| 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 | 70.4 | Confident | 85.9 | Confident | 225 Ų | 225 | 116.5 Ų | 116.5 | 100% | 1.108 | 65% | 0.647 | S | S | * | * | 0 | 1.6 | 0 | -76.6 | -163.6 | 168.2 | 0 | 0 | 115.4 | |||||
| 2 | N | 80 | Confident | 86.5 | Confident | 134 Ų | 134 | 115.5 Ų | 115.5 | 72% | 0.717 | 64% | 0.638 | S | S | * | * | trans | -90.5 | -15.4 | -173.3 | -75.5 | -9 | 0 | 0 | 0 | 116.4 | F5 V6 | N2-F5 PolarHBondContact O-N 3.08Å; N2-V6 PolarHBondContact O-N 2.99Å | ||
| 3 | V | 83.5 | Confident | 86.8 | Confident | 124 Ų | 124 | 109.6 Ų | 109.6 | 75% | 0.752 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -71.2 | -37.7 | -173.7 | -171.7 | 0 | 0 | 0 | 0 | 111.9 | F5 V6 A7 | V3-F5 VanDerWaalsContact C-N 3.33Å; V3-F5 PolarHBondContact O-N 2.54Å; V3-V6 PolarHBondContact O-N 3.11Å; V3-A7 PolarHBondContact O-N 2.91Å |
| 4 | F | 84.5 | Confident | 87.2 | Confident | 176 Ų | 176 | 107.6 Ų | 107.6 | 77% | 0.772 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -66.2 | -33.3 | 177.8 | -75.2 | -77 | 0 | 0 | 0 | 113 | A7 T8 | F4-A7 PolarHBondContact O-N 3.38Å; F4-T8 PolarHBondContact O-N 2.93Å; F4-T8 VanDerWaalsContact O-N 3.15Å; F4-T8 PolarHBondContact O-OG1 3.06Å |
| 5 | F | 88.2 | Confident | 87.3 | Confident | 161 Ų | 161 | 104.1 Ų | 104.1 | 71% | 0.706 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -71.5 | -32.4 | 179.9 | -136.7 | -87.8 | 0 | 0 | 0 | 112.5 | N2 V3 T8 A9 | N2-F5 PolarHBondContact O-N 3.08Å; V3-F5 VanDerWaalsContact C-N 3.33Å; V3-F5 PolarHBondContact O-N 2.54Å; F5-T8 PolarHBondContact O-OG1 2.96Å; F5-T8 VanDerWaalsContact O-OG1 3.11Å; F5-A9 WeakPolarHBondContact O-CB 3.25Å; F5-A9 PolarHBondContact O-N 2.7Å |
| 6 | V | 88.7 | Confident | 87.5 | Confident | 94 Ų | 94 | 104.9 Ų | 104.9 | 57% | 0.57 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -71.8 | -41.3 | 175.6 | 179.5 | 0 | 0 | 0 | 0 | 110.4 | N2 V3 T8 A9 V10 | N2-V6 PolarHBondContact O-N 2.99Å; V3-V6 PolarHBondContact O-N 3.11Å; V6-T8 PolarHBondContact O-N 2.82Å; V6-A9 PolarHBondContact O-N 2.84Å; V6-V10 HydrophobicContact CG1-CG2 4.48Å; V6-V10 VanDerWaalsContact O-CG2 3.31Å; V6-V10 WeakPolarHBondContact O-CG2 3.5Å; V6-V10 PolarHBondContact O-N 3.19Å; V6-V10 VanDerWaalsContact O-N 3.09Å |
| 7 | A | 88.2 | Confident | 87.5 | Confident | 56 Ų | 56 | 105.5 Ų | 105.5 | 46% | 0.463 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -62.4 | -42.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V3 F4 V10 T11 | V3-A7 PolarHBondContact O-N 2.91Å; F4-A7 PolarHBondContact O-N 3.38Å; A7-V10 PolarHBondContact O-N 3.28Å; A7-T11 WeakPolarHBondContact O-CG2 3.18Å; A7-T11 PolarHBondContact O-N 2.91Å; A7-T11 PolarHBondContact O-OG1 2.68Å |
| 8 | T | 88.6 | Confident | 87.4 | Confident | 72 Ų | 72 | 106.2 Ų | 106.2 | 44% | 0.442 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70.1 | -36.1 | 178 | 52.5 | 0 | 0 | 0 | 0 | 112.9 | F4 F5 V6 T11 I12 | F4-T8 PolarHBondContact O-N 2.93Å; F4-T8 VanDerWaalsContact O-N 3.15Å; F4-T8 PolarHBondContact O-OG1 3.06Å; F5-T8 PolarHBondContact O-OG1 2.96Å; F5-T8 VanDerWaalsContact O-OG1 3.11Å; V6-T8 PolarHBondContact O-N 2.82Å; T8-T11 WeakPolarHBondContact CA-OG1 3.43Å; T8-T11 PolarHBondContact O-OG1 3.14Å; T8-I12 WeakPolarHBondContact O-CD1 3.44Å; T8-I12 VanDerWaalsContact O-CG1 3.25Å; T8-I12 WeakPolarHBondContact O-CG1 3.44Å; T8-I12 PolarHBondContact O-N 3.46Å; T8-I12 VanDerWaalsContact O-N 3.16Å |
| 9 | A | 90.4 | Very high | 87.1 | Confident | 59 Ų | 59 | 109 Ų | 109 | 49% | 0.488 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -65.3 | -38.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | F5 V6 G13 | F5-A9 WeakPolarHBondContact O-CB 3.25Å; F5-A9 PolarHBondContact O-N 2.7Å; V6-A9 PolarHBondContact O-N 2.84Å; A9-G13 PolarHBondContact O-N 2.9Å; A9-G13 VanDerWaalsContact O-N 3.11Å |
| 10 | V | 91.2 | Very high | 86.9 | Confident | 88 Ų | 88 | 111.6 Ų | 111.6 | 53% | 0.533 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -67.8 | -43 | 178.4 | 173.8 | 0 | 0 | 0 | 0 | 111.3 | V6 A7 G13 V14 | V6-V10 HydrophobicContact CG1-CG2 4.48Å; V6-V10 VanDerWaalsContact O-CG2 3.31Å; V6-V10 WeakPolarHBondContact O-CG2 3.5Å; V6-V10 PolarHBondContact O-N 3.19Å; V6-V10 VanDerWaalsContact O-N 3.09Å; A7-V10 PolarHBondContact O-N 3.28Å; V10-G13 PolarHBondContact O-N 2.78Å; V10-V14 WeakPolarHBondContact O-CG2 3.37Å; V10-V14 PolarHBondContact O-N 3.45Å; V10-V14 VanDerWaalsContact O-N 3.09Å |
| 11 | T | 90.9 | Very high | 86.4 | Confident | 92 Ų | 92 | 112.7 Ų | 112.7 | 56% | 0.564 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -66.1 | -39.7 | 179.7 | 51.3 | 0 | 0 | 0 | 0 | 112.5 | A7 T8 G13 V14 A15 | A7-T11 WeakPolarHBondContact O-CG2 3.18Å; A7-T11 PolarHBondContact O-N 2.91Å; A7-T11 PolarHBondContact O-OG1 2.68Å; T8-T11 WeakPolarHBondContact CA-OG1 3.43Å; T8-T11 PolarHBondContact O-OG1 3.14Å; T11-G13 VanDerWaalsContact C-N 3.34Å; T11-G13 PolarHBondContact O-N 2.99Å; T11-V14 PolarHBondContact O-N 3.16Å; T11-A15 PolarHBondContact O-N 3.13Å; T11-A15 VanDerWaalsContact O-N 3.15Å |
| 12 | I | 92.9 | Very high | 86.6 | Confident | 105 Ų | 105 | 105.6 Ų | 105.6 | 54% | 0.538 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -63.6 | -40.7 | 174.8 | -65.7 | 166.4 | 0 | 0 | 0 | 110.9 | T8 V14 A15 L16 | T8-I12 WeakPolarHBondContact O-CD1 3.44Å; T8-I12 VanDerWaalsContact O-CG1 3.25Å; T8-I12 WeakPolarHBondContact O-CG1 3.44Å; T8-I12 PolarHBondContact O-N 3.46Å; T8-I12 VanDerWaalsContact O-N 3.16Å; I12-V14 PolarHBondContact O-N 3.15Å; I12-A15 PolarHBondContact O-N 2.89Å; I12-L16 HydrophobicContact CG2-CD1 4.24Å; I12-L16 PolarHBondContact O-N 2.92Å; I12-L16 VanDerWaalsContact O-N 3.16Å |
| 13 | G | 91.5 | Very high | 86 | Confident | 39 Ų | 39 | 102.8 Ų | 102.8 | 40% | 0.402 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.7 | -42.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | A9 V10 T11 L16 L17 | A9-G13 PolarHBondContact O-N 2.9Å; A9-G13 VanDerWaalsContact O-N 3.11Å; V10-G13 PolarHBondContact O-N 2.78Å; T11-G13 VanDerWaalsContact C-N 3.34Å; T11-G13 PolarHBondContact O-N 2.99Å; G13-L16 PolarHBondContact O-N 3.19Å; G13-L17 PolarHBondContact O-N 3.41Å; G13-L17 VanDerWaalsContact O-N 3.15Å |
| 14 | V | 91.8 | Very high | 85.3 | Confident | 81 Ų | 81 | 103.5 Ų | 103.5 | 49% | 0.491 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.8 | -40.2 | 178.4 | 174.9 | 0 | 0 | 0 | 0 | 111.5 | V10 T11 I12 L16 L17 L18 | V10-V14 WeakPolarHBondContact O-CG2 3.37Å; V10-V14 PolarHBondContact O-N 3.45Å; V10-V14 VanDerWaalsContact O-N 3.09Å; T11-V14 PolarHBondContact O-N 3.16Å; I12-V14 PolarHBondContact O-N 3.15Å; V14-L16 PolarHBondContact O-N 2.82Å; V14-L17 PolarHBondContact O-N 3.33Å; V14-L18 HydrophobicContact CG1-CD1 4.04Å; V14-L18 PolarHBondContact O-N 2.86Å; V14-L18 VanDerWaalsContact O-N 3.12Å |
| 15 | A | 89 | Confident | 84.4 | Confident | 55 Ų | 55 | 104.2 Ų | 104.2 | 46% | 0.455 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64 | -38.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | T11 I12 K19 | T11-A15 PolarHBondContact O-N 3.13Å; T11-A15 VanDerWaalsContact O-N 3.15Å; I12-A15 PolarHBondContact O-N 2.89Å; A15-K19 PolarHBondContact O-N 3.32Å |
| 16 | L | 90.3 | Very high | 83 | Confident | 117 Ų | 117 | 102 Ų | 102 | 61% | 0.613 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -68.6 | -37.9 | 176.2 | -72.1 | 172.3 | 0 | 0 | 0 | 112.3 | I12 G13 V14 L18 K19 Y20 | I12-L16 HydrophobicContact CG2-CD1 4.24Å; I12-L16 PolarHBondContact O-N 2.92Å; I12-L16 VanDerWaalsContact O-N 3.16Å; G13-L16 PolarHBondContact O-N 3.19Å; V14-L16 PolarHBondContact O-N 2.82Å; L16-L18 VanDerWaalsContact C-N 3.35Å; L16-L18 PolarHBondContact O-N 2.87Å; L16-K19 PolarHBondContact O-N 3.44Å; L16-Y20 PolarHBondContact O-N 3.23Å; L16-Y20 VanDerWaalsContact O-N 3.07Å |
| 17 | L | 87.9 | Confident | 81.2 | Confident | 116 Ų | 116 | 102.7 Ų | 102.7 | 61% | 0.607 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -66.4 | -37 | 178.3 | -163.1 | 75.1 | 0 | 0 | 0 | 112.2 | G13 V14 Y20 K21 | G13-L17 PolarHBondContact O-N 3.41Å; G13-L17 VanDerWaalsContact O-N 3.15Å; V14-L17 PolarHBondContact O-N 3.33Å; L17-Y20 PolarHBondContact O-N 3.33Å; L17-K21 PolarHBondContact O-N 2.9Å; L17-K21 VanDerWaalsContact O-N 3.14Å |
| 18 | L | 85.6 | Confident | 79.5 | Confident | 117 Ų | 117 | 106.4 Ų | 106.4 | 61% | 0.613 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66 | -43 | 176 | -81.1 | 158.1 | 0 | 0 | 0 | 112 | V14 L16 Y20 K21 S22 | V14-L18 HydrophobicContact CG1-CD1 4.04Å; V14-L18 PolarHBondContact O-N 2.86Å; V14-L18 VanDerWaalsContact O-N 3.12Å; L16-L18 VanDerWaalsContact C-N 3.35Å; L16-L18 PolarHBondContact O-N 2.87Å; L18-Y20 VanDerWaalsContact C-N 3.31Å; L18-Y20 PolarHBondContact O-N 3Å; L18-K21 PolarHBondContact O-N 3.45Å; L18-S22 PolarHBondContact O-N 2.79Å; L18-S22 VanDerWaalsContact O-N 3.17Å |
| 19 | K | 82.1 | Confident | 77.7 | Confident | 160 Ų | 160 | 106.2 Ų | 106.2 | 70% | 0.696 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -63.7 | -35 | 174.4 | -83.2 | -170.8 | 176.1 | -176.7 | 0 | 113 | A15 L16 S22 A23 | A15-K19 PolarHBondContact O-N 3.32Å; L16-K19 PolarHBondContact O-N 3.44Å; K19-S22 PolarHBondContact O-OG 2.91Å; K19-A23 PolarHBondContact O-N 2.81Å |
| 20 | Y | 82.5 | Confident | 75.7 | Confident | 160 Ų | 160 | 107.9 Ų | 107.9 | 63% | 0.627 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -69.5 | -37.9 | 178.3 | -165.1 | -97.2 | 0 | 0 | 0 | 112.1 | L16 L17 L18 | L16-Y20 PolarHBondContact O-N 3.23Å; L16-Y20 VanDerWaalsContact O-N 3.07Å; L17-Y20 PolarHBondContact O-N 3.33Å; L18-Y20 VanDerWaalsContact C-N 3.31Å; L18-Y20 PolarHBondContact O-N 3Å |
| 21 | K | 77.1 | Confident | 73.7 | Confident | 136 Ų | 136 | 111.8 Ų | 111.8 | 59% | 0.591 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -68.7 | -39 | 176.4 | -84.6 | -170.1 | 173.4 | -175 | 0 | 113 | L17 L18 A23 Q24 Y25 | L17-K21 PolarHBondContact O-N 2.9Å; L17-K21 VanDerWaalsContact O-N 3.14Å; L18-K21 PolarHBondContact O-N 3.45Å; K21-A23 VanDerWaalsContact C-N 3.25Å; K21-A23 PolarHBondContact O-N 3.21Å; K21-Q24 PolarHBondContact O-N 2.9Å; K21-Y25 WeakPolarHBondContact O-CD2 3.36Å |
| 22 | S | 73.4 | Confident | 71.6 | Confident | 76 Ų | 76 | 115.4 Ų | 115.4 | 53% | 0.531 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -64.6 | -30.9 | 179.3 | 58.2 | 0 | 0 | 0 | 0 | 112.7 | L18 K19 Q24 | L18-S22 PolarHBondContact O-N 2.79Å; L18-S22 VanDerWaalsContact O-N 3.17Å; K19-S22 PolarHBondContact O-OG 2.91Å; S22-Q24 VanDerWaalsContact C-N 3.33Å; S22-Q24 PolarHBondContact O-N 2.91Å |
| 23 | A | 68.6 | Low | 69.6 | Low | 74 Ų | 74 | 115.9 Ų | 115.9 | 61% | 0.612 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69 | -27.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | K19 K21 | K19-A23 PolarHBondContact O-N 2.81Å; K21-A23 VanDerWaalsContact C-N 3.25Å; K21-A23 PolarHBondContact O-N 3.21Å |
| 24 | Q | 67.8 | Low | 67.4 | Low | 139 Ų | 139 | 119.8 Ų | 119.8 | 65% | 0.65 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -79.6 | -19.7 | -179.4 | -71.7 | -148.3 | -18.8 | 0 | 0 | 114.2 | K21 S22 | K21-Q24 PolarHBondContact O-N 2.9Å; S22-Q24 VanDerWaalsContact C-N 3.33Å; S22-Q24 PolarHBondContact O-N 2.91Å |
| 25 | Y | 66 | Low | 65.2 | Low | 192 Ų | 192 | 123.1 Ų | 123.1 | 75% | 0.753 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | -4.3 | -177.3 | -73.7 | -77.4 | 0 | 0 | 0 | 114.8 | K21 S27 | K21-Y25 WeakPolarHBondContact O-CD2 3.36Å; Y25-S27 PolarHBondContact O-N 3.36Å |
| 26 | S | 57.9 | Low | 63.1 | Low | 113 Ų | 113 | 128.6 Ų | 128.6 | 79% | 0.79 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | 16 | 177.9 | -70.4 | 0 | 0 | 0 | 0 | 115 | ||
| 27 | S | 52.6 | Low | 61 | Low | 110 Ų | 110 | 128.8 Ų | 128.8 | 77% | 0.769 | 72% | 0.721 | S | S | * | * | trans | -114.7 | 50 | 175 | -164.2 | 0 | 0 | 0 | 0 | 112.1 | Y25 | Y25-S27 PolarHBondContact O-N 3.36Š| ||
| 28 | T | 52 | Low | 58.8 | Low | 134 Ų | 134 | 130.6 Ų | 130.6 | 82% | 0.822 | 73% | 0.732 | S | S | * | * | trans | -99.7 | 73.2 | 160.1 | 50.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 29 | G | 49.9 | Very low | 56.7 | Low | 68 Ų | 68 | 133.2 Ų | 133.2 | 70% | 0.701 | 74% | 0.741 | S | S | * | * | trans | -73 | 132.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 30 | A | 48.5 | Very low | 54.7 | Low | 94 Ų | 94 | 137.6 Ų | 137.6 | 78% | 0.777 | 75% | 0.753 | S | S | * | * | trans | -47.9 | 130.6 | -174 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q32 | A30-Q32 PolarHBondContact O-N 2.89Å; A30-Q32 VanDerWaalsContact O-N 3.08Å | ||
| 31 | I | 48.8 | Very low | 52.8 | Low | 170 Ų | 170 | 139.9 Ų | 139.9 | 87% | 0.872 | 76% | 0.761 | S | S | * | * | trans | -71.6 | 95.7 | 167.3 | -60.4 | 167.9 | 0 | 0 | 0 | 106.6 | ||||
| 32 | Q | 47.8 | Very low | 51.3 | Low | 168 Ų | 168 | 143.2 Ų | 143.2 | 79% | 0.785 | 78% | 0.778 | S | S | * | * | trans | -81.1 | 112 | 161.7 | -83.4 | -175.5 | -6.2 | 0 | 0 | 108.1 | A30 V34 | A30-Q32 PolarHBondContact O-N 2.89Å; A30-Q32 VanDerWaalsContact O-N 3.08Å; Q32-V34 PolarHBondContact O-N 3.37Å | ||
| 33 | S | 50.5 | Low | 50.3 | Low | 114 Ų | 114 | 145 Ų | 145 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -60.7 | 118.2 | 163.2 | 48.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 34 | V | 46.1 | Very low | 49.6 | Very low | 122 Ų | 122 | 148.3 Ų | 148.3 | 74% | 0.739 | 80% | 0.803 | S | S | * | * | trans | -124.4 | 121.5 | 170.4 | -174.5 | 0 | 0 | 0 | 0 | 107.7 | Q32 | Q32-V34 PolarHBondContact O-N 3.37Š| ||
| 35 | D | 45.2 | Very low | 48.9 | Very low | 150 Ų | 150 | 146.8 Ų | 146.8 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | trans | -58.1 | 138.5 | -175.7 | -76.3 | -49.3 | 0 | 0 | 0 | 113 | T37 | D35-T37 PolarHBondContact O-N 3.17Š| ||
| 36 | I | 43.7 | Very low | 48.2 | Very low | 170 Ų | 170 | 141.8 Ų | 141.8 | 87% | 0.872 | 81% | 0.806 | S | S | * | * | trans | -83.8 | 91.1 | 178.8 | -58.8 | 166.5 | 0 | 0 | 0 | 107.6 | ||||
| 37 | T | 47.2 | Very low | 48.3 | Very low | 121 Ų | 121 | 144.7 Ų | 144.7 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | trans | -141.4 | 115.7 | 158.7 | 45.7 | 0 | 0 | 0 | 0 | 109.7 | D35 | D35-T37 PolarHBondContact O-N 3.17Š| ||
| 38 | D | 41.5 | Very low | 48.3 | Very low | 154 Ų | 154 | 147.1 Ų | 147.1 | 82% | 0.824 | 81% | 0.808 | S | S | * | * | trans | 34.7 | 102.9 | 151.1 | -83 | -33.7 | 0 | 0 | 0 | 117.8 | ||||
| 39 | Q | 41.1 | Very low | 48.4 | Very low | 172 Ų | 172 | 147.9 Ų | 147.9 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | -164.8 | 105.6 | 122.4 | -107.4 | 168.3 | 44.8 | 0 | 0 | 112.5 | R41 | Q39-R41 VanDerWaalsContact C-N 3.27Å; Q39-R41 PolarHBondContact O-N 2.95Å | |||
| 40 | R | 40.3 | Very low | 48.8 | Very low | 253 Ų | 253 | 151.5 Ų | 151.5 | 96% | 0.955 | 81% | 0.807 | S | S | * | * | trans | -52 | 82 | 154.6 | -176 | -172.2 | -173.7 | -158.4 | 2.9 | 110.7 | ||||
| 41 | R | 43.6 | Very low | 49.1 | Very low | 208 Ų | 208 | 152.3 Ų | 152.3 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -145.4 | 104.1 | 161.7 | -74.3 | -164.1 | 176.8 | -140.4 | -0.4 | 111 | Q39 S43 | Q39-R41 VanDerWaalsContact C-N 3.27Å; Q39-R41 PolarHBondContact O-N 2.95Å; R41-S43 PolarHBondContact O-N 2.86Å | ||
| 42 | Q | 46 | Very low | 49.2 | Very low | 205 Ų | 205 | 155.3 Ų | 155.3 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | trans | 13.1 | 81.4 | 144.4 | -63.4 | 175.3 | -8.7 | 0 | 0 | 115.1 | ||||
| 43 | S | 51.5 | Low | 49.2 | Very low | 115 Ų | 115 | 152.5 Ų | 152.5 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | -102.6 | 117.5 | 163.9 | 56.9 | 0 | 0 | 0 | 0 | 108.8 | R41 S45 | R41-S43 PolarHBondContact O-N 2.86Å; S43-S45 PolarHBondContact O-N 3.41Å; S43-S45 VanDerWaalsContact O-N 3.15Å | ||
| 44 | V | 53.2 | Low | 49.2 | Very low | 142 Ų | 142 | 152.4 Ų | 152.4 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | trans | -53.5 | 112.8 | -179.3 | -167.9 | 0 | 0 | 0 | 0 | 108.2 | A46 | V44-A46 PolarHBondContact O-N 3.48Š| ||
| 45 | S | 54.3 | Low | 49.3 | Very low | 108 Ų | 108 | 153.7 Ų | 153.7 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | trans | -53.3 | 102.4 | 175.1 | 155.5 | 0 | 0 | 0 | 0 | 108.9 | S43 K47 | S43-S45 PolarHBondContact O-N 3.41Å; S43-S45 VanDerWaalsContact O-N 3.15Å; S45-K47 PolarHBondContact O-N 3.08Å | ||
| 46 | A | 50.8 | Low | 49.9 | Very low | 86 Ų | 86 | 150.9 Ų | 150.9 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | -53.6 | 105.3 | 171.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | V44 L48 | V44-A46 PolarHBondContact O-N 3.48Å; A46-L48 VanDerWaalsContact C-N 3.26Å; A46-L48 PolarHBondContact O-N 3.36Å | ||
| 47 | K | 59.8 | Low | 50 | Low | 175 Ų | 175 | 151.3 Ų | 151.3 | 76% | 0.761 | 79% | 0.794 | S | S | * | * | trans | -66.7 | 90.5 | 178 | -163.6 | 168.2 | -171.7 | 171.6 | 0 | 106.5 | S45 M49 | S45-K47 PolarHBondContact O-N 3.08Å; K47-M49 VanDerWaalsContact C-N 3.26Å; K47-M49 PolarHBondContact O-N 2.81Å | ||
| 48 | L | 53.7 | Low | 50.1 | Low | 160 Ų | 160 | 155.4 Ų | 155.4 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | -56 | 97.6 | 165.8 | -80.1 | 163.5 | 0 | 0 | 0 | 106.7 | A46 L50 | A46-L48 VanDerWaalsContact C-N 3.26Å; A46-L48 PolarHBondContact O-N 3.36Å; L48-L50 PolarHBondContact O-N 2.92Å | ||
| 49 | M | 53 | Low | 50.5 | Low | 150 Ų | 150 | 152.8 Ų | 152.8 | 74% | 0.739 | 78% | 0.784 | S | S | * | * | trans | -69.8 | 83.1 | 171 | -65.4 | -128 | 83.3 | 0 | 0 | 106.5 | K47 | K47-M49 VanDerWaalsContact C-N 3.26Å; K47-M49 PolarHBondContact O-N 2.81Å | ||
| 50 | L | 59.1 | Low | 51.1 | Low | 145 Ų | 145 | 152.5 Ų | 152.5 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | trans | -57.4 | 126.4 | 162.2 | -73.4 | 168.2 | 0 | 0 | 0 | 106.5 | L48 R52 | L48-L50 PolarHBondContact O-N 2.92Å; L50-R52 PolarHBondContact O-N 3.44Å | ||
| 51 | P | 54.8 | Low | 51.6 | Low | 111 Ų | 111 | 150 Ų | 150 | 72% | 0.721 | 77% | 0.771 | S | S | * | * | trans | -56.1 | 115.5 | 174.9 | 21.3 | -29.9 | 0 | 0 | 0 | 106.9 | C53 | P51-C53 VanDerWaalsContact C-N 3.27Å; P51-C53 PolarHBondContact O-N 2.75Å | ||
| 52 | R | 50.2 | Low | 52 | Low | 233 Ų | 233 | 146.2 Ų | 146.2 | 88% | 0.879 | 77% | 0.765 | S | S | * | * | trans | -57.8 | 99.6 | 171 | -74.1 | -179.1 | 168.4 | 155.8 | -4.7 | 105.7 | L50 S54 | L50-R52 PolarHBondContact O-N 3.44Å; R52-S54 VanDerWaalsContact C-N 3.33Å; R52-S54 PolarHBondContact O-N 2.76Å | ||
| 53 | C | 47.1 | Very low | 52.2 | Low | 109 Ų | 109 | 140.9 Ų | 140.9 | 74% | 0.736 | 75% | 0.751 | S | S | * | * | trans | -50.5 | 111.5 | 158.4 | -66.8 | 0 | 0 | 0 | 0 | 104.5 | P51 N55 | P51-C53 VanDerWaalsContact C-N 3.27Å; P51-C53 PolarHBondContact O-N 2.75Å; C53-N55 PolarHBondContact O-N 2.75Å | ||
| 54 | S | 51.6 | Low | 52.2 | Low | 111 Ų | 111 | 144.1 Ų | 144.1 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | trans | -53.6 | 97.9 | 169.3 | 48.2 | 0 | 0 | 0 | 0 | 105.7 | R52 S56 | R52-S54 VanDerWaalsContact C-N 3.33Å; R52-S54 PolarHBondContact O-N 2.76Å; S54-S56 PolarHBondContact O-N 2.96Å | ||
| 55 | N | 48.6 | Very low | 52 | Low | 149 Ų | 149 | 147.8 Ų | 147.8 | 80% | 0.797 | 75% | 0.751 | S | S | * | * | trans | -60.5 | 90 | 160.5 | -74.9 | -14.7 | 0 | 0 | 0 | 103.9 | C53 E57 | C53-N55 PolarHBondContact O-N 2.75Å; N55-E57 PolarHBondContact O-N 3.36Å | ||
| 56 | S | 56.4 | Low | 51.6 | Low | 92 Ų | 92 | 145.6 Ų | 145.6 | 64% | 0.643 | 75% | 0.746 | S | S | * | * | trans | -49 | 120.5 | 160.9 | 45.8 | 0 | 0 | 0 | 0 | 105 | S54 Y58 | S54-S56 PolarHBondContact O-N 2.96Å; S56-Y58 PolarHBondContact O-N 3.07Å | ||
| 57 | E | 46.8 | Very low | 51.5 | Low | 178 Ų | 178 | 146.9 Ų | 146.9 | 83% | 0.832 | 75% | 0.75 | S | S | * | * | trans | -62.1 | 65.7 | -176.1 | -138.4 | 169.3 | -174.1 | 0 | 0 | 108.8 | N55 D59 | N55-E57 PolarHBondContact O-N 3.36Å; E57-D59 PolarHBondContact O-N 3.47Å | ||
| 58 | Y | 49.2 | Very low | 51 | Low | 207 Ų | 207 | 144.6 Ų | 144.6 | 81% | 0.812 | 75% | 0.75 | S | S | * | * | trans | -77.7 | 72.6 | 156.8 | -92.3 | -85.5 | 0 | 0 | 0 | 105.9 | S56 F60 | S56-Y58 PolarHBondContact O-N 3.07Å; Y58-F60 PolarHBondContact O-N 3.24Å | ||
| 59 | D | 49.7 | Very low | 50.8 | Low | 100 Ų | 100 | 140.6 Ų | 140.6 | 54% | 0.535 | 74% | 0.74 | S | S | . | * | trans | -64.5 | 75 | 164.6 | -148.7 | 17.4 | 0 | 0 | 0 | 105.5 | E57 R61 | E57-D59 PolarHBondContact O-N 3.47Å; D59-R61 PolarHBondContact O-N 2.9Å; D59-R61 IonicContact OD1-NE 3.88Å; D59-R61 IonicContact OD2-CZ 3.67Å; D59-R61 IonicContact OD2-NE 2.99Å; D59-R61 PolarHBondContact OD2-NE 3.45Å; D59-R61 IonicContact OD2-NH2 3.95Å | ||
| 60 | F | 52.6 | Low | 50.4 | Low | 165 Ų | 165 | 139.2 Ų | 139.2 | 72% | 0.724 | 74% | 0.741 | S | S | * | * | trans | -72.3 | 64.1 | 168.9 | -147 | -97.1 | 0 | 0 | 0 | 106 | Y58 L62 | Y58-F60 PolarHBondContact O-N 3.24Å; F60-L62 HydrophobicContact CD1-CD1 4.25Å; F60-L62 HydrophobicContact CD1-CD2 4.19Å; F60-L62 HydrophobicContact CD1-CG 3.75Å; F60-L62 HydrophobicContact CE1-CD1 4.49Å; F60-L62 HydrophobicContact CE1-CD2 3.81Å; F60-L62 HydrophobicContact CE1-CG 3.91Å; F60-L62 PolarHBondContact O-N 3.01Å | ||
| 61 | R | 52.8 | Low | 50.1 | Low | 202 Ų | 202 | 138.9 Ų | 138.9 | 76% | 0.762 | 75% | 0.745 | S | S | * | * | trans | -63 | 83.6 | 159.6 | -71.6 | -175.7 | 175.4 | -164 | -8.5 | 104.8 | D59 S63 | D59-R61 PolarHBondContact O-N 2.9Å; D59-R61 IonicContact OD1-NE 3.88Å; D59-R61 IonicContact OD2-CZ 3.67Å; D59-R61 IonicContact OD2-NE 2.99Å; D59-R61 PolarHBondContact OD2-NE 3.45Å; D59-R61 IonicContact OD2-NH2 3.95Å; R61-S63 PolarHBondContact O-N 3.47Å | ||
| 62 | L | 51.2 | Low | 49.8 | Very low | 128 Ų | 128 | 143 Ų | 143 | 67% | 0.67 | 75% | 0.751 | S | S | * | * | trans | -47 | 99.9 | 152.7 | -81.4 | 160.7 | 0 | 0 | 0 | 104.8 | F60 E64 | F60-L62 HydrophobicContact CD1-CD1 4.25Å; F60-L62 HydrophobicContact CD1-CD2 4.19Å; F60-L62 HydrophobicContact CD1-CG 3.75Å; F60-L62 HydrophobicContact CE1-CD1 4.49Å; F60-L62 HydrophobicContact CE1-CD2 3.81Å; F60-L62 HydrophobicContact CE1-CG 3.91Å; F60-L62 PolarHBondContact O-N 3.01Å; L62-E64 PolarHBondContact O-N 3.34Å | ||
| 63 | S | 50 | Low | 49.3 | Very low | 93 Ų | 93 | 135.1 Ų | 135.1 | 65% | 0.65 | 74% | 0.743 | S | S | * | * | trans | -62.3 | 78 | 166.1 | 157.6 | 0 | 0 | 0 | 0 | 106 | R61 R65 | R61-S63 PolarHBondContact O-N 3.47Å; S63-R65 PolarHBondContact O-N 2.88Å | ||
| 64 | E | 51.3 | Low | 49.3 | Very low | 182 Ų | 182 | 136.7 Ų | 136.7 | 85% | 0.85 | 75% | 0.749 | S | S | * | * | trans | -69.4 | 44.3 | 150.8 | -67.1 | -170.2 | 170.7 | 0 | 0 | 108.9 | L62 G66 | L62-E64 PolarHBondContact O-N 3.34Å; E64-G66 PolarHBondContact O-N 3.44Å | ||
| 65 | R | 49.7 | Very low | 48.7 | Very low | 220 Ų | 220 | 138.2 Ų | 138.2 | 83% | 0.83 | 75% | 0.754 | S | S | * | * | trans | -71.7 | 83.1 | 151.3 | -80.2 | -173.4 | 177.8 | 179.1 | 1 | 105.3 | S63 S67 | S63-R65 PolarHBondContact O-N 2.88Å; R65-S67 VanDerWaalsContact C-N 3.31Å; R65-S67 PolarHBondContact O-N 3.2Å | ||
| 66 | G | 45.4 | Very low | 48.7 | Very low | 62 Ų | 62 | 136.2 Ų | 136.2 | 64% | 0.639 | 75% | 0.751 | S | S | * | * | trans | -43.3 | 105.1 | 154.6 | 0 | 0 | 0 | 0 | 0 | 107.2 | E64 T68 | E64-G66 PolarHBondContact O-N 3.44Å; G66-T68 PolarHBondContact O-N 2.97Å | ||
| 67 | S | 48.8 | Very low | 48.1 | Very low | 113 Ų | 113 | 141.4 Ų | 141.4 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | trans | -70.2 | 85.1 | 175.3 | -163.2 | 0 | 0 | 0 | 0 | 106.3 | R65 A69 | R65-S67 VanDerWaalsContact C-N 3.31Å; R65-S67 PolarHBondContact O-N 3.2Å; S67-A69 PolarHBondContact O-N 3.31Å | ||
| 68 | T | 49.7 | Very low | 47.8 | Very low | 126 Ų | 126 | 143.7 Ų | 143.7 | 77% | 0.773 | 76% | 0.763 | S | S | * | * | trans | -75.4 | 73.2 | 164.5 | 46.5 | 0 | 0 | 0 | 0 | 107.1 | G66 T70 | G66-T68 PolarHBondContact O-N 2.97Å; T68-T70 VanDerWaalsContact C-N 3.31Å; T68-T70 PolarHBondContact O-N 3.43Å | ||
| 69 | A | 48.2 | Very low | 47.6 | Very low | 76 Ų | 76 | 139.6 Ų | 139.6 | 63% | 0.628 | 76% | 0.76 | S | S | * | * | trans | -62.6 | 98 | 168.9 | 0 | 0 | 0 | 0 | 0 | 107.7 | S67 T71 | S67-A69 PolarHBondContact O-N 3.31Å; A69-T71 PolarHBondContact O-N 3.49Å | ||
| 70 | T | 44.2 | Very low | 47.2 | Very low | 122 Ų | 122 | 144 Ų | 144 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | trans | -68.9 | 90.7 | 172.2 | 42.7 | 0 | 0 | 0 | 0 | 108.7 | T68 K72 | T68-T70 VanDerWaalsContact C-N 3.31Å; T68-T70 PolarHBondContact O-N 3.43Å; T70-K72 PolarHBondContact O-N 3.02Å; T70-K72 VanDerWaalsContact O-N 3.14Å | ||
| 71 | T | 54.3 | Low | 46.8 | Very low | 138 Ų | 138 | 139.4 Ų | 139.4 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | trans | -69.2 | 105.1 | 167.6 | 40.7 | 0 | 0 | 0 | 0 | 109.1 | A69 G73 | A69-T71 PolarHBondContact O-N 3.49Å; T71-G73 PolarHBondContact O-N 3.27Å | ||
| 72 | K | 47.4 | Very low | 46.7 | Very low | 197 Ų | 197 | 136.9 Ų | 136.9 | 86% | 0.857 | 78% | 0.777 | S | S | * | * | trans | -72.7 | 119.5 | 171.5 | -71.1 | -179.1 | 177 | 178.9 | 0 | 110.1 | T70 | T70-K72 PolarHBondContact O-N 3.02Å; T70-K72 VanDerWaalsContact O-N 3.14Å | ||
| 73 | G | 41.2 | Very low | 46.8 | Very low | 68 Ų | 68 | 136.2 Ų | 136.2 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | trans | 70.4 | 85.8 | 134.3 | 0 | 0 | 0 | 0 | 0 | 117.5 | T71 | T71-G73 PolarHBondContact O-N 3.27Š| ||
| 74 | V | 46.6 | Very low | 47.1 | Very low | 141 Ų | 141 | 140.3 Ų | 140.3 | 86% | 0.855 | 79% | 0.792 | S | S | * | * | trans | -126.6 | 107.3 | 140.2 | 177.7 | 0 | 0 | 0 | 0 | 106.4 | S76 | V74-S76 PolarHBondContact O-N 3.23Å; V74-S76 VanDerWaalsContact O-N 3.08Å | ||
| 75 | T | 38.6 | Very low | 47.3 | Very low | 144 Ų | 144 | 139.1 Ų | 139.1 | 88% | 0.883 | 79% | 0.792 | S | S | * | * | trans | -69.3 | 96.6 | 174.3 | 43.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 76 | S | 48 | Very low | 47.3 | Very low | 107 Ų | 107 | 136.7 Ų | 136.7 | 75% | 0.748 | 79% | 0.794 | S | S | * | * | trans | -115.8 | 105.8 | 162.3 | -167.3 | 0 | 0 | 0 | 0 | 108.3 | V74 R78 | V74-S76 PolarHBondContact O-N 3.23Å; V74-S76 VanDerWaalsContact O-N 3.08Å; S76-R78 PolarHBondContact O-N 3.02Å | ||
| 77 | K | 44.7 | Very low | 47.8 | Very low | 200 Ų | 200 | 138.2 Ų | 138.2 | 87% | 0.87 | 80% | 0.795 | S | S | * | * | trans | -66.8 | 117.4 | 167 | -69.4 | 177 | 175.9 | 179.8 | 0 | 107.2 | ||||
| 78 | R | 39.4 | Very low | 47.9 | Very low | 227 Ų | 227 | 138.9 Ų | 138.9 | 86% | 0.857 | 80% | 0.795 | S | S | * | * | trans | 179.9 | 129 | 133.7 | -106.8 | 176 | 173.6 | 164.8 | -2.2 | 113.2 | S76 | S76-R78 PolarHBondContact O-N 3.02Š| ||
| 79 | T | 45 | Very low | 47.9 | Very low | 121 Ų | 121 | 141.4 Ų | 141.4 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | trans | 61.6 | 108.1 | 145 | 53.6 | 0 | 0 | 0 | 0 | 119.1 | G81 | T79-G81 PolarHBondContact O-N 3.36Š| ||
| 80 | H | 42.7 | Very low | 48.6 | Very low | 193 Ų | 193 | 141.3 Ų | 141.3 | 89% | 0.894 | 79% | 0.79 | S | S | * | * | trans | -1.8 | 105.8 | 135.6 | -102.5 | -69 | 0 | 0 | 0 | 113.7 | ||||
| 81 | G | 43.6 | Very low | 49.2 | Very low | 67 Ų | 67 | 140.5 Ų | 140.5 | 69% | 0.691 | 79% | 0.789 | S | S | * | * | trans | -136.6 | 115.2 | 161.1 | 0 | 0 | 0 | 0 | 0 | 105.9 | T79 S83 | T79-G81 PolarHBondContact O-N 3.36Å; G81-S83 PolarHBondContact O-N 2.76Å; G81-S83 VanDerWaalsContact O-N 3.15Å | ||
| 82 | D | 51.2 | Low | 49.3 | Very low | 150 Ų | 150 | 140 Ų | 140 | 80% | 0.802 | 78% | 0.781 | S | S | * | * | trans | -52.8 | 113.4 | -176.1 | -60.6 | -53.4 | 0 | 0 | 0 | 110.4 | E84 | D82-E84 PolarHBondContact O-N 2.76Å; D82-E84 VanDerWaalsContact O-N 3.16Å | ||
| 83 | S | 53.1 | Low | 49.6 | Very low | 114 Ų | 114 | 136.7 Ų | 136.7 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | trans | -77.7 | 100.1 | 174.8 | 56 | 0 | 0 | 0 | 0 | 108.1 | G81 D85 | G81-S83 PolarHBondContact O-N 2.76Å; G81-S83 VanDerWaalsContact O-N 3.15Å; S83-D85 PolarHBondContact O-N 2.99Å | ||
| 84 | E | 55.3 | Low | 50.3 | Low | 178 Ų | 178 | 138.8 Ų | 138.8 | 83% | 0.832 | 77% | 0.768 | S | S | * | * | trans | -55.1 | 131.2 | 165 | -66.2 | -169.3 | 155 | 0 | 0 | 109.7 | D82 L86 | D82-E84 PolarHBondContact O-N 2.76Å; D82-E84 VanDerWaalsContact O-N 3.16Å; E84-L86 PolarHBondContact O-N 2.86Å | ||
| 85 | D | 56.8 | Low | 50.6 | Low | 157 Ų | 157 | 136.8 Ų | 136.8 | 84% | 0.84 | 76% | 0.756 | S | S | * | * | trans | -51.6 | 101.3 | 175.4 | -77.3 | -47.6 | 0 | 0 | 0 | 110.4 | S83 S87 | S83-D85 PolarHBondContact O-N 2.99Å; D85-S87 PolarHBondContact O-N 3.48Å | ||
| 86 | L | 49.5 | Very low | 51.3 | Low | 169 Ų | 169 | 132.9 Ų | 132.9 | 89% | 0.885 | 74% | 0.738 | S | S | * | * | trans | -70.6 | 72.5 | 157.4 | -71.6 | 171.3 | 0 | 0 | 0 | 107.5 | E84 T88 | E84-L86 PolarHBondContact O-N 2.86Å; L86-T88 PolarHBondContact O-N 2.94Å | ||
| 87 | S | 55.6 | Low | 51.5 | Low | 94 Ų | 94 | 130.7 Ų | 130.7 | 66% | 0.657 | 73% | 0.727 | S | S | * | * | trans | -53.9 | 103.7 | 164.3 | -179.4 | 0 | 0 | 0 | 0 | 106.9 | D85 K89 | D85-S87 PolarHBondContact O-N 3.48Å; S87-K89 VanDerWaalsContact C-N 3.26Å; S87-K89 PolarHBondContact O-N 2.76Å | ||
| 88 | T | 50.9 | Low | 52 | Low | 128 Ų | 128 | 128.9 Ų | 128.9 | 79% | 0.785 | 72% | 0.723 | S | S | * | * | trans | -57.3 | 94 | 170.5 | 47.4 | 0 | 0 | 0 | 0 | 107.2 | L86 S90 | L86-T88 PolarHBondContact O-N 2.94Å; T88-S90 PolarHBondContact O-N 2.69Å | ||
| 89 | K | 49.9 | Very low | 52.7 | Low | 179 Ų | 179 | 127.8 Ų | 127.8 | 78% | 0.778 | 72% | 0.72 | S | S | * | * | trans | -58.2 | 96 | 166.2 | -68.5 | -177.2 | 177.4 | -178.1 | 0 | 106.7 | S87 S91 | S87-K89 VanDerWaalsContact C-N 3.26Å; S87-K89 PolarHBondContact O-N 2.76Å; K89-S91 PolarHBondContact O-N 2.76Å | ||
| 90 | S | 62.1 | Low | 53.2 | Low | 74 Ų | 74 | 126.5 Ų | 126.5 | 52% | 0.517 | 72% | 0.717 | S | S | . | * | trans | -61.1 | 131.8 | 175.4 | 56.9 | 0 | 0 | 0 | 0 | 107.8 | T88 D92 E93 | T88-S90 PolarHBondContact O-N 2.69Å; S90-D92 PolarHBondContact O-N 3.3Å; S90-E93 PolarHBondContact O-N 2.9Å | ||
| 91 | S | 58.2 | Low | 53.6 | Low | 104 Ų | 104 | 126 Ų | 126 | 73% | 0.727 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.4 | -3.5 | -176.1 | -43.4 | 0 | 0 | 0 | 0 | 115.9 | K89 | K89-S91 PolarHBondContact O-N 2.76Š|
| 92 | D | 55.8 | Low | 54.2 | Low | 127 Ų | 127 | 134.3 Ų | 134.3 | 68% | 0.679 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -16.4 | -178.1 | -64.7 | -24.1 | 0 | 0 | 0 | 113.8 | S90 V94 T95 | S90-D92 PolarHBondContact O-N 3.3Å; D92-V94 PolarHBondContact O-N 3.41Å; D92-T95 PolarHBondContact O-N 3.35Å |
| 93 | E | 53.4 | Low | 54.2 | Low | 129 Ų | 129 | 136.3 Ų | 136.3 | 60% | 0.603 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -68.1 | -22.9 | 174.4 | -78.1 | -173 | 163.6 | 0 | 0 | 113.2 | S90 T95 A96 A97 | S90-E93 PolarHBondContact O-N 2.9Å; E93-T95 PolarHBondContact O-N 3.48Å; E93-A96 PolarHBondContact O-N 3.25Å; E93-A97 WeakPolarHBondContact O-CB 3.36Å; E93-A97 PolarHBondContact O-N 2.93Å |
| 94 | V | 55.2 | Low | 54.1 | Low | 112 Ų | 112 | 135 Ų | 135 | 68% | 0.679 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -64.5 | -28.5 | 179.6 | -175.3 | 0 | 0 | 0 | 0 | 111.4 | D92 | D92-V94 PolarHBondContact O-N 3.41Å |
| 95 | T | 54.4 | Low | 53.9 | Low | 98 Ų | 98 | 136.3 Ų | 136.3 | 60% | 0.601 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -84.6 | -28.4 | -179.6 | -34.4 | 0 | 0 | 0 | 0 | 112.4 | D92 E93 | D92-T95 PolarHBondContact O-N 3.35Å; E93-T95 PolarHBondContact O-N 3.48Å |
| 96 | A | 52.3 | Low | 53.7 | Low | 63 Ų | 63 | 138.3 Ų | 138.3 | 52% | 0.521 | 73% | 0.733 | S | S | . | * | H | α-helix | trans | -79.3 | -35.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | E93 M98 Y99 S100 | E93-A96 PolarHBondContact O-N 3.25Å; A96-M98 VanDerWaalsContact C-N 3.31Å; A96-M98 PolarHBondContact O-N 3.3Å; A96-Y99 PolarHBondContact O-N 3.47Å; A96-S100 PolarHBondContact O-OG 3.26Å |
| 97 | A | 52.6 | Low | 53.6 | Low | 61 Ų | 61 | 135.7 Ų | 135.7 | 50% | 0.504 | 73% | 0.729 | S | S | . | * | H | α-helix | trans | -64.6 | -35.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | E93 Y99 S100 | E93-A97 WeakPolarHBondContact O-CB 3.36Å; E93-A97 PolarHBondContact O-N 2.93Å; A97-Y99 PolarHBondContact O-N 2.97Å; A97-Y99 VanDerWaalsContact O-N 3.07Å; A97-S100 PolarHBondContact O-N 3.03Å |
| 98 | M | 56 | Low | 53 | Low | 162 Ų | 162 | 134.9 Ų | 134.9 | 80% | 0.798 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -66.6 | -14 | -177.4 | -134.2 | -159.1 | 147.1 | 0 | 0 | 114.5 | A96 | A96-M98 VanDerWaalsContact C-N 3.31Å; A96-M98 PolarHBondContact O-N 3.3Å |
| 99 | Y | 53.5 | Low | 53 | Low | 203 Ų | 203 | 137.4 Ų | 137.4 | 80% | 0.796 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -109.5 | -4.8 | 178 | -76.4 | -80.6 | 0 | 0 | 0 | 114.6 | A96 A97 | A96-Y99 PolarHBondContact O-N 3.47Å; A97-Y99 PolarHBondContact O-N 2.97Å; A97-Y99 VanDerWaalsContact O-N 3.07Å |
| 100 | S | 55.1 | Low | 52.7 | Low | 95 Ų | 95 | 138.7 Ų | 138.7 | 66% | 0.664 | 74% | 0.744 | S | S | * | * | H | α-helix | trans | -96.5 | -9.1 | -176.7 | -59.4 | 0 | 0 | 0 | 0 | 114.7 | A96 A97 R102 | A96-S100 PolarHBondContact O-OG 3.26Å; A97-S100 PolarHBondContact O-N 3.03Å; S100-R102 PolarHBondContact O-N 3.44Å |
| 101 | E | 51.1 | Low | 51.7 | Low | 182 Ų | 182 | 141.1 Ų | 141.1 | 85% | 0.85 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85 | 6.3 | -176.7 | -81.3 | -170.1 | 160.5 | 0 | 0 | 115.7 | ||
| 102 | R | 55.4 | Low | 51.1 | Low | 241 Ų | 241 | 141.5 Ų | 141.5 | 91% | 0.909 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | 1.6 | -177 | -125.5 | -179.1 | -162.2 | 173.8 | 4.8 | 117.2 | S100 | S100-R102 PolarHBondContact O-N 3.44Š|
| 103 | E | 52.2 | Low | 50.6 | Low | 193 Ų | 193 | 143.6 Ų | 143.6 | 90% | 0.902 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -115.7 | 8.2 | -179.2 | -67.6 | -170.8 | 178.1 | 0 | 0 | 115.2 | ||
| 104 | A | 51.8 | Low | 50.2 | Low | 87 Ų | 87 | 145.4 Ų | 145.4 | 72% | 0.719 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -105.3 | 21.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 105 | K | 50.5 | Low | 49.8 | Very low | 205 Ų | 205 | 147.9 Ų | 147.9 | 89% | 0.891 | 78% | 0.777 | S | S | * | * | trans | -133.3 | 58.9 | 177.5 | -66.9 | -168.6 | 179.9 | -175.5 | 0 | 112.3 | ||||
| 106 | E | 53.1 | Low | 49.3 | Very low | 199 Ų | 199 | 149.7 Ų | 149.7 | 93% | 0.93 | 79% | 0.788 | S | S | * | * | trans | -149.5 | 49.5 | 162.6 | -143.4 | 170.8 | -157 | 0 | 0 | 110.7 | ||||
| 107 | S | 46.8 | Very low | 49.1 | Very low | 113 Ų | 113 | 151.7 Ų | 151.7 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -142.6 | 88.6 | 164.6 | 70.7 | 0 | 0 | 0 | 0 | 110.3 | ||
| 108 | G | 42.7 | Very low | 48.6 | Very low | 78 Ų | 78 | 155.4 Ų | 155.4 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | trans | 62.4 | 105 | 144.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 109 | E | 51.1 | Low | 48.2 | Very low | 180 Ų | 180 | 155.7 Ų | 155.7 | 84% | 0.841 | 81% | 0.814 | S | S | * | * | trans | -148.9 | 109.7 | 130.7 | -154.9 | 160.3 | -179.3 | 0 | 0 | 109.5 | ||||
| 110 | K | 43.7 | Very low | 48 | Very low | 207 Ų | 207 | 154.1 Ų | 154.1 | 90% | 0.9 | 82% | 0.82 | S | S | * | * | trans | -76.7 | 116.4 | 169.3 | -72.4 | 174.3 | 174.6 | 176.7 | 0 | 106.8 | ||||
| 111 | T | 40.5 | Very low | 47.8 | Very low | 125 Ų | 125 | 155.4 Ų | 155.4 | 77% | 0.767 | 82% | 0.823 | S | S | * | * | trans | -109.8 | 129.8 | 158.4 | 42.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 112 | P | 46.4 | Very low | 48.2 | Very low | 111 Ų | 111 | 152 Ų | 152 | 72% | 0.721 | 82% | 0.819 | S | S | * | * | trans | -89.4 | 152.7 | -169.1 | 36 | -33.3 | 0 | 0 | 0 | 112.4 | ||||
| 113 | K | 44 | Very low | 48.3 | Very low | 172 Ų | 172 | 144.6 Ų | 144.6 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | trans | 45.4 | 111 | 144 | -61.9 | -177.5 | 176.3 | -166.5 | 0 | 117.6 | ||||
| 114 | D | 46.7 | Very low | 48.2 | Very low | 167 Ų | 167 | 143 Ų | 143 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | -131 | 123.6 | 132.8 | -94.3 | -35.4 | 0 | 0 | 0 | 109 | ||||
| 115 | E | 46.5 | Very low | 48 | Very low | 163 Ų | 163 | 146.6 Ų | 146.6 | 76% | 0.762 | 80% | 0.804 | S | S | * | * | trans | -79.9 | 130.4 | 176.9 | -65.1 | 168.9 | 178.6 | 0 | 0 | 107.7 | ||||
| 116 | T | 44 | Very low | 48 | Very low | 136 Ų | 136 | 141.7 Ų | 141.7 | 83% | 0.834 | 80% | 0.802 | S | S | * | * | trans | -145.6 | 95.3 | 158.5 | 0.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 117 | S | 47.2 | Very low | 47.6 | Very low | 106 Ų | 106 | 142.4 Ų | 142.4 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | trans | -57 | 127.6 | 161.4 | 48.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 118 | T | 42.3 | Very low | 47.5 | Very low | 139 Ų | 139 | 140.4 Ų | 140.4 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | trans | -140.4 | 107.7 | 144.8 | 40.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 119 | E | 47 | Very low | 47.5 | Very low | 167 Ų | 167 | 142.3 Ų | 142.3 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | trans | -54.5 | 138.6 | 164.9 | -56.4 | 173.3 | 157 | 0 | 0 | 109.4 | ||||
| 120 | D | 49.8 | Very low | 47.5 | Very low | 170 Ų | 170 | 142.8 Ų | 142.8 | 91% | 0.909 | 79% | 0.793 | S | S | * | * | trans | -145.1 | 103.1 | 147.3 | -92.1 | -35 | 0 | 0 | 0 | 108.6 | ||||
| 121 | V | 50.6 | Low | 47.9 | Very low | 122 Ų | 122 | 137.8 Ų | 137.8 | 74% | 0.739 | 78% | 0.784 | S | S | * | * | trans | -68.3 | 118.5 | 173.8 | 173.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 122 | S | 60.8 | Low | 48.4 | Very low | 110 Ų | 110 | 141.5 Ų | 141.5 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | -130 | 77 | 161 | 179.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 123 | S | 56.9 | Low | 48.9 | Very low | 87 Ų | 87 | 140.9 Ų | 140.9 | 61% | 0.608 | 79% | 0.788 | S | S | * | * | trans | -62 | 123.4 | 157.3 | 40 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 124 | N | 50 | Low | 49.5 | Very low | 160 Ų | 160 | 141.5 Ų | 141.5 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | -142.9 | 98.9 | 148.1 | -99.1 | -23.6 | 0 | 0 | 0 | 108.7 | ||||
| 125 | E | 48.1 | Very low | 50.1 | Low | 161 Ų | 161 | 141 Ų | 141 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | trans | -59.3 | 139.3 | 159.8 | -60.5 | 170.3 | 152.4 | 0 | 0 | 109.5 | ||||
| 126 | A | 50 | Low | 50.6 | Low | 102 Ų | 102 | 139.6 Ų | 139.6 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | trans | -158.4 | 105.6 | 148 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 127 | Y | 45.4 | Very low | 51.3 | Low | 215 Ų | 215 | 136 Ų | 136 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | trans | -51.7 | 147.1 | 170.8 | -73.6 | -104.6 | 0 | 0 | 0 | 113 | ||||
| 128 | G | 43.4 | Very low | 52 | Low | 71 Ų | 71 | 139.1 Ų | 139.1 | 73% | 0.732 | 78% | 0.775 | S | S | * | * | trans | 177.5 | 59.8 | 173 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 129 | T | 43.7 | Very low | 52.8 | Low | 118 Ų | 118 | 138.4 Ų | 138.4 | 72% | 0.724 | 77% | 0.77 | S | S | * | * | trans | -31.2 | 136.4 | 152.3 | 32.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 130 | H | 50.2 | Low | 53.5 | Low | 190 Ų | 190 | 136.9 Ų | 136.9 | 88% | 0.88 | 77% | 0.767 | S | S | * | * | -164.4 | 131.3 | 125.1 | -78.4 | -46.4 | 0 | 0 | 0 | 111 | |||||
| 131 | S | 53 | Low | 54.2 | Low | 102 Ų | 102 | 134 Ų | 134 | 71% | 0.713 | 75% | 0.751 | S | S | * | * | trans | -69.1 | 166.8 | -173.7 | -39.7 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 132 | K | 49.5 | Very low | 55.1 | Low | 203 Ų | 203 | 133.9 Ų | 133.9 | 88% | 0.883 | 75% | 0.747 | S | S | * | * | trans | 79.4 | 124.4 | 158.9 | -58.7 | 167 | 177.2 | 179.4 | 0 | 113.3 | ||||
| 133 | S | 56.8 | Low | 55.7 | Low | 97 Ų | 97 | 131.8 Ų | 131.8 | 68% | 0.678 | 74% | 0.736 | S | S | * | * | cis | -152.8 | 138.5 | 38 | 44.5 | 0 | 0 | 0 | 0 | 110.9 | D135 | S133-D135 PolarHBondContact O-N 3.45Š| ||
| 134 | E | 57.9 | Low | 56.7 | Low | 185 Ų | 185 | 131.5 Ų | 131.5 | 86% | 0.864 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -3.1 | -168.7 | -75.1 | 179.6 | 148.4 | 0 | 0 | 115.9 | ||
| 135 | D | 58.8 | Low | 58 | Low | 156 Ų | 156 | 129.3 Ų | 129.3 | 83% | 0.834 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99 | -6.3 | -166.4 | -68.2 | -33.2 | 0 | 0 | 0 | 116.6 | S133 | S133-D135 PolarHBondContact O-N 3.45Š|
| 136 | D | 58 | Low | 59.4 | Low | 135 Ų | 135 | 126.6 Ų | 126.6 | 72% | 0.722 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -105.3 | 1.5 | 176.6 | -71.5 | -37.4 | 0 | 0 | 0 | 113.9 | Q138 | D136-Q138 VanDerWaalsContact C-N 3.34Å; D136-Q138 PolarHBondContact O-N 3.44Å |
| 137 | A | 58.7 | Low | 61 | Low | 60 Ų | 60 | 124.1 Ų | 124.1 | 50% | 0.496 | 69% | 0.69 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.1 | -12.1 | -171.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 138 | Q | 60.5 | Low | 63 | Low | 172 Ų | 172 | 116.9 Ų | 116.9 | 80% | 0.804 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -22.4 | -176.6 | -84.2 | -175.6 | -13.3 | 0 | 0 | 114.3 | D136 | D136-Q138 VanDerWaalsContact C-N 3.34Å; D136-Q138 PolarHBondContact O-N 3.44Å |
| 139 | V | 59.9 | Low | 65.1 | Low | 123 Ų | 123 | 119 Ų | 119 | 75% | 0.745 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -83.7 | -19.8 | -175.7 | -173.9 | 0 | 0 | 0 | 0 | 112.9 | ||
| 140 | L | 60.4 | Low | 67.3 | Low | 136 Ų | 136 | 120.9 Ų | 120.9 | 71% | 0.712 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -81.8 | -17.2 | -177.1 | -77.5 | 168 | 0 | 0 | 0 | 114.7 | D142 | L140-D142 PolarHBondContact O-N 3.42Š|
| 141 | N | 65.4 | Low | 69.2 | Low | 109 Ų | 109 | 119.3 Ų | 119.3 | 58% | 0.583 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -71.6 | -30.7 | -177.1 | -78 | -30.3 | 0 | 0 | 0 | 113.2 | A143 S144 M145 | N141-A143 PolarHBondContact O-N 2.9Å; N141-S144 PolarHBondContact O-N 3.33Å; N141-M145 PolarHBondContact O-N 3.38Å |
| 142 | D | 68.9 | Low | 71 | Confident | 119 Ų | 119 | 118.5 Ų | 118.5 | 64% | 0.636 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -69.4 | -33.8 | -176.9 | -69.8 | -12.9 | 0 | 0 | 0 | 112.6 | L140 S144 L146 | L140-D142 PolarHBondContact O-N 3.42Å; D142-S144 VanDerWaalsContact C-N 3.33Å; D142-S144 PolarHBondContact O-N 3.18Å; D142-L146 PolarHBondContact O-N 3.5Å |
| 143 | A | 73.5 | Confident | 73.1 | Confident | 67 Ų | 67 | 111.7 Ų | 111.7 | 55% | 0.554 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -68.1 | -32.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | N141 A147 | N141-A143 PolarHBondContact O-N 2.9Å; A143-A147 PolarHBondContact O-N 2.98Å |
| 144 | S | 78 | Confident | 74.9 | Confident | 81 Ų | 81 | 111.4 Ų | 111.4 | 57% | 0.566 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -70 | -41.4 | 179.6 | -174.8 | 0 | 0 | 0 | 0 | 112.2 | N141 D142 L146 A147 S148 | N141-S144 PolarHBondContact O-N 3.33Å; D142-S144 VanDerWaalsContact C-N 3.33Å; D142-S144 PolarHBondContact O-N 3.18Å; S144-L146 PolarHBondContact O-N 3.04Å; S144-A147 PolarHBondContact O-N 3.38Å; S144-S148 PolarHBondContact O-N 2.94Å |
| 145 | M | 76.9 | Confident | 76.6 | Confident | 113 Ų | 113 | 106.4 Ų | 106.4 | 56% | 0.557 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -57.7 | -47.8 | 176.5 | -83.1 | -119 | 56.6 | 0 | 0 | 111.6 | N141 A147 S148 E149 | N141-M145 PolarHBondContact O-N 3.38Å; M145-A147 VanDerWaalsContact C-N 3.29Å; M145-A147 PolarHBondContact O-N 3.09Å; M145-S148 PolarHBondContact O-N 2.92Å; M145-S148 PolarHBondContact O-OG 3.03Å; M145-E149 PolarHBondContact O-N 3.27Å |
| 146 | L | 79 | Confident | 78.4 | Confident | 105 Ų | 105 | 105.1 Ų | 105.1 | 55% | 0.55 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.3 | -31.5 | 179.2 | -67.9 | 174.5 | 0 | 0 | 0 | 113.3 | D142 S144 K150 | D142-L146 PolarHBondContact O-N 3.5Å; S144-L146 PolarHBondContact O-N 3.04Å; L146-K150 WeakPolarHBondContact O-CG 3.5Å; L146-K150 PolarHBondContact O-N 3.41Å |
| 147 | A | 84 | Confident | 80.2 | Confident | 49 Ų | 49 | 105.9 Ų | 105.9 | 41% | 0.405 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -71.2 | -37.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A143 S144 M145 K151 | A143-A147 PolarHBondContact O-N 2.98Å; S144-A147 PolarHBondContact O-N 3.38Å; M145-A147 VanDerWaalsContact C-N 3.29Å; M145-A147 PolarHBondContact O-N 3.09Å; A147-K151 WeakPolarHBondContact O-CG 3.23Å; A147-K151 PolarHBondContact O-N 3.19Å |
| 148 | S | 86.2 | Confident | 81.9 | Confident | 63 Ų | 63 | 107.7 Ų | 107.7 | 44% | 0.441 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -68.7 | -38.4 | 178.6 | 75.6 | 0 | 0 | 0 | 0 | 112.6 | S144 M145 K151 N152 | S144-S148 PolarHBondContact O-N 2.94Å; M145-S148 PolarHBondContact O-N 2.92Å; M145-S148 PolarHBondContact O-OG 3.03Å; S148-K151 PolarHBondContact O-N 3.01Å; S148-N152 PolarHBondContact O-N 3.34Å |
| 149 | E | 87.3 | Confident | 83.6 | Confident | 117 Ų | 117 | 102.6 Ų | 102.6 | 55% | 0.547 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.7 | -42.3 | 177 | -71.8 | -172.4 | 161.5 | 0 | 0 | 112.1 | M145 K151 N152 A153 | M145-E149 PolarHBondContact O-N 3.27Å; E149-K151 VanDerWaalsContact C-N 3.35Å; E149-K151 PolarHBondContact O-N 3.44Å; E149-N152 PolarHBondContact O-N 3.07Å; E149-A153 WeakPolarHBondContact O-CB 3.34Å; E149-A153 PolarHBondContact O-N 3.02Å |
| 150 | K | 89.4 | Confident | 85.4 | Confident | 156 Ų | 156 | 102.6 Ų | 102.6 | 68% | 0.678 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.7 | -42.4 | 175.7 | -73.6 | 178.2 | -178.8 | 178.8 | 0 | 112.1 | L146 A153 E154 | L146-K150 WeakPolarHBondContact O-CG 3.5Å; L146-K150 PolarHBondContact O-N 3.41Å; K150-A153 PolarHBondContact O-N 3.28Å; K150-E154 PolarHBondContact O-N 3.34Å |
| 151 | K | 91.2 | Very high | 87.2 | Confident | 157 Ų | 157 | 100.3 Ų | 100.3 | 68% | 0.683 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.2 | -40.3 | 176 | -71.1 | 179.4 | 179.7 | -179.6 | 0 | 111.9 | A147 S148 E149 E154 T155 | A147-K151 WeakPolarHBondContact O-CG 3.23Å; A147-K151 PolarHBondContact O-N 3.19Å; S148-K151 PolarHBondContact O-N 3.01Å; E149-K151 VanDerWaalsContact C-N 3.35Å; E149-K151 PolarHBondContact O-N 3.44Å; K151-E154 PolarHBondContact O-N 3.39Å; K151-T155 PolarHBondContact O-N 3.02Å; K151-T155 PolarHBondContact O-OG1 3.36Å |
| 152 | N | 91.7 | Very high | 88.7 | Confident | 85 Ų | 85 | 102.9 Ų | 102.9 | 46% | 0.455 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.5 | -42.8 | 176.9 | -167.5 | -9 | 0 | 0 | 0 | 111.6 | S148 E149 E154 T155 K156 | S148-N152 PolarHBondContact O-N 3.34Å; E149-N152 PolarHBondContact O-N 3.07Å; N152-E154 PolarHBondContact O-N 3.06Å; N152-T155 PolarHBondContact O-N 2.87Å; N152-K156 WeakPolarHBondContact O-CG 3.25Å; N152-K156 PolarHBondContact O-N 3.42Å; N152-K156 WeakPolarHBondContact OD1-CE 3.47Å |
| 153 | A | 92.5 | Very high | 90.1 | Very high | 60 Ų | 60 | 104 Ų | 104 | 50% | 0.496 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | E149 K150 K156 R157 | E149-A153 WeakPolarHBondContact O-CB 3.34Å; E149-A153 PolarHBondContact O-N 3.02Å; K150-A153 PolarHBondContact O-N 3.28Å; A153-K156 PolarHBondContact O-N 2.98Å; A153-R157 WeakPolarHBondContact O-CB 3.45Å; A153-R157 PolarHBondContact O-N 3.23Å |
| 154 | E | 94.4 | Very high | 91.2 | Very high | 91 Ų | 91 | 103.8 Ų | 103.8 | 43% | 0.425 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.8 | -39.2 | 178.3 | -169.2 | 59.3 | -160.3 | 0 | 0 | 112 | K150 K151 N152 K156 R157 M158 | K150-E154 PolarHBondContact O-N 3.34Å; K151-E154 PolarHBondContact O-N 3.39Å; N152-E154 PolarHBondContact O-N 3.06Å; E154-K156 PolarHBondContact O-N 2.77Å; E154-R157 WeakPolarHBondContact O-CB 3.21Å; E154-R157 PolarHBondContact O-N 3.44Å; E154-R157 IonicContact OE2-NH1 3.6Å; E154-M158 WeakPolarHBondContact O-CG 3.4Å; E154-M158 PolarHBondContact O-N 3.47Å |
| 155 | T | 94.6 | Very high | 92.2 | Very high | 80 Ų | 80 | 104.3 Ų | 104.3 | 49% | 0.491 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.9 | -46.8 | 175.1 | -52.8 | 0 | 0 | 0 | 0 | 111 | K151 N152 R157 M158 D159 | K151-T155 PolarHBondContact O-N 3.02Å; K151-T155 PolarHBondContact O-OG1 3.36Å; N152-T155 PolarHBondContact O-N 2.87Å; T155-R157 VanDerWaalsContact C-N 3.3Å; T155-R157 PolarHBondContact O-N 3.48Å; T155-M158 PolarHBondContact O-N 3.36Å; T155-D159 PolarHBondContact O-N 3.11Å |
| 156 | K | 94.8 | Very high | 93.2 | Very high | 129 Ų | 129 | 102.6 Ų | 102.6 | 56% | 0.561 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.9 | -38.9 | 175.8 | -73.3 | 172.6 | 176.9 | 172.2 | 0 | 112.5 | N152 A153 E154 F160 | N152-K156 WeakPolarHBondContact O-CG 3.25Å; N152-K156 PolarHBondContact O-N 3.42Å; N152-K156 WeakPolarHBondContact OD1-CE 3.47Å; A153-K156 PolarHBondContact O-N 2.98Å; E154-K156 PolarHBondContact O-N 2.77Å; K156-F160 WeakPolarHBondContact O-CB 3.35Å; K156-F160 PolarHBondContact O-N 2.84Å |
| 157 | R | 95.9 | Very high | 94.1 | Very high | 152 Ų | 152 | 105.1 Ų | 105.1 | 57% | 0.574 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.1 | -45.6 | 176 | -176.6 | -174.1 | 179.3 | -171.7 | 0.4 | 111.4 | A153 E154 T155 F160 L161 | A153-R157 WeakPolarHBondContact O-CB 3.45Å; A153-R157 PolarHBondContact O-N 3.23Å; E154-R157 WeakPolarHBondContact O-CB 3.21Å; E154-R157 PolarHBondContact O-N 3.44Å; E154-R157 IonicContact OE2-NH1 3.6Å; T155-R157 VanDerWaalsContact C-N 3.3Å; T155-R157 PolarHBondContact O-N 3.48Å; R157-F160 WeakPolarHBondContact O-CB 3.37Å; R157-F160 PolarHBondContact O-N 3.42Å; R157-L161 WeakPolarHBondContact O-CG 3.46Å; R157-L161 PolarHBondContact O-N 3.19Å |
| 158 | M | 95.6 | Very high | 94.8 | Very high | 98 Ų | 98 | 106 Ų | 106 | 48% | 0.483 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.7 | -40.1 | 178.1 | -70.9 | -58.2 | -69.9 | 0 | 0 | 112.2 | E154 T155 F160 L161 R162 | E154-M158 WeakPolarHBondContact O-CG 3.4Å; E154-M158 PolarHBondContact O-N 3.47Å; T155-M158 PolarHBondContact O-N 3.36Å; M158-F160 VanDerWaalsContact C-N 3.32Å; M158-F160 PolarHBondContact O-N 3.38Å; M158-L161 PolarHBondContact O-N 3.38Å; M158-L161 HydrophobicContact SD-CD1 4.28Å; M158-R162 WeakPolarHBondContact O-CB 3.44Å; M158-R162 PolarHBondContact O-N 3.19Å |
| 159 | D | 96.6 | Very high | 95.3 | Very high | 64 Ų | 64 | 110.3 Ų | 110.3 | 34% | 0.342 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.7 | -35.2 | 174.7 | -74.1 | -21.1 | 0 | 0 | 0 | 112.6 | T155 R163 | T155-D159 PolarHBondContact O-N 3.11Å; D159-R163 WeakPolarHBondContact O-CG 3.41Å; D159-R163 PolarHBondContact O-N 3.44Å; D159-R163 VanDerWaalsContact O-N 3.11Å; D159-R163 PolarHBondContact O-NE 3.03Å |
| 160 | F | 97.5 | Very high | 95.8 | Very high | 123 Ų | 123 | 109 Ų | 109 | 54% | 0.539 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64 | -49.2 | 172.1 | 177.1 | -97.7 | 0 | 0 | 0 | 111.6 | K156 R157 M158 R162 R163 V164 | K156-F160 WeakPolarHBondContact O-CB 3.35Å; K156-F160 PolarHBondContact O-N 2.84Å; R157-F160 WeakPolarHBondContact O-CB 3.37Å; R157-F160 PolarHBondContact O-N 3.42Å; M158-F160 VanDerWaalsContact C-N 3.32Å; M158-F160 PolarHBondContact O-N 3.38Å; F160-R162 VanDerWaalsContact C-N 3.32Å; F160-R162 PolarHBondContact O-N 3.04Å; F160-R163 PolarHBondContact O-N 3.34Å; F160-R163 VanDerWaalsContact O-N 3.15Å; F160-V164 HydrophobicContact CD1-CG2 4.2Å; F160-V164 HydrophobicContact CE1-CG2 3.73Å; F160-V164 HydrophobicContact CE2-CG2 4.14Å; F160-V164 HydrophobicContact CZ-CG2 3.7Å; F160-V164 WeakPolarHBondContact O-CG2 3.36Å; F160-V164 PolarHBondContact O-N 2.95Å |
| 161 | L | 97.6 | Very high | 96.2 | Very high | 88 Ų | 88 | 110.3 Ų | 110.3 | 46% | 0.461 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.8 | -41.9 | 178 | -69.7 | 175.5 | 0 | 0 | 0 | 112 | R157 M158 R163 V164 E165 | R157-L161 WeakPolarHBondContact O-CG 3.46Å; R157-L161 PolarHBondContact O-N 3.19Å; M158-L161 PolarHBondContact O-N 3.38Å; M158-L161 HydrophobicContact SD-CD1 4.28Å; L161-R163 VanDerWaalsContact C-N 3.33Å; L161-R163 PolarHBondContact O-N 2.92Å; L161-V164 PolarHBondContact O-N 3.35Å; L161-E165 WeakPolarHBondContact O-CB 3.48Å; L161-E165 PolarHBondContact O-N 3.43Å |
| 162 | R | 97.8 | Very high | 96.5 | Very high | 163 Ų | 163 | 107.9 Ų | 107.9 | 62% | 0.615 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60 | -41.7 | 175.4 | -168.5 | -174.9 | -59.3 | 177 | 4.7 | 112.1 | M158 F160 M166 | M158-R162 WeakPolarHBondContact O-CB 3.44Å; M158-R162 PolarHBondContact O-N 3.19Å; F160-R162 VanDerWaalsContact C-N 3.32Å; F160-R162 PolarHBondContact O-N 3.04Å; R162-M166 WeakPolarHBondContact O-CB 3.41Å; R162-M166 PolarHBondContact O-N 2.93Å |
| 163 | R | 97.6 | Very high | 96.8 | Very high | 143 Ų | 143 | 106.3 Ų | 106.3 | 54% | 0.54 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.7 | -45.3 | 175.4 | -78.3 | -177.9 | -75.2 | -166 | -1.2 | 111.8 | D159 F160 L161 E165 M166 Y167 | D159-R163 WeakPolarHBondContact O-CG 3.41Å; D159-R163 PolarHBondContact O-N 3.44Å; D159-R163 VanDerWaalsContact O-N 3.11Å; D159-R163 PolarHBondContact O-NE 3.03Å; F160-R163 PolarHBondContact O-N 3.34Å; F160-R163 VanDerWaalsContact O-N 3.15Å; L161-R163 VanDerWaalsContact C-N 3.33Å; L161-R163 PolarHBondContact O-N 2.92Å; R163-E165 PolarHBondContact O-N 3.49Å; R163-M166 PolarHBondContact O-N 3.19Å; R163-Y167 WeakPolarHBondContact O-CD2 3.44Å; R163-Y167 PolarHBondContact O-N 3.43Å |
| 164 | V | 97 | Very high | 97.1 | Very high | 63 Ų | 63 | 113.1 Ų | 113.1 | 38% | 0.382 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 177.6 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | F160 L161 M166 Y167 T168 | F160-V164 HydrophobicContact CD1-CG2 4.2Å; F160-V164 HydrophobicContact CE1-CG2 3.73Å; F160-V164 HydrophobicContact CE2-CG2 4.14Å; F160-V164 HydrophobicContact CZ-CG2 3.7Å; F160-V164 WeakPolarHBondContact O-CG2 3.36Å; F160-V164 PolarHBondContact O-N 2.95Å; L161-V164 PolarHBondContact O-N 3.35Å; V164-M166 VanDerWaalsContact C-N 3.35Å; V164-M166 PolarHBondContact O-N 3.44Å; V164-Y167 PolarHBondContact O-N 3.2Å; V164-T168 WeakPolarHBondContact O-CB 3.31Å; V164-T168 PolarHBondContact O-N 2.95Å; V164-T168 PolarHBondContact O-OG1 3.23Å |
| 165 | E | 98.1 | Very high | 97.2 | Very high | 92 Ų | 92 | 112.2 Ų | 112.2 | 43% | 0.43 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.4 | -43.6 | 176.2 | -172.3 | -177.6 | -169 | 0 | 0 | 111.5 | L161 R163 T168 R169 | L161-E165 WeakPolarHBondContact O-CB 3.48Å; L161-E165 PolarHBondContact O-N 3.43Å; R163-E165 PolarHBondContact O-N 3.49Å; E165-T168 WeakPolarHBondContact O-CB 3.37Å; E165-T168 PolarHBondContact O-N 3.39Å; E165-R169 WeakPolarHBondContact O-CG 3.43Å; E165-R169 PolarHBondContact O-N 3.1Å; E165-R169 IonicContact OE1-CZ 3.2Å; E165-R169 IonicContact OE1-NE 3.91Å; E165-R169 IonicContact OE1-NH1 3.65Å; E165-R169 IonicContact OE1-NH2 2.63Å; E165-R169 PolarHBondContact OE1-NH2 3.43Å |
| 166 | M | 98.3 | Very high | 97.4 | Very high | 77 Ų | 77 | 116.6 Ų | 116.6 | 38% | 0.379 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61 | -46.1 | 176 | -176.9 | -78.3 | -63.7 | 0 | 0 | 111.9 | R162 R163 V164 T168 R169 N170 | R162-M166 WeakPolarHBondContact O-CB 3.41Å; R162-M166 PolarHBondContact O-N 2.93Å; R163-M166 PolarHBondContact O-N 3.19Å; V164-M166 VanDerWaalsContact C-N 3.35Å; V164-M166 PolarHBondContact O-N 3.44Å; M166-T168 VanDerWaalsContact C-N 3.29Å; M166-T168 PolarHBondContact O-N 3.45Å; M166-R169 PolarHBondContact O-N 3.01Å; M166-N170 WeakPolarHBondContact O-CB 3.43Å; M166-N170 PolarHBondContact O-N 3.24Å; M166-N170 PolarHBondContact SD-ND2 2.77Å |
| 167 | Y | 98.4 | Very high | 97.5 | Very high | 158 Ų | 158 | 113.1 Ų | 113.1 | 62% | 0.62 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.5 | -38.2 | 175 | -78.1 | -64.8 | 0 | 0 | 0 | 112.5 | R163 V164 N170 R171 | R163-Y167 WeakPolarHBondContact O-CD2 3.44Å; R163-Y167 PolarHBondContact O-N 3.43Å; V164-Y167 PolarHBondContact O-N 3.2Å; Y167-N170 PolarHBondContact O-N 2.91Å; Y167-R171 VanDerWaalsContact O-CB 3.32Å; Y167-R171 WeakPolarHBondContact O-CB 3.42Å; Y167-R171 PolarHBondContact O-N 2.91Å |
| 168 | T | 97.7 | Very high | 97.6 | Very high | 68 Ų | 68 | 109.2 Ų | 109.2 | 42% | 0.417 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.8 | -48.5 | 177.7 | -54.6 | 0 | 0 | 0 | 0 | 110.6 | V164 E165 M166 N170 R171 E172 | V164-T168 WeakPolarHBondContact O-CB 3.31Å; V164-T168 PolarHBondContact O-N 2.95Å; V164-T168 PolarHBondContact O-OG1 3.23Å; E165-T168 WeakPolarHBondContact O-CB 3.37Å; E165-T168 PolarHBondContact O-N 3.39Å; M166-T168 VanDerWaalsContact C-N 3.29Å; M166-T168 PolarHBondContact O-N 3.45Å; T168-N170 PolarHBondContact O-N 3.49Å; T168-R171 PolarHBondContact O-N 2.84Å; T168-E172 WeakPolarHBondContact O-CG 3.43Å; T168-E172 PolarHBondContact O-N 2.91Å |
| 169 | R | 98 | Very high | 97.7 | Very high | 152 Ų | 152 | 112.7 Ų | 112.7 | 57% | 0.574 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59 | -44 | 174.6 | -74.4 | -178 | 178.3 | 145.6 | 4.7 | 112.5 | E165 M166 R171 E172 A173 | E165-R169 WeakPolarHBondContact O-CG 3.43Å; E165-R169 PolarHBondContact O-N 3.1Å; E165-R169 IonicContact OE1-CZ 3.2Å; E165-R169 IonicContact OE1-NE 3.91Å; E165-R169 IonicContact OE1-NH1 3.65Å; E165-R169 IonicContact OE1-NH2 2.63Å; E165-R169 PolarHBondContact OE1-NH2 3.43Å; M166-R169 PolarHBondContact O-N 3.01Å; R169-R171 PolarHBondContact O-N 3.34Å; R169-E172 PolarHBondContact O-N 3.45Å; R169-A173 VanDerWaalsContact O-CB 3.31Å; R169-A173 WeakPolarHBondContact O-CB 3.43Å; R169-A173 PolarHBondContact O-N 2.91Å |
| 170 | N | 97.7 | Very high | 97.7 | Very high | 89 Ų | 89 | 112.9 Ų | 112.9 | 48% | 0.476 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.7 | -39.9 | 177.7 | -82.8 | -10.5 | 0 | 0 | 0 | 112.3 | M166 Y167 T168 A173 R174 | M166-N170 WeakPolarHBondContact O-CB 3.43Å; M166-N170 PolarHBondContact O-N 3.24Å; M166-N170 PolarHBondContact SD-ND2 2.77Å; Y167-N170 PolarHBondContact O-N 2.91Å; T168-N170 PolarHBondContact O-N 3.49Å; N170-A173 PolarHBondContact O-N 3.47Å; N170-R174 WeakPolarHBondContact O-CG 3.33Å; N170-R174 PolarHBondContact O-N 3.47Å |
| 171 | R | 97.6 | Very high | 97.7 | Very high | 185 Ų | 185 | 109.9 Ų | 109.9 | 70% | 0.698 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.4 | -46 | 174.7 | -177 | 179.4 | 179.4 | -177.9 | 0.4 | 111.1 | Y167 T168 R169 R174 I175 | Y167-R171 VanDerWaalsContact O-CB 3.32Å; Y167-R171 WeakPolarHBondContact O-CB 3.42Å; Y167-R171 PolarHBondContact O-N 2.91Å; T168-R171 PolarHBondContact O-N 2.84Å; R169-R171 PolarHBondContact O-N 3.34Å; R171-R174 PolarHBondContact O-N 3.09Å; R171-I175 HydrophobicContact CG-CD1 4.09Å; R171-I175 WeakPolarHBondContact O-CG1 3.35Å; R171-I175 PolarHBondContact O-N 3.18Å |
| 172 | E | 98.1 | Very high | 97.7 | Very high | 105 Ų | 105 | 111.5 Ų | 111.5 | 49% | 0.491 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 176.9 | -73.5 | 178.5 | -176.8 | 0 | 0 | 112.3 | T168 R169 R174 I175 R176 | T168-E172 WeakPolarHBondContact O-CG 3.43Å; T168-E172 PolarHBondContact O-N 2.91Å; R169-E172 PolarHBondContact O-N 3.45Å; E172-R174 PolarHBondContact O-N 3.11Å; E172-I175 PolarHBondContact O-N 3.15Å; E172-R176 WeakPolarHBondContact O-CB 3.44Å; E172-R176 PolarHBondContact O-N 3.25Å |
| 173 | A | 98.1 | Very high | 97.6 | Very high | 52 Ų | 52 | 108.2 Ų | 108.2 | 43% | 0.43 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.4 | -44 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | R169 N170 R176 A177 | R169-A173 VanDerWaalsContact O-CB 3.31Å; R169-A173 WeakPolarHBondContact O-CB 3.43Å; R169-A173 PolarHBondContact O-N 2.91Å; N170-A173 PolarHBondContact O-N 3.47Å; A173-R176 PolarHBondContact O-N 2.63Å; A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.16Å |
| 174 | R | 97.7 | Very high | 97.6 | Very high | 203 Ų | 203 | 107.7 Ų | 107.7 | 77% | 0.766 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.7 | -44.3 | 174.5 | -76.7 | 178.9 | 61.6 | -177.8 | -1 | 112.5 | N170 R171 E172 A177 C178 | N170-R174 WeakPolarHBondContact O-CG 3.33Å; N170-R174 PolarHBondContact O-N 3.47Å; R171-R174 PolarHBondContact O-N 3.09Å; E172-R174 PolarHBondContact O-N 3.11Å; R174-A177 PolarHBondContact O-N 2.94Å; R174-C178 WeakPolarHBondContact O-CB 3.42Å; R174-C178 PolarHBondContact O-N 3.46Å |
| 175 | I | 97.3 | Very high | 97.5 | Very high | 73 Ų | 73 | 108.8 Ų | 108.8 | 37% | 0.374 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64 | -43.2 | 177.8 | -67.6 | 166.4 | 0 | 0 | 0 | 110.4 | R171 E172 C178 R179 | R171-I175 HydrophobicContact CG-CD1 4.09Å; R171-I175 WeakPolarHBondContact O-CG1 3.35Å; R171-I175 PolarHBondContact O-N 3.18Å; E172-I175 PolarHBondContact O-N 3.15Å; I175-C178 PolarHBondContact O-N 3.14Å; I175-R179 WeakPolarHBondContact O-CG 3.45Å; I175-R179 PolarHBondContact O-N 3.05Å |
| 176 | R | 97.9 | Very high | 97.4 | Very high | 172 Ų | 172 | 106.4 Ų | 106.4 | 65% | 0.649 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.6 | -45.7 | 177.2 | -169.7 | -179 | -67.2 | 157.9 | 0.9 | 111.1 | E172 A173 C178 R179 T180 | E172-R176 WeakPolarHBondContact O-CB 3.44Å; E172-R176 PolarHBondContact O-N 3.25Å; A173-R176 PolarHBondContact O-N 2.63Å; R176-C178 VanDerWaalsContact C-N 3.34Å; R176-C178 PolarHBondContact O-N 3Å; R176-R179 PolarHBondContact O-N 3.36Å; R176-T180 WeakPolarHBondContact O-CG2 3.45Å; R176-T180 PolarHBondContact O-N 2.93Å; R176-T180 PolarHBondContact O-OG1 2.95Å |
| 177 | A | 97.9 | Very high | 97.3 | Very high | 55 Ų | 55 | 109.3 Ų | 109.3 | 46% | 0.455 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -57.8 | -46.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | A173 R174 R179 T180 S181 | A173-A177 WeakPolarHBondContact O-CB 3.45Å; A173-A177 PolarHBondContact O-N 3.16Å; R174-A177 PolarHBondContact O-N 2.94Å; A177-R179 PolarHBondContact O-N 3.38Å; A177-T180 WeakPolarHBondContact CA-OG1 3.49Å; A177-T180 PolarHBondContact O-N 3.29Å; A177-T180 PolarHBondContact O-OG1 3.34Å; A177-S181 PolarHBondContact O-N 3.34Å; A177-S181 PolarHBondContact O-OG 2.95Å |
| 178 | C | 97.5 | Very high | 97.1 | Very high | 70 Ų | 70 | 107.9 Ų | 107.9 | 47% | 0.473 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 176.3 | -174.8 | 0 | 0 | 0 | 0 | 112.7 | R174 I175 R176 T180 S181 M182 | R174-C178 WeakPolarHBondContact O-CB 3.42Å; R174-C178 PolarHBondContact O-N 3.46Å; I175-C178 PolarHBondContact O-N 3.14Å; R176-C178 VanDerWaalsContact C-N 3.34Å; R176-C178 PolarHBondContact O-N 3Å; C178-T180 PolarHBondContact O-N 2.98Å; C178-S181 PolarHBondContact O-N 3.39Å; C178-S181 PolarHBondContact O-OG 3Å; C178-M182 WeakPolarHBondContact O-CG 3.33Å; C178-M182 PolarHBondContact O-N 3.08Å |
| 179 | R | 97.6 | Very high | 96.8 | Very high | 172 Ų | 172 | 108 Ų | 108 | 65% | 0.649 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.4 | -44.8 | 175.3 | -71.4 | 177.7 | -179.7 | 173.8 | 0.4 | 111.7 | I175 R176 A177 S181 M182 D183 | I175-R179 WeakPolarHBondContact O-CG 3.45Å; I175-R179 PolarHBondContact O-N 3.05Å; R176-R179 PolarHBondContact O-N 3.36Å; A177-R179 PolarHBondContact O-N 3.38Å; R179-S181 VanDerWaalsContact C-N 3.32Å; R179-S181 PolarHBondContact O-N 2.8Å; R179-M182 PolarHBondContact O-N 2.91Å; R179-D183 PolarHBondContact O-N 3.49Å |
| 180 | T | 97.4 | Very high | 96.5 | Very high | 67 Ų | 67 | 111 Ų | 111 | 41% | 0.411 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.3 | -32.7 | 179 | 59.6 | 0 | 0 | 0 | 0 | 113.1 | R176 A177 C178 K184 | R176-T180 WeakPolarHBondContact O-CG2 3.45Å; R176-T180 PolarHBondContact O-N 2.93Å; R176-T180 PolarHBondContact O-OG1 2.95Å; A177-T180 WeakPolarHBondContact CA-OG1 3.49Å; A177-T180 PolarHBondContact O-N 3.29Å; A177-T180 PolarHBondContact O-OG1 3.34Å; C178-T180 PolarHBondContact O-N 2.98Å; T180-K184 VanDerWaalsContact O-CG 3.23Å; T180-K184 WeakPolarHBondContact O-CG 3.31Å; T180-K184 PolarHBondContact O-N 2.79Å |
| 181 | S | 97.4 | Very high | 96.3 | Very high | 60 Ų | 60 | 114.5 Ų | 114.5 | 42% | 0.42 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -70.1 | -42.8 | 174.8 | 65.4 | 0 | 0 | 0 | 0 | 111 | A177 C178 R179 D183 K184 T185 | A177-S181 PolarHBondContact O-N 3.34Å; A177-S181 PolarHBondContact O-OG 2.95Å; C178-S181 PolarHBondContact O-N 3.39Å; C178-S181 PolarHBondContact O-OG 3Å; R179-S181 VanDerWaalsContact C-N 3.32Å; R179-S181 PolarHBondContact O-N 2.8Å; S181-D183 PolarHBondContact O-N 2.89Å; S181-K184 PolarHBondContact O-N 3.22Å; S181-T185 WeakPolarHBondContact O-CG2 3.42Å; S181-T185 PolarHBondContact O-N 3.39Å; S181-T185 PolarHBondContact O-OG1 3.46Å |
| 182 | M | 96.2 | Very high | 96 | Very high | 122 Ų | 122 | 113.7 Ų | 113.7 | 60% | 0.601 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.2 | -40.8 | 173.4 | -71.3 | -174 | 68.8 | 0 | 0 | 112.7 | C178 R179 K184 T185 A186 | C178-M182 WeakPolarHBondContact O-CG 3.33Å; C178-M182 PolarHBondContact O-N 3.08Å; R179-M182 PolarHBondContact O-N 2.91Å; M182-K184 VanDerWaalsContact C-N 3.32Å; M182-K184 PolarHBondContact O-N 2.95Å; M182-T185 PolarHBondContact O-N 3.49Å; M182-T185 PolarHBondContact O-OG1 3.16Å; M182-A186 VanDerWaalsContact O-CB 3.25Å; M182-A186 WeakPolarHBondContact O-CB 3.25Å; M182-A186 PolarHBondContact O-N 3.46Å |
| 183 | D | 97.3 | Very high | 95.4 | Very high | 94 Ų | 94 | 117.1 Ų | 117.1 | 50% | 0.503 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -66.8 | -34.9 | 177.1 | -76.8 | -27.4 | 0 | 0 | 0 | 112.2 | R179 S181 K187 | R179-D183 PolarHBondContact O-N 3.49Å; S181-D183 PolarHBondContact O-N 2.89Å; D183-K187 WeakPolarHBondContact O-CB 3.37Å; D183-K187 WeakPolarHBondContact O-CG 3.39Å; D183-K187 PolarHBondContact O-N 3.39Å |
| 184 | K | 96.8 | Very high | 94.9 | Very high | 133 Ų | 133 | 118.2 Ų | 118.2 | 58% | 0.578 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -65.6 | -49.7 | 174.7 | -75.9 | 172.4 | -178 | -175.1 | 0 | 111.1 | T180 S181 M182 A186 K187 E188 | T180-K184 VanDerWaalsContact O-CG 3.23Å; T180-K184 WeakPolarHBondContact O-CG 3.31Å; T180-K184 PolarHBondContact O-N 2.79Å; S181-K184 PolarHBondContact O-N 3.22Å; M182-K184 VanDerWaalsContact C-N 3.32Å; M182-K184 PolarHBondContact O-N 2.95Å; K184-A186 VanDerWaalsContact C-N 3.31Å; K184-A186 PolarHBondContact O-N 3.09Å; K184-K187 PolarHBondContact O-N 3.15Å; K184-K187 VanDerWaalsContact O-N 3.17Å; K184-E188 WeakPolarHBondContact O-CG 3.46Å; K184-E188 PolarHBondContact O-N 3.46Å |
| 185 | T | 95.2 | Very high | 94.4 | Very high | 86 Ų | 86 | 117.8 Ų | 117.8 | 53% | 0.528 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64 | -37.3 | 178.2 | 57.6 | 0 | 0 | 0 | 0 | 111.7 | S181 M182 E188 A189 | S181-T185 WeakPolarHBondContact O-CG2 3.42Å; S181-T185 PolarHBondContact O-N 3.39Å; S181-T185 PolarHBondContact O-OG1 3.46Å; M182-T185 PolarHBondContact O-N 3.49Å; M182-T185 PolarHBondContact O-OG1 3.16Å; T185-E188 PolarHBondContact O-N 2.66Å; T185-A189 WeakPolarHBondContact O-CB 3.48Å; T185-A189 PolarHBondContact O-N 3.28Å |
| 186 | A | 95.3 | Very high | 94.2 | Very high | 41 Ų | 41 | 120 Ų | 120 | 34% | 0.339 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -64.7 | -40.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | M182 K184 A189 R190 | M182-A186 VanDerWaalsContact O-CB 3.25Å; M182-A186 WeakPolarHBondContact O-CB 3.25Å; M182-A186 PolarHBondContact O-N 3.46Å; K184-A186 VanDerWaalsContact C-N 3.31Å; K184-A186 PolarHBondContact O-N 3.09Å; A186-A189 PolarHBondContact O-N 3.4Å; A186-R190 WeakPolarHBondContact O-CG 3.5Å; A186-R190 PolarHBondContact O-N 3.29Å; A186-R190 VanDerWaalsContact O-N 3.08Å |
| 187 | K | 95.9 | Very high | 93.7 | Very high | 138 Ų | 138 | 115.8 Ų | 115.8 | 60% | 0.6 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -66.2 | -39.5 | 174.5 | -76.7 | 171.8 | -176.8 | 179.4 | 0 | 111.9 | D183 K184 R190 K191 | D183-K187 WeakPolarHBondContact O-CB 3.37Å; D183-K187 WeakPolarHBondContact O-CG 3.39Å; D183-K187 PolarHBondContact O-N 3.39Å; K184-K187 PolarHBondContact O-N 3.15Å; K184-K187 VanDerWaalsContact O-N 3.17Å; K187-R190 PolarHBondContact O-N 3.48Å; K187-K191 WeakPolarHBondContact O-CG 3.35Å; K187-K191 PolarHBondContact O-N 3.49Å |
| 188 | E | 94.4 | Very high | 93.3 | Very high | 128 Ų | 128 | 117.5 Ų | 117.5 | 60% | 0.598 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -65.8 | -42.7 | 175.1 | -74.4 | 171.6 | -169.5 | 0 | 0 | 111.7 | K184 T185 R190 K191 F192 | K184-E188 WeakPolarHBondContact O-CG 3.46Å; K184-E188 PolarHBondContact O-N 3.46Å; T185-E188 PolarHBondContact O-N 2.66Å; E188-R190 VanDerWaalsContact C-N 3.27Å; E188-R190 PolarHBondContact O-N 2.91Å; E188-K191 WeakPolarHBondContact O-CA 3.36Å; E188-K191 WeakPolarHBondContact O-CB 3.42Å; E188-K191 PolarHBondContact O-N 3.25Å; E188-F192 PolarHBondContact O-N 3.39Å |
| 189 | A | 91.9 | Very high | 92.8 | Very high | 71 Ų | 71 | 123 Ų | 123 | 59% | 0.587 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -60 | -36.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | T185 A186 K191 F192 | T185-A189 WeakPolarHBondContact O-CB 3.48Å; T185-A189 PolarHBondContact O-N 3.28Å; A186-A189 PolarHBondContact O-N 3.4Å; A189-K191 VanDerWaalsContact C-N 3.3Å; A189-K191 PolarHBondContact O-N 2.91Å; A189-F192 VanDerWaalsContact O-CB 3.25Å; A189-F192 WeakPolarHBondContact O-CB 3.38Å; A189-F192 PolarHBondContact O-N 3.41Å |
| 190 | R | 92.1 | Very high | 92.1 | Very high | 214 Ų | 214 | 122.6 Ų | 122.6 | 81% | 0.808 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -69.2 | -24.9 | 173.9 | -71.6 | 176.1 | -173.1 | 179.9 | 3.4 | 113.6 | A186 K187 E188 F192 | A186-R190 WeakPolarHBondContact O-CG 3.5Å; A186-R190 PolarHBondContact O-N 3.29Å; A186-R190 VanDerWaalsContact O-N 3.08Å; K187-R190 PolarHBondContact O-N 3.48Å; E188-R190 VanDerWaalsContact C-N 3.27Å; E188-R190 PolarHBondContact O-N 2.91Å; R190-F192 VanDerWaalsContact C-N 3.26Å |
| 191 | K | 92.8 | Very high | 91.2 | Very high | 164 Ų | 164 | 127 Ų | 127 | 71% | 0.713 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -7.2 | 174.5 | -69.2 | 175.4 | -177.8 | -177.2 | 0 | 112.8 | K187 E188 A189 Q193 | K187-K191 WeakPolarHBondContact O-CG 3.35Å; K187-K191 PolarHBondContact O-N 3.49Å; E188-K191 WeakPolarHBondContact O-CA 3.36Å; E188-K191 WeakPolarHBondContact O-CB 3.42Å; E188-K191 PolarHBondContact O-N 3.25Å; A189-K191 VanDerWaalsContact C-N 3.3Å; A189-K191 PolarHBondContact O-N 2.91Å; K191-Q193 VanDerWaalsContact C-N 3.3Å; K191-Q193 PolarHBondContact O-N 3.09Å |
| 192 | F | 91.1 | Very high | 89.7 | Confident | 168 Ų | 168 | 132.1 Ų | 132.1 | 74% | 0.737 | 67% | 0.67 | S | S | * | * | trans | -66.4 | 91.4 | 175.9 | -175.1 | -99.8 | 0 | 0 | 0 | 109.9 | E188 A189 R190 A194 | E188-F192 PolarHBondContact O-N 3.39Å; A189-F192 VanDerWaalsContact O-CB 3.25Å; A189-F192 WeakPolarHBondContact O-CB 3.38Å; A189-F192 PolarHBondContact O-N 3.41Å; R190-F192 VanDerWaalsContact C-N 3.26Å; F192-A194 HydrophobicContact CE1-CB 4.32Å; F192-A194 PolarHBondContact O-N 2.99Å | ||
| 193 | Q | 86.4 | Confident | 87.9 | Confident | 176 Ų | 176 | 131.7 Ų | 131.7 | 82% | 0.822 | 68% | 0.675 | S | S | * | * | trans | -81.5 | 111.4 | 167 | -62.7 | -156.5 | 15.6 | 0 | 0 | 107.8 | K191 K195 | K191-Q193 VanDerWaalsContact C-N 3.3Å; K191-Q193 PolarHBondContact O-N 3.09Å; Q193-K195 PolarHBondContact O-N 3.49Å | ||
| 194 | A | 87.9 | Confident | 86.4 | Confident | 76 Ų | 76 | 136.3 Ų | 136.3 | 63% | 0.628 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 124.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | F192 | F192-A194 HydrophobicContact CE1-CB 4.32Å; F192-A194 PolarHBondContact O-N 2.99Å |
| 195 | K | 86.9 | Confident | 84.9 | Confident | 194 Ų | 194 | 139.4 Ų | 139.4 | 84% | 0.843 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 134.9 | 172.8 | -66.4 | -179.8 | -179.3 | 178.3 | 0 | 107.7 | Q193 A197 | Q193-K195 PolarHBondContact O-N 3.49Å; K195-A197 PolarHBondContact O-N 2.9Å |
| 196 | P | 91.7 | Very high | 83.3 | Confident | 119 Ų | 119 | 142.3 Ų | 142.3 | 77% | 0.773 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 143 | 178.2 | 23.4 | -32.8 | 0 | 0 | 0 | 109.1 | ||
| 197 | A | 88.8 | Confident | 81.9 | Confident | 84 Ų | 84 | 144.2 Ų | 144.2 | 69% | 0.694 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 131.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | K195 K199 | K195-A197 PolarHBondContact O-N 2.9Å; A197-K199 PolarHBondContact O-N 3.29Å |
| 198 | P | 89 | Confident | 80.3 | Confident | 90 Ų | 90 | 145.6 Ų | 145.6 | 58% | 0.584 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 129 | -179.5 | 17.1 | -26.5 | 0 | 0 | 0 | 109 | F200 | P198-F200 HydrophobicContact CB-CE2 4.48Å; P198-F200 HydrophobicContact CB-CZ 4.49Å; P198-F200 HydrophobicContact CG-CE2 3.87Å; P198-F200 HydrophobicContact CG-CZ 3.87Å; P198-F200 WeakPolarHBondContact O-CD2 3.36Å; P198-F200 PolarHBondContact O-N 3.27Å |
| 199 | K | 86.8 | Confident | 78.9 | Confident | 187 Ų | 187 | 143.8 Ų | 143.8 | 81% | 0.813 | 75% | 0.746 | S | S | * | * | trans | -69.1 | 96.2 | 178.4 | -66.2 | -178.8 | -178 | 179.5 | 0 | 108 | A197 H201 | A197-K199 PolarHBondContact O-N 3.29Å; K199-H201 PolarHBondContact O-N 3.48Å | ||
| 200 | F | 82.3 | Confident | 77.8 | Confident | 163 Ų | 163 | 151.2 Ų | 151.2 | 72% | 0.715 | 76% | 0.759 | S | S | * | * | trans | -71.3 | 101.4 | 169.9 | -63.9 | -78.8 | 0 | 0 | 0 | 107.6 | P198 L202 | P198-F200 HydrophobicContact CB-CE2 4.48Å; P198-F200 HydrophobicContact CB-CZ 4.49Å; P198-F200 HydrophobicContact CG-CE2 3.87Å; P198-F200 HydrophobicContact CG-CZ 3.87Å; P198-F200 WeakPolarHBondContact O-CD2 3.36Å; P198-F200 PolarHBondContact O-N 3.27Å; F200-L202 VanDerWaalsContact C-N 3.33Å; F200-L202 PolarHBondContact O-N 3.47Å | ||
| 201 | H | 78.4 | Confident | 76.7 | Confident | 160 Ų | 160 | 147.4 Ų | 147.4 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | trans | -62.2 | 101.8 | 164 | -62.6 | -71 | 0 | 0 | 0 | 107 | K199 T203 | K199-H201 PolarHBondContact O-N 3.48Å; H201-T203 PolarHBondContact O-N 3.32Å | ||
| 202 | L | 67 | Low | 75.8 | Confident | 167 Ų | 167 | 148.8 Ų | 148.8 | 87% | 0.874 | 77% | 0.765 | S | S | * | * | trans | -62.9 | 10.2 | -178.6 | -88 | 119.6 | 0 | 0 | 0 | 114.2 | F200 | F200-L202 VanDerWaalsContact C-N 3.33Å; F200-L202 PolarHBondContact O-N 3.47Å | ||
| 203 | T | 58.4 | Low | 75.3 | Confident | 112 Ų | 112 | 146.7 Ų | 146.7 | 69% | 0.687 | 77% | 0.766 | S | S | * | * | trans | -127 | 49.7 | -163.6 | 52.5 | 0 | 0 | 0 | 0 | 112.2 | H201 | H201-T203 PolarHBondContact O-N 3.32Š| ||
| 204 | K | 65.6 | Low | 75.2 | Confident | 192 Ų | 192 | 144.5 Ų | 144.5 | 84% | 0.835 | 77% | 0.765 | S | S | * | * | trans | -91.7 | 92.1 | 139.1 | -69.7 | -172.1 | -177.4 | -175.3 | 0 | 105.3 | I206 | K204-I206 VanDerWaalsContact C-N 3.31Å; K204-I206 PolarHBondContact O-N 3.25Å | ||
| 205 | K | 64.6 | Low | 75.2 | Confident | 198 Ų | 198 | 151.5 Ų | 151.5 | 86% | 0.861 | 78% | 0.775 | S | S | * | * | trans | -43.2 | 108.1 | 162.4 | -66.7 | -178.9 | 179.7 | -178.1 | 0 | 104.6 | A207 | K205-A207 PolarHBondContact O-N 2.94Š| ||
| 206 | I | 62.2 | Low | 75.4 | Confident | 146 Ų | 146 | 148.1 Ų | 148.1 | 75% | 0.749 | 77% | 0.773 | S | S | * | * | trans | -65 | 90.2 | 173.6 | -61.7 | 169 | 0 | 0 | 0 | 101.9 | K204 N208 | K204-I206 VanDerWaalsContact C-N 3.31Å; K204-I206 PolarHBondContact O-N 3.25Å; I206-N208 PolarHBondContact O-N 2.97Å; I206-N208 VanDerWaalsContact O-N 3.11Å | ||
| 207 | A | 65.5 | Low | 75.4 | Confident | 82 Ų | 82 | 150.8 Ų | 150.8 | 68% | 0.678 | 78% | 0.775 | S | S | * | * | trans | -47.4 | 125.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 104.9 | K205 S209 | K205-A207 PolarHBondContact O-N 2.94Å; A207-S209 PolarHBondContact O-N 3.42Å | ||
| 208 | N | 63 | Low | 75.6 | Confident | 166 Ų | 166 | 152.6 Ų | 152.6 | 89% | 0.888 | 78% | 0.78 | S | S | * | * | trans | -47 | 64.7 | -170.3 | -65.7 | -26.1 | 0 | 0 | 0 | 113.3 | I206 R210 | I206-N208 PolarHBondContact O-N 2.97Å; I206-N208 VanDerWaalsContact O-N 3.11Å; N208-R210 PolarHBondContact O-N 3.11Å | ||
| 209 | S | 64.7 | Low | 75.8 | Confident | 90 Ų | 90 | 156.1 Ų | 156.1 | 63% | 0.629 | 79% | 0.787 | S | S | * | * | trans | -72 | 104.6 | 174.2 | 66.3 | 0 | 0 | 0 | 0 | 102.2 | A207 T211 | A207-S209 PolarHBondContact O-N 3.42Å; S209-T211 PolarHBondContact O-N 3.15Å | ||
| 210 | R | 69.5 | Low | 76.1 | Confident | 228 Ų | 228 | 156 Ų | 156 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | trans | -27.4 | 115.4 | 171 | -74.1 | 179.1 | 173.5 | -175.6 | -2.7 | 107.7 | N208 K212 | N208-R210 PolarHBondContact O-N 3.11Å; R210-K212 PolarHBondContact O-N 2.89Å | ||
| 211 | T | 67.4 | Low | 76.6 | Confident | 133 Ų | 133 | 154.6 Ų | 154.6 | 82% | 0.816 | 79% | 0.788 | S | S | * | * | trans | -50.6 | 92.8 | -178 | 36 | 0 | 0 | 0 | 0 | 107.8 | S209 T213 | S209-T211 PolarHBondContact O-N 3.15Å; T211-T213 VanDerWaalsContact C-N 3.3Å; T211-T213 PolarHBondContact O-N 3.39Å | ||
| 212 | K | 74.2 | Confident | 77.3 | Confident | 193 Ų | 193 | 155.9 Ų | 155.9 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | trans | -66.8 | 104.9 | 168.5 | -70.4 | -174.9 | -178.8 | -177.5 | 0 | 102.9 | R210 T214 | R210-K212 PolarHBondContact O-N 2.89Å; K212-T214 VanDerWaalsContact C-N 3.28Å; K212-T214 PolarHBondContact O-N 3.07Å | ||
| 213 | T | 81.1 | Confident | 78.7 | Confident | 124 Ų | 124 | 152.2 Ų | 152.2 | 76% | 0.761 | 77% | 0.771 | S | S | * | * | trans | -55.8 | 99.7 | 172.3 | -57 | 0 | 0 | 0 | 0 | 106.5 | T211 R215 | T211-T213 VanDerWaalsContact C-N 3.3Å; T211-T213 PolarHBondContact O-N 3.39Å; T213-R215 PolarHBondContact O-N 3.39Å | ||
| 214 | T | 84.5 | Confident | 80.5 | Confident | 131 Ų | 131 | 150.3 Ų | 150.3 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -61.7 | 105 | 177 | -58.1 | 0 | 0 | 0 | 0 | 106.2 | K212 | K212-T214 VanDerWaalsContact C-N 3.28Å; K212-T214 PolarHBondContact O-N 3.07Å | ||
| 215 | R | 87.9 | Confident | 81.9 | Confident | 222 Ų | 222 | 145.9 Ų | 145.9 | 84% | 0.838 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 130.2 | 174 | -68.9 | -173.4 | 175.7 | -174.8 | -1.4 | 107.1 | T213 Q217 | T213-R215 PolarHBondContact O-N 3.39Å; R215-Q217 PolarHBondContact O-N 3.43Å; R215-Q217 VanDerWaalsContact O-N 3.13Å |
| 216 | P | 90.6 | Very high | 83.5 | Confident | 124 Ų | 124 | 145.3 Ų | 145.3 | 81% | 0.805 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 121.4 | 177.5 | 25.1 | -32.8 | 0 | 0 | 0 | 108.4 | ||
| 217 | Q | 91.4 | Very high | 85.2 | Confident | 174 Ų | 174 | 141.2 Ų | 141.2 | 81% | 0.813 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 123.2 | 173.3 | -172.6 | 175.3 | 4.4 | 0 | 0 | 107.7 | R215 F219 | R215-Q217 PolarHBondContact O-N 3.43Å; R215-Q217 VanDerWaalsContact O-N 3.13Å; Q217-F219 PolarHBondContact O-N 3.49Å |
| 218 | P | 92.7 | Very high | 86.7 | Confident | 123 Ų | 123 | 143.2 Ų | 143.2 | 80% | 0.799 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 130 | 173 | 26.6 | -32.6 | 0 | 0 | 0 | 108.7 | ||
| 219 | F | 93.5 | Very high | 88.4 | Confident | 163 Ų | 163 | 141.2 Ų | 141.2 | 72% | 0.715 | 71% | 0.71 | S | S | * | * | trans | -112.9 | 139.1 | 174.8 | 61.7 | -86.5 | 0 | 0 | 0 | 109.2 | Q217 L221 | Q217-F219 PolarHBondContact O-N 3.49Å; F219-L221 HydrophobicContact CD2-CD2 4.07Å; F219-L221 HydrophobicContact CD2-CG 4.31Å; F219-L221 HydrophobicContact CE2-CD2 3.6Å; F219-L221 HydrophobicContact CE2-CG 3.96Å | ||
| 220 | Q | 93.2 | Very high | 90 | Very high | 185 Ų | 185 | 145 Ų | 145 | 86% | 0.864 | 71% | 0.711 | S | S | * | * | trans | -88.3 | 125.5 | 174.5 | -67.1 | 177.6 | -2.1 | 0 | 0 | 108.9 | R222 | Q220-R222 PolarHBondContact O-N 3.14Š| ||
| 221 | L | 92.9 | Very high | 91.4 | Very high | 134 Ų | 134 | 140.7 Ų | 140.7 | 70% | 0.702 | 70% | 0.698 | S | S | * | * | trans | -75 | 114.9 | 175.3 | -73.3 | 172.9 | 0 | 0 | 0 | 109.6 | F219 T223 | F219-L221 HydrophobicContact CD2-CD2 4.07Å; F219-L221 HydrophobicContact CD2-CG 4.31Å; F219-L221 HydrophobicContact CE2-CD2 3.6Å; F219-L221 HydrophobicContact CE2-CG 3.96Å; L221-T223 PolarHBondContact O-N 3.12Å | ||
| 222 | R | 94.4 | Very high | 92.9 | Very high | 186 Ų | 186 | 139.7 Ų | 139.7 | 70% | 0.702 | 68% | 0.684 | S | S | * | * | trans | -77.9 | 45.3 | 175.5 | -64.3 | 177.1 | 178.3 | -177.9 | 2.5 | 112.6 | Q220 A224 E225 R226 | Q220-R222 PolarHBondContact O-N 3.14Å; R222-A224 VanDerWaalsContact C-N 3.33Å; R222-A224 PolarHBondContact O-N 3.15Å; R222-E225 HydrophobicContact CB-CB 4.41Å; R222-E225 WeakPolarHBondContact CD-OE2 3.32Å; R222-R226 PolarHBondContact O-N 3.47Å | ||
| 223 | T | 95.4 | Very high | 94 | Very high | 90 Ų | 90 | 136.5 Ų | 136.5 | 55% | 0.552 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -67.3 | -36 | -175.9 | -52.1 | 0 | 0 | 0 | 0 | 111.4 | L221 R226 A227 | L221-T223 PolarHBondContact O-N 3.12Å; T223-R226 PolarHBondContact O-N 3.18Å; T223-A227 PolarHBondContact O-N 3.31Å |
| 224 | A | 95.7 | Very high | 94.8 | Very high | 73 Ų | 73 | 135.1 Ų | 135.1 | 60% | 0.603 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -62.6 | -50.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | R222 R226 A227 E228 | R222-A224 VanDerWaalsContact C-N 3.33Å; R222-A224 PolarHBondContact O-N 3.15Å; A224-R226 VanDerWaalsContact C-N 3.31Å; A224-R226 PolarHBondContact O-N 3.42Å; A224-A227 WeakPolarHBondContact O-CB 3.43Å; A224-A227 PolarHBondContact O-N 3.05Å; A224-A227 VanDerWaalsContact O-N 3.09Å; A224-E228 PolarHBondContact O-N 3.43Å |
| 225 | E | 96.6 | Very high | 95.5 | Very high | 98 Ų | 98 | 132.9 Ų | 132.9 | 46% | 0.458 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -58.5 | -42.5 | 177.2 | -63.6 | 175.8 | -165.4 | 0 | 0 | 111.9 | R222 A227 E228 Q229 | R222-E225 HydrophobicContact CB-CB 4.41Å; R222-E225 WeakPolarHBondContact CD-OE2 3.32Å; E225-A227 VanDerWaalsContact C-N 3.32Å; E225-A227 PolarHBondContact O-N 3.41Å; E225-E228 PolarHBondContact O-N 3.26Å; E225-Q229 WeakPolarHBondContact O-CG 3.48Å; E225-Q229 PolarHBondContact O-N 3.03Å |
| 226 | R | 97.1 | Very high | 96 | Very high | 187 Ų | 187 | 128.5 Ų | 128.5 | 71% | 0.706 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -62.8 | -39 | 176.7 | -174 | -176.1 | -65.8 | 175.4 | -0.5 | 112 | R222 T223 A224 Q229 R230 | R222-R226 PolarHBondContact O-N 3.47Å; T223-R226 PolarHBondContact O-N 3.18Å; A224-R226 VanDerWaalsContact C-N 3.31Å; A224-R226 PolarHBondContact O-N 3.42Å; R226-Q229 PolarHBondContact O-N 2.97Å; R226-R230 WeakPolarHBondContact O-CB 3.43Å; R226-R230 PolarHBondContact O-N 3.26Å |
| 227 | A | 97.8 | Very high | 96.3 | Very high | 60 Ų | 60 | 126.2 Ų | 126.2 | 50% | 0.496 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -65.7 | -40.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | T223 A224 E225 R230 K231 | T223-A227 PolarHBondContact O-N 3.31Å; A224-A227 WeakPolarHBondContact O-CB 3.43Å; A224-A227 PolarHBondContact O-N 3.05Å; A224-A227 VanDerWaalsContact O-N 3.09Å; E225-A227 VanDerWaalsContact C-N 3.32Å; E225-A227 PolarHBondContact O-N 3.41Å; A227-R230 PolarHBondContact O-N 3.42Å; A227-K231 PolarHBondContact O-N 2.96Å |
| 228 | E | 98.1 | Very high | 96.7 | Very high | 124 Ų | 124 | 124.7 Ų | 124.7 | 58% | 0.579 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -64.6 | -45 | 175.1 | -69.7 | -177.5 | 176.6 | 0 | 0 | 112.3 | A224 E225 R230 K231 Q232 | A224-E228 PolarHBondContact O-N 3.43Å; E225-E228 PolarHBondContact O-N 3.26Å; E228-R230 VanDerWaalsContact C-N 3.29Å; E228-R230 PolarHBondContact O-N 3.4Å; E228-K231 WeakPolarHBondContact O-CB 3.49Å; E228-K231 PolarHBondContact O-N 2.88Å; E228-Q232 WeakPolarHBondContact O-CG 3.35Å; E228-Q232 PolarHBondContact O-N 2.81Å |
| 229 | Q | 98.1 | Very high | 96.9 | Very high | 123 Ų | 123 | 124.9 Ų | 124.9 | 58% | 0.575 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -59.5 | -41.3 | 175.8 | -73 | 176.3 | -2.6 | 0 | 0 | 111.8 | E225 R226 Q232 F233 | E225-Q229 WeakPolarHBondContact O-CG 3.48Å; E225-Q229 PolarHBondContact O-N 3.03Å; R226-Q229 PolarHBondContact O-N 2.97Å; Q229-Q232 PolarHBondContact O-N 3.32Å; Q229-F233 WeakPolarHBondContact O-CB 3.49Å; Q229-F233 PolarHBondContact O-N 3.35Å |
| 230 | R | 98 | Very high | 97.1 | Very high | 169 Ų | 169 | 124.2 Ų | 124.2 | 64% | 0.638 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -63.1 | -44.6 | 175.6 | -175.4 | 173.3 | 179.4 | 160.4 | 5.2 | 111.6 | R226 A227 E228 Q232 F233 E234 | R226-R230 WeakPolarHBondContact O-CB 3.43Å; R226-R230 PolarHBondContact O-N 3.26Å; A227-R230 PolarHBondContact O-N 3.42Å; E228-R230 VanDerWaalsContact C-N 3.29Å; E228-R230 PolarHBondContact O-N 3.4Å; R230-Q232 VanDerWaalsContact C-N 3.32Å; R230-Q232 PolarHBondContact O-N 2.94Å; R230-F233 PolarHBondContact O-N 3.2Å; R230-E234 WeakPolarHBondContact CG-OE1 3.47Å; R230-E234 IonicContact CZ-OE1 3.94Å; R230-E234 IonicContact NE-OE1 3.03Å; R230-E234 PolarHBondContact NE-OE1 2.84Å; R230-E234 IonicContact NH2-OE1 3.97Å; R230-E234 WeakPolarHBondContact O-CG 3.3Å; R230-E234 PolarHBondContact O-N 2.85Å |
| 231 | K | 98.3 | Very high | 97.3 | Very high | 139 Ų | 139 | 121.1 Ų | 121.1 | 60% | 0.604 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -59.7 | -42 | 175.4 | -173.6 | -179.4 | 179.2 | -177.6 | 0 | 111.8 | A227 E228 N235 | A227-K231 PolarHBondContact O-N 2.96Å; E228-K231 WeakPolarHBondContact O-CB 3.49Å; E228-K231 PolarHBondContact O-N 2.88Å; K231-N235 WeakPolarHBondContact O-CB 3.07Å; K231-N235 PolarHBondContact O-N 2.93Å; K231-N235 PolarHBondContact O-ND2 3.17Å |
| 232 | Q | 98.5 | Very high | 97.6 | Very high | 111 Ų | 111 | 118.6 Ų | 118.6 | 52% | 0.519 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64 | -41.1 | 175.7 | -69.5 | 175.8 | 10.5 | 0 | 0 | 112.2 | E228 Q229 R230 N235 K236 | E228-Q232 WeakPolarHBondContact O-CG 3.35Å; E228-Q232 PolarHBondContact O-N 2.81Å; Q229-Q232 PolarHBondContact O-N 3.32Å; R230-Q232 VanDerWaalsContact C-N 3.32Å; R230-Q232 PolarHBondContact O-N 2.94Å; Q232-N235 PolarHBondContact O-N 2.99Å; Q232-K236 WeakPolarHBondContact O-CG 3.32Å; Q232-K236 PolarHBondContact O-N 3.33Å |
| 233 | F | 98.5 | Very high | 97.7 | Very high | 126 Ų | 126 | 112.1 Ų | 112.1 | 55% | 0.553 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.7 | -45.6 | 177.5 | -179.4 | -100.9 | 0 | 0 | 0 | 112.1 | Q229 R230 N235 K236 L237 | Q229-F233 WeakPolarHBondContact O-CB 3.49Å; Q229-F233 PolarHBondContact O-N 3.35Å; R230-F233 PolarHBondContact O-N 3.2Å; F233-N235 VanDerWaalsContact C-N 3.33Å; F233-N235 PolarHBondContact O-N 2.98Å; F233-K236 PolarHBondContact O-N 3.34Å; F233-L237 HydrophobicContact CD1-CD1 3.89Å; F233-L237 HydrophobicContact CD1-CG 4.39Å; F233-L237 HydrophobicContact CE1-CD1 3.31Å; F233-L237 HydrophobicContact CE1-CG 3.98Å; F233-L237 HydrophobicContact CZ-CD1 3.81Å; F233-L237 HydrophobicContact CZ-CD2 4.44Å; F233-L237 HydrophobicContact CZ-CG 4.09Å; F233-L237 PolarHBondContact O-N 3.15Å |
| 234 | E | 98.1 | Very high | 97.8 | Very high | 95 Ų | 95 | 112.7 Ų | 112.7 | 44% | 0.444 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.6 | -40.8 | 176.5 | -72.3 | 172.7 | -171.2 | 0 | 0 | 111.5 | R230 K236 L237 K238 | R230-E234 WeakPolarHBondContact CG-OE1 3.47Å; R230-E234 IonicContact CZ-OE1 3.94Å; R230-E234 IonicContact NE-OE1 3.03Å; R230-E234 PolarHBondContact NE-OE1 2.84Å; R230-E234 IonicContact NH2-OE1 3.97Å; R230-E234 WeakPolarHBondContact O-CG 3.3Å; R230-E234 PolarHBondContact O-N 2.85Å; E234-K236 PolarHBondContact O-N 3.45Å; E234-L237 PolarHBondContact O-N 3.16Å; E234-K238 WeakPolarHBondContact O-CB 3.42Å; E234-K238 PolarHBondContact O-N 3.26Å |
| 235 | N | 98.6 | Very high | 97.8 | Very high | 84 Ų | 84 | 115.5 Ų | 115.5 | 45% | 0.449 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.2 | -44 | 173.5 | -73.6 | -14.9 | 0 | 0 | 0 | 112.3 | K231 Q232 F233 K238 Q239 | K231-N235 WeakPolarHBondContact O-CB 3.07Å; K231-N235 PolarHBondContact O-N 2.93Å; K231-N235 PolarHBondContact O-ND2 3.17Å; Q232-N235 PolarHBondContact O-N 2.99Å; F233-N235 VanDerWaalsContact C-N 3.33Å; F233-N235 PolarHBondContact O-N 2.98Å; N235-K238 PolarHBondContact O-N 3.43Å; N235-Q239 WeakPolarHBondContact O-CG 3.45Å; N235-Q239 PolarHBondContact O-N 3.28Å |
| 236 | K | 98.4 | Very high | 97.9 | Very high | 130 Ų | 130 | 118.2 Ų | 118.2 | 57% | 0.565 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.1 | -40.8 | 176.9 | -74.3 | 178.1 | -179.6 | -179 | 0 | 112 | Q232 F233 E234 Q239 K240 | Q232-K236 WeakPolarHBondContact O-CG 3.32Å; Q232-K236 PolarHBondContact O-N 3.33Å; F233-K236 PolarHBondContact O-N 3.34Å; E234-K236 PolarHBondContact O-N 3.45Å; K236-Q239 PolarHBondContact O-N 3.01Å; K236-K240 WeakPolarHBondContact O-CG 3.43Å; K236-K240 PolarHBondContact O-N 3.04Å |
| 237 | L | 97.6 | Very high | 97.9 | Very high | 77 Ų | 77 | 114.5 Ų | 114.5 | 40% | 0.403 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.8 | -46.1 | 175 | -81.1 | 179.8 | 0 | 0 | 0 | 111.5 | F233 E234 Q239 K240 Q241 | F233-L237 HydrophobicContact CD1-CD1 3.89Å; F233-L237 HydrophobicContact CD1-CG 4.39Å; F233-L237 HydrophobicContact CE1-CD1 3.31Å; F233-L237 HydrophobicContact CE1-CG 3.98Å; F233-L237 HydrophobicContact CZ-CD1 3.81Å; F233-L237 HydrophobicContact CZ-CD2 4.44Å; F233-L237 HydrophobicContact CZ-CG 4.09Å; F233-L237 PolarHBondContact O-N 3.15Å; E234-L237 PolarHBondContact O-N 3.16Å; L237-Q239 PolarHBondContact O-N 3.37Å; L237-K240 PolarHBondContact O-N 3.35Å; L237-Q241 WeakPolarHBondContact O-CG 3.46Å; L237-Q241 PolarHBondContact O-N 2.96Å |
| 238 | K | 98.3 | Very high | 97.8 | Very high | 141 Ų | 141 | 116.8 Ų | 116.8 | 61% | 0.613 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.4 | -44.1 | 177.5 | -171.1 | 178.2 | 179.2 | -177.7 | 0 | 111.8 | E234 N235 K240 Q241 E242 | E234-K238 WeakPolarHBondContact O-CB 3.42Å; E234-K238 PolarHBondContact O-N 3.26Å; N235-K238 PolarHBondContact O-N 3.43Å; K238-K240 VanDerWaalsContact C-N 3.33Å; K238-K240 PolarHBondContact O-N 2.94Å; K238-Q241 PolarHBondContact O-N 3.36Å; K238-E242 WeakPolarHBondContact O-CB 3.47Å; K238-E242 PolarHBondContact O-N 2.9Å |
| 239 | Q | 98.2 | Very high | 97.8 | Very high | 128 Ų | 128 | 113.6 Ų | 113.6 | 60% | 0.598 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60 | -41.4 | 175.4 | -75 | 174.4 | -5 | 0 | 0 | 112.4 | N235 K236 L237 A243 | N235-Q239 WeakPolarHBondContact O-CG 3.45Å; N235-Q239 PolarHBondContact O-N 3.28Å; K236-Q239 PolarHBondContact O-N 3.01Å; L237-Q239 PolarHBondContact O-N 3.37Å; Q239-A243 WeakPolarHBondContact O-CB 3.42Å; Q239-A243 PolarHBondContact O-N 2.94Å |
| 240 | K | 97.7 | Very high | 97.8 | Very high | 148 Ų | 148 | 111.3 Ų | 111.3 | 64% | 0.643 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.7 | -42.4 | 176.5 | -74.6 | -174.9 | 175 | -169.8 | 0 | 112.2 | K236 L237 K238 A243 I244 | K236-K240 WeakPolarHBondContact O-CG 3.43Å; K236-K240 PolarHBondContact O-N 3.04Å; L237-K240 PolarHBondContact O-N 3.35Å; K238-K240 VanDerWaalsContact C-N 3.33Å; K238-K240 PolarHBondContact O-N 2.94Å; K240-A243 PolarHBondContact O-N 2.83Å; K240-I244 WeakPolarHBondContact O-CG1 3.33Å; K240-I244 PolarHBondContact O-N 3.35Å; K240-I244 VanDerWaalsContact O-N 3.08Å |
| 241 | Q | 97.1 | Very high | 97.7 | Very high | 120 Ų | 120 | 110.2 Ų | 110.2 | 56% | 0.561 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62 | -48.1 | 176 | -73.9 | 173.6 | -18.9 | 0 | 0 | 111.1 | L237 K238 A243 I244 E245 | L237-Q241 WeakPolarHBondContact O-CG 3.46Å; L237-Q241 PolarHBondContact O-N 2.96Å; K238-Q241 PolarHBondContact O-N 3.36Å; Q241-A243 VanDerWaalsContact C-N 3.3Å; Q241-A243 PolarHBondContact O-N 2.89Å; Q241-I244 PolarHBondContact O-N 3.47Å; Q241-I244 VanDerWaalsContact O-N 3.14Å; Q241-E245 WeakPolarHBondContact O-CG 3.42Å; Q241-E245 PolarHBondContact O-N 2.98Å |
| 242 | E | 98.1 | Very high | 97.6 | Very high | 82 Ų | 82 | 112.1 Ų | 112.1 | 38% | 0.383 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -60.8 | -38.6 | 177.3 | -172.4 | 179 | 178 | 0 | 0 | 112 | K238 E245 R246 | K238-E242 WeakPolarHBondContact O-CB 3.47Å; K238-E242 PolarHBondContact O-N 2.9Å; E242-E245 PolarHBondContact O-N 3.23Å; E242-R246 WeakPolarHBondContact O-CB 3.44Å; E242-R246 VanDerWaalsContact O-CG 3.3Å; E242-R246 WeakPolarHBondContact O-CG 3.44Å; E242-R246 PolarHBondContact O-N 3.02Å; E242-R246 IonicContact OE1-CZ 3.4Å; E242-R246 IonicContact OE1-NE 3.46Å; E242-R246 PolarHBondContact OE1-NE 3.03Å; E242-R246 IonicContact OE1-NH2 2.66Å; E242-R246 PolarHBondContact OE1-NH2 3.48Å |
| 243 | A | 97.8 | Very high | 97.5 | Very high | 49 Ų | 49 | 114.4 Ų | 114.4 | 41% | 0.405 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.3 | -41.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q239 K240 Q241 L247 | Q239-A243 WeakPolarHBondContact O-CB 3.42Å; Q239-A243 PolarHBondContact O-N 2.94Å; K240-A243 PolarHBondContact O-N 2.83Å; Q241-A243 VanDerWaalsContact C-N 3.3Å; Q241-A243 PolarHBondContact O-N 2.89Å; A243-L247 WeakPolarHBondContact O-CG 3.42Å; A243-L247 PolarHBondContact O-N 2.79Å |
| 244 | I | 96.2 | Very high | 97.5 | Very high | 102 Ų | 102 | 116.2 Ų | 116.2 | 52% | 0.523 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.7 | -44.3 | 176.3 | -68 | 166.6 | 0 | 0 | 0 | 110.5 | K240 Q241 R246 L247 L248 | K240-I244 WeakPolarHBondContact O-CG1 3.33Å; K240-I244 PolarHBondContact O-N 3.35Å; K240-I244 VanDerWaalsContact O-N 3.08Å; Q241-I244 PolarHBondContact O-N 3.47Å; Q241-I244 VanDerWaalsContact O-N 3.14Å; I244-R246 PolarHBondContact O-N 3Å; I244-L247 PolarHBondContact O-N 3.02Å; I244-L248 HydrophobicContact CG2-CD1 4.05Å; I244-L248 HydrophobicContact CG2-CG 4.5Å; I244-L248 WeakPolarHBondContact O-CG 3.35Å; I244-L248 PolarHBondContact O-N 3Å |
| 245 | E | 96.6 | Very high | 97.4 | Very high | 133 Ų | 133 | 113.8 Ų | 113.8 | 62% | 0.621 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.1 | -43.6 | 177.4 | -73.5 | 177.7 | -178.9 | 0 | 0 | 111.9 | Q241 E242 L248 A249 | Q241-E245 WeakPolarHBondContact O-CG 3.42Å; Q241-E245 PolarHBondContact O-N 2.98Å; E242-E245 PolarHBondContact O-N 3.23Å; E245-L248 PolarHBondContact O-N 3.41Å; E245-A249 WeakPolarHBondContact O-CB 3.45Å; E245-A249 PolarHBondContact O-N 2.89Å |
| 246 | R | 98.1 | Very high | 97.3 | Very high | 154 Ų | 154 | 114.3 Ų | 114.3 | 58% | 0.581 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60 | -46 | 174.4 | -73.9 | 178.6 | -171.9 | -173.6 | 3.3 | 112 | E242 I244 L248 A249 D250 | E242-R246 WeakPolarHBondContact O-CB 3.44Å; E242-R246 VanDerWaalsContact O-CG 3.3Å; E242-R246 WeakPolarHBondContact O-CG 3.44Å; E242-R246 PolarHBondContact O-N 3.02Å; E242-R246 IonicContact OE1-CZ 3.4Å; E242-R246 IonicContact OE1-NE 3.46Å; E242-R246 PolarHBondContact OE1-NE 3.03Å; E242-R246 IonicContact OE1-NH2 2.66Å; E242-R246 PolarHBondContact OE1-NH2 3.48Å; I244-R246 PolarHBondContact O-N 3Å; R246-L248 VanDerWaalsContact C-N 3.32Å; R246-L248 PolarHBondContact O-N 3.21Å; R246-A249 PolarHBondContact O-N 3.41Å; R246-D250 PolarHBondContact O-N 3.48Å |
| 247 | L | 97.4 | Very high | 97.3 | Very high | 110 Ų | 110 | 112.1 Ų | 112.1 | 58% | 0.576 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -61.9 | -38.7 | 177.4 | -74.8 | 174 | 0 | 0 | 0 | 112.6 | A243 I244 K251 | A243-L247 WeakPolarHBondContact O-CG 3.42Å; A243-L247 PolarHBondContact O-N 2.79Å; I244-L247 PolarHBondContact O-N 3.02Å; L247-K251 WeakPolarHBondContact O-CG 3.37Å; L247-K251 PolarHBondContact O-N 3.13Å; L247-K251 VanDerWaalsContact O-N 3.09Å |
| 248 | L | 96.6 | Very high | 97.3 | Very high | 108 Ų | 108 | 113.3 Ų | 113.3 | 57% | 0.565 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -69.1 | -40.3 | 176.2 | -71.4 | 172.8 | 0 | 0 | 0 | 111.8 | I244 E245 R246 K251 R252 | I244-L248 HydrophobicContact CG2-CD1 4.05Å; I244-L248 HydrophobicContact CG2-CG 4.5Å; I244-L248 WeakPolarHBondContact O-CG 3.35Å; I244-L248 PolarHBondContact O-N 3Å; E245-L248 PolarHBondContact O-N 3.41Å; R246-L248 VanDerWaalsContact C-N 3.32Å; R246-L248 PolarHBondContact O-N 3.21Å; L248-K251 PolarHBondContact O-N 2.94Å; L248-R252 WeakPolarHBondContact O-CB 3.42Å; L248-R252 PolarHBondContact O-N 3.1Å |
| 249 | A | 97.5 | Very high | 97.2 | Very high | 56 Ų | 56 | 112 Ų | 112 | 46% | 0.463 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63 | -43.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | E245 R246 K251 R252 R253 | E245-A249 WeakPolarHBondContact O-CB 3.45Å; E245-A249 PolarHBondContact O-N 2.89Å; R246-A249 PolarHBondContact O-N 3.41Å; A249-K251 PolarHBondContact O-N 3.35Å; A249-R252 PolarHBondContact O-N 3.31Å; A249-R253 WeakPolarHBondContact O-CB 3.49Å; A249-R253 PolarHBondContact O-N 3.5Å |
| 250 | D | 97.9 | Very high | 97.2 | Very high | 76 Ų | 76 | 108.6 Ų | 108.6 | 41% | 0.406 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.5 | -41.5 | 176.7 | -76.5 | -18.7 | 0 | 0 | 0 | 112 | R246 R252 R253 R254 | R246-D250 PolarHBondContact O-N 3.48Å; D250-R252 VanDerWaalsContact C-N 3.35Å; D250-R253 PolarHBondContact O-N 3.47Å; D250-R254 VanDerWaalsContact O-CG 3.32Å; D250-R254 WeakPolarHBondContact O-CG 3.43Å; D250-R254 PolarHBondContact O-N 3.05Å |
| 251 | K | 95.3 | Very high | 97.2 | Very high | 146 Ų | 146 | 107.5 Ų | 107.5 | 64% | 0.635 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.3 | -44 | 174.4 | -78 | -179.1 | 178 | -173.9 | 0 | 111.8 | L247 L248 A249 R254 A255 | L247-K251 WeakPolarHBondContact O-CG 3.37Å; L247-K251 PolarHBondContact O-N 3.13Å; L247-K251 VanDerWaalsContact O-N 3.09Å; L248-K251 PolarHBondContact O-N 2.94Å; A249-K251 PolarHBondContact O-N 3.35Å; K251-R254 PolarHBondContact O-N 2.92Å; K251-A255 PolarHBondContact O-N 3.41Å |
| 252 | R | 96.2 | Very high | 97.2 | Very high | 178 Ų | 178 | 107.6 Ų | 107.6 | 67% | 0.672 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.6 | -46.6 | 176.9 | -178.2 | 177.4 | 176.7 | 164.9 | 4.6 | 111.5 | L248 A249 D250 R254 A255 E256 | L248-R252 WeakPolarHBondContact O-CB 3.42Å; L248-R252 PolarHBondContact O-N 3.1Å; A249-R252 PolarHBondContact O-N 3.31Å; D250-R252 VanDerWaalsContact C-N 3.35Å; R252-R254 VanDerWaalsContact C-N 3.35Å; R252-R254 PolarHBondContact O-N 3.15Å; R252-A255 WeakPolarHBondContact O-CB 3.45Å; R252-A255 PolarHBondContact O-N 2.87Å; R252-E256 WeakPolarHBondContact CG-OE1 3.29Å; R252-E256 IonicContact CZ-OE1 3.79Å; R252-E256 IonicContact NE-OE1 3.63Å; R252-E256 PolarHBondContact NE-OE1 3.45Å; R252-E256 IonicContact NH2-OE1 2.9Å; R252-E256 WeakPolarHBondContact O-CG 3.3Å; R252-E256 PolarHBondContact O-N 3.17Å |
| 253 | R | 97.5 | Very high | 97.1 | Very high | 160 Ų | 160 | 107.7 Ų | 107.7 | 60% | 0.604 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -58.7 | -44.6 | 176.8 | -177.8 | -178.6 | 170.6 | 168.1 | 4.6 | 112 | A249 D250 A255 E256 E257 | A249-R253 WeakPolarHBondContact O-CB 3.49Å; A249-R253 PolarHBondContact O-N 3.5Å; D250-R253 PolarHBondContact O-N 3.47Å; R253-A255 VanDerWaalsContact C-N 3.34Å; R253-A255 PolarHBondContact O-N 3.18Å; R253-E256 PolarHBondContact O-N 3.18Å; R253-E257 IonicContact CZ-OE1 3.04Å; R253-E257 IonicContact NE-OE1 3.78Å; R253-E257 PolarHBondContact NE-OE1 3.07Å; R253-E257 IonicContact NH2-OE1 3.81Å; R253-E257 WeakPolarHBondContact O-CG 3.36Å; R253-E257 PolarHBondContact O-N 3.36Å |
| 254 | R | 97.7 | Very high | 97.1 | Very high | 164 Ų | 164 | 113.8 Ų | 113.8 | 62% | 0.619 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.6 | -39.8 | 176.5 | -71.9 | 176.7 | -167.1 | 172.2 | 5.2 | 112.1 | D250 K251 R252 E257 L258 | D250-R254 VanDerWaalsContact O-CG 3.32Å; D250-R254 WeakPolarHBondContact O-CG 3.43Å; D250-R254 PolarHBondContact O-N 3.05Å; K251-R254 PolarHBondContact O-N 2.92Å; R252-R254 VanDerWaalsContact C-N 3.35Å; R252-R254 PolarHBondContact O-N 3.15Å; R254-E257 PolarHBondContact O-N 2.79Å; R254-L258 WeakPolarHBondContact O-CG 3.48Å; R254-L258 PolarHBondContact O-N 3.34Å |
| 255 | A | 97 | Very high | 97.1 | Very high | 43 Ų | 43 | 113.8 Ų | 113.8 | 36% | 0.355 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.3 | -47 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | K251 R252 R253 E257 L258 E259 | K251-A255 PolarHBondContact O-N 3.41Å; R252-A255 WeakPolarHBondContact O-CB 3.45Å; R252-A255 PolarHBondContact O-N 2.87Å; R253-A255 VanDerWaalsContact C-N 3.34Å; R253-A255 PolarHBondContact O-N 3.18Å; A255-E257 VanDerWaalsContact C-N 3.31Å; A255-E257 PolarHBondContact O-N 3.2Å; A255-L258 PolarHBondContact O-N 3.44Å; A255-L258 VanDerWaalsContact O-N 3.15Å; A255-E259 WeakPolarHBondContact O-CG 3.5Å; A255-E259 PolarHBondContact O-N 3.45Å |
| 256 | E | 97 | Very high | 97.1 | Very high | 95 Ų | 95 | 112.2 Ų | 112.2 | 44% | 0.444 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.2 | -37.7 | 176.9 | -69.5 | 170.8 | -172.4 | 0 | 0 | 111.9 | R252 R253 A260 | R252-E256 WeakPolarHBondContact CG-OE1 3.29Å; R252-E256 IonicContact CZ-OE1 3.79Å; R252-E256 IonicContact NE-OE1 3.63Å; R252-E256 PolarHBondContact NE-OE1 3.45Å; R252-E256 IonicContact NH2-OE1 2.9Å; R252-E256 WeakPolarHBondContact O-CG 3.3Å; R252-E256 PolarHBondContact O-N 3.17Å; R253-E256 PolarHBondContact O-N 3.18Å; E256-A260 VanDerWaalsContact O-CB 3.29Å; E256-A260 WeakPolarHBondContact O-CB 3.19Å; E256-A260 PolarHBondContact O-N 3.27Å |
| 257 | E | 98 | Very high | 96.9 | Very high | 85 Ų | 85 | 112.9 Ų | 112.9 | 40% | 0.397 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.3 | -36 | 174.9 | -74.7 | 176 | -165.5 | 0 | 0 | 113.1 | R253 R254 A255 K261 | R253-E257 IonicContact CZ-OE1 3.04Å; R253-E257 IonicContact NE-OE1 3.78Å; R253-E257 PolarHBondContact NE-OE1 3.07Å; R253-E257 IonicContact NH2-OE1 3.81Å; R253-E257 WeakPolarHBondContact O-CG 3.36Å; R253-E257 PolarHBondContact O-N 3.36Å; R254-E257 PolarHBondContact O-N 2.79Å; A255-E257 VanDerWaalsContact C-N 3.31Å; A255-E257 PolarHBondContact O-N 3.2Å; E257-K261 VanDerWaalsContact O-CG 3.3Å; E257-K261 WeakPolarHBondContact O-CG 3.34Å; E257-K261 PolarHBondContact O-N 3.49Å; E257-K261 VanDerWaalsContact O-N 3.16Å |
| 258 | L | 97.6 | Very high | 96.8 | Very high | 101 Ų | 101 | 115.1 Ų | 115.1 | 53% | 0.529 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69.5 | -47.1 | 175.1 | -70.8 | 172.8 | 0 | 0 | 0 | 111.1 | R254 A255 A260 K261 E262 | R254-L258 WeakPolarHBondContact O-CG 3.48Å; R254-L258 PolarHBondContact O-N 3.34Å; A255-L258 PolarHBondContact O-N 3.44Å; A255-L258 VanDerWaalsContact O-N 3.15Å; L258-A260 VanDerWaalsContact C-N 3.3Å; L258-A260 PolarHBondContact O-N 3.03Å; L258-K261 WeakPolarHBondContact O-CB 3.35Å; L258-K261 PolarHBondContact O-N 3.07Å; L258-K261 VanDerWaalsContact O-N 3.1Å; L258-E262 WeakPolarHBondContact O-CG 3.42Å; L258-E262 PolarHBondContact O-N 3.17Å |
| 259 | E | 95.8 | Very high | 96.6 | Very high | 114 Ų | 114 | 119.5 Ų | 119.5 | 53% | 0.533 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -58.8 | -41.6 | 175.5 | -70.5 | 177.5 | -172.8 | 0 | 0 | 111.4 | A255 K261 E262 I263 | A255-E259 WeakPolarHBondContact O-CG 3.5Å; A255-E259 PolarHBondContact O-N 3.45Å; E259-K261 VanDerWaalsContact C-N 3.33Å; E259-K261 PolarHBondContact O-N 3.3Å; E259-E262 PolarHBondContact O-N 2.86Å; E259-I263 VanDerWaalsContact O-CG1 3.29Å; E259-I263 WeakPolarHBondContact O-CG1 3.45Å; E259-I263 PolarHBondContact O-N 3.32Å |
| 260 | A | 97.7 | Very high | 96.4 | Very high | 57 Ų | 57 | 121.1 Ų | 121.1 | 47% | 0.471 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64 | -35.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | E256 L258 R264 | E256-A260 VanDerWaalsContact O-CB 3.29Å; E256-A260 WeakPolarHBondContact O-CB 3.19Å; E256-A260 PolarHBondContact O-N 3.27Å; L258-A260 VanDerWaalsContact C-N 3.3Å; L258-A260 PolarHBondContact O-N 3.03Å; A260-R264 WeakPolarHBondContact O-CB 3.35Å; A260-R264 PolarHBondContact O-N 3.45Å |
| 261 | K | 98 | Very high | 96.1 | Very high | 124 Ų | 124 | 122.1 Ų | 122.1 | 54% | 0.539 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.6 | -45.1 | 174.4 | -74.2 | 169.6 | -175 | 174.5 | 0 | 111.1 | E257 L258 E259 I263 R264 E265 | E257-K261 VanDerWaalsContact O-CG 3.3Å; E257-K261 WeakPolarHBondContact O-CG 3.34Å; E257-K261 PolarHBondContact O-N 3.49Å; E257-K261 VanDerWaalsContact O-N 3.16Å; L258-K261 WeakPolarHBondContact O-CB 3.35Å; L258-K261 PolarHBondContact O-N 3.07Å; L258-K261 VanDerWaalsContact O-N 3.1Å; E259-K261 VanDerWaalsContact C-N 3.33Å; E259-K261 PolarHBondContact O-N 3.3Å; K261-I263 PolarHBondContact O-N 2.94Å; K261-R264 WeakPolarHBondContact O-CB 3.39Å; K261-R264 PolarHBondContact O-N 3.03Å; K261-E265 PolarHBondContact O-N 3.3Å |
| 262 | E | 97.7 | Very high | 95.7 | Very high | 122 Ų | 122 | 122.9 Ų | 122.9 | 57% | 0.57 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.1 | -46.9 | 176.7 | -70.3 | 178.8 | -173.7 | 0 | 0 | 111.6 | L258 E259 R264 E265 I266 | L258-E262 WeakPolarHBondContact O-CG 3.42Å; L258-E262 PolarHBondContact O-N 3.17Å; E259-E262 PolarHBondContact O-N 2.86Å; E262-R264 VanDerWaalsContact C-N 3.28Å; E262-R264 PolarHBondContact O-N 3.05Å; E262-E265 PolarHBondContact O-N 3.2Å; E262-E265 VanDerWaalsContact O-N 3.13Å; E262-I266 WeakPolarHBondContact O-CG1 3.29Å; E262-I266 PolarHBondContact O-N 3.5Å |
| 263 | I | 95.7 | Very high | 95.2 | Very high | 85 Ų | 85 | 124.7 Ų | 124.7 | 44% | 0.436 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -60.5 | -40 | 176.3 | -68.4 | 167.9 | 0 | 0 | 0 | 110.9 | E259 K261 I266 R267 | E259-I263 VanDerWaalsContact O-CG1 3.29Å; E259-I263 WeakPolarHBondContact O-CG1 3.45Å; E259-I263 PolarHBondContact O-N 3.32Å; K261-I263 PolarHBondContact O-N 2.94Å; I263-I266 PolarHBondContact O-N 3.44Å; I263-R267 HydrophobicContact CG2-CG 4.5Å; I263-R267 WeakPolarHBondContact O-CB 3.44Å; I263-R267 VanDerWaalsContact O-CG 3.27Å; I263-R267 WeakPolarHBondContact O-CG 3.44Å; I263-R267 PolarHBondContact O-N 3.14Å |
| 264 | R | 97.1 | Very high | 94.6 | Very high | 177 Ų | 177 | 121.6 Ų | 121.6 | 67% | 0.668 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.3 | -39.5 | 176.6 | -178.3 | -178.9 | -86 | -170.2 | -5.5 | 111.5 | A260 K261 E262 K268 | A260-R264 WeakPolarHBondContact O-CB 3.35Å; A260-R264 PolarHBondContact O-N 3.45Å; K261-R264 WeakPolarHBondContact O-CB 3.39Å; K261-R264 PolarHBondContact O-N 3.03Å; E262-R264 VanDerWaalsContact C-N 3.28Å; E262-R264 PolarHBondContact O-N 3.05Å; R264-K268 WeakPolarHBondContact O-CG 3.27Å; R264-K268 PolarHBondContact O-N 2.92Å |
| 265 | E | 96.8 | Very high | 93.8 | Very high | 101 Ų | 101 | 122 Ų | 122 | 47% | 0.472 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -68.3 | -42.9 | 176.1 | -72.4 | -169.6 | -175.1 | 0 | 0 | 112.8 | K261 E262 R267 K268 R269 | K261-E265 PolarHBondContact O-N 3.3Å; E262-E265 PolarHBondContact O-N 3.2Å; E262-E265 VanDerWaalsContact O-N 3.13Å; E265-R267 VanDerWaalsContact C-N 3.32Å; E265-R267 PolarHBondContact O-N 3.35Å; E265-K268 WeakPolarHBondContact O-CB 3.41Å; E265-K268 PolarHBondContact O-N 3.43Å; E265-R269 WeakPolarHBondContact O-CG 3.47Å; E265-R269 PolarHBondContact O-N 3.08Å; E265-R269 VanDerWaalsContact O-N 3.07Å; E265-R269 IonicContact OE2-NH2 3.86Å |
| 266 | I | 95.9 | Very high | 93.1 | Very high | 100 Ų | 100 | 125.4 Ų | 125.4 | 51% | 0.513 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -57.4 | -49.1 | 174 | -67.5 | 166.5 | 0 | 0 | 0 | 109.3 | E262 I263 K268 R269 T270 | E262-I266 WeakPolarHBondContact O-CG1 3.29Å; E262-I266 PolarHBondContact O-N 3.5Å; I263-I266 PolarHBondContact O-N 3.44Å; I266-K268 VanDerWaalsContact C-N 3.3Å; I266-K268 PolarHBondContact O-N 3.39Å; I266-R269 PolarHBondContact O-N 3.49Å; I266-T270 HydrophobicContact CG2-CG2 3.95Å; I266-T270 WeakPolarHBondContact O-CG2 3.36Å; I266-T270 PolarHBondContact O-N 3.47Å; I266-T270 PolarHBondContact O-OG1 3.29Å; I266-T270 VanDerWaalsContact O-OG1 3.05Å |
| 267 | R | 95.7 | Very high | 92.2 | Very high | 169 Ų | 169 | 127.8 Ų | 127.8 | 64% | 0.638 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -56.7 | -41.5 | 177 | -74.7 | 176.1 | -177.2 | -175.8 | 3 | 112.5 | I263 E265 R269 T270 V271 | I263-R267 HydrophobicContact CG2-CG 4.5Å; I263-R267 WeakPolarHBondContact O-CB 3.44Å; I263-R267 VanDerWaalsContact O-CG 3.27Å; I263-R267 WeakPolarHBondContact O-CG 3.44Å; I263-R267 PolarHBondContact O-N 3.14Å; E265-R267 VanDerWaalsContact C-N 3.32Å; E265-R267 PolarHBondContact O-N 3.35Å; R267-R269 VanDerWaalsContact C-N 3.31Å; R267-R269 PolarHBondContact O-N 3.44Å; R267-T270 WeakPolarHBondContact CA-OG1 3.48Å; R267-T270 PolarHBondContact O-N 3.43Å; R267-T270 PolarHBondContact O-OG1 2.87Å; R267-V271 WeakPolarHBondContact O-CG2 3.19Å; R267-V271 PolarHBondContact O-N 3.04Å; R267-V271 VanDerWaalsContact O-N 3.14Å |
| 268 | K | 94.9 | Very high | 91 | Very high | 156 Ų | 156 | 131.7 Ų | 131.7 | 68% | 0.678 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -61.9 | -38.3 | 176.2 | -74.8 | 175.7 | 179.7 | -177.6 | 0 | 112.4 | R264 E265 I266 | R264-K268 WeakPolarHBondContact O-CG 3.27Å; R264-K268 PolarHBondContact O-N 2.92Å; E265-K268 WeakPolarHBondContact O-CB 3.41Å; E265-K268 PolarHBondContact O-N 3.43Å; I266-K268 VanDerWaalsContact C-N 3.3Å; I266-K268 PolarHBondContact O-N 3.39Å |
| 269 | R | 92.6 | Very high | 89.5 | Confident | 200 Ų | 200 | 130.2 Ų | 130.2 | 76% | 0.755 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -78.2 | -31.6 | 179.8 | -65.1 | 179.3 | -169.4 | 167.4 | 8.6 | 112.7 | E265 I266 R267 | E265-R269 WeakPolarHBondContact O-CG 3.47Å; E265-R269 PolarHBondContact O-N 3.08Å; E265-R269 VanDerWaalsContact O-N 3.07Å; E265-R269 IonicContact OE2-NH2 3.86Å; I266-R269 PolarHBondContact O-N 3.49Å; R267-R269 VanDerWaalsContact C-N 3.31Å; R267-R269 PolarHBondContact O-N 3.44Å |
| 270 | T | 93.3 | Very high | 88.4 | Confident | 90 Ų | 90 | 133.8 Ų | 133.8 | 55% | 0.552 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -86.4 | -18.3 | -176.5 | 56.5 | 0 | 0 | 0 | 0 | 114.2 | I266 R267 I272 | I266-T270 HydrophobicContact CG2-CG2 3.95Å; I266-T270 WeakPolarHBondContact O-CG2 3.36Å; I266-T270 PolarHBondContact O-N 3.47Å; I266-T270 PolarHBondContact O-OG1 3.29Å; I266-T270 VanDerWaalsContact O-OG1 3.05Å; R267-T270 WeakPolarHBondContact CA-OG1 3.48Å; R267-T270 PolarHBondContact O-N 3.43Å; R267-T270 PolarHBondContact O-OG1 2.87Å; T270-I272 PolarHBondContact O-N 3.01Å |
| 271 | V | 91.2 | Very high | 86.9 | Confident | 97 Ų | 97 | 137.3 Ų | 137.3 | 59% | 0.588 | 67% | 0.669 | S | S | * | * | trans | -68.6 | 98.3 | 175.3 | 171.9 | 0 | 0 | 0 | 0 | 108.7 | R267 R273 | R267-V271 WeakPolarHBondContact O-CG2 3.19Å; R267-V271 PolarHBondContact O-N 3.04Å; R267-V271 VanDerWaalsContact O-N 3.14Å; V271-R273 PolarHBondContact O-N 3.23Å | ||
| 272 | I | 86.7 | Confident | 85.7 | Confident | 162 Ų | 162 | 136.3 Ų | 136.3 | 83% | 0.831 | 68% | 0.675 | S | S | * | * | trans | -63.9 | 106.5 | 172.3 | -56.7 | 171.8 | 0 | 0 | 0 | 107 | T270 A274 | T270-I272 PolarHBondContact O-N 3.01Å; I272-A274 PolarHBondContact O-N 2.91Å | ||
| 273 | R | 85.9 | Confident | 84.4 | Confident | 216 Ų | 216 | 136.4 Ų | 136.4 | 82% | 0.815 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 122.1 | 165.9 | -68.1 | -171.9 | 175.6 | -173 | -2.1 | 106.7 | V271 Q275 | V271-R273 PolarHBondContact O-N 3.23Å; R273-Q275 PolarHBondContact O-N 3.35Å |
| 274 | A | 84.4 | Confident | 83.2 | Confident | 95 Ų | 95 | 143.7 Ų | 143.7 | 79% | 0.785 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 117.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 107.1 | I272 | I272-A274 PolarHBondContact O-N 2.91Š|
| 275 | Q | 81.9 | Confident | 81.8 | Confident | 172 Ų | 172 | 146.6 Ų | 146.6 | 80% | 0.804 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 139.5 | 170 | -67 | -164.9 | -4.6 | 0 | 0 | 106.8 | R273 I277 | R273-Q275 PolarHBondContact O-N 3.35Å; Q275-I277 PolarHBondContact O-N 3.46Å |
| 276 | P | 82.2 | Confident | 80.4 | Confident | 116 Ų | 116 | 150.8 Ų | 150.8 | 75% | 0.753 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -53 | 117.4 | 173.1 | 23.3 | -31.4 | 0 | 0 | 0 | 106.2 | L278 | P276-L278 PolarHBondContact O-N 2.9Š|
| 277 | I | 77.6 | Confident | 79 | Confident | 144 Ų | 144 | 155.3 Ų | 155.3 | 74% | 0.738 | 76% | 0.755 | S | S | * | * | trans | -60.7 | 113.2 | 173.7 | -53.3 | 174.6 | 0 | 0 | 0 | 103.3 | Q275 C279 | Q275-I277 PolarHBondContact O-N 3.46Å; I277-C279 WeakPolarHBondContact CG2-SG 3.34Å; I277-C279 PolarHBondContact O-N 2.93Å | ||
| 278 | L | 71.6 | Confident | 77.2 | Confident | 167 Ų | 167 | 156.7 Ų | 156.7 | 87% | 0.874 | 77% | 0.766 | S | S | * | * | trans | -66.5 | 74.1 | 165.5 | -78.1 | 167.6 | 0 | 0 | 0 | 105.6 | P276 E280 | P276-L278 PolarHBondContact O-N 2.9Å; L278-E280 PolarHBondContact O-N 2.7Å | ||
| 279 | C | 66.3 | Low | 75.4 | Confident | 70 Ų | 70 | 153 Ų | 153 | 47% | 0.473 | 77% | 0.771 | S | S | . | * | trans | -70.3 | 93 | 170 | -77.5 | 0 | 0 | 0 | 0 | 105.1 | I277 L281 | I277-C279 WeakPolarHBondContact CG2-SG 3.34Å; I277-C279 PolarHBondContact O-N 2.93Å; C279-L281 HydrophobicContact CB-CB 4.02Å; C279-L281 HydrophobicContact CB-CD1 3.96Å; C279-L281 HydrophobicContact CB-CG 3.95Å; C279-L281 PolarHBondContact O-N 2.94Å; C279-L281 VanDerWaalsContact SG-CD1 3.6Å | ||
| 280 | E | 72.9 | Confident | 73.8 | Confident | 190 Ų | 190 | 147.3 Ų | 147.3 | 89% | 0.888 | 77% | 0.767 | S | S | * | * | trans | -66.3 | 27.5 | 148.9 | -61.2 | -168.3 | 177.1 | 0 | 0 | 110.8 | L278 P282 | L278-E280 PolarHBondContact O-N 2.7Å; E280-P282 WeakPolarHBondContact O-CD 3.41Å | ||
| 281 | L | 67.4 | Low | 72.2 | Confident | 131 Ų | 131 | 150.4 Ų | 150.4 | 69% | 0.686 | 78% | 0.781 | S | S | * | * | trans | -67.7 | 121.7 | 171.8 | -72.1 | 171.7 | 0 | 0 | 0 | 106.1 | C279 | C279-L281 HydrophobicContact CB-CB 4.02Å; C279-L281 HydrophobicContact CB-CD1 3.96Å; C279-L281 HydrophobicContact CB-CG 3.95Å; C279-L281 PolarHBondContact O-N 2.94Å; C279-L281 VanDerWaalsContact SG-CD1 3.6Å | ||
| 282 | P | 71.9 | Confident | 70.8 | Confident | 102 Ų | 102 | 153.8 Ų | 153.8 | 66% | 0.662 | 79% | 0.792 | S | S | * | * | trans | -54.8 | 147.4 | -179.6 | 22.3 | -32.7 | 0 | 0 | 0 | 109.3 | E280 R284 | E280-P282 WeakPolarHBondContact O-CD 3.41Å; P282-R284 PolarHBondContact O-N 3.14Å | ||
| 283 | P | 69.9 | Low | 69.8 | Low | 124 Ų | 124 | 151.4 Ų | 151.4 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | trans | -44.6 | 115 | -176 | -27.6 | 32.1 | 0 | 0 | 0 | 110.1 | R285 | P283-R285 PolarHBondContact O-N 2.95Š| ||
| 284 | R | 70.4 | Confident | 68.5 | Low | 238 Ų | 238 | 149.8 Ų | 149.8 | 90% | 0.898 | 79% | 0.788 | S | S | * | * | trans | -51.7 | 109.6 | -179 | -173.5 | 175.5 | -176.2 | 171.9 | 0.7 | 106.8 | P282 Q286 | P282-R284 PolarHBondContact O-N 3.14Å; R284-Q286 PolarHBondContact O-N 2.97Å | ||
| 285 | R | 68.6 | Low | 67.5 | Low | 239 Ų | 239 | 151 Ų | 151 | 90% | 0.902 | 79% | 0.786 | S | S | * | * | trans | -47.1 | 112.5 | 176.5 | -79.2 | -179.3 | 159.5 | -173.3 | -5.5 | 106.5 | P283 K287 | P283-R285 PolarHBondContact O-N 2.95Å; R285-K287 PolarHBondContact O-N 3.38Å | ||
| 286 | Q | 68 | Low | 66.8 | Low | 188 Ų | 188 | 148.1 Ų | 148.1 | 88% | 0.879 | 78% | 0.782 | S | S | * | * | trans | -55.9 | 109.4 | 176.6 | -67.1 | -173.5 | 5.1 | 0 | 0 | 106 | R284 K288 | R284-Q286 PolarHBondContact O-N 2.97Å; Q286-K288 PolarHBondContact O-N 2.88Å | ||
| 287 | K | 65.9 | Low | 65.9 | Low | 195 Ų | 195 | 150.6 Ų | 150.6 | 85% | 0.848 | 79% | 0.788 | S | S | * | * | trans | -71.6 | 92 | 174.6 | -152.8 | -179.8 | -174.6 | -172.9 | 0 | 105 | R285 G289 | R285-K287 PolarHBondContact O-N 3.38Å; K287-G289 PolarHBondContact O-N 2.89Å | ||
| 288 | K | 56.9 | Low | 65.4 | Low | 199 Ų | 199 | 148.6 Ų | 148.6 | 87% | 0.865 | 79% | 0.787 | S | S | * | * | trans | -56.3 | 119.5 | 176.1 | -158 | 176.1 | -173.6 | -178.6 | 0 | 107.1 | Q286 | Q286-K288 PolarHBondContact O-N 2.88Š| ||
| 289 | G | 57.1 | Low | 64.9 | Low | 77 Ų | 77 | 145.9 Ų | 145.9 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | trans | 44.8 | 92.1 | 161.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | K287 | K287-G289 PolarHBondContact O-N 2.89Š| ||
| 290 | A | 59.5 | Low | 64.5 | Low | 81 Ų | 81 | 149 Ų | 149 | 67% | 0.669 | 79% | 0.791 | S | S | * | * | trans | -140.3 | 93 | 149.6 | 0 | 0 | 0 | 0 | 0 | 106.4 | M292 | A290-M292 PolarHBondContact O-N 2.84Š| ||
| 291 | D | 60.8 | Low | 63.8 | Low | 156 Ų | 156 | 146.3 Ų | 146.3 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | trans | 23 | 97.6 | 155 | -59.9 | -31.1 | 0 | 0 | 0 | 115.2 | P293 | D291-P293 WeakPolarHBondContact O-CD 3.17Å; D291-P293 VanDerWaalsContact O-N 3.13Å | ||
| 292 | M | 61.7 | Low | 63.3 | Low | 168 Ų | 168 | 149.8 Ų | 149.8 | 83% | 0.828 | 79% | 0.793 | S | S | * | * | trans | -52.5 | 112.9 | 161.6 | -75 | -80.8 | -72.7 | 0 | 0 | 108.4 | A290 H294 | A290-M292 PolarHBondContact O-N 2.84Å; M292-H294 PolarHBondContact O-N 3.23Å | ||
| 293 | P | 64.4 | Low | 62.3 | Low | 111 Ų | 111 | 152.7 Ų | 152.7 | 72% | 0.721 | 80% | 0.797 | S | S | * | * | trans | -66.1 | 114 | 164.3 | 27.7 | -29.8 | 0 | 0 | 0 | 106.4 | D291 T295 | D291-P293 WeakPolarHBondContact O-CD 3.17Å; D291-P293 VanDerWaalsContact O-N 3.13Å; P293-T295 PolarHBondContact O-N 2.95Å | ||
| 294 | H | 59.7 | Low | 61.8 | Low | 182 Ų | 182 | 158.8 Ų | 158.8 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | trans | -38.4 | 109.5 | 169.3 | -112 | -77.7 | 0 | 0 | 0 | 109 | M292 P296 | M292-H294 PolarHBondContact O-N 3.23Å; H294-P296 WeakPolarHBondContact O-CD 3.09Å | ||
| 295 | T | 63.8 | Low | 61.7 | Low | 120 Ų | 120 | 159 Ų | 159 | 74% | 0.736 | 82% | 0.816 | S | S | * | * | trans | -69.6 | 112.7 | 167.5 | -25.3 | 0 | 0 | 0 | 0 | 105.1 | P293 L297 | P293-T295 PolarHBondContact O-N 2.95Å; T295-L297 PolarHBondContact O-N 2.82Å | ||
| 296 | P | 66.1 | Low | 61.3 | Low | 113 Ų | 113 | 155.1 Ų | 155.1 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -64.1 | 126.9 | -178.8 | 25.7 | -31.7 | 0 | 0 | 0 | 108.1 | H294 S298 | H294-P296 WeakPolarHBondContact O-CD 3.09Å; P296-S298 PolarHBondContact O-N 3.26Å | ||
| 297 | L | 64.3 | Low | 61 | Low | 168 Ų | 168 | 153.3 Ų | 153.3 | 88% | 0.88 | 81% | 0.808 | S | S | * | * | trans | -47.4 | 108.6 | 168.5 | -75.3 | 151.8 | 0 | 0 | 0 | 107.8 | T295 P299 | T295-L297 PolarHBondContact O-N 2.82Å; L297-P299 WeakPolarHBondContact O-CD 3.13Å | ||
| 298 | S | 65.3 | Low | 60.7 | Low | 101 Ų | 101 | 151 Ų | 151 | 71% | 0.706 | 81% | 0.806 | S | S | * | * | trans | -68.3 | 110 | 172 | -171 | 0 | 0 | 0 | 0 | 107.3 | P296 N300 | P296-S298 PolarHBondContact O-N 3.26Å; S298-N300 PolarHBondContact O-N 3.47Å | ||
| 299 | P | 62.1 | Low | 60.9 | Low | 111 Ų | 111 | 148.2 Ų | 148.2 | 72% | 0.721 | 80% | 0.802 | S | S | * | * | trans | -90.3 | 98.8 | 175.8 | 27.8 | -11.5 | 0 | 0 | 0 | 105.9 | L297 | L297-P299 WeakPolarHBondContact O-CD 3.13Š| ||
| 300 | N | 58.5 | Low | 61.1 | Low | 134 Ų | 134 | 152.6 Ų | 152.6 | 72% | 0.717 | 80% | 0.803 | S | S | * | * | trans | -133.3 | 85.1 | 169.2 | -103.5 | -24.6 | 0 | 0 | 0 | 110.8 | S298 | S298-N300 PolarHBondContact O-N 3.47Š| ||
| 301 | N | 56.6 | Low | 61.2 | Low | 134 Ų | 134 | 157.4 Ų | 157.4 | 72% | 0.717 | 81% | 0.812 | S | S | * | * | 59.9 | 90.2 | 120.8 | -65.3 | -34.8 | 0 | 0 | 0 | 116.4 | H303 | N301-H303 PolarHBondContact O-N 3.05Å; N301-H303 VanDerWaalsContact O-N 3.14Å | |||
| 302 | F | 57.3 | Low | 61.3 | Low | 205 Ų | 205 | 157.5 Ų | 157.5 | 90% | 0.899 | 81% | 0.81 | S | S | * | * | trans | -37 | 107.6 | 131 | -78.4 | -96.7 | 0 | 0 | 0 | 110.5 | ||||
| 303 | H | 51.9 | Low | 61.2 | Low | 162 Ų | 162 | 156.7 Ų | 156.7 | 75% | 0.75 | 81% | 0.809 | S | S | * | * | trans | -172.3 | 101.2 | 144.3 | -108.3 | 55.8 | 0 | 0 | 0 | 108.8 | N301 | N301-H303 PolarHBondContact O-N 3.05Å; N301-H303 VanDerWaalsContact O-N 3.14Å | ||
| 304 | R | 59 | Low | 61 | Low | 252 Ų | 252 | 160.5 Ų | 160.5 | 95% | 0.951 | 82% | 0.816 | S | S | * | * | trans | -146.6 | 96.3 | 147.8 | -126.4 | -179.9 | -169.8 | -174.9 | 2.5 | 107 | ||||
| 305 | E | 67.4 | Low | 61.1 | Low | 244 Ų | 244 | 158.5 Ų | 158.5 | 100% | 1.14 | 81% | 0.814 | S | S | * | * | trans | -54.3 | 0 | 159.6 | -63.2 | -180 | 150.6 | 0 | 0 | 111 |
Retrieved 305 of 305 residues in 103 ms
(Link to these results)