| 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 | D | 62.9 | Low | 79.3 | Confident | 181 Ų | 181 | 102.2 Ų | 102.2 | 97% | 0.968 | 58% | 0.582 | S | S | * | * | 0 | -43.6 | 0 | -61.8 | -10.8 | 0 | 0 | 0 | 114.3 | A3 V4 S5 | D1-A3 PolarHBondContact O-N 3.38Å; D1-V4 PolarHBondContact O-N 2.98Å; D1-S5 PolarHBondContact O-N 3.23Å | |||
| 2 | D | 65.8 | Low | 80.3 | Confident | 147 Ų | 147 | 101.2 Ų | 101.2 | 79% | 0.786 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -62 | -35.9 | -177.8 | -67.4 | -30.5 | 0 | 0 | 0 | 115.5 | V4 S5 S6 | D2-V4 PolarHBondContact O-N 3.48Å; D2-S5 PolarHBondContact O-N 2.66Å; D2-S6 WeakPolarHBondContact O-CB 3.42Å; D2-S6 PolarHBondContact O-N 2.99Å |
| 3 | A | 70.1 | Confident | 81.1 | Confident | 76 Ų | 76 | 103.3 Ų | 103.3 | 63% | 0.628 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.3 | -38 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | D1 S6 V7 | D1-A3 PolarHBondContact O-N 3.38Å; A3-S6 PolarHBondContact O-N 3.35Å; A3-V7 WeakPolarHBondContact O-CG2 3.42Å; A3-V7 PolarHBondContact O-N 3.46Å; A3-V7 VanDerWaalsContact O-N 3.17Å |
| 4 | V | 76.4 | Confident | 82 | Confident | 92 Ų | 92 | 104.2 Ų | 104.2 | 56% | 0.558 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -73.2 | -39.5 | 179.9 | 179.7 | 0 | 0 | 0 | 0 | 110.6 | D1 D2 S6 V7 I8 | D1-V4 PolarHBondContact O-N 2.98Å; D2-V4 PolarHBondContact O-N 3.48Å; V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.06Å; V4-V7 PolarHBondContact O-N 2.95Å; V4-I8 HydrophobicContact CG1-CD1 3.97Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.33Å |
| 5 | S | 78.8 | Confident | 82.7 | Confident | 59 Ų | 59 | 104.7 Ų | 104.7 | 41% | 0.413 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.7 | -37.7 | 174.3 | -168.4 | 0 | 0 | 0 | 0 | 112.2 | D1 D2 R9 | D1-S5 PolarHBondContact O-N 3.23Å; D2-S5 PolarHBondContact O-N 2.66Å; S5-R9 WeakPolarHBondContact O-CB 3.36Å; S5-R9 PolarHBondContact O-N 2.98Å |
| 6 | S | 82 | Confident | 83.4 | Confident | 66 Ų | 66 | 104 Ų | 104 | 46% | 0.462 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.9 | -46.1 | 174.8 | -173 | 0 | 0 | 0 | 0 | 112.2 | D2 A3 V4 R9 S10 | D2-S6 WeakPolarHBondContact O-CB 3.42Å; D2-S6 PolarHBondContact O-N 2.99Å; A3-S6 PolarHBondContact O-N 3.35Å; V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.06Å; S6-R9 PolarHBondContact O-N 3.4Å; S6-S10 PolarHBondContact O-N 3.26Å; S6-S10 PolarHBondContact O-OG 3.25Å |
| 7 | V | 85.4 | Confident | 84.1 | Confident | 85 Ų | 85 | 105.4 Ų | 105.4 | 52% | 0.515 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.1 | -43.6 | 179.2 | 172 | 0 | 0 | 0 | 0 | 111.8 | A3 V4 R9 S10 L11 | A3-V7 WeakPolarHBondContact O-CG2 3.42Å; A3-V7 PolarHBondContact O-N 3.46Å; A3-V7 VanDerWaalsContact O-N 3.17Å; V4-V7 PolarHBondContact O-N 2.95Å; V7-R9 VanDerWaalsContact C-N 3.32Å; V7-R9 PolarHBondContact O-N 2.98Å; V7-S10 PolarHBondContact O-N 2.97Å; V7-L11 HydrophobicContact CG1-CD1 3.92Å; V7-L11 PolarHBondContact O-N 3.49Å |
| 8 | I | 86.6 | Confident | 84.7 | Confident | 93 Ų | 93 | 104.4 Ų | 104.4 | 48% | 0.477 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63 | -40.7 | 176.6 | -67.2 | 168.6 | 0 | 0 | 0 | 110.8 | V4 S10 L11 L12 | V4-I8 HydrophobicContact CG1-CD1 3.97Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.33Å; I8-S10 VanDerWaalsContact C-N 3.34Å; I8-S10 PolarHBondContact O-N 3.39Å; I8-L11 PolarHBondContact O-N 3.27Å; I8-L12 HydrophobicContact CG2-CD1 3.93Å; I8-L12 HydrophobicContact CG2-CG 4.44Å; I8-L12 WeakPolarHBondContact O-CB 3.42Å; I8-L12 WeakPolarHBondContact O-CG 3.35Å; I8-L12 PolarHBondContact O-N 2.93Å |
| 9 | R | 87.7 | Confident | 85.3 | Confident | 155 Ų | 155 | 103.1 Ų | 103.1 | 59% | 0.585 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -65.5 | -37 | 177.1 | -169.1 | -178.8 | -65 | 157.8 | 1.6 | 112 | S5 S6 V7 K13 | S5-R9 WeakPolarHBondContact O-CB 3.36Å; S5-R9 PolarHBondContact O-N 2.98Å; S6-R9 PolarHBondContact O-N 3.4Å; V7-R9 VanDerWaalsContact C-N 3.32Å; V7-R9 PolarHBondContact O-N 2.98Å; R9-K13 VanDerWaalsContact O-CG 3.31Å; R9-K13 WeakPolarHBondContact O-CG 3.43Å; R9-K13 PolarHBondContact O-N 3.45Å; R9-K13 VanDerWaalsContact O-N 3.11Å |
| 10 | S | 87.1 | Confident | 85.8 | Confident | 70 Ų | 70 | 103.6 Ų | 103.6 | 49% | 0.49 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -68.1 | -43 | 175.1 | -64.2 | 0 | 0 | 0 | 0 | 112 | S6 V7 I8 K13 E14 | S6-S10 PolarHBondContact O-N 3.26Å; S6-S10 PolarHBondContact O-OG 3.25Å; V7-S10 PolarHBondContact O-N 2.97Å; I8-S10 VanDerWaalsContact C-N 3.34Å; I8-S10 PolarHBondContact O-N 3.39Å; S10-K13 PolarHBondContact O-N 2.87Å; S10-E14 PolarHBondContact O-N 2.91Å |
| 11 | L | 89.8 | Confident | 86.4 | Confident | 100 Ų | 100 | 101.8 Ų | 101.8 | 52% | 0.524 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 175.7 | -84.1 | 157.3 | 0 | 0 | 0 | 112.7 | V7 I8 K13 E14 Q15 | V7-L11 HydrophobicContact CG1-CD1 3.92Å; V7-L11 PolarHBondContact O-N 3.49Å; I8-L11 PolarHBondContact O-N 3.27Å; L11-K13 VanDerWaalsContact C-N 3.35Å; L11-E14 PolarHBondContact O-N 2.94Å; L11-Q15 WeakPolarHBondContact O-CB 3.45Å; L11-Q15 PolarHBondContact O-N 3.32Å |
| 12 | L | 90.8 | Very high | 88 | Confident | 90 Ų | 90 | 97.8 Ų | 97.8 | 47% | 0.471 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.3 | -40.5 | 176 | -75.2 | 168.5 | 0 | 0 | 0 | 111.6 | I8 Q15 D16 | I8-L12 HydrophobicContact CG2-CD1 3.93Å; I8-L12 HydrophobicContact CG2-CG 4.44Å; I8-L12 WeakPolarHBondContact O-CB 3.42Å; I8-L12 WeakPolarHBondContact O-CG 3.35Å; I8-L12 PolarHBondContact O-N 2.93Å; L12-Q15 PolarHBondContact O-N 3.49Å; L12-D16 WeakPolarHBondContact O-CB 3.43Å; L12-D16 VanDerWaalsContact O-CG 3.28Å; L12-D16 PolarHBondContact O-N 2.83Å |
| 13 | K | 91.4 | Very high | 89.4 | Confident | 129 Ų | 129 | 94.7 Ų | 94.7 | 56% | 0.561 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.9 | -43.4 | 174.8 | -77.7 | 178.2 | 175.4 | -169.2 | 0 | 112.3 | R9 S10 L11 Q15 D16 E17 | R9-K13 VanDerWaalsContact O-CG 3.31Å; R9-K13 WeakPolarHBondContact O-CG 3.43Å; R9-K13 PolarHBondContact O-N 3.45Å; R9-K13 VanDerWaalsContact O-N 3.11Å; S10-K13 PolarHBondContact O-N 2.87Å; L11-K13 VanDerWaalsContact C-N 3.35Å; K13-Q15 VanDerWaalsContact C-N 3.32Å; K13-Q15 PolarHBondContact O-N 2.9Å; K13-D16 PolarHBondContact O-N 3.33Å; K13-E17 WeakPolarHBondContact O-CG 3.48Å; K13-E17 PolarHBondContact O-N 3.37Å |
| 14 | E | 92.9 | Very high | 90.7 | Very high | 116 Ų | 116 | 97.5 Ų | 97.5 | 54% | 0.542 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.7 | -40.1 | 177.3 | -171.1 | 172.7 | -168.6 | 0 | 0 | 111.2 | S10 L11 E17 I18 | S10-E14 PolarHBondContact O-N 2.91Å; L11-E14 PolarHBondContact O-N 2.94Å; E14-E17 PolarHBondContact O-N 2.81Å; E14-I18 HydrophobicContact CG-CD1 4.39Å; E14-I18 WeakPolarHBondContact O-CD1 3.49Å; E14-I18 VanDerWaalsContact O-CG1 3.27Å; E14-I18 WeakPolarHBondContact O-CG1 3.4Å; E14-I18 PolarHBondContact O-N 2.91Å |
| 15 | Q | 93.3 | Very high | 91.7 | Very high | 111 Ų | 111 | 98.9 Ų | 98.9 | 52% | 0.519 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.2 | -41.3 | 174.8 | -170.9 | 173.9 | 8.6 | 0 | 0 | 112.6 | L11 L12 K13 E17 I18 L19 | L11-Q15 WeakPolarHBondContact O-CB 3.45Å; L11-Q15 PolarHBondContact O-N 3.32Å; L12-Q15 PolarHBondContact O-N 3.49Å; K13-Q15 VanDerWaalsContact C-N 3.32Å; K13-Q15 PolarHBondContact O-N 2.9Å; Q15-E17 VanDerWaalsContact C-N 3.34Å; Q15-I18 PolarHBondContact O-N 3.49Å; Q15-L19 HydrophobicContact CG-CD1 4.33Å; Q15-L19 WeakPolarHBondContact O-CG 3.26Å; Q15-L19 PolarHBondContact O-N 3.3Å |
| 16 | D | 93.2 | Very high | 92.5 | Very high | 94 Ų | 94 | 100.9 Ų | 100.9 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.7 | -40.3 | 175.6 | -75 | -22.8 | 0 | 0 | 0 | 111.2 | L12 K13 L19 L20 | L12-D16 WeakPolarHBondContact O-CB 3.43Å; L12-D16 VanDerWaalsContact O-CG 3.28Å; L12-D16 PolarHBondContact O-N 2.83Å; K13-D16 PolarHBondContact O-N 3.33Å; D16-L19 PolarHBondContact O-N 2.88Å; D16-L20 WeakPolarHBondContact O-CB 3.32Å; D16-L20 WeakPolarHBondContact O-CG 3.37Å; D16-L20 PolarHBondContact O-N 3.1Å |
| 17 | E | 95.1 | Very high | 93.2 | Very high | 128 Ų | 128 | 106.6 Ų | 106.6 | 60% | 0.598 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62 | -45.1 | 174.9 | -76.9 | 179.1 | -178.1 | 0 | 0 | 111.7 | K13 E14 Q15 L19 L20 D21 | K13-E17 WeakPolarHBondContact O-CG 3.48Å; K13-E17 PolarHBondContact O-N 3.37Å; E14-E17 PolarHBondContact O-N 2.81Å; Q15-E17 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.5Å; E17-L20 PolarHBondContact O-N 3.14Å; E17-D21 PolarHBondContact O-N 3.41Å |
| 18 | I | 95.7 | Very high | 93.8 | Very high | 88 Ų | 88 | 106.9 Ų | 106.9 | 45% | 0.451 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 176.4 | -67.5 | 163.8 | 0 | 0 | 0 | 111.3 | E14 Q15 D21 Q22 | E14-I18 HydrophobicContact CG-CD1 4.39Å; E14-I18 WeakPolarHBondContact O-CD1 3.49Å; E14-I18 VanDerWaalsContact O-CG1 3.27Å; E14-I18 WeakPolarHBondContact O-CG1 3.4Å; E14-I18 PolarHBondContact O-N 2.91Å; Q15-I18 PolarHBondContact O-N 3.49Å; I18-D21 PolarHBondContact O-N 3.27Å; I18-Q22 WeakPolarHBondContact O-CG 3.42Å; I18-Q22 PolarHBondContact O-N 3.36Å |
| 19 | L | 95.8 | Very high | 94.3 | Very high | 78 Ų | 78 | 107.1 Ų | 107.1 | 41% | 0.408 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.2 | -38.9 | 178.4 | -72.6 | 172.1 | 0 | 0 | 0 | 111.7 | Q15 D16 E17 Q22 I23 | Q15-L19 HydrophobicContact CG-CD1 4.33Å; Q15-L19 WeakPolarHBondContact O-CG 3.26Å; Q15-L19 PolarHBondContact O-N 3.3Å; D16-L19 PolarHBondContact O-N 2.88Å; E17-L19 PolarHBondContact O-N 3.5Å; L19-Q22 PolarHBondContact O-N 2.85Å; L19-I23 WeakPolarHBondContact O-CB 3.36Å; L19-I23 VanDerWaalsContact O-CG1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.29Å; L19-I23 PolarHBondContact O-N 2.73Å |
| 20 | L | 96.4 | Very high | 94.7 | Very high | 113 Ų | 113 | 103.8 Ų | 103.8 | 59% | 0.592 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -41.1 | 175.3 | -75 | 170.6 | 0 | 0 | 0 | 111.7 | D16 E17 I23 R24 | D16-L20 WeakPolarHBondContact O-CB 3.32Å; D16-L20 WeakPolarHBondContact O-CG 3.37Å; D16-L20 PolarHBondContact O-N 3.1Å; E17-L20 PolarHBondContact O-N 3.14Å; L20-I23 PolarHBondContact O-N 2.81Å; L20-R24 PolarHBondContact O-N 2.98Å |
| 21 | D | 96.5 | Very high | 95.2 | Very high | 66 Ų | 66 | 102.1 Ų | 102.1 | 35% | 0.353 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 175.6 | -80.3 | -22.2 | 0 | 0 | 0 | 111.7 | E17 I18 I23 R24 E25 | E17-D21 PolarHBondContact O-N 3.41Å; I18-D21 PolarHBondContact O-N 3.27Å; D21-I23 PolarHBondContact O-N 2.86Å; D21-R24 WeakPolarHBondContact O-CB 3.47Å; D21-R24 PolarHBondContact O-N 3.42Å; D21-R24 VanDerWaalsContact O-N 3.17Å; D21-R24 IonicContact OD1-CZ 3.99Å; D21-R24 IonicContact OD1-NH1 2.76Å; D21-R24 PolarHBondContact OD1-NH1 3.24Å; D21-R24 IonicContact OD1-NH2 2.79Å; D21-R24 PolarHBondContact OD1-NH2 3.48Å; D21-E25 WeakPolarHBondContact O-CG 3.44Å; D21-E25 PolarHBondContact O-N 2.79Å |
| 22 | Q | 96.7 | Very high | 95.6 | Very high | 97 Ų | 97 | 104.8 Ų | 104.8 | 45% | 0.453 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 174.8 | -73.6 | 177.5 | -2.5 | 0 | 0 | 112.6 | I18 L19 R24 E25 L26 | I18-Q22 WeakPolarHBondContact O-CG 3.42Å; I18-Q22 PolarHBondContact O-N 3.36Å; L19-Q22 PolarHBondContact O-N 2.85Å; Q22-R24 VanDerWaalsContact C-N 3.28Å; Q22-R24 PolarHBondContact O-N 2.76Å; Q22-E25 PolarHBondContact O-N 2.82Å; Q22-L26 WeakPolarHBondContact O-CB 3.3Å; Q22-L26 WeakPolarHBondContact O-CG 3.41Å; Q22-L26 PolarHBondContact O-N 3.5Å |
| 23 | I | 96.3 | Very high | 95.8 | Very high | 83 Ų | 83 | 105 Ų | 105 | 43% | 0.426 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63 | -38.6 | 175.8 | -71.1 | 167.4 | 0 | 0 | 0 | 110.5 | L19 L20 D21 R27 | L19-I23 WeakPolarHBondContact O-CB 3.36Å; L19-I23 VanDerWaalsContact O-CG1 3.25Å; L19-I23 WeakPolarHBondContact O-CG1 3.29Å; L19-I23 PolarHBondContact O-N 2.73Å; L20-I23 PolarHBondContact O-N 2.81Å; D21-I23 PolarHBondContact O-N 2.86Å; I23-R27 WeakPolarHBondContact O-CG 3.35Å; I23-R27 PolarHBondContact O-N 3.21Å; I23-R27 VanDerWaalsContact O-N 3.11Å |
| 24 | R | 97.4 | Very high | 96.1 | Very high | 135 Ų | 135 | 105.8 Ų | 105.8 | 51% | 0.509 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.4 | -49.1 | 175.9 | -173.1 | 178.6 | 68.2 | -131 | -7.4 | 111 | L20 D21 Q22 L26 R27 D28 | L20-R24 PolarHBondContact O-N 2.98Å; D21-R24 WeakPolarHBondContact O-CB 3.47Å; D21-R24 PolarHBondContact O-N 3.42Å; D21-R24 VanDerWaalsContact O-N 3.17Å; D21-R24 IonicContact OD1-CZ 3.99Å; D21-R24 IonicContact OD1-NH1 2.76Å; D21-R24 PolarHBondContact OD1-NH1 3.24Å; D21-R24 IonicContact OD1-NH2 2.79Å; D21-R24 PolarHBondContact OD1-NH2 3.48Å; Q22-R24 VanDerWaalsContact C-N 3.28Å; Q22-R24 PolarHBondContact O-N 2.76Å; R24-L26 PolarHBondContact O-N 2.87Å; R24-R27 PolarHBondContact O-N 3.48Å; R24-D28 PolarHBondContact O-N 2.85Å |
| 25 | E | 96.6 | Very high | 96.3 | Very high | 121 Ų | 121 | 107.2 Ų | 107.2 | 57% | 0.565 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.4 | -44.8 | 179.4 | -72.8 | 178.8 | 180 | 0 | 0 | 112.8 | D21 Q22 R27 D28 E29 | D21-E25 WeakPolarHBondContact O-CG 3.44Å; D21-E25 PolarHBondContact O-N 2.79Å; Q22-E25 PolarHBondContact O-N 2.82Å; E25-R27 VanDerWaalsContact C-N 3.3Å; E25-R27 PolarHBondContact O-N 3.23Å; E25-D28 PolarHBondContact O-N 2.74Å; E25-E29 PolarHBondContact O-N 3.04Å |
| 26 | L | 96.4 | Very high | 96.5 | Very high | 101 Ų | 101 | 106.2 Ų | 106.2 | 53% | 0.529 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.7 | -31.8 | 177.7 | -72.4 | 173.4 | 0 | 0 | 0 | 112.7 | Q22 R24 N30 | Q22-L26 WeakPolarHBondContact O-CB 3.3Å; Q22-L26 WeakPolarHBondContact O-CG 3.41Å; Q22-L26 PolarHBondContact O-N 3.5Å; R24-L26 PolarHBondContact O-N 2.87Å; L26-N30 WeakPolarHBondContact O-CB 3.14Å; L26-N30 PolarHBondContact O-N 3.03Å; L26-N30 PolarHBondContact O-ND2 3.29Å |
| 27 | R | 96.8 | Very high | 96.6 | Very high | 186 Ų | 186 | 106.6 Ų | 106.6 | 70% | 0.702 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -68.5 | -42.9 | 172.8 | -78.6 | -176.6 | -170 | -160.4 | 5.1 | 111.4 | I23 R24 E25 N30 G31 | I23-R27 WeakPolarHBondContact O-CG 3.35Å; I23-R27 PolarHBondContact O-N 3.21Å; I23-R27 VanDerWaalsContact O-N 3.11Å; R24-R27 PolarHBondContact O-N 3.48Å; E25-R27 VanDerWaalsContact C-N 3.3Å; E25-R27 PolarHBondContact O-N 3.23Å; R27-N30 PolarHBondContact O-N 3.39Å; R27-G31 PolarHBondContact O-N 3.4Å |
| 28 | D | 97.2 | Very high | 96.7 | Very high | 90 Ų | 90 | 103.7 Ų | 103.7 | 48% | 0.481 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.1 | -40.5 | 178.2 | -70.8 | -18.6 | 0 | 0 | 0 | 111.5 | R24 E25 G31 R32 | R24-D28 PolarHBondContact O-N 2.85Å; E25-D28 PolarHBondContact O-N 2.74Å; D28-G31 PolarHBondContact O-N 3.28Å; D28-R32 WeakPolarHBondContact O-CG 3.26Å; D28-R32 PolarHBondContact O-N 3.31Å |
| 29 | E | 97.2 | Very high | 96.7 | Very high | 99 Ų | 99 | 105.4 Ų | 105.4 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.6 | -46.5 | 175.7 | -171.7 | 168.6 | -157.7 | 0 | 0 | 112.2 | E25 G31 R32 L33 | E25-E29 PolarHBondContact O-N 3.04Å; E29-G31 VanDerWaalsContact C-N 3.26Å; E29-G31 PolarHBondContact O-N 2.84Å; E29-R32 PolarHBondContact O-N 3.03Å; E29-R32 VanDerWaalsContact O-N 3.12Å; E29-L33 HydrophobicContact CG-CD1 4.36Å; E29-L33 WeakPolarHBondContact O-CG 3.37Å; E29-L33 PolarHBondContact O-N 3.38Å |
| 30 | N | 95.6 | Very high | 96.6 | Very high | 85 Ų | 85 | 106.4 Ų | 106.4 | 46% | 0.455 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -57.6 | -41.3 | 172.8 | -84.9 | -53 | 0 | 0 | 0 | 111.6 | L26 R27 R32 L33 F34 | L26-N30 WeakPolarHBondContact O-CB 3.14Å; L26-N30 PolarHBondContact O-N 3.03Å; L26-N30 PolarHBondContact O-ND2 3.29Å; R27-N30 PolarHBondContact O-N 3.39Å; N30-R32 VanDerWaalsContact C-N 3.35Å; N30-R32 PolarHBondContact O-N 3.12Å; N30-L33 PolarHBondContact O-N 3.25Å; N30-F34 WeakPolarHBondContact O-CD2 3.28Å; N30-F34 PolarHBondContact O-N 2.96Å |
| 31 | G | 97.6 | Very high | 96.5 | Very high | 34 Ų | 34 | 104.5 Ų | 104.5 | 35% | 0.351 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.6 | -40.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | R27 D28 E29 K35 | R27-G31 PolarHBondContact O-N 3.4Å; D28-G31 PolarHBondContact O-N 3.28Å; E29-G31 VanDerWaalsContact C-N 3.26Å; E29-G31 PolarHBondContact O-N 2.84Å; G31-K35 WeakPolarHBondContact O-CG 3.48Å; G31-K35 PolarHBondContact O-N 3.38Å |
| 32 | R | 97.9 | Very high | 96.3 | Very high | 157 Ų | 157 | 108.3 Ų | 108.3 | 59% | 0.592 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66 | -43.7 | 173.8 | -72.4 | -173.2 | -69.6 | -100.2 | 1.8 | 111.8 | D28 E29 N30 K35 L36 | D28-R32 WeakPolarHBondContact O-CG 3.26Å; D28-R32 PolarHBondContact O-N 3.31Å; E29-R32 PolarHBondContact O-N 3.03Å; E29-R32 VanDerWaalsContact O-N 3.12Å; N30-R32 VanDerWaalsContact C-N 3.35Å; N30-R32 PolarHBondContact O-N 3.12Å; R32-K35 PolarHBondContact O-N 3.48Å; R32-L36 PolarHBondContact O-N 3.27Å |
| 33 | L | 96.7 | Very high | 96 | Very high | 94 Ų | 94 | 108 Ų | 108 | 49% | 0.492 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63 | -42.3 | 178.3 | -70.6 | 173.8 | 0 | 0 | 0 | 112 | E29 N30 K35 L36 L37 | E29-L33 HydrophobicContact CG-CD1 4.36Å; E29-L33 WeakPolarHBondContact O-CG 3.37Å; E29-L33 PolarHBondContact O-N 3.38Å; N30-L33 PolarHBondContact O-N 3.25Å; L33-K35 VanDerWaalsContact C-N 3.34Å; L33-K35 PolarHBondContact O-N 3Å; L33-L36 PolarHBondContact O-N 3.46Å; L33-L37 VanDerWaalsContact O-CB 3.29Å; L33-L37 WeakPolarHBondContact O-CB 3.19Å; L33-L37 PolarHBondContact O-N 2.86Å |
| 34 | F | 97.4 | Very high | 95.4 | Very high | 145 Ų | 145 | 109.2 Ų | 109.2 | 64% | 0.636 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.8 | -38.9 | 175.7 | -88.1 | -67 | 0 | 0 | 0 | 112.9 | N30 S38 | N30-F34 WeakPolarHBondContact O-CD2 3.28Å; N30-F34 PolarHBondContact O-N 2.96Å; F34-S38 PolarHBondContact O-N 2.9Å; F34-S38 PolarHBondContact O-OG 2.8Å |
| 35 | K | 97.3 | Very high | 94.8 | Very high | 147 Ų | 147 | 109.8 Ų | 109.8 | 64% | 0.639 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.2 | -44.9 | 175 | -73.4 | 178.9 | -178.4 | 178.9 | 0 | 111.9 | G31 R32 L33 L37 S38 E39 | G31-K35 WeakPolarHBondContact O-CG 3.48Å; G31-K35 PolarHBondContact O-N 3.38Å; R32-K35 PolarHBondContact O-N 3.48Å; L33-K35 VanDerWaalsContact C-N 3.34Å; L33-K35 PolarHBondContact O-N 3Å; K35-L37 VanDerWaalsContact C-N 3.31Å; K35-L37 PolarHBondContact O-N 3.43Å; K35-S38 PolarHBondContact O-N 3.33Å; K35-S38 PolarHBondContact O-OG 3.16Å; K35-E39 WeakPolarHBondContact O-CG 3.35Å; K35-E39 PolarHBondContact O-N 2.79Å |
| 36 | L | 97.1 | Very high | 93.9 | Very high | 90 Ų | 90 | 108.7 Ų | 108.7 | 47% | 0.471 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64 | -39.7 | 177.9 | -175.5 | 63.9 | 0 | 0 | 0 | 111.5 | R32 L33 E39 K40 | R32-L36 PolarHBondContact O-N 3.27Å; L33-L36 PolarHBondContact O-N 3.46Å; L36-E39 PolarHBondContact O-N 3.41Å; L36-K40 VanDerWaalsContact O-CG 3.29Å; L36-K40 WeakPolarHBondContact O-CG 3.39Å; L36-K40 PolarHBondContact O-N 3.03Å |
| 37 | L | 96.2 | Very high | 92.9 | Very high | 101 Ų | 101 | 108.9 Ų | 108.9 | 53% | 0.529 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 177.9 | -166.6 | 143.3 | 0 | 0 | 0 | 111.2 | L33 K35 K40 D41 | L33-L37 VanDerWaalsContact O-CB 3.29Å; L33-L37 WeakPolarHBondContact O-CB 3.19Å; L33-L37 PolarHBondContact O-N 2.86Å; K35-L37 VanDerWaalsContact C-N 3.31Å; K35-L37 PolarHBondContact O-N 3.43Å; L37-K40 PolarHBondContact O-N 2.98Å; L37-D41 WeakPolarHBondContact CD2-OD2 3.48Å; L37-D41 WeakPolarHBondContact O-CB 3.16Å; L37-D41 PolarHBondContact O-N 3.44Å |
| 38 | S | 95.7 | Very high | 91.7 | Very high | 68 Ų | 68 | 103.1 Ų | 103.1 | 48% | 0.476 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.7 | -36.6 | 176.6 | 69.4 | 0 | 0 | 0 | 0 | 113.1 | F34 K35 F42 | F34-S38 PolarHBondContact O-N 2.9Å; F34-S38 PolarHBondContact O-OG 2.8Å; K35-S38 PolarHBondContact O-N 3.33Å; K35-S38 PolarHBondContact O-OG 3.16Å; S38-F42 WeakPolarHBondContact O-CB 3.42Å; S38-F42 PolarHBondContact O-N 2.96Å |
| 39 | E | 96 | Very high | 90 | Very high | 123 Ų | 123 | 104.9 Ų | 104.9 | 58% | 0.575 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.1 | -45.4 | 171.5 | -75 | 174.1 | -168.3 | 0 | 0 | 111.6 | K35 L36 F42 E43 | K35-E39 WeakPolarHBondContact O-CG 3.35Å; K35-E39 PolarHBondContact O-N 2.79Å; L36-E39 PolarHBondContact O-N 3.41Å; E39-F42 WeakPolarHBondContact O-CB 3.21Å; E39-F42 PolarHBondContact O-N 3.47Å; E39-E43 PolarHBondContact O-N 2.88Å |
| 40 | K | 94.4 | Very high | 88.2 | Confident | 100 Ų | 100 | 104.3 Ų | 104.3 | 44% | 0.435 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.9 | -38.6 | 178.3 | -67.9 | -69.9 | 147.8 | -167.2 | 0 | 112.4 | L36 L37 F42 E43 I44 | L36-K40 VanDerWaalsContact O-CG 3.29Å; L36-K40 WeakPolarHBondContact O-CG 3.39Å; L36-K40 PolarHBondContact O-N 3.03Å; L37-K40 PolarHBondContact O-N 2.98Å; K40-F42 VanDerWaalsContact C-N 3.28Å; K40-F42 PolarHBondContact O-N 3.25Å; K40-E43 IonicContact NZ-OE2 3.07Å; K40-E43 PolarHBondContact NZ-OE2 2.79Å; K40-E43 PolarHBondContact O-N 3.48Å; K40-I44 WeakPolarHBondContact O-CB 3.25Å; K40-I44 VanDerWaalsContact O-CG1 3.27Å; K40-I44 WeakPolarHBondContact O-CG1 3.47Å; K40-I44 PolarHBondContact O-N 2.91Å |
| 41 | D | 93.6 | Very high | 86.2 | Confident | 73 Ų | 73 | 103.5 Ų | 103.5 | 39% | 0.39 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.5 | -38.1 | 173.3 | -82.7 | -20.3 | 0 | 0 | 0 | 111.8 | L37 K45 | L37-D41 WeakPolarHBondContact CD2-OD2 3.48Å; L37-D41 WeakPolarHBondContact O-CB 3.16Å; L37-D41 PolarHBondContact O-N 3.44Å; D41-K45 WeakPolarHBondContact O-CB 3.38Å; D41-K45 VanDerWaalsContact O-CG 3.24Å; D41-K45 WeakPolarHBondContact O-CG 3.46Å; D41-K45 PolarHBondContact O-N 2.77Å |
| 42 | F | 93.1 | Very high | 84 | Confident | 146 Ų | 146 | 105 Ų | 105 | 64% | 0.64 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66 | -43.4 | 174.3 | -172.4 | -93.1 | 0 | 0 | 0 | 111.4 | S38 E39 K40 K45 H46 | S38-F42 WeakPolarHBondContact O-CB 3.42Å; S38-F42 PolarHBondContact O-N 2.96Å; E39-F42 WeakPolarHBondContact O-CB 3.21Å; E39-F42 PolarHBondContact O-N 3.47Å; K40-F42 VanDerWaalsContact C-N 3.28Å; K40-F42 PolarHBondContact O-N 3.25Å; F42-K45 PolarHBondContact O-N 3.47Å; F42-H46 WeakPolarHBondContact O-CB 3.44Å; F42-H46 PolarHBondContact O-N 3.09Å |
| 43 | E | 90.3 | Very high | 81.9 | Confident | 90 Ų | 90 | 100.7 Ų | 100.7 | 42% | 0.421 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 176 | -169.9 | 175.1 | -169.7 | 0 | 0 | 111.9 | E39 K40 K45 H46 L47 | E39-E43 PolarHBondContact O-N 2.88Å; K40-E43 IonicContact NZ-OE2 3.07Å; K40-E43 PolarHBondContact NZ-OE2 2.79Å; K40-E43 PolarHBondContact O-N 3.48Å; E43-K45 PolarHBondContact O-N 2.82Å; E43-H46 PolarHBondContact O-N 3.4Å; E43-L47 HydrophobicContact CG-CD1 4.07Å; E43-L47 HydrophobicContact CG-CG 4.46Å; E43-L47 WeakPolarHBondContact O-CB 3.23Å; E43-L47 VanDerWaalsContact O-CG 3.28Å; E43-L47 WeakPolarHBondContact O-CG 3.4Å; E43-L47 PolarHBondContact O-N 3.15Å |
| 44 | I | 83.1 | Confident | 80.1 | Confident | 109 Ų | 109 | 98.7 Ų | 98.7 | 56% | 0.559 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61.5 | -45.1 | 174.9 | -70.1 | 165.6 | 0 | 0 | 0 | 110.6 | K40 H46 L47 A48 | K40-I44 WeakPolarHBondContact O-CB 3.25Å; K40-I44 VanDerWaalsContact O-CG1 3.27Å; K40-I44 WeakPolarHBondContact O-CG1 3.47Å; K40-I44 PolarHBondContact O-N 2.91Å; I44-H46 VanDerWaalsContact C-N 3.34Å; I44-H46 PolarHBondContact O-N 3.08Å; I44-L47 PolarHBondContact O-N 2.77Å; I44-A48 VanDerWaalsContact O-CB 3.24Å; I44-A48 WeakPolarHBondContact O-CB 3.33Å; I44-A48 PolarHBondContact O-N 3.01Å |
| 45 | K | 84.2 | Confident | 78.2 | Confident | 146 Ų | 146 | 98.9 Ų | 98.9 | 64% | 0.635 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.8 | -41.5 | 176.2 | -75.3 | 170.7 | -173.4 | 170.8 | 0 | 111.6 | D41 F42 E43 A48 L49 | D41-K45 WeakPolarHBondContact O-CB 3.38Å; D41-K45 VanDerWaalsContact O-CG 3.24Å; D41-K45 WeakPolarHBondContact O-CG 3.46Å; D41-K45 PolarHBondContact O-N 2.77Å; F42-K45 PolarHBondContact O-N 3.47Å; E43-K45 PolarHBondContact O-N 2.82Å; K45-A48 PolarHBondContact O-N 3.43Å; K45-L49 VanDerWaalsContact O-CB 3.32Å; K45-L49 WeakPolarHBondContact O-CB 3.11Å; K45-L49 PolarHBondContact O-N 2.94Å |
| 46 | H | 79.2 | Confident | 76.4 | Confident | 98 Ų | 98 | 95 Ų | 95 | 45% | 0.454 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.3 | -42.3 | 178 | -177 | -88.5 | 0 | 0 | 0 | 112 | F42 E43 I44 L49 T50 | F42-H46 WeakPolarHBondContact O-CB 3.44Å; F42-H46 PolarHBondContact O-N 3.09Å; E43-H46 PolarHBondContact O-N 3.4Å; I44-H46 VanDerWaalsContact C-N 3.34Å; I44-H46 PolarHBondContact O-N 3.08Å; H46-L49 PolarHBondContact O-N 3.47Å; H46-T50 PolarHBondContact CE1-OG1 3.45Å; H46-T50 VanDerWaalsContact CE1-OG1 3.28Å; H46-T50 VanDerWaalsContact O-CB 3.26Å; H46-T50 WeakPolarHBondContact O-CB 3.33Å; H46-T50 PolarHBondContact O-N 2.92Å; H46-T50 PolarHBondContact O-OG1 2.83Å |
| 47 | L | 75.2 | Confident | 75.1 | Confident | 106 Ų | 106 | 92.3 Ų | 92.3 | 56% | 0.555 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -69.5 | -32.9 | 174.7 | -71 | 173.1 | 0 | 0 | 0 | 112.1 | E43 I44 G51 | E43-L47 HydrophobicContact CG-CD1 4.07Å; E43-L47 HydrophobicContact CG-CG 4.46Å; E43-L47 WeakPolarHBondContact O-CB 3.23Å; E43-L47 VanDerWaalsContact O-CG 3.28Å; E43-L47 WeakPolarHBondContact O-CG 3.4Å; E43-L47 PolarHBondContact O-N 3.15Å; I44-L47 PolarHBondContact O-N 2.77Å; L47-G51 WeakPolarHBondContact O-CA 3.43Å; L47-G51 PolarHBondContact O-N 3.27Å |
| 48 | A | 70.1 | Confident | 74 | Confident | 65 Ų | 65 | 89.9 Ų | 89.9 | 54% | 0.537 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.7 | -39.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | I44 K45 S52 | I44-A48 VanDerWaalsContact O-CB 3.24Å; I44-A48 WeakPolarHBondContact O-CB 3.33Å; I44-A48 PolarHBondContact O-N 3.01Å; K45-A48 PolarHBondContact O-N 3.43Å; A48-S52 WeakPolarHBondContact O-CB 3.47Å; A48-S52 PolarHBondContact O-N 3.23Å; A48-S52 VanDerWaalsContact O-N 3.08Å |
| 49 | L | 62.7 | Low | 73.2 | Confident | 126 Ų | 126 | 91.2 Ų | 91.2 | 66% | 0.66 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -71.1 | -40.5 | 177.6 | -170.8 | 66 | 0 | 0 | 0 | 112.3 | K45 H46 S52 | K45-L49 VanDerWaalsContact O-CB 3.32Å; K45-L49 WeakPolarHBondContact O-CB 3.11Å; K45-L49 PolarHBondContact O-N 2.94Å; H46-L49 PolarHBondContact O-N 3.47Å; L49-S52 PolarHBondContact O-OG 2.77Å |
| 50 | T | 59.4 | Low | 72.4 | Confident | 87 Ų | 87 | 87.6 Ų | 87.6 | 53% | 0.534 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -86 | -30.7 | -177.6 | -46.4 | 0 | 0 | 0 | 0 | 112.4 | H46 S52 | H46-T50 PolarHBondContact CE1-OG1 3.45Å; H46-T50 VanDerWaalsContact CE1-OG1 3.28Å; H46-T50 VanDerWaalsContact O-CB 3.26Å; H46-T50 WeakPolarHBondContact O-CB 3.33Å; H46-T50 PolarHBondContact O-N 2.92Å; H46-T50 PolarHBondContact O-OG1 2.83Å; T50-S52 VanDerWaalsContact C-N 3.27Å |
| 51 | G | 52.9 | Low | 71.8 | Confident | 68 Ų | 68 | 85.4 Ų | 85.4 | 70% | 0.701 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -73.5 | -18.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L47 S53 | L47-G51 WeakPolarHBondContact O-CA 3.43Å; L47-G51 PolarHBondContact O-N 3.27Å; G51-S53 PolarHBondContact O-N 3.47Å |
| 52 | S | 51.1 | Low | 71.4 | Confident | 66 Ų | 66 | 85.8 Ų | 85.8 | 46% | 0.462 | 53% | 0.531 | S | S | . | . | S | Bend | trans | -78.2 | 93.2 | 154 | 91.8 | 0 | 0 | 0 | 0 | 108 | A48 L49 T50 G54 | A48-S52 WeakPolarHBondContact O-CB 3.47Å; A48-S52 PolarHBondContact O-N 3.23Å; A48-S52 VanDerWaalsContact O-N 3.08Å; L49-S52 PolarHBondContact O-OG 2.77Å; T50-S52 VanDerWaalsContact C-N 3.27Å; S52-G54 PolarHBondContact O-N 3.25Å |
| 53 | S | 54.6 | Low | 71.4 | Confident | 67 Ų | 67 | 83.4 Ų | 83.4 | 47% | 0.469 | 52% | 0.521 | S | S | . | . | trans | -65.4 | 75.6 | 166 | -172 | 0 | 0 | 0 | 0 | 108.7 | G51 L55 A56 G57 | G51-S53 PolarHBondContact O-N 3.47Å; S53-L55 PolarHBondContact O-N 3.01Å; S53-L55 VanDerWaalsContact O-N 3.13Å; S53-A56 WeakPolarHBondContact OG-CB 3.09Å; S53-G57 VanDerWaalsContact O-CA 3.3Å; S53-G57 WeakPolarHBondContact O-CA 3.36Å; S53-G57 PolarHBondContact O-N 3.48Å; S53-G57 PolarHBondContact OG-N 2.94Å | ||
| 54 | G | 57.9 | Low | 71.5 | Confident | 52 Ų | 52 | 84.2 Ų | 84.2 | 54% | 0.536 | 53% | 0.527 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.2 | -15.5 | -165.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | S52 A58 | S52-G54 PolarHBondContact O-N 3.25Å; G54-A58 WeakPolarHBondContact O-CB 3.49Å |
| 55 | L | 58.3 | Low | 72 | Confident | 148 Ų | 148 | 83.8 Ų | 83.8 | 78% | 0.775 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.4 | -50.2 | 173.9 | -115.9 | 74.1 | 0 | 0 | 0 | 112.6 | S53 A58 V59 | S53-L55 PolarHBondContact O-N 3.01Å; S53-L55 VanDerWaalsContact O-N 3.13Å; L55-A58 PolarHBondContact O-N 3.39Å; L55-V59 WeakPolarHBondContact O-CB 3.26Å; L55-V59 WeakPolarHBondContact O-CG2 3.25Å; L55-V59 PolarHBondContact O-N 2.84Å |
| 56 | A | 59.8 | Low | 72.5 | Confident | 65 Ų | 65 | 81.5 Ų | 81.5 | 54% | 0.537 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -74.9 | -36.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S53 V59 A60 | S53-A56 WeakPolarHBondContact OG-CB 3.09Å; A56-V59 PolarHBondContact O-N 2.7Å; A56-A60 VanDerWaalsContact O-CB 3.32Å; A56-A60 WeakPolarHBondContact O-CB 3.46Å; A56-A60 PolarHBondContact O-N 3.3Å |
| 57 | G | 69.5 | Low | 73.3 | Confident | 35 Ų | 35 | 81.3 Ų | 81.3 | 36% | 0.361 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67 | -37.7 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S53 A60 A61 | S53-G57 VanDerWaalsContact O-CA 3.3Å; S53-G57 WeakPolarHBondContact O-CA 3.36Å; S53-G57 PolarHBondContact O-N 3.48Å; S53-G57 PolarHBondContact OG-N 2.94Å; G57-A60 PolarHBondContact O-N 3.43Å; G57-A61 VanDerWaalsContact O-CB 3.24Å; G57-A61 WeakPolarHBondContact O-CB 3.32Å; G57-A61 PolarHBondContact O-N 2.75Å |
| 58 | A | 72.7 | Confident | 74.1 | Confident | 49 Ų | 49 | 78.8 Ų | 78.8 | 41% | 0.405 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67.2 | -40.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G54 L55 A61 T62 | G54-A58 WeakPolarHBondContact O-CB 3.49Å; L55-A58 PolarHBondContact O-N 3.39Å; A58-A61 PolarHBondContact O-N 2.86Å; A58-T62 WeakPolarHBondContact O-CB 3.29Å; A58-T62 WeakPolarHBondContact O-CG2 3.41Å; A58-T62 PolarHBondContact O-N 2.86Å; A58-T62 PolarHBondContact O-OG1 3.29Å |
| 59 | V | 79.5 | Confident | 75.4 | Confident | 96 Ų | 96 | 81.9 Ų | 81.9 | 58% | 0.582 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66.7 | -39.9 | 174.1 | 171.4 | 0 | 0 | 0 | 0 | 111.3 | L55 A56 T62 K63 | L55-V59 WeakPolarHBondContact O-CB 3.26Å; L55-V59 WeakPolarHBondContact O-CG2 3.25Å; L55-V59 PolarHBondContact O-N 2.84Å; A56-V59 PolarHBondContact O-N 2.7Å; V59-T62 WeakPolarHBondContact CA-OG1 3.39Å; V59-T62 PolarHBondContact O-OG1 2.83Å; V59-K63 VanDerWaalsContact O-CB 3.31Å; V59-K63 WeakPolarHBondContact O-CB 3.46Å; V59-K63 PolarHBondContact O-N 3.45Å |
| 60 | A | 79.4 | Confident | 77.1 | Confident | 48 Ų | 48 | 81.2 Ų | 81.2 | 40% | 0.397 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.1 | -44 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A56 G57 K63 I64 | A56-A60 VanDerWaalsContact O-CB 3.32Å; A56-A60 WeakPolarHBondContact O-CB 3.46Å; A56-A60 PolarHBondContact O-N 3.3Å; G57-A60 PolarHBondContact O-N 3.43Å; A60-K63 PolarHBondContact O-N 3.29Å; A60-I64 WeakPolarHBondContact O-CB 3.27Å; A60-I64 WeakPolarHBondContact O-CD1 3.37Å; A60-I64 WeakPolarHBondContact O-CG1 3.33Å; A60-I64 PolarHBondContact O-N 2.89Å |
| 61 | A | 80.5 | Confident | 78.7 | Confident | 53 Ų | 53 | 82.1 Ų | 82.1 | 44% | 0.438 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.3 | -45.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | G57 A58 K63 I64 V65 | G57-A61 VanDerWaalsContact O-CB 3.24Å; G57-A61 WeakPolarHBondContact O-CB 3.32Å; G57-A61 PolarHBondContact O-N 2.75Å; A58-A61 PolarHBondContact O-N 2.86Å; A61-K63 VanDerWaalsContact C-N 3.31Å; A61-K63 PolarHBondContact O-N 2.9Å; A61-I64 PolarHBondContact O-N 2.89Å; A61-V65 WeakPolarHBondContact O-CG2 3.34Å; A61-V65 PolarHBondContact O-N 3.44Å |
| 62 | T | 85.3 | Confident | 80.7 | Confident | 82 Ų | 82 | 88.2 Ų | 88.2 | 50% | 0.503 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.4 | -40.9 | 173.9 | 47.6 | 0 | 0 | 0 | 0 | 111.2 | A58 V59 I64 V65 E66 | A58-T62 WeakPolarHBondContact O-CB 3.29Å; A58-T62 WeakPolarHBondContact O-CG2 3.41Å; A58-T62 PolarHBondContact O-N 2.86Å; A58-T62 PolarHBondContact O-OG1 3.29Å; V59-T62 WeakPolarHBondContact CA-OG1 3.39Å; V59-T62 PolarHBondContact O-OG1 2.83Å; T62-I64 PolarHBondContact O-N 3.45Å; T62-V65 PolarHBondContact O-N 2.84Å; T62-E66 WeakPolarHBondContact O-CG 3.39Å; T62-E66 PolarHBondContact O-N 2.73Å |
| 63 | K | 93.6 | Very high | 82.8 | Confident | 95 Ų | 95 | 90 Ų | 90 | 41% | 0.413 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66 | -38.5 | 177.2 | -166.1 | 57.3 | 172.5 | -175.1 | 0 | 113.3 | V59 A60 A61 V65 E66 L67 | V59-K63 VanDerWaalsContact O-CB 3.31Å; V59-K63 WeakPolarHBondContact O-CB 3.46Å; V59-K63 PolarHBondContact O-N 3.45Å; A60-K63 PolarHBondContact O-N 3.29Å; A61-K63 VanDerWaalsContact C-N 3.31Å; A61-K63 PolarHBondContact O-N 2.9Å; K63-V65 VanDerWaalsContact C-N 3.32Å; K63-E66 WeakPolarHBondContact CD-OE2 3.2Å; K63-E66 IonicContact NZ-OE2 2.74Å; K63-E66 PolarHBondContact NZ-OE2 2.85Å; K63-E66 PolarHBondContact O-N 3.4Å; K63-L67 HydrophobicContact CD-CG 4.48Å; K63-L67 HydrophobicContact CG-CD1 4.15Å; K63-L67 HydrophobicContact CG-CG 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.49Å; K63-L67 VanDerWaalsContact O-CG 3.29Å; K63-L67 WeakPolarHBondContact O-CG 3.49Å; K63-L67 PolarHBondContact O-N 3.43Å |
| 64 | I | 92.1 | Very high | 84.7 | Confident | 107 Ų | 107 | 92 Ų | 92 | 55% | 0.549 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.9 | -42.7 | 174.7 | -71.3 | 163 | 0 | 0 | 0 | 110.3 | A60 A61 T62 S68 | A60-I64 WeakPolarHBondContact O-CB 3.27Å; A60-I64 WeakPolarHBondContact O-CD1 3.37Å; A60-I64 WeakPolarHBondContact O-CG1 3.33Å; A60-I64 PolarHBondContact O-N 2.89Å; A61-I64 PolarHBondContact O-N 2.89Å; T62-I64 PolarHBondContact O-N 3.45Å; I64-S68 VanDerWaalsContact O-CB 3.24Å; I64-S68 WeakPolarHBondContact O-CB 3.43Å; I64-S68 PolarHBondContact O-N 3.23Å; I64-S68 PolarHBondContact O-OG 2.99Å |
| 65 | V | 93.6 | Very high | 86.4 | Confident | 101 Ų | 101 | 92.8 Ų | 92.8 | 61% | 0.612 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.2 | -45.5 | 176.7 | 173.3 | 0 | 0 | 0 | 0 | 111.3 | A61 T62 K63 S68 K69 | A61-V65 WeakPolarHBondContact O-CG2 3.34Å; A61-V65 PolarHBondContact O-N 3.44Å; T62-V65 PolarHBondContact O-N 2.84Å; K63-V65 VanDerWaalsContact C-N 3.32Å; V65-S68 PolarHBondContact O-N 2.85Å; V65-K69 WeakPolarHBondContact O-CB 2.87Å; V65-K69 PolarHBondContact O-N 2.87Å |
| 66 | E | 95.5 | Very high | 88.1 | Confident | 97 Ų | 97 | 88.5 Ų | 88.5 | 45% | 0.453 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59 | -48.8 | 175.3 | -77.1 | -176.6 | 178.6 | 0 | 0 | 112.3 | T62 K63 S68 K69 K70 | T62-E66 WeakPolarHBondContact O-CG 3.39Å; T62-E66 PolarHBondContact O-N 2.73Å; K63-E66 WeakPolarHBondContact CD-OE2 3.2Å; K63-E66 IonicContact NZ-OE2 2.74Å; K63-E66 PolarHBondContact NZ-OE2 2.85Å; K63-E66 PolarHBondContact O-N 3.4Å; E66-S68 VanDerWaalsContact C-N 3.31Å; E66-S68 PolarHBondContact O-N 3.48Å; E66-K69 PolarHBondContact O-N 2.78Å; E66-K70 WeakPolarHBondContact O-CG 3.35Å; E66-K70 PolarHBondContact O-N 2.95Å |
| 67 | L | 95.1 | Very high | 89.7 | Confident | 94 Ų | 94 | 89.9 Ų | 89.9 | 49% | 0.492 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 178.4 | -72.9 | 175.3 | 0 | 0 | 0 | 110.9 | K63 K69 K70 N71 | K63-L67 HydrophobicContact CD-CG 4.48Å; K63-L67 HydrophobicContact CG-CD1 4.15Å; K63-L67 HydrophobicContact CG-CG 4.37Å; K63-L67 WeakPolarHBondContact O-CB 3.49Å; K63-L67 VanDerWaalsContact O-CG 3.29Å; K63-L67 WeakPolarHBondContact O-CG 3.49Å; K63-L67 PolarHBondContact O-N 3.43Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.15Å; L67-K70 PolarHBondContact O-N 3.49Å; L67-N71 WeakPolarHBondContact O-CB 3.36Å; L67-N71 PolarHBondContact O-N 3.5Å |
| 68 | S | 93.4 | Very high | 90.9 | Very high | 53 Ų | 53 | 92.6 Ų | 92.6 | 37% | 0.371 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.5 | -39.3 | 175.5 | -61.4 | 0 | 0 | 0 | 0 | 111.9 | I64 V65 E66 N71 R72 | I64-S68 VanDerWaalsContact O-CB 3.24Å; I64-S68 WeakPolarHBondContact O-CB 3.43Å; I64-S68 PolarHBondContact O-N 3.23Å; I64-S68 PolarHBondContact O-OG 2.99Å; V65-S68 PolarHBondContact O-N 2.85Å; E66-S68 VanDerWaalsContact C-N 3.31Å; E66-S68 PolarHBondContact O-N 3.48Å; S68-N71 PolarHBondContact O-N 2.9Å; S68-R72 WeakPolarHBondContact O-CG 3.42Å; S68-R72 PolarHBondContact O-N 3.26Å |
| 69 | K | 96.9 | Very high | 91.9 | Very high | 131 Ų | 131 | 96.5 Ų | 96.5 | 57% | 0.57 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.3 | -47.8 | 175 | -171 | -179.5 | 176.6 | -174.5 | 0 | 111.2 | V65 E66 L67 N71 R72 E73 | V65-K69 WeakPolarHBondContact O-CB 2.87Å; V65-K69 PolarHBondContact O-N 2.87Å; E66-K69 PolarHBondContact O-N 2.78Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.15Å; K69-N71 VanDerWaalsContact C-N 3.28Å; K69-N71 PolarHBondContact O-N 2.93Å; K69-R72 PolarHBondContact O-N 3.39Å; K69-E73 VanDerWaalsContact CE-OE1 3.25Å; K69-E73 WeakPolarHBondContact CE-OE1 3.45Å; K69-E73 WeakPolarHBondContact O-CG 3.41Å; K69-E73 PolarHBondContact O-N 3.43Å |
| 70 | K | 97.3 | Very high | 92.6 | Very high | 112 Ų | 112 | 96.7 Ų | 96.7 | 49% | 0.487 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59 | -38.8 | 174.4 | -73.7 | -175 | 179.6 | -173.1 | 0 | 112.3 | E66 L67 E73 L74 | E66-K70 WeakPolarHBondContact O-CG 3.35Å; E66-K70 PolarHBondContact O-N 2.95Å; L67-K70 PolarHBondContact O-N 3.49Å; K70-E73 PolarHBondContact O-N 3.48Å; K70-L74 WeakPolarHBondContact O-CB 3.45Å; K70-L74 WeakPolarHBondContact O-CG 3.23Å; K70-L74 PolarHBondContact O-N 2.89Å |
| 71 | N | 94 | Very high | 93.3 | Very high | 106 Ų | 106 | 98.9 Ų | 98.9 | 57% | 0.567 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.2 | -40.1 | 178.5 | -141 | -14.2 | 0 | 0 | 0 | 111.3 | L67 S68 K69 L74 C75 | L67-N71 WeakPolarHBondContact O-CB 3.36Å; L67-N71 PolarHBondContact O-N 3.5Å; S68-N71 PolarHBondContact O-N 2.9Å; K69-N71 VanDerWaalsContact C-N 3.28Å; K69-N71 PolarHBondContact O-N 2.93Å; N71-L74 PolarHBondContact O-N 3.33Å; N71-C75 WeakPolarHBondContact O-CB 3.47Å; N71-C75 PolarHBondContact O-N 3.34Å; N71-C75 PolarHBondContact O-SG 3.36Å |
| 72 | R | 95.2 | Very high | 93.9 | Very high | 195 Ų | 195 | 103.1 Ų | 103.1 | 74% | 0.736 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.8 | -42.9 | 173 | -70.2 | 174.6 | -173.9 | 173.4 | 2.3 | 112.3 | S68 K69 C75 A76 | S68-R72 WeakPolarHBondContact O-CG 3.42Å; S68-R72 PolarHBondContact O-N 3.26Å; K69-R72 PolarHBondContact O-N 3.39Å; R72-C75 PolarHBondContact O-N 3.22Å; R72-A76 PolarHBondContact O-N 3.22Å |
| 73 | E | 94.1 | Very high | 94.4 | Very high | 104 Ų | 104 | 103.8 Ų | 103.8 | 49% | 0.486 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.8 | -45.4 | 176.9 | -72.2 | 168 | -174.4 | 0 | 0 | 111.7 | K69 K70 C75 A76 E77 | K69-E73 VanDerWaalsContact CE-OE1 3.25Å; K69-E73 WeakPolarHBondContact CE-OE1 3.45Å; K69-E73 WeakPolarHBondContact O-CG 3.41Å; K69-E73 PolarHBondContact O-N 3.43Å; K70-E73 PolarHBondContact O-N 3.48Å; E73-C75 PolarHBondContact O-N 3.24Å; E73-A76 WeakPolarHBondContact O-CB 3.46Å; E73-A76 PolarHBondContact O-N 3.47Å; E73-E77 PolarHBondContact O-N 3.46Å |
| 74 | L | 95.1 | Very high | 94.5 | Very high | 108 Ų | 108 | 104.2 Ų | 104.2 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.1 | -40.5 | 175.8 | -73.2 | 173.6 | 0 | 0 | 0 | 112.2 | K70 N71 A76 E77 I78 | K70-L74 WeakPolarHBondContact O-CB 3.45Å; K70-L74 WeakPolarHBondContact O-CG 3.23Å; K70-L74 PolarHBondContact O-N 2.89Å; N71-L74 PolarHBondContact O-N 3.33Å; L74-A76 VanDerWaalsContact C-N 3.32Å; L74-A76 PolarHBondContact O-N 2.81Å; L74-E77 PolarHBondContact O-N 3.28Å; L74-I78 WeakPolarHBondContact O-CB 3.34Å; L74-I78 VanDerWaalsContact O-CG1 3.27Å; L74-I78 WeakPolarHBondContact O-CG1 3.36Å; L74-I78 PolarHBondContact O-N 3.11Å |
| 75 | C | 92.8 | Very high | 94.4 | Very high | 69 Ų | 69 | 102.7 Ų | 102.7 | 47% | 0.466 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.9 | -44 | 173.2 | -74.8 | 0 | 0 | 0 | 0 | 111.7 | N71 R72 E73 I78 E79 | N71-C75 WeakPolarHBondContact O-CB 3.47Å; N71-C75 PolarHBondContact O-N 3.34Å; N71-C75 PolarHBondContact O-SG 3.36Å; R72-C75 PolarHBondContact O-N 3.22Å; E73-C75 PolarHBondContact O-N 3.24Å; C75-I78 PolarHBondContact O-N 3.02Å; C75-E79 WeakPolarHBondContact O-CG 3.36Å; C75-E79 PolarHBondContact O-N 2.73Å |
| 76 | A | 94.1 | Very high | 94.5 | Very high | 59 Ų | 59 | 104.8 Ų | 104.8 | 49% | 0.488 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.7 | -42.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | R72 E73 L74 E79 K80 | R72-A76 PolarHBondContact O-N 3.22Å; E73-A76 WeakPolarHBondContact O-CB 3.46Å; E73-A76 PolarHBondContact O-N 3.47Å; L74-A76 VanDerWaalsContact C-N 3.32Å; L74-A76 PolarHBondContact O-N 2.81Å; A76-E79 PolarHBondContact O-N 2.89Å; A76-K80 WeakPolarHBondContact O-CB 3.38Å; A76-K80 PolarHBondContact O-N 3.35Å |
| 77 | E | 95 | Very high | 94.4 | Very high | 93 Ų | 93 | 106 Ų | 106 | 44% | 0.435 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.3 | -36.7 | 178.1 | -157.4 | 65.3 | -147.7 | 0 | 0 | 111.6 | E73 L74 K80 E81 R84 | E73-E77 PolarHBondContact O-N 3.46Å; L74-E77 PolarHBondContact O-N 3.28Å; E77-K80 PolarHBondContact O-N 2.86Å; E77-K80 IonicContact OE1-NZ 2.66Å; E77-E81 WeakPolarHBondContact O-CB 3.36Å; E77-E81 PolarHBondContact O-N 3.46Å; E77-R84 IonicContact OE1-NH2 2.73Å; E77-R84 PolarHBondContact OE1-NH2 2.89Å |
| 78 | I | 94 | Very high | 94.1 | Very high | 93 Ų | 93 | 104.8 Ų | 104.8 | 48% | 0.477 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 172.9 | -72.2 | 168 | 0 | 0 | 0 | 111.1 | L74 C75 E81 K82 | L74-I78 WeakPolarHBondContact O-CB 3.34Å; L74-I78 VanDerWaalsContact O-CG1 3.27Å; L74-I78 WeakPolarHBondContact O-CG1 3.36Å; L74-I78 PolarHBondContact O-N 3.11Å; C75-I78 PolarHBondContact O-N 3.02Å; I78-E81 PolarHBondContact O-N 2.93Å; I78-K82 HydrophobicContact CG2-CD 4.2Å; I78-K82 HydrophobicContact CG2-CG 4.46Å; I78-K82 WeakPolarHBondContact O-CB 3.22Å; I78-K82 WeakPolarHBondContact O-CG 3.35Å; I78-K82 PolarHBondContact O-N 2.93Å |
| 79 | E | 94 | Very high | 94.1 | Very high | 130 Ų | 130 | 105 Ų | 105 | 61% | 0.607 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.4 | -43.3 | 177.3 | -76.1 | -164.1 | 166.1 | 0 | 0 | 111.8 | C75 A76 E81 K82 I83 | C75-E79 WeakPolarHBondContact O-CG 3.36Å; C75-E79 PolarHBondContact O-N 2.73Å; A76-E79 PolarHBondContact O-N 2.89Å; E79-E81 VanDerWaalsContact C-N 3.31Å; E79-E81 PolarHBondContact O-N 2.98Å; E79-K82 WeakPolarHBondContact O-CB 3.24Å; E79-K82 PolarHBondContact O-N 3.39Å; E79-I83 VanDerWaalsContact O-CG1 3.29Å; E79-I83 WeakPolarHBondContact O-CG1 3.37Å; E79-I83 PolarHBondContact O-N 3.3Å |
| 80 | K | 93.3 | Very high | 93.8 | Very high | 100 Ų | 100 | 101.4 Ų | 101.4 | 44% | 0.435 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -58.9 | -43.2 | 173.8 | -175.5 | -177.8 | 173.7 | -167.2 | 0 | 111.7 | A76 E77 I83 R84 | A76-K80 WeakPolarHBondContact O-CB 3.38Å; A76-K80 PolarHBondContact O-N 3.35Å; E77-K80 PolarHBondContact O-N 2.86Å; E77-K80 IonicContact OE1-NZ 2.66Å; K80-I83 PolarHBondContact O-N 2.84Å; K80-R84 PolarHBondContact O-N 3.33Å |
| 81 | E | 93.8 | Very high | 93.8 | Very high | 94 Ų | 94 | 101.8 Ų | 101.8 | 44% | 0.439 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.9 | -37.9 | 177.7 | -163.7 | 55.6 | -144.5 | 0 | 0 | 112.4 | E77 I78 E79 I83 R84 S85 | E77-E81 WeakPolarHBondContact O-CB 3.36Å; E77-E81 PolarHBondContact O-N 3.46Å; I78-E81 PolarHBondContact O-N 2.93Å; E79-E81 VanDerWaalsContact C-N 3.31Å; E79-E81 PolarHBondContact O-N 2.98Å; E81-I83 VanDerWaalsContact C-N 3.3Å; E81-I83 PolarHBondContact O-N 2.86Å; E81-R84 PolarHBondContact O-N 3.32Å; E81-R84 IonicContact OE2-CZ 3.74Å; E81-R84 IonicContact OE2-NE 4Å; E81-R84 PolarHBondContact OE2-NE 3.27Å; E81-R84 IonicContact OE2-NH2 3.16Å; E81-R84 PolarHBondContact OE2-NH2 3.44Å; E81-S85 VanDerWaalsContact O-CB 3.26Å; E81-S85 WeakPolarHBondContact O-CB 3.46Å; E81-S85 PolarHBondContact O-N 3.47Å |
| 82 | K | 93.9 | Very high | 93.6 | Very high | 143 Ų | 143 | 100.8 Ų | 100.8 | 62% | 0.622 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.2 | -40.6 | 171.5 | -79.2 | 177.2 | 179.1 | 175.6 | 0 | 111.8 | I78 E79 K86 | I78-K82 HydrophobicContact CG2-CD 4.2Å; I78-K82 HydrophobicContact CG2-CG 4.46Å; I78-K82 WeakPolarHBondContact O-CB 3.22Å; I78-K82 WeakPolarHBondContact O-CG 3.35Å; I78-K82 PolarHBondContact O-N 2.93Å; E79-K82 WeakPolarHBondContact O-CB 3.24Å; E79-K82 PolarHBondContact O-N 3.39Å; K82-K86 VanDerWaalsContact O-CB 3.3Å; K82-K86 WeakPolarHBondContact O-CB 3.32Å; K82-K86 PolarHBondContact O-N 2.87Å |
| 83 | I | 94.6 | Very high | 93.5 | Very high | 96 Ų | 96 | 97 Ų | 97 | 49% | 0.492 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.9 | -48.2 | 176.1 | -67.3 | 164.4 | 0 | 0 | 0 | 110.1 | E79 K80 E81 S85 K86 Q87 | E79-I83 VanDerWaalsContact O-CG1 3.29Å; E79-I83 WeakPolarHBondContact O-CG1 3.37Å; E79-I83 PolarHBondContact O-N 3.3Å; K80-I83 PolarHBondContact O-N 2.84Å; E81-I83 VanDerWaalsContact C-N 3.3Å; E81-I83 PolarHBondContact O-N 2.86Å; I83-S85 PolarHBondContact O-N 3.34Å; I83-K86 PolarHBondContact O-N 2.98Å; I83-Q87 HydrophobicContact CG2-CG 4.47Å; I83-Q87 WeakPolarHBondContact O-CG 3.32Å; I83-Q87 PolarHBondContact O-N 2.88Å |
| 84 | R | 95.9 | Very high | 93.5 | Very high | 104 Ų | 104 | 96.5 Ų | 96.5 | 39% | 0.392 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.2 | -45 | 176.3 | -74.7 | -167.6 | -74.8 | -142.4 | -7.9 | 112.3 | E77 K80 E81 K86 Q87 S88 | E77-R84 IonicContact OE1-NH2 2.73Å; E77-R84 PolarHBondContact OE1-NH2 2.89Å; K80-R84 PolarHBondContact O-N 3.33Å; E81-R84 PolarHBondContact O-N 3.32Å; E81-R84 IonicContact OE2-CZ 3.74Å; E81-R84 IonicContact OE2-NE 4Å; E81-R84 PolarHBondContact OE2-NE 3.27Å; E81-R84 IonicContact OE2-NH2 3.16Å; E81-R84 PolarHBondContact OE2-NH2 3.44Å; R84-K86 PolarHBondContact O-N 2.94Å; R84-Q87 PolarHBondContact O-N 3.48Å; R84-S88 WeakPolarHBondContact O-CB 3.47Å; R84-S88 PolarHBondContact O-N 2.71Å |
| 85 | S | 91.3 | Very high | 93.3 | Very high | 74 Ų | 74 | 95.1 Ų | 95.1 | 52% | 0.517 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 176.5 | -178.4 | 0 | 0 | 0 | 0 | 111.7 | E81 I83 S88 S89 | E81-S85 VanDerWaalsContact O-CB 3.26Å; E81-S85 WeakPolarHBondContact O-CB 3.46Å; E81-S85 PolarHBondContact O-N 3.47Å; I83-S85 PolarHBondContact O-N 3.34Å; S85-S88 PolarHBondContact O-N 2.94Å; S85-S89 VanDerWaalsContact O-CB 3.31Å; S85-S89 WeakPolarHBondContact O-CB 3.45Å; S85-S89 PolarHBondContact O-N 3.47Å |
| 86 | K | 94.4 | Very high | 93.1 | Very high | 146 Ų | 146 | 97.5 Ų | 97.5 | 64% | 0.635 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -64.6 | -41.5 | 176 | -171.8 | 177.4 | -178.3 | -178 | 0 | 112.1 | K82 I83 R84 S89 N90 | K82-K86 VanDerWaalsContact O-CB 3.3Å; K82-K86 WeakPolarHBondContact O-CB 3.32Å; K82-K86 PolarHBondContact O-N 2.87Å; I83-K86 PolarHBondContact O-N 2.98Å; R84-K86 PolarHBondContact O-N 2.94Å; K86-S89 PolarHBondContact O-N 3.43Å; K86-N90 WeakPolarHBondContact O-CB 3.49Å; K86-N90 PolarHBondContact O-N 3.36Å; K86-N90 PolarHBondContact O-ND2 3.35Å |
| 87 | Q | 94.4 | Very high | 92.9 | Very high | 122 Ų | 122 | 101.2 Ų | 101.2 | 57% | 0.57 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.1 | -48.1 | 175.1 | -73.8 | 172.5 | -14.2 | 0 | 0 | 111.3 | I83 R84 N90 R91 | I83-Q87 HydrophobicContact CG2-CG 4.47Å; I83-Q87 WeakPolarHBondContact O-CG 3.32Å; I83-Q87 PolarHBondContact O-N 2.88Å; R84-Q87 PolarHBondContact O-N 3.48Å; Q87-N90 PolarHBondContact O-N 2.91Å; Q87-R91 PolarHBondContact O-N 3.39Å |
| 88 | S | 89 | Confident | 92.7 | Very high | 69 Ų | 69 | 102 Ų | 102 | 48% | 0.483 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.1 | -45.6 | 176.2 | -176 | 0 | 0 | 0 | 0 | 112 | R84 S85 N90 R91 I92 | R84-S88 WeakPolarHBondContact O-CB 3.47Å; R84-S88 PolarHBondContact O-N 2.71Å; S85-S88 PolarHBondContact O-N 2.94Å; S88-N90 VanDerWaalsContact C-N 3.33Å; S88-N90 PolarHBondContact O-N 3.31Å; S88-R91 PolarHBondContact O-N 3.44Å; S88-R91 VanDerWaalsContact O-N 3.14Å; S88-I92 WeakPolarHBondContact O-CG1 3.39Å; S88-I92 PolarHBondContact O-N 2.87Å |
| 89 | S | 91.9 | Very high | 92.4 | Very high | 57 Ų | 57 | 102.7 Ų | 102.7 | 40% | 0.399 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.9 | -39.3 | 176 | 175.9 | 0 | 0 | 0 | 0 | 113 | S85 K86 R93 | S85-S89 VanDerWaalsContact O-CB 3.31Å; S85-S89 WeakPolarHBondContact O-CB 3.45Å; S85-S89 PolarHBondContact O-N 3.47Å; K86-S89 PolarHBondContact O-N 3.43Å; S89-R93 WeakPolarHBondContact O-CB 3.47Å; S89-R93 PolarHBondContact O-N 3.45Å |
| 90 | N | 92.4 | Very high | 91.9 | Very high | 56 Ų | 56 | 101.6 Ų | 101.6 | 30% | 0.299 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65.6 | -43.2 | 174.3 | -72.4 | -14.8 | 0 | 0 | 0 | 111.1 | K86 Q87 S88 I92 R93 E94 | K86-N90 WeakPolarHBondContact O-CB 3.49Å; K86-N90 PolarHBondContact O-N 3.36Å; K86-N90 PolarHBondContact O-ND2 3.35Å; Q87-N90 PolarHBondContact O-N 2.91Å; S88-N90 VanDerWaalsContact C-N 3.33Å; S88-N90 PolarHBondContact O-N 3.31Å; N90-I92 PolarHBondContact O-N 3.3Å; N90-R93 WeakPolarHBondContact O-CB 3.41Å; N90-R93 PolarHBondContact O-N 2.86Å; N90-R93 VanDerWaalsContact O-N 3.16Å; N90-R93 PolarHBondContact OD1-NH2 3.36Å; N90-E94 WeakPolarHBondContact O-CG 3.47Å; N90-E94 PolarHBondContact O-N 2.9Å |
| 91 | R | 95.4 | Very high | 91.2 | Very high | 119 Ų | 119 | 100.1 Ų | 100.1 | 45% | 0.449 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.5 | -40.6 | 177.9 | -173.9 | 59.9 | -177.5 | 148.2 | 6.4 | 112.3 | Q87 S88 R93 E94 L95 E98 | Q87-R91 PolarHBondContact O-N 3.39Å; S88-R91 PolarHBondContact O-N 3.44Å; S88-R91 VanDerWaalsContact O-N 3.14Å; R91-R93 VanDerWaalsContact C-N 3.33Å; R91-R93 PolarHBondContact O-N 2.9Å; R91-E94 IonicContact NH1-OE2 2.69Å; R91-E94 PolarHBondContact NH1-OE2 3.48Å; R91-E94 VanDerWaalsContact NH1-OE2 3.16Å; R91-E94 PolarHBondContact O-N 3.44Å; R91-L95 HydrophobicContact CG-CD1 4.31Å; R91-L95 WeakPolarHBondContact O-CG 3.49Å; R91-L95 PolarHBondContact O-N 3.01Å; R91-E98 IonicContact NH1-OE1 3.59Å |
| 92 | I | 91.7 | Very high | 90.6 | Very high | 85 Ų | 85 | 98.1 Ų | 98.1 | 44% | 0.436 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.8 | -47.2 | 172.7 | -69.6 | 166.8 | 0 | 0 | 0 | 109.8 | S88 N90 E94 L95 E96 | S88-I92 WeakPolarHBondContact O-CG1 3.39Å; S88-I92 PolarHBondContact O-N 2.87Å; N90-I92 PolarHBondContact O-N 3.3Å; I92-E94 VanDerWaalsContact C-N 3.32Å; I92-E94 PolarHBondContact O-N 3.22Å; I92-L95 PolarHBondContact O-N 2.97Å; I92-E96 HydrophobicContact CG2-CG 4.24Å; I92-E96 WeakPolarHBondContact O-CB 3.49Å; I92-E96 VanDerWaalsContact O-CG 3.31Å; I92-E96 WeakPolarHBondContact O-CG 3.34Å; I92-E96 PolarHBondContact O-N 3.5Å |
| 93 | R | 92.9 | Very high | 89.8 | Confident | 115 Ų | 115 | 96.4 Ų | 96.4 | 43% | 0.434 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.9 | -34.8 | 179.6 | -160.8 | -173.6 | -44.4 | 140.1 | 21.8 | 113.3 | S89 N90 R91 K97 | S89-R93 WeakPolarHBondContact O-CB 3.47Å; S89-R93 PolarHBondContact O-N 3.45Å; N90-R93 WeakPolarHBondContact O-CB 3.41Å; N90-R93 PolarHBondContact O-N 2.86Å; N90-R93 VanDerWaalsContact O-N 3.16Å; N90-R93 PolarHBondContact OD1-NH2 3.36Å; R91-R93 VanDerWaalsContact C-N 3.33Å; R91-R93 PolarHBondContact O-N 2.9Å; R93-K97 VanDerWaalsContact O-CG 3.28Å; R93-K97 WeakPolarHBondContact O-CG 3.26Å; R93-K97 PolarHBondContact O-N 3.28Å; R93-K97 VanDerWaalsContact O-N 3.14Å |
| 94 | E | 93.4 | Very high | 88.4 | Confident | 94 Ų | 94 | 98 Ų | 98 | 44% | 0.439 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.7 | -49.1 | 172.6 | -73.5 | 165 | -166 | 0 | 0 | 110.9 | N90 R91 I92 E96 K97 E98 | N90-E94 WeakPolarHBondContact O-CG 3.47Å; N90-E94 PolarHBondContact O-N 2.9Å; R91-E94 IonicContact NH1-OE2 2.69Å; R91-E94 PolarHBondContact NH1-OE2 3.48Å; R91-E94 VanDerWaalsContact NH1-OE2 3.16Å; R91-E94 PolarHBondContact O-N 3.44Å; I92-E94 VanDerWaalsContact C-N 3.32Å; I92-E94 PolarHBondContact O-N 3.22Å; E94-E96 VanDerWaalsContact C-N 3.33Å; E94-E96 PolarHBondContact O-N 3.05Å; E94-K97 WeakPolarHBondContact O-CB 3.45Å; E94-K97 PolarHBondContact O-N 3.28Å; E94-K97 VanDerWaalsContact O-N 3.12Å; E94-E98 WeakPolarHBondContact O-CG 3.06Å; E94-E98 PolarHBondContact O-N 3.23Å |
| 95 | L | 90.4 | Very high | 86.7 | Confident | 79 Ų | 79 | 99.7 Ų | 99.7 | 41% | 0.414 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62 | -39.4 | 177.5 | -70.8 | 171.9 | 0 | 0 | 0 | 112.2 | R91 I92 K97 E98 L99 | R91-L95 HydrophobicContact CG-CD1 4.31Å; R91-L95 WeakPolarHBondContact O-CG 3.49Å; R91-L95 PolarHBondContact O-N 3.01Å; I92-L95 PolarHBondContact O-N 2.97Å; L95-K97 VanDerWaalsContact C-N 3.33Å; L95-K97 PolarHBondContact O-N 2.91Å; L95-E98 PolarHBondContact O-N 3.44Å; L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.43Å |
| 96 | E | 89.4 | Confident | 85 | Confident | 120 Ų | 120 | 101.4 Ų | 101.4 | 56% | 0.561 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.9 | -41.1 | 173.4 | -75.4 | 171.8 | 168.8 | 0 | 0 | 111.6 | I92 E94 L99 Q100 | I92-E96 HydrophobicContact CG2-CG 4.24Å; I92-E96 WeakPolarHBondContact O-CB 3.49Å; I92-E96 VanDerWaalsContact O-CG 3.31Å; I92-E96 WeakPolarHBondContact O-CG 3.34Å; I92-E96 PolarHBondContact O-N 3.5Å; E94-E96 VanDerWaalsContact C-N 3.33Å; E94-E96 PolarHBondContact O-N 3.05Å; E96-L99 PolarHBondContact O-N 3.28Å; E96-Q100 WeakPolarHBondContact O-CB 3.45Å; E96-Q100 PolarHBondContact O-N 3.44Å |
| 97 | K | 90.6 | Very high | 82.6 | Confident | 137 Ų | 137 | 100.2 Ų | 100.2 | 60% | 0.596 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.4 | -44.4 | 175.1 | -74.8 | 174 | 178 | -172.7 | 0 | 112.1 | R93 E94 L95 L99 Q100 C101 | R93-K97 VanDerWaalsContact O-CG 3.28Å; R93-K97 WeakPolarHBondContact O-CG 3.26Å; R93-K97 PolarHBondContact O-N 3.28Å; R93-K97 VanDerWaalsContact O-N 3.14Å; E94-K97 WeakPolarHBondContact O-CB 3.45Å; E94-K97 PolarHBondContact O-N 3.28Å; E94-K97 VanDerWaalsContact O-N 3.12Å; L95-K97 VanDerWaalsContact C-N 3.33Å; L95-K97 PolarHBondContact O-N 2.91Å; K97-L99 VanDerWaalsContact C-N 3.28Å; K97-L99 PolarHBondContact O-N 3.01Å; K97-Q100 PolarHBondContact O-N 3.42Å; K97-C101 WeakPolarHBondContact O-CB 3.49Å; K97-C101 PolarHBondContact O-N 3.36Å; K97-C101 PolarHBondContact O-SG 2.89Å; K97-C101 VanDerWaalsContact O-SG 3.36Å |
| 98 | E | 89.8 | Confident | 80.3 | Confident | 108 Ų | 108 | 100.3 Ų | 100.3 | 51% | 0.505 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -58.6 | -42.9 | 175.4 | -73.3 | 173.9 | -156.8 | 0 | 0 | 110.7 | R91 E94 L95 C101 A102 | R91-E98 IonicContact NH1-OE1 3.59Å; E94-E98 WeakPolarHBondContact O-CG 3.06Å; E94-E98 PolarHBondContact O-N 3.23Å; L95-E98 PolarHBondContact O-N 3.44Å; E98-C101 PolarHBondContact O-N 2.94Å; E98-A102 WeakPolarHBondContact O-CB 3.46Å; E98-A102 PolarHBondContact O-N 3.49Å |
| 99 | L | 87.5 | Confident | 77.9 | Confident | 109 Ų | 109 | 100.1 Ų | 100.1 | 57% | 0.571 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -67.2 | -41.3 | 178 | -159.5 | 154.7 | 0 | 0 | 0 | 111.6 | L95 E96 K97 A102 L103 | L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.49Å; L95-L99 PolarHBondContact O-N 3.43Å; E96-L99 PolarHBondContact O-N 3.28Å; K97-L99 VanDerWaalsContact C-N 3.28Å; K97-L99 PolarHBondContact O-N 3.01Å; L99-A102 PolarHBondContact O-N 2.9Å; L99-L103 HydrophobicContact CD2-CD1 3.99Å; L99-L103 PolarHBondContact O-N 3.25Å |
| 100 | Q | 84.1 | Confident | 75.2 | Confident | 106 Ų | 106 | 106.9 Ų | 106.9 | 50% | 0.495 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -61.9 | -46.5 | 174.6 | -169.1 | 69.7 | 17.7 | 0 | 0 | 111.6 | E96 K97 A102 L103 E104 | E96-Q100 WeakPolarHBondContact O-CB 3.45Å; E96-Q100 PolarHBondContact O-N 3.44Å; K97-Q100 PolarHBondContact O-N 3.42Å; Q100-A102 VanDerWaalsContact C-N 3.32Å; Q100-A102 PolarHBondContact O-N 2.84Å; Q100-L103 WeakPolarHBondContact O-CB 3.39Å; Q100-L103 PolarHBondContact O-N 2.95Å; Q100-E104 WeakPolarHBondContact O-CG 3.34Å; Q100-E104 PolarHBondContact O-N 2.96Å |
| 101 | C | 78.9 | Confident | 72.9 | Confident | 69 Ų | 69 | 113.6 Ų | 113.6 | 47% | 0.466 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.2 | -36.6 | 175.1 | -69.9 | 0 | 0 | 0 | 0 | 111.9 | K97 E98 N105 | K97-C101 WeakPolarHBondContact O-CB 3.49Å; K97-C101 PolarHBondContact O-N 3.36Å; K97-C101 PolarHBondContact O-SG 2.89Å; K97-C101 VanDerWaalsContact O-SG 3.36Å; E98-C101 PolarHBondContact O-N 2.94Å; C101-N105 PolarHBondContact O-N 3.16Å; C101-N105 PolarHBondContact O-ND2 3.33Å |
| 102 | A | 79.6 | Confident | 69.9 | Low | 53 Ų | 53 | 113.8 Ų | 113.8 | 44% | 0.438 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -66 | -38.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | E98 L99 Q100 N105 V106 | E98-A102 WeakPolarHBondContact O-CB 3.46Å; E98-A102 PolarHBondContact O-N 3.49Å; L99-A102 PolarHBondContact O-N 2.9Å; Q100-A102 VanDerWaalsContact C-N 3.32Å; Q100-A102 PolarHBondContact O-N 2.84Å; A102-N105 PolarHBondContact O-N 2.97Å; A102-V106 WeakPolarHBondContact O-CG2 3.35Å; A102-V106 PolarHBondContact O-N 3.24Å |
| 103 | L | 77.1 | Confident | 67.3 | Low | 107 Ų | 107 | 115.5 Ų | 115.5 | 56% | 0.56 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -64.9 | -42.3 | 175.7 | -123.6 | 82.6 | 0 | 0 | 0 | 112.3 | L99 Q100 N105 V106 | L99-L103 HydrophobicContact CD2-CD1 3.99Å; L99-L103 PolarHBondContact O-N 3.25Å; Q100-L103 WeakPolarHBondContact O-CB 3.39Å; Q100-L103 PolarHBondContact O-N 2.95Å; L103-N105 PolarHBondContact O-N 3.2Å; L103-V106 PolarHBondContact O-N 2.91Å; L103-V106 VanDerWaalsContact O-N 3.11Å |
| 104 | E | 66.9 | Low | 64.6 | Low | 128 Ų | 128 | 119.4 Ų | 119.4 | 60% | 0.598 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -63.7 | -30 | 177.2 | -74.6 | 171.8 | -177.2 | 0 | 0 | 112.3 | Q100 V106 | Q100-E104 WeakPolarHBondContact O-CG 3.34Å; Q100-E104 PolarHBondContact O-N 2.96Å; E104-V106 VanDerWaalsContact C-N 3.35Å |
| 105 | N | 59.3 | Low | 62.2 | Low | 140 Ų | 140 | 124.4 Ų | 124.4 | 75% | 0.749 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.4 | -8.4 | 175.6 | -70.5 | -47.5 | 0 | 0 | 0 | 114.2 | C101 A102 L103 | C101-N105 PolarHBondContact O-N 3.16Å; C101-N105 PolarHBondContact O-ND2 3.33Å; A102-N105 PolarHBondContact O-N 2.97Å; L103-N105 PolarHBondContact O-N 3.2Å |
| 106 | V | 54.9 | Low | 59.6 | Low | 111 Ų | 111 | 127.1 Ų | 127.1 | 67% | 0.673 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.3 | 15.8 | -177.4 | 176.6 | 0 | 0 | 0 | 0 | 112.4 | A102 L103 E104 P108 | A102-V106 WeakPolarHBondContact O-CG2 3.35Å; A102-V106 PolarHBondContact O-N 3.24Å; L103-V106 PolarHBondContact O-N 2.91Å; L103-V106 VanDerWaalsContact O-N 3.11Å; E104-V106 VanDerWaalsContact C-N 3.35Å; V106-P108 WeakPolarHBondContact O-CD 3.45Å |
| 107 | V | 44 | Very low | 57.2 | Low | 121 Ų | 121 | 128.7 Ų | 128.7 | 73% | 0.733 | 69% | 0.694 | S | S | * | * | trans | -99.5 | 84.7 | 169.5 | -172.7 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 108 | P | 47.5 | Very low | 54.3 | Low | 123 Ų | 123 | 128.6 Ų | 128.6 | 80% | 0.799 | 70% | 0.699 | S | S | * | * | trans | -88.2 | 110.4 | 163.4 | 33.3 | -29.1 | 0 | 0 | 0 | 109.6 | V106 | V106-P108 WeakPolarHBondContact O-CD 3.45Š| ||
| 109 | G | 38.8 | Very low | 51.8 | Low | 66 Ų | 66 | 132.3 Ų | 132.3 | 68% | 0.68 | 71% | 0.714 | S | S | * | * | trans | 131.4 | 98.2 | 150.5 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 110 | Q | 35.4 | Very low | 49.1 | Very low | 198 Ų | 198 | 132.2 Ų | 132.2 | 93% | 0.925 | 72% | 0.722 | S | S | * | * | -162.2 | 118.6 | 119.5 | -108.7 | 173.1 | 11.8 | 0 | 0 | 110.8 | |||||
| 111 | K | 43.2 | Very low | 46.5 | Very low | 198 Ų | 198 | 133 Ų | 133 | 86% | 0.861 | 74% | 0.74 | S | S | * | * | trans | -63 | 151.5 | 163.4 | -61 | 174.2 | 178.6 | 177.7 | 0 | 107.2 | ||||
| 112 | T | 33.4 | Very low | 44.4 | Very low | 122 Ų | 122 | 135.1 Ų | 135.1 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | -176.5 | 126.5 | 84 | -51.2 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 113 | T | 36.8 | Very low | 42.2 | Very low | 121 Ų | 121 | 141.9 Ų | 141.9 | 74% | 0.742 | 78% | 0.778 | S | S | * | * | trans | 32.7 | 127.3 | 151.9 | 47.4 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 114 | Q | 35.2 | Very low | 40.1 | Very low | 198 Ų | 198 | 143.5 Ų | 143.5 | 93% | 0.925 | 79% | 0.787 | S | S | * | * | -162.7 | 138.9 | 107.1 | -128.1 | 165.3 | -31 | 0 | 0 | 113.8 | |||||
| 115 | K | 44.1 | Very low | 38.6 | Very low | 199 Ų | 199 | 146 Ų | 146 | 87% | 0.865 | 80% | 0.798 | S | S | * | * | trans | -59.6 | 142.9 | 175.8 | -86.4 | 167.1 | 160 | 175.1 | 0 | 114 | ||||
| 116 | T | 34.8 | Very low | 37.8 | Very low | 135 Ų | 135 | 147.4 Ų | 147.4 | 83% | 0.828 | 80% | 0.8 | S | S | * | * | -173 | 103.2 | 128.6 | 35.5 | 0 | 0 | 0 | 0 | 106.9 | |||||
| 117 | L | 39.8 | Very low | 37.1 | Very low | 154 Ų | 154 | 152 Ų | 152 | 81% | 0.806 | 82% | 0.815 | S | S | * | * | 52.4 | 96.5 | 95 | -161.1 | 80.9 | 0 | 0 | 0 | 113.4 | |||||
| 118 | D | 29.8 | Very low | 37 | Very low | 134 Ų | 134 | 153.8 Ų | 153.8 | 72% | 0.717 | 82% | 0.815 | S | S | * | * | -176.9 | 124.2 | 112 | -99.8 | -33.6 | 0 | 0 | 0 | 114.6 | |||||
| 119 | K | 37.3 | Very low | 37 | Very low | 186 Ų | 186 | 154.7 Ų | 154.7 | 81% | 0.809 | 81% | 0.809 | S | S | * | * | trans | 45.4 | 120.4 | 142.1 | -97.3 | 162.6 | 172.7 | 171.6 | 0 | 123.8 | ||||
| 120 | S | 30.8 | Very low | 37.8 | Very low | 107 Ų | 107 | 155 Ų | 155 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | 75.5 | 95.5 | 135.6 | 63.1 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 121 | S | 29.6 | Very low | 39.6 | Very low | 124 Ų | 124 | 150.4 Ų | 150.4 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | -175.6 | 107.4 | 112.3 | 34.3 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 122 | S | 33.8 | Very low | 41.1 | Very low | 113 Ų | 113 | 145.8 Ų | 145.8 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | trans | -80 | 114.2 | 164 | 51.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 123 | E | 34.1 | Very low | 43.4 | Very low | 194 Ų | 194 | 143.1 Ų | 143.1 | 91% | 0.907 | 75% | 0.75 | S | S | * | * | -151.9 | 101.5 | 127.8 | -100.7 | 177.2 | -163.2 | 0 | 0 | 106.5 | |||||
| 124 | D | 33.5 | Very low | 45.7 | Very low | 142 Ų | 142 | 143.8 Ų | 143.8 | 76% | 0.759 | 74% | 0.742 | S | S | * | * | trans | -60.9 | 126.5 | 168.6 | -75.8 | -53.9 | 0 | 0 | 0 | 109.5 | ||||
| 125 | H | 35.5 | Very low | 48 | Very low | 180 Ų | 180 | 136.3 Ų | 136.3 | 83% | 0.833 | 71% | 0.712 | S | S | * | * | 178.2 | 145.2 | 112.4 | -93.3 | -66.7 | 0 | 0 | 0 | 110.6 | |||||
| 126 | E | 41.4 | Very low | 50.1 | Low | 169 Ų | 169 | 131.4 Ų | 131.4 | 79% | 0.79 | 69% | 0.694 | S | S | * | * | trans | 87.9 | 43.2 | 169.5 | -50.2 | -168.5 | 167.4 | 0 | 0 | 118.3 | Q128 | E126-Q128 PolarHBondContact O-N 3.37Š| ||
| 127 | Q | 39.5 | Very low | 52.8 | Low | 208 Ų | 208 | 131.4 Ų | 131.4 | 97% | 0.972 | 69% | 0.685 | S | S | * | * | trans | -73.4 | 58.6 | 144.7 | -78.1 | 166.6 | -20.9 | 0 | 0 | 110.6 | ||||
| 128 | Q | 42.3 | Very low | 55.2 | Low | 158 Ų | 158 | 131.1 Ų | 131.1 | 74% | 0.738 | 68% | 0.679 | S | S | * | * | trans | -151.3 | 62.6 | 160.5 | -167.4 | 151.8 | 9.6 | 0 | 0 | 106.5 | E126 N130 | E126-Q128 PolarHBondContact O-N 3.37Å; Q128-N130 PolarHBondContact O-N 3.5Å | ||
| 129 | E | 48.3 | Very low | 58.2 | Low | 143 Ų | 143 | 131 Ų | 131 | 67% | 0.668 | 67% | 0.673 | S | S | * | * | trans | -63.5 | 87.3 | 158.7 | -83.5 | -160.8 | 162.8 | 0 | 0 | 107.4 | ||||
| 130 | N | 55.6 | Low | 60.9 | Low | 72 Ų | 72 | 126.9 Ų | 126.9 | 39% | 0.385 | 66% | 0.659 | S | S | . | * | trans | -47.6 | 132.2 | -176.1 | -168 | -16.9 | 0 | 0 | 0 | 108.4 | Q128 L132 V133 | Q128-N130 PolarHBondContact O-N 3.5Å; N130-L132 HydrophobicContact CB-CB 4.27Å; N130-L132 CarbonylContact O-C 3.58Å; N130-L132 PolarHBondContact O-N 3.48Å; N130-L132 WeakPolarHBondContact OD1-CB 3.48Å; N130-L132 PolarHBondContact OD1-N 3.14Å; N130-V133 HydrophobicContact CB-CG2 4.28Å; N130-V133 PolarHBondContact O-N 3.12Å | ||
| 131 | P | 72.5 | Confident | 63.8 | Low | 101 Ų | 101 | 124.3 Ų | 124.3 | 66% | 0.656 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -48.3 | -24.4 | 173.1 | 18.9 | -33 | 0 | 0 | 0 | 112.7 | S135 | P131-S135 WeakPolarHBondContact O-CB 3.43Å; P131-S135 PolarHBondContact O-N 3.08Å |
| 132 | L | 74.7 | Confident | 66.9 | Low | 102 Ų | 102 | 120.8 Ų | 120.8 | 53% | 0.534 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -56.5 | -46.2 | 169.2 | -138.5 | 94.9 | 0 | 0 | 0 | 113.7 | N130 S135 L136 | N130-L132 HydrophobicContact CB-CB 4.27Å; N130-L132 CarbonylContact O-C 3.58Å; N130-L132 PolarHBondContact O-N 3.48Å; N130-L132 WeakPolarHBondContact OD1-CB 3.48Å; N130-L132 PolarHBondContact OD1-N 3.14Å; L132-S135 PolarHBondContact O-N 3.19Å; L132-S135 PolarHBondContact O-OG 2.93Å; L132-L136 HydrophobicContact CD2-CD1 4.3Å; L132-L136 WeakPolarHBondContact O-CB 3.46Å; L132-L136 VanDerWaalsContact O-CG 3.23Å; L132-L136 WeakPolarHBondContact O-CG 3.28Å; L132-L136 PolarHBondContact O-N 3.39Å |
| 133 | V | 82.1 | Confident | 69.6 | Low | 66 Ų | 66 | 119.3 Ų | 119.3 | 40% | 0.4 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -64.3 | -43.9 | -179.2 | 176.8 | 0 | 0 | 0 | 0 | 110.6 | N130 S135 L136 Q137 | N130-V133 HydrophobicContact CB-CG2 4.28Å; N130-V133 PolarHBondContact O-N 3.12Å; V133-S135 PolarHBondContact O-N 3.48Å; V133-L136 PolarHBondContact O-N 3.14Å; V133-Q137 WeakPolarHBondContact O-CB 3.35Å; V133-Q137 PolarHBondContact O-N 3.43Å |
| 134 | K | 84.2 | Confident | 72.3 | Confident | 135 Ų | 135 | 115.6 Ų | 115.6 | 59% | 0.587 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61.8 | -43.4 | 174 | -69.4 | -178.5 | -179.5 | 175.2 | 0 | 111.8 | L136 Q137 E138 | K134-L136 VanDerWaalsContact C-N 3.32Å; K134-L136 PolarHBondContact O-N 2.99Å; K134-Q137 PolarHBondContact O-N 2.81Å; K134-E138 WeakPolarHBondContact O-CB 3.45Å; K134-E138 PolarHBondContact O-N 3.39Å |
| 135 | S | 85.4 | Confident | 75.2 | Confident | 41 Ų | 41 | 113.4 Ų | 113.4 | 29% | 0.287 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.6 | -35.1 | 176.3 | 81.9 | 0 | 0 | 0 | 0 | 112.9 | P131 L132 V133 K139 | P131-S135 WeakPolarHBondContact O-CB 3.43Å; P131-S135 PolarHBondContact O-N 3.08Å; L132-S135 PolarHBondContact O-N 3.19Å; L132-S135 PolarHBondContact O-OG 2.93Å; V133-S135 PolarHBondContact O-N 3.48Å; S135-K139 WeakPolarHBondContact O-CB 3.29Å; S135-K139 VanDerWaalsContact O-CG 3.24Å; S135-K139 WeakPolarHBondContact O-CG 3.5Å; S135-K139 PolarHBondContact O-N 3.42Å |
| 136 | L | 87 | Confident | 78.1 | Confident | 96 Ų | 96 | 110.6 Ų | 110.6 | 50% | 0.503 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -72.1 | -38.1 | 176.7 | -73.1 | 171.8 | 0 | 0 | 0 | 111.1 | L132 V133 K134 K139 L140 | L132-L136 HydrophobicContact CD2-CD1 4.3Å; L132-L136 WeakPolarHBondContact O-CB 3.46Å; L132-L136 VanDerWaalsContact O-CG 3.23Å; L132-L136 WeakPolarHBondContact O-CG 3.28Å; L132-L136 PolarHBondContact O-N 3.39Å; V133-L136 PolarHBondContact O-N 3.14Å; K134-L136 VanDerWaalsContact C-N 3.32Å; K134-L136 PolarHBondContact O-N 2.99Å; L136-K139 PolarHBondContact O-N 3.41Å; L136-L140 WeakPolarHBondContact O-CB 3.43Å; L136-L140 PolarHBondContact O-N 3.35Å |
| 137 | Q | 90.9 | Very high | 80.6 | Confident | 135 Ų | 135 | 107 Ų | 107 | 63% | 0.631 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -68.5 | -38.2 | 176.1 | -170.1 | 154.2 | -1.5 | 0 | 0 | 112.2 | V133 K134 L140 A141 | V133-Q137 WeakPolarHBondContact O-CB 3.35Å; V133-Q137 PolarHBondContact O-N 3.43Å; K134-Q137 PolarHBondContact O-N 2.81Å; Q137-L140 PolarHBondContact O-N 2.96Å; Q137-A141 WeakPolarHBondContact O-CB 3.49Å; Q137-A141 PolarHBondContact O-N 2.73Å |
| 138 | E | 91.2 | Very high | 83.2 | Confident | 147 Ų | 147 | 100.5 Ų | 100.5 | 69% | 0.687 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67.2 | -41.7 | 172.7 | -169.4 | 172.8 | -163 | 0 | 0 | 111.8 | K134 L140 A141 A142 | K134-E138 WeakPolarHBondContact O-CB 3.45Å; K134-E138 PolarHBondContact O-N 3.39Å; E138-L140 VanDerWaalsContact C-N 3.33Å; E138-L140 PolarHBondContact O-N 2.84Å; E138-A141 PolarHBondContact O-N 3.31Å; E138-A142 WeakPolarHBondContact O-CB 3.29Å; E138-A142 PolarHBondContact O-N 2.87Å |
| 139 | K | 93.4 | Very high | 85.7 | Confident | 133 Ų | 133 | 97.5 Ų | 97.5 | 58% | 0.578 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.6 | -38.7 | 172.6 | -78 | 174.5 | -178.4 | 176.9 | 0 | 112.4 | S135 L136 T143 | S135-K139 WeakPolarHBondContact O-CB 3.29Å; S135-K139 VanDerWaalsContact O-CG 3.24Å; S135-K139 WeakPolarHBondContact O-CG 3.5Å; S135-K139 PolarHBondContact O-N 3.42Å; L136-K139 PolarHBondContact O-N 3.41Å; K139-T143 WeakPolarHBondContact O-CB 3.4Å; K139-T143 PolarHBondContact O-N 3.4Å; K139-T143 PolarHBondContact O-OG1 3.39Å |
| 140 | L | 92.5 | Very high | 88.1 | Confident | 99 Ų | 99 | 97.6 Ų | 97.6 | 52% | 0.518 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.6 | -48.1 | 175.3 | -178.9 | 66 | 0 | 0 | 0 | 110.5 | L136 Q137 E138 A142 T143 Q144 | L136-L140 WeakPolarHBondContact O-CB 3.43Å; L136-L140 PolarHBondContact O-N 3.35Å; Q137-L140 PolarHBondContact O-N 2.96Å; E138-L140 VanDerWaalsContact C-N 3.33Å; E138-L140 PolarHBondContact O-N 2.84Å; L140-A142 PolarHBondContact O-N 3.49Å; L140-T143 PolarHBondContact O-N 2.92Å; L140-Q144 WeakPolarHBondContact O-CB 3.24Å; L140-Q144 VanDerWaalsContact O-CG 3.32Å; L140-Q144 WeakPolarHBondContact O-CG 3.45Å; L140-Q144 PolarHBondContact O-N 2.93Å |
| 141 | A | 93.2 | Very high | 90 | Very high | 52 Ų | 52 | 101 Ų | 101 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q137 E138 T143 Q144 L145 | Q137-A141 WeakPolarHBondContact O-CB 3.49Å; Q137-A141 PolarHBondContact O-N 2.73Å; E138-A141 PolarHBondContact O-N 3.31Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.18Å; A141-Q144 PolarHBondContact O-N 3.24Å; A141-L145 WeakPolarHBondContact O-CB 3.42Å; A141-L145 PolarHBondContact O-N 2.91Å |
| 142 | A | 93.4 | Very high | 91.1 | Very high | 51 Ų | 51 | 100.2 Ų | 100.2 | 42% | 0.421 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.9 | -38.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | E138 L140 L145 K146 | E138-A142 WeakPolarHBondContact O-CB 3.29Å; E138-A142 PolarHBondContact O-N 2.87Å; L140-A142 PolarHBondContact O-N 3.49Å; A142-L145 PolarHBondContact O-N 2.93Å; A142-K146 WeakPolarHBondContact O-CG 3.37Å; A142-K146 PolarHBondContact O-N 3.3Å |
| 143 | T | 91.4 | Very high | 92.1 | Very high | 82 Ų | 82 | 100.9 Ų | 100.9 | 50% | 0.503 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -70.6 | -40.6 | 176.8 | -54.2 | 0 | 0 | 0 | 0 | 111.2 | K139 L140 A141 L145 K146 V147 | K139-T143 WeakPolarHBondContact O-CB 3.4Å; K139-T143 PolarHBondContact O-N 3.4Å; K139-T143 PolarHBondContact O-OG1 3.39Å; L140-T143 PolarHBondContact O-N 2.92Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.18Å; T143-L145 VanDerWaalsContact C-N 3.31Å; T143-L145 PolarHBondContact O-N 3.39Å; T143-K146 PolarHBondContact O-N 3.02Å; T143-V147 WeakPolarHBondContact O-CG2 3.38Å; T143-V147 PolarHBondContact O-N 3.16Å |
| 144 | Q | 89.4 | Confident | 92.7 | Very high | 115 Ų | 115 | 101.5 Ų | 101.5 | 54% | 0.537 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.2 | -41.3 | 173.8 | -75.5 | 174.6 | -8.7 | 0 | 0 | 111.6 | L140 A141 V147 T148 | L140-Q144 WeakPolarHBondContact O-CB 3.24Å; L140-Q144 VanDerWaalsContact O-CG 3.32Å; L140-Q144 WeakPolarHBondContact O-CG 3.45Å; L140-Q144 PolarHBondContact O-N 2.93Å; A141-Q144 PolarHBondContact O-N 3.24Å; Q144-V147 PolarHBondContact O-N 3.16Å; Q144-T148 WeakPolarHBondContact O-CG2 3.45Å; Q144-T148 PolarHBondContact O-N 3.28Å |
| 145 | L | 95.4 | Very high | 93.3 | Very high | 97 Ų | 97 | 99.8 Ų | 99.8 | 51% | 0.508 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65 | -41.6 | 175.2 | -170.9 | 140.7 | 0 | 0 | 0 | 111.9 | A141 A142 T143 V147 T148 E149 | A141-L145 WeakPolarHBondContact O-CB 3.42Å; A141-L145 PolarHBondContact O-N 2.91Å; A142-L145 PolarHBondContact O-N 2.93Å; T143-L145 VanDerWaalsContact C-N 3.31Å; T143-L145 PolarHBondContact O-N 3.39Å; L145-V147 VanDerWaalsContact C-N 3.33Å; L145-V147 PolarHBondContact O-N 3.39Å; L145-T148 PolarHBondContact O-N 2.99Å; L145-T148 PolarHBondContact O-OG1 3.44Å; L145-E149 HydrophobicContact CD2-CG 4.3Å; L145-E149 VanDerWaalsContact CD2-OE1 3.24Å; L145-E149 WeakPolarHBondContact CD2-OE1 3.34Å; L145-E149 WeakPolarHBondContact O-CG 3.43Å; L145-E149 PolarHBondContact O-N 2.95Å |
| 146 | K | 96.8 | Very high | 93.8 | Very high | 120 Ų | 120 | 100.7 Ų | 100.7 | 52% | 0.522 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.6 | -39.4 | 172.4 | -77.6 | -180 | 176.3 | -179.5 | 0 | 112.7 | A142 T143 T148 E149 Y150 | A142-K146 WeakPolarHBondContact O-CG 3.37Å; A142-K146 PolarHBondContact O-N 3.3Å; T143-K146 PolarHBondContact O-N 3.02Å; K146-T148 VanDerWaalsContact C-N 3.34Å; K146-T148 PolarHBondContact O-N 2.87Å; K146-E149 PolarHBondContact O-N 3.49Å; K146-Y150 HydrophobicContact CB-CD2 4.47Å; K146-Y150 HydrophobicContact CB-CE2 4.3Å; K146-Y150 WeakPolarHBondContact O-CD2 3.38Å; K146-Y150 PolarHBondContact O-N 3.34Å |
| 147 | V | 94.3 | Very high | 94.2 | Very high | 93 Ų | 93 | 98.8 Ų | 98.8 | 56% | 0.564 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.4 | -41.5 | 177.2 | 168.8 | 0 | 0 | 0 | 0 | 111 | T143 Q144 L145 R151 | T143-V147 WeakPolarHBondContact O-CG2 3.38Å; T143-V147 PolarHBondContact O-N 3.16Å; Q144-V147 PolarHBondContact O-N 3.16Å; L145-V147 VanDerWaalsContact C-N 3.33Å; L145-V147 PolarHBondContact O-N 3.39Å; V147-R151 WeakPolarHBondContact O-CB 3.45Å; V147-R151 PolarHBondContact O-N 3.47Å |
| 148 | T | 93.4 | Very high | 94.4 | Very high | 73 Ų | 73 | 98.8 Ų | 98.8 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.7 | -38.9 | 176.7 | 59.1 | 0 | 0 | 0 | 0 | 111.9 | Q144 L145 K146 R151 N152 | Q144-T148 WeakPolarHBondContact O-CG2 3.45Å; Q144-T148 PolarHBondContact O-N 3.28Å; L145-T148 PolarHBondContact O-N 2.99Å; L145-T148 PolarHBondContact O-OG1 3.44Å; K146-T148 VanDerWaalsContact C-N 3.34Å; K146-T148 PolarHBondContact O-N 2.87Å; T148-R151 WeakPolarHBondContact O-CB 3.35Å; T148-R151 PolarHBondContact O-N 3.16Å; T148-N152 PolarHBondContact O-N 3.07Å; T148-N152 PolarHBondContact O-ND2 3.14Å; T148-N152 PolarHBondContact O-OD1 3.39Å |
| 149 | E | 95.6 | Very high | 94.6 | Very high | 95 Ų | 95 | 97 Ų | 97 | 44% | 0.444 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.9 | -49.5 | 172.8 | -75.3 | 178 | 171.5 | 0 | 0 | 112.2 | L145 K146 R151 N152 Q153 | L145-E149 HydrophobicContact CD2-CG 4.3Å; L145-E149 VanDerWaalsContact CD2-OE1 3.24Å; L145-E149 WeakPolarHBondContact CD2-OE1 3.34Å; L145-E149 WeakPolarHBondContact O-CG 3.43Å; L145-E149 PolarHBondContact O-N 2.95Å; K146-E149 PolarHBondContact O-N 3.49Å; E149-R151 VanDerWaalsContact C-N 3.32Å; E149-R151 PolarHBondContact O-N 2.93Å; E149-N152 PolarHBondContact O-N 3.33Å; E149-N152 VanDerWaalsContact O-N 3.14Å; E149-Q153 WeakPolarHBondContact O-CG 3.44Å; E149-Q153 PolarHBondContact O-N 3.29Å |
| 150 | Y | 96.6 | Very high | 94.6 | Very high | 144 Ų | 144 | 96.4 Ų | 96.4 | 57% | 0.565 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62 | -39.4 | 176.7 | -74.7 | -54.9 | 0 | 0 | 0 | 112 | K146 N152 Q153 V154 | K146-Y150 HydrophobicContact CB-CD2 4.47Å; K146-Y150 HydrophobicContact CB-CE2 4.3Å; K146-Y150 WeakPolarHBondContact O-CD2 3.38Å; K146-Y150 PolarHBondContact O-N 3.34Å; Y150-N152 VanDerWaalsContact C-N 3.28Å; Y150-N152 PolarHBondContact O-N 3.33Å; Y150-Q153 PolarHBondContact O-N 3.48Å; Y150-V154 WeakPolarHBondContact O-CB 3.36Å; Y150-V154 VanDerWaalsContact O-CG2 3.29Å; Y150-V154 WeakPolarHBondContact O-CG2 3.43Å; Y150-V154 PolarHBondContact O-N 3.37Å |
| 151 | R | 96 | Very high | 94.7 | Very high | 145 Ų | 145 | 96.5 Ų | 96.5 | 55% | 0.547 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59 | -42.8 | 174.6 | -165 | -167.8 | 79 | 118.7 | 5.6 | 111.2 | V147 T148 E149 Q155 | V147-R151 WeakPolarHBondContact O-CB 3.45Å; V147-R151 PolarHBondContact O-N 3.47Å; T148-R151 WeakPolarHBondContact O-CB 3.35Å; T148-R151 PolarHBondContact O-N 3.16Å; E149-R151 VanDerWaalsContact C-N 3.32Å; E149-R151 PolarHBondContact O-N 2.93Å; R151-Q155 WeakPolarHBondContact O-CG 3.46Å; R151-Q155 PolarHBondContact O-N 2.8Å; R151-Q155 VanDerWaalsContact O-N 3.08Å |
| 152 | N | 95.3 | Very high | 94.6 | Very high | 84 Ų | 84 | 99.8 Ų | 99.8 | 45% | 0.449 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -69.5 | -41.1 | 178.9 | -66.1 | -13.2 | 0 | 0 | 0 | 111.7 | T148 E149 Y150 V154 Q155 S156 | T148-N152 PolarHBondContact O-N 3.07Å; T148-N152 PolarHBondContact O-ND2 3.14Å; T148-N152 PolarHBondContact O-OD1 3.39Å; E149-N152 PolarHBondContact O-N 3.33Å; E149-N152 VanDerWaalsContact O-N 3.14Å; Y150-N152 VanDerWaalsContact C-N 3.28Å; Y150-N152 PolarHBondContact O-N 3.33Å; N152-V154 PolarHBondContact O-N 3.43Å; N152-Q155 PolarHBondContact O-N 2.73Å; N152-S156 PolarHBondContact O-N 3.02Å |
| 153 | Q | 95.8 | Very high | 94.7 | Very high | 115 Ų | 115 | 100.8 Ų | 100.8 | 54% | 0.537 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 174.4 | -72.4 | 176.2 | 18.9 | 0 | 0 | 111.8 | E149 Y150 Q155 S156 A157 | E149-Q153 WeakPolarHBondContact O-CG 3.44Å; E149-Q153 PolarHBondContact O-N 3.29Å; Y150-Q153 PolarHBondContact O-N 3.48Å; Q153-Q155 VanDerWaalsContact C-N 3.29Å; Q153-Q155 PolarHBondContact O-N 3.12Å; Q153-S156 PolarHBondContact O-N 2.94Å; Q153-A157 WeakPolarHBondContact O-CB 3.42Å; Q153-A157 PolarHBondContact O-N 3.3Å |
| 154 | V | 96.3 | Very high | 94.6 | Very high | 79 Ų | 79 | 99.2 Ų | 99.2 | 48% | 0.479 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.7 | -36.9 | 176.4 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | Y150 N152 K158 | Y150-V154 WeakPolarHBondContact O-CB 3.36Å; Y150-V154 VanDerWaalsContact O-CG2 3.29Å; Y150-V154 WeakPolarHBondContact O-CG2 3.43Å; Y150-V154 PolarHBondContact O-N 3.37Å; N152-V154 PolarHBondContact O-N 3.43Å; V154-K158 HydrophobicContact CG1-CD 4.34Å; V154-K158 WeakPolarHBondContact O-CB 3.44Å; V154-K158 VanDerWaalsContact O-CG 3.29Å; V154-K158 WeakPolarHBondContact O-CG 3.41Å; V154-K158 PolarHBondContact O-N 2.91Å |
| 155 | Q | 96.8 | Very high | 94.4 | Very high | 99 Ų | 99 | 98 Ų | 98 | 46% | 0.463 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.8 | -42.6 | 174.9 | -74.1 | 178.7 | -1.5 | 0 | 0 | 112.2 | R151 N152 Q153 K158 Q159 | R151-Q155 WeakPolarHBondContact O-CG 3.46Å; R151-Q155 PolarHBondContact O-N 2.8Å; R151-Q155 VanDerWaalsContact O-N 3.08Å; N152-Q155 PolarHBondContact O-N 2.73Å; Q153-Q155 VanDerWaalsContact C-N 3.29Å; Q153-Q155 PolarHBondContact O-N 3.12Å; Q155-K158 PolarHBondContact O-N 3.5Å; Q155-Q159 PolarHBondContact O-N 3.24Å |
| 156 | S | 94.8 | Very high | 94 | Very high | 61 Ų | 61 | 100.7 Ų | 100.7 | 43% | 0.427 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.5 | -50.8 | 174.7 | -163.7 | 0 | 0 | 0 | 0 | 111.1 | N152 Q153 K158 Q159 E160 | N152-S156 PolarHBondContact O-N 3.02Å; Q153-S156 PolarHBondContact O-N 2.94Å; S156-K158 VanDerWaalsContact C-N 3.3Å; S156-K158 PolarHBondContact O-N 2.87Å; S156-Q159 CarbonylContact O-C 3.56Å; S156-Q159 WeakPolarHBondContact O-CA 3.31Å; S156-Q159 WeakPolarHBondContact O-CB 3.44Å; S156-Q159 PolarHBondContact O-N 3.16Å; S156-E160 WeakPolarHBondContact O-CG 3.4Å; S156-E160 PolarHBondContact O-N 2.9Å; S156-E160 PolarHBondContact OG-OE1 3.34Å |
| 157 | A | 94.7 | Very high | 93.5 | Very high | 55 Ų | 55 | 98.3 Ų | 98.3 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.9 | -38.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q153 Q159 L161 | Q153-A157 WeakPolarHBondContact O-CB 3.42Å; Q153-A157 PolarHBondContact O-N 3.3Å; A157-Q159 VanDerWaalsContact C-N 3.34Å; A157-Q159 PolarHBondContact O-N 3.39Å; A157-L161 VanDerWaalsContact O-CB 3.29Å; A157-L161 WeakPolarHBondContact O-CB 3.39Å; A157-L161 PolarHBondContact O-N 3.02Å |
| 158 | K | 96.6 | Very high | 93 | Very high | 136 Ų | 136 | 97.8 Ų | 97.8 | 59% | 0.591 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.1 | -37.4 | 173 | -79.6 | 179.6 | 179.3 | -176.7 | 0 | 112.5 | V154 Q155 S156 K162 | V154-K158 HydrophobicContact CG1-CD 4.34Å; V154-K158 WeakPolarHBondContact O-CB 3.44Å; V154-K158 VanDerWaalsContact O-CG 3.29Å; V154-K158 WeakPolarHBondContact O-CG 3.41Å; V154-K158 PolarHBondContact O-N 2.91Å; Q155-K158 PolarHBondContact O-N 3.5Å; S156-K158 VanDerWaalsContact C-N 3.3Å; S156-K158 PolarHBondContact O-N 2.87Å; K158-K162 WeakPolarHBondContact O-CG 3.36Å; K158-K162 PolarHBondContact O-N 3.41Å; K158-K162 VanDerWaalsContact O-N 3.14Å |
| 159 | Q | 95.1 | Very high | 92.4 | Very high | 108 Ų | 108 | 96.9 Ų | 96.9 | 51% | 0.505 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -71.5 | -44.3 | 177.6 | -177.7 | 61.1 | 15 | 0 | 0 | 111.5 | Q155 S156 A157 L161 K162 V163 | Q155-Q159 PolarHBondContact O-N 3.24Å; S156-Q159 CarbonylContact O-C 3.56Å; S156-Q159 WeakPolarHBondContact O-CA 3.31Å; S156-Q159 WeakPolarHBondContact O-CB 3.44Å; S156-Q159 PolarHBondContact O-N 3.16Å; A157-Q159 VanDerWaalsContact C-N 3.34Å; A157-Q159 PolarHBondContact O-N 3.39Å; Q159-L161 VanDerWaalsContact C-N 3.29Å; Q159-L161 PolarHBondContact O-N 3.05Å; Q159-K162 WeakPolarHBondContact O-CB 3.45Å; Q159-K162 PolarHBondContact O-N 3.07Å; Q159-K162 VanDerWaalsContact O-N 3.15Å; Q159-V163 WeakPolarHBondContact O-CG2 3.29Å; Q159-V163 PolarHBondContact O-N 3.26Å |
| 160 | E | 93.8 | Very high | 91.6 | Very high | 121 Ų | 121 | 95.4 Ų | 95.4 | 57% | 0.565 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -58.8 | -41.8 | 174 | -72.8 | 168 | -141.5 | 0 | 0 | 111.2 | S156 K162 V163 A164 | S156-E160 WeakPolarHBondContact O-CG 3.4Å; S156-E160 PolarHBondContact O-N 2.9Å; S156-E160 PolarHBondContact OG-OE1 3.34Å; E160-K162 PolarHBondContact O-N 3.38Å; E160-V163 PolarHBondContact O-N 3.16Å; E160-A164 WeakPolarHBondContact O-CB 3.45Å; E160-A164 PolarHBondContact O-N 3.01Å |
| 161 | L | 93.9 | Very high | 90.7 | Very high | 101 Ų | 101 | 94.1 Ų | 94.1 | 53% | 0.529 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 174.7 | -177.2 | 63.5 | 0 | 0 | 0 | 112.2 | A157 Q159 V163 A164 Q165 | A157-L161 VanDerWaalsContact O-CB 3.29Å; A157-L161 WeakPolarHBondContact O-CB 3.39Å; A157-L161 PolarHBondContact O-N 3.02Å; Q159-L161 VanDerWaalsContact C-N 3.29Å; Q159-L161 PolarHBondContact O-N 3.05Å; L161-V163 VanDerWaalsContact C-N 3.34Å; L161-A164 PolarHBondContact O-N 3.33Å; L161-Q165 VanDerWaalsContact O-CG 3.3Å; L161-Q165 WeakPolarHBondContact O-CG 3.39Å; L161-Q165 PolarHBondContact O-N 3.03Å |
| 162 | K | 92.2 | Very high | 89.6 | Confident | 121 Ų | 121 | 88 Ų | 88 | 53% | 0.526 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -64.1 | -39.1 | 175.1 | -74.5 | 176.2 | 179.9 | -177.4 | 0 | 112.1 | K158 Q159 E160 Q165 K166 | K158-K162 WeakPolarHBondContact O-CG 3.36Å; K158-K162 PolarHBondContact O-N 3.41Å; K158-K162 VanDerWaalsContact O-N 3.14Å; Q159-K162 WeakPolarHBondContact O-CB 3.45Å; Q159-K162 PolarHBondContact O-N 3.07Å; Q159-K162 VanDerWaalsContact O-N 3.15Å; E160-K162 PolarHBondContact O-N 3.38Å; K162-Q165 PolarHBondContact O-N 2.87Å; K162-K166 WeakPolarHBondContact O-CG 3.39Å; K162-K166 PolarHBondContact O-N 3.03Å |
| 163 | V | 93.7 | Very high | 88.4 | Confident | 73 Ų | 73 | 84.7 Ų | 84.7 | 44% | 0.442 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65.6 | -47.1 | 176.1 | 173.1 | 0 | 0 | 0 | 0 | 110.1 | Q159 E160 L161 Q165 K166 V167 | Q159-V163 WeakPolarHBondContact O-CG2 3.29Å; Q159-V163 PolarHBondContact O-N 3.26Å; E160-V163 PolarHBondContact O-N 3.16Å; L161-V163 VanDerWaalsContact C-N 3.34Å; V163-Q165 VanDerWaalsContact C-N 3.3Å; V163-Q165 PolarHBondContact O-N 2.9Å; V163-K166 WeakPolarHBondContact O-CB 3.38Å; V163-K166 PolarHBondContact O-N 2.85Å; V163-V167 HydrophobicContact CG1-CG2 4.45Å; V163-V167 WeakPolarHBondContact O-CG2 3.37Å; V163-V167 PolarHBondContact O-N 3.38Å |
| 164 | A | 89.3 | Confident | 87.1 | Confident | 48 Ų | 48 | 87.8 Ų | 87.8 | 40% | 0.397 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -57.5 | -43.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111.8 | E160 L161 K166 V167 L168 | E160-A164 WeakPolarHBondContact O-CB 3.45Å; E160-A164 PolarHBondContact O-N 3.01Å; L161-A164 PolarHBondContact O-N 3.33Å; A164-K166 VanDerWaalsContact C-N 3.35Å; A164-K166 PolarHBondContact O-N 2.91Å; A164-V167 PolarHBondContact O-N 3.1Å; A164-L168 VanDerWaalsContact O-CG 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.35Å; A164-L168 PolarHBondContact O-N 2.92Å |
| 165 | Q | 86.9 | Confident | 85.6 | Confident | 89 Ų | 89 | 93.1 Ų | 93.1 | 42% | 0.416 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60 | -41.7 | 173.8 | -74.7 | 174.3 | -9.4 | 0 | 0 | 112.5 | L161 K162 V163 L168 L169 L178 | L161-Q165 VanDerWaalsContact O-CG 3.3Å; L161-Q165 WeakPolarHBondContact O-CG 3.39Å; L161-Q165 PolarHBondContact O-N 3.03Å; K162-Q165 PolarHBondContact O-N 2.87Å; V163-Q165 VanDerWaalsContact C-N 3.3Å; V163-Q165 PolarHBondContact O-N 2.9Å; Q165-L168 PolarHBondContact O-N 3.25Å; Q165-L169 WeakPolarHBondContact O-CG 3.43Å; Q165-L169 PolarHBondContact O-N 3.08Å; Q165-L178 HydrophobicContact CB-CD1 4.11Å; Q165-L178 HydrophobicContact CG-CD1 4.22Å |
| 166 | K | 86.3 | Confident | 84 | Confident | 154 Ų | 154 | 90.4 Ų | 90.4 | 67% | 0.67 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -65.4 | -41.6 | 176 | -74.7 | -177.9 | 178.5 | -170.9 | 0 | 112.8 | K162 V163 A164 L169 S170 | K162-K166 WeakPolarHBondContact O-CG 3.39Å; K162-K166 PolarHBondContact O-N 3.03Å; V163-K166 WeakPolarHBondContact O-CB 3.38Å; V163-K166 PolarHBondContact O-N 2.85Å; A164-K166 VanDerWaalsContact C-N 3.35Å; A164-K166 PolarHBondContact O-N 2.91Å; K166-L169 PolarHBondContact O-N 3.46Å; K166-S170 PolarHBondContact O-N 3.19Å |
| 167 | V | 86.1 | Confident | 83 | Confident | 70 Ų | 70 | 91 Ų | 91 | 42% | 0.424 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.7 | -47.2 | 176.4 | 176.2 | 0 | 0 | 0 | 0 | 110 | V163 A164 L169 S170 E171 | V163-V167 HydrophobicContact CG1-CG2 4.45Å; V163-V167 WeakPolarHBondContact O-CG2 3.37Å; V163-V167 PolarHBondContact O-N 3.38Å; A164-V167 PolarHBondContact O-N 3.1Å; V167-L169 VanDerWaalsContact C-N 3.33Å; V167-L169 PolarHBondContact O-N 3.34Å; V167-S170 PolarHBondContact O-N 3.5Å; V167-S170 PolarHBondContact O-OG 3.08Å; V167-E171 PolarHBondContact O-N 3.04Å; V167-E171 VanDerWaalsContact O-N 3.07Å |
| 168 | L | 83 | Confident | 82 | Confident | 83 Ų | 83 | 90.4 Ų | 90.4 | 44% | 0.435 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -58.2 | -44.5 | 175.7 | -69.6 | 172.6 | 0 | 0 | 0 | 111.7 | A164 Q165 S170 E171 V172 L178 | A164-L168 VanDerWaalsContact O-CG 3.3Å; A164-L168 WeakPolarHBondContact O-CG 3.35Å; A164-L168 PolarHBondContact O-N 2.92Å; Q165-L168 PolarHBondContact O-N 3.25Å; L168-S170 VanDerWaalsContact C-N 3.29Å; L168-S170 PolarHBondContact O-N 2.95Å; L168-E171 PolarHBondContact O-N 2.96Å; L168-V172 WeakPolarHBondContact O-CB 3.33Å; L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.21Å; L168-L178 HydrophobicContact CB-CD2 4.08Å |
| 169 | L | 81.4 | Confident | 81 | Confident | 53 Ų | 53 | 90.6 Ų | 90.6 | 28% | 0.277 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -60.1 | -37.3 | 174.4 | -74.7 | 168.1 | 0 | 0 | 0 | 112.6 | Q165 K166 V167 E171 V172 G173 V176 L178 | Q165-L169 WeakPolarHBondContact O-CG 3.43Å; Q165-L169 PolarHBondContact O-N 3.08Å; K166-L169 PolarHBondContact O-N 3.46Å; V167-L169 VanDerWaalsContact C-N 3.33Å; V167-L169 PolarHBondContact O-N 3.34Å; L169-E171 VanDerWaalsContact C-N 3.33Å; L169-E171 PolarHBondContact O-N 2.88Å; L169-V172 PolarHBondContact O-N 3.29Å; L169-G173 CarbonylContact O-C 3.14Å; L169-G173 VanDerWaalsContact O-CA 3.31Å; L169-G173 WeakPolarHBondContact O-CA 3.46Å; L169-G173 PolarHBondContact O-N 3.15Å; L169-V176 WeakPolarHBondContact CD2-O 3.31Å; L169-L178 HydrophobicContact CD1-CD1 4.23Å; L169-L178 HydrophobicContact CD2-CD1 4.06Å; L169-L178 HydrophobicContact CD2-CG 3.94Å; L169-L178 HydrophobicContact CG-CD1 3.85Å; L169-L178 HydrophobicContact CG-CG 4.23Å |
| 170 | S | 79.1 | Confident | 79.8 | Confident | 64 Ų | 64 | 91.8 Ų | 91.8 | 45% | 0.448 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.7 | -32.3 | 177.3 | 73.5 | 0 | 0 | 0 | 0 | 113.3 | K166 V167 L168 | K166-S170 PolarHBondContact O-N 3.19Å; V167-S170 PolarHBondContact O-N 3.5Å; V167-S170 PolarHBondContact O-OG 3.08Å; L168-S170 VanDerWaalsContact C-N 3.29Å; L168-S170 PolarHBondContact O-N 2.95Å |
| 171 | E | 78.3 | Confident | 78.6 | Confident | 117 Ų | 117 | 88.1 Ų | 88.1 | 55% | 0.547 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -80.8 | -32.6 | 177.1 | -68.4 | -176 | 175.9 | 0 | 0 | 113.1 | V167 L168 L169 R191 | V167-E171 PolarHBondContact O-N 3.04Å; V167-E171 VanDerWaalsContact O-N 3.07Å; L168-E171 PolarHBondContact O-N 2.96Å; L169-E171 VanDerWaalsContact C-N 3.33Å; L169-E171 PolarHBondContact O-N 2.88Å; E171-R191 WeakPolarHBondContact O-CB 3.47Å; E171-R191 PolarHBondContact O-N 3.15Å |
| 172 | V | 72.8 | Confident | 77.6 | Confident | 18 Ų | 18 | 90.2 Ų | 90.2 | 11% | 0.109 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -86.6 | -29.2 | -178.2 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | L168 L169 V176 M181 F188 | L168-V172 WeakPolarHBondContact O-CB 3.33Å; L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.21Å; L169-V172 PolarHBondContact O-N 3.29Å; V172-V176 HydrophobicContact CG1-CB 3.5Å; V172-V176 VanDerWaalsContact CG1-CB 3.5Å; V172-V176 HydrophobicContact CG1-CG1 3.58Å; V172-V176 HydrophobicContact CG1-CG2 3.93Å; V172-M181 HydrophobicContact CG1-SD 3.56Å; V172-M181 VanDerWaalsContact CG1-SD 3.56Å; V172-M181 HydrophobicContact CG2-SD 4.1Å; V172-F188 HydrophobicContact CB-CE1 4.39Å; V172-F188 HydrophobicContact CB-CZ 3.88Å; V172-F188 HydrophobicContact CG1-CE1 4Å; V172-F188 HydrophobicContact CG1-CE2 3.6Å; V172-F188 HydrophobicContact CG1-CZ 3.21Å; V172-F188 HydrophobicContact CG2-CE1 4Å; V172-F188 HydrophobicContact CG2-CZ 4Å |
| 173 | G | 69.5 | Low | 76.8 | Confident | 13 Ų | 13 | 90.4 Ų | 90.4 | 13% | 0.134 | 47% | 0.468 | C | S | . | . | trans | 106.5 | 142.4 | -171.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L169 E175 V176 | L169-G173 CarbonylContact O-C 3.14Å; L169-G173 VanDerWaalsContact O-CA 3.31Å; L169-G173 WeakPolarHBondContact O-CA 3.46Å; L169-G173 PolarHBondContact O-N 3.15Å; G173-E175 PolarHBondContact O-N 3.48Å; G173-E175 VanDerWaalsContact O-N 3.11Å; G173-V176 PolarHBondContact O-N 3.29Å | ||
| 174 | E | 68.4 | Low | 75.5 | Confident | 180 Ų | 180 | 92.2 Ų | 92.2 | 84% | 0.841 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | -16.6 | -176.9 | -67.6 | 177.7 | -176.6 | 0 | 0 | 113.5 | ||
| 175 | E | 64.2 | Low | 74.3 | Confident | 191 Ų | 191 | 95 Ų | 95 | 89% | 0.893 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | 0.1 | -176.3 | -62.3 | -76 | 163.6 | 0 | 0 | 114.2 | G173 | G173-E175 PolarHBondContact O-N 3.48Å; G173-E175 VanDerWaalsContact O-N 3.11Å |
| 176 | V | 63.9 | Low | 73.3 | Confident | 42 Ų | 42 | 102.8 Ų | 102.8 | 26% | 0.255 | 52% | 0.515 | S | S | . | . | trans | -115.3 | 123.8 | -169.6 | -175.4 | 0 | 0 | 0 | 0 | 112.6 | L169 V172 G173 L178 M181 F188 | L169-V176 WeakPolarHBondContact CD2-O 3.31Å; V172-V176 HydrophobicContact CG1-CB 3.5Å; V172-V176 VanDerWaalsContact CG1-CB 3.5Å; V172-V176 HydrophobicContact CG1-CG1 3.58Å; V172-V176 HydrophobicContact CG1-CG2 3.93Å; G173-V176 PolarHBondContact O-N 3.29Å; V176-L178 PolarHBondContact O-N 3.41Å; V176-M181 HydrophobicContact CG1-CG 3.91Å; V176-M181 HydrophobicContact CG1-SD 4.01Å; V176-F188 HydrophobicContact CG1-CD2 4.36Å; V176-F188 HydrophobicContact CG1-CE2 3.92Å; V176-F188 HydrophobicContact CG2-CE2 4.18Å | ||
| 177 | N | 74 | Confident | 72.1 | Confident | 73 Ų | 73 | 100.4 Ų | 100.4 | 39% | 0.39 | 52% | 0.518 | S | S | . | . | trans | -76.5 | 113.9 | 177.7 | -173.5 | -23 | 0 | 0 | 0 | 111.8 | Q179 Q180 M181 | N177-Q179 PolarHBondContact O-N 2.9Å; N177-Q179 VanDerWaalsContact O-N 3.16Å; N177-Q179 WeakPolarHBondContact OD1-CB 3.3Å; N177-Q179 PolarHBondContact OD1-N 3.46Å; N177-Q180 HydrophobicContact CB-CB 4.41Å; N177-Q180 HydrophobicContact CB-CG 4.16Å; N177-Q180 PolarHBondContact O-N 3.49Å; N177-M181 PolarHBondContact O-N 3.25Å | ||
| 178 | L | 73.5 | Confident | 71.2 | Confident | 43 Ų | 43 | 99.9 Ų | 99.9 | 23% | 0.225 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -53.2 | -33.2 | 178.1 | -74.6 | 165 | 0 | 0 | 0 | 113.8 | Q165 L168 L169 V176 M181 L182 | Q165-L178 HydrophobicContact CB-CD1 4.11Å; Q165-L178 HydrophobicContact CG-CD1 4.22Å; L168-L178 HydrophobicContact CB-CD2 4.08Å; L169-L178 HydrophobicContact CD1-CD1 4.23Å; L169-L178 HydrophobicContact CD2-CD1 4.06Å; L169-L178 HydrophobicContact CD2-CG 3.94Å; L169-L178 HydrophobicContact CG-CD1 3.85Å; L169-L178 HydrophobicContact CG-CG 4.23Å; V176-L178 PolarHBondContact O-N 3.41Å; L178-M181 PolarHBondContact O-N 2.93Å; L178-L182 WeakPolarHBondContact O-CG 3.46Å; L178-L182 PolarHBondContact O-N 2.84Å; L178-L182 VanDerWaalsContact O-N 3.15Å |
| 179 | Q | 74.8 | Confident | 70.7 | Confident | 140 Ų | 140 | 102 Ų | 102 | 65% | 0.654 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -69.3 | -34.1 | 178.3 | -70.4 | 178.2 | -40.5 | 0 | 0 | 112.3 | N177 N183 | N177-Q179 PolarHBondContact O-N 2.9Å; N177-Q179 VanDerWaalsContact O-N 3.16Å; N177-Q179 WeakPolarHBondContact OD1-CB 3.3Å; N177-Q179 PolarHBondContact OD1-N 3.46Å; Q179-N183 VanDerWaalsContact O-CG 3.31Å; Q179-N183 PolarHBondContact O-N 3.28Å; Q179-N183 PolarHBondContact O-ND2 3.44Å |
| 180 | Q | 69.8 | Low | 70.5 | Confident | 133 Ų | 133 | 100.3 Ų | 100.3 | 62% | 0.621 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -72.8 | -32.5 | 177.6 | -68.4 | 176.7 | -20 | 0 | 0 | 111.6 | N177 N183 N184 | N177-Q180 HydrophobicContact CB-CB 4.41Å; N177-Q180 HydrophobicContact CB-CG 4.16Å; N177-Q180 PolarHBondContact O-N 3.49Å; Q180-N183 PolarHBondContact O-N 3.17Å; Q180-N184 PolarHBondContact O-N 3.15Å |
| 181 | M | 69.3 | Low | 70.6 | Confident | 45 Ų | 45 | 103.4 Ų | 103.4 | 22% | 0.222 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -67.2 | -41.6 | 173.2 | -82.4 | -157.9 | 60.7 | 0 | 0 | 113.6 | V172 V176 N177 L178 N183 N184 F188 | V172-M181 HydrophobicContact CG1-SD 3.56Å; V172-M181 VanDerWaalsContact CG1-SD 3.56Å; V172-M181 HydrophobicContact CG2-SD 4.1Å; V176-M181 HydrophobicContact CG1-CG 3.91Å; V176-M181 HydrophobicContact CG1-SD 4.01Å; N177-M181 PolarHBondContact O-N 3.25Å; L178-M181 PolarHBondContact O-N 2.93Å; M181-N183 PolarHBondContact O-N 3.32Å; M181-N184 CarbonylContact O-C 3.59Å; M181-N184 VanDerWaalsContact O-C 3.3Å; M181-N184 PolarHBondContact O-N 3.36Å; M181-F188 HydrophobicContact CE-CB 3.68Å; M181-F188 HydrophobicContact CE-CD1 3.09Å; M181-F188 HydrophobicContact CE-CD2 3.91Å; M181-F188 HydrophobicContact CE-CE1 3.64Å; M181-F188 HydrophobicContact CE-CE2 4.4Å; M181-F188 HydrophobicContact CE-CG 3.24Å; M181-F188 HydrophobicContact CE-CZ 4.3Å; M181-F188 HydrophobicContact CG-CD2 4.01Å; M181-F188 HydrophobicContact CG-CG 4.19Å; M181-F188 HydrophobicContact SD-CB 4.39Å; M181-F188 HydrophobicContact SD-CD1 3.72Å; M181-F188 HydrophobicContact SD-CD2 3.56Å; M181-F188 VanDerWaalsContact SD-CD2 3.56Å; M181-F188 HydrophobicContact SD-CE1 3.81Å; M181-F188 HydrophobicContact SD-CE2 3.72Å; M181-F188 HydrophobicContact SD-CG 3.58Å; M181-F188 VanDerWaalsContact SD-CG 3.58Å; M181-F188 HydrophobicContact SD-CZ 3.86Å |
| 182 | L | 72.4 | Confident | 70.8 | Confident | 144 Ų | 144 | 101.9 Ų | 101.9 | 75% | 0.754 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.1 | -33.7 | 176.2 | -73.5 | 170.1 | 0 | 0 | 0 | 111.6 | L178 | L178-L182 WeakPolarHBondContact O-CG 3.46Å; L178-L182 PolarHBondContact O-N 2.84Å; L178-L182 VanDerWaalsContact O-N 3.15Å |
| 183 | N | 76.5 | Confident | 71.3 | Confident | 126 Ų | 126 | 105.6 Ų | 105.6 | 67% | 0.674 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -79.5 | -23.7 | 179.5 | -66.8 | -16.5 | 0 | 0 | 0 | 113.3 | Q179 Q180 M181 | Q179-N183 VanDerWaalsContact O-CG 3.31Å; Q179-N183 PolarHBondContact O-N 3.28Å; Q179-N183 PolarHBondContact O-ND2 3.44Å; Q180-N183 PolarHBondContact O-N 3.17Å; M181-N183 PolarHBondContact O-N 3.32Å |
| 184 | N | 66.8 | Low | 72 | Confident | 111 Ų | 111 | 109.3 Ų | 109.3 | 59% | 0.594 | 54% | 0.541 | S | S | * | . | trans | -142.2 | 78.4 | -179.4 | -78.3 | -33.9 | 0 | 0 | 0 | 112.4 | Q180 M181 R186 | Q180-N184 PolarHBondContact O-N 3.15Å; M181-N184 CarbonylContact O-C 3.59Å; M181-N184 VanDerWaalsContact O-C 3.3Å; M181-N184 PolarHBondContact O-N 3.36Å; N184-R186 VanDerWaalsContact C-N 3.29Å; N184-R186 PolarHBondContact O-N 2.93Å | ||
| 185 | P | 62.8 | Low | 72.8 | Confident | 106 Ų | 106 | 104.1 Ų | 104.1 | 69% | 0.688 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.8 | -16.4 | -174 | 26.7 | -34.3 | 0 | 0 | 0 | 114.5 | ||
| 186 | R | 66.1 | Low | 74 | Confident | 252 Ų | 252 | 99.9 Ų | 99.9 | 95% | 0.951 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.8 | -20.9 | -168.3 | -157.8 | 175.5 | -169.4 | 160.3 | 3.2 | 114.7 | N184 | N184-R186 VanDerWaalsContact C-N 3.29Å; N184-R186 PolarHBondContact O-N 2.93Å |
| 187 | S | 62.3 | Low | 75.2 | Confident | 105 Ų | 105 | 99.7 Ų | 99.7 | 73% | 0.734 | 51% | 0.505 | S | S | * | . | S | Bend | trans | -98.6 | -4.7 | -176.5 | 55.8 | 0 | 0 | 0 | 0 | 113.7 | ||
| 188 | F | 67.3 | Low | 76.1 | Confident | 59 Ų | 59 | 101.7 Ų | 101.7 | 26% | 0.259 | 52% | 0.515 | S | S | . | . | trans | -86.8 | 129 | -174.1 | -176.4 | -98.7 | 0 | 0 | 0 | 112.3 | V172 V176 M181 G190 | V172-F188 HydrophobicContact CB-CE1 4.39Å; V172-F188 HydrophobicContact CB-CZ 3.88Å; V172-F188 HydrophobicContact CG1-CE1 4Å; V172-F188 HydrophobicContact CG1-CE2 3.6Å; V172-F188 HydrophobicContact CG1-CZ 3.21Å; V172-F188 HydrophobicContact CG2-CE1 4Å; V172-F188 HydrophobicContact CG2-CZ 4Å; V176-F188 HydrophobicContact CG1-CD2 4.36Å; V176-F188 HydrophobicContact CG1-CE2 3.92Å; V176-F188 HydrophobicContact CG2-CE2 4.18Å; M181-F188 HydrophobicContact CE-CB 3.68Å; M181-F188 HydrophobicContact CE-CD1 3.09Å; M181-F188 HydrophobicContact CE-CD2 3.91Å; M181-F188 HydrophobicContact CE-CE1 3.64Å; M181-F188 HydrophobicContact CE-CE2 4.4Å; M181-F188 HydrophobicContact CE-CG 3.24Å; M181-F188 HydrophobicContact CE-CZ 4.3Å; M181-F188 HydrophobicContact CG-CD2 4.01Å; M181-F188 HydrophobicContact CG-CG 4.19Å; M181-F188 HydrophobicContact SD-CB 4.39Å; M181-F188 HydrophobicContact SD-CD1 3.72Å; M181-F188 HydrophobicContact SD-CD2 3.56Å; M181-F188 VanDerWaalsContact SD-CD2 3.56Å; M181-F188 HydrophobicContact SD-CE1 3.81Å; M181-F188 HydrophobicContact SD-CE2 3.72Å; M181-F188 HydrophobicContact SD-CG 3.58Å; M181-F188 VanDerWaalsContact SD-CG 3.58Å; M181-F188 HydrophobicContact SD-CZ 3.86Å; F188-G190 VanDerWaalsContact CE1-CA 3.43Å | ||
| 189 | R | 72.2 | Confident | 77 | Confident | 128 Ų | 128 | 104.5 Ų | 104.5 | 48% | 0.483 | 53% | 0.527 | S | S | . | . | trans | -115.2 | 114.6 | 175.1 | -163.4 | 178.7 | -178.7 | 151.8 | 2.9 | 108.3 | Q193 Q194 | R189-Q193 HydrophobicContact CG-CB 4.01Å; R189-Q193 HydrophobicContact CG-CG 3.97Å; R189-Q193 VanDerWaalsContact CG-OE1 3.24Å; R189-Q194 HydrophobicContact CG-CG 4.45Å; R189-Q194 PolarHBondContact O-NE2 3.36Å | ||
| 190 | G | 76.8 | Confident | 77.9 | Confident | 17 Ų | 17 | 101 Ų | 101 | 18% | 0.175 | 52% | 0.515 | C | S | . | . | trans | -63.8 | 158.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | F188 S192 Q193 Q194 | F188-G190 VanDerWaalsContact CE1-CA 3.43Å; G190-S192 VanDerWaalsContact C-N 3.29Å; G190-S192 PolarHBondContact O-N 3.48Å; G190-Q193 WeakPolarHBondContact O-CB 3.42Å; G190-Q193 PolarHBondContact O-N 3.4Å; G190-Q194 WeakPolarHBondContact O-CG 3.42Å; G190-Q194 PolarHBondContact O-N 3.2Å | ||
| 191 | R | 81.8 | Confident | 79.1 | Confident | 128 Ų | 128 | 102.8 Ų | 102.8 | 48% | 0.483 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -56.9 | -41.5 | -178.2 | -173.7 | -177.7 | 176.2 | 167.4 | 3.2 | 112.2 | E171 Q193 Q194 I195 | E171-R191 WeakPolarHBondContact O-CB 3.47Å; E171-R191 PolarHBondContact O-N 3.15Å; R191-Q193 VanDerWaalsContact C-N 3.3Å; R191-Q193 PolarHBondContact O-N 3.42Å; R191-Q194 PolarHBondContact O-N 2.84Å; R191-I195 HydrophobicContact CG-CD1 3.89Å; R191-I195 HydrophobicContact CG-CG1 4.38Å; R191-I195 WeakPolarHBondContact O-CB 3.5Å; R191-I195 VanDerWaalsContact O-CG1 3.26Å; R191-I195 WeakPolarHBondContact O-CG1 3.45Å; R191-I195 PolarHBondContact O-N 2.97Å |
| 192 | S | 81.1 | Confident | 80.4 | Confident | 86 Ų | 86 | 104.1 Ų | 104.1 | 60% | 0.601 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -58.6 | -41.8 | 175.8 | 56.9 | 0 | 0 | 0 | 0 | 112 | G190 I195 L196 | G190-S192 VanDerWaalsContact C-N 3.29Å; G190-S192 PolarHBondContact O-N 3.48Å; S192-I195 PolarHBondContact O-N 3.14Å; S192-L196 WeakPolarHBondContact O-CB 3.46Å; S192-L196 VanDerWaalsContact O-CG 3.31Å; S192-L196 WeakPolarHBondContact O-CG 3.39Å; S192-L196 PolarHBondContact O-N 3.45Å |
| 193 | Q | 83.1 | Confident | 81.4 | Confident | 95 Ų | 95 | 105.2 Ų | 105.2 | 44% | 0.444 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -74.4 | -30.5 | 178.8 | -161.1 | -175.4 | 2.8 | 0 | 0 | 112.6 | R189 G190 R191 A197 | R189-Q193 HydrophobicContact CG-CB 4.01Å; R189-Q193 HydrophobicContact CG-CG 3.97Å; R189-Q193 VanDerWaalsContact CG-OE1 3.24Å; G190-Q193 WeakPolarHBondContact O-CB 3.42Å; G190-Q193 PolarHBondContact O-N 3.4Å; R191-Q193 VanDerWaalsContact C-N 3.3Å; R191-Q193 PolarHBondContact O-N 3.42Å; Q193-A197 WeakPolarHBondContact O-CB 3.38Å; Q193-A197 PolarHBondContact O-N 2.84Å |
| 194 | Q | 84.2 | Confident | 82.2 | Confident | 92 Ų | 92 | 103.7 Ų | 103.7 | 43% | 0.43 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.6 | -45.2 | 170.4 | -67 | 178.2 | 19.6 | 0 | 0 | 111.2 | R189 G190 R191 L196 A197 L198 | R189-Q194 HydrophobicContact CG-CG 4.45Å; R189-Q194 PolarHBondContact O-NE2 3.36Å; G190-Q194 WeakPolarHBondContact O-CG 3.42Å; G190-Q194 PolarHBondContact O-N 3.2Å; R191-Q194 PolarHBondContact O-N 2.84Å; Q194-L196 PolarHBondContact O-N 2.95Å; Q194-A197 PolarHBondContact O-N 2.99Å; Q194-L198 WeakPolarHBondContact O-CB 3.32Å; Q194-L198 WeakPolarHBondContact O-CG 3.22Å; Q194-L198 PolarHBondContact O-N 3.36Å |
| 195 | I | 86 | Confident | 83.5 | Confident | 71 Ų | 71 | 102.6 Ų | 102.6 | 36% | 0.364 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.5 | -47.8 | 175.2 | -70.7 | 167.5 | 0 | 0 | 0 | 110.2 | R191 S192 A197 L198 Q199 | R191-I195 HydrophobicContact CG-CD1 3.89Å; R191-I195 HydrophobicContact CG-CG1 4.38Å; R191-I195 WeakPolarHBondContact O-CB 3.5Å; R191-I195 VanDerWaalsContact O-CG1 3.26Å; R191-I195 WeakPolarHBondContact O-CG1 3.45Å; R191-I195 PolarHBondContact O-N 2.97Å; S192-I195 PolarHBondContact O-N 3.14Å; I195-A197 VanDerWaalsContact C-N 3.33Å; I195-A197 PolarHBondContact O-N 3.38Å; I195-L198 PolarHBondContact O-N 3.42Å; I195-Q199 HydrophobicContact CG2-CG 4.12Å; I195-Q199 WeakPolarHBondContact O-CB 3.46Å; I195-Q199 VanDerWaalsContact O-CG 3.26Å; I195-Q199 WeakPolarHBondContact O-CG 3.41Å; I195-Q199 PolarHBondContact O-N 2.95Å |
| 196 | L | 89.6 | Confident | 84.8 | Confident | 102 Ų | 102 | 103.3 Ų | 103.3 | 53% | 0.534 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.5 | -44 | 176.9 | -76.8 | 169.7 | 0 | 0 | 0 | 111.7 | S192 Q194 L198 Q199 T200 | S192-L196 WeakPolarHBondContact O-CB 3.46Å; S192-L196 VanDerWaalsContact O-CG 3.31Å; S192-L196 WeakPolarHBondContact O-CG 3.39Å; S192-L196 PolarHBondContact O-N 3.45Å; Q194-L196 PolarHBondContact O-N 2.95Å; L196-L198 VanDerWaalsContact C-N 3.35Å; L196-L198 PolarHBondContact O-N 3.17Å; L196-Q199 PolarHBondContact O-N 3.49Å; L196-T200 PolarHBondContact O-N 3.29Å; L196-T200 PolarHBondContact O-OG1 2.89Å; L196-T200 VanDerWaalsContact O-OG1 3.07Å |
| 197 | A | 90.1 | Very high | 85.9 | Confident | 38 Ų | 38 | 96.8 Ų | 96.8 | 31% | 0.314 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.1 | -42 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q193 Q194 I195 R201 | Q193-A197 WeakPolarHBondContact O-CB 3.38Å; Q193-A197 PolarHBondContact O-N 2.84Å; Q194-A197 PolarHBondContact O-N 2.99Å; I195-A197 VanDerWaalsContact C-N 3.33Å; I195-A197 PolarHBondContact O-N 3.38Å; A197-R201 WeakPolarHBondContact O-CB 3.28Å; A197-R201 PolarHBondContact O-N 3.25Å |
| 198 | L | 92.3 | Very high | 87.2 | Confident | 115 Ų | 115 | 97.6 Ų | 97.6 | 60% | 0.602 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -66.7 | -43 | 175.9 | -72.8 | 171.9 | 0 | 0 | 0 | 111.7 | Q194 I195 L196 T200 R201 V202 | Q194-L198 WeakPolarHBondContact O-CB 3.32Å; Q194-L198 WeakPolarHBondContact O-CG 3.22Å; Q194-L198 PolarHBondContact O-N 3.36Å; I195-L198 PolarHBondContact O-N 3.42Å; L196-L198 VanDerWaalsContact C-N 3.35Å; L196-L198 PolarHBondContact O-N 3.17Å; L198-T200 PolarHBondContact O-N 3.18Å; L198-R201 PolarHBondContact O-N 2.66Å; L198-V202 WeakPolarHBondContact O-CB 3.35Å; L198-V202 VanDerWaalsContact O-CG2 3.29Å; L198-V202 WeakPolarHBondContact O-CG2 3.44Å; L198-V202 PolarHBondContact O-N 3.03Å |
| 199 | Q | 92.9 | Very high | 88 | Confident | 102 Ų | 102 | 99.6 Ų | 99.6 | 48% | 0.477 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 176.5 | -76 | 175.6 | -17 | 0 | 0 | 111.9 | I195 L196 R201 V202 R203 | I195-Q199 HydrophobicContact CG2-CG 4.12Å; I195-Q199 WeakPolarHBondContact O-CB 3.46Å; I195-Q199 VanDerWaalsContact O-CG 3.26Å; I195-Q199 WeakPolarHBondContact O-CG 3.41Å; I195-Q199 PolarHBondContact O-N 2.95Å; L196-Q199 PolarHBondContact O-N 3.49Å; Q199-R201 VanDerWaalsContact C-N 3.33Å; Q199-V202 PolarHBondContact O-N 3.44Å; Q199-R203 WeakPolarHBondContact O-CB 3.44Å; Q199-R203 PolarHBondContact O-N 3.04Å |
| 200 | T | 93.6 | Very high | 88.2 | Confident | 67 Ų | 67 | 96.7 Ų | 96.7 | 41% | 0.411 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 174 | -62.3 | 0 | 0 | 0 | 0 | 110.7 | L196 L198 R203 E204 | L196-T200 PolarHBondContact O-N 3.29Å; L196-T200 PolarHBondContact O-OG1 2.89Å; L196-T200 VanDerWaalsContact O-OG1 3.07Å; L198-T200 PolarHBondContact O-N 3.18Å; T200-R203 WeakPolarHBondContact O-CB 3.45Å; T200-R203 PolarHBondContact O-N 2.97Å; T200-E204 WeakPolarHBondContact O-CG 3.46Å; T200-E204 PolarHBondContact O-N 2.89Å |
| 201 | R | 94.7 | Very high | 88 | Confident | 170 Ų | 170 | 101 Ų | 101 | 64% | 0.642 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -68.8 | -36.8 | -179.5 | -162.3 | 157.4 | -176.5 | 121.2 | -4.4 | 113.1 | A197 L198 Q199 E204 L205 | A197-R201 WeakPolarHBondContact O-CB 3.28Å; A197-R201 PolarHBondContact O-N 3.25Å; L198-R201 PolarHBondContact O-N 2.66Å; Q199-R201 VanDerWaalsContact C-N 3.33Å; R201-E204 PolarHBondContact O-N 3.1Å; R201-L205 HydrophobicContact CG-CD1 4.48Å; R201-L205 WeakPolarHBondContact O-CB 3.4Å; R201-L205 VanDerWaalsContact O-CG 3.24Å; R201-L205 WeakPolarHBondContact O-CG 3.26Å; R201-L205 PolarHBondContact O-N 3.07Å |
| 202 | V | 95.3 | Very high | 87.5 | Confident | 72 Ų | 72 | 101.3 Ų | 101.3 | 44% | 0.436 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.5 | -44.9 | 172.4 | 168.6 | 0 | 0 | 0 | 0 | 110.1 | L198 Q199 E204 L205 E206 | L198-V202 WeakPolarHBondContact O-CB 3.35Å; L198-V202 VanDerWaalsContact O-CG2 3.29Å; L198-V202 WeakPolarHBondContact O-CG2 3.44Å; L198-V202 PolarHBondContact O-N 3.03Å; Q199-V202 PolarHBondContact O-N 3.44Å; V202-E204 PolarHBondContact O-N 3.46Å; V202-L205 PolarHBondContact O-N 2.95Å; V202-E206 HydrophobicContact CG1-CG 4.22Å; V202-E206 WeakPolarHBondContact O-CB 3.29Å; V202-E206 VanDerWaalsContact O-CG 3.29Å; V202-E206 WeakPolarHBondContact O-CG 3.32Å; V202-E206 PolarHBondContact O-N 3.31Å |
| 203 | R | 94.4 | Very high | 86.6 | Confident | 168 Ų | 168 | 106.2 Ų | 106.2 | 63% | 0.634 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.9 | -41.7 | 177 | -169.5 | -174.7 | -57.8 | 170.2 | 3.3 | 112.3 | Q199 T200 E206 Q207 | Q199-R203 WeakPolarHBondContact O-CB 3.44Å; Q199-R203 PolarHBondContact O-N 3.04Å; T200-R203 WeakPolarHBondContact O-CB 3.45Å; T200-R203 PolarHBondContact O-N 2.97Å; R203-E206 PolarHBondContact O-N 2.85Å; R203-Q207 VanDerWaalsContact O-CB 3.31Å; R203-Q207 WeakPolarHBondContact O-CB 3.42Å; R203-Q207 PolarHBondContact O-N 3.47Å |
| 204 | E | 93.9 | Very high | 85.4 | Confident | 93 Ų | 93 | 107.9 Ų | 107.9 | 44% | 0.435 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.8 | -44 | 174.4 | -73.6 | 169 | -174.8 | 0 | 0 | 111.5 | T200 R201 V202 Q207 Q208 | T200-E204 WeakPolarHBondContact O-CG 3.46Å; T200-E204 PolarHBondContact O-N 2.89Å; R201-E204 PolarHBondContact O-N 3.1Å; V202-E204 PolarHBondContact O-N 3.46Å; E204-Q207 WeakPolarHBondContact O-CB 3.47Å; E204-Q207 PolarHBondContact O-N 3.19Å; E204-Q208 VanDerWaalsContact O-CG 3.29Å; E204-Q208 WeakPolarHBondContact O-CG 3.14Å; E204-Q208 PolarHBondContact O-N 3.46Å |
| 205 | L | 93.2 | Very high | 84 | Confident | 89 Ų | 89 | 106.7 Ų | 106.7 | 47% | 0.466 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -67 | -41.3 | 177.2 | -71.4 | 170 | 0 | 0 | 0 | 112.3 | R201 V202 Q207 Q208 L209 | R201-L205 HydrophobicContact CG-CD1 4.48Å; R201-L205 WeakPolarHBondContact O-CB 3.4Å; R201-L205 VanDerWaalsContact O-CG 3.24Å; R201-L205 WeakPolarHBondContact O-CG 3.26Å; R201-L205 PolarHBondContact O-N 3.07Å; V202-L205 PolarHBondContact O-N 2.95Å; L205-Q207 VanDerWaalsContact C-N 3.31Å; L205-Q207 PolarHBondContact O-N 2.95Å; L205-Q208 PolarHBondContact O-N 3.42Å; L205-L209 WeakPolarHBondContact O-CG 3.4Å; L205-L209 PolarHBondContact O-N 3.07Å |
| 206 | E | 90 | Very high | 82.3 | Confident | 120 Ų | 120 | 109 Ų | 109 | 56% | 0.561 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.8 | -41.9 | 173.3 | -75.5 | 173.9 | 167.5 | 0 | 0 | 111.1 | V202 R203 L209 C210 | V202-E206 HydrophobicContact CG1-CG 4.22Å; V202-E206 WeakPolarHBondContact O-CB 3.29Å; V202-E206 VanDerWaalsContact O-CG 3.29Å; V202-E206 WeakPolarHBondContact O-CG 3.32Å; V202-E206 PolarHBondContact O-N 3.31Å; R203-E206 PolarHBondContact O-N 2.85Å; E206-L209 PolarHBondContact O-N 2.93Å; E206-C210 WeakPolarHBondContact O-CB 3.3Å; E206-C210 PolarHBondContact O-N 3.37Å |
| 207 | Q | 89.8 | Confident | 80.4 | Confident | 115 Ų | 115 | 109.2 Ų | 109.2 | 54% | 0.537 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.9 | -46.7 | 174.6 | -172.3 | 174.8 | 8.3 | 0 | 0 | 110.5 | R203 E204 L205 L209 C210 H211 | R203-Q207 VanDerWaalsContact O-CB 3.31Å; R203-Q207 WeakPolarHBondContact O-CB 3.42Å; R203-Q207 PolarHBondContact O-N 3.47Å; E204-Q207 WeakPolarHBondContact O-CB 3.47Å; E204-Q207 PolarHBondContact O-N 3.19Å; L205-Q207 VanDerWaalsContact C-N 3.31Å; L205-Q207 PolarHBondContact O-N 2.95Å; Q207-L209 VanDerWaalsContact C-N 3.34Å; Q207-L209 PolarHBondContact O-N 3.45Å; Q207-C210 WeakPolarHBondContact O-CB 3.33Å; Q207-C210 PolarHBondContact O-N 3.5Å; Q207-H211 VanDerWaalsContact CG-CE1 3.45Å; Q207-H211 WeakPolarHBondContact CG-CE1 3.33Å; Q207-H211 PolarHBondContact O-N 3.47Å; Q207-H211 PolarHBondContact O-ND1 2.93Å |
| 208 | Q | 90.2 | Very high | 78.3 | Confident | 123 Ų | 123 | 116.1 Ų | 116.1 | 58% | 0.575 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -59.3 | -42.3 | 176.4 | -73.4 | 172.6 | 8.6 | 0 | 0 | 112.3 | E204 L205 C210 H211 Q212 | E204-Q208 VanDerWaalsContact O-CG 3.29Å; E204-Q208 WeakPolarHBondContact O-CG 3.14Å; E204-Q208 PolarHBondContact O-N 3.46Å; L205-Q208 PolarHBondContact O-N 3.42Å; Q208-C210 PolarHBondContact O-N 3.31Å; Q208-H211 PolarHBondContact O-N 3.32Å; Q208-Q212 WeakPolarHBondContact O-CB 3.49Å; Q208-Q212 PolarHBondContact O-N 3.26Å |
| 209 | L | 84 | Confident | 76.1 | Confident | 101 Ų | 101 | 115.3 Ų | 115.3 | 53% | 0.529 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66.1 | -35.3 | 175.7 | -73.2 | 172.3 | 0 | 0 | 0 | 112.8 | L205 E206 Q207 Q212 R213 | L205-L209 WeakPolarHBondContact O-CG 3.4Å; L205-L209 PolarHBondContact O-N 3.07Å; E206-L209 PolarHBondContact O-N 2.93Å; Q207-L209 VanDerWaalsContact C-N 3.34Å; Q207-L209 PolarHBondContact O-N 3.45Å; L209-Q212 PolarHBondContact O-N 2.94Å; L209-R213 WeakPolarHBondContact O-CB 3.22Å; L209-R213 PolarHBondContact O-N 2.95Å |
| 210 | C | 75.9 | Confident | 73.8 | Confident | 66 Ų | 66 | 115.2 Ų | 115.2 | 45% | 0.446 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -65 | -42.5 | 174.4 | -169.2 | 0 | 0 | 0 | 0 | 111.5 | E206 Q207 Q208 R213 Q214 | E206-C210 WeakPolarHBondContact O-CB 3.3Å; E206-C210 PolarHBondContact O-N 3.37Å; Q207-C210 WeakPolarHBondContact O-CB 3.33Å; Q207-C210 PolarHBondContact O-N 3.5Å; Q208-C210 PolarHBondContact O-N 3.31Å; C210-R213 PolarHBondContact O-N 3.2Å; C210-Q214 WeakPolarHBondContact O-CG 3.49Å; C210-Q214 PolarHBondContact O-N 3.01Å |
| 211 | H | 73.1 | Confident | 71.4 | Confident | 108 Ų | 108 | 121.4 Ų | 121.4 | 50% | 0.5 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -66.3 | -38.6 | 175.3 | -70.3 | 75.8 | 0 | 0 | 0 | 111.7 | Q207 Q208 Q214 A215 | Q207-H211 VanDerWaalsContact CG-CE1 3.45Å; Q207-H211 WeakPolarHBondContact CG-CE1 3.33Å; Q207-H211 PolarHBondContact O-N 3.47Å; Q207-H211 PolarHBondContact O-ND1 2.93Å; Q208-H211 PolarHBondContact O-N 3.32Å; H211-Q214 PolarHBondContact O-N 2.98Å; H211-A215 PolarHBondContact O-N 3.38Å |
| 212 | Q | 69.5 | Low | 69.1 | Low | 134 Ų | 134 | 121.1 Ų | 121.1 | 63% | 0.626 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -65.5 | -37.6 | 175.5 | -165.9 | 172.9 | 14.4 | 0 | 0 | 112.1 | Q208 L209 A215 D216 | Q208-Q212 WeakPolarHBondContact O-CB 3.49Å; Q208-Q212 PolarHBondContact O-N 3.26Å; L209-Q212 PolarHBondContact O-N 2.94Å; Q212-A215 PolarHBondContact O-N 3.05Å; Q212-D216 PolarHBondContact O-N 2.71Å; Q212-D216 VanDerWaalsContact O-N 3.13Å |
| 213 | R | 63.7 | Low | 66.2 | Low | 189 Ų | 189 | 124.3 Ų | 124.3 | 71% | 0.713 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -70.2 | -32 | 176.1 | -159.6 | -178.3 | -64.4 | -166.3 | 0 | 112.7 | L209 C210 V217 | L209-R213 WeakPolarHBondContact O-CB 3.22Å; L209-R213 PolarHBondContact O-N 2.95Å; C210-R213 PolarHBondContact O-N 3.2Å; R213-V217 VanDerWaalsContact O-CG2 3.25Å; R213-V217 WeakPolarHBondContact O-CG2 3.41Å; R213-V217 PolarHBondContact O-N 3.04Å |
| 214 | Q | 56.8 | Low | 63.3 | Low | 130 Ų | 130 | 125.4 Ų | 125.4 | 61% | 0.607 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -73.9 | -31 | 173.1 | -73.2 | -177.6 | -6 | 0 | 0 | 112.7 | C210 H211 | C210-Q214 WeakPolarHBondContact O-CG 3.49Å; C210-Q214 PolarHBondContact O-N 3.01Å; H211-Q214 PolarHBondContact O-N 2.98Å |
| 215 | A | 55.9 | Low | 61.2 | Low | 67 Ų | 67 | 126.8 Ų | 126.8 | 55% | 0.554 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -69.2 | -33.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | H211 Q212 | H211-A215 PolarHBondContact O-N 3.38Å; Q212-A215 PolarHBondContact O-N 3.05Å |
| 216 | D | 50.3 | Low | 58.4 | Low | 119 Ų | 119 | 125.7 Ų | 125.7 | 64% | 0.636 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -74.5 | -24.9 | 179.3 | -148.9 | 21.6 | 0 | 0 | 0 | 113 | Q212 Q218 S219 | Q212-D216 PolarHBondContact O-N 2.71Å; Q212-D216 VanDerWaalsContact O-N 3.13Å; D216-Q218 VanDerWaalsContact C-N 3.34Å; D216-Q218 PolarHBondContact O-N 3.32Å; D216-S219 PolarHBondContact O-N 2.86Å |
| 217 | V | 49.2 | Very low | 56.4 | Low | 107 Ų | 107 | 127.5 Ų | 127.5 | 65% | 0.648 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | -14.9 | 178.7 | 174 | 0 | 0 | 0 | 0 | 112.9 | R213 | R213-V217 VanDerWaalsContact O-CG2 3.25Å; R213-V217 WeakPolarHBondContact O-CG2 3.41Å; R213-V217 PolarHBondContact O-N 3.04Å |
| 218 | Q | 46.1 | Very low | 53.8 | Low | 184 Ų | 184 | 126.5 Ų | 126.5 | 86% | 0.86 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -4.6 | 172.7 | -80.9 | -177.8 | 0.3 | 0 | 0 | 114.1 | D216 | D216-Q218 VanDerWaalsContact C-N 3.34Å; D216-Q218 PolarHBondContact O-N 3.32Å |
| 219 | S | 46.3 | Very low | 51.4 | Low | 97 Ų | 97 | 125.6 Ų | 125.6 | 68% | 0.678 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -107.1 | -4.7 | -177 | -168.3 | 0 | 0 | 0 | 0 | 115 | D216 | D216-S219 PolarHBondContact O-N 2.86Š|
| 220 | V | 44.8 | Very low | 49.6 | Very low | 101 Ų | 101 | 128.9 Ų | 128.9 | 61% | 0.612 | 71% | 0.711 | S | S | * | * | trans | -135.4 | 62.8 | -173.6 | -167.7 | 0 | 0 | 0 | 0 | 111 | Q222 | V220-Q222 VanDerWaalsContact C-N 3.27Š| ||
| 221 | E | 42.1 | Very low | 48.3 | Very low | 197 Ų | 197 | 134 Ų | 134 | 92% | 0.921 | 73% | 0.728 | S | S | * | * | trans | -94.7 | 54.2 | 155.1 | -76.2 | -154.1 | 160.5 | 0 | 0 | 110 | ||||
| 222 | Q | 46.7 | Very low | 47.4 | Very low | 163 Ų | 163 | 135.1 Ų | 135.1 | 76% | 0.762 | 73% | 0.732 | S | S | * | * | trans | -160 | 84.1 | 165.9 | -153.9 | 161 | 11.1 | 0 | 0 | 108.3 | V220 | V220-Q222 VanDerWaalsContact C-N 3.27Š| ||
| 223 | D | 35.2 | Very low | 46.6 | Very low | 139 Ų | 139 | 132.2 Ų | 132.2 | 74% | 0.743 | 73% | 0.725 | S | S | * | * | trans | 173.1 | 120.8 | 131.7 | -84 | -21.2 | 0 | 0 | 0 | 113.2 | ||||
| 224 | F | 32.5 | Very low | 46.4 | Very low | 192 Ų | 192 | 128.1 Ų | 128.1 | 84% | 0.842 | 72% | 0.722 | S | S | * | * | trans | 69.3 | 107.8 | 138.4 | -102.1 | -103.2 | 0 | 0 | 0 | 121.2 | ||||
| 225 | S | 49.8 | Very low | 46.5 | Very low | 122 Ų | 122 | 125 Ų | 125 | 85% | 0.853 | 72% | 0.718 | S | S | * | * | trans | -45.5 | 128.9 | 149.3 | -45.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 226 | G | 35.5 | Very low | 46.9 | Very low | 65 Ų | 65 | 126.4 Ų | 126.4 | 67% | 0.67 | 71% | 0.714 | S | S | * | * | trans | -163.6 | 104.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | A228 | G226-A228 PolarHBondContact O-N 2.86Š| ||
| 227 | T | 46.3 | Very low | 47.8 | Very low | 158 Ų | 158 | 125.1 Ų | 125.1 | 97% | 0.969 | 71% | 0.707 | S | S | * | * | trans | -46.1 | 97.3 | 165.5 | 12 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 228 | A | 35.1 | Very low | 49 | Very low | 95 Ų | 95 | 129.3 Ų | 129.3 | 79% | 0.785 | 71% | 0.711 | S | S | * | * | trans | -98 | 102.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110 | G226 H230 | G226-A228 PolarHBondContact O-N 2.86Å; A228-H230 PolarHBondContact O-N 3.34Å | ||
| 229 | S | 40.2 | Very low | 50.8 | Low | 103 Ų | 103 | 125.2 Ų | 125.2 | 72% | 0.72 | 70% | 0.695 | S | S | * | * | trans | -41.1 | 131.5 | 161.8 | -178.4 | 0 | 0 | 0 | 0 | 111.6 | H231 | S229-H231 VanDerWaalsContact C-N 3.32Å; S229-H231 PolarHBondContact O-N 3.43Å | ||
| 230 | H | 46.8 | Very low | 52.7 | Low | 170 Ų | 170 | 124.3 Ų | 124.3 | 79% | 0.787 | 68% | 0.682 | S | S | * | * | trans | -61.3 | 82.9 | 175.5 | -87.6 | -65 | 0 | 0 | 0 | 112.2 | A228 K232 | A228-H230 PolarHBondContact O-N 3.34Å; H230-K232 PolarHBondContact O-N 2.79Å | ||
| 231 | H | 49.1 | Very low | 54.7 | Low | 174 Ų | 174 | 123 Ų | 123 | 81% | 0.806 | 67% | 0.671 | S | S | * | * | trans | -90.5 | 86.9 | 153.6 | -93.3 | -69.5 | 0 | 0 | 0 | 108.9 | S229 | S229-H231 VanDerWaalsContact C-N 3.32Å; S229-H231 PolarHBondContact O-N 3.43Å | ||
| 232 | K | 53 | Low | 57.1 | Low | 132 Ų | 132 | 121 Ų | 121 | 57% | 0.574 | 66% | 0.657 | S | S | * | * | trans | -63 | 132.2 | 161.6 | -73.4 | -180 | 179.5 | 175.3 | 0 | 107.9 | H230 | H230-K232 PolarHBondContact O-N 2.79Š| ||
| 233 | P | 52.7 | Low | 59.2 | Low | 73 Ų | 73 | 117.1 Ų | 117.1 | 47% | 0.474 | 64% | 0.64 | S | S | . | * | trans | -59.9 | 143.5 | -179.2 | 21.2 | -29.9 | 0 | 0 | 0 | 110.7 | A235 Q236 | P233-A235 PolarHBondContact O-N 3.46Å; P233-Q236 HydrophobicContact CG-CB 4.33Å; P233-Q236 WeakPolarHBondContact O-CB 3.47Å; P233-Q236 PolarHBondContact O-N 3.42Å | ||
| 234 | P | 60.2 | Low | 62 | Low | 103 Ų | 103 | 117.6 Ų | 117.6 | 67% | 0.669 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -58 | -21.7 | -175.4 | 18.7 | -30 | 0 | 0 | 0 | 114 | R238 | P234-R238 PolarHBondContact O-N 3.29Å |
| 235 | A | 59.3 | Low | 65 | Low | 63 Ų | 63 | 111.8 Ų | 111.8 | 52% | 0.521 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -66.5 | -34.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | P233 R238 N239 | P233-A235 PolarHBondContact O-N 3.46Å; A235-R238 PolarHBondContact O-N 2.93Å; A235-N239 PolarHBondContact O-N 3.29Å; A235-N239 PolarHBondContact O-ND2 3.38Å |
| 236 | Q | 64.9 | Low | 67.2 | Low | 98 Ų | 98 | 108.2 Ų | 108.2 | 46% | 0.458 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -73.9 | -32.6 | -177 | -141.7 | 172.9 | 12.7 | 0 | 0 | 111.9 | P233 L240 | P233-Q236 HydrophobicContact CG-CB 4.33Å; P233-Q236 WeakPolarHBondContact O-CB 3.47Å; P233-Q236 PolarHBondContact O-N 3.42Å; Q236-L240 WeakPolarHBondContact O-CG 3.31Å; Q236-L240 PolarHBondContact O-N 2.95Å |
| 237 | N | 67.1 | Low | 69.9 | Low | 92 Ų | 92 | 110 Ų | 110 | 49% | 0.492 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -71 | -37.2 | 174.9 | -163 | -17.1 | 0 | 0 | 0 | 111.7 | L240 N241 | N237-L240 PolarHBondContact O-N 3.34Å; N237-N241 PolarHBondContact O-N 3.19Å; N237-N241 PolarHBondContact O-ND2 2.88Å; N237-N241 PolarHBondContact OD1-ND2 3.48Å |
| 238 | R | 76.1 | Confident | 72.3 | Confident | 194 Ų | 194 | 108.1 Ų | 108.1 | 73% | 0.732 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.7 | -43.5 | 173.4 | -71.6 | 179.9 | -179.9 | 178.6 | 0.4 | 112.3 | P234 A235 N241 Y242 | P234-R238 PolarHBondContact O-N 3.29Å; A235-R238 PolarHBondContact O-N 2.93Å; R238-N241 PolarHBondContact O-N 3.36Å; R238-Y242 WeakPolarHBondContact O-CB 3.28Å; R238-Y242 PolarHBondContact O-N 3.26Å |
| 239 | N | 83.5 | Confident | 75.2 | Confident | 99 Ų | 99 | 108.9 Ų | 108.9 | 53% | 0.529 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.2 | -41.4 | 176.5 | -71.7 | -34 | 0 | 0 | 0 | 112.3 | A235 Y242 I243 | A235-N239 PolarHBondContact O-N 3.29Å; A235-N239 PolarHBondContact O-ND2 3.38Å; N239-Y242 PolarHBondContact O-N 2.84Å; N239-I243 VanDerWaalsContact O-CG1 3.25Å; N239-I243 WeakPolarHBondContact O-CG1 3.29Å; N239-I243 PolarHBondContact O-N 2.94Å |
| 240 | L | 86.9 | Confident | 77.9 | Confident | 77 Ų | 77 | 110.9 Ų | 110.9 | 40% | 0.403 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.3 | -40.7 | 177.6 | -72.4 | 171.9 | 0 | 0 | 0 | 112.7 | Q236 N237 I243 R244 | Q236-L240 WeakPolarHBondContact O-CG 3.31Å; Q236-L240 PolarHBondContact O-N 2.95Å; N237-L240 PolarHBondContact O-N 3.34Å; L240-I243 PolarHBondContact O-N 3.44Å; L240-R244 WeakPolarHBondContact O-CG 3.46Å; L240-R244 PolarHBondContact O-N 3.44Å |
| 241 | N | 86.4 | Confident | 80.2 | Confident | 73 Ų | 73 | 109.8 Ų | 109.8 | 39% | 0.39 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.9 | -39.6 | 176.2 | -68.3 | -26.6 | 0 | 0 | 0 | 111.5 | N237 R238 R244 T245 | N237-N241 PolarHBondContact O-N 3.19Å; N237-N241 PolarHBondContact O-ND2 2.88Å; N237-N241 PolarHBondContact OD1-ND2 3.48Å; R238-N241 PolarHBondContact O-N 3.36Å; N241-R244 PolarHBondContact O-N 3.24Å; N241-T245 PolarHBondContact O-N 3.41Å; N241-T245 PolarHBondContact O-OG1 2.8Å |
| 242 | Y | 92.7 | Very high | 82.5 | Confident | 157 Ų | 157 | 105.4 Ų | 105.4 | 62% | 0.616 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.5 | -43.4 | 174.6 | -178.5 | -114.4 | 0 | 0 | 0 | 112.4 | R238 N239 T245 I246 | R238-Y242 WeakPolarHBondContact O-CB 3.28Å; R238-Y242 PolarHBondContact O-N 3.26Å; N239-Y242 PolarHBondContact O-N 2.84Å; Y242-T245 PolarHBondContact O-N 2.94Å; Y242-I246 HydrophobicContact CD1-CD1 3.74Å; Y242-I246 HydrophobicContact CD2-CD1 4.4Å; Y242-I246 HydrophobicContact CE1-CD1 3.26Å; Y242-I246 HydrophobicContact CE1-CG1 4.39Å; Y242-I246 HydrophobicContact CE2-CD1 3.98Å; Y242-I246 HydrophobicContact CE2-CG1 4.32Å; Y242-I246 HydrophobicContact CG-CD1 4.29Å; Y242-I246 WeakPolarHBondContact O-CG1 3.39Å; Y242-I246 PolarHBondContact O-N 3.31Å |
| 243 | I | 90.3 | Very high | 84.5 | Confident | 81 Ų | 81 | 100.6 Ų | 100.6 | 42% | 0.415 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.7 | -47 | 175.1 | -69 | 164.5 | 0 | 0 | 0 | 110.8 | N239 L240 T245 I246 E247 | N239-I243 VanDerWaalsContact O-CG1 3.25Å; N239-I243 WeakPolarHBondContact O-CG1 3.29Å; N239-I243 PolarHBondContact O-N 2.94Å; L240-I243 PolarHBondContact O-N 3.44Å; I243-T245 VanDerWaalsContact C-N 3.3Å; I243-T245 PolarHBondContact O-N 3.02Å; I243-I246 PolarHBondContact O-N 2.97Å; I243-E247 HydrophobicContact CG2-CG 4.33Å; I243-E247 WeakPolarHBondContact O-CG 3.47Å; I243-E247 PolarHBondContact O-N 3.3Å |
| 244 | R | 94.6 | Very high | 86.5 | Confident | 149 Ų | 149 | 103.8 Ų | 103.8 | 56% | 0.562 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.1 | -38.3 | 177.1 | -73.2 | -174.4 | -139.6 | 152.5 | 5.9 | 112.6 | L240 N241 E247 K248 | L240-R244 WeakPolarHBondContact O-CG 3.46Å; L240-R244 PolarHBondContact O-N 3.44Å; N241-R244 PolarHBondContact O-N 3.24Å; R244-E247 PolarHBondContact O-N 2.94Å; R244-K248 VanDerWaalsContact O-CB 3.32Å; R244-K248 WeakPolarHBondContact O-CB 3.33Å; R244-K248 PolarHBondContact O-N 3.09Å |
| 245 | T | 95 | Very high | 88.2 | Confident | 70 Ų | 70 | 104.2 Ų | 104.2 | 43% | 0.429 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.6 | -47.5 | 175.6 | -57.6 | 0 | 0 | 0 | 0 | 110.8 | N241 Y242 I243 E247 K248 E249 | N241-T245 PolarHBondContact O-N 3.41Å; N241-T245 PolarHBondContact O-OG1 2.8Å; Y242-T245 PolarHBondContact O-N 2.94Å; I243-T245 VanDerWaalsContact C-N 3.3Å; I243-T245 PolarHBondContact O-N 3.02Å; T245-E247 VanDerWaalsContact C-N 3.34Å; T245-E247 PolarHBondContact O-N 3.4Å; T245-K248 PolarHBondContact O-N 3.37Å; T245-E249 HydrophobicContact CG2-CG 4.44Å; T245-E249 WeakPolarHBondContact CG2-OE1 3.36Å; T245-E249 WeakPolarHBondContact O-CB 3.35Å; T245-E249 WeakPolarHBondContact O-CG 3.39Å; T245-E249 PolarHBondContact O-N 3.11Å |
| 246 | I | 95 | Very high | 90 | Very high | 47 Ų | 47 | 108.8 Ų | 108.8 | 24% | 0.241 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -61 | -42.3 | 176.2 | -68.9 | 166.2 | 0 | 0 | 0 | 111.4 | Y242 I243 K248 E249 K250 | Y242-I246 HydrophobicContact CD1-CD1 3.74Å; Y242-I246 HydrophobicContact CD2-CD1 4.4Å; Y242-I246 HydrophobicContact CE1-CD1 3.26Å; Y242-I246 HydrophobicContact CE1-CG1 4.39Å; Y242-I246 HydrophobicContact CE2-CD1 3.98Å; Y242-I246 HydrophobicContact CE2-CG1 4.32Å; Y242-I246 HydrophobicContact CG-CD1 4.29Å; Y242-I246 WeakPolarHBondContact O-CG1 3.39Å; Y242-I246 PolarHBondContact O-N 3.31Å; I243-I246 PolarHBondContact O-N 2.97Å; I246-K248 VanDerWaalsContact C-N 3.34Å; I246-E249 PolarHBondContact O-N 2.92Å; I246-K250 HydrophobicContact CG2-CD 4.01Å; I246-K250 HydrophobicContact CG2-CG 4.28Å; I246-K250 WeakPolarHBondContact O-CB 3.34Å; I246-K250 VanDerWaalsContact O-CG 3.28Å; I246-K250 WeakPolarHBondContact O-CG 3.48Å; I246-K250 PolarHBondContact O-N 3.06Å |
| 247 | E | 92.9 | Very high | 91.5 | Very high | 102 Ų | 102 | 109.4 Ų | 109.4 | 48% | 0.477 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.9 | -40.5 | 178.1 | -74.4 | 175.8 | 169.5 | 0 | 0 | 112 | I243 R244 T245 R251 | I243-E247 HydrophobicContact CG2-CG 4.33Å; I243-E247 WeakPolarHBondContact O-CG 3.47Å; I243-E247 PolarHBondContact O-N 3.3Å; R244-E247 PolarHBondContact O-N 2.94Å; T245-E247 VanDerWaalsContact C-N 3.34Å; T245-E247 PolarHBondContact O-N 3.4Å; E247-R251 WeakPolarHBondContact O-CB 3.37Å; E247-R251 PolarHBondContact O-N 2.86Å |
| 248 | K | 97.1 | Very high | 92.8 | Very high | 119 Ų | 119 | 107.4 Ų | 107.4 | 52% | 0.517 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.7 | -48.9 | 174.1 | -178.5 | 179.2 | 168.9 | -178.4 | 0 | 111.1 | R244 T245 I246 K250 R251 E252 | R244-K248 VanDerWaalsContact O-CB 3.32Å; R244-K248 WeakPolarHBondContact O-CB 3.33Å; R244-K248 PolarHBondContact O-N 3.09Å; T245-K248 PolarHBondContact O-N 3.37Å; I246-K248 VanDerWaalsContact C-N 3.34Å; K248-K250 VanDerWaalsContact C-N 3.33Å; K248-K250 PolarHBondContact O-N 2.95Å; K248-R251 WeakPolarHBondContact O-CB 3.48Å; K248-R251 PolarHBondContact O-N 2.89Å; K248-R251 VanDerWaalsContact O-N 3.13Å; K248-E252 WeakPolarHBondContact CE-OE1 3.43Å; K248-E252 HydrophobicContact CG-CG 4.49Å; K248-E252 IonicContact NZ-OE1 2.74Å; K248-E252 WeakPolarHBondContact O-CG 3.3Å; K248-E252 PolarHBondContact O-N 3.24Å |
| 249 | E | 95.8 | Very high | 93.8 | Very high | 110 Ų | 110 | 100.9 Ų | 100.9 | 51% | 0.514 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 177.8 | -74.1 | 173.6 | -177 | 0 | 0 | 112.1 | T245 I246 E252 A253 | T245-E249 HydrophobicContact CG2-CG 4.44Å; T245-E249 WeakPolarHBondContact CG2-OE1 3.36Å; T245-E249 WeakPolarHBondContact O-CB 3.35Å; T245-E249 WeakPolarHBondContact O-CG 3.39Å; T245-E249 PolarHBondContact O-N 3.11Å; I246-E249 PolarHBondContact O-N 2.92Å; E249-E252 PolarHBondContact O-N 2.91Å; E249-A253 WeakPolarHBondContact O-CB 3.09Å; E249-A253 PolarHBondContact O-N 3.15Å |
| 250 | K | 96.1 | Very high | 94.3 | Very high | 145 Ų | 145 | 101.3 Ų | 101.3 | 63% | 0.63 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -63.1 | -41.7 | 173.9 | -78.5 | 179.2 | 179.1 | -179.1 | 0 | 111.8 | I246 K248 A253 F254 | I246-K250 HydrophobicContact CG2-CD 4.01Å; I246-K250 HydrophobicContact CG2-CG 4.28Å; I246-K250 WeakPolarHBondContact O-CB 3.34Å; I246-K250 VanDerWaalsContact O-CG 3.28Å; I246-K250 WeakPolarHBondContact O-CG 3.48Å; I246-K250 PolarHBondContact O-N 3.06Å; K248-K250 VanDerWaalsContact C-N 3.33Å; K248-K250 PolarHBondContact O-N 2.95Å; K250-A253 PolarHBondContact O-N 3.42Å; K250-F254 WeakPolarHBondContact O-CB 3.46Å; K250-F254 PolarHBondContact O-N 2.93Å |
| 251 | R | 96.4 | Very high | 94.7 | Very high | 148 Ų | 148 | 103 Ų | 103 | 56% | 0.558 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65 | -47.8 | 177 | -166.2 | -177.9 | -58.6 | 129.1 | 5.5 | 111 | E247 K248 A253 F254 E255 | E247-R251 WeakPolarHBondContact O-CB 3.37Å; E247-R251 PolarHBondContact O-N 2.86Å; K248-R251 WeakPolarHBondContact O-CB 3.48Å; K248-R251 PolarHBondContact O-N 2.89Å; K248-R251 VanDerWaalsContact O-N 3.13Å; R251-A253 VanDerWaalsContact C-N 3.33Å; R251-A253 PolarHBondContact O-N 3.3Å; R251-F254 PolarHBondContact O-N 3.37Å; R251-E255 WeakPolarHBondContact O-CG 3.33Å; R251-E255 PolarHBondContact O-N 3.27Å |
| 252 | E | 96.9 | Very high | 95.2 | Very high | 82 Ų | 82 | 104.6 Ų | 104.6 | 38% | 0.383 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.3 | -36 | 177.2 | -70.6 | 174.9 | 179.2 | 0 | 0 | 112.3 | K248 E249 R256 | K248-E252 WeakPolarHBondContact CE-OE1 3.43Å; K248-E252 HydrophobicContact CG-CG 4.49Å; K248-E252 IonicContact NZ-OE1 2.74Å; K248-E252 WeakPolarHBondContact O-CG 3.3Å; K248-E252 PolarHBondContact O-N 3.24Å; E249-E252 PolarHBondContact O-N 2.91Å; E252-R256 WeakPolarHBondContact O-CB 3.34Å; E252-R256 VanDerWaalsContact O-CG 3.25Å; E252-R256 WeakPolarHBondContact O-CG 3.46Å; E252-R256 PolarHBondContact O-N 3.5Å; E252-R256 PolarHBondContact O-NE 3.47Å |
| 253 | A | 95 | Very high | 95.4 | Very high | 30 Ų | 30 | 98.5 Ų | 98.5 | 25% | 0.248 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -66.7 | -41.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | E249 K250 R251 R256 I257 | E249-A253 WeakPolarHBondContact O-CB 3.09Å; E249-A253 PolarHBondContact O-N 3.15Å; K250-A253 PolarHBondContact O-N 3.42Å; R251-A253 VanDerWaalsContact C-N 3.33Å; R251-A253 PolarHBondContact O-N 3.3Å; A253-R256 PolarHBondContact O-N 2.96Å; A253-I257 WeakPolarHBondContact O-CB 3.39Å; A253-I257 VanDerWaalsContact O-CG1 3.27Å; A253-I257 WeakPolarHBondContact O-CG1 3.44Å; A253-I257 PolarHBondContact O-N 3.42Å |
| 254 | F | 93.5 | Very high | 95.7 | Very high | 140 Ų | 140 | 99.8 Ų | 99.8 | 61% | 0.614 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65 | -42.7 | 176.7 | -175.9 | -93.8 | 0 | 0 | 0 | 112.1 | K250 R251 I257 S258 | K250-F254 WeakPolarHBondContact O-CB 3.46Å; K250-F254 PolarHBondContact O-N 2.93Å; R251-F254 PolarHBondContact O-N 3.37Å; F254-I257 PolarHBondContact O-N 3.36Å; F254-S258 VanDerWaalsContact O-CB 3.29Å; F254-S258 WeakPolarHBondContact O-CB 3.46Å; F254-S258 PolarHBondContact O-N 2.92Å; F254-S258 PolarHBondContact O-OG 3.35Å |
| 255 | E | 96.6 | Very high | 95.8 | Very high | 113 Ų | 113 | 97.1 Ų | 97.1 | 53% | 0.528 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 175.1 | -74.3 | 172 | -170.7 | 0 | 0 | 111.4 | R251 S258 A259 | R251-E255 WeakPolarHBondContact O-CG 3.33Å; R251-E255 PolarHBondContact O-N 3.27Å; E255-S258 PolarHBondContact O-N 3.08Å; E255-A259 WeakPolarHBondContact O-CB 3.46Å; E255-A259 PolarHBondContact O-N 3.46Å |
| 256 | R | 97.7 | Very high | 95.9 | Very high | 158 Ų | 158 | 99.6 Ų | 99.6 | 60% | 0.596 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -59.6 | -50.7 | 173.9 | -77.5 | -178 | -69 | 157.4 | -5 | 112.3 | E252 A253 S258 A259 D260 | E252-R256 WeakPolarHBondContact O-CB 3.34Å; E252-R256 VanDerWaalsContact O-CG 3.25Å; E252-R256 WeakPolarHBondContact O-CG 3.46Å; E252-R256 PolarHBondContact O-N 3.5Å; E252-R256 PolarHBondContact O-NE 3.47Å; A253-R256 PolarHBondContact O-N 2.96Å; R256-S258 VanDerWaalsContact C-N 3.27Å; R256-S258 PolarHBondContact O-N 3.11Å; R256-A259 PolarHBondContact O-N 2.73Å; R256-D260 VanDerWaalsContact O-CG 3.32Å; R256-D260 PolarHBondContact O-N 2.96Å |
| 257 | I | 95.4 | Very high | 96 | Very high | 112 Ų | 112 | 103.3 Ų | 103.3 | 57% | 0.574 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.7 | -37.7 | 178.5 | -69 | 166.9 | 0 | 0 | 0 | 111.1 | A253 F254 D260 H261 | A253-I257 WeakPolarHBondContact O-CB 3.39Å; A253-I257 VanDerWaalsContact O-CG1 3.27Å; A253-I257 WeakPolarHBondContact O-CG1 3.44Å; A253-I257 PolarHBondContact O-N 3.42Å; F254-I257 PolarHBondContact O-N 3.36Å; I257-D260 PolarHBondContact O-N 2.96Å; I257-H261 VanDerWaalsContact O-CB 3.27Å; I257-H261 WeakPolarHBondContact O-CB 3.45Å; I257-H261 PolarHBondContact O-N 3.41Å |
| 258 | S | 94.1 | Very high | 96.1 | Very high | 49 Ų | 49 | 103.9 Ų | 103.9 | 34% | 0.343 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67 | -42.3 | 178 | -60.1 | 0 | 0 | 0 | 0 | 111.7 | F254 E255 R256 H261 E262 | F254-S258 VanDerWaalsContact O-CB 3.29Å; F254-S258 WeakPolarHBondContact O-CB 3.46Å; F254-S258 PolarHBondContact O-N 2.92Å; F254-S258 PolarHBondContact O-OG 3.35Å; E255-S258 PolarHBondContact O-N 3.08Å; R256-S258 VanDerWaalsContact C-N 3.27Å; R256-S258 PolarHBondContact O-N 3.11Å; S258-H261 PolarHBondContact O-N 3Å; S258-E262 PolarHBondContact O-N 2.9Å |
| 259 | A | 97.3 | Very high | 96.1 | Very high | 58 Ų | 58 | 101.9 Ų | 101.9 | 48% | 0.479 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | E255 R256 H261 E262 G263 | E255-A259 WeakPolarHBondContact O-CB 3.46Å; E255-A259 PolarHBondContact O-N 3.46Å; R256-A259 PolarHBondContact O-N 2.73Å; A259-H261 VanDerWaalsContact C-N 3.33Å; A259-H261 PolarHBondContact O-N 2.99Å; A259-E262 PolarHBondContact O-N 3.39Å; A259-G263 PolarHBondContact O-N 3.41Å |
| 260 | D | 95.8 | Very high | 96.2 | Very high | 108 Ų | 108 | 100.5 Ų | 100.5 | 58% | 0.578 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63 | -40.4 | 175.5 | -70 | -16.7 | 0 | 0 | 0 | 111.3 | R256 I257 G263 L264 | R256-D260 VanDerWaalsContact O-CG 3.32Å; R256-D260 PolarHBondContact O-N 2.96Å; I257-D260 PolarHBondContact O-N 2.96Å; D260-G263 PolarHBondContact O-N 2.95Å; D260-L264 WeakPolarHBondContact O-CB 3.46Å; D260-L264 WeakPolarHBondContact O-CG 3.34Å; D260-L264 PolarHBondContact O-N 2.88Å |
| 261 | H | 94.8 | Very high | 96.2 | Very high | 113 Ų | 113 | 97.9 Ų | 97.9 | 52% | 0.523 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63 | -44.6 | 175.9 | -176.3 | 66.4 | 0 | 0 | 0 | 111.8 | I257 S258 A259 G263 L264 L265 | I257-H261 VanDerWaalsContact O-CB 3.27Å; I257-H261 WeakPolarHBondContact O-CB 3.45Å; I257-H261 PolarHBondContact O-N 3.41Å; S258-H261 PolarHBondContact O-N 3Å; A259-H261 VanDerWaalsContact C-N 3.33Å; A259-H261 PolarHBondContact O-N 2.99Å; H261-G263 VanDerWaalsContact C-N 3.34Å; H261-L264 PolarHBondContact O-N 2.96Å; H261-L265 WeakPolarHBondContact O-CG 3.44Å; H261-L265 PolarHBondContact O-N 3.32Å |
| 262 | E | 96.8 | Very high | 96.3 | Very high | 106 Ų | 106 | 95.5 Ų | 95.5 | 50% | 0.495 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.9 | -40.2 | 175.3 | -165 | -169.1 | 150.4 | 0 | 0 | 111.7 | S258 A259 L265 K266 | S258-E262 PolarHBondContact O-N 2.9Å; A259-E262 PolarHBondContact O-N 3.39Å; E262-L265 PolarHBondContact O-N 3.39Å; E262-K266 WeakPolarHBondContact O-CG 3.44Å; E262-K266 PolarHBondContact O-N 2.64Å; E262-K266 VanDerWaalsContact O-N 3.09Å; E262-K266 VanDerWaalsContact OE1-CE 3.26Å; E262-K266 WeakPolarHBondContact OE1-CE 3.32Å; E262-K266 IonicContact OE1-NZ 2.73Å; E262-K266 PolarHBondContact OE1-NZ 3.16Å |
| 263 | G | 96.9 | Very high | 96.3 | Very high | 29 Ų | 29 | 97.7 Ų | 97.7 | 30% | 0.299 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.4 | -50 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A259 D260 H261 L265 K266 E267 | A259-G263 PolarHBondContact O-N 3.41Å; D260-G263 PolarHBondContact O-N 2.95Å; H261-G263 VanDerWaalsContact C-N 3.34Å; G263-L265 VanDerWaalsContact C-N 3.31Å; G263-L265 PolarHBondContact O-N 3.49Å; G263-K266 WeakPolarHBondContact O-CB 3.35Å; G263-K266 PolarHBondContact O-N 3.04Å; G263-K266 VanDerWaalsContact O-N 3.14Å; G263-E267 WeakPolarHBondContact O-CG 3.41Å; G263-E267 PolarHBondContact O-N 3.34Å |
| 264 | L | 96.2 | Very high | 96.5 | Very high | 107 Ų | 107 | 103.5 Ų | 103.5 | 56% | 0.56 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.3 | -37.1 | 176.9 | -77 | 168.8 | 0 | 0 | 0 | 112.6 | D260 H261 E267 H268 | D260-L264 WeakPolarHBondContact O-CB 3.46Å; D260-L264 WeakPolarHBondContact O-CG 3.34Å; D260-L264 PolarHBondContact O-N 2.88Å; H261-L264 PolarHBondContact O-N 2.96Å; L264-E267 PolarHBondContact O-N 2.96Å; L264-H268 VanDerWaalsContact O-CB 3.27Å; L264-H268 WeakPolarHBondContact O-CB 3.42Å; L264-H268 PolarHBondContact O-N 2.87Å |
| 265 | L | 95.9 | Very high | 96.5 | Very high | 93 Ų | 93 | 101 Ų | 101 | 49% | 0.487 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 174.6 | -76.7 | 175.5 | 0 | 0 | 0 | 112 | H261 E262 G263 H268 E269 | H261-L265 WeakPolarHBondContact O-CG 3.44Å; H261-L265 PolarHBondContact O-N 3.32Å; E262-L265 PolarHBondContact O-N 3.39Å; G263-L265 VanDerWaalsContact C-N 3.31Å; G263-L265 PolarHBondContact O-N 3.49Å; L265-H268 PolarHBondContact O-N 3.07Å; L265-E269 PolarHBondContact O-N 3.46Å |
| 266 | K | 97.9 | Very high | 96.6 | Very high | 122 Ų | 122 | 99.9 Ų | 99.9 | 53% | 0.53 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64 | -46.8 | 175.5 | -72.3 | 171 | -175.9 | 165.6 | 0 | 111.3 | E262 G263 H268 E269 D270 | E262-K266 WeakPolarHBondContact O-CG 3.44Å; E262-K266 PolarHBondContact O-N 2.64Å; E262-K266 VanDerWaalsContact O-N 3.09Å; E262-K266 VanDerWaalsContact OE1-CE 3.26Å; E262-K266 WeakPolarHBondContact OE1-CE 3.32Å; E262-K266 IonicContact OE1-NZ 2.73Å; E262-K266 PolarHBondContact OE1-NZ 3.16Å; G263-K266 WeakPolarHBondContact O-CB 3.35Å; G263-K266 PolarHBondContact O-N 3.04Å; G263-K266 VanDerWaalsContact O-N 3.14Å; K266-H268 VanDerWaalsContact C-N 3.34Å; K266-H268 PolarHBondContact O-N 3.44Å; K266-E269 PolarHBondContact O-N 2.96Å; K266-D270 PolarHBondContact O-N 3.1Å |
| 267 | E | 96.7 | Very high | 96.5 | Very high | 125 Ų | 125 | 94.9 Ų | 94.9 | 58% | 0.584 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.9 | -42.1 | 176.7 | -71 | -177.8 | 175.3 | 0 | 0 | 112.3 | G263 L264 E269 D270 V271 | G263-E267 WeakPolarHBondContact O-CG 3.41Å; G263-E267 PolarHBondContact O-N 3.34Å; L264-E267 PolarHBondContact O-N 2.96Å; E267-E269 PolarHBondContact O-N 3.33Å; E267-D270 PolarHBondContact O-N 3.01Å; E267-V271 WeakPolarHBondContact O-CG2 3.47Å; E267-V271 PolarHBondContact O-N 3.43Å |
| 268 | H | 95.6 | Very high | 96.4 | Very high | 114 Ų | 114 | 92.2 Ų | 92.2 | 53% | 0.528 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 176 | 175.8 | -91.8 | 0 | 0 | 0 | 111.7 | L264 L265 K266 D270 V271 K272 | L264-H268 VanDerWaalsContact O-CB 3.27Å; L264-H268 WeakPolarHBondContact O-CB 3.42Å; L264-H268 PolarHBondContact O-N 2.87Å; L265-H268 PolarHBondContact O-N 3.07Å; K266-H268 VanDerWaalsContact C-N 3.34Å; K266-H268 PolarHBondContact O-N 3.44Å; H268-D270 VanDerWaalsContact C-N 3.34Å; H268-D270 PolarHBondContact O-N 2.74Å; H268-V271 PolarHBondContact O-N 2.96Å; H268-K272 VanDerWaalsContact O-CB 3.25Å; H268-K272 WeakPolarHBondContact O-CB 3.47Å; H268-K272 PolarHBondContact O-N 3.11Å |
| 269 | E | 97.3 | Very high | 96.5 | Very high | 78 Ų | 78 | 93.9 Ų | 93.9 | 36% | 0.364 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.4 | -37.8 | 175.6 | -80.6 | -62.5 | 145.9 | 0 | 0 | 112.3 | L265 K266 E267 K272 K273 | L265-E269 PolarHBondContact O-N 3.46Å; K266-E269 PolarHBondContact O-N 2.96Å; E267-E269 PolarHBondContact O-N 3.33Å; E269-K272 PolarHBondContact O-N 2.9Å; E269-K272 IonicContact OE1-NZ 2.71Å; E269-K272 PolarHBondContact OE1-NZ 2.96Å; E269-K272 IonicContact OE2-NZ 3.32Å; E269-K272 PolarHBondContact OE2-NZ 2.91Å; E269-K273 VanDerWaalsContact O-CG 3.31Å; E269-K273 WeakPolarHBondContact O-CG 3.36Å; E269-K273 PolarHBondContact O-N 3.47Å |
| 270 | D | 96.9 | Very high | 96.5 | Very high | 80 Ų | 80 | 93.4 Ų | 93.4 | 43% | 0.428 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -69.2 | -40.4 | 176.5 | -75.9 | -14.2 | 0 | 0 | 0 | 112.9 | K266 E267 H268 K272 K273 K274 | K266-D270 PolarHBondContact O-N 3.1Å; E267-D270 PolarHBondContact O-N 3.01Å; H268-D270 VanDerWaalsContact C-N 3.34Å; H268-D270 PolarHBondContact O-N 2.74Å; D270-K272 VanDerWaalsContact C-N 3.34Å; D270-K273 PolarHBondContact O-N 3.32Å; D270-K273 IonicContact OD1-NZ 2.86Å; D270-K274 WeakPolarHBondContact O-CG 3.38Å; D270-K274 PolarHBondContact O-N 2.91Å |
| 271 | V | 97.2 | Very high | 96.6 | Very high | 91 Ų | 91 | 96.1 Ų | 96.1 | 55% | 0.552 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -63.9 | -41.4 | 173.3 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | E267 H268 K274 L275 | E267-V271 WeakPolarHBondContact O-CG2 3.47Å; E267-V271 PolarHBondContact O-N 3.43Å; H268-V271 PolarHBondContact O-N 2.96Å; V271-K274 PolarHBondContact O-N 3.42Å; V271-L275 WeakPolarHBondContact O-CB 3.46Å; V271-L275 PolarHBondContact O-N 3.42Å |
| 272 | K | 97.7 | Very high | 96.5 | Very high | 97 Ų | 97 | 93.7 Ų | 93.7 | 42% | 0.422 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 175.2 | 178.8 | -178.4 | 167.2 | -163.2 | 0 | 111.8 | H268 E269 D270 L275 E276 | H268-K272 VanDerWaalsContact O-CB 3.25Å; H268-K272 WeakPolarHBondContact O-CB 3.47Å; H268-K272 PolarHBondContact O-N 3.11Å; E269-K272 PolarHBondContact O-N 2.9Å; E269-K272 IonicContact OE1-NZ 2.71Å; E269-K272 PolarHBondContact OE1-NZ 2.96Å; E269-K272 IonicContact OE2-NZ 3.32Å; E269-K272 PolarHBondContact OE2-NZ 2.91Å; D270-K272 VanDerWaalsContact C-N 3.34Å; K272-L275 PolarHBondContact O-N 2.91Å; K272-E276 WeakPolarHBondContact O-CG 3.25Å; K272-E276 PolarHBondContact O-N 3.45Å |
| 273 | K | 98.1 | Very high | 96.6 | Very high | 128 Ų | 128 | 96.3 Ų | 96.3 | 56% | 0.557 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60.3 | -44.8 | 173.3 | -71.4 | 168.8 | -169.1 | 164.3 | 0 | 112 | E269 D270 L275 E276 A277 | E269-K273 VanDerWaalsContact O-CG 3.31Å; E269-K273 WeakPolarHBondContact O-CG 3.36Å; E269-K273 PolarHBondContact O-N 3.47Å; D270-K273 PolarHBondContact O-N 3.32Å; D270-K273 IonicContact OD1-NZ 2.86Å; K273-L275 VanDerWaalsContact C-N 3.32Å; K273-L275 PolarHBondContact O-N 3.3Å; K273-E276 PolarHBondContact O-N 3.27Å; K273-A277 WeakPolarHBondContact O-CB 3.43Å; K273-A277 PolarHBondContact O-N 2.97Å |
| 274 | K | 97.7 | Very high | 96.6 | Very high | 152 Ų | 152 | 98.2 Ų | 98.2 | 66% | 0.661 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.8 | -40 | 176.3 | -72.5 | 171.9 | -175.6 | 171 | 0 | 111.9 | D270 V271 S278 | D270-K274 WeakPolarHBondContact O-CG 3.38Å; D270-K274 PolarHBondContact O-N 2.91Å; V271-K274 PolarHBondContact O-N 3.42Å; K274-S278 WeakPolarHBondContact O-CB 3.48Å; K274-S278 PolarHBondContact O-N 3.45Å |
| 275 | L | 95 | Very high | 96.7 | Very high | 89 Ų | 89 | 98.7 Ų | 98.7 | 47% | 0.466 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.4 | -48 | 176.4 | 177.2 | 63.7 | 0 | 0 | 0 | 111.3 | V271 K272 K273 A277 S278 K279 | V271-L275 WeakPolarHBondContact O-CB 3.46Å; V271-L275 PolarHBondContact O-N 3.42Å; K272-L275 PolarHBondContact O-N 2.91Å; K273-L275 VanDerWaalsContact C-N 3.32Å; K273-L275 PolarHBondContact O-N 3.3Å; L275-A277 VanDerWaalsContact C-N 3.35Å; L275-A277 PolarHBondContact O-N 3.48Å; L275-S278 PolarHBondContact O-N 3.27Å; L275-K279 HydrophobicContact CD1-CG 4.44Å; L275-K279 HydrophobicContact CG-CD 4.36Å; L275-K279 WeakPolarHBondContact O-CG 3.27Å; L275-K279 PolarHBondContact O-N 3.19Å |
| 276 | E | 97.8 | Very high | 96.7 | Very high | 89 Ų | 89 | 96.8 Ų | 96.8 | 42% | 0.416 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63 | -40.5 | 177.6 | -70.2 | -53 | 136.4 | 0 | 0 | 111.9 | K272 K273 S278 K279 A280 | K272-E276 WeakPolarHBondContact O-CG 3.25Å; K272-E276 PolarHBondContact O-N 3.45Å; K273-E276 PolarHBondContact O-N 3.27Å; E276-S278 VanDerWaalsContact C-N 3.34Å; E276-S278 PolarHBondContact O-N 2.89Å; E276-K279 PolarHBondContact O-N 3.48Å; E276-K279 IonicContact OE1-NZ 3.51Å; E276-K279 PolarHBondContact OE1-NZ 3.31Å; E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.84Å |
| 277 | A | 96.6 | Very high | 96.7 | Very high | 53 Ų | 53 | 96.6 Ų | 96.6 | 44% | 0.438 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | K273 L275 A280 R281 | K273-A277 WeakPolarHBondContact O-CB 3.43Å; K273-A277 PolarHBondContact O-N 2.97Å; L275-A277 VanDerWaalsContact C-N 3.35Å; L275-A277 PolarHBondContact O-N 3.48Å; A277-A280 PolarHBondContact O-N 3.35Å; A277-R281 WeakPolarHBondContact O-CG 3.44Å; A277-R281 PolarHBondContact O-N 3.01Å |
| 278 | S | 91.9 | Very high | 96.8 | Very high | 55 Ų | 55 | 95.7 Ų | 95.7 | 39% | 0.385 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.9 | -40.6 | 176.2 | -162.7 | 0 | 0 | 0 | 0 | 112.3 | K274 L275 E276 A280 R281 S282 | K274-S278 WeakPolarHBondContact O-CB 3.48Å; K274-S278 PolarHBondContact O-N 3.45Å; L275-S278 PolarHBondContact O-N 3.27Å; E276-S278 VanDerWaalsContact C-N 3.34Å; E276-S278 PolarHBondContact O-N 2.89Å; S278-A280 VanDerWaalsContact C-N 3.35Å; S278-R281 PolarHBondContact O-N 3.29Å; S278-S282 WeakPolarHBondContact O-CB 3.48Å; S278-S282 PolarHBondContact O-N 2.93Å |
| 279 | K | 97.6 | Very high | 96.9 | Very high | 85 Ų | 85 | 94.5 Ų | 94.5 | 37% | 0.37 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 174 | -74.2 | 174.3 | -176.1 | 167.8 | 0 | 111.2 | L275 E276 S282 R283 | L275-K279 HydrophobicContact CD1-CG 4.44Å; L275-K279 HydrophobicContact CG-CD 4.36Å; L275-K279 WeakPolarHBondContact O-CG 3.27Å; L275-K279 PolarHBondContact O-N 3.19Å; E276-K279 PolarHBondContact O-N 3.48Å; E276-K279 IonicContact OE1-NZ 3.51Å; E276-K279 PolarHBondContact OE1-NZ 3.31Å; K279-S282 PolarHBondContact O-N 2.94Å; K279-R283 WeakPolarHBondContact O-CG 3.47Å; K279-R283 PolarHBondContact O-N 3.18Å |
| 280 | A | 96.7 | Very high | 96.9 | Very high | 48 Ų | 48 | 97.9 Ų | 97.9 | 40% | 0.397 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.1 | -49.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | E276 A277 S278 S282 R283 T284 | E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.84Å; A277-A280 PolarHBondContact O-N 3.35Å; S278-A280 VanDerWaalsContact C-N 3.35Å; A280-S282 VanDerWaalsContact C-N 3.32Å; A280-S282 PolarHBondContact O-N 2.98Å; A280-R283 WeakPolarHBondContact O-CB 3.37Å; A280-R283 PolarHBondContact O-N 3.06Å; A280-R283 VanDerWaalsContact O-N 3.16Å; A280-T284 PolarHBondContact O-N 3.48Å; A280-T284 VanDerWaalsContact O-N 3.09Å; A280-T284 PolarHBondContact O-OG1 3.34Å |
| 281 | R | 97.4 | Very high | 96.9 | Very high | 164 Ų | 164 | 97.1 Ų | 97.1 | 62% | 0.619 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -57.8 | -43.1 | 175.2 | -71.4 | -172.3 | -61.2 | -174.5 | 3 | 112.6 | A277 S278 R283 T284 Q285 | A277-R281 WeakPolarHBondContact O-CG 3.44Å; A277-R281 PolarHBondContact O-N 3.01Å; S278-R281 PolarHBondContact O-N 3.29Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.32Å; R281-T284 PolarHBondContact O-N 3.5Å; R281-Q285 WeakPolarHBondContact O-CB 3.47Å; R281-Q285 WeakPolarHBondContact O-CG 3.26Å; R281-Q285 PolarHBondContact O-N 3.48Å |
| 282 | S | 93.3 | Very high | 97 | Very high | 63 Ų | 63 | 97.1 Ų | 97.1 | 44% | 0.441 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.9 | -36.1 | 178.8 | -178.9 | 0 | 0 | 0 | 0 | 112.6 | S278 K279 A280 S286 | S278-S282 WeakPolarHBondContact O-CB 3.48Å; S278-S282 PolarHBondContact O-N 2.93Å; K279-S282 PolarHBondContact O-N 2.94Å; A280-S282 VanDerWaalsContact C-N 3.32Å; A280-S282 PolarHBondContact O-N 2.98Å; S282-S286 WeakPolarHBondContact O-CB 3.5Å; S282-S286 PolarHBondContact O-N 3.5Å; S282-S286 PolarHBondContact O-OG 2.97Å |
| 283 | R | 97.6 | Very high | 97 | Very high | 161 Ų | 161 | 99 Ų | 99 | 61% | 0.608 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.1 | -50.4 | 173.7 | -70.8 | 175 | -171.9 | 165.9 | 4.2 | 111.3 | K279 A280 R281 Q285 S286 E287 | K279-R283 WeakPolarHBondContact O-CG 3.47Å; K279-R283 PolarHBondContact O-N 3.18Å; A280-R283 WeakPolarHBondContact O-CB 3.37Å; A280-R283 PolarHBondContact O-N 3.06Å; A280-R283 VanDerWaalsContact O-N 3.16Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.32Å; R283-Q285 PolarHBondContact O-N 2.88Å; R283-S286 WeakPolarHBondContact O-CB 3.46Å; R283-S286 PolarHBondContact O-N 2.96Å; R283-S286 VanDerWaalsContact O-N 3.1Å; R283-E287 WeakPolarHBondContact O-CG 3.4Å; R283-E287 PolarHBondContact O-N 3.05Å |
| 284 | T | 97.7 | Very high | 97 | Very high | 68 Ų | 68 | 99.1 Ų | 99.1 | 42% | 0.417 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.3 | -46.8 | 178.1 | -53.3 | 0 | 0 | 0 | 0 | 111.7 | A280 R281 S286 E287 E288 | A280-T284 PolarHBondContact O-N 3.48Å; A280-T284 VanDerWaalsContact O-N 3.09Å; A280-T284 PolarHBondContact O-OG1 3.34Å; R281-T284 PolarHBondContact O-N 3.5Å; T284-S286 VanDerWaalsContact C-N 3.28Å; T284-S286 PolarHBondContact O-N 3.46Å; T284-E287 WeakPolarHBondContact O-CB 3.31Å; T284-E287 PolarHBondContact O-N 3.39Å; T284-E287 VanDerWaalsContact O-N 3.11Å; T284-E288 WeakPolarHBondContact O-CG 3.45Å; T284-E288 PolarHBondContact O-N 3.2Å |
| 285 | Q | 97.1 | Very high | 97 | Very high | 117 Ų | 117 | 97.3 Ų | 97.3 | 55% | 0.547 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.1 | -36.8 | 175.7 | -74.1 | 178.2 | -21.7 | 0 | 0 | 112.5 | R281 R283 E287 E288 I289 | R281-Q285 WeakPolarHBondContact O-CB 3.47Å; R281-Q285 WeakPolarHBondContact O-CG 3.26Å; R281-Q285 PolarHBondContact O-N 3.48Å; R283-Q285 PolarHBondContact O-N 2.88Å; Q285-E287 VanDerWaalsContact C-N 3.33Å; Q285-E288 PolarHBondContact O-N 3.34Å; Q285-I289 VanDerWaalsContact O-CG1 3.28Å; Q285-I289 WeakPolarHBondContact O-CG1 3.47Å; Q285-I289 PolarHBondContact O-N 3.07Å |
| 286 | S | 97 | Very high | 97.2 | Very high | 54 Ų | 54 | 97.8 Ų | 97.8 | 38% | 0.378 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.1 | -36.2 | 176.1 | -61.7 | 0 | 0 | 0 | 0 | 112 | S282 R283 T284 K290 | S282-S286 WeakPolarHBondContact O-CB 3.5Å; S282-S286 PolarHBondContact O-N 3.5Å; S282-S286 PolarHBondContact O-OG 2.97Å; R283-S286 WeakPolarHBondContact O-CB 3.46Å; R283-S286 PolarHBondContact O-N 2.96Å; R283-S286 VanDerWaalsContact O-N 3.1Å; T284-S286 VanDerWaalsContact C-N 3.28Å; T284-S286 PolarHBondContact O-N 3.46Å; S286-K290 WeakPolarHBondContact O-CG 3.35Å; S286-K290 PolarHBondContact O-N 2.92Å; S286-K290 VanDerWaalsContact O-N 3.15Å |
| 287 | E | 97.8 | Very high | 97.2 | Very high | 117 Ų | 117 | 96.8 Ų | 96.8 | 55% | 0.547 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.2 | -45.2 | 173.9 | -70.9 | 165 | -173.5 | 0 | 0 | 111 | R283 T284 Q285 I289 K290 T291 | R283-E287 WeakPolarHBondContact O-CG 3.4Å; R283-E287 PolarHBondContact O-N 3.05Å; T284-E287 WeakPolarHBondContact O-CB 3.31Å; T284-E287 PolarHBondContact O-N 3.39Å; T284-E287 VanDerWaalsContact O-N 3.11Å; Q285-E287 VanDerWaalsContact C-N 3.33Å; E287-I289 VanDerWaalsContact C-N 3.34Å; E287-I289 PolarHBondContact O-N 3.39Å; E287-K290 WeakPolarHBondContact O-CB 3.33Å; E287-K290 PolarHBondContact O-N 3.46Å; E287-K290 VanDerWaalsContact O-N 3.09Å; E287-T291 WeakPolarHBondContact O-CG2 3.37Å; E287-T291 PolarHBondContact O-N 2.93Å |
| 288 | E | 97.8 | Very high | 97.2 | Very high | 106 Ų | 106 | 97.2 Ų | 97.2 | 50% | 0.495 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59 | -42 | 174 | -71 | 172.1 | -172.5 | 0 | 0 | 112.4 | T284 Q285 K290 T291 L292 | T284-E288 WeakPolarHBondContact O-CG 3.45Å; T284-E288 PolarHBondContact O-N 3.2Å; Q285-E288 PolarHBondContact O-N 3.34Å; E288-K290 VanDerWaalsContact C-N 3.29Å; E288-K290 PolarHBondContact O-N 2.82Å; E288-T291 WeakPolarHBondContact CA-OG1 3.48Å; E288-T291 PolarHBondContact O-N 3.3Å; E288-T291 PolarHBondContact O-OG1 2.98Å; E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 VanDerWaalsContact O-CG 3.29Å; E288-L292 WeakPolarHBondContact O-CG 3.41Å; E288-L292 PolarHBondContact O-N 3.26Å |
| 289 | I | 97.9 | Very high | 97.5 | Very high | 90 Ų | 90 | 100 Ų | 100 | 46% | 0.462 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.8 | -38.7 | 175.5 | -72.3 | 167.4 | 0 | 0 | 0 | 111 | Q285 E287 K293 | Q285-I289 VanDerWaalsContact O-CG1 3.28Å; Q285-I289 WeakPolarHBondContact O-CG1 3.47Å; Q285-I289 PolarHBondContact O-N 3.07Å; E287-I289 VanDerWaalsContact C-N 3.34Å; E287-I289 PolarHBondContact O-N 3.39Å; I289-K293 HydrophobicContact CG2-CD 4.19Å; I289-K293 WeakPolarHBondContact O-CB 3.31Å; I289-K293 VanDerWaalsContact O-CG 3.28Å; I289-K293 WeakPolarHBondContact O-CG 3.48Å; I289-K293 PolarHBondContact O-N 3.02Å |
| 290 | K | 98.3 | Very high | 97.5 | Very high | 148 Ų | 148 | 101 Ų | 101 | 64% | 0.643 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.1 | -43.4 | 176.7 | -72.5 | 172.5 | -175.3 | 179.6 | 0 | 111.4 | S286 E287 E288 K293 M294 | S286-K290 WeakPolarHBondContact O-CG 3.35Å; S286-K290 PolarHBondContact O-N 2.92Å; S286-K290 VanDerWaalsContact O-N 3.15Å; E287-K290 WeakPolarHBondContact O-CB 3.33Å; E287-K290 PolarHBondContact O-N 3.46Å; E287-K290 VanDerWaalsContact O-N 3.09Å; E288-K290 VanDerWaalsContact C-N 3.29Å; E288-K290 PolarHBondContact O-N 2.82Å; K290-K293 PolarHBondContact O-N 3.23Å; K290-M294 WeakPolarHBondContact O-CB 3.34Å; K290-M294 PolarHBondContact O-N 3.41Å |
| 291 | T | 97.7 | Very high | 97.5 | Very high | 64 Ų | 64 | 102.9 Ų | 102.9 | 39% | 0.393 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.6 | -42.9 | 178.4 | 59.6 | 0 | 0 | 0 | 0 | 111.4 | E287 E288 K293 M294 Q295 | E287-T291 WeakPolarHBondContact O-CG2 3.37Å; E287-T291 PolarHBondContact O-N 2.93Å; E288-T291 WeakPolarHBondContact CA-OG1 3.48Å; E288-T291 PolarHBondContact O-N 3.3Å; E288-T291 PolarHBondContact O-OG1 2.98Å; T291-K293 PolarHBondContact O-N 2.76Å; T291-M294 WeakPolarHBondContact O-CB 3.47Å; T291-M294 PolarHBondContact O-N 2.89Å; T291-Q295 WeakPolarHBondContact O-CG 3.32Å; T291-Q295 PolarHBondContact O-N 3.34Å |
| 292 | L | 98.2 | Very high | 97.5 | Very high | 92 Ų | 92 | 100.8 Ų | 100.8 | 48% | 0.482 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 175.5 | -72.1 | 173.6 | 0 | 0 | 0 | 112.1 | E288 M294 Q295 I296 | E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 VanDerWaalsContact O-CG 3.29Å; E288-L292 WeakPolarHBondContact O-CG 3.41Å; E288-L292 PolarHBondContact O-N 3.26Å; L292-M294 VanDerWaalsContact C-N 3.32Å; L292-M294 PolarHBondContact O-N 3.31Å; L292-Q295 PolarHBondContact O-N 3.27Å; L292-I296 VanDerWaalsContact O-CG1 3.32Å; L292-I296 WeakPolarHBondContact O-CG1 3.35Å; L292-I296 PolarHBondContact O-N 2.84Å |
| 293 | K | 98.4 | Very high | 97.7 | Very high | 137 Ų | 137 | 99.2 Ų | 99.2 | 60% | 0.596 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.2 | -44.3 | 174.1 | -79.2 | 178.8 | 177.7 | -173.4 | 0 | 111.8 | I289 K290 T291 Q295 I296 S297 | I289-K293 HydrophobicContact CG2-CD 4.19Å; I289-K293 WeakPolarHBondContact O-CB 3.31Å; I289-K293 VanDerWaalsContact O-CG 3.28Å; I289-K293 WeakPolarHBondContact O-CG 3.48Å; I289-K293 PolarHBondContact O-N 3.02Å; K290-K293 PolarHBondContact O-N 3.23Å; T291-K293 PolarHBondContact O-N 2.76Å; K293-Q295 VanDerWaalsContact C-N 3.35Å; K293-Q295 PolarHBondContact O-N 3.36Å; K293-I296 PolarHBondContact O-N 3.27Å; K293-S297 PolarHBondContact O-N 3.09Å; K293-S297 PolarHBondContact O-OG 3.3Å |
| 294 | M | 97.8 | Very high | 97.6 | Very high | 129 Ų | 129 | 97.6 Ų | 97.6 | 64% | 0.635 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63 | -40.5 | 177 | -176.9 | 173.6 | 52.1 | 0 | 0 | 112 | K290 T291 L292 S297 S298 | K290-M294 WeakPolarHBondContact O-CB 3.34Å; K290-M294 PolarHBondContact O-N 3.41Å; T291-M294 WeakPolarHBondContact O-CB 3.47Å; T291-M294 PolarHBondContact O-N 2.89Å; L292-M294 VanDerWaalsContact C-N 3.32Å; L292-M294 PolarHBondContact O-N 3.31Å; M294-S297 PolarHBondContact O-N 3.46Å; M294-S298 PolarHBondContact O-N 3.17Å |
| 295 | Q | 98.2 | Very high | 97.6 | Very high | 114 Ų | 114 | 100.4 Ų | 100.4 | 53% | 0.533 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 173.8 | -72.1 | 176.7 | -1.5 | 0 | 0 | 111.9 | T291 L292 K293 S298 L299 | T291-Q295 WeakPolarHBondContact O-CG 3.32Å; T291-Q295 PolarHBondContact O-N 3.34Å; L292-Q295 PolarHBondContact O-N 3.27Å; K293-Q295 VanDerWaalsContact C-N 3.35Å; K293-Q295 PolarHBondContact O-N 3.36Å; Q295-S298 PolarHBondContact O-N 2.92Å; Q295-L299 WeakPolarHBondContact O-CG 3.47Å; Q295-L299 PolarHBondContact O-N 3.48Å |
| 296 | I | 98.1 | Very high | 97.6 | Very high | 99 Ų | 99 | 99.6 Ų | 99.6 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.6 | -46.3 | 176.1 | -69.1 | 166.3 | 0 | 0 | 0 | 110.5 | L292 K293 S298 L299 L300 | L292-I296 VanDerWaalsContact O-CG1 3.32Å; L292-I296 WeakPolarHBondContact O-CG1 3.35Å; L292-I296 PolarHBondContact O-N 2.84Å; K293-I296 PolarHBondContact O-N 3.27Å; I296-S298 VanDerWaalsContact C-N 3.3Å; I296-S298 PolarHBondContact O-N 3.44Å; I296-L299 PolarHBondContact O-N 3.41Å; I296-L300 HydrophobicContact CG2-CD1 4Å; I296-L300 HydrophobicContact CG2-CG 4.33Å; I296-L300 WeakPolarHBondContact O-CG 3.49Å; I296-L300 PolarHBondContact O-N 3.05Å |
| 297 | S | 98.1 | Very high | 97.6 | Very high | 69 Ų | 69 | 100.9 Ų | 100.9 | 48% | 0.483 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59 | -41.2 | 176.5 | -65.4 | 0 | 0 | 0 | 0 | 112.2 | K293 M294 L300 E301 | K293-S297 PolarHBondContact O-N 3.09Å; K293-S297 PolarHBondContact O-OG 3.3Å; M294-S297 PolarHBondContact O-N 3.46Å; S297-L300 PolarHBondContact O-N 2.83Å; S297-E301 PolarHBondContact O-N 3.48Å |
| 298 | S | 97.6 | Very high | 97.5 | Very high | 61 Ų | 61 | 97.2 Ų | 97.2 | 43% | 0.427 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64 | -42.1 | 175.4 | -178.7 | 0 | 0 | 0 | 0 | 112.4 | M294 Q295 I296 L300 E301 K302 | M294-S298 PolarHBondContact O-N 3.17Å; Q295-S298 PolarHBondContact O-N 2.92Å; I296-S298 VanDerWaalsContact C-N 3.3Å; I296-S298 PolarHBondContact O-N 3.44Å; S298-L300 VanDerWaalsContact C-N 3.34Å; S298-E301 PolarHBondContact O-N 2.86Å; S298-K302 WeakPolarHBondContact O-CG 3.46Å; S298-K302 PolarHBondContact O-N 2.95Å |
| 299 | L | 97.6 | Very high | 97.6 | Very high | 113 Ų | 113 | 97 Ų | 97 | 59% | 0.592 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.6 | -37.6 | 176.1 | -71.1 | 173.7 | 0 | 0 | 0 | 112.1 | Q295 I296 K302 G303 | Q295-L299 WeakPolarHBondContact O-CG 3.47Å; Q295-L299 PolarHBondContact O-N 3.48Å; I296-L299 PolarHBondContact O-N 3.41Å; L299-K302 PolarHBondContact O-N 3.45Å; L299-G303 PolarHBondContact O-N 3.35Å |
| 300 | L | 97.6 | Very high | 97.6 | Very high | 108 Ų | 108 | 96.5 Ų | 96.5 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64 | -42.1 | 175 | -73.4 | 172.9 | 0 | 0 | 0 | 111.9 | I296 S297 S298 G303 K304 | I296-L300 HydrophobicContact CG2-CD1 4Å; I296-L300 HydrophobicContact CG2-CG 4.33Å; I296-L300 WeakPolarHBondContact O-CG 3.49Å; I296-L300 PolarHBondContact O-N 3.05Å; S297-L300 PolarHBondContact O-N 2.83Å; S298-L300 VanDerWaalsContact C-N 3.34Å; L300-G303 PolarHBondContact O-N 3.26Å; L300-K304 WeakPolarHBondContact O-CG 3.38Å; L300-K304 PolarHBondContact O-N 3.38Å |
| 301 | E | 97.3 | Very high | 97.5 | Very high | 87 Ų | 87 | 94 Ų | 94 | 41% | 0.407 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 173.6 | -76.9 | -57.1 | 142.8 | 0 | 0 | 111.9 | S297 S298 G303 K304 H305 | S297-E301 PolarHBondContact O-N 3.48Å; S298-E301 PolarHBondContact O-N 2.86Å; E301-G303 VanDerWaalsContact C-N 3.33Å; E301-G303 PolarHBondContact O-N 3.45Å; E301-K304 WeakPolarHBondContact O-CB 3.32Å; E301-K304 PolarHBondContact O-N 2.87Å; E301-K304 VanDerWaalsContact O-N 3.16Å; E301-K304 IonicContact OE1-NZ 3.37Å; E301-K304 PolarHBondContact OE1-NZ 2.96Å; E301-K304 IonicContact OE2-NZ 3.48Å; E301-H305 PolarHBondContact O-CD2 3.06Å; E301-H305 PolarHBondContact O-N 2.89Å |
| 302 | K | 96.9 | Very high | 97.5 | Very high | 119 Ų | 119 | 93.4 Ų | 93.4 | 52% | 0.517 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -57.8 | -45.4 | 173 | -69.5 | 178 | -176.2 | -176.6 | 0 | 111.8 | S298 L299 K304 H305 D306 | S298-K302 WeakPolarHBondContact O-CG 3.46Å; S298-K302 PolarHBondContact O-N 2.95Å; L299-K302 PolarHBondContact O-N 3.45Å; K302-K304 VanDerWaalsContact C-N 3.3Å; K302-K304 PolarHBondContact O-N 3.35Å; K302-H305 WeakPolarHBondContact O-CB 3.37Å; K302-H305 PolarHBondContact O-N 3.27Å; K302-H305 VanDerWaalsContact O-N 3.1Å; K302-D306 PolarHBondContact O-N 3.16Å |
| 303 | G | 96.9 | Very high | 97.4 | Very high | 30 Ų | 30 | 93.4 Ų | 93.4 | 31% | 0.309 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -35.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L299 L300 E301 D306 T307 | L299-G303 PolarHBondContact O-N 3.35Å; L300-G303 PolarHBondContact O-N 3.26Å; E301-G303 VanDerWaalsContact C-N 3.33Å; E301-G303 PolarHBondContact O-N 3.45Å; G303-D306 PolarHBondContact O-N 3.44Å; G303-T307 WeakPolarHBondContact O-CB 3.46Å; G303-T307 PolarHBondContact O-N 2.97Å; G303-T307 PolarHBondContact O-OG1 3.49Å |
| 304 | K | 96.6 | Very high | 97.4 | Very high | 127 Ų | 127 | 91.1 Ų | 91.1 | 55% | 0.552 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.3 | -43.3 | 172.8 | -68.2 | 174.6 | -171.6 | 171.4 | 0 | 111.6 | L300 E301 K302 T307 G308 | L300-K304 WeakPolarHBondContact O-CG 3.38Å; L300-K304 PolarHBondContact O-N 3.38Å; E301-K304 WeakPolarHBondContact O-CB 3.32Å; E301-K304 PolarHBondContact O-N 2.87Å; E301-K304 VanDerWaalsContact O-N 3.16Å; E301-K304 IonicContact OE1-NZ 3.37Å; E301-K304 PolarHBondContact OE1-NZ 2.96Å; E301-K304 IonicContact OE2-NZ 3.48Å; K302-K304 VanDerWaalsContact C-N 3.3Å; K302-K304 PolarHBondContact O-N 3.35Å; K304-T307 PolarHBondContact O-N 3.29Å; K304-G308 PolarHBondContact O-N 3.47Å |
| 305 | H | 96.8 | Very high | 97.4 | Very high | 128 Ų | 128 | 91.5 Ų | 91.5 | 59% | 0.593 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -62.3 | -43.7 | 176.1 | -63.7 | -49.1 | 0 | 0 | 0 | 111.8 | E301 K302 G308 L309 | E301-H305 PolarHBondContact O-CD2 3.06Å; E301-H305 PolarHBondContact O-N 2.89Å; K302-H305 WeakPolarHBondContact O-CB 3.37Å; K302-H305 PolarHBondContact O-N 3.27Å; K302-H305 VanDerWaalsContact O-N 3.1Å; H305-G308 PolarHBondContact O-N 2.89Å; H305-L309 PolarHBondContact O-N 3.42Å |
| 306 | D | 97.3 | Very high | 97.3 | Very high | 100 Ų | 100 | 91.8 Ų | 91.8 | 54% | 0.535 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.7 | -42.4 | 177.1 | -65.9 | -29.1 | 0 | 0 | 0 | 111.5 | K302 G303 L309 V310 | K302-D306 PolarHBondContact O-N 3.16Å; G303-D306 PolarHBondContact O-N 3.44Å; D306-L309 WeakPolarHBondContact O-CB 3.5Å; D306-L309 PolarHBondContact O-N 3.43Å; D306-V310 WeakPolarHBondContact O-CG2 3.47Å; D306-V310 PolarHBondContact O-N 3.47Å |
| 307 | T | 96.6 | Very high | 97.2 | Very high | 81 Ų | 81 | 91.6 Ų | 91.6 | 50% | 0.497 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.4 | -45.5 | 175.2 | -53.6 | 0 | 0 | 0 | 0 | 110.9 | G303 K304 L309 V310 D311 | G303-T307 WeakPolarHBondContact O-CB 3.46Å; G303-T307 PolarHBondContact O-N 2.97Å; G303-T307 PolarHBondContact O-OG1 3.49Å; K304-T307 PolarHBondContact O-N 3.29Å; T307-L309 VanDerWaalsContact C-N 3.3Å; T307-L309 PolarHBondContact O-N 3.29Å; T307-V310 PolarHBondContact O-N 3Å; T307-D311 PolarHBondContact O-N 3.35Å |
| 308 | G | 97.1 | Very high | 97.1 | Very high | 39 Ų | 39 | 90.9 Ų | 90.9 | 40% | 0.402 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.6 | -35.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | K304 H305 A312 | K304-G308 PolarHBondContact O-N 3.47Å; H305-G308 PolarHBondContact O-N 2.89Å; G308-A312 WeakPolarHBondContact O-CB 3.49Å; G308-A312 PolarHBondContact O-N 3.47Å |
| 309 | L | 97.9 | Very high | 97 | Very high | 103 Ų | 103 | 93 Ų | 93 | 54% | 0.539 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.2 | -45 | 172.7 | 177.1 | 62.8 | 0 | 0 | 0 | 111.4 | H305 D306 T307 D311 A312 L313 | H305-L309 PolarHBondContact O-N 3.42Å; D306-L309 WeakPolarHBondContact O-CB 3.5Å; D306-L309 PolarHBondContact O-N 3.43Å; T307-L309 VanDerWaalsContact C-N 3.3Å; T307-L309 PolarHBondContact O-N 3.29Å; L309-D311 VanDerWaalsContact C-N 3.34Å; L309-D311 PolarHBondContact O-N 3.24Å; L309-A312 PolarHBondContact O-N 2.83Å; L309-L313 HydrophobicContact CD1-CD1 4.42Å; L309-L313 HydrophobicContact CD1-CG 4.41Å; L309-L313 HydrophobicContact CG-CD1 4.27Å; L309-L313 WeakPolarHBondContact O-CG 3.26Å; L309-L313 PolarHBondContact O-N 3.06Å |
| 310 | V | 97.9 | Very high | 97 | Very high | 78 Ų | 78 | 92.8 Ų | 92.8 | 47% | 0.473 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.7 | -45.2 | 175.9 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | D306 T307 A312 L313 L314 | D306-V310 WeakPolarHBondContact O-CG2 3.47Å; D306-V310 PolarHBondContact O-N 3.47Å; T307-V310 PolarHBondContact O-N 3Å; V310-A312 VanDerWaalsContact C-N 3.34Å; V310-A312 PolarHBondContact O-N 3.41Å; V310-L313 PolarHBondContact O-N 3.36Å; V310-L314 HydrophobicContact CG1-CD1 3.89Å; V310-L314 HydrophobicContact CG1-CG 4.28Å; V310-L314 WeakPolarHBondContact O-CB 3.27Å; V310-L314 WeakPolarHBondContact O-CG 3.37Å; V310-L314 PolarHBondContact O-N 3.18Å |
| 311 | D | 97.5 | Very high | 96.9 | Very high | 97 Ų | 97 | 92.1 Ų | 92.1 | 52% | 0.519 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.3 | -41.7 | 177.1 | -73.1 | -19.7 | 0 | 0 | 0 | 112.1 | T307 L309 L314 K315 | T307-D311 PolarHBondContact O-N 3.35Å; L309-D311 VanDerWaalsContact C-N 3.34Å; L309-D311 PolarHBondContact O-N 3.24Å; D311-L314 PolarHBondContact O-N 2.87Å; D311-K315 VanDerWaalsContact O-CB 3.32Å; D311-K315 WeakPolarHBondContact O-CB 3.25Å; D311-K315 PolarHBondContact O-N 3.25Å |
| 312 | A | 97.2 | Very high | 96.8 | Very high | 50 Ų | 50 | 91.4 Ų | 91.4 | 41% | 0.413 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | G308 L309 V310 K315 Q316 | G308-A312 WeakPolarHBondContact O-CB 3.49Å; G308-A312 PolarHBondContact O-N 3.47Å; L309-A312 PolarHBondContact O-N 2.83Å; V310-A312 VanDerWaalsContact C-N 3.34Å; V310-A312 PolarHBondContact O-N 3.41Å; A312-K315 PolarHBondContact O-N 3.42Å; A312-Q316 WeakPolarHBondContact O-CG 3.42Å; A312-Q316 PolarHBondContact O-N 3.34Å |
| 313 | L | 97.2 | Very high | 96.6 | Very high | 92 Ų | 92 | 91.5 Ų | 91.5 | 48% | 0.482 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.4 | -43.4 | 176.6 | -71.3 | 173.9 | 0 | 0 | 0 | 112 | L309 V310 K315 Q316 Q317 | L309-L313 HydrophobicContact CD1-CD1 4.42Å; L309-L313 HydrophobicContact CD1-CG 4.41Å; L309-L313 HydrophobicContact CG-CD1 4.27Å; L309-L313 WeakPolarHBondContact O-CG 3.26Å; L309-L313 PolarHBondContact O-N 3.06Å; V310-L313 PolarHBondContact O-N 3.36Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.07Å; L313-Q316 PolarHBondContact O-N 3.46Å; L313-Q317 WeakPolarHBondContact O-CB 3.46Å; L313-Q317 PolarHBondContact O-N 2.78Å |
| 314 | L | 97.2 | Very high | 96.4 | Very high | 90 Ų | 90 | 95.3 Ų | 95.3 | 47% | 0.471 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 174.8 | -74.3 | 173.7 | 0 | 0 | 0 | 111.4 | V310 D311 Q317 S318 | V310-L314 HydrophobicContact CG1-CD1 3.89Å; V310-L314 HydrophobicContact CG1-CG 4.28Å; V310-L314 WeakPolarHBondContact O-CB 3.27Å; V310-L314 WeakPolarHBondContact O-CG 3.37Å; V310-L314 PolarHBondContact O-N 3.18Å; D311-L314 PolarHBondContact O-N 2.87Å; L314-Q317 PolarHBondContact O-N 2.89Å; L314-S318 WeakPolarHBondContact O-CB 3.35Å; L314-S318 PolarHBondContact O-N 3.05Å |
| 315 | K | 97.1 | Very high | 96.3 | Very high | 136 Ų | 136 | 96.1 Ų | 96.1 | 59% | 0.591 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.8 | -46.2 | 174.7 | -169.1 | 175.2 | -176.9 | 177.4 | 0 | 111.3 | D311 A312 L313 Q317 S318 Q319 | D311-K315 VanDerWaalsContact O-CB 3.32Å; D311-K315 WeakPolarHBondContact O-CB 3.25Å; D311-K315 PolarHBondContact O-N 3.25Å; A312-K315 PolarHBondContact O-N 3.42Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.07Å; K315-Q317 PolarHBondContact O-N 3.23Å; K315-S318 PolarHBondContact O-N 3.5Å; K315-S318 PolarHBondContact O-OG 2.89Å; K315-Q319 WeakPolarHBondContact O-CG 3.41Å; K315-Q319 PolarHBondContact O-N 2.91Å |
| 316 | Q | 96.4 | Very high | 96 | Very high | 121 Ų | 121 | 95.3 Ų | 95.3 | 57% | 0.565 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60 | -43.7 | 174.5 | -74.2 | -176.9 | -19.1 | 0 | 0 | 112.1 | A312 L313 S318 Q319 M320 | A312-Q316 WeakPolarHBondContact O-CG 3.42Å; A312-Q316 PolarHBondContact O-N 3.34Å; L313-Q316 PolarHBondContact O-N 3.46Å; Q316-S318 VanDerWaalsContact C-N 3.34Å; Q316-S318 PolarHBondContact O-N 3.47Å; Q316-Q319 PolarHBondContact O-N 3.23Å; Q316-M320 WeakPolarHBondContact O-CB 3.49Å; Q316-M320 PolarHBondContact O-N 3.38Å |
| 317 | Q | 96.3 | Very high | 95.6 | Very high | 95 Ų | 95 | 95.5 Ų | 95.5 | 44% | 0.444 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 176.3 | -173.4 | -175.3 | 6.8 | 0 | 0 | 111.6 | L313 L314 K315 M320 Q321 | L313-Q317 WeakPolarHBondContact O-CB 3.46Å; L313-Q317 PolarHBondContact O-N 2.78Å; L314-Q317 PolarHBondContact O-N 2.89Å; K315-Q317 PolarHBondContact O-N 3.23Å; Q317-M320 PolarHBondContact O-N 2.93Å; Q317-Q321 WeakPolarHBondContact O-CG 3.37Å; Q317-Q321 PolarHBondContact O-N 3.41Å |
| 318 | S | 96.3 | Very high | 95.2 | Very high | 54 Ų | 54 | 93.5 Ų | 93.5 | 38% | 0.378 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.1 | -39.7 | 178.2 | 76.3 | 0 | 0 | 0 | 0 | 112.6 | L314 K315 Q316 Q321 T322 | L314-S318 WeakPolarHBondContact O-CB 3.35Å; L314-S318 PolarHBondContact O-N 3.05Å; K315-S318 PolarHBondContact O-N 3.5Å; K315-S318 PolarHBondContact O-OG 2.89Å; Q316-S318 VanDerWaalsContact C-N 3.34Å; Q316-S318 PolarHBondContact O-N 3.47Å; S318-Q321 PolarHBondContact O-N 3.41Å; S318-T322 WeakPolarHBondContact O-CB 3.41Å; S318-T322 PolarHBondContact O-N 2.69Å; S318-T322 PolarHBondContact O-OG1 2.88Å |
| 319 | Q | 96.3 | Very high | 94.5 | Very high | 106 Ų | 106 | 97.7 Ų | 97.7 | 50% | 0.495 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.6 | -46.3 | 175.5 | -74 | 176 | -16.6 | 0 | 0 | 110.7 | K315 Q316 Q321 T322 M323 | K315-Q319 WeakPolarHBondContact O-CG 3.41Å; K315-Q319 PolarHBondContact O-N 2.91Å; Q316-Q319 PolarHBondContact O-N 3.23Å; Q319-Q321 PolarHBondContact O-N 2.98Å; Q319-T322 WeakPolarHBondContact O-CB 3.44Å; Q319-T322 PolarHBondContact O-N 3.08Å; Q319-T322 VanDerWaalsContact O-N 3.15Å; Q319-M323 PolarHBondContact O-N 2.94Å |
| 320 | M | 95.9 | Very high | 93.6 | Very high | 107 Ų | 107 | 99 Ų | 99 | 53% | 0.527 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.1 | -43.5 | 176.7 | -174.6 | 176.1 | 63.2 | 0 | 0 | 112 | Q316 Q317 T322 M323 L324 | Q316-M320 WeakPolarHBondContact O-CB 3.49Å; Q316-M320 PolarHBondContact O-N 3.38Å; Q317-M320 PolarHBondContact O-N 2.93Å; M320-T322 VanDerWaalsContact C-N 3.27Å; M320-T322 PolarHBondContact O-N 3.46Å; M320-M323 PolarHBondContact O-N 2.87Å; M320-L324 HydrophobicContact CG-CD1 4.33Å; M320-L324 WeakPolarHBondContact O-CB 3.48Å; M320-L324 WeakPolarHBondContact O-CG 3.35Å; M320-L324 PolarHBondContact O-N 3.44Å |
| 321 | Q | 96.1 | Very high | 92.3 | Very high | 94 Ų | 94 | 101.3 Ų | 101.3 | 44% | 0.439 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61 | -37.2 | 173.7 | -77.6 | -177.6 | 0.5 | 0 | 0 | 112.4 | Q317 S318 Q319 L324 K325 | Q317-Q321 WeakPolarHBondContact O-CG 3.37Å; Q317-Q321 PolarHBondContact O-N 3.41Å; S318-Q321 PolarHBondContact O-N 3.41Å; Q319-Q321 PolarHBondContact O-N 2.98Å; Q321-L324 PolarHBondContact O-N 2.93Å; Q321-K325 WeakPolarHBondContact O-CB 3.24Å; Q321-K325 WeakPolarHBondContact O-CG 3.36Å; Q321-K325 PolarHBondContact O-N 3.37Å |
| 322 | T | 94.8 | Very high | 90.7 | Very high | 72 Ų | 72 | 99.3 Ų | 99.3 | 44% | 0.442 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.5 | -45.6 | 177.3 | -56.4 | 0 | 0 | 0 | 0 | 111 | S318 Q319 M320 L324 K325 Q326 | S318-T322 WeakPolarHBondContact O-CB 3.41Å; S318-T322 PolarHBondContact O-N 2.69Å; S318-T322 PolarHBondContact O-OG1 2.88Å; Q319-T322 WeakPolarHBondContact O-CB 3.44Å; Q319-T322 PolarHBondContact O-N 3.08Å; Q319-T322 VanDerWaalsContact O-N 3.15Å; M320-T322 VanDerWaalsContact C-N 3.27Å; M320-T322 PolarHBondContact O-N 3.46Å; T322-L324 VanDerWaalsContact C-N 3.35Å; T322-L324 PolarHBondContact O-N 3.25Å; T322-K325 PolarHBondContact O-N 2.86Å; T322-Q326 WeakPolarHBondContact O-CG 3.49Å; T322-Q326 PolarHBondContact O-N 2.83Å |
| 323 | M | 93.6 | Very high | 89 | Confident | 122 Ų | 122 | 99.5 Ų | 99.5 | 60% | 0.601 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.3 | -41.8 | 174.6 | -70.1 | -162.3 | -65.3 | 0 | 0 | 111.8 | Q319 M320 K325 Q326 L327 | Q319-M323 PolarHBondContact O-N 2.94Å; M320-M323 PolarHBondContact O-N 2.87Å; M323-K325 PolarHBondContact O-N 3.29Å; M323-Q326 PolarHBondContact O-N 3.38Å; M323-L327 WeakPolarHBondContact O-CB 3.46Å; M323-L327 PolarHBondContact O-N 2.76Å |
| 324 | L | 92.8 | Very high | 87.2 | Confident | 110 Ų | 110 | 102 Ų | 102 | 58% | 0.576 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.8 | -42.1 | 174.8 | -76.9 | 169.6 | 0 | 0 | 0 | 112.2 | M320 Q321 T322 L327 G328 | M320-L324 HydrophobicContact CG-CD1 4.33Å; M320-L324 WeakPolarHBondContact O-CB 3.48Å; M320-L324 WeakPolarHBondContact O-CG 3.35Å; M320-L324 PolarHBondContact O-N 3.44Å; Q321-L324 PolarHBondContact O-N 2.93Å; T322-L324 VanDerWaalsContact C-N 3.35Å; T322-L324 PolarHBondContact O-N 3.25Å; L324-L327 PolarHBondContact O-N 3.33Å; L324-G328 PolarHBondContact O-N 2.99Å |
| 325 | K | 93.4 | Very high | 85.4 | Confident | 143 Ų | 143 | 104.1 Ų | 104.1 | 62% | 0.622 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63 | -44.4 | 174.6 | -77.2 | 176.1 | -178.4 | 177.2 | 0 | 111.8 | Q321 T322 M323 G328 Q329 | Q321-K325 WeakPolarHBondContact O-CB 3.24Å; Q321-K325 WeakPolarHBondContact O-CG 3.36Å; Q321-K325 PolarHBondContact O-N 3.37Å; T322-K325 PolarHBondContact O-N 2.86Å; M323-K325 PolarHBondContact O-N 3.29Å; K325-G328 PolarHBondContact O-N 2.99Å; K325-Q329 WeakPolarHBondContact O-CB 3.32Å; K325-Q329 VanDerWaalsContact O-CG 3.29Å; K325-Q329 WeakPolarHBondContact O-CG 3.47Å; K325-Q329 PolarHBondContact O-N 3.45Å |
| 326 | Q | 92.1 | Very high | 83.3 | Confident | 111 Ų | 111 | 106 Ų | 106 | 52% | 0.519 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.2 | -43 | 177.1 | -73.4 | 174.9 | -8.5 | 0 | 0 | 111.7 | T322 M323 Q329 Q330 | T322-Q326 WeakPolarHBondContact O-CG 3.49Å; T322-Q326 PolarHBondContact O-N 2.83Å; M323-Q326 PolarHBondContact O-N 3.38Å; Q326-Q329 PolarHBondContact O-N 3.48Å; Q326-Q330 PolarHBondContact O-N 2.89Å |
| 327 | L | 88.3 | Confident | 80.9 | Confident | 105 Ų | 105 | 104.2 Ų | 104.2 | 55% | 0.55 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66 | -42.7 | 177.6 | -164.7 | 70.1 | 0 | 0 | 0 | 111.2 | M323 L324 Q329 Q330 Q331 | M323-L327 WeakPolarHBondContact O-CB 3.46Å; M323-L327 PolarHBondContact O-N 2.76Å; L324-L327 PolarHBondContact O-N 3.33Å; L327-Q329 VanDerWaalsContact C-N 3.32Å; L327-Q329 PolarHBondContact O-N 2.98Å; L327-Q330 PolarHBondContact O-N 3.13Å; L327-Q331 WeakPolarHBondContact O-CB 3.5Å; L327-Q331 PolarHBondContact O-N 2.84Å |
| 328 | G | 87.1 | Confident | 78.4 | Confident | 38 Ų | 38 | 101 Ų | 101 | 39% | 0.392 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.2 | -38.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L324 K325 S332 | L324-G328 PolarHBondContact O-N 2.99Å; K325-G328 PolarHBondContact O-N 2.99Å; G328-S332 WeakPolarHBondContact O-CB 3.29Å; G328-S332 PolarHBondContact O-N 2.93Å |
| 329 | Q | 82.8 | Confident | 76.2 | Confident | 128 Ų | 128 | 100.2 Ų | 100.2 | 60% | 0.598 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.3 | -45.4 | 173.3 | -76.9 | 175.6 | -2.4 | 0 | 0 | 111.9 | K325 Q326 L327 Q331 S332 A333 | K325-Q329 WeakPolarHBondContact O-CB 3.32Å; K325-Q329 VanDerWaalsContact O-CG 3.29Å; K325-Q329 WeakPolarHBondContact O-CG 3.47Å; K325-Q329 PolarHBondContact O-N 3.45Å; Q326-Q329 PolarHBondContact O-N 3.48Å; L327-Q329 VanDerWaalsContact C-N 3.32Å; L327-Q329 PolarHBondContact O-N 2.98Å; Q329-Q331 VanDerWaalsContact C-N 3.34Å; Q329-Q331 PolarHBondContact O-N 3.4Å; Q329-S332 PolarHBondContact O-N 3.09Å; Q329-S332 PolarHBondContact O-OG 3.35Å; Q329-A333 WeakPolarHBondContact O-CB 3.33Å; Q329-A333 PolarHBondContact O-N 3.02Å |
| 330 | Q | 78.3 | Confident | 74.5 | Confident | 131 Ų | 131 | 100.3 Ų | 100.3 | 61% | 0.612 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -58.4 | -45 | 174 | -89.4 | -179.5 | -19.8 | 0 | 0 | 111.7 | Q326 L327 S332 A333 Q334 | Q326-Q330 PolarHBondContact O-N 2.89Å; L327-Q330 PolarHBondContact O-N 3.13Å; Q330-S332 PolarHBondContact O-N 3.21Å; Q330-A333 PolarHBondContact O-N 3.3Å; Q330-Q334 WeakPolarHBondContact O-CB 3.36Å; Q330-Q334 PolarHBondContact O-N 3.25Å |
| 331 | Q | 72.3 | Confident | 72.7 | Confident | 126 Ų | 126 | 102 Ų | 102 | 59% | 0.589 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -63.1 | -42.7 | 177.3 | -140.5 | 174.7 | 25.9 | 0 | 0 | 111.1 | L327 Q329 A333 Q334 I335 | L327-Q331 WeakPolarHBondContact O-CB 3.5Å; L327-Q331 PolarHBondContact O-N 2.84Å; Q329-Q331 VanDerWaalsContact C-N 3.34Å; Q329-Q331 PolarHBondContact O-N 3.4Å; Q331-A333 VanDerWaalsContact C-N 3.33Å; Q331-A333 PolarHBondContact O-N 3.13Å; Q331-Q334 PolarHBondContact O-N 3.11Å; Q331-I335 WeakPolarHBondContact O-CD1 3.48Å; Q331-I335 WeakPolarHBondContact O-CG1 3.45Å; Q331-I335 PolarHBondContact O-N 2.96Å |
| 332 | S | 62.6 | Low | 71.2 | Confident | 54 Ų | 54 | 101.7 Ų | 101.7 | 38% | 0.378 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.8 | -34.2 | 175.7 | 81.3 | 0 | 0 | 0 | 0 | 113.1 | G328 Q329 Q330 K336 | G328-S332 WeakPolarHBondContact O-CB 3.29Å; G328-S332 PolarHBondContact O-N 2.93Å; Q329-S332 PolarHBondContact O-N 3.09Å; Q329-S332 PolarHBondContact O-OG 3.35Å; Q330-S332 PolarHBondContact O-N 3.21Å; S332-K336 WeakPolarHBondContact O-CB 3.24Å; S332-K336 WeakPolarHBondContact O-CG 3.38Å; S332-K336 PolarHBondContact O-N 3.34Å |
| 333 | A | 61.8 | Low | 70 | Confident | 54 Ų | 54 | 103 Ų | 103 | 45% | 0.446 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -72.7 | -40.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111 | Q329 Q330 Q331 I335 K336 S337 | Q329-A333 WeakPolarHBondContact O-CB 3.33Å; Q329-A333 PolarHBondContact O-N 3.02Å; Q330-A333 PolarHBondContact O-N 3.3Å; Q331-A333 VanDerWaalsContact C-N 3.33Å; Q331-A333 PolarHBondContact O-N 3.13Å; A333-I335 VanDerWaalsContact C-N 3.33Å; A333-I335 PolarHBondContact O-N 3.45Å; A333-K336 CarbonylContact O-C 3.3Å; A333-K336 PolarHBondContact O-N 2.89Å; A333-S337 VanDerWaalsContact O-CB 3.27Å; A333-S337 WeakPolarHBondContact O-CB 3.49Å; A333-S337 PolarHBondContact O-N 3.15Å; A333-S337 PolarHBondContact O-OG 2.9Å; A333-S337 VanDerWaalsContact O-OG 3.09Å |
| 334 | Q | 59.2 | Low | 69.1 | Low | 146 Ų | 146 | 101 Ų | 101 | 68% | 0.682 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.8 | -37.6 | 173.4 | -117.2 | 175.5 | -11.2 | 0 | 0 | 112.5 | Q330 Q331 S337 | Q330-Q334 WeakPolarHBondContact O-CB 3.36Å; Q330-Q334 PolarHBondContact O-N 3.25Å; Q331-Q334 PolarHBondContact O-N 3.11Å; Q334-S337 PolarHBondContact O-OG 3.47Å |
| 335 | I | 59 | Low | 68.6 | Low | 134 Ų | 134 | 100.4 Ų | 100.4 | 69% | 0.687 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -71.3 | -37.1 | 175.8 | -66 | 163.6 | 0 | 0 | 0 | 111 | Q331 A333 | Q331-I335 WeakPolarHBondContact O-CD1 3.48Å; Q331-I335 WeakPolarHBondContact O-CG1 3.45Å; Q331-I335 PolarHBondContact O-N 2.96Å; A333-I335 VanDerWaalsContact C-N 3.33Å; A333-I335 PolarHBondContact O-N 3.45Å |
| 336 | K | 54.9 | Low | 68 | Low | 176 Ų | 176 | 97.6 Ų | 97.6 | 77% | 0.765 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -78.3 | -23.7 | 176.8 | -75.6 | 176.8 | 177.3 | 179.4 | 0 | 113.8 | S332 A333 G338 | S332-K336 WeakPolarHBondContact O-CB 3.24Å; S332-K336 WeakPolarHBondContact O-CG 3.38Å; S332-K336 PolarHBondContact O-N 3.34Å; A333-K336 CarbonylContact O-C 3.3Å; A333-K336 PolarHBondContact O-N 2.89Å; K336-G338 VanDerWaalsContact C-N 3.27Å |
| 337 | S | 44.3 | Very low | 67.5 | Low | 83 Ų | 83 | 98.7 Ų | 98.7 | 58% | 0.58 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | 23.8 | 172.6 | 76.1 | 0 | 0 | 0 | 0 | 112.5 | A333 Q334 S339 | A333-S337 VanDerWaalsContact O-CB 3.27Å; A333-S337 WeakPolarHBondContact O-CB 3.49Å; A333-S337 PolarHBondContact O-N 3.15Å; A333-S337 PolarHBondContact O-OG 2.9Å; A333-S337 VanDerWaalsContact O-OG 3.09Å; Q334-S337 PolarHBondContact O-OG 3.47Å; S337-S339 PolarHBondContact O-N 3.3Å; S337-S339 VanDerWaalsContact O-N 3.08Å |
| 338 | G | 44.3 | Very low | 67.3 | Low | 27 Ų | 27 | 100.3 Ų | 100.3 | 28% | 0.278 | 54% | 0.54 | S | S | . | . | trans | -47.7 | 122.3 | 163.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | K336 | K336-G338 VanDerWaalsContact C-N 3.27Š| ||
| 339 | S | 51.3 | Low | 67.4 | Low | 37 Ų | 37 | 102.9 Ų | 102.9 | 26% | 0.259 | 55% | 0.545 | S | S | . | . | trans | -37 | 138.3 | -176 | 166 | 0 | 0 | 0 | 0 | 111.2 | S337 E341 N342 N343 | S337-S339 PolarHBondContact O-N 3.3Å; S337-S339 VanDerWaalsContact O-N 3.08Å; S339-E341 PolarHBondContact O-N 2.87Å; S339-E341 VanDerWaalsContact OG-CB 3.23Å; S339-E341 WeakPolarHBondContact OG-CB 3.47Å; S339-E341 WeakPolarHBondContact OG-CG 3.4Å; S339-E341 PolarHBondContact OG-N 3.39Å; S339-E341 PolarHBondContact OG-OE2 2.86Å; S339-N342 WeakPolarHBondContact O-CA 3.24Å; S339-N342 WeakPolarHBondContact O-CB 3.46Å; S339-N342 PolarHBondContact O-N 2.9Å; S339-N343 PolarHBondContact O-N 2.95Å | ||
| 340 | P | 59.3 | Low | 67.6 | Low | 108 Ų | 108 | 103.9 Ų | 103.9 | 70% | 0.701 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -52.9 | -23.7 | 171.3 | 23 | -32.6 | 0 | 0 | 0 | 111.9 | C344 | P340-C344 WeakPolarHBondContact O-CB 3.48Å; P340-C344 PolarHBondContact O-N 3.46Å |
| 341 | E | 57.8 | Low | 68.2 | Low | 142 Ų | 142 | 103.5 Ų | 103.5 | 66% | 0.664 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -68.3 | -38.2 | 172.1 | -57.7 | 167.8 | 143.4 | 0 | 0 | 112.5 | S339 C344 L345 | S339-E341 PolarHBondContact O-N 2.87Å; S339-E341 VanDerWaalsContact OG-CB 3.23Å; S339-E341 WeakPolarHBondContact OG-CB 3.47Å; S339-E341 WeakPolarHBondContact OG-CG 3.4Å; S339-E341 PolarHBondContact OG-N 3.39Å; S339-E341 PolarHBondContact OG-OE2 2.86Å; E341-C344 PolarHBondContact O-N 2.8Å; E341-L345 WeakPolarHBondContact O-CB 3.47Å; E341-L345 PolarHBondContact O-N 2.96Å |
| 342 | N | 65.8 | Low | 68.9 | Low | 89 Ų | 89 | 101.5 Ų | 101.5 | 48% | 0.476 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -67.4 | -41.6 | 176.1 | -73.2 | -12.8 | 0 | 0 | 0 | 110.9 | S339 L345 I346 | S339-N342 WeakPolarHBondContact O-CA 3.24Å; S339-N342 WeakPolarHBondContact O-CB 3.46Å; S339-N342 PolarHBondContact O-N 2.9Å; N342-L345 PolarHBondContact O-N 2.71Å; N342-I346 WeakPolarHBondContact O-CB 3.29Å; N342-I346 WeakPolarHBondContact O-CD1 3.31Å; N342-I346 WeakPolarHBondContact O-CG1 3.36Å; N342-I346 PolarHBondContact O-N 3.27Å |
| 343 | N | 69.6 | Low | 70.3 | Confident | 100 Ų | 100 | 102.8 Ų | 102.8 | 54% | 0.535 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.1 | -40.7 | 175 | -82.6 | -29 | 0 | 0 | 0 | 112.3 | S339 I346 Q347 | S339-N343 PolarHBondContact O-N 2.95Å; N343-I346 PolarHBondContact O-N 2.96Å; N343-Q347 WeakPolarHBondContact O-CB 3.27Å; N343-Q347 PolarHBondContact O-N 3.42Å |
| 344 | C | 75 | Confident | 71.7 | Confident | 79 Ų | 79 | 103 Ų | 103 | 53% | 0.534 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.4 | -41.3 | 175 | -172.8 | 0 | 0 | 0 | 0 | 112 | P340 E341 Q347 K348 | P340-C344 WeakPolarHBondContact O-CB 3.48Å; P340-C344 PolarHBondContact O-N 3.46Å; E341-C344 PolarHBondContact O-N 2.8Å; C344-Q347 PolarHBondContact O-N 3.21Å; C344-K348 WeakPolarHBondContact O-CB 3.27Å; C344-K348 PolarHBondContact O-N 3.48Å |
| 345 | L | 81.4 | Confident | 73.1 | Confident | 97 Ų | 97 | 102.4 Ų | 102.4 | 51% | 0.508 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.5 | -43.4 | 176.2 | -170.9 | 73.9 | 0 | 0 | 0 | 111.2 | E341 N342 Q347 K348 L349 | E341-L345 WeakPolarHBondContact O-CB 3.47Å; E341-L345 PolarHBondContact O-N 2.96Å; N342-L345 PolarHBondContact O-N 2.71Å; L345-Q347 VanDerWaalsContact C-N 3.3Å; L345-Q347 PolarHBondContact O-N 3.47Å; L345-K348 PolarHBondContact O-N 3.26Å; L345-L349 HydrophobicContact CG-CD1 4.19Å; L345-L349 WeakPolarHBondContact O-CB 3.38Å; L345-L349 VanDerWaalsContact O-CG 3.26Å; L345-L349 WeakPolarHBondContact O-CG 3.47Å; L345-L349 PolarHBondContact O-N 3.42Å |
| 346 | I | 81.1 | Confident | 74.6 | Confident | 84 Ų | 84 | 101.3 Ų | 101.3 | 43% | 0.431 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -59.9 | -42.5 | 173.8 | -71.9 | 163.7 | 0 | 0 | 0 | 110.3 | N342 N343 L349 K350 | N342-I346 WeakPolarHBondContact O-CB 3.29Å; N342-I346 WeakPolarHBondContact O-CD1 3.31Å; N342-I346 WeakPolarHBondContact O-CG1 3.36Å; N342-I346 PolarHBondContact O-N 3.27Å; N343-I346 PolarHBondContact O-N 2.96Å; I346-L349 PolarHBondContact O-N 2.92Å; I346-K350 HydrophobicContact CG2-CD 4.37Å; I346-K350 WeakPolarHBondContact O-CB 3.22Å; I346-K350 VanDerWaalsContact O-CG 3.32Å; I346-K350 WeakPolarHBondContact O-CG 3.25Å; I346-K350 PolarHBondContact O-N 2.88Å |
| 347 | Q | 80.8 | Confident | 76.2 | Confident | 134 Ų | 134 | 97.3 Ų | 97.3 | 63% | 0.626 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -68.2 | -39.4 | 178.9 | -158.5 | 170.3 | 22.5 | 0 | 0 | 112 | N343 C344 L345 K350 L351 | N343-Q347 WeakPolarHBondContact O-CB 3.27Å; N343-Q347 PolarHBondContact O-N 3.42Å; C344-Q347 PolarHBondContact O-N 3.21Å; L345-Q347 VanDerWaalsContact C-N 3.3Å; L345-Q347 PolarHBondContact O-N 3.47Å; Q347-K350 PolarHBondContact O-N 3.47Å; Q347-L351 PolarHBondContact O-N 3.05Å |
| 348 | K | 85.6 | Confident | 78.4 | Confident | 139 Ų | 139 | 96.3 Ų | 96.3 | 60% | 0.604 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.6 | -41.5 | 174.4 | -171.7 | 173.4 | -177.4 | 176.7 | 0 | 112.3 | C344 L345 L351 M352 | C344-K348 WeakPolarHBondContact O-CB 3.27Å; C344-K348 PolarHBondContact O-N 3.48Å; L345-K348 PolarHBondContact O-N 3.26Å; K348-L351 PolarHBondContact O-N 3.5Å; K348-M352 WeakPolarHBondContact O-CB 3.32Å; K348-M352 PolarHBondContact O-N 3.4Å |
| 349 | L | 87.2 | Confident | 80.6 | Confident | 92 Ų | 92 | 100 Ų | 100 | 48% | 0.482 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.8 | -41.1 | 174.7 | -73.6 | 170.6 | 0 | 0 | 0 | 111.2 | L345 I346 L351 M352 V353 | L345-L349 HydrophobicContact CG-CD1 4.19Å; L345-L349 WeakPolarHBondContact O-CB 3.38Å; L345-L349 VanDerWaalsContact O-CG 3.26Å; L345-L349 WeakPolarHBondContact O-CG 3.47Å; L345-L349 PolarHBondContact O-N 3.42Å; I346-L349 PolarHBondContact O-N 2.92Å; L349-L351 PolarHBondContact O-N 3.43Å; L349-M352 PolarHBondContact O-N 3.32Å; L349-V353 WeakPolarHBondContact O-CB 3.38Å; L349-V353 VanDerWaalsContact O-CG2 3.25Å; L349-V353 WeakPolarHBondContact O-CG2 3.31Å; L349-V353 PolarHBondContact O-N 3.33Å |
| 350 | K | 88.5 | Confident | 82.5 | Confident | 149 Ų | 149 | 102.1 Ų | 102.1 | 65% | 0.648 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.5 | -43.1 | 174 | -77.4 | 179 | 178.7 | -174.3 | 0 | 112.6 | I346 Q347 V353 A354 | I346-K350 HydrophobicContact CG2-CD 4.37Å; I346-K350 WeakPolarHBondContact O-CB 3.22Å; I346-K350 VanDerWaalsContact O-CG 3.32Å; I346-K350 WeakPolarHBondContact O-CG 3.25Å; I346-K350 PolarHBondContact O-N 2.88Å; Q347-K350 PolarHBondContact O-N 3.47Å; K350-V353 PolarHBondContact O-N 3.48Å; K350-A354 PolarHBondContact O-N 2.86Å |
| 351 | L | 90.7 | Very high | 84 | Confident | 123 Ų | 123 | 103 Ų | 103 | 64% | 0.644 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.8 | -45.9 | 176.1 | -109.4 | 161.8 | 0 | 0 | 0 | 111.6 | Q347 K348 L349 V353 A354 E355 | Q347-L351 PolarHBondContact O-N 3.05Å; K348-L351 PolarHBondContact O-N 3.5Å; L349-L351 PolarHBondContact O-N 3.43Å; L351-V353 VanDerWaalsContact C-N 3.33Å; L351-V353 PolarHBondContact O-N 2.97Å; L351-A354 PolarHBondContact O-N 3.48Å; L351-E355 WeakPolarHBondContact O-CB 3.29Å; L351-E355 PolarHBondContact O-N 3.37Å |
| 352 | M | 87.1 | Confident | 85.4 | Confident | 84 Ų | 84 | 100.3 Ų | 100.3 | 41% | 0.414 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.8 | -36.1 | 178.4 | -168.9 | 179.8 | -62.5 | 0 | 0 | 112.2 | K348 L349 E355 K356 | K348-M352 WeakPolarHBondContact O-CB 3.32Å; K348-M352 PolarHBondContact O-N 3.4Å; L349-M352 PolarHBondContact O-N 3.32Å; M352-E355 PolarHBondContact O-N 2.85Å; M352-K356 HydrophobicContact CG-CG 4.45Å; M352-K356 WeakPolarHBondContact O-CB 3.35Å; M352-K356 WeakPolarHBondContact O-CG 3.46Å; M352-K356 PolarHBondContact O-N 2.89Å |
| 353 | V | 90.8 | Very high | 86.4 | Confident | 81 Ų | 81 | 100.5 Ų | 100.5 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.2 | -47 | 173.5 | 168.9 | 0 | 0 | 0 | 0 | 110.3 | L349 K350 L351 E355 K356 D357 | L349-V353 WeakPolarHBondContact O-CB 3.38Å; L349-V353 VanDerWaalsContact O-CG2 3.25Å; L349-V353 WeakPolarHBondContact O-CG2 3.31Å; L349-V353 PolarHBondContact O-N 3.33Å; K350-V353 PolarHBondContact O-N 3.48Å; L351-V353 VanDerWaalsContact C-N 3.33Å; L351-V353 PolarHBondContact O-N 2.97Å; V353-E355 VanDerWaalsContact C-N 3.29Å; V353-E355 PolarHBondContact O-N 3.14Å; V353-K356 PolarHBondContact O-N 2.96Å; V353-K356 VanDerWaalsContact O-N 3.16Å; V353-D357 WeakPolarHBondContact CG1-OD2 3.31Å; V353-D357 WeakPolarHBondContact O-CB 3.5Å; V353-D357 VanDerWaalsContact O-CG 3.26Å; V353-D357 PolarHBondContact O-N 3.41Å |
| 354 | A | 91 | Very high | 87.1 | Confident | 59 Ų | 59 | 100.9 Ų | 100.9 | 49% | 0.488 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.3 | -38.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | K350 L351 A358 | K350-A354 PolarHBondContact O-N 2.86Å; L351-A354 PolarHBondContact O-N 3.48Å; A354-A358 WeakPolarHBondContact O-CB 3.29Å; A354-A358 PolarHBondContact O-N 3.09Å |
| 355 | E | 89.4 | Confident | 87.7 | Confident | 134 Ų | 134 | 102 Ų | 102 | 63% | 0.626 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -67.6 | -41.5 | 175.7 | -169.1 | 179.2 | -165.1 | 0 | 0 | 111.9 | L351 M352 V353 A358 M359 | L351-E355 WeakPolarHBondContact O-CB 3.29Å; L351-E355 PolarHBondContact O-N 3.37Å; M352-E355 PolarHBondContact O-N 2.85Å; V353-E355 VanDerWaalsContact C-N 3.29Å; V353-E355 PolarHBondContact O-N 3.14Å; E355-A358 PolarHBondContact O-N 3.38Å; E355-M359 PolarHBondContact O-N 3.37Å |
| 356 | K | 90.3 | Very high | 87.8 | Confident | 111 Ų | 111 | 104.9 Ų | 104.9 | 48% | 0.483 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.2 | -37.8 | 176 | -68.2 | -70.4 | 155.6 | 69.6 | 0 | 111.8 | M352 V353 M359 I360 | M352-K356 HydrophobicContact CG-CG 4.45Å; M352-K356 WeakPolarHBondContact O-CB 3.35Å; M352-K356 WeakPolarHBondContact O-CG 3.46Å; M352-K356 PolarHBondContact O-N 2.89Å; V353-K356 PolarHBondContact O-N 2.96Å; V353-K356 VanDerWaalsContact O-N 3.16Å; K356-M359 PolarHBondContact O-N 2.95Å; K356-I360 WeakPolarHBondContact O-CB 3.42Å; K356-I360 WeakPolarHBondContact O-CG1 3.37Å; K356-I360 PolarHBondContact O-N 2.98Å |
| 357 | D | 89.1 | Confident | 87.6 | Confident | 91 Ų | 91 | 107.2 Ų | 107.2 | 49% | 0.487 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66 | -39.4 | 175 | -71.4 | -22.9 | 0 | 0 | 0 | 111.5 | V353 M359 I360 K361 | V353-D357 WeakPolarHBondContact CG1-OD2 3.31Å; V353-D357 WeakPolarHBondContact O-CB 3.5Å; V353-D357 VanDerWaalsContact O-CG 3.26Å; V353-D357 PolarHBondContact O-N 3.41Å; D357-M359 VanDerWaalsContact C-N 3.34Å; D357-I360 PolarHBondContact O-N 3.24Å; D357-K361 WeakPolarHBondContact O-CB 3.29Å; D357-K361 PolarHBondContact O-N 2.9Å |
| 358 | A | 90.8 | Very high | 87.5 | Confident | 62 Ų | 62 | 106.7 Ų | 106.7 | 51% | 0.512 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.4 | -42.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A354 E355 K361 E362 | A354-A358 WeakPolarHBondContact O-CB 3.29Å; A354-A358 PolarHBondContact O-N 3.09Å; E355-A358 PolarHBondContact O-N 3.38Å; A358-K361 WeakPolarHBondContact O-CB 3.26Å; A358-K361 PolarHBondContact O-N 2.83Å; A358-E362 PolarHBondContact O-N 3.45Å |
| 359 | M | 90.4 | Very high | 87.2 | Confident | 105 Ų | 105 | 106.3 Ų | 106.3 | 52% | 0.517 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -70.3 | -36.3 | 177.9 | -165.6 | 154.7 | -155.7 | 0 | 0 | 112.6 | E355 K356 D357 K361 E362 L363 | E355-M359 PolarHBondContact O-N 3.37Å; K356-M359 PolarHBondContact O-N 2.95Å; D357-M359 VanDerWaalsContact C-N 3.34Å; M359-K361 VanDerWaalsContact C-N 3.29Å; M359-K361 PolarHBondContact O-N 2.91Å; M359-E362 PolarHBondContact O-N 3.25Å; M359-L363 HydrophobicContact CG-CD1 4.33Å; M359-L363 WeakPolarHBondContact O-CB 3.28Å; M359-L363 VanDerWaalsContact O-CG 3.26Å; M359-L363 WeakPolarHBondContact O-CG 3.48Å; M359-L363 PolarHBondContact O-N 3.27Å |
| 360 | I | 90.6 | Very high | 86.5 | Confident | 82 Ų | 82 | 105.3 Ų | 105.3 | 42% | 0.421 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.3 | -44.1 | 171.3 | -73.1 | 163.9 | 0 | 0 | 0 | 109.6 | K356 D357 L363 Q364 | K356-I360 WeakPolarHBondContact O-CB 3.42Å; K356-I360 WeakPolarHBondContact O-CG1 3.37Å; K356-I360 PolarHBondContact O-N 2.98Å; D357-I360 PolarHBondContact O-N 3.24Å; I360-L363 PolarHBondContact O-N 2.88Å; I360-Q364 HydrophobicContact CG2-CG 4.33Å; I360-Q364 WeakPolarHBondContact O-CB 3.35Å; I360-Q364 VanDerWaalsContact O-CG 3.25Å; I360-Q364 WeakPolarHBondContact O-CG 3.34Å; I360-Q364 PolarHBondContact O-N 2.9Å |
| 361 | K | 90.6 | Very high | 85.8 | Confident | 127 Ų | 127 | 102 Ų | 102 | 55% | 0.552 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.5 | -45 | 178 | -167.8 | -179.2 | 176.8 | -172.8 | 0 | 112 | D357 A358 M359 L363 Q364 E365 | D357-K361 WeakPolarHBondContact O-CB 3.29Å; D357-K361 PolarHBondContact O-N 2.9Å; A358-K361 WeakPolarHBondContact O-CB 3.26Å; A358-K361 PolarHBondContact O-N 2.83Å; M359-K361 VanDerWaalsContact C-N 3.29Å; M359-K361 PolarHBondContact O-N 2.91Å; K361-L363 PolarHBondContact O-N 2.94Å; K361-Q364 WeakPolarHBondContact O-CB 3.47Å; K361-Q364 PolarHBondContact O-N 3.03Å; K361-E365 WeakPolarHBondContact O-CG 3.48Å; K361-E365 PolarHBondContact O-N 3.31Å |
| 362 | E | 87.9 | Confident | 84.9 | Confident | 84 Ų | 84 | 102.1 Ų | 102.1 | 39% | 0.393 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.4 | -41.6 | 176.3 | -168.4 | -171.1 | 169.4 | 0 | 0 | 112 | A358 M359 Q364 E365 R366 | A358-E362 PolarHBondContact O-N 3.45Å; M359-E362 PolarHBondContact O-N 3.25Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; E362-E365 PolarHBondContact O-N 3.48Å; E362-R366 WeakPolarHBondContact O-CG 3.43Å; E362-R366 PolarHBondContact O-N 2.86Å; E362-R366 IonicContact OE1-CZ 2.9Å; E362-R366 IonicContact OE1-NE 2.88Å; E362-R366 PolarHBondContact OE1-NE 3.23Å; E362-R366 IonicContact OE1-NH2 3.47Å; E362-R366 PolarHBondContact OE1-NH2 2.96Å |
| 363 | L | 86.4 | Confident | 84.2 | Confident | 94 Ų | 94 | 102.2 Ų | 102.2 | 49% | 0.492 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.1 | -37.6 | 175.5 | -73.3 | 172.1 | 0 | 0 | 0 | 111.8 | M359 I360 K361 R366 Q367 | M359-L363 HydrophobicContact CG-CD1 4.33Å; M359-L363 WeakPolarHBondContact O-CB 3.28Å; M359-L363 VanDerWaalsContact O-CG 3.26Å; M359-L363 WeakPolarHBondContact O-CG 3.48Å; M359-L363 PolarHBondContact O-N 3.27Å; I360-L363 PolarHBondContact O-N 2.88Å; K361-L363 PolarHBondContact O-N 2.94Å; L363-R366 PolarHBondContact O-N 3.48Å; L363-Q367 WeakPolarHBondContact O-CB 3.35Å; L363-Q367 PolarHBondContact O-N 3.35Å |
| 364 | Q | 85.6 | Confident | 83.1 | Confident | 107 Ų | 107 | 105.7 Ų | 105.7 | 50% | 0.5 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.2 | -41.2 | 173.8 | -76.6 | 174.5 | -16.5 | 0 | 0 | 111.7 | I360 K361 E362 Q367 Q368 | I360-Q364 HydrophobicContact CG2-CG 4.33Å; I360-Q364 WeakPolarHBondContact O-CB 3.35Å; I360-Q364 VanDerWaalsContact O-CG 3.25Å; I360-Q364 WeakPolarHBondContact O-CG 3.34Å; I360-Q364 PolarHBondContact O-N 2.9Å; K361-Q364 WeakPolarHBondContact O-CB 3.47Å; K361-Q364 PolarHBondContact O-N 3.03Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; Q364-Q367 PolarHBondContact O-N 3.47Å; Q364-Q368 WeakPolarHBondContact O-CB 3.41Å; Q364-Q368 WeakPolarHBondContact O-CG 3.41Å; Q364-Q368 PolarHBondContact O-N 3.47Å |
| 365 | E | 86.6 | Confident | 81.7 | Confident | 104 Ų | 104 | 106.3 Ų | 106.3 | 49% | 0.486 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.8 | -43 | 175.1 | -73.7 | 172.2 | -171.3 | 0 | 0 | 111.4 | K361 E362 Q367 Q368 F369 | K361-E365 WeakPolarHBondContact O-CG 3.48Å; K361-E365 PolarHBondContact O-N 3.31Å; E362-E365 PolarHBondContact O-N 3.48Å; E365-Q367 PolarHBondContact O-N 2.8Å; E365-Q368 PolarHBondContact O-N 3.49Å; E365-F369 WeakPolarHBondContact O-CB 3.39Å; E365-F369 PolarHBondContact O-N 2.89Å |
| 366 | R | 83.2 | Confident | 80.4 | Confident | 156 Ų | 156 | 102.4 Ų | 102.4 | 59% | 0.589 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.7 | -38.3 | 173.7 | -71.1 | -178.7 | -171.4 | -173.9 | 3.2 | 112.4 | E362 L363 F369 S370 | E362-R366 WeakPolarHBondContact O-CG 3.43Å; E362-R366 PolarHBondContact O-N 2.86Å; E362-R366 IonicContact OE1-CZ 2.9Å; E362-R366 IonicContact OE1-NE 2.88Å; E362-R366 PolarHBondContact OE1-NE 3.23Å; E362-R366 IonicContact OE1-NH2 3.47Å; E362-R366 PolarHBondContact OE1-NH2 2.96Å; L363-R366 PolarHBondContact O-N 3.48Å; R366-F369 PolarHBondContact O-N 3.2Å; R366-S370 WeakPolarHBondContact O-CB 3.43Å; R366-S370 PolarHBondContact O-N 3.44Å |
| 367 | Q | 77.8 | Confident | 79.1 | Confident | 133 Ų | 133 | 100.6 Ų | 100.6 | 62% | 0.621 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -68.2 | -41.5 | 176.6 | -163.8 | -176.8 | 8.1 | 0 | 0 | 110.8 | L363 Q364 E365 S370 T371 | L363-Q367 WeakPolarHBondContact O-CB 3.35Å; L363-Q367 PolarHBondContact O-N 3.35Å; Q364-Q367 PolarHBondContact O-N 3.47Å; E365-Q367 PolarHBondContact O-N 2.8Å; Q367-S370 PolarHBondContact O-N 2.74Å; Q367-T371 WeakPolarHBondContact O-CG2 3.48Å; Q367-T371 PolarHBondContact O-N 3.17Å; Q367-T371 PolarHBondContact O-OG1 3.32Å; Q367-T371 VanDerWaalsContact O-OG1 3.1Å |
| 368 | Q | 79.3 | Confident | 77.7 | Confident | 124 Ų | 124 | 98.3 Ų | 98.3 | 58% | 0.579 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -58.8 | -48.1 | 172.9 | -81.4 | 179.8 | -12.5 | 0 | 0 | 111.3 | Q364 E365 S370 T371 E372 | Q364-Q368 WeakPolarHBondContact O-CB 3.41Å; Q364-Q368 WeakPolarHBondContact O-CG 3.41Å; Q364-Q368 PolarHBondContact O-N 3.47Å; E365-Q368 PolarHBondContact O-N 3.49Å; Q368-S370 VanDerWaalsContact C-N 3.33Å; Q368-S370 PolarHBondContact O-N 2.87Å; Q368-T371 VanDerWaalsContact CA-OG1 3.29Å; Q368-T371 WeakPolarHBondContact CA-OG1 3.17Å; Q368-T371 PolarHBondContact O-N 2.91Å; Q368-T371 VanDerWaalsContact O-N 3.14Å; Q368-T371 PolarHBondContact O-OG1 3.35Å; Q368-E372 WeakPolarHBondContact O-CG 3.39Å; Q368-E372 PolarHBondContact O-N 2.69Å |
| 369 | F | 78.1 | Confident | 76.2 | Confident | 131 Ų | 131 | 99.9 Ų | 99.9 | 58% | 0.575 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.2 | -41.1 | 176.2 | -166.6 | -105.4 | 0 | 0 | 0 | 112.2 | E365 R366 E372 I373 | E365-F369 WeakPolarHBondContact O-CB 3.39Å; E365-F369 PolarHBondContact O-N 2.89Å; R366-F369 PolarHBondContact O-N 3.2Å; F369-E372 PolarHBondContact O-N 2.92Å; F369-I373 HydrophobicContact CD1-CD1 3.65Å; F369-I373 HydrophobicContact CE1-CD1 3.42Å; F369-I373 VanDerWaalsContact CE1-CD1 3.42Å; F369-I373 HydrophobicContact CE1-CG1 4.38Å; F369-I373 HydrophobicContact CZ-CD1 4.13Å; F369-I373 WeakPolarHBondContact O-CG1 3.24Å; F369-I373 PolarHBondContact O-N 2.86Å |
| 370 | S | 73.4 | Confident | 74.5 | Confident | 70 Ų | 70 | 99 Ų | 99 | 49% | 0.49 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.9 | -37.1 | 174.6 | -171.3 | 0 | 0 | 0 | 0 | 112.3 | R366 Q367 Q368 F374 | R366-S370 WeakPolarHBondContact O-CB 3.43Å; R366-S370 PolarHBondContact O-N 3.44Å; Q367-S370 PolarHBondContact O-N 2.74Å; Q368-S370 VanDerWaalsContact C-N 3.33Å; Q368-S370 PolarHBondContact O-N 2.87Å; S370-F374 VanDerWaalsContact O-CB 3.3Å; S370-F374 WeakPolarHBondContact O-CB 3.22Å; S370-F374 PolarHBondContact O-N 3.27Å |
| 371 | T | 72.8 | Confident | 72.9 | Confident | 81 Ų | 81 | 99 Ų | 99 | 50% | 0.497 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -71.1 | -34.4 | 175.3 | 49.2 | 0 | 0 | 0 | 0 | 112.4 | Q367 Q368 F374 S375 | Q367-T371 WeakPolarHBondContact O-CG2 3.48Å; Q367-T371 PolarHBondContact O-N 3.17Å; Q367-T371 PolarHBondContact O-OG1 3.32Å; Q367-T371 VanDerWaalsContact O-OG1 3.1Å; Q368-T371 VanDerWaalsContact CA-OG1 3.29Å; Q368-T371 WeakPolarHBondContact CA-OG1 3.17Å; Q368-T371 PolarHBondContact O-N 2.91Å; Q368-T371 VanDerWaalsContact O-N 3.14Å; Q368-T371 PolarHBondContact O-OG1 3.35Å; T371-F374 PolarHBondContact O-N 2.98Å; T371-S375 WeakPolarHBondContact O-CB 3.48Å; T371-S375 PolarHBondContact O-N 3.24Å |
| 372 | E | 73 | Confident | 71 | Confident | 125 Ų | 125 | 101.1 Ų | 101.1 | 58% | 0.584 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.7 | -46.7 | 172.3 | -76.4 | 179.9 | 176.6 | 0 | 0 | 110.7 | Q368 F369 F374 S375 A376 | Q368-E372 WeakPolarHBondContact O-CG 3.39Å; Q368-E372 PolarHBondContact O-N 2.69Å; F369-E372 PolarHBondContact O-N 2.92Å; E372-F374 PolarHBondContact O-N 3.41Å; E372-S375 PolarHBondContact O-N 2.85Å; E372-S375 PolarHBondContact O-OG 3.24Å; E372-A376 PolarHBondContact O-N 2.85Å |
| 373 | I | 71.8 | Confident | 69.3 | Low | 86 Ų | 86 | 105 Ų | 105 | 44% | 0.441 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.1 | -43.9 | 173.3 | -68.3 | 169.7 | 0 | 0 | 0 | 111.1 | F369 S375 A376 V377 | F369-I373 HydrophobicContact CD1-CD1 3.65Å; F369-I373 HydrophobicContact CE1-CD1 3.42Å; F369-I373 VanDerWaalsContact CE1-CD1 3.42Å; F369-I373 HydrophobicContact CE1-CG1 4.38Å; F369-I373 HydrophobicContact CZ-CD1 4.13Å; F369-I373 WeakPolarHBondContact O-CG1 3.24Å; F369-I373 PolarHBondContact O-N 2.86Å; I373-S375 VanDerWaalsContact C-N 3.3Å; I373-S375 PolarHBondContact O-N 3.41Å; I373-A376 PolarHBondContact O-N 3.48Å; I373-V377 HydrophobicContact CG2-CG2 4.36Å; I373-V377 WeakPolarHBondContact O-CG2 3.43Å; I373-V377 PolarHBondContact O-N 3.25Å |
| 374 | F | 66.4 | Low | 67.6 | Low | 153 Ų | 153 | 107.3 Ų | 107.3 | 67% | 0.671 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.9 | -33.9 | 178.9 | -147.5 | -88.8 | 0 | 0 | 0 | 111.8 | S370 T371 E372 V377 A378 | S370-F374 VanDerWaalsContact O-CB 3.3Å; S370-F374 WeakPolarHBondContact O-CB 3.22Å; S370-F374 PolarHBondContact O-N 3.27Å; T371-F374 PolarHBondContact O-N 2.98Å; E372-F374 PolarHBondContact O-N 3.41Å; F374-V377 PolarHBondContact O-N 3.45Å; F374-A378 WeakPolarHBondContact O-CB 3.5Å; F374-A378 PolarHBondContact O-N 2.87Å |
| 375 | S | 62.7 | Low | 65.5 | Low | 72 Ų | 72 | 107.2 Ų | 107.2 | 50% | 0.503 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.6 | -36.1 | 173.6 | 83.5 | 0 | 0 | 0 | 0 | 112.4 | T371 E372 I373 A378 T379 | T371-S375 WeakPolarHBondContact O-CB 3.48Å; T371-S375 PolarHBondContact O-N 3.24Å; E372-S375 PolarHBondContact O-N 2.85Å; E372-S375 PolarHBondContact O-OG 3.24Å; I373-S375 VanDerWaalsContact C-N 3.3Å; I373-S375 PolarHBondContact O-N 3.41Å; S375-A378 PolarHBondContact O-N 3.43Å; S375-T379 PolarHBondContact O-N 3.22Å; S375-T379 PolarHBondContact O-OG1 3.28Å |
| 376 | A | 62.6 | Low | 63.5 | Low | 52 Ų | 52 | 109.5 Ų | 109.5 | 43% | 0.43 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -71.5 | -35.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | E372 I373 T379 T380 | E372-A376 PolarHBondContact O-N 2.85Å; I373-A376 PolarHBondContact O-N 3.48Å; A376-T379 WeakPolarHBondContact CA-OG1 3.32Å; A376-T379 PolarHBondContact O-OG1 2.88Å; A376-T379 VanDerWaalsContact O-OG1 3.06Å; A376-T380 PolarHBondContact O-N 3.13Å; A376-T380 PolarHBondContact O-OG1 3.45Å |
| 377 | V | 63 | Low | 61.2 | Low | 73 Ų | 73 | 109.8 Ų | 109.8 | 44% | 0.442 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -75 | -37.1 | 172.4 | 176.1 | 0 | 0 | 0 | 0 | 111 | I373 F374 T379 T380 V381 | I373-V377 HydrophobicContact CG2-CG2 4.36Å; I373-V377 WeakPolarHBondContact O-CG2 3.43Å; I373-V377 PolarHBondContact O-N 3.25Å; F374-V377 PolarHBondContact O-N 3.45Å; V377-T379 VanDerWaalsContact C-N 3.3Å; V377-T379 PolarHBondContact O-N 3Å; V377-T380 WeakPolarHBondContact CA-OG1 3.38Å; V377-T380 PolarHBondContact O-N 3.4Å; V377-T380 PolarHBondContact O-OG1 3.48Å; V377-V381 HydrophobicContact CG1-CG2 3.97Å; V377-V381 WeakPolarHBondContact O-CB 3.45Å; V377-V381 VanDerWaalsContact O-CG2 3.26Å; V377-V381 WeakPolarHBondContact O-CG2 3.48Å; V377-V381 PolarHBondContact O-N 2.82Å |
| 378 | A | 59.7 | Low | 59.3 | Low | 44 Ų | 44 | 111.9 Ų | 111.9 | 36% | 0.364 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -65.8 | -31.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | F374 S375 K382 | F374-A378 WeakPolarHBondContact O-CB 3.5Å; F374-A378 PolarHBondContact O-N 2.87Å; S375-A378 PolarHBondContact O-N 3.43Å; A378-K382 VanDerWaalsContact O-CB 3.28Å; A378-K382 WeakPolarHBondContact O-CB 3.35Å; A378-K382 WeakPolarHBondContact O-CG 3.44Å; A378-K382 PolarHBondContact O-N 3Å |
| 379 | T | 57.6 | Low | 57.1 | Low | 95 Ų | 95 | 112.7 Ų | 112.7 | 58% | 0.583 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -73.3 | -33.3 | 173.4 | 27.2 | 0 | 0 | 0 | 0 | 112.6 | S375 A376 V377 | S375-T379 PolarHBondContact O-N 3.22Å; S375-T379 PolarHBondContact O-OG1 3.28Å; A376-T379 WeakPolarHBondContact CA-OG1 3.32Å; A376-T379 PolarHBondContact O-OG1 2.88Å; A376-T379 VanDerWaalsContact O-OG1 3.06Å; V377-T379 VanDerWaalsContact C-N 3.3Å; V377-T379 PolarHBondContact O-N 3Å |
| 380 | T | 56.4 | Low | 54.9 | Low | 86 Ų | 86 | 115 Ų | 115 | 53% | 0.528 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -79.4 | -33 | 175.2 | 51.8 | 0 | 0 | 0 | 0 | 113.2 | A376 V377 Q383 | A376-T380 PolarHBondContact O-N 3.13Å; A376-T380 PolarHBondContact O-OG1 3.45Å; V377-T380 WeakPolarHBondContact CA-OG1 3.38Å; V377-T380 PolarHBondContact O-N 3.4Å; V377-T380 PolarHBondContact O-OG1 3.48Å; T380-Q383 PolarHBondContact O-N 3.02Å |
| 381 | V | 55.4 | Low | 52.8 | Low | 81 Ų | 81 | 120.7 Ų | 120.7 | 49% | 0.491 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -76.1 | -31.6 | 175.6 | 174.3 | 0 | 0 | 0 | 0 | 112.3 | V377 Q383 I384 C385 | V377-V381 HydrophobicContact CG1-CG2 3.97Å; V377-V381 WeakPolarHBondContact O-CB 3.45Å; V377-V381 VanDerWaalsContact O-CG2 3.26Å; V377-V381 WeakPolarHBondContact O-CG2 3.48Å; V377-V381 PolarHBondContact O-N 2.82Å; V381-Q383 PolarHBondContact O-N 3.47Å; V381-I384 PolarHBondContact O-N 3.43Å; V381-I384 VanDerWaalsContact O-N 3.12Å; V381-C385 PolarHBondContact O-N 2.84Å |
| 382 | K | 52.4 | Low | 50.7 | Low | 173 Ų | 173 | 122.5 Ų | 122.5 | 75% | 0.752 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | -21.9 | 170.5 | -94.8 | 179.7 | 172.4 | 176.2 | 0 | 113.6 | A378 | A378-K382 VanDerWaalsContact O-CB 3.28Å; A378-K382 WeakPolarHBondContact O-CB 3.35Å; A378-K382 WeakPolarHBondContact O-CG 3.44Å; A378-K382 PolarHBondContact O-N 3Å |
| 383 | Q | 50.8 | Low | 48.6 | Very low | 166 Ų | 166 | 122.7 Ų | 122.7 | 78% | 0.776 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -16.6 | 176.3 | -159.5 | 70.5 | 21.7 | 0 | 0 | 112.8 | T380 V381 | T380-Q383 PolarHBondContact O-N 3.02Å; V381-Q383 PolarHBondContact O-N 3.47Å |
| 384 | I | 50.8 | Low | 46.6 | Very low | 141 Ų | 141 | 126.6 Ų | 126.6 | 72% | 0.723 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.6 | -23.5 | -170.5 | -67.6 | 175.7 | 0 | 0 | 0 | 113.6 | V381 | V381-I384 PolarHBondContact O-N 3.43Å; V381-I384 VanDerWaalsContact O-N 3.12Å |
| 385 | C | 42.7 | Very low | 44.8 | Very low | 106 Ų | 106 | 124 Ų | 124 | 72% | 0.716 | 67% | 0.67 | S | S | * | * | trans | -105 | 61.8 | 176.9 | -81.6 | 0 | 0 | 0 | 0 | 112.9 | V381 | V381-C385 PolarHBondContact O-N 2.84Š| ||
| 386 | L | 42.9 | Very low | 43.1 | Very low | 151 Ų | 151 | 128.1 Ų | 128.1 | 79% | 0.791 | 68% | 0.681 | S | S | * | * | trans | -110.3 | 37.9 | 168.1 | -132.9 | 173.1 | 0 | 0 | 0 | 111.6 | ||||
| 387 | L | 36.3 | Very low | 41.4 | Very low | 162 Ų | 162 | 130.8 Ų | 130.8 | 85% | 0.848 | 69% | 0.692 | S | S | * | * | trans | -145.4 | 131.5 | 167.6 | -78.4 | 172.3 | 0 | 0 | 0 | 109.5 | ||||
| 388 | E | 37.3 | Very low | 39.7 | Very low | 177 Ų | 177 | 136.1 Ų | 136.1 | 83% | 0.827 | 71% | 0.712 | S | S | * | * | trans | 91.8 | 81.9 | 169.1 | -60.7 | -173.8 | 154.3 | 0 | 0 | 120.4 | ||||
| 389 | I | 33.5 | Very low | 38.2 | Very low | 141 Ų | 141 | 137.3 Ų | 137.3 | 72% | 0.723 | 73% | 0.729 | S | S | * | * | 66.9 | 116.2 | 117.5 | -64.1 | 171.7 | 0 | 0 | 0 | 119.9 | |||||
| 390 | K | 30.9 | Very low | 37.4 | Very low | 181 Ų | 181 | 144.7 Ų | 144.7 | 79% | 0.787 | 75% | 0.746 | S | S | * | * | trans | 85.6 | 116.9 | 145.2 | -84 | 167.4 | -175 | 172 | 0 | 120.7 | ||||
| 391 | K | 30.8 | Very low | 35.9 | Very low | 188 Ų | 188 | 149.6 Ų | 149.6 | 82% | 0.817 | 76% | 0.763 | S | S | * | * | trans | 93.4 | 127.9 | 134.1 | -82.4 | -178.2 | 172.5 | -177.3 | 0 | 118.7 | ||||
| 392 | S | 27.5 | Very low | 34.6 | Very low | 120 Ų | 120 | 151.2 Ų | 151.2 | 84% | 0.839 | 78% | 0.776 | S | S | * | * | trans | 63.5 | 83.6 | 165.6 | 57.4 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 393 | V | 29.7 | Very low | 33.5 | Very low | 129 Ų | 129 | 145.4 Ų | 145.4 | 78% | 0.782 | 77% | 0.766 | S | S | * | * | trans | -86.7 | 143.1 | 152.6 | 161.8 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 394 | F | 29.5 | Very low | 32.5 | Very low | 167 Ų | 167 | 145.9 Ų | 145.9 | 73% | 0.732 | 77% | 0.768 | S | S | * | * | cis | -176 | 165.6 | -0 | -126 | -132.9 | 0 | 0 | 0 | 104.2 | ||||
| 395 | T | 28.3 | Very low | 31.4 | Very low | 100 Ų | 100 | 144.2 Ų | 144.2 | 61% | 0.613 | 77% | 0.765 | S | S | * | * | trans | 60.5 | 150.4 | 139.6 | 58 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 396 | E | 27.4 | Very low | 31 | Very low | 157 Ų | 157 | 147.5 Ų | 147.5 | 73% | 0.734 | 77% | 0.767 | S | S | * | * | cis | -158.8 | 156.4 | 18.2 | -131.2 | 156.5 | -147.6 | 0 | 0 | 108.4 | ||||
| 397 | T | 26.5 | Very low | 30.4 | Very low | 109 Ų | 109 | 147 Ų | 147 | 67% | 0.669 | 77% | 0.765 | S | S | * | * | trans | 22.4 | 145.9 | 143 | 43.1 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 398 | E | 26.3 | Very low | 30.1 | Very low | 185 Ų | 185 | 142.9 Ų | 142.9 | 86% | 0.864 | 76% | 0.761 | S | S | * | * | trans | 83.6 | 116.6 | 148 | -77.9 | 177.2 | -169 | 0 | 0 | 117.5 | ||||
| 399 | G | 28.3 | Very low | 29.8 | Very low | 69 Ų | 69 | 141.4 Ų | 141.4 | 71% | 0.711 | 76% | 0.759 | S | S | * | * | 84.2 | 112.2 | 112.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 400 | R | 41.2 | Very low | 29.7 | Very low | 250 Ų | 250 | 138.9 Ų | 138.9 | 94% | 0.943 | 75% | 0.754 | S | S | * | * | trans | 52.7 | 89 | 141.1 | -71.6 | -177.4 | 179.4 | -154.8 | -0.3 | 115.3 | ||||
| 401 | E | 26.2 | Very low | 29.8 | Very low | 188 Ų | 188 | 136.1 Ų | 136.1 | 88% | 0.879 | 75% | 0.752 | S | S | * | * | trans | -72.1 | 154 | 136.4 | -81.4 | -169.8 | 149.7 | 0 | 0 | 109.6 | ||||
| 402 | C | 27.5 | Very low | 30 | Very low | 115 Ų | 115 | 132.8 Ų | 132.8 | 78% | 0.777 | 75% | 0.748 | S | S | * | * | cis | 166.6 | 145.4 | -8.8 | -178.3 | 0 | 0 | 0 | 0 | 100.7 | ||||
| 403 | G | 29.3 | Very low | 30.1 | Very low | 52 Ų | 52 | 138 Ų | 138 | 54% | 0.536 | 75% | 0.749 | S | S | . | * | cis | 176.9 | 139.2 | 9.4 | 0 | 0 | 0 | 0 | 0 | 103.7 | ||||
| 404 | Q | 30.2 | Very low | 30.2 | Very low | 175 Ų | 175 | 139.5 Ų | 139.5 | 82% | 0.818 | 75% | 0.751 | S | S | * | * | 69.5 | 123.5 | 109.5 | -59.9 | -172.1 | -11.6 | 0 | 0 | 113 | |||||
| 405 | T | 27.8 | Very low | 30.3 | Very low | 106 Ų | 106 | 137.6 Ų | 137.6 | 65% | 0.65 | 75% | 0.753 | S | S | * | * | -175.2 | 143.5 | 72.6 | 29.2 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 406 | K | 32.6 | Very low | 31 | Very low | 176 Ų | 176 | 137.6 Ų | 137.6 | 77% | 0.765 | 76% | 0.755 | S | S | * | * | trans | 68.1 | 143.7 | 134.4 | -66.8 | -179.7 | -175.8 | -168.1 | 0 | 117.9 | ||||
| 407 | D | 32.1 | Very low | 31 | Very low | 140 Ų | 140 | 136.2 Ų | 136.2 | 75% | 0.749 | 75% | 0.753 | S | S | * | * | cis | -153.7 | 156 | -0.2 | -87.7 | -34.2 | 0 | 0 | 0 | 104.2 | ||||
| 408 | G | 29.3 | Very low | 31.3 | Very low | 75 Ų | 75 | 139.8 Ų | 139.8 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | 46 | 125.5 | 88.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 409 | D | 30.4 | Very low | 31.6 | Very low | 147 Ų | 147 | 136.2 Ų | 136.2 | 79% | 0.786 | 75% | 0.754 | S | S | * | * | cis | -178.6 | 161.8 | 23.4 | -171.2 | 18.6 | 0 | 0 | 0 | 107.9 | ||||
| 410 | S | 32.1 | Very low | 31.9 | Very low | 88 Ų | 88 | 138.7 Ų | 138.7 | 62% | 0.615 | 76% | 0.761 | S | S | * | * | trans | 40.9 | 132.7 | 152.9 | 61.2 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 411 | V | 33.5 | Very low | 31.4 | Very low | 122 Ų | 122 | 133.3 Ų | 133.3 | 74% | 0.739 | 76% | 0.756 | S | S | * | * | -174.4 | 130.1 | 76.7 | 159.5 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 412 | T | 33.9 | Very low | 31.9 | Very low | 118 Ų | 118 | 129.9 Ų | 129.9 | 72% | 0.724 | 75% | 0.752 | S | S | * | * | trans | 19.7 | 122.5 | 154.5 | 56.5 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 413 | R | 30.6 | Very low | 33 | Very low | 230 Ų | 230 | 133.6 Ų | 133.6 | 87% | 0.868 | 76% | 0.755 | S | S | * | * | 57.3 | 105.3 | 89.3 | -157.8 | -171.8 | -83.2 | -177 | -3.8 | 111.4 | |||||
| 414 | I | 31.6 | Very low | 34 | Very low | 160 Ų | 160 | 138.7 Ų | 138.7 | 82% | 0.821 | 77% | 0.769 | S | S | * | * | -165.3 | 127.5 | 96.5 | -79.6 | 148.9 | 0 | 0 | 0 | 109.2 | |||||
| 415 | T | 30.1 | Very low | 35 | Very low | 127 Ų | 127 | 133.9 Ų | 133.9 | 78% | 0.779 | 77% | 0.767 | S | S | * | * | trans | -96 | 169.4 | 151.4 | 37.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 416 | P | 43.6 | Very low | 35.9 | Very low | 100 Ų | 100 | 137.6 Ų | 137.6 | 65% | 0.649 | 78% | 0.776 | S | S | * | * | cis | -128 | 168.6 | -1.5 | 26.6 | -1.7 | 0 | 0 | 0 | 111.4 | ||||
| 417 | D | 27.8 | Very low | 36.2 | Very low | 129 Ų | 129 | 138.7 Ų | 138.7 | 69% | 0.69 | 78% | 0.781 | S | S | * | * | -173.7 | 136.2 | 92.4 | -90.5 | -24.4 | 0 | 0 | 0 | 113 | |||||
| 418 | F | 32 | Very low | 36.5 | Very low | 184 Ų | 184 | 140.2 Ų | 140.2 | 81% | 0.807 | 79% | 0.788 | S | S | * | * | trans | 30 | 103.5 | 146.1 | -67.2 | -90.9 | 0 | 0 | 0 | 119.5 | ||||
| 419 | S | 33.2 | Very low | 36.9 | Very low | 109 Ų | 109 | 142.5 Ų | 142.5 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | 167.6 | 123.5 | 95.6 | 49.3 | 0 | 0 | 0 | 0 | 112 | |||||
| 420 | S | 35 | Very low | 37.2 | Very low | 121 Ų | 121 | 142.9 Ų | 142.9 | 85% | 0.846 | 79% | 0.787 | S | S | * | * | trans | -3.7 | 117.8 | 162.2 | 50.6 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 421 | V | 30.1 | Very low | 37.3 | Very low | 138 Ų | 138 | 143.2 Ų | 143.2 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | trans | -75.7 | 129.8 | 162.2 | -179.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 422 | S | 37.9 | Very low | 37.2 | Very low | 115 Ų | 115 | 143.8 Ų | 143.8 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -103.2 | 129.6 | 159.1 | -174.1 | 0 | 0 | 0 | 0 | 109.6 | L424 | S422-L424 PolarHBondContact O-N 2.88Š| ||
| 423 | K | 50.8 | Low | 37.5 | Very low | 193 Ų | 193 | 145.5 Ų | 145.5 | 84% | 0.839 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -72.8 | 87.7 | -175.3 | -72.8 | 174.1 | 174.6 | 174.9 | 0 | 111.2 | ||
| 424 | L | 49.8 | Very low | 37.8 | Very low | 159 Ų | 159 | 138.1 Ų | 138.1 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -176.2 | 89.8 | 153.9 | -98.3 | 137.4 | 0 | 0 | 0 | 107 | S422 H426 | S422-L424 PolarHBondContact O-N 2.88Å; L424-H426 PolarHBondContact O-N 2.71Å; L424-H426 VanDerWaalsContact O-N 3.1Å |
| 425 | G | 50.7 | Low | 37.9 | Very low | 74 Ų | 74 | 134 Ų | 134 | 76% | 0.763 | 80% | 0.802 | S | S | * | * | trans | -62.4 | 110.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 426 | H | 45.8 | Very low | 38.4 | Very low | 185 Ų | 185 | 137.8 Ų | 137.8 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | trans | -140.5 | 136.2 | 155.2 | -73.6 | -38.1 | 0 | 0 | 0 | 110.5 | L424 | L424-H426 PolarHBondContact O-N 2.71Å; L424-H426 VanDerWaalsContact O-N 3.1Å | ||
| 427 | K | 40.5 | Very low | 37.9 | Very low | 199 Ų | 199 | 140.5 Ų | 140.5 | 87% | 0.865 | 82% | 0.816 | S | S | * | * | trans | -87.8 | 110.6 | 178.8 | -161.1 | -179.9 | -169.5 | -175.3 | 0 | 107.9 | V429 | K427-V429 PolarHBondContact O-N 2.93Š| ||
| 428 | L | 37.8 | Very low | 38.6 | Very low | 172 Ų | 172 | 144 Ų | 144 | 90% | 0.901 | 83% | 0.829 | S | S | * | * | trans | -75 | 110.7 | 170.2 | -92.4 | 155 | 0 | 0 | 0 | 108.8 | ||||
| 429 | V | 38 | Very low | 38.8 | Very low | 123 Ų | 123 | 141.4 Ų | 141.4 | 75% | 0.745 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -84 | 120.4 | 166.2 | 176.8 | 0 | 0 | 0 | 0 | 107.6 | K427 A431 | K427-V429 PolarHBondContact O-N 2.93Å; V429-A431 PolarHBondContact O-N 3.43Å |
| 430 | I | 36.3 | Very low | 39.3 | Very low | 154 Ų | 154 | 146.2 Ų | 146.2 | 79% | 0.79 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 118.4 | 170.3 | -62.1 | 171.3 | 0 | 0 | 0 | 107.2 | ||
| 431 | A | 34.2 | Very low | 39.3 | Very low | 95 Ų | 95 | 144.7 Ų | 144.7 | 79% | 0.785 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -100.4 | 117.5 | 167.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | V429 | V429-A431 PolarHBondContact O-N 3.43Š|
| 432 | T | 32.3 | Very low | 40.2 | Very low | 134 Ų | 134 | 147.5 Ų | 147.5 | 82% | 0.822 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 151.6 | 174.2 | 36.6 | 0 | 0 | 0 | 0 | 112.6 | ||
| 433 | V | 39.6 | Very low | 40.5 | Very low | 154 Ų | 154 | 147.1 Ų | 147.1 | 93% | 0.933 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -54 | 142 | 177.4 | 171.3 | 0 | 0 | 0 | 0 | 113.7 | ||
| 434 | G | 36.9 | Very low | 40 | Very low | 76 Ų | 76 | 148.4 Ų | 148.4 | 78% | 0.784 | 83% | 0.826 | S | S | * | * | trans | 122 | 108.1 | 150.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 435 | G | 32.4 | Very low | 39.6 | Very low | 72 Ų | 72 | 144.9 Ų | 144.9 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | trans | 160 | 99 | 169.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | M437 | G435-M437 PolarHBondContact O-N 3.32Š| ||
| 436 | E | 40.6 | Very low | 39.4 | Very low | 207 Ų | 207 | 148 Ų | 148 | 97% | 0.967 | 82% | 0.82 | S | S | * | * | trans | -58.5 | 122.5 | 162.7 | -143.6 | 170 | -169.3 | 0 | 0 | 108.6 | ||||
| 437 | M | 35.2 | Very low | 39.7 | Very low | 157 Ų | 157 | 142.3 Ų | 142.3 | 77% | 0.773 | 81% | 0.812 | S | S | * | * | trans | -142.2 | 100.5 | 179.9 | -151.5 | 164.2 | 170.6 | 0 | 0 | 109.5 | G435 L439 | G435-M437 PolarHBondContact O-N 3.32Å; M437-L439 HydrophobicContact CG-CD1 4.3Å; M437-L439 PolarHBondContact O-N 3.02Å | ||
| 438 | E | 41.3 | Very low | 40.4 | Very low | 204 Ų | 204 | 138.1 Ų | 138.1 | 95% | 0.953 | 81% | 0.806 | S | S | * | * | trans | -61.8 | 115.2 | 164.4 | -85.5 | -174.5 | 141.2 | 0 | 0 | 108.9 | ||||
| 439 | L | 35.8 | Very low | 40.8 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 68% | 0.675 | 79% | 0.794 | S | S | * | * | trans | -116.3 | 94.5 | 173.5 | -102.6 | 139 | 0 | 0 | 0 | 109.1 | M437 | M437-L439 HydrophobicContact CG-CD1 4.3Å; M437-L439 PolarHBondContact O-N 3.02Å | ||
| 440 | K | 44.1 | Very low | 41.5 | Very low | 209 Ų | 209 | 132.5 Ų | 132.5 | 91% | 0.909 | 79% | 0.792 | S | S | * | * | trans | -77 | 114.2 | 153.3 | -87.8 | 175.9 | 176.1 | 169.8 | 0 | 107.6 | ||||
| 441 | S | 35.9 | Very low | 42.8 | Very low | 89 Ų | 89 | 129.4 Ų | 129.4 | 62% | 0.622 | 78% | 0.777 | S | S | * | * | trans | -142 | 109.2 | 167.7 | 40.2 | 0 | 0 | 0 | 0 | 111.6 | S443 | S441-S443 PolarHBondContact O-N 3.42Š| ||
| 442 | H | 47.8 | Very low | 44.3 | Very low | 198 Ų | 198 | 129.7 Ų | 129.7 | 92% | 0.917 | 77% | 0.768 | S | S | * | * | trans | -76.3 | 105 | 160.5 | -73.8 | -85.2 | 0 | 0 | 0 | 108.7 | ||||
| 443 | S | 43.8 | Very low | 46 | Very low | 107 Ų | 107 | 126.5 Ų | 126.5 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | trans | -164 | 120.7 | 153 | 52.1 | 0 | 0 | 0 | 0 | 110.7 | S441 C445 | S441-S443 PolarHBondContact O-N 3.42Å; S443-C445 PolarHBondContact O-N 3.4Å | ||
| 444 | K | 42 | Very low | 47.5 | Very low | 220 Ų | 220 | 121.4 Ų | 121.4 | 96% | 0.957 | 73% | 0.726 | S | S | * | * | trans | -80.8 | 107.1 | 174.2 | -77.4 | 175.7 | 174.9 | 178 | 0 | 108.8 | ||||
| 445 | C | 39.6 | Very low | 49.2 | Very low | 85 Ų | 85 | 122.7 Ų | 122.7 | 57% | 0.574 | 71% | 0.714 | S | S | * | * | trans | -103 | 115.6 | 163.6 | -179.6 | 0 | 0 | 0 | 0 | 108.8 | S443 G447 | S443-C445 PolarHBondContact O-N 3.4Å; C445-G447 PolarHBondContact O-N 3.49Å; C445-G447 VanDerWaalsContact O-N 3.08Å | ||
| 446 | P | 48.3 | Very low | 51.2 | Low | 140 Ų | 140 | 124.6 Ų | 124.6 | 91% | 0.909 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | 36.7 | -171.2 | 33.8 | -34.1 | 0 | 0 | 0 | 114.1 | ||
| 447 | G | 50.6 | Low | 52.8 | Low | 65 Ų | 65 | 119 Ų | 119 | 67% | 0.67 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -154 | -5.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 117 | C445 | C445-G447 PolarHBondContact O-N 3.49Å; C445-G447 VanDerWaalsContact O-N 3.08Å |
| 448 | C | 55.4 | Low | 54.9 | Low | 110 Ų | 110 | 118 Ų | 118 | 74% | 0.743 | 68% | 0.679 | S | S | * | * | trans | -133.1 | 77.7 | -179.6 | -53 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 449 | S | 46.3 | Very low | 56.6 | Low | 94 Ų | 94 | 111.3 Ų | 111.3 | 66% | 0.657 | 66% | 0.656 | S | S | * | * | trans | -134 | 73 | 173.6 | -174.1 | 0 | 0 | 0 | 0 | 109.8 | D451 | S449-D451 PolarHBondContact O-N 3.17Š| ||
| 450 | A | 54.1 | Low | 58.6 | Low | 84 Ų | 84 | 108.1 Ų | 108.1 | 69% | 0.694 | 64% | 0.644 | S | S | * | * | trans | -67 | 111.2 | 143 | 0 | 0 | 0 | 0 | 0 | 104.9 | V452 | A450-V452 PolarHBondContact O-N 2.94Š| ||
| 451 | D | 61.8 | Low | 60.4 | Low | 88 Ų | 88 | 100.4 Ų | 100.4 | 47% | 0.471 | 62% | 0.619 | S | S | . | * | trans | -61.9 | 91.2 | -161.9 | -151.8 | -12.4 | 0 | 0 | 0 | 111.2 | S449 S453 A454 L455 | S449-D451 PolarHBondContact O-N 3.17Å; D451-S453 PolarHBondContact O-N 3.2Å; D451-S453 VanDerWaalsContact O-N 3.13Å; D451-S453 PolarHBondContact OD1-OG 2.94Å; D451-A454 HydrophobicContact CB-CB 3.81Å; D451-A454 WeakPolarHBondContact O-CA 3.25Å; D451-A454 WeakPolarHBondContact O-CB 3.45Å; D451-A454 PolarHBondContact O-N 3.34Å; D451-L455 PolarHBondContact O-N 3.37Å; D451-L455 VanDerWaalsContact O-N 3.09Å | ||
| 452 | V | 66.9 | Low | 62.8 | Low | 101 Ų | 101 | 104.5 Ų | 104.5 | 61% | 0.612 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -56.8 | -31.1 | -178.3 | 178.2 | 0 | 0 | 0 | 0 | 110.4 | A450 L455 I456 | A450-V452 PolarHBondContact O-N 2.94Å; V452-L455 PolarHBondContact O-N 2.95Å; V452-I456 HydrophobicContact CG1-CD1 3.95Å; V452-I456 HydrophobicContact CG1-CG1 4.48Å; V452-I456 WeakPolarHBondContact O-CD1 3.47Å; V452-I456 VanDerWaalsContact O-CG1 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.4Å; V452-I456 PolarHBondContact O-N 3.06Å |
| 453 | S | 68.1 | Low | 64.8 | Low | 68 Ų | 68 | 102.1 Ų | 102.1 | 48% | 0.476 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -63.3 | -40.5 | 173.2 | 78.9 | 0 | 0 | 0 | 0 | 112.8 | D451 I456 T457 | D451-S453 PolarHBondContact O-N 3.2Å; D451-S453 VanDerWaalsContact O-N 3.13Å; D451-S453 PolarHBondContact OD1-OG 2.94Å; S453-I456 PolarHBondContact O-N 3.32Å; S453-T457 WeakPolarHBondContact O-CB 3.32Å; S453-T457 PolarHBondContact O-N 3.37Å; S453-T457 PolarHBondContact O-OG1 3.44Å |
| 454 | A | 69.8 | Low | 67 | Low | 47 Ų | 47 | 101.5 Ų | 101.5 | 39% | 0.388 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -69.7 | -38.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | D451 T457 Q458 | D451-A454 HydrophobicContact CB-CB 3.81Å; D451-A454 WeakPolarHBondContact O-CA 3.25Å; D451-A454 WeakPolarHBondContact O-CB 3.45Å; D451-A454 PolarHBondContact O-N 3.34Å; A454-T457 PolarHBondContact O-N 3.48Å; A454-Q458 WeakPolarHBondContact O-CB 3.45Å; A454-Q458 PolarHBondContact O-N 3.41Å |
| 455 | L | 72.8 | Confident | 69.2 | Low | 102 Ų | 102 | 96.7 Ų | 96.7 | 53% | 0.534 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.7 | -40.3 | 174.8 | -84.8 | 161.9 | 0 | 0 | 0 | 112.5 | D451 V452 T457 Q458 S459 | D451-L455 PolarHBondContact O-N 3.37Å; D451-L455 VanDerWaalsContact O-N 3.09Å; V452-L455 PolarHBondContact O-N 2.95Å; L455-T457 VanDerWaalsContact C-N 3.34Å; L455-Q458 PolarHBondContact O-N 2.89Å; L455-S459 WeakPolarHBondContact O-CB 2.8Å; L455-S459 PolarHBondContact O-N 3.36Å |
| 456 | I | 74.6 | Confident | 71.5 | Confident | 112 Ų | 112 | 95.1 Ų | 95.1 | 57% | 0.574 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.3 | -42.1 | 174.1 | -69.5 | 165.6 | 0 | 0 | 0 | 110.5 | V452 S453 S459 S460 | V452-I456 HydrophobicContact CG1-CD1 3.95Å; V452-I456 HydrophobicContact CG1-CG1 4.48Å; V452-I456 WeakPolarHBondContact O-CD1 3.47Å; V452-I456 VanDerWaalsContact O-CG1 3.24Å; V452-I456 WeakPolarHBondContact O-CG1 3.4Å; V452-I456 PolarHBondContact O-N 3.06Å; S453-I456 PolarHBondContact O-N 3.32Å; I456-S459 PolarHBondContact O-N 3.25Å; I456-S460 PolarHBondContact O-N 3.4Å; I456-S460 PolarHBondContact O-OG 3.05Å |
| 457 | T | 75 | Confident | 73.8 | Confident | 91 Ų | 91 | 92.9 Ų | 92.9 | 56% | 0.558 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.1 | -42 | 176.5 | -54.2 | 0 | 0 | 0 | 0 | 111.2 | S453 A454 L455 S460 A461 | S453-T457 WeakPolarHBondContact O-CB 3.32Å; S453-T457 PolarHBondContact O-N 3.37Å; S453-T457 PolarHBondContact O-OG1 3.44Å; A454-T457 PolarHBondContact O-N 3.48Å; L455-T457 VanDerWaalsContact C-N 3.34Å; T457-S460 PolarHBondContact O-N 2.92Å; T457-S460 PolarHBondContact O-OG 2.98Å; T457-A461 WeakPolarHBondContact O-CB 3.3Å; T457-A461 PolarHBondContact O-N 2.99Å |
| 458 | Q | 78.9 | Confident | 75.8 | Confident | 134 Ų | 134 | 93.8 Ų | 93.8 | 63% | 0.626 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.2 | -39 | 176.3 | -168.1 | 177 | 15.1 | 0 | 0 | 112.3 | A454 L455 A461 Y462 | A454-Q458 WeakPolarHBondContact O-CB 3.45Å; A454-Q458 PolarHBondContact O-N 3.41Å; L455-Q458 PolarHBondContact O-N 2.89Å; Q458-A461 PolarHBondContact O-N 3.22Å; Q458-Y462 PolarHBondContact O-N 2.91Å |
| 459 | S | 76.8 | Confident | 77.6 | Confident | 65 Ų | 65 | 95 Ų | 95 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.9 | -42.4 | 176.5 | -178.3 | 0 | 0 | 0 | 0 | 112.3 | L455 I456 Y462 K463 | L455-S459 WeakPolarHBondContact O-CB 2.8Å; L455-S459 PolarHBondContact O-N 3.36Å; I456-S459 PolarHBondContact O-N 3.25Å; S459-Y462 PolarHBondContact O-N 3.45Å; S459-K463 WeakPolarHBondContact O-CG 3.48Å; S459-K463 PolarHBondContact O-N 3.34Å; S459-K463 VanDerWaalsContact O-N 3.11Å |
| 460 | S | 78.7 | Confident | 79.9 | Confident | 61 Ų | 61 | 95 Ų | 95 | 43% | 0.427 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.2 | -40.3 | 174.8 | 63.4 | 0 | 0 | 0 | 0 | 112.2 | I456 T457 Y462 K463 V464 | I456-S460 PolarHBondContact O-N 3.4Å; I456-S460 PolarHBondContact O-OG 3.05Å; T457-S460 PolarHBondContact O-N 2.92Å; T457-S460 PolarHBondContact O-OG 2.98Å; S460-Y462 VanDerWaalsContact C-N 3.34Å; S460-Y462 PolarHBondContact O-N 3.13Å; S460-K463 PolarHBondContact O-N 3.36Å; S460-V464 WeakPolarHBondContact O-CG2 3.25Å; S460-V464 PolarHBondContact O-N 3.02Å; S460-V464 VanDerWaalsContact O-N 3.13Å |
| 461 | A | 81.9 | Confident | 81.9 | Confident | 47 Ų | 47 | 98.9 Ų | 98.9 | 39% | 0.388 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | T457 Q458 K463 V464 L465 | T457-A461 WeakPolarHBondContact O-CB 3.3Å; T457-A461 PolarHBondContact O-N 2.99Å; Q458-A461 PolarHBondContact O-N 3.22Å; A461-K463 VanDerWaalsContact C-N 3.34Å; A461-K463 PolarHBondContact O-N 2.96Å; A461-V464 PolarHBondContact O-N 3.34Å; A461-L465 WeakPolarHBondContact O-CB 3.41Å; A461-L465 WeakPolarHBondContact O-CG 3.32Å; A461-L465 PolarHBondContact O-N 3.43Å |
| 462 | Y | 86.3 | Confident | 83.5 | Confident | 176 Ų | 176 | 99.8 Ų | 99.8 | 69% | 0.69 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.9 | -36.4 | 176.9 | -167.3 | -95.9 | 0 | 0 | 0 | 112.6 | Q458 S459 S460 L465 S466 | Q458-Y462 PolarHBondContact O-N 2.91Å; S459-Y462 PolarHBondContact O-N 3.45Å; S460-Y462 VanDerWaalsContact C-N 3.34Å; S460-Y462 PolarHBondContact O-N 3.13Å; Y462-L465 PolarHBondContact O-N 2.7Å; Y462-S466 WeakPolarHBondContact O-CB 3.48Å; Y462-S466 PolarHBondContact O-N 2.91Å |
| 463 | K | 89.8 | Confident | 84.9 | Confident | 148 Ų | 148 | 99.1 Ų | 99.1 | 64% | 0.643 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -62.7 | -45.5 | 173.7 | -72.9 | 176.4 | -179.2 | 179.9 | 0 | 111.6 | S459 S460 A461 S466 V467 | S459-K463 WeakPolarHBondContact O-CG 3.48Å; S459-K463 PolarHBondContact O-N 3.34Å; S459-K463 VanDerWaalsContact O-N 3.11Å; S460-K463 PolarHBondContact O-N 3.36Å; A461-K463 VanDerWaalsContact C-N 3.34Å; A461-K463 PolarHBondContact O-N 2.96Å; K463-S466 WeakPolarHBondContact O-CB 3.26Å; K463-S466 PolarHBondContact O-N 3.08Å; K463-V467 WeakPolarHBondContact O-CG2 3.24Å; K463-V467 PolarHBondContact O-N 3.49Å; K463-V467 VanDerWaalsContact O-N 3.15Å |
| 464 | V | 90 | Very high | 86.3 | Confident | 94 Ų | 94 | 101.8 Ų | 101.8 | 57% | 0.57 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.3 | -46.5 | 176.8 | 175.7 | 0 | 0 | 0 | 0 | 110.8 | S460 A461 S466 V467 E468 | S460-V464 WeakPolarHBondContact O-CG2 3.25Å; S460-V464 PolarHBondContact O-N 3.02Å; S460-V464 VanDerWaalsContact O-N 3.13Å; A461-V464 PolarHBondContact O-N 3.34Å; V464-S466 VanDerWaalsContact C-N 3.29Å; V464-S466 PolarHBondContact O-N 3.03Å; V464-V467 PolarHBondContact O-N 3.34Å; V464-E468 PolarHBondContact O-N 3.13Å |
| 465 | L | 88.8 | Confident | 87.6 | Confident | 118 Ų | 118 | 104 Ų | 104 | 62% | 0.618 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.3 | -34.7 | 177.3 | -72 | 171.4 | 0 | 0 | 0 | 112.9 | A461 Y462 E468 K469 | A461-L465 WeakPolarHBondContact O-CB 3.41Å; A461-L465 WeakPolarHBondContact O-CG 3.32Å; A461-L465 PolarHBondContact O-N 3.43Å; Y462-L465 PolarHBondContact O-N 2.7Å; L465-E468 PolarHBondContact O-N 2.83Å; L465-K469 VanDerWaalsContact O-CB 3.31Å; L465-K469 WeakPolarHBondContact O-CB 3.19Å; L465-K469 PolarHBondContact O-N 3.25Å |
| 466 | S | 87.6 | Confident | 88.7 | Confident | 52 Ų | 52 | 102.5 Ų | 102.5 | 36% | 0.364 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.2 | -41.6 | 175.7 | -174.6 | 0 | 0 | 0 | 0 | 112.1 | Y462 K463 V464 K469 N470 | Y462-S466 WeakPolarHBondContact O-CB 3.48Å; Y462-S466 PolarHBondContact O-N 2.91Å; K463-S466 WeakPolarHBondContact O-CB 3.26Å; K463-S466 PolarHBondContact O-N 3.08Å; V464-S466 VanDerWaalsContact C-N 3.29Å; V464-S466 PolarHBondContact O-N 3.03Å; S466-K469 PolarHBondContact O-N 3.45Å; S466-N470 VanDerWaalsContact O-CG 3.31Å; S466-N470 PolarHBondContact O-N 3.28Å; S466-N470 PolarHBondContact O-ND2 3.42Å |
| 467 | V | 95.5 | Very high | 89.8 | Confident | 94 Ų | 94 | 103.6 Ų | 103.6 | 57% | 0.57 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.2 | -45.3 | 175.7 | 176.2 | 0 | 0 | 0 | 0 | 110.8 | K463 V464 K469 N470 R471 | K463-V467 WeakPolarHBondContact O-CG2 3.24Å; K463-V467 PolarHBondContact O-N 3.49Å; K463-V467 VanDerWaalsContact O-N 3.15Å; V464-V467 PolarHBondContact O-N 3.34Å; V467-K469 PolarHBondContact O-N 2.82Å; V467-N470 PolarHBondContact O-N 2.74Å; V467-N470 VanDerWaalsContact O-N 3.16Å; V467-R471 PolarHBondContact O-N 2.83Å |
| 468 | E | 93.3 | Very high | 90.9 | Very high | 83 Ų | 83 | 103.9 Ų | 103.9 | 39% | 0.388 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65 | -37.8 | 177.4 | -71.9 | -59.1 | 151.2 | 0 | 0 | 112.2 | V464 L465 N470 R471 L472 | V464-E468 PolarHBondContact O-N 3.13Å; L465-E468 PolarHBondContact O-N 2.83Å; E468-N470 VanDerWaalsContact C-N 3.32Å; E468-N470 PolarHBondContact O-N 2.79Å; E468-R471 PolarHBondContact O-N 3.26Å; E468-R471 IonicContact OE1-NH1 3.13Å; E468-L472 WeakPolarHBondContact O-CB 3.24Å; E468-L472 WeakPolarHBondContact O-CG 3.34Å; E468-L472 PolarHBondContact O-N 2.91Å |
| 469 | K | 93.4 | Very high | 91.6 | Very high | 135 Ų | 135 | 102.6 Ų | 102.6 | 59% | 0.587 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -57.6 | -44.9 | 171.3 | 177.6 | -175.1 | 174 | -179.4 | 0 | 111.4 | L465 S466 V467 L472 L473 | L465-K469 VanDerWaalsContact O-CB 3.31Å; L465-K469 WeakPolarHBondContact O-CB 3.19Å; L465-K469 PolarHBondContact O-N 3.25Å; S466-K469 PolarHBondContact O-N 3.45Å; V467-K469 PolarHBondContact O-N 2.82Å; K469-L472 PolarHBondContact O-N 3.42Å; K469-L473 HydrophobicContact CG-CD1 4.3Å; K469-L473 WeakPolarHBondContact O-CG 3.41Å; K469-L473 PolarHBondContact O-N 3.31Å |
| 470 | N | 94.4 | Very high | 92.5 | Very high | 94 Ų | 94 | 104.5 Ų | 104.5 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 178.7 | -69.7 | -26.1 | 0 | 0 | 0 | 111.7 | S466 V467 E468 L472 L473 E474 | S466-N470 VanDerWaalsContact O-CG 3.31Å; S466-N470 PolarHBondContact O-N 3.28Å; S466-N470 PolarHBondContact O-ND2 3.42Å; V467-N470 PolarHBondContact O-N 2.74Å; V467-N470 VanDerWaalsContact O-N 3.16Å; E468-N470 VanDerWaalsContact C-N 3.32Å; E468-N470 PolarHBondContact O-N 2.79Å; N470-L472 PolarHBondContact O-N 3.3Å; N470-L473 PolarHBondContact O-N 2.8Å; N470-E474 PolarHBondContact O-N 2.7Å |
| 471 | R | 96.6 | Very high | 93.4 | Very high | 167 Ų | 167 | 105.8 Ų | 105.8 | 63% | 0.63 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.5 | -41.1 | 175.1 | -170.4 | -179.5 | -176.2 | 179.5 | 2.6 | 112.3 | V467 E468 E474 L475 | V467-R471 PolarHBondContact O-N 2.83Å; E468-R471 PolarHBondContact O-N 3.26Å; E468-R471 IonicContact OE1-NH1 3.13Å; R471-E474 PolarHBondContact O-N 3.49Å; R471-L475 PolarHBondContact O-N 2.78Å |
| 472 | L | 95.6 | Very high | 94 | Very high | 106 Ų | 106 | 110.2 Ų | 110.2 | 56% | 0.555 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.4 | -40.7 | 175.3 | -74.1 | 172.5 | 0 | 0 | 0 | 111.8 | E468 K469 N470 E474 L475 V476 | E468-L472 WeakPolarHBondContact O-CB 3.24Å; E468-L472 WeakPolarHBondContact O-CG 3.34Å; E468-L472 PolarHBondContact O-N 2.91Å; K469-L472 PolarHBondContact O-N 3.42Å; N470-L472 PolarHBondContact O-N 3.3Å; L472-E474 VanDerWaalsContact C-N 3.31Å; L472-E474 PolarHBondContact O-N 2.97Å; L472-L475 PolarHBondContact O-N 3.49Å; L472-V476 VanDerWaalsContact O-CG2 3.32Å; L472-V476 WeakPolarHBondContact O-CG2 3.32Å; L472-V476 PolarHBondContact O-N 3.46Å |
| 473 | L | 95.6 | Very high | 94.5 | Very high | 87 Ų | 87 | 106.6 Ų | 106.6 | 46% | 0.455 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.1 | -39.3 | 174.9 | -75.1 | 170 | 0 | 0 | 0 | 111.9 | K469 N470 V476 K477 | K469-L473 HydrophobicContact CG-CD1 4.3Å; K469-L473 WeakPolarHBondContact O-CG 3.41Å; K469-L473 PolarHBondContact O-N 3.31Å; N470-L473 PolarHBondContact O-N 2.8Å; L473-V476 PolarHBondContact O-N 2.94Å; L473-K477 WeakPolarHBondContact O-CG 3.28Å; L473-K477 PolarHBondContact O-N 3.27Å |
| 474 | E | 97.3 | Very high | 94.8 | Very high | 125 Ų | 125 | 106.8 Ų | 106.8 | 58% | 0.584 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -65.5 | -42.9 | 174.8 | -170 | 171.5 | -165.5 | 0 | 0 | 111.8 | N470 R471 L472 V476 K477 L478 | N470-E474 PolarHBondContact O-N 2.7Å; R471-E474 PolarHBondContact O-N 3.49Å; L472-E474 VanDerWaalsContact C-N 3.31Å; L472-E474 PolarHBondContact O-N 2.97Å; E474-V476 VanDerWaalsContact C-N 3.33Å; E474-V476 PolarHBondContact O-N 3.24Å; E474-K477 WeakPolarHBondContact O-CB 3.47Å; E474-K477 PolarHBondContact O-N 3.44Å; E474-L478 WeakPolarHBondContact O-CG 3.39Å; E474-L478 PolarHBondContact O-N 3Å |
| 475 | L | 97 | Very high | 95.2 | Very high | 92 Ų | 92 | 107.7 Ų | 107.7 | 48% | 0.482 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 175 | -175.3 | 62.9 | 0 | 0 | 0 | 112 | R471 L472 K477 L478 L479 | R471-L475 PolarHBondContact O-N 2.78Å; L472-L475 PolarHBondContact O-N 3.49Å; L475-K477 VanDerWaalsContact C-N 3.34Å; L475-K477 PolarHBondContact O-N 3.42Å; L475-L478 PolarHBondContact O-N 2.96Å; L475-L479 HydrophobicContact CG-CD1 4.33Å; L475-L479 WeakPolarHBondContact O-CG 3.4Å; L475-L479 PolarHBondContact O-N 2.83Å |
| 476 | V | 96.7 | Very high | 95.5 | Very high | 72 Ų | 72 | 107.9 Ų | 107.9 | 44% | 0.436 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 175.3 | 169.4 | 0 | 0 | 0 | 0 | 111 | L472 L473 E474 L478 L479 Q480 | L472-V476 VanDerWaalsContact O-CG2 3.32Å; L472-V476 WeakPolarHBondContact O-CG2 3.32Å; L472-V476 PolarHBondContact O-N 3.46Å; L473-V476 PolarHBondContact O-N 2.94Å; E474-V476 VanDerWaalsContact C-N 3.33Å; E474-V476 PolarHBondContact O-N 3.24Å; V476-L478 PolarHBondContact O-N 2.85Å; V476-L479 PolarHBondContact O-N 2.88Å; V476-Q480 WeakPolarHBondContact O-CG 3.27Å; V476-Q480 PolarHBondContact O-N 3.32Å |
| 477 | K | 96.8 | Very high | 95.9 | Very high | 135 Ų | 135 | 111 Ų | 111 | 59% | 0.587 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.3 | -44.8 | 175.6 | -71.5 | 173.4 | -177 | 179.1 | 0 | 111.8 | L473 E474 L475 L479 Q480 I481 | L473-K477 WeakPolarHBondContact O-CG 3.28Å; L473-K477 PolarHBondContact O-N 3.27Å; E474-K477 WeakPolarHBondContact O-CB 3.47Å; E474-K477 PolarHBondContact O-N 3.44Å; L475-K477 VanDerWaalsContact C-N 3.34Å; L475-K477 PolarHBondContact O-N 3.42Å; K477-L479 VanDerWaalsContact C-N 3.34Å; K477-L479 PolarHBondContact O-N 3.42Å; K477-Q480 PolarHBondContact O-N 3.04Å; K477-I481 WeakPolarHBondContact O-CG1 3.45Å; K477-I481 PolarHBondContact O-N 3.33Å |
| 478 | L | 97.7 | Very high | 96 | Very high | 97 Ų | 97 | 111 Ų | 111 | 51% | 0.508 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.6 | -40.9 | 177.1 | -70.4 | 175.9 | 0 | 0 | 0 | 112.1 | E474 L475 V476 I481 K482 | E474-L478 WeakPolarHBondContact O-CG 3.39Å; E474-L478 PolarHBondContact O-N 3Å; L475-L478 PolarHBondContact O-N 2.96Å; V476-L478 PolarHBondContact O-N 2.85Å; L478-I481 PolarHBondContact O-N 2.95Å; L478-K482 PolarHBondContact O-N 3.02Å |
| 479 | L | 93.2 | Very high | 96.1 | Very high | 106 Ų | 106 | 111.1 Ų | 111.1 | 56% | 0.555 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.9 | -40.5 | 176.1 | -72.8 | 174.8 | 0 | 0 | 0 | 111.9 | L475 V476 K477 I481 K482 E483 | L475-L479 HydrophobicContact CG-CD1 4.33Å; L475-L479 WeakPolarHBondContact O-CG 3.4Å; L475-L479 PolarHBondContact O-N 2.83Å; V476-L479 PolarHBondContact O-N 2.88Å; K477-L479 VanDerWaalsContact C-N 3.34Å; K477-L479 PolarHBondContact O-N 3.42Å; L479-I481 VanDerWaalsContact C-N 3.34Å; L479-I481 PolarHBondContact O-N 3.38Å; L479-K482 PolarHBondContact O-N 2.74Å; L479-E483 WeakPolarHBondContact O-CB 3.44Å; L479-E483 PolarHBondContact O-N 3.01Å |
| 480 | Q | 96 | Very high | 96 | Very high | 105 Ų | 105 | 108.3 Ų | 108.3 | 49% | 0.491 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.8 | -38.1 | 175.2 | -74.5 | 176 | -11.7 | 0 | 0 | 112.5 | V476 K477 K484 | V476-Q480 WeakPolarHBondContact O-CG 3.27Å; V476-Q480 PolarHBondContact O-N 3.32Å; K477-Q480 PolarHBondContact O-N 3.04Å; Q480-K484 WeakPolarHBondContact O-CG 3.49Å; Q480-K484 PolarHBondContact O-N 3.26Å; Q480-K484 VanDerWaalsContact O-N 3.11Å |
| 481 | I | 97.6 | Very high | 96.1 | Very high | 88 Ų | 88 | 108.1 Ų | 108.1 | 45% | 0.451 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.1 | -50.4 | 174.7 | -68.1 | 165.7 | 0 | 0 | 0 | 109.8 | K477 L478 L479 E483 K484 E485 | K477-I481 WeakPolarHBondContact O-CG1 3.45Å; K477-I481 PolarHBondContact O-N 3.33Å; L478-I481 PolarHBondContact O-N 2.95Å; L479-I481 VanDerWaalsContact C-N 3.34Å; L479-I481 PolarHBondContact O-N 3.38Å; I481-E483 VanDerWaalsContact C-N 3.28Å; I481-E483 PolarHBondContact O-N 3.31Å; I481-K484 WeakPolarHBondContact O-CB 3.29Å; I481-K484 PolarHBondContact O-N 3.43Å; I481-K484 VanDerWaalsContact O-N 3.08Å; I481-E485 HydrophobicContact CG2-CG 4.45Å; I481-E485 WeakPolarHBondContact O-CG 3.29Å; I481-E485 PolarHBondContact O-N 2.88Å |
| 482 | K | 96.1 | Very high | 96.2 | Very high | 141 Ų | 141 | 104.4 Ų | 104.4 | 61% | 0.613 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.4 | -35.5 | 178 | -74.8 | -156.2 | 173.5 | -167.3 | 0 | 113.2 | L478 L479 E485 M486 | L478-K482 PolarHBondContact O-N 3.02Å; L479-K482 PolarHBondContact O-N 2.74Å; K482-E485 PolarHBondContact O-N 2.9Å; K482-M486 VanDerWaalsContact O-CB 3.3Å; K482-M486 WeakPolarHBondContact O-CB 3.42Å; K482-M486 PolarHBondContact O-N 3.45Å |
| 483 | E | 95.3 | Very high | 96.2 | Very high | 99 Ų | 99 | 102.1 Ų | 102.1 | 46% | 0.463 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 174.9 | -170.2 | -168.7 | 162.3 | 0 | 0 | 111.2 | L479 I481 M486 K487 | L479-E483 WeakPolarHBondContact O-CB 3.44Å; L479-E483 PolarHBondContact O-N 3.01Å; I481-E483 VanDerWaalsContact C-N 3.28Å; I481-E483 PolarHBondContact O-N 3.31Å; E483-M486 PolarHBondContact O-N 3.44Å; E483-K487 WeakPolarHBondContact O-CB 3.49Å; E483-K487 WeakPolarHBondContact O-CG 3.35Å; E483-K487 PolarHBondContact O-N 3.33Å; E483-K487 VanDerWaalsContact OE1-CE 3.22Å; E483-K487 WeakPolarHBondContact OE1-CE 3.48Å; E483-K487 IonicContact OE1-NZ 3.79Å; E483-K487 PolarHBondContact OE1-NZ 3.29Å |
| 484 | K | 96.9 | Very high | 96.1 | Very high | 153 Ų | 153 | 103 Ų | 103 | 67% | 0.665 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.9 | -44.6 | 176.1 | -71.8 | 176.2 | -178.3 | -177.3 | 0 | 112 | Q480 I481 K487 Q488 | Q480-K484 WeakPolarHBondContact O-CG 3.49Å; Q480-K484 PolarHBondContact O-N 3.26Å; Q480-K484 VanDerWaalsContact O-N 3.11Å; I481-K484 WeakPolarHBondContact O-CB 3.29Å; I481-K484 PolarHBondContact O-N 3.43Å; I481-K484 VanDerWaalsContact O-N 3.08Å; K484-K487 PolarHBondContact O-N 3.33Å; K484-Q488 PolarHBondContact O-N 2.91Å |
| 485 | E | 97.4 | Very high | 96.1 | Very high | 112 Ų | 112 | 103.1 Ų | 103.1 | 52% | 0.523 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.4 | -45.4 | 175.8 | -71 | 172.7 | 174.1 | 0 | 0 | 111.3 | I481 K482 K487 Q488 V489 | I481-E485 HydrophobicContact CG2-CG 4.45Å; I481-E485 WeakPolarHBondContact O-CG 3.29Å; I481-E485 PolarHBondContact O-N 2.88Å; K482-E485 PolarHBondContact O-N 2.9Å; E485-K487 PolarHBondContact O-N 3.46Å; E485-Q488 WeakPolarHBondContact O-CB 3.21Å; E485-Q488 PolarHBondContact O-N 3.27Å; E485-V489 WeakPolarHBondContact O-CG2 3.47Å; E485-V489 PolarHBondContact O-N 3.12Å |
| 486 | M | 94.8 | Very high | 96.1 | Very high | 122 Ų | 122 | 105.2 Ų | 105.2 | 60% | 0.601 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.7 | -42.4 | 178.5 | -166.5 | 64.8 | 65 | 0 | 0 | 111.7 | K482 E483 Q488 V489 C490 | K482-M486 VanDerWaalsContact O-CB 3.3Å; K482-M486 WeakPolarHBondContact O-CB 3.42Å; K482-M486 PolarHBondContact O-N 3.45Å; E483-M486 PolarHBondContact O-N 3.44Å; M486-Q488 VanDerWaalsContact C-N 3.29Å; M486-Q488 PolarHBondContact O-N 2.92Å; M486-V489 PolarHBondContact O-N 3Å; M486-C490 PolarHBondContact O-N 2.96Å; M486-C490 PolarHBondContact O-SG 3.4Å |
| 487 | K | 96.1 | Very high | 96.1 | Very high | 117 Ų | 117 | 108.9 Ų | 108.9 | 51% | 0.509 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59 | -41.9 | 174.1 | -76.7 | 175.7 | -175.6 | 171.1 | 0 | 111.6 | E483 K484 E485 C490 L491 | E483-K487 WeakPolarHBondContact O-CB 3.49Å; E483-K487 WeakPolarHBondContact O-CG 3.35Å; E483-K487 PolarHBondContact O-N 3.33Å; E483-K487 VanDerWaalsContact OE1-CE 3.22Å; E483-K487 WeakPolarHBondContact OE1-CE 3.48Å; E483-K487 IonicContact OE1-NZ 3.79Å; E483-K487 PolarHBondContact OE1-NZ 3.29Å; K484-K487 PolarHBondContact O-N 3.33Å; E485-K487 PolarHBondContact O-N 3.46Å; K487-C490 PolarHBondContact O-N 3.21Å; K487-L491 WeakPolarHBondContact O-CG 3.37Å; K487-L491 PolarHBondContact O-N 3.2Å |
| 488 | Q | 97.5 | Very high | 96 | Very high | 95 Ų | 95 | 106.4 Ų | 106.4 | 44% | 0.444 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.4 | -46.5 | 176.8 | -178 | 60.8 | 26.2 | 0 | 0 | 111.7 | K484 E485 M486 C490 L491 E492 | K484-Q488 PolarHBondContact O-N 2.91Å; E485-Q488 WeakPolarHBondContact O-CB 3.21Å; E485-Q488 PolarHBondContact O-N 3.27Å; M486-Q488 VanDerWaalsContact C-N 3.29Å; M486-Q488 PolarHBondContact O-N 2.92Å; Q488-C490 VanDerWaalsContact C-N 3.33Å; Q488-C490 PolarHBondContact O-N 3.03Å; Q488-L491 PolarHBondContact O-N 3.46Å; Q488-E492 PolarHBondContact NE2-OE1 3.44Å; Q488-E492 WeakPolarHBondContact O-CG 3.36Å; Q488-E492 PolarHBondContact O-N 3.36Å |
| 489 | V | 97.1 | Very high | 96 | Very high | 85 Ų | 85 | 106.5 Ų | 106.5 | 52% | 0.515 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.5 | -42.1 | 176.5 | 172.7 | 0 | 0 | 0 | 0 | 111.4 | E485 M486 L491 E492 A493 | E485-V489 WeakPolarHBondContact O-CG2 3.47Å; E485-V489 PolarHBondContact O-N 3.12Å; M486-V489 PolarHBondContact O-N 3Å; V489-L491 PolarHBondContact O-N 2.98Å; V489-E492 PolarHBondContact O-N 3.02Å; V489-A493 WeakPolarHBondContact O-CB 3.25Å; V489-A493 PolarHBondContact O-N 2.97Å |
| 490 | C | 91.3 | Very high | 96.1 | Very high | 76 Ų | 76 | 106.1 Ų | 106.1 | 51% | 0.514 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 175.6 | -70.5 | 0 | 0 | 0 | 0 | 112.2 | M486 K487 Q488 E492 A493 E494 | M486-C490 PolarHBondContact O-N 2.96Å; M486-C490 PolarHBondContact O-SG 3.4Å; K487-C490 PolarHBondContact O-N 3.21Å; Q488-C490 VanDerWaalsContact C-N 3.33Å; Q488-C490 PolarHBondContact O-N 3.03Å; C490-E492 VanDerWaalsContact C-N 3.34Å; C490-E492 PolarHBondContact O-N 2.9Å; C490-A493 PolarHBondContact O-N 3.11Å; C490-E494 PolarHBondContact O-N 2.93Å |
| 491 | L | 96.5 | Very high | 96.2 | Very high | 90 Ų | 90 | 108.6 Ų | 108.6 | 47% | 0.471 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.7 | -39 | 177.7 | -71.9 | 170.8 | 0 | 0 | 0 | 112.2 | K487 Q488 V489 E494 K495 | K487-L491 WeakPolarHBondContact O-CG 3.37Å; K487-L491 PolarHBondContact O-N 3.2Å; Q488-L491 PolarHBondContact O-N 3.46Å; V489-L491 PolarHBondContact O-N 2.98Å; L491-E494 PolarHBondContact O-N 3.37Å; L491-K495 WeakPolarHBondContact O-CG 3.4Å; L491-K495 PolarHBondContact O-N 3.4Å |
| 492 | E | 97.3 | Very high | 96.1 | Very high | 90 Ų | 90 | 111.6 Ų | 111.6 | 42% | 0.421 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -67.2 | -40.8 | 175.9 | -72.9 | 173.9 | -163.9 | 0 | 0 | 112.2 | Q488 V489 C490 E494 K495 K496 | Q488-E492 PolarHBondContact NE2-OE1 3.44Å; Q488-E492 WeakPolarHBondContact O-CG 3.36Å; Q488-E492 PolarHBondContact O-N 3.36Å; V489-E492 PolarHBondContact O-N 3.02Å; C490-E492 VanDerWaalsContact C-N 3.34Å; C490-E492 PolarHBondContact O-N 2.9Å; E492-E494 VanDerWaalsContact C-N 3.34Å; E492-K495 PolarHBondContact O-N 2.94Å; E492-K496 WeakPolarHBondContact O-CG 3.36Å; E492-K496 PolarHBondContact O-N 3.46Å |
| 493 | A | 95.2 | Very high | 96.1 | Very high | 57 Ų | 57 | 110 Ų | 110 | 47% | 0.471 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.8 | -41 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | V489 C490 K496 Y497 | V489-A493 WeakPolarHBondContact O-CB 3.25Å; V489-A493 PolarHBondContact O-N 2.97Å; C490-A493 PolarHBondContact O-N 3.11Å; A493-K496 PolarHBondContact O-N 3.17Å; A493-Y497 WeakPolarHBondContact O-CB 3.46Å; A493-Y497 PolarHBondContact O-N 3.28Å |
| 494 | E | 94.5 | Very high | 96.1 | Very high | 105 Ų | 105 | 108.5 Ų | 108.5 | 49% | 0.491 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 176.8 | -171.1 | 174.4 | -174.1 | 0 | 0 | 111.9 | C490 L491 E492 Y497 Q498 | C490-E494 PolarHBondContact O-N 2.93Å; L491-E494 PolarHBondContact O-N 3.37Å; E492-E494 VanDerWaalsContact C-N 3.34Å; E494-Y497 PolarHBondContact O-N 2.88Å; E494-Q498 WeakPolarHBondContact O-CG 3.5Å; E494-Q498 PolarHBondContact O-N 3.46Å |
| 495 | K | 97.3 | Very high | 96.1 | Very high | 128 Ų | 128 | 105.9 Ų | 105.9 | 56% | 0.557 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.9 | -47.3 | 174.1 | -74.4 | 178 | -176.9 | 179.9 | 0 | 112 | L491 E492 Y497 Q498 E499 | L491-K495 WeakPolarHBondContact O-CG 3.4Å; L491-K495 PolarHBondContact O-N 3.4Å; E492-K495 PolarHBondContact O-N 2.94Å; K495-Y497 VanDerWaalsContact C-N 3.32Å; K495-Y497 PolarHBondContact O-N 2.94Å; K495-Q498 PolarHBondContact O-N 3.37Å; K495-E499 WeakPolarHBondContact O-CG 3.19Å; K495-E499 PolarHBondContact O-N 2.97Å |
| 496 | K | 97.6 | Very high | 96 | Very high | 137 Ų | 137 | 104.9 Ų | 104.9 | 60% | 0.596 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.4 | -42.3 | 176.8 | -72.9 | -179.7 | -178 | 178 | 0 | 111.9 | E492 A493 Q498 E499 E500 | E492-K496 WeakPolarHBondContact O-CG 3.36Å; E492-K496 PolarHBondContact O-N 3.46Å; A493-K496 PolarHBondContact O-N 3.17Å; K496-Q498 VanDerWaalsContact C-N 3.34Å; K496-Q498 PolarHBondContact O-N 2.97Å; K496-E499 PolarHBondContact O-N 2.74Å; K496-E500 PolarHBondContact O-N 2.79Å |
| 497 | Y | 95.3 | Very high | 96 | Very high | 149 Ų | 149 | 103.9 Ų | 103.9 | 58% | 0.584 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.2 | -42.8 | 175.9 | 174.6 | -105.9 | 0 | 0 | 0 | 112.1 | A493 E494 K495 E500 R501 | A493-Y497 WeakPolarHBondContact O-CB 3.46Å; A493-Y497 PolarHBondContact O-N 3.28Å; E494-Y497 PolarHBondContact O-N 2.88Å; K495-Y497 VanDerWaalsContact C-N 3.32Å; K495-Y497 PolarHBondContact O-N 2.94Å; Y497-E500 PolarHBondContact O-N 3.41Å; Y497-R501 WeakPolarHBondContact O-CB 3.33Å; Y497-R501 PolarHBondContact O-N 2.92Å |
| 498 | Q | 96.3 | Very high | 95.8 | Very high | 83 Ų | 83 | 103.1 Ų | 103.1 | 39% | 0.388 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.5 | -38.6 | 175.7 | -70.3 | 179.5 | 12 | 0 | 0 | 112.3 | E494 K495 K496 R501 R502 | E494-Q498 WeakPolarHBondContact O-CG 3.5Å; E494-Q498 PolarHBondContact O-N 3.46Å; K495-Q498 PolarHBondContact O-N 3.37Å; K496-Q498 VanDerWaalsContact C-N 3.34Å; K496-Q498 PolarHBondContact O-N 2.97Å; Q498-R501 PolarHBondContact O-N 2.87Å; Q498-R502 WeakPolarHBondContact O-CG 3.27Å; Q498-R502 PolarHBondContact O-N 3.5Å |
| 499 | E | 97.3 | Very high | 95.6 | Very high | 98 Ų | 98 | 103.3 Ų | 103.3 | 46% | 0.458 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.9 | -47.4 | 175.2 | -74.2 | 174 | -171.1 | 0 | 0 | 112.2 | K495 K496 R501 R502 K503 | K495-E499 WeakPolarHBondContact O-CG 3.19Å; K495-E499 PolarHBondContact O-N 2.97Å; K496-E499 PolarHBondContact O-N 2.74Å; E499-R501 VanDerWaalsContact C-N 3.31Å; E499-R501 PolarHBondContact O-N 3.35Å; E499-R502 WeakPolarHBondContact O-CB 3.44Å; E499-R502 PolarHBondContact O-N 3.29Å; E499-R502 VanDerWaalsContact O-N 3.15Å; E499-K503 WeakPolarHBondContact O-CG 3.43Å; E499-K503 PolarHBondContact O-N 3.11Å |
| 500 | E | 95.4 | Very high | 95.4 | Very high | 98 Ų | 98 | 104.7 Ų | 104.7 | 46% | 0.458 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.8 | -42.4 | 175.7 | -72.5 | -54.7 | 132.9 | 0 | 0 | 111.2 | K496 Y497 R502 K503 T504 | K496-E500 PolarHBondContact O-N 2.79Å; Y497-E500 PolarHBondContact O-N 3.41Å; E500-R502 VanDerWaalsContact C-N 3.29Å; E500-R502 PolarHBondContact O-N 3.04Å; E500-K503 WeakPolarHBondContact O-CB 3.36Å; E500-K503 PolarHBondContact O-N 3.37Å; E500-K503 IonicContact OE1-NZ 2.66Å; E500-K503 PolarHBondContact OE1-NZ 2.94Å; E500-T504 PolarHBondContact O-N 3.41Å; E500-T504 PolarHBondContact O-OG1 2.97Å |
| 501 | R | 96.3 | Very high | 95.1 | Very high | 157 Ų | 157 | 107.3 Ų | 107.3 | 59% | 0.592 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.2 | -39.3 | 175 | -172.3 | 171.8 | 179.5 | 177.5 | 0.4 | 112.5 | Y497 Q498 E499 T504 L505 | Y497-R501 WeakPolarHBondContact O-CB 3.33Å; Y497-R501 PolarHBondContact O-N 2.92Å; Q498-R501 PolarHBondContact O-N 2.87Å; E499-R501 VanDerWaalsContact C-N 3.31Å; E499-R501 PolarHBondContact O-N 3.35Å; R501-T504 PolarHBondContact O-N 2.94Å; R501-L505 WeakPolarHBondContact O-CG 3.34Å; R501-L505 PolarHBondContact O-N 3.32Å; R501-L505 VanDerWaalsContact O-N 3.08Å |
| 502 | R | 96.6 | Very high | 94.5 | Very high | 152 Ų | 152 | 110.8 Ų | 110.8 | 57% | 0.574 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -65.2 | -42.5 | 174 | -70.9 | 172.9 | -171.8 | 153.2 | 4.7 | 111.5 | Q498 E499 E500 L505 I506 | Q498-R502 WeakPolarHBondContact O-CG 3.27Å; Q498-R502 PolarHBondContact O-N 3.5Å; E499-R502 WeakPolarHBondContact O-CB 3.44Å; E499-R502 PolarHBondContact O-N 3.29Å; E499-R502 VanDerWaalsContact O-N 3.15Å; E500-R502 VanDerWaalsContact C-N 3.29Å; E500-R502 PolarHBondContact O-N 3.04Å; R502-L505 PolarHBondContact O-N 3.37Å; R502-I506 WeakPolarHBondContact O-CG1 3.49Å; R502-I506 PolarHBondContact O-N 3.28Å; R502-I506 VanDerWaalsContact O-N 3.08Å |
| 503 | K | 96.8 | Very high | 93.8 | Very high | 106 Ų | 106 | 115.4 Ų | 115.4 | 46% | 0.461 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.6 | -44.3 | 176.1 | -67.5 | 175.5 | -169.4 | 167.9 | 0 | 111.5 | E499 E500 L505 I506 L507 | E499-K503 WeakPolarHBondContact O-CG 3.43Å; E499-K503 PolarHBondContact O-N 3.11Å; E500-K503 WeakPolarHBondContact O-CB 3.36Å; E500-K503 PolarHBondContact O-N 3.37Å; E500-K503 IonicContact OE1-NZ 2.66Å; E500-K503 PolarHBondContact OE1-NZ 2.94Å; K503-L505 PolarHBondContact O-N 3.45Å; K503-I506 PolarHBondContact O-N 3.02Å; K503-L507 WeakPolarHBondContact O-CG 3.39Å; K503-L507 PolarHBondContact O-N 3.2Å |
| 504 | T | 95.1 | Very high | 92.3 | Very high | 69 Ų | 69 | 119.1 Ų | 119.1 | 42% | 0.423 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -59.1 | -45.7 | 176.2 | -52.1 | 0 | 0 | 0 | 0 | 111.4 | E500 R501 I506 L507 E508 | E500-T504 PolarHBondContact O-N 3.41Å; E500-T504 PolarHBondContact O-OG1 2.97Å; R501-T504 PolarHBondContact O-N 2.94Å; T504-I506 VanDerWaalsContact C-N 3.31Å; T504-I506 PolarHBondContact O-N 2.95Å; T504-L507 PolarHBondContact O-N 3.39Å; T504-E508 HydrophobicContact CG2-CG 4.47Å; T504-E508 WeakPolarHBondContact O-CG 3.35Å; T504-E508 PolarHBondContact O-N 3.25Å |
| 505 | L | 96.3 | Very high | 92.2 | Very high | 98 Ų | 98 | 119.9 Ų | 119.9 | 51% | 0.513 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -60.7 | -39.2 | 177 | -72.9 | 171.2 | 0 | 0 | 0 | 112.6 | R501 R502 K503 Q509 | R501-L505 WeakPolarHBondContact O-CG 3.34Å; R501-L505 PolarHBondContact O-N 3.32Å; R501-L505 VanDerWaalsContact O-N 3.08Å; R502-L505 PolarHBondContact O-N 3.37Å; K503-L505 PolarHBondContact O-N 3.45Å; L505-Q509 WeakPolarHBondContact O-CB 3.46Å; L505-Q509 PolarHBondContact O-N 3.46Å |
| 506 | I | 95.7 | Very high | 91.9 | Very high | 90 Ų | 90 | 119.4 Ų | 119.4 | 46% | 0.462 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -65.5 | -43.9 | 176.2 | -66.6 | 165.7 | 0 | 0 | 0 | 110.5 | R502 K503 T504 Q509 Q510 | R502-I506 WeakPolarHBondContact O-CG1 3.49Å; R502-I506 PolarHBondContact O-N 3.28Å; R502-I506 VanDerWaalsContact O-N 3.08Å; K503-I506 PolarHBondContact O-N 3.02Å; T504-I506 VanDerWaalsContact C-N 3.31Å; T504-I506 PolarHBondContact O-N 2.95Å; I506-Q509 PolarHBondContact O-N 3.04Å; I506-Q510 WeakPolarHBondContact O-CG 3.31Å; I506-Q510 PolarHBondContact O-N 3.04Å |
| 507 | L | 93.9 | Very high | 91.6 | Very high | 102 Ų | 102 | 118.4 Ų | 118.4 | 53% | 0.534 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.8 | -42.2 | 177.4 | -70.9 | 172.1 | 0 | 0 | 0 | 111.9 | K503 T504 Q509 Q510 L511 | K503-L507 WeakPolarHBondContact O-CG 3.39Å; K503-L507 PolarHBondContact O-N 3.2Å; T504-L507 PolarHBondContact O-N 3.39Å; L507-Q509 VanDerWaalsContact C-N 3.33Å; L507-Q509 PolarHBondContact O-N 3.44Å; L507-Q510 PolarHBondContact O-N 3.17Å; L507-L511 WeakPolarHBondContact O-CG 3.36Å; L507-L511 PolarHBondContact O-N 3.31Å |
| 508 | E | 92.3 | Very high | 91.4 | Very high | 101 Ų | 101 | 116.6 Ų | 116.6 | 47% | 0.472 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -60.4 | -42.4 | 173.9 | -75.8 | 177.9 | 174.6 | 0 | 0 | 111.5 | T504 Q510 L511 Q512 | T504-E508 HydrophobicContact CG2-CG 4.47Å; T504-E508 WeakPolarHBondContact O-CG 3.35Å; T504-E508 PolarHBondContact O-N 3.25Å; E508-Q510 VanDerWaalsContact C-N 3.34Å; E508-Q510 PolarHBondContact O-N 2.96Å; E508-L511 PolarHBondContact O-N 3.48Å; E508-Q512 WeakPolarHBondContact O-CG 3.47Å; E508-Q512 PolarHBondContact O-N 3.19Å |
| 509 | Q | 93.5 | Very high | 91.1 | Very high | 99 Ų | 99 | 118.8 Ų | 118.8 | 46% | 0.463 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66.8 | -35 | 177 | -170.5 | 176.7 | 49.9 | 0 | 0 | 112.5 | L505 I506 L507 R513 | L505-Q509 WeakPolarHBondContact O-CB 3.46Å; L505-Q509 PolarHBondContact O-N 3.46Å; I506-Q509 PolarHBondContact O-N 3.04Å; L507-Q509 VanDerWaalsContact C-N 3.33Å; L507-Q509 PolarHBondContact O-N 3.44Å; Q509-R513 VanDerWaalsContact CD-NH2 3.33Å; Q509-R513 WeakPolarHBondContact O-CG 3.38Å; Q509-R513 PolarHBondContact O-N 3.49Å |
| 510 | Q | 92.5 | Very high | 90.7 | Very high | 114 Ų | 114 | 120.1 Ų | 120.1 | 53% | 0.533 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -68.3 | -41.4 | 174.2 | -73.8 | 176.5 | -7.7 | 0 | 0 | 111.6 | I506 L507 E508 Q512 R513 A514 | I506-Q510 WeakPolarHBondContact O-CG 3.31Å; I506-Q510 PolarHBondContact O-N 3.04Å; L507-Q510 PolarHBondContact O-N 3.17Å; E508-Q510 VanDerWaalsContact C-N 3.34Å; E508-Q510 PolarHBondContact O-N 2.96Å; Q510-Q512 VanDerWaalsContact C-N 3.31Å; Q510-Q512 PolarHBondContact O-N 3.32Å; Q510-R513 PolarHBondContact O-N 3.5Å; Q510-R513 VanDerWaalsContact O-N 3.16Å; Q510-A514 PolarHBondContact O-N 3.29Å; Q510-A514 VanDerWaalsContact O-N 3.16Å |
| 511 | L | 85.6 | Confident | 90.4 | Very high | 130 Ų | 130 | 121.7 Ų | 121.7 | 68% | 0.681 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -64.6 | -32.2 | 175.7 | -77.3 | 169.9 | 0 | 0 | 0 | 113.1 | L507 E508 R513 | L507-L511 WeakPolarHBondContact O-CG 3.36Å; L507-L511 PolarHBondContact O-N 3.31Å; E508-L511 PolarHBondContact O-N 3.48Å; L511-R513 VanDerWaalsContact C-N 3.29Å |
| 512 | Q | 84.6 | Confident | 89.9 | Confident | 164 Ų | 164 | 119 Ų | 119 | 77% | 0.766 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -17.2 | 175.1 | -74.9 | 178.9 | -1.8 | 0 | 0 | 113.8 | E508 Q510 | E508-Q512 WeakPolarHBondContact O-CG 3.47Å; E508-Q512 PolarHBondContact O-N 3.19Å; Q510-Q512 VanDerWaalsContact C-N 3.31Å; Q510-Q512 PolarHBondContact O-N 3.32Å |
| 513 | R | 81.8 | Confident | 89.3 | Confident | 187 Ų | 187 | 116.3 Ų | 116.3 | 71% | 0.706 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96 | -17.9 | 178.6 | -72 | 179.1 | -173.3 | 168.5 | 5.3 | 113.3 | Q509 Q510 L511 | Q509-R513 VanDerWaalsContact CD-NH2 3.33Å; Q509-R513 WeakPolarHBondContact O-CG 3.38Å; Q509-R513 PolarHBondContact O-N 3.49Å; Q510-R513 PolarHBondContact O-N 3.5Å; Q510-R513 VanDerWaalsContact O-N 3.16Å; L511-R513 VanDerWaalsContact C-N 3.29Å |
| 514 | A | 64.1 | Low | 88.7 | Confident | 135 Ų | 135 | 117.2 Ų | 117.2 | 100% | 1.116 | 61% | 0.606 | S | S | * | * | trans | -82.6 | 0 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q510 | Q510-A514 PolarHBondContact O-N 3.29Å; Q510-A514 VanDerWaalsContact O-N 3.16Å |
Retrieved 514 of 514 residues in 646.5 ms
(Link to these results)