 68% | 0.679 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.6 | 35.7 | -174.1 | -56.9 | 179.8 | 171.9 | 174.3 | -2.3 | 113.5 | L54 S55 K56 Y104 | L54-R58 PolarHBondContact O-N 2.88Å; S55-R58 PolarHBondContact O-N 3.48Å; K56-R58 VanDerWaalsContact C-N 3.32Å; R58-Y104 HydrophobicContact CG-CD1 3.43Å; R58-Y104 VanDerWaalsContact CG-CD1 3.43Å; R58-Y104 HydrophobicContact CG-CE1 3.57Å; R58-Y104 HydrophobicContact CG-CG 4.34Å; R58-Y104 VanDerWaalsContact NE-CD1 3.27Å |
| 59 | L | 94.4 | Very high | 92.9 | Very high | 70 Ų | 70 | 94.7 Ų | 94.7 | 37% | 0.366 | 54% | 0.542 | S | S | . | . | trans | -106.3 | 136.3 | 178 | -62.1 | 177.4 | 0 | 0 | 0 | 110.4 | L54 L57 | L54-L59 WeakPolarHBondContact CB-O 3.04Å; L54-L59 HydrophobicContact CD2-CB 3.99Å; L54-L59 PolarHBondContact O-N 3.46Å; L57-L59 VanDerWaalsContact C-N 3.26Å; L57-L59 HydrophobicContact CB-CD1 3.94Å; L57-L59 HydrophobicContact CB-CG 3.93Å; L57-L59 HydrophobicContact CD1-CD1 4.17Å; L57-L59 PolarHBondContact O-N 2.97Å | ||
| 60 | A | 93.4 | Very high | 92.4 | Very high | 108 Ų | 108 | 98.8 Ų | 98.8 | 89% | 0.893 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -78.6 | -31.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 61 | S | 93.3 | Very high | 92 | Very high | 78 Ų | 78 | 95.1 Ų | 95.1 | 55% | 0.545 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -146.3 | 160.3 | 179.8 | 59.6 | 0 | 0 | 0 | 0 | 110.4 | ||
| 62 | P | 93.4 | Very high | 91.8 | Very high | 82 Ų | 82 | 99.6 Ų | 99.6 | 53% | 0.532 | 60% | 0.598 | S | S | . | * | P | Polyproline II helix | trans | -55.6 | 138.4 | 172.5 | -23.7 | 34.2 | 0 | 0 | 0 | 111.5 | ||
| 63 | P | 91.9 | Very high | 91.6 | Very high | 95 Ų | 95 | 100.2 Ų | 100.2 | 62% | 0.617 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 152.9 | 178.8 | 29.9 | -32.8 | 0 | 0 | 0 | 110.9 | ||
| 64 | S | 90.9 | Very high | 91.5 | Very high | 103 Ų | 103 | 100.1 Ų | 100.1 | 72% | 0.72 | 61% | 0.609 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 131.1 | 175.4 | 50 | 0 | 0 | 0 | 0 | 111.1 | G66 | S64-G66 VanDerWaalsContact C-N 3.34Š|
| 65 | Q | 88 | Confident | 91.3 | Very high | 164 Ų | 164 | 106.7 Ų | 106.7 | 77% | 0.766 | 64% | 0.639 | S | S | * | * | trans | -89 | 3.5 | 177.9 | -65.6 | -174.1 | -15.9 | 0 | 0 | 113.8 | E67 V68 | Q65-E67 PolarHBondContact O-N 2.89Å; Q65-V68 HydrophobicContact CB-CG2 4.38Å; Q65-V68 WeakPolarHBondContact O-CB 2.97Å; Q65-V68 PolarHBondContact O-N 3.18Å; Q65-V68 VanDerWaalsContact O-N 3.09Å | ||
| 66 | G | 81.7 | Confident | 91.1 | Very high | 80 Ų | 80 | 107.4 Ų | 107.4 | 83% | 0.825 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | -24.3 | -173 | 0 | 0 | 0 | 0 | 0 | 114.9 | S64 | S64-G66 VanDerWaalsContact C-N 3.34Š|
| 67 | E | 82.4 | Confident | 90.9 | Very high | 185 Ų | 185 | 107.4 Ų | 107.4 | 86% | 0.864 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.7 | -2.6 | 178.5 | -65.4 | 178.8 | -180 | 0 | 0 | 113.1 | Q65 P69 | Q65-E67 PolarHBondContact O-N 2.89Å; E67-P69 WeakPolarHBondContact O-CD 3.41Å |
| 68 | V | 87.3 | Confident | 90.9 | Very high | 97 Ų | 97 | 106.6 Ų | 106.6 | 59% | 0.588 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -76.9 | 121.1 | -179.1 | -179 | 0 | 0 | 0 | 0 | 108.7 | Q65 | Q65-V68 HydrophobicContact CB-CG2 4.38Å; Q65-V68 WeakPolarHBondContact O-CB 2.97Å; Q65-V68 PolarHBondContact O-N 3.18Å; Q65-V68 VanDerWaalsContact O-N 3.09Å |
| 69 | P | 87.8 | Confident | 90.7 | Very high | 106 Ų | 106 | 99.8 Ų | 99.8 | 69% | 0.688 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 131.6 | 179.7 | 24.3 | -32.3 | 0 | 0 | 0 | 110 | E67 | E67-P69 WeakPolarHBondContact O-CD 3.41Š|
| 70 | P | 87 | Confident | 90.8 | Very high | 136 Ų | 136 | 98.2 Ų | 98.2 | 88% | 0.883 | 62% | 0.623 | S | S | * | * | S | Bend | trans | -70.5 | 133.3 | 174.4 | 29.4 | -33.2 | 0 | 0 | 0 | 109.4 | ||
| 71 | G | 88.6 | Confident | 90.8 | Very high | 57 Ų | 57 | 100 Ų | 100 | 59% | 0.588 | 61% | 0.608 | S | S | * | * | S | Bend | trans | 140.5 | -173.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 72 | P | 91.5 | Very high | 90.8 | Very high | 131 Ų | 131 | 99.5 Ų | 99.5 | 85% | 0.851 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 145.8 | 175.6 | 28 | -33.1 | 0 | 0 | 0 | 111 | ||
| 73 | L | 93.2 | Very high | 90.7 | Very high | 107 Ų | 107 | 98 Ų | 98 | 56% | 0.56 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 148.3 | 173.9 | -83.7 | 74.5 | 0 | 0 | 0 | 110.3 | E75 V77 L78 | L73-E75 PolarHBondContact O-N 3.44Å; L73-V77 HydrophobicContact CD2-CG1 4.1Å; L73-L78 HydrophobicContact CB-CD2 4.17Å; L73-L78 HydrophobicContact CB-CG 4.16Å |
| 74 | P | 94.1 | Very high | 90.7 | Very high | 87 Ų | 87 | 95.8 Ų | 95.8 | 57% | 0.565 | 58% | 0.575 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 138.9 | 174.6 | -23.3 | 32.9 | 0 | 0 | 0 | 112 | A76 V77 L78 | P74-A76 PolarHBondContact O-N 3.47Å; P74-A76 VanDerWaalsContact O-N 3.13Å; P74-V77 HydrophobicContact CB-CG2 4.23Å; P74-V77 HydrophobicContact CG-CG2 4.34Å; P74-V77 WeakPolarHBondContact O-CB 3.32Å; P74-V77 PolarHBondContact O-N 3.33Å; P74-L78 PolarHBondContact O-N 2.92Å; P74-L78 VanDerWaalsContact O-N 3.16Å |
| 75 | E | 93.6 | Very high | 90.6 | Very high | 167 Ų | 167 | 97 Ų | 97 | 78% | 0.78 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -56.3 | -33.9 | -179.1 | -69.3 | -171.2 | 175.8 | 0 | 0 | 112.9 | L73 V77 L78 A79 | L73-E75 PolarHBondContact O-N 3.44Å; E75-V77 VanDerWaalsContact C-N 3.29Å; E75-V77 PolarHBondContact O-N 2.88Å; E75-L78 PolarHBondContact O-N 3.34Å; E75-A79 VanDerWaalsContact O-CB 3.3Å; E75-A79 WeakPolarHBondContact O-CB 3.23Å; E75-A79 PolarHBondContact O-N 2.98Å |
| 76 | A | 92 | Very high | 90.5 | Very high | 59 Ų | 59 | 93.3 Ų | 93.3 | 49% | 0.488 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.4 | -38.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | P74 L80 | P74-A76 PolarHBondContact O-N 3.47Å; P74-A76 VanDerWaalsContact O-N 3.13Å; A76-L80 WeakPolarHBondContact O-CB 3.44Å; A76-L80 PolarHBondContact O-N 3.18Å; A76-L80 VanDerWaalsContact O-N 3.12Å |
| 77 | V | 93.9 | Very high | 90.6 | Very high | 70 Ų | 70 | 98 Ų | 98 | 42% | 0.424 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -72.3 | -43 | 177.3 | 179.2 | 0 | 0 | 0 | 0 | 110.2 | L73 P74 E75 A79 L80 Y81 | L73-V77 HydrophobicContact CD2-CG1 4.1Å; P74-V77 HydrophobicContact CB-CG2 4.23Å; P74-V77 HydrophobicContact CG-CG2 4.34Å; P74-V77 WeakPolarHBondContact O-CB 3.32Å; P74-V77 PolarHBondContact O-N 3.33Å; E75-V77 VanDerWaalsContact C-N 3.29Å; E75-V77 PolarHBondContact O-N 2.88Å; V77-A79 PolarHBondContact O-N 3.48Å; V77-L80 PolarHBondContact O-N 2.95Å; V77-Y81 WeakPolarHBondContact O-CB 3.44Å; V77-Y81 PolarHBondContact O-N 3.48Å |
| 78 | L | 94.3 | Very high | 90.2 | Very high | 77 Ų | 77 | 94.6 Ų | 94.6 | 40% | 0.403 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.3 | -44.3 | 176.4 | -68.2 | 174.3 | 0 | 0 | 0 | 111.8 | L73 P74 E75 L80 Y81 N82 | L73-L78 HydrophobicContact CB-CD2 4.17Å; L73-L78 HydrophobicContact CB-CG 4.16Å; P74-L78 PolarHBondContact O-N 2.92Å; P74-L78 VanDerWaalsContact O-N 3.16Å; E75-L78 PolarHBondContact O-N 3.34Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 2.76Å; L78-Y81 PolarHBondContact O-N 2.67Å; L78-N82 WeakPolarHBondContact O-CB 3.32Å; L78-N82 VanDerWaalsContact O-CG 3.22Å; L78-N82 PolarHBondContact O-N 3.28Å; L78-N82 PolarHBondContact O-ND2 3.19Å |
| 79 | A | 92.9 | Very high | 89.6 | Confident | 36 Ų | 36 | 93.7 Ų | 93.7 | 30% | 0.298 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.4 | -39.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E75 V77 S83 R110 | E75-A79 VanDerWaalsContact O-CB 3.3Å; E75-A79 WeakPolarHBondContact O-CB 3.23Å; E75-A79 PolarHBondContact O-N 2.98Å; V77-A79 PolarHBondContact O-N 3.48Å; A79-S83 PolarHBondContact O-N 2.76Å; A79-S83 PolarHBondContact O-OG 3.11Å; A79-R110 VanDerWaalsContact CB-NH1 3.28Å |
| 80 | L | 94.8 | Very high | 88.4 | Confident | 38 Ų | 38 | 91.2 Ų | 91.2 | 20% | 0.199 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -65.8 | -42.7 | 174.8 | -178 | 63.6 | 0 | 0 | 0 | 112.4 | A76 V77 L78 S83 T84 V108 R110 | A76-L80 WeakPolarHBondContact O-CB 3.44Å; A76-L80 PolarHBondContact O-N 3.18Å; A76-L80 VanDerWaalsContact O-N 3.12Å; V77-L80 PolarHBondContact O-N 2.95Å; L78-L80 VanDerWaalsContact C-N 3.34Å; L78-L80 PolarHBondContact O-N 2.76Å; L80-S83 WeakPolarHBondContact CA-OG 3.38Å; L80-S83 PolarHBondContact O-OG 3.1Å; L80-T84 PolarHBondContact O-N 2.96Å; L80-T84 PolarHBondContact O-OG1 2.82Å; L80-V108 HydrophobicContact CD1-CG1 3.98Å; L80-V108 WeakPolarHBondContact CD2-O 3.44Å; L80-V108 HydrophobicContact CG-CG1 4.46Å; L80-R110 HydrophobicContact CD1-CB 3.79Å; L80-R110 HydrophobicContact CD1-CG 3.89Å |
| 81 | Y | 94.4 | Very high | 86.9 | Confident | 146 Ų | 146 | 90.3 Ų | 90.3 | 57% | 0.573 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.2 | -47.6 | 175.7 | 174.6 | -98.7 | 0 | 0 | 0 | 111.2 | V77 L78 S83 T84 R85 | V77-Y81 WeakPolarHBondContact O-CB 3.44Å; V77-Y81 PolarHBondContact O-N 3.48Å; L78-Y81 PolarHBondContact O-N 2.67Å; Y81-S83 PolarHBondContact O-N 2.89Å; Y81-T84 PolarHBondContact O-N 2.68Å; Y81-T84 VanDerWaalsContact O-N 3.15Å; Y81-R85 WeakPolarHBondContact O-CB 3.18Å; Y81-R85 PolarHBondContact O-N 2.73Å |
| 82 | N | 93.3 | Very high | 85.3 | Confident | 66 Ų | 66 | 93.4 Ų | 93.4 | 35% | 0.353 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.6 | -45.9 | 178.5 | -71.1 | -18.5 | 0 | 0 | 0 | 111.3 | L78 T84 R85 D86 | L78-N82 WeakPolarHBondContact O-CB 3.32Å; L78-N82 VanDerWaalsContact O-CG 3.22Å; L78-N82 PolarHBondContact O-N 3.28Å; L78-N82 PolarHBondContact O-ND2 3.19Å; N82-T84 VanDerWaalsContact C-N 3.26Å; N82-T84 PolarHBondContact O-N 2.83Å; N82-R85 PolarHBondContact O-N 3Å; N82-D86 WeakPolarHBondContact O-CB 3.37Å; N82-D86 PolarHBondContact O-N 2.9Å |
| 83 | S | 91.1 | Very high | 83.5 | Confident | 52 Ų | 52 | 90.9 Ų | 90.9 | 36% | 0.364 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -35.3 | 176.4 | 59.8 | 0 | 0 | 0 | 0 | 112.9 | A79 L80 Y81 R87 | A79-S83 PolarHBondContact O-N 2.76Å; A79-S83 PolarHBondContact O-OG 3.11Å; L80-S83 WeakPolarHBondContact CA-OG 3.38Å; L80-S83 PolarHBondContact O-OG 3.1Å; Y81-S83 PolarHBondContact O-N 2.89Å; S83-R87 WeakPolarHBondContact O-CG 3.26Å; S83-R87 PolarHBondContact O-N 2.99Å |
| 84 | T | 91 | Very high | 81.6 | Confident | 47 Ų | 47 | 93.2 Ų | 93.2 | 29% | 0.288 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -71.4 | -46 | 178.5 | -53.6 | 0 | 0 | 0 | 0 | 110.9 | L80 Y81 N82 D86 R87 V88 | L80-T84 PolarHBondContact O-N 2.96Å; L80-T84 PolarHBondContact O-OG1 2.82Å; Y81-T84 PolarHBondContact O-N 2.68Å; Y81-T84 VanDerWaalsContact O-N 3.15Å; N82-T84 VanDerWaalsContact C-N 3.26Å; N82-T84 PolarHBondContact O-N 2.83Å; T84-D86 VanDerWaalsContact C-N 3.33Å; T84-D86 PolarHBondContact O-N 2.67Å; T84-R87 PolarHBondContact O-N 2.74Å; T84-V88 WeakPolarHBondContact O-CG2 3.34Å; T84-V88 PolarHBondContact O-N 2.92Å |
| 85 | R | 89.6 | Confident | 79.7 | Confident | 129 Ų | 129 | 94.8 Ų | 94.8 | 49% | 0.487 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 177.7 | -175.1 | -166 | 67.6 | 172.1 | -2.5 | 111.4 | Y81 N82 V88 A89 | Y81-R85 WeakPolarHBondContact O-CB 3.18Å; Y81-R85 PolarHBondContact O-N 2.73Å; N82-R85 PolarHBondContact O-N 3Å; R85-V88 PolarHBondContact O-N 3.43Å; R85-A89 VanDerWaalsContact O-CB 3.26Å; R85-A89 WeakPolarHBondContact O-CB 3.37Å; R85-A89 PolarHBondContact O-N 2.98Å |
| 86 | D | 87.1 | Confident | 78 | Confident | 86 Ų | 86 | 93.7 Ų | 93.7 | 46% | 0.46 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -70.2 | -33.6 | -176.3 | -61.7 | -12.3 | 0 | 0 | 0 | 111.3 | N82 T84 G90 | N82-D86 WeakPolarHBondContact O-CB 3.37Å; N82-D86 PolarHBondContact O-N 2.9Å; T84-D86 VanDerWaalsContact C-N 3.33Å; T84-D86 PolarHBondContact O-N 2.67Å; D86-G90 PolarHBondContact O-N 2.81Å |
| 87 | R | 81.8 | Confident | 76.3 | Confident | 180 Ų | 180 | 96.5 Ų | 96.5 | 68% | 0.679 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62 | -53.8 | 168.8 | -73.1 | 173.4 | 70.3 | 118.5 | 5.8 | 111.4 | S83 T84 A89 G90 E91 | S83-R87 WeakPolarHBondContact O-CG 3.26Å; S83-R87 PolarHBondContact O-N 2.99Å; T84-R87 PolarHBondContact O-N 2.74Å; R87-A89 PolarHBondContact O-N 3.38Å; R87-G90 PolarHBondContact O-N 2.81Å; R87-G90 VanDerWaalsContact O-N 3.11Å; R87-E91 WeakPolarHBondContact O-CB 2.94Å; R87-E91 PolarHBondContact O-N 3.28Å |
| 88 | V | 75.2 | Confident | 74.7 | Confident | 113 Ų | 113 | 100.4 Ų | 100.4 | 69% | 0.685 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.9 | -32.8 | 179.9 | 174.4 | 0 | 0 | 0 | 0 | 112.3 | T84 R85 | T84-V88 WeakPolarHBondContact O-CG2 3.34Å; T84-V88 PolarHBondContact O-N 2.92Å; R85-V88 PolarHBondContact O-N 3.43Å |
| 89 | A | 75 | Confident | 73.5 | Confident | 77 Ų | 77 | 102.1 Ų | 102.1 | 64% | 0.636 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -80.2 | -30.1 | 177 | 0 | 0 | 0 | 0 | 0 | 113.5 | R85 R87 | R85-A89 VanDerWaalsContact O-CB 3.26Å; R85-A89 WeakPolarHBondContact O-CB 3.37Å; R85-A89 PolarHBondContact O-N 2.98Å; R87-A89 PolarHBondContact O-N 3.38Å |
| 90 | G | 62 | Low | 72.5 | Confident | 55 Ų | 55 | 109.6 Ų | 109.6 | 57% | 0.567 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -86.2 | -16.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | D86 R87 S92 | D86-G90 PolarHBondContact O-N 2.81Å; R87-G90 PolarHBondContact O-N 2.81Å; R87-G90 VanDerWaalsContact O-N 3.11Å; G90-S92 PolarHBondContact O-N 3.44Å |
| 91 | E | 56.6 | Low | 71.5 | Confident | 116 Ų | 116 | 111.9 Ų | 111.9 | 54% | 0.542 | 63% | 0.626 | S | S | . | * | trans | -80.6 | 52.6 | -177.5 | -152.1 | 145.4 | -179.3 | 0 | 0 | 112.5 | R87 | R87-E91 WeakPolarHBondContact O-CB 2.94Å; R87-E91 PolarHBondContact O-N 3.28Å | ||
| 92 | S | 54 | Low | 71.1 | Confident | 122 Ų | 122 | 109.8 Ų | 109.8 | 85% | 0.853 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -99.1 | 5.6 | 166.8 | -98.9 | 0 | 0 | 0 | 0 | 113.2 | G90 | G90-S92 PolarHBondContact O-N 3.44Š|
| 93 | A | 54.2 | Low | 71 | Confident | 78 Ų | 78 | 112.4 Ų | 112.4 | 65% | 0.645 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -114.4 | -29.3 | -164.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||
| 94 | E | 51.8 | Low | 71.1 | Confident | 156 Ų | 156 | 115 Ų | 115 | 73% | 0.729 | 63% | 0.633 | S | S | * | * | trans | -148.8 | 115.8 | 176.9 | -81.6 | -64.4 | 146.7 | 0 | 0 | 109.9 | E96 | E94-E96 VanDerWaalsContact C-N 3.29Å; E94-E96 PolarHBondContact O-N 2.81Å | ||
| 95 | P | 55.2 | Low | 71.1 | Confident | 120 Ų | 120 | 115.6 Ų | 115.6 | 78% | 0.779 | 64% | 0.642 | S | S | * | * | trans | -74.2 | 89.5 | 169.8 | 31.1 | -28.8 | 0 | 0 | 0 | 107.6 | ||||
| 96 | E | 57.6 | Low | 71.3 | Confident | 145 Ų | 145 | 116.3 Ų | 116.3 | 68% | 0.678 | 65% | 0.649 | S | S | * | * | trans | -50.3 | 139.6 | 155.6 | -92.5 | -86.9 | 148.4 | 0 | 0 | 107.5 | E94 E98 | E94-E96 VanDerWaalsContact C-N 3.29Å; E94-E96 PolarHBondContact O-N 2.81Å; E96-E98 PolarHBondContact O-N 2.88Å | ||
| 97 | P | 56.5 | Low | 71.4 | Confident | 118 Ų | 118 | 120.5 Ų | 120.5 | 77% | 0.766 | 67% | 0.666 | S | S | * | * | trans | -70.2 | 70.9 | 176.3 | 29.7 | -33.5 | 0 | 0 | 0 | 109.3 | ||||
| 98 | E | 60 | Low | 71.9 | Confident | 151 Ų | 151 | 115.7 Ų | 115.7 | 71% | 0.706 | 66% | 0.656 | S | S | * | * | trans | -67.9 | 132.8 | 172 | -79.7 | -145.6 | 146.1 | 0 | 0 | 108.4 | E96 | E96-E98 PolarHBondContact O-N 2.88Š| ||
| 99 | P | 68.8 | Low | 72.7 | Confident | 114 Ų | 114 | 115.3 Ų | 115.3 | 74% | 0.74 | 65% | 0.654 | S | S | * | * | trans | -56.6 | 150.5 | 168.6 | 26.6 | -33.7 | 0 | 0 | 0 | 109.5 | A101 | P99-A101 PolarHBondContact O-N 2.94Š| ||
| 100 | E | 72.4 | Confident | 73.4 | Confident | 192 Ų | 192 | 117.2 Ų | 117.2 | 90% | 0.897 | 65% | 0.645 | S | S | * | * | trans | -43.9 | 115.9 | 177.6 | -64.3 | -179.7 | -179.9 | 0 | 0 | 110.6 | D102 | E100-D102 PolarHBondContact O-N 3.44Š| ||
| 101 | A | 73.9 | Confident | 74.7 | Confident | 87 Ų | 87 | 121.2 Ų | 121.2 | 72% | 0.719 | 66% | 0.658 | S | S | * | * | trans | -60.2 | 131.8 | -174.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | P99 Y103 | P99-A101 PolarHBondContact O-N 2.94Å; A101-Y103 PolarHBondContact O-N 3.26Å | ||
| 102 | D | 85.8 | Confident | 76.2 | Confident | 102 Ų | 102 | 122.1 Ų | 122.1 | 55% | 0.545 | 67% | 0.666 | S | S | . | * | trans | -53.7 | 139 | 178.5 | -64.1 | -60 | 0 | 0 | 0 | 111.2 | E100 Y104 K106 | E100-D102 PolarHBondContact O-N 3.44Å; D102-Y104 PolarHBondContact O-N 3.42Å; D102-K106 WeakPolarHBondContact OD2-CE 3.27Å; D102-K106 IonicContact OD2-NZ 3.83Å; D102-K106 PolarHBondContact OD2-NZ 2.83Å | ||
| 103 | Y | 90.8 | Very high | 77.9 | Confident | 120 Ų | 120 | 125.3 Ų | 125.3 | 47% | 0.471 | 67% | 0.67 | S | S | . | * | S | Bend | trans | -58.6 | -34.1 | -179 | 176.9 | -101.1 | 0 | 0 | 0 | 113 | S55 K56 A101 | S55-Y103 PolarHBondContact OG-OH 3.37Å; S55-Y103 VanDerWaalsContact OG-OH 3.12Å; K56-Y103 HydrophobicContact CG-CE1 4.45Å; K56-Y103 WeakPolarHBondContact CG-O 3.46Å; K56-Y103 PolarHBondContact NZ-O 2.89Å; A101-Y103 PolarHBondContact O-N 3.26Å |
| 104 | Y | 94 | Very high | 79.7 | Confident | 107 Ų | 107 | 128.3 Ų | 128.3 | 42% | 0.42 | 68% | 0.68 | S | S | . | * | S | Bend | trans | -82.3 | 153.4 | -176.1 | -64.6 | -72.8 | 0 | 0 | 0 | 112.9 | S55 R58 D102 | S55-Y104 WeakPolarHBondContact O-CD1 3.47Å; S55-Y104 WeakPolarHBondContact O-CE1 3.38Å; R58-Y104 HydrophobicContact CG-CD1 3.43Å; R58-Y104 VanDerWaalsContact CG-CD1 3.43Å; R58-Y104 HydrophobicContact CG-CE1 3.57Å; R58-Y104 HydrophobicContact CG-CG 4.34Å; R58-Y104 VanDerWaalsContact NE-CD1 3.27Å; D102-Y104 PolarHBondContact O-N 3.42Å |
| 105 | A | 91.7 | Very high | 81.2 | Confident | 59 Ų | 59 | 129.4 Ų | 129.4 | 49% | 0.488 | 69% | 0.685 | S | S | . | * | trans | -63.9 | 144.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | K56 L57 | K56-A105 PolarHBondContact O-N 2.83Å; L57-A105 HydrophobicContact CD2-CB 3.8Å | ||
| 106 | K | 92 | Very high | 82.3 | Confident | 144 Ų | 144 | 129.3 Ų | 129.3 | 63% | 0.626 | 68% | 0.682 | S | S | * | * | trans | -107.8 | 140.3 | 172.8 | -64.6 | -174.3 | 179.1 | -177.3 | 0 | 109.4 | D102 | D102-K106 WeakPolarHBondContact OD2-CE 3.27Å; D102-K106 IonicContact OD2-NZ 3.83Å; D102-K106 PolarHBondContact OD2-NZ 2.83Å | ||
| 107 | E | 90.8 | Very high | 82.6 | Confident | 175 Ų | 175 | 130.5 Ų | 130.5 | 82% | 0.818 | 69% | 0.687 | S | S | * | * | trans | -73.7 | 130.3 | 170.5 | -173.3 | 178.4 | 175.9 | 0 | 0 | 109.2 | T109 | E107-T109 HydrophobicContact CG-CG2 4.42Š| ||
| 108 | V | 92 | Very high | 82.7 | Confident | 78 Ų | 78 | 132 Ų | 132 | 47% | 0.473 | 69% | 0.689 | S | S | . | * | trans | -99.7 | 129.1 | 178.1 | -170.9 | 0 | 0 | 0 | 0 | 108.1 | L80 | L80-V108 HydrophobicContact CD1-CG1 3.98Å; L80-V108 WeakPolarHBondContact CD2-O 3.44Å; L80-V108 HydrophobicContact CG-CG1 4.46Å | ||
| 109 | T | 91.5 | Very high | 82 | Confident | 105 Ų | 105 | 127.6 Ų | 127.6 | 64% | 0.644 | 68% | 0.684 | S | S | * | * | trans | -133.1 | 154.1 | 173.9 | 53.1 | 0 | 0 | 0 | 0 | 109.4 | E107 | E107-T109 HydrophobicContact CG-CG2 4.42Š| ||
| 110 | R | 89.1 | Confident | 81.1 | Confident | 118 Ų | 118 | 131.6 Ų | 131.6 | 45% | 0.445 | 69% | 0.693 | S | S | . | * | trans | -124.5 | 140.1 | 176.1 | 67.1 | 179.8 | -173.5 | 165.1 | 5.3 | 110.6 | A79 L80 | A79-R110 VanDerWaalsContact CB-NH1 3.28Å; L80-R110 HydrophobicContact CD1-CB 3.79Å; L80-R110 HydrophobicContact CD1-CG 3.89Å | ||
| 111 | V | 90.4 | Very high | 79.8 | Confident | 139 Ų | 139 | 130.4 Ų | 130.4 | 84% | 0.842 | 69% | 0.692 | S | S | * | * | trans | -118.1 | 127.8 | 173.8 | -176.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 112 | L | 87.7 | Confident | 78.3 | Confident | 135 Ų | 135 | 130.1 Ų | 130.1 | 71% | 0.707 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 146.7 | 177.7 | -59.4 | 178.4 | 0 | 0 | 0 | 109.8 | ||
| 113 | M | 90.7 | Very high | 75.9 | Confident | 189 Ų | 189 | 128.9 Ų | 128.9 | 93% | 0.931 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -71 | 153 | 173.8 | -65.1 | -178.4 | 174.7 | 0 | 0 | 110.5 | ||
| 114 | V | 90.4 | Very high | 73.9 | Confident | 140 Ų | 140 | 128.8 Ų | 128.8 | 85% | 0.848 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 137.3 | 174.8 | -179.6 | 0 | 0 | 0 | 0 | 109.4 | T116 | V114-T116 PolarHBondContact O-N 3.34Š|
| 115 | E | 84.6 | Confident | 71.4 | Confident | 179 Ų | 179 | 127.2 Ų | 127.2 | 84% | 0.836 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 123.7 | -179.2 | -167.4 | 158.8 | -157.2 | 0 | 0 | 111.1 | H117 | E115-H117 PolarHBondContact O-N 3.09Å; E115-H117 VanDerWaalsContact O-N 3.14Å |
| 116 | T | 78.2 | Confident | 69.1 | Low | 118 Ų | 118 | 133.1 Ų | 133.1 | 72% | 0.724 | 77% | 0.766 | S | S | * | * | trans | -75.3 | 101.9 | 174.3 | -44.6 | 0 | 0 | 0 | 0 | 108.3 | V114 N118 | V114-T116 PolarHBondContact O-N 3.34Å; T116-N118 VanDerWaalsContact C-N 3.3Å; T116-N118 PolarHBondContact O-N 3.03Å | ||
| 117 | H | 64.1 | Low | 67.2 | Low | 170 Ų | 170 | 132.1 Ų | 132.1 | 79% | 0.787 | 78% | 0.775 | S | S | * | * | trans | -68.6 | 91.5 | 166.3 | 63.2 | -77.4 | 0 | 0 | 0 | 108.2 | E115 G119 | E115-H117 PolarHBondContact O-N 3.09Å; E115-H117 VanDerWaalsContact O-N 3.14Å; H117-G119 VanDerWaalsContact C-N 3.3Å; H117-G119 PolarHBondContact O-N 3.31Å | ||
| 118 | N | 57.2 | Low | 64.9 | Low | 150 Ų | 150 | 127.5 Ų | 127.5 | 80% | 0.802 | 77% | 0.774 | S | S | * | * | trans | -69.4 | 100.3 | 161.1 | -95.3 | 13.1 | 0 | 0 | 0 | 106.5 | T116 E120 | T116-N118 VanDerWaalsContact C-N 3.3Å; T116-N118 PolarHBondContact O-N 3.03Å; N118-E120 PolarHBondContact O-N 3.23Å | ||
| 119 | G | 46.5 | Very low | 62.3 | Low | 58 Ų | 58 | 127.5 Ų | 127.5 | 60% | 0.598 | 79% | 0.789 | S | S | * | * | trans | -50.4 | 123.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | H117 L121 | H117-G119 VanDerWaalsContact C-N 3.3Å; H117-G119 PolarHBondContact O-N 3.31Å; G119-L121 PolarHBondContact O-N 3.39Å | ||
| 120 | E | 49.1 | Very low | 59.9 | Low | 198 Ų | 198 | 126 Ų | 126 | 93% | 0.925 | 80% | 0.795 | S | S | * | * | trans | -53.2 | 101.4 | 161.1 | -171.7 | 143.6 | 94.3 | 0 | 0 | 109.2 | N118 | N118-E120 PolarHBondContact O-N 3.23Š| ||
| 121 | L | 45.5 | Very low | 58 | Low | 168 Ų | 168 | 126.4 Ų | 126.4 | 88% | 0.88 | 81% | 0.813 | S | S | * | * | trans | -121.7 | 89 | 166.6 | -95.2 | 157.2 | 0 | 0 | 0 | 107.9 | G119 | G119-L121 PolarHBondContact O-N 3.39Š| ||
| 122 | G | 42.1 | Very low | 56.2 | Low | 80 Ų | 80 | 125.7 Ų | 125.7 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | trans | 43.5 | 115.2 | 141.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 123 | G | 35.7 | Very low | 53.9 | Low | 77 Ų | 77 | 123.3 Ų | 123.3 | 79% | 0.794 | 82% | 0.819 | S | S | * | * | trans | -172.8 | 71.9 | 161.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G125 | G123-G125 PolarHBondContact O-N 2.85Š| ||
| 124 | A | 49.7 | Very low | 51.6 | Low | 118 Ų | 118 | 118.2 Ų | 118.2 | 98% | 0.975 | 82% | 0.815 | S | S | * | * | trans | -58.1 | 121.2 | 162 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 125 | G | 39.7 | Very low | 49.6 | Very low | 73 Ų | 73 | 116.6 Ų | 116.6 | 75% | 0.753 | 82% | 0.816 | S | S | * | * | trans | -152.1 | 125.3 | 174 | 0 | 0 | 0 | 0 | 0 | 109.8 | G123 | G123-G125 PolarHBondContact O-N 2.85Š| ||
| 126 | E | 44 | Very low | 47.6 | Very low | 184 Ų | 184 | 111.4 Ų | 111.4 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -51.3 | 163.8 | -165.5 | -81.6 | -161.6 | 95.5 | 0 | 0 | 120.3 | G128 | E126-G128 PolarHBondContact O-N 3.35Š| ||
| 127 | P | 52.1 | Low | 46.5 | Very low | 123 Ų | 123 | 112.5 Ų | 112.5 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | trans | -78.7 | 98.7 | 166.1 | 33.6 | -31.2 | 0 | 0 | 0 | 111.4 | ||||
| 128 | G | 42.3 | Very low | 46 | Very low | 78 Ų | 78 | 110.3 Ų | 110.3 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | -82.6 | 121.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | E126 | E126-G128 PolarHBondContact O-N 3.35Š| ||
| 129 | G | 38.8 | Very low | 45.8 | Very low | 77 Ų | 77 | 106.5 Ų | 106.5 | 79% | 0.794 | 81% | 0.814 | S | S | * | * | trans | -65 | 159.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 130 | G | 39.7 | Very low | 46.4 | Very low | 74 Ų | 74 | 109.5 Ų | 109.5 | 76% | 0.763 | 82% | 0.823 | S | S | * | * | trans | -70.6 | 174.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 131 | P | 49.9 | Very low | 46.5 | Very low | 126 Ų | 126 | 112.2 Ų | 112.2 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | -142.3 | -170.3 | 123.1 | 47.2 | -33.4 | 0 | 0 | 0 | 110.6 | |||||
| 132 | P | 51.8 | Low | 47.4 | Very low | 125 Ų | 125 | 110.9 Ų | 110.9 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | -119.6 | 166.2 | -113 | 22.8 | 1.8 | 0 | 0 | 0 | 114.3 | |||||
| 133 | G | 39.5 | Very low | 47.8 | Very low | 85 Ų | 85 | 114.2 Ų | 114.2 | 88% | 0.876 | 86% | 0.857 | S | S | * | * | trans | 93.3 | 121.6 | 142.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 134 | G | 43.5 | Very low | 48.5 | Very low | 82 Ų | 82 | 116.1 Ų | 116.1 | 85% | 0.845 | 86% | 0.861 | S | S | * | * | trans | -178.4 | 85 | 165.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 135 | A | 47.7 | Very low | 48.4 | Very low | 105 Ų | 105 | 115.9 Ų | 115.9 | 87% | 0.868 | 86% | 0.855 | S | S | * | * | trans | -68 | 137.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 136 | G | 42.6 | Very low | 48.9 | Very low | 71 Ų | 71 | 118.3 Ų | 118.3 | 73% | 0.732 | 86% | 0.86 | S | S | * | * | trans | 63.4 | 122.9 | 137.2 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 137 | V | 54.2 | Low | 49.2 | Very low | 140 Ų | 140 | 114.5 Ų | 114.5 | 85% | 0.848 | 86% | 0.86 | S | S | * | * | -163.7 | 131 | 115.3 | 179.5 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 138 | P | 55.4 | Low | 49 | Very low | 125 Ų | 125 | 113.9 Ų | 113.9 | 81% | 0.812 | 86% | 0.864 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 128 | 168.7 | 31.8 | -30 | 0 | 0 | 0 | 112.3 | ||
| 139 | G | 52.7 | Low | 49.4 | Very low | 69 Ų | 69 | 116.3 Ų | 116.3 | 71% | 0.711 | 87% | 0.868 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 160.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 140 | P | 59.1 | Low | 50.2 | Low | 122 Ų | 122 | 119.1 Ų | 119.1 | 79% | 0.792 | 87% | 0.873 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 149 | -149.2 | 33.3 | -34.6 | 0 | 0 | 0 | 114.5 | ||
| 141 | R | 51.7 | Low | 51 | Low | 254 Ų | 254 | 122.6 Ų | 122.6 | 96% | 0.958 | 88% | 0.882 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 129.4 | 163.4 | -69.3 | -177 | -176.1 | -144 | 0.2 | 109.1 | ||
| 142 | V | 62.5 | Low | 51.1 | Low | 141 Ų | 141 | 122.3 Ų | 122.3 | 86% | 0.855 | 89% | 0.887 | S | S | * | * | P | Polyproline II helix | trans | -102.8 | 130.5 | 165.1 | -165.4 | 0 | 0 | 0 | 0 | 106.7 | ||
| 143 | G | 52.4 | Low | 51 | Low | 149 Ų | 149 | 122.1 Ų | 122.1 | 100% | 1.536 | 89% | 0.894 | S | S | * | * | trans | -81 | 0 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.6 |
Retrieved 143 of 143 residues in 28.6 ms
(Link to these results)