| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 55.1 | Low | 79 | Confident | 222 Ų | 222 | 118.2 Ų | 118.2 | 100% | 1.094 | 63% | 0.63 | S | S | * | * | 0 | -25.3 | 0 | -74.7 | -159.9 | -76.2 | 0 | 0 | 113.8 | |||||
| 2 | T | 62.3 | Low | 80.4 | Confident | 132 Ų | 132 | 115.1 Ų | 115.1 | 81% | 0.81 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -72.3 | -28 | 179.9 | 36.2 | 0 | 0 | 0 | 0 | 115.1 | G5 A6 | T2-G5 PolarHBondContact O-N 3.39Å; T2-A6 PolarHBondContact O-N 3.18Å |
| 3 | Q | 65.8 | Low | 81.5 | Confident | 174 Ų | 174 | 113.5 Ų | 113.5 | 81% | 0.813 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -72.7 | -36.6 | -173.8 | -140.7 | 177.1 | 26.7 | 0 | 0 | 114 | A6 A7 | Q3-A6 PolarHBondContact O-N 3.39Å; Q3-A7 PolarHBondContact O-N 3.16Å; Q3-A7 VanDerWaalsContact O-N 3.17Å |
| 4 | Q | 71.6 | Confident | 82.6 | Confident | 165 Ų | 165 | 112.7 Ų | 112.7 | 77% | 0.771 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -68.9 | -36.4 | 174.7 | -92 | 177 | -22.9 | 0 | 0 | 112.2 | A7 L8 | Q4-A7 PolarHBondContact O-N 3.39Å; Q4-L8 WeakPolarHBondContact O-CB 3.41Å; Q4-L8 PolarHBondContact O-N 3.31Å |
| 5 | G | 80.1 | Confident | 83.5 | Confident | 40 Ų | 40 | 112.2 Ų | 112.2 | 41% | 0.412 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -63.3 | -41.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | T2 L8 Q9 | T2-G5 PolarHBondContact O-N 3.39Å; G5-L8 PolarHBondContact O-N 2.85Å; G5-Q9 WeakPolarHBondContact O-CB 3.5Å; G5-Q9 PolarHBondContact O-N 3.32Å |
| 6 | A | 83.1 | Confident | 84.4 | Confident | 59 Ų | 59 | 109.9 Ų | 109.9 | 49% | 0.488 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.5 | -41.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | T2 Q3 Q9 N10 | T2-A6 PolarHBondContact O-N 3.18Å; Q3-A6 PolarHBondContact O-N 3.39Å; A6-Q9 PolarHBondContact O-N 3.48Å; A6-N10 PolarHBondContact O-N 2.78Å |
| 7 | A | 84.9 | Confident | 85.1 | Confident | 45 Ų | 45 | 110.8 Ų | 110.8 | 37% | 0.372 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -64.4 | -45.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q3 Q4 Q9 N10 Y11 | Q3-A7 PolarHBondContact O-N 3.16Å; Q3-A7 VanDerWaalsContact O-N 3.17Å; Q4-A7 PolarHBondContact O-N 3.39Å; A7-Q9 VanDerWaalsContact C-N 3.33Å; A7-Q9 PolarHBondContact O-N 3.34Å; A7-N10 PolarHBondContact O-N 3.3Å; A7-Y11 HydrophobicContact CB-CE2 4.45Å; A7-Y11 WeakPolarHBondContact O-CD2 3.43Å; A7-Y11 PolarHBondContact O-N 2.93Å |
| 8 | L | 89.9 | Confident | 85.8 | Confident | 106 Ų | 106 | 108.5 Ų | 108.5 | 56% | 0.555 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -62.3 | -40.4 | 177.1 | -174 | 66.1 | 0 | 0 | 0 | 112 | Q4 G5 N10 Y11 N12 | Q4-L8 WeakPolarHBondContact O-CB 3.41Å; Q4-L8 PolarHBondContact O-N 3.31Å; G5-L8 PolarHBondContact O-N 2.85Å; L8-N10 VanDerWaalsContact C-N 3.32Å; L8-N10 PolarHBondContact O-N 3.25Å; L8-Y11 PolarHBondContact O-N 2.98Å; L8-N12 WeakPolarHBondContact O-CB 3.44Å; L8-N12 VanDerWaalsContact O-CG 3.3Å; L8-N12 PolarHBondContact O-N 2.91Å; L8-N12 PolarHBondContact O-ND2 3.44Å |
| 9 | Q | 91 | Very high | 86.5 | Confident | 122 Ų | 122 | 108.1 Ų | 108.1 | 57% | 0.57 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -62.9 | -39.1 | 175.6 | -173.6 | 175.4 | -8.8 | 0 | 0 | 111.8 | G5 A6 A7 N12 N13 | G5-Q9 WeakPolarHBondContact O-CB 3.5Å; G5-Q9 PolarHBondContact O-N 3.32Å; A6-Q9 PolarHBondContact O-N 3.48Å; A7-Q9 VanDerWaalsContact C-N 3.33Å; A7-Q9 PolarHBondContact O-N 3.34Å; Q9-N12 PolarHBondContact O-N 2.92Å; Q9-N13 PolarHBondContact O-N 3.22Å; Q9-N13 PolarHBondContact O-ND2 3.34Å; Q9-N13 PolarHBondContact O-OD1 3.12Å |
| 10 | N | 91.7 | Very high | 87 | Confident | 89 Ų | 89 | 108.2 Ų | 108.2 | 48% | 0.476 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.6 | -46.7 | 175.9 | -163.2 | 19.7 | 0 | 0 | 0 | 111.8 | A6 A7 L8 N12 N13 E14 | A6-N10 PolarHBondContact O-N 2.78Å; A7-N10 PolarHBondContact O-N 3.3Å; L8-N10 VanDerWaalsContact C-N 3.32Å; L8-N10 PolarHBondContact O-N 3.25Å; N10-N12 VanDerWaalsContact C-N 3.33Å; N10-N12 PolarHBondContact O-N 3.48Å; N10-N13 PolarHBondContact O-N 3.43Å; N10-E14 PolarHBondContact O-N 3.41Å |
| 11 | Y | 93.8 | Very high | 87.6 | Confident | 146 Ų | 146 | 106.8 Ų | 106.8 | 57% | 0.573 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -59.5 | -42.6 | 175.3 | -70.3 | -58.2 | 0 | 0 | 0 | 112.5 | A7 L8 N13 E14 L15 | A7-Y11 HydrophobicContact CB-CE2 4.45Å; A7-Y11 WeakPolarHBondContact O-CD2 3.43Å; A7-Y11 PolarHBondContact O-N 2.93Å; L8-Y11 PolarHBondContact O-N 2.98Å; Y11-N13 VanDerWaalsContact C-N 3.33Å; Y11-N13 PolarHBondContact O-N 3.16Å; Y11-E14 PolarHBondContact O-N 3.24Å; Y11-L15 WeakPolarHBondContact O-CB 3.44Å; Y11-L15 VanDerWaalsContact O-CG 3.28Å; Y11-L15 WeakPolarHBondContact O-CG 3.43Å; Y11-L15 PolarHBondContact O-N 3.49Å |
| 12 | N | 94.9 | Very high | 89.6 | Confident | 81 Ų | 81 | 101.6 Ų | 101.6 | 43% | 0.433 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.4 | -40.6 | 176.8 | -74.4 | -19.8 | 0 | 0 | 0 | 111.8 | L8 Q9 N10 L15 V16 | L8-N12 WeakPolarHBondContact O-CB 3.44Å; L8-N12 VanDerWaalsContact O-CG 3.3Å; L8-N12 PolarHBondContact O-N 2.91Å; L8-N12 PolarHBondContact O-ND2 3.44Å; Q9-N12 PolarHBondContact O-N 2.92Å; N10-N12 VanDerWaalsContact C-N 3.33Å; N10-N12 PolarHBondContact O-N 3.48Å; N12-L15 PolarHBondContact O-N 3.22Å; N12-V16 VanDerWaalsContact O-CG2 3.28Å; N12-V16 WeakPolarHBondContact O-CG2 3.45Å; N12-V16 PolarHBondContact O-N 3.45Å |
| 13 | N | 95.6 | Very high | 91.3 | Very high | 95 Ų | 95 | 97.3 Ų | 97.3 | 51% | 0.508 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.6 | -42.9 | 177 | -69.3 | -14.6 | 0 | 0 | 0 | 112 | Q9 N10 Y11 V16 K17 | Q9-N13 PolarHBondContact O-N 3.22Å; Q9-N13 PolarHBondContact O-ND2 3.34Å; Q9-N13 PolarHBondContact O-OD1 3.12Å; N10-N13 PolarHBondContact O-N 3.43Å; Y11-N13 VanDerWaalsContact C-N 3.33Å; Y11-N13 PolarHBondContact O-N 3.16Å; N13-V16 PolarHBondContact O-N 3.39Å; N13-K17 WeakPolarHBondContact O-CB 3.42Å; N13-K17 PolarHBondContact O-N 3.15Å |
| 14 | E | 96.3 | Very high | 92.9 | Very high | 102 Ų | 102 | 95 Ų | 95 | 48% | 0.477 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.8 | -43.2 | 176.1 | -71.8 | 179.8 | 178.7 | 0 | 0 | 111.7 | N10 Y11 K17 C18 | N10-E14 PolarHBondContact O-N 3.41Å; Y11-E14 PolarHBondContact O-N 3.24Å; E14-K17 PolarHBondContact O-N 3.3Å; E14-C18 PolarHBondContact O-N 3.17Å; E14-C18 PolarHBondContact O-SG 3.44Å; E14-C18 VanDerWaalsContact O-SG 3.42Å |
| 15 | L | 96.4 | Very high | 94.1 | Very high | 105 Ų | 105 | 93.8 Ų | 93.8 | 55% | 0.55 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 176.5 | -75 | 171.4 | 0 | 0 | 0 | 112 | Y11 N12 K17 C18 I19 | Y11-L15 WeakPolarHBondContact O-CB 3.44Å; Y11-L15 VanDerWaalsContact O-CG 3.28Å; Y11-L15 WeakPolarHBondContact O-CG 3.43Å; Y11-L15 PolarHBondContact O-N 3.49Å; N12-L15 PolarHBondContact O-N 3.22Å; L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 2.99Å; L15-C18 PolarHBondContact O-N 3.29Å; L15-I19 VanDerWaalsContact O-CG1 3.29Å; L15-I19 WeakPolarHBondContact O-CG1 3.45Å; L15-I19 PolarHBondContact O-N 3.08Å |
| 16 | V | 97.5 | Very high | 95 | Very high | 75 Ų | 75 | 98.5 Ų | 98.5 | 46% | 0.455 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.4 | -46.4 | 177.3 | 169.8 | 0 | 0 | 0 | 0 | 110.2 | N12 N13 C18 I19 E20 | N12-V16 VanDerWaalsContact O-CG2 3.28Å; N12-V16 WeakPolarHBondContact O-CG2 3.45Å; N12-V16 PolarHBondContact O-N 3.45Å; N13-V16 PolarHBondContact O-N 3.39Å; V16-C18 PolarHBondContact O-N 3.42Å; V16-I19 PolarHBondContact O-N 3.02Å; V16-I19 VanDerWaalsContact O-N 3.16Å; V16-E20 HydrophobicContact CG1-CG 4.37Å; V16-E20 WeakPolarHBondContact O-CG 3.49Å; V16-E20 PolarHBondContact O-N 3.44Å |
| 17 | K | 97.3 | Very high | 95.8 | Very high | 125 Ų | 125 | 101.2 Ų | 101.2 | 54% | 0.543 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 177.9 | -172.8 | -179.4 | 176.6 | -173.4 | 0 | 112.2 | N13 E14 L15 I19 E20 E21 | N13-K17 WeakPolarHBondContact O-CB 3.42Å; N13-K17 PolarHBondContact O-N 3.15Å; E14-K17 PolarHBondContact O-N 3.3Å; L15-K17 VanDerWaalsContact C-N 3.33Å; L15-K17 PolarHBondContact O-N 2.99Å; K17-I19 VanDerWaalsContact C-N 3.32Å; K17-I19 PolarHBondContact O-N 3.15Å; K17-E20 PolarHBondContact O-N 3.32Å; K17-E21 WeakPolarHBondContact CE-OE1 3.45Å; K17-E21 WeakPolarHBondContact O-CG 3.28Å; K17-E21 PolarHBondContact O-N 3.39Å |
| 18 | C | 97.6 | Very high | 96.4 | Very high | 70 Ų | 70 | 102.5 Ų | 102.5 | 47% | 0.473 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.8 | -39.1 | 176.4 | -72.5 | 0 | 0 | 0 | 0 | 112.3 | E14 L15 V16 E21 L22 | E14-C18 PolarHBondContact O-N 3.17Å; E14-C18 PolarHBondContact O-SG 3.44Å; E14-C18 VanDerWaalsContact O-SG 3.42Å; L15-C18 PolarHBondContact O-N 3.29Å; V16-C18 PolarHBondContact O-N 3.42Å; C18-E21 PolarHBondContact O-N 2.91Å; C18-L22 VanDerWaalsContact O-CG 3.27Å; C18-L22 WeakPolarHBondContact O-CG 3.34Å; C18-L22 PolarHBondContact O-N 2.94Å |
| 19 | I | 97.7 | Very high | 96.8 | Very high | 101 Ų | 101 | 102 Ų | 102 | 52% | 0.518 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.1 | -43.7 | 176.2 | -69.6 | 166.6 | 0 | 0 | 0 | 110.7 | L15 V16 K17 L22 C23 | L15-I19 VanDerWaalsContact O-CG1 3.29Å; L15-I19 WeakPolarHBondContact O-CG1 3.45Å; L15-I19 PolarHBondContact O-N 3.08Å; V16-I19 PolarHBondContact O-N 3.02Å; V16-I19 VanDerWaalsContact O-N 3.16Å; K17-I19 VanDerWaalsContact C-N 3.32Å; K17-I19 PolarHBondContact O-N 3.15Å; I19-L22 PolarHBondContact O-N 2.92Å; I19-C23 PolarHBondContact O-N 3.41Å; I19-C23 PolarHBondContact O-SG 2.88Å; I19-C23 VanDerWaalsContact O-SG 3.38Å |
| 20 | E | 97.8 | Very high | 97.2 | Very high | 110 Ų | 110 | 99.8 Ų | 99.8 | 51% | 0.514 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.5 | -45.6 | 176.6 | -73.4 | 175.1 | 173.5 | 0 | 0 | 111.7 | V16 K17 L22 C23 Q24 | V16-E20 HydrophobicContact CG1-CG 4.37Å; V16-E20 WeakPolarHBondContact O-CG 3.49Å; V16-E20 PolarHBondContact O-N 3.44Å; K17-E20 PolarHBondContact O-N 3.32Å; E20-L22 VanDerWaalsContact C-N 3.31Å; E20-L22 PolarHBondContact O-N 2.99Å; E20-C23 PolarHBondContact O-N 2.93Å; E20-Q24 WeakPolarHBondContact O-CG 3.5Å; E20-Q24 PolarHBondContact O-N 2.81Å |
| 21 | E | 98.2 | Very high | 97.5 | Very high | 79 Ų | 79 | 102 Ų | 102 | 37% | 0.369 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.5 | -39.5 | 175.6 | -73.5 | 177.7 | -164.2 | 0 | 0 | 112.1 | K17 C18 K25 | K17-E21 WeakPolarHBondContact CE-OE1 3.45Å; K17-E21 WeakPolarHBondContact O-CG 3.28Å; K17-E21 PolarHBondContact O-N 3.39Å; C18-E21 PolarHBondContact O-N 2.91Å; E21-K25 WeakPolarHBondContact O-CB 3.36Å; E21-K25 WeakPolarHBondContact O-CG 3.43Å; E21-K25 PolarHBondContact O-N 3.11Å |
| 22 | L | 98.3 | Very high | 97.7 | Very high | 112 Ų | 112 | 99.1 Ų | 99.1 | 59% | 0.586 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -67.9 | -40.8 | 176 | -72.4 | 172.1 | 0 | 0 | 0 | 112 | C18 I19 E20 K25 R26 | C18-L22 VanDerWaalsContact O-CG 3.27Å; C18-L22 WeakPolarHBondContact O-CG 3.34Å; C18-L22 PolarHBondContact O-N 2.94Å; I19-L22 PolarHBondContact O-N 2.92Å; E20-L22 VanDerWaalsContact C-N 3.31Å; E20-L22 PolarHBondContact O-N 2.99Å; L22-K25 PolarHBondContact O-N 3.4Å; L22-R26 WeakPolarHBondContact O-CB 3.37Å; L22-R26 PolarHBondContact O-N 2.97Å |
| 23 | C | 98.3 | Very high | 97.9 | Very high | 42 Ų | 42 | 99.1 Ų | 99.1 | 28% | 0.284 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.9 | -44.9 | 175 | -75 | 0 | 0 | 0 | 0 | 111.5 | I19 E20 R26 E27 | I19-C23 PolarHBondContact O-N 3.41Å; I19-C23 PolarHBondContact O-SG 2.88Å; I19-C23 VanDerWaalsContact O-SG 3.38Å; E20-C23 PolarHBondContact O-N 2.93Å; C23-R26 WeakPolarHBondContact O-CB 3.4Å; C23-R26 PolarHBondContact O-N 3.13Å; C23-E27 WeakPolarHBondContact O-CG 3.38Å; C23-E27 PolarHBondContact O-N 3.03Å |
| 24 | Q | 98.4 | Very high | 98.1 | Very high | 127 Ų | 127 | 99.1 Ų | 99.1 | 59% | 0.593 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.2 | -45.8 | 176.5 | -71.4 | 174.2 | 5.9 | 0 | 0 | 111.9 | E20 R26 E27 E28 | E20-Q24 WeakPolarHBondContact O-CG 3.5Å; E20-Q24 PolarHBondContact O-N 2.81Å; Q24-R26 VanDerWaalsContact C-N 3.3Å; Q24-R26 PolarHBondContact O-N 3.49Å; Q24-E27 PolarHBondContact O-N 2.96Å; Q24-E28 WeakPolarHBondContact O-CB 3.42Å; Q24-E28 PolarHBondContact O-N 2.96Å |
| 25 | K | 98.4 | Very high | 98.2 | Very high | 138 Ų | 138 | 99.4 Ų | 99.4 | 60% | 0.6 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.3 | -39.3 | 176.6 | -76.1 | 173.5 | -179.2 | 169.7 | 0 | 112.2 | E21 L22 L29 | E21-K25 WeakPolarHBondContact O-CB 3.36Å; E21-K25 WeakPolarHBondContact O-CG 3.43Å; E21-K25 PolarHBondContact O-N 3.11Å; L22-K25 PolarHBondContact O-N 3.4Å; K25-L29 WeakPolarHBondContact O-CB 3.46Å; K25-L29 PolarHBondContact O-N 2.78Å |
| 26 | R | 98.5 | Very high | 98.3 | Very high | 140 Ų | 140 | 101.1 Ų | 101.1 | 53% | 0.528 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.7 | -47 | 175.5 | -178.3 | -164.4 | 66.6 | -155.5 | -5.4 | 111 | L22 C23 Q24 L29 C30 | L22-R26 WeakPolarHBondContact O-CB 3.37Å; L22-R26 PolarHBondContact O-N 2.97Å; C23-R26 WeakPolarHBondContact O-CB 3.4Å; C23-R26 PolarHBondContact O-N 3.13Å; Q24-R26 VanDerWaalsContact C-N 3.3Å; Q24-R26 PolarHBondContact O-N 3.49Å; R26-L29 PolarHBondContact O-N 3.36Å; R26-C30 PolarHBondContact O-N 2.96Å; R26-C30 PolarHBondContact O-SG 2.86Å |
| 27 | E | 98.5 | Very high | 98.3 | Very high | 116 Ų | 116 | 102.6 Ų | 102.6 | 54% | 0.542 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | -179.4 | -75.3 | 169 | -163.1 | 0 | 0 | 112.3 | C23 Q24 C30 R31 | C23-E27 WeakPolarHBondContact O-CG 3.38Å; C23-E27 PolarHBondContact O-N 3.03Å; Q24-E27 PolarHBondContact O-N 2.96Å; E27-C30 PolarHBondContact O-N 3.25Å; E27-R31 PolarHBondContact O-N 3.35Å |
| 28 | E | 98.5 | Very high | 98.4 | Very high | 72 Ų | 72 | 100.5 Ų | 100.5 | 34% | 0.336 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.5 | -46.7 | 173.2 | 178.3 | 57.5 | -145.5 | 0 | 0 | 111.4 | Q24 C30 R31 Q32 | Q24-E28 WeakPolarHBondContact O-CB 3.42Å; Q24-E28 PolarHBondContact O-N 2.96Å; E28-C30 VanDerWaalsContact C-N 3.34Å; E28-C30 PolarHBondContact O-N 2.76Å; E28-R31 WeakPolarHBondContact O-CB 3.43Å; E28-R31 PolarHBondContact O-N 2.92Å; E28-R31 IonicContact OE1-CZ 3.61Å; E28-R31 IonicContact OE1-NE 3.08Å; E28-R31 IonicContact OE1-NH2 3.74Å; E28-R31 PolarHBondContact OE1-NH2 3.34Å; E28-R31 IonicContact OE2-CZ 3.61Å; E28-R31 VanDerWaalsContact OE2-CZ 3.23Å; E28-R31 IonicContact OE2-NE 3.82Å; E28-R31 IonicContact OE2-NH1 3.87Å; E28-R31 IonicContact OE2-NH2 2.69Å; E28-R31 PolarHBondContact OE2-NH2 3.43Å; E28-Q32 WeakPolarHBondContact O-CG 3.36Å; E28-Q32 PolarHBondContact O-N 3.46Å; E28-Q32 PolarHBondContact OE1-NE2 2.78Å |
| 29 | L | 98.5 | Very high | 98.5 | Very high | 96 Ų | 96 | 101 Ų | 101 | 50% | 0.503 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.6 | -40 | 178 | -174.1 | 64.2 | 0 | 0 | 0 | 111.8 | K25 R26 R31 Q32 I33 | K25-L29 WeakPolarHBondContact O-CB 3.46Å; K25-L29 PolarHBondContact O-N 2.78Å; R26-L29 PolarHBondContact O-N 3.36Å; L29-R31 VanDerWaalsContact C-N 3.31Å; L29-R31 PolarHBondContact O-N 2.94Å; L29-Q32 PolarHBondContact O-N 3.39Å; L29-I33 HydrophobicContact CG-CD1 4.06Å; L29-I33 VanDerWaalsContact O-CG1 3.27Å; L29-I33 WeakPolarHBondContact O-CG1 3.42Å; L29-I33 PolarHBondContact O-N 2.99Å |
| 30 | C | 98.6 | Very high | 98.5 | Very high | 74 Ų | 74 | 102.1 Ų | 102.1 | 50% | 0.5 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61 | -39.9 | 174.5 | -73.9 | 0 | 0 | 0 | 0 | 112 | R26 E27 E28 I33 Q34 | R26-C30 PolarHBondContact O-N 2.96Å; R26-C30 PolarHBondContact O-SG 2.86Å; E27-C30 PolarHBondContact O-N 3.25Å; E28-C30 VanDerWaalsContact C-N 3.34Å; E28-C30 PolarHBondContact O-N 2.76Å; C30-I33 PolarHBondContact O-N 3.29Å; C30-Q34 PolarHBondContact O-N 3.34Å; C30-Q34 VanDerWaalsContact O-N 3.08Å |
| 31 | R | 98.7 | Very high | 98.6 | Very high | 135 Ų | 135 | 101.5 Ų | 101.5 | 51% | 0.509 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.5 | -47.1 | 175 | -172.4 | -174.6 | 68.8 | -163.5 | -5.7 | 111.4 | E27 E28 L29 I33 Q34 E35 | E27-R31 PolarHBondContact O-N 3.35Å; E28-R31 WeakPolarHBondContact O-CB 3.43Å; E28-R31 PolarHBondContact O-N 2.92Å; E28-R31 IonicContact OE1-CZ 3.61Å; E28-R31 IonicContact OE1-NE 3.08Å; E28-R31 IonicContact OE1-NH2 3.74Å; E28-R31 PolarHBondContact OE1-NH2 3.34Å; E28-R31 IonicContact OE2-CZ 3.61Å; E28-R31 VanDerWaalsContact OE2-CZ 3.23Å; E28-R31 IonicContact OE2-NE 3.82Å; E28-R31 IonicContact OE2-NH1 3.87Å; E28-R31 IonicContact OE2-NH2 2.69Å; E28-R31 PolarHBondContact OE2-NH2 3.43Å; L29-R31 VanDerWaalsContact C-N 3.31Å; L29-R31 PolarHBondContact O-N 2.94Å; R31-I33 VanDerWaalsContact C-N 3.33Å; R31-I33 PolarHBondContact O-N 3.45Å; R31-Q34 PolarHBondContact O-N 3.38Å; R31-Q34 VanDerWaalsContact O-N 3.15Å; R31-E35 IonicContact NE-OE1 3.59Å; R31-E35 WeakPolarHBondContact O-CG 3.45Å; R31-E35 PolarHBondContact O-N 3.24Å |
| 32 | Q | 98.6 | Very high | 98.6 | Very high | 86 Ų | 86 | 105.6 Ų | 105.6 | 40% | 0.402 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.6 | -42.1 | 178.4 | -69.4 | 173.6 | 7.2 | 0 | 0 | 111.8 | E28 L29 Q34 E35 E36 | E28-Q32 WeakPolarHBondContact O-CG 3.36Å; E28-Q32 PolarHBondContact O-N 3.46Å; E28-Q32 PolarHBondContact OE1-NE2 2.78Å; L29-Q32 PolarHBondContact O-N 3.39Å; Q32-Q34 VanDerWaalsContact C-N 3.32Å; Q32-Q34 PolarHBondContact O-N 3.49Å; Q32-E35 PolarHBondContact O-N 2.86Å; Q32-E36 WeakPolarHBondContact O-CG 3.33Å; Q32-E36 PolarHBondContact O-N 3.16Å |
| 33 | I | 98.6 | Very high | 98.6 | Very high | 82 Ų | 82 | 104.4 Ų | 104.4 | 42% | 0.421 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.9 | -45.7 | 174.9 | -71.1 | 165.6 | 0 | 0 | 0 | 110.6 | L29 C30 R31 E35 E36 E37 | L29-I33 HydrophobicContact CG-CD1 4.06Å; L29-I33 VanDerWaalsContact O-CG1 3.27Å; L29-I33 WeakPolarHBondContact O-CG1 3.42Å; L29-I33 PolarHBondContact O-N 2.99Å; C30-I33 PolarHBondContact O-N 3.29Å; R31-I33 VanDerWaalsContact C-N 3.33Å; R31-I33 PolarHBondContact O-N 3.45Å; I33-E35 PolarHBondContact O-N 2.99Å; I33-E36 PolarHBondContact O-N 3.25Å; I33-E37 HydrophobicContact CG2-CG 4.33Å; I33-E37 WeakPolarHBondContact O-CB 3.48Å; I33-E37 WeakPolarHBondContact O-CG 3.41Å; I33-E37 PolarHBondContact O-N 3.13Å |
| 34 | Q | 98.7 | Very high | 98.6 | Very high | 95 Ų | 95 | 107.2 Ų | 107.2 | 44% | 0.444 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.3 | -41.2 | 179.6 | -171.7 | 62.5 | 62.9 | 0 | 0 | 112.2 | C30 R31 Q32 E37 D38 | C30-Q34 PolarHBondContact O-N 3.34Å; C30-Q34 VanDerWaalsContact O-N 3.08Å; R31-Q34 PolarHBondContact O-N 3.38Å; R31-Q34 VanDerWaalsContact O-N 3.15Å; Q32-Q34 VanDerWaalsContact C-N 3.32Å; Q32-Q34 PolarHBondContact O-N 3.49Å; Q34-E37 PolarHBondContact O-N 2.97Å; Q34-D38 PolarHBondContact NE2-OD1 2.72Å; Q34-D38 WeakPolarHBondContact O-CB 3.37Å; Q34-D38 PolarHBondContact O-N 3.41Å |
| 35 | E | 98.7 | Very high | 98.6 | Very high | 108 Ų | 108 | 104.8 Ų | 104.8 | 51% | 0.505 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.4 | -43.8 | 176.7 | -71.8 | 171.1 | -173.5 | 0 | 0 | 111.6 | R31 Q32 I33 D38 E39 | R31-E35 IonicContact NE-OE1 3.59Å; R31-E35 WeakPolarHBondContact O-CG 3.45Å; R31-E35 PolarHBondContact O-N 3.24Å; Q32-E35 PolarHBondContact O-N 2.86Å; I33-E35 PolarHBondContact O-N 2.99Å; E35-D38 PolarHBondContact O-N 3.14Å; E35-E39 PolarHBondContact O-N 2.95Å |
| 36 | E | 98.7 | Very high | 98.6 | Very high | 140 Ų | 140 | 103.3 Ų | 103.3 | 65% | 0.654 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -67.2 | -37.3 | 176.3 | -69.7 | -68 | 157 | 0 | 0 | 112.4 | Q32 I33 E39 K40 | Q32-E36 WeakPolarHBondContact O-CG 3.33Å; Q32-E36 PolarHBondContact O-N 3.16Å; I33-E36 PolarHBondContact O-N 3.25Å; E36-E39 PolarHBondContact O-N 3.1Å; E36-K40 WeakPolarHBondContact O-CB 3.33Å; E36-K40 PolarHBondContact O-N 2.99Å |
| 37 | E | 98.7 | Very high | 98.6 | Very high | 107 Ų | 107 | 101 Ų | 101 | 50% | 0.5 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.8 | -42.7 | 175 | -76.7 | -177.6 | 166.7 | 0 | 0 | 112 | I33 Q34 K40 Q41 | I33-E37 HydrophobicContact CG2-CG 4.33Å; I33-E37 WeakPolarHBondContact O-CB 3.48Å; I33-E37 WeakPolarHBondContact O-CG 3.41Å; I33-E37 PolarHBondContact O-N 3.13Å; Q34-E37 PolarHBondContact O-N 2.97Å; E37-K40 PolarHBondContact O-N 2.99Å; E37-Q41 WeakPolarHBondContact O-CB 3.47Å; E37-Q41 PolarHBondContact O-N 2.91Å |
| 38 | D | 98.7 | Very high | 98.6 | Very high | 80 Ų | 80 | 103.3 Ų | 103.3 | 43% | 0.428 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64 | -43.8 | 176.5 | -74.8 | -4.1 | 0 | 0 | 0 | 111.1 | Q34 E35 Q41 R42 | Q34-D38 PolarHBondContact NE2-OD1 2.72Å; Q34-D38 WeakPolarHBondContact O-CB 3.37Å; Q34-D38 PolarHBondContact O-N 3.41Å; E35-D38 PolarHBondContact O-N 3.14Å; D38-Q41 PolarHBondContact O-N 3.38Å; D38-R42 WeakPolarHBondContact O-CG 3.29Å; D38-R42 PolarHBondContact O-N 2.88Å |
| 39 | E | 98.7 | Very high | 98.7 | Very high | 80 Ų | 80 | 105 Ų | 105 | 37% | 0.374 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67 | -43 | 178.2 | -174.2 | 57.5 | -160.6 | 0 | 0 | 111.7 | E35 E36 Q41 R42 L43 | E35-E39 PolarHBondContact O-N 2.95Å; E36-E39 PolarHBondContact O-N 3.1Å; E39-Q41 VanDerWaalsContact C-N 3.27Å; E39-Q41 PolarHBondContact O-N 3.3Å; E39-R42 WeakPolarHBondContact O-CB 3.4Å; E39-R42 PolarHBondContact O-N 2.98Å; E39-R42 VanDerWaalsContact O-N 3.14Å; E39-R42 IonicContact OE2-NH1 3.9Å; E39-L43 HydrophobicContact CG-CD1 4.26Å; E39-L43 WeakPolarHBondContact O-CG 3.41Å; E39-L43 PolarHBondContact O-N 3.21Å |
| 40 | K | 98.7 | Very high | 98.7 | Very high | 126 Ų | 126 | 104.9 Ų | 104.9 | 55% | 0.548 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -54.7 | -44.6 | 171.9 | 175.5 | -174.2 | 170.1 | -170.6 | 0 | 111.3 | E36 E37 L43 Q44 | E36-K40 WeakPolarHBondContact O-CB 3.33Å; E36-K40 PolarHBondContact O-N 2.99Å; E37-K40 PolarHBondContact O-N 2.99Å; K40-L43 PolarHBondContact O-N 3.15Å; K40-Q44 WeakPolarHBondContact O-CB 3.47Å; K40-Q44 VanDerWaalsContact O-CG 3.29Å; K40-Q44 WeakPolarHBondContact O-CG 3.28Å; K40-Q44 PolarHBondContact O-N 3.03Å |
| 41 | Q | 98.8 | Very high | 98.7 | Very high | 97 Ų | 97 | 105.4 Ų | 105.4 | 45% | 0.453 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66 | -37.8 | 179.7 | -172.9 | 59.4 | 59.2 | 0 | 0 | 112.1 | E37 D38 E39 N45 | E37-Q41 WeakPolarHBondContact O-CB 3.47Å; E37-Q41 PolarHBondContact O-N 2.91Å; D38-Q41 PolarHBondContact O-N 3.38Å; E39-Q41 VanDerWaalsContact C-N 3.27Å; E39-Q41 PolarHBondContact O-N 3.3Å; Q41-N45 PolarHBondContact NE2-OD1 2.86Å; Q41-N45 PolarHBondContact O-N 3.29Å; Q41-N45 VanDerWaalsContact O-N 3.1Å; Q41-N45 PolarHBondContact O-ND2 3.41Å |
| 42 | R | 98.8 | Very high | 98.7 | Very high | 165 Ų | 165 | 103.2 Ų | 103.2 | 62% | 0.623 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.6 | -50.2 | 174.1 | -72.4 | 174.1 | -176 | 171.6 | 3.7 | 111.6 | D38 E39 Q44 N45 E46 | D38-R42 WeakPolarHBondContact O-CG 3.29Å; D38-R42 PolarHBondContact O-N 2.88Å; E39-R42 WeakPolarHBondContact O-CB 3.4Å; E39-R42 PolarHBondContact O-N 2.98Å; E39-R42 VanDerWaalsContact O-N 3.14Å; E39-R42 IonicContact OE2-NH1 3.9Å; R42-Q44 VanDerWaalsContact C-N 3.32Å; R42-Q44 PolarHBondContact O-N 2.84Å; R42-N45 WeakPolarHBondContact O-CB 3.25Å; R42-N45 PolarHBondContact O-N 3.48Å; R42-N45 VanDerWaalsContact O-N 3.13Å; R42-E46 PolarHBondContact O-N 3.45Å |
| 43 | L | 98.8 | Very high | 98.7 | Very high | 87 Ų | 87 | 105 Ų | 105 | 46% | 0.455 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.9 | -40.8 | 178.7 | -68.9 | 173.2 | 0 | 0 | 0 | 111.7 | E39 K40 N45 E46 V47 | E39-L43 HydrophobicContact CG-CD1 4.26Å; E39-L43 WeakPolarHBondContact O-CG 3.41Å; E39-L43 PolarHBondContact O-N 3.21Å; K40-L43 PolarHBondContact O-N 3.15Å; L43-N45 VanDerWaalsContact C-N 3.33Å; L43-N45 PolarHBondContact O-N 3.2Å; L43-E46 PolarHBondContact O-N 3.44Å; L43-V47 VanDerWaalsContact O-CG2 3.31Å; L43-V47 WeakPolarHBondContact O-CG2 3.3Å; L43-V47 PolarHBondContact O-N 3Å |
| 44 | Q | 98.7 | Very high | 98.7 | Very high | 100 Ų | 100 | 106 Ų | 106 | 47% | 0.467 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.1 | -40.8 | 175.1 | -76.9 | -178.5 | -14.6 | 0 | 0 | 112.6 | K40 R42 R48 | K40-Q44 WeakPolarHBondContact O-CB 3.47Å; K40-Q44 VanDerWaalsContact O-CG 3.29Å; K40-Q44 WeakPolarHBondContact O-CG 3.28Å; K40-Q44 PolarHBondContact O-N 3.03Å; R42-Q44 VanDerWaalsContact C-N 3.32Å; R42-Q44 PolarHBondContact O-N 2.84Å; Q44-R48 PolarHBondContact O-N 2.99Å |
| 45 | N | 98.6 | Very high | 98.7 | Very high | 76 Ų | 76 | 104.3 Ų | 104.3 | 41% | 0.406 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.6 | -41 | 175.7 | -74.3 | -22.3 | 0 | 0 | 0 | 111.7 | Q41 R42 L43 R48 Q49 | Q41-N45 PolarHBondContact NE2-OD1 2.86Å; Q41-N45 PolarHBondContact O-N 3.29Å; Q41-N45 VanDerWaalsContact O-N 3.1Å; Q41-N45 PolarHBondContact O-ND2 3.41Å; R42-N45 WeakPolarHBondContact O-CB 3.25Å; R42-N45 PolarHBondContact O-N 3.48Å; R42-N45 VanDerWaalsContact O-N 3.13Å; L43-N45 VanDerWaalsContact C-N 3.33Å; L43-N45 PolarHBondContact O-N 3.2Å; N45-R48 PolarHBondContact O-N 3.07Å; N45-Q49 WeakPolarHBondContact O-CG 3.11Å; N45-Q49 PolarHBondContact O-N 3.43Å |
| 46 | E | 98.6 | Very high | 98.7 | Very high | 107 Ų | 107 | 107.3 Ų | 107.3 | 50% | 0.5 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.4 | -46.4 | 176.7 | -173.2 | 173.5 | 179.7 | 0 | 0 | 111.8 | R42 L43 R48 Q49 L50 | R42-E46 PolarHBondContact O-N 3.45Å; L43-E46 PolarHBondContact O-N 3.44Å; E46-R48 VanDerWaalsContact C-N 3.26Å; E46-R48 PolarHBondContact O-N 2.95Å; E46-Q49 PolarHBondContact O-N 3Å; E46-Q49 VanDerWaalsContact O-N 3.11Å; E46-L50 HydrophobicContact CG-CD1 3.95Å; E46-L50 HydrophobicContact CG-CG 4.28Å; E46-L50 WeakPolarHBondContact O-CB 3.41Å; E46-L50 WeakPolarHBondContact O-CG 3.25Å; E46-L50 PolarHBondContact O-N 2.97Å |
| 47 | V | 98.6 | Very high | 98.7 | Very high | 91 Ų | 91 | 104.8 Ų | 104.8 | 55% | 0.552 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -55.3 | -44 | 175.2 | 167.5 | 0 | 0 | 0 | 0 | 110.9 | L43 L50 T51 | L43-V47 VanDerWaalsContact O-CG2 3.31Å; L43-V47 WeakPolarHBondContact O-CG2 3.3Å; L43-V47 PolarHBondContact O-N 3Å; V47-L50 PolarHBondContact O-N 3.48Å; V47-T51 WeakPolarHBondContact O-CB 3.49Å; V47-T51 PolarHBondContact O-N 3.34Å; V47-T51 PolarHBondContact O-OG1 3.29Å |
| 48 | R | 98.6 | Very high | 98.7 | Very high | 165 Ų | 165 | 103.8 Ų | 103.8 | 62% | 0.623 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.5 | -49.4 | 176.3 | -179.5 | -178.3 | 170.1 | 174.1 | 2.4 | 111.6 | Q44 N45 E46 L50 T51 E52 | Q44-R48 PolarHBondContact O-N 2.99Å; N45-R48 PolarHBondContact O-N 3.07Å; E46-R48 VanDerWaalsContact C-N 3.26Å; E46-R48 PolarHBondContact O-N 2.95Å; R48-L50 VanDerWaalsContact C-N 3.35Å; R48-L50 PolarHBondContact O-N 2.97Å; R48-T51 WeakPolarHBondContact O-CB 3.41Å; R48-T51 PolarHBondContact O-N 3.49Å; R48-E52 IonicContact CZ-OE1 3.35Å; R48-E52 IonicContact NE-OE1 2.76Å; R48-E52 PolarHBondContact NE-OE1 3.41Å; R48-E52 VanDerWaalsContact NE-OE1 3.08Å; R48-E52 IonicContact NH2-OE1 3.55Å; R48-E52 WeakPolarHBondContact O-CG 3.42Å; R48-E52 PolarHBondContact O-N 3.49Å |
| 49 | Q | 98.7 | Very high | 98.7 | Very high | 108 Ų | 108 | 105.1 Ų | 105.1 | 51% | 0.505 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.1 | -41.7 | 179.5 | -70.3 | 179.5 | 18.6 | 0 | 0 | 112.4 | N45 E46 T51 E52 K53 | N45-Q49 WeakPolarHBondContact O-CG 3.11Å; N45-Q49 PolarHBondContact O-N 3.43Å; E46-Q49 PolarHBondContact O-N 3Å; E46-Q49 VanDerWaalsContact O-N 3.11Å; Q49-T51 VanDerWaalsContact C-N 3.34Å; Q49-E52 PolarHBondContact O-N 2.99Å; Q49-K53 WeakPolarHBondContact O-CG 3.32Å; Q49-K53 PolarHBondContact O-N 2.87Å |
| 50 | L | 98.7 | Very high | 98.7 | Very high | 93 Ų | 93 | 104.9 Ų | 104.9 | 49% | 0.487 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 176.9 | -71.6 | 174.3 | 0 | 0 | 0 | 111.4 | E46 V47 R48 K53 L54 | E46-L50 HydrophobicContact CG-CD1 3.95Å; E46-L50 HydrophobicContact CG-CG 4.28Å; E46-L50 WeakPolarHBondContact O-CB 3.41Å; E46-L50 WeakPolarHBondContact O-CG 3.25Å; E46-L50 PolarHBondContact O-N 2.97Å; V47-L50 PolarHBondContact O-N 3.48Å; R48-L50 VanDerWaalsContact C-N 3.35Å; R48-L50 PolarHBondContact O-N 2.97Å; L50-K53 PolarHBondContact O-N 2.92Å; L50-L54 WeakPolarHBondContact O-CB 3.28Å; L50-L54 PolarHBondContact O-N 3.18Å |
| 51 | T | 98.6 | Very high | 98.7 | Very high | 86 Ų | 86 | 103.3 Ų | 103.3 | 53% | 0.528 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | 175.6 | -58.3 | 0 | 0 | 0 | 0 | 111.4 | V47 R48 Q49 L54 A55 | V47-T51 WeakPolarHBondContact O-CB 3.49Å; V47-T51 PolarHBondContact O-N 3.34Å; V47-T51 PolarHBondContact O-OG1 3.29Å; R48-T51 WeakPolarHBondContact O-CB 3.41Å; R48-T51 PolarHBondContact O-N 3.49Å; Q49-T51 VanDerWaalsContact C-N 3.34Å; T51-L54 PolarHBondContact O-N 3.01Å; T51-A55 PolarHBondContact O-N 3.39Å |
| 52 | E | 98.6 | Very high | 98.7 | Very high | 88 Ų | 88 | 101.4 Ų | 101.4 | 41% | 0.411 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.7 | -42.1 | 176.4 | -71 | 175.5 | -163.8 | 0 | 0 | 111.9 | R48 Q49 A55 R56 | R48-E52 IonicContact CZ-OE1 3.35Å; R48-E52 IonicContact NE-OE1 2.76Å; R48-E52 PolarHBondContact NE-OE1 3.41Å; R48-E52 VanDerWaalsContact NE-OE1 3.08Å; R48-E52 IonicContact NH2-OE1 3.55Å; R48-E52 WeakPolarHBondContact O-CG 3.42Å; R48-E52 PolarHBondContact O-N 3.49Å; Q49-E52 PolarHBondContact O-N 2.99Å; E52-A55 PolarHBondContact O-N 3.47Å; E52-R56 WeakPolarHBondContact O-CG 3.44Å; E52-R56 PolarHBondContact O-N 3.33Å; E52-R56 VanDerWaalsContact O-N 3.16Å |
| 53 | K | 98.7 | Very high | 98.7 | Very high | 124 Ų | 124 | 100.1 Ų | 100.1 | 54% | 0.539 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 174.7 | -74.3 | 172.4 | -177 | 172.8 | 0 | 111.5 | Q49 L50 A55 R56 V57 | Q49-K53 WeakPolarHBondContact O-CG 3.32Å; Q49-K53 PolarHBondContact O-N 2.87Å; L50-K53 PolarHBondContact O-N 2.92Å; K53-A55 PolarHBondContact O-N 2.76Å; K53-R56 PolarHBondContact O-N 2.98Å; K53-V57 WeakPolarHBondContact O-CG2 3.49Å; K53-V57 PolarHBondContact O-N 3.32Å |
| 54 | L | 98.6 | Very high | 98.7 | Very high | 103 Ų | 103 | 103.4 Ų | 103.4 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 178.3 | -179.6 | 61.7 | 0 | 0 | 0 | 111.4 | L50 T51 R56 V57 N58 | L50-L54 WeakPolarHBondContact O-CB 3.28Å; L50-L54 PolarHBondContact O-N 3.18Å; T51-L54 PolarHBondContact O-N 3.01Å; L54-R56 VanDerWaalsContact C-N 3.34Å; L54-R56 PolarHBondContact O-N 2.89Å; L54-V57 PolarHBondContact O-N 3.29Å; L54-N58 PolarHBondContact O-N 2.92Å |
| 55 | A | 98.6 | Very high | 98.7 | Very high | 59 Ų | 59 | 101.8 Ų | 101.8 | 49% | 0.488 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.4 | -44.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | T51 E52 K53 V57 N58 E59 | T51-A55 PolarHBondContact O-N 3.39Å; E52-A55 PolarHBondContact O-N 3.47Å; K53-A55 PolarHBondContact O-N 2.76Å; A55-V57 PolarHBondContact O-N 2.72Å; A55-N58 PolarHBondContact O-N 3.47Å; A55-E59 PolarHBondContact O-N 2.83Å |
| 56 | R | 98.7 | Very high | 98.7 | Very high | 171 Ų | 171 | 101 Ų | 101 | 65% | 0.645 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62 | -41.8 | 176.3 | -69.6 | 176.8 | -175.4 | -137.8 | 3 | 112.6 | E52 K53 L54 N60 | E52-R56 WeakPolarHBondContact O-CG 3.44Å; E52-R56 PolarHBondContact O-N 3.33Å; E52-R56 VanDerWaalsContact O-N 3.16Å; K53-R56 PolarHBondContact O-N 2.98Å; L54-R56 VanDerWaalsContact C-N 3.34Å; L54-R56 PolarHBondContact O-N 2.89Å; R56-N60 WeakPolarHBondContact O-CB 3.35Å; R56-N60 VanDerWaalsContact O-CG 3.31Å; R56-N60 PolarHBondContact O-N 3.05Å; R56-N60 PolarHBondContact O-ND2 3.44Å |
| 57 | V | 98.7 | Very high | 98.7 | Very high | 87 Ų | 87 | 98.2 Ų | 98.2 | 53% | 0.527 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.4 | -43.1 | 176.9 | 171.8 | 0 | 0 | 0 | 0 | 110.7 | K53 L54 A55 N60 L61 | K53-V57 WeakPolarHBondContact O-CG2 3.49Å; K53-V57 PolarHBondContact O-N 3.32Å; L54-V57 PolarHBondContact O-N 3.29Å; A55-V57 PolarHBondContact O-N 2.72Å; V57-N60 PolarHBondContact O-N 3.2Å; V57-L61 VanDerWaalsContact O-CB 3.32Å; V57-L61 WeakPolarHBondContact O-CB 3.41Å; V57-L61 PolarHBondContact O-N 2.95Å |
| 58 | N | 98.7 | Very high | 98.7 | Very high | 87 Ų | 87 | 99.5 Ų | 99.5 | 47% | 0.465 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.1 | -44.1 | 177.7 | -75.5 | -19.6 | 0 | 0 | 0 | 112.3 | L54 A55 L61 A62 | L54-N58 PolarHBondContact O-N 2.92Å; A55-N58 PolarHBondContact O-N 3.47Å; N58-L61 PolarHBondContact O-N 3.34Å; N58-A62 WeakPolarHBondContact O-CB 3.31Å; N58-A62 PolarHBondContact O-N 3.44Å |
| 59 | E | 98.7 | Very high | 98.7 | Very high | 107 Ų | 107 | 95.7 Ų | 95.7 | 50% | 0.5 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.5 | -45.9 | 175.8 | -169.9 | -165.5 | 152.4 | 0 | 0 | 111.3 | A55 L61 A62 R63 | A55-E59 PolarHBondContact O-N 2.83Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 3.5Å; E59-A62 PolarHBondContact O-N 3.33Å; E59-R63 PolarHBondContact O-N 2.99Å; E59-R63 IonicContact OE1-CZ 3.88Å; E59-R63 IonicContact OE1-NH1 3.23Å; E59-R63 PolarHBondContact OE1-NH1 3.31Å; E59-R63 IonicContact OE1-NH2 2.7Å |
| 60 | N | 98.7 | Very high | 98.7 | Very high | 76 Ų | 76 | 97 Ų | 97 | 41% | 0.406 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.9 | -42.6 | 176.4 | -77.9 | -30.6 | 0 | 0 | 0 | 112.4 | R56 V57 R63 K64 | R56-N60 WeakPolarHBondContact O-CB 3.35Å; R56-N60 VanDerWaalsContact O-CG 3.31Å; R56-N60 PolarHBondContact O-N 3.05Å; R56-N60 PolarHBondContact O-ND2 3.44Å; V57-N60 PolarHBondContact O-N 3.2Å; N60-R63 PolarHBondContact O-N 3.22Å; N60-R63 PolarHBondContact OD1-NH2 3.41Å; N60-K64 WeakPolarHBondContact O-CG 3.44Å; N60-K64 PolarHBondContact O-N 3.3Å |
| 61 | L | 98.8 | Very high | 98.7 | Very high | 93 Ų | 93 | 98.8 Ų | 98.8 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.5 | -46.5 | 177.7 | -179.2 | 60.9 | 0 | 0 | 0 | 110.8 | V57 N58 E59 R63 K64 I65 | V57-L61 VanDerWaalsContact O-CB 3.32Å; V57-L61 WeakPolarHBondContact O-CB 3.41Å; V57-L61 PolarHBondContact O-N 2.95Å; N58-L61 PolarHBondContact O-N 3.34Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 3.5Å; L61-R63 VanDerWaalsContact C-N 3.34Å; L61-R63 PolarHBondContact O-N 3.05Å; L61-K64 PolarHBondContact O-N 3.08Å; L61-I65 HydrophobicContact CD1-CD1 4.15Å; L61-I65 HydrophobicContact CD1-CG1 4.31Å; L61-I65 HydrophobicContact CG-CD1 3.89Å; L61-I65 HydrophobicContact CG-CG1 4.45Å; L61-I65 WeakPolarHBondContact O-CB 3.32Å; L61-I65 VanDerWaalsContact O-CG1 3.28Å; L61-I65 WeakPolarHBondContact O-CG1 3.33Å; L61-I65 PolarHBondContact O-N 3.25Å |
| 62 | A | 98.8 | Very high | 98.7 | Very high | 57 Ų | 57 | 98.8 Ų | 98.8 | 47% | 0.471 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.1 | -44.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | N58 E59 K64 I65 A66 | N58-A62 WeakPolarHBondContact O-CB 3.31Å; N58-A62 PolarHBondContact O-N 3.44Å; E59-A62 PolarHBondContact O-N 3.33Å; A62-K64 PolarHBondContact O-N 2.85Å; A62-I65 PolarHBondContact O-N 3.16Å; A62-A66 PolarHBondContact O-N 3.41Å |
| 63 | R | 98.8 | Very high | 98.7 | Very high | 137 Ų | 137 | 102.6 Ų | 102.6 | 52% | 0.517 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.9 | -45.7 | 174.5 | -74.3 | -165.2 | -72.3 | -126.2 | -4.6 | 112.6 | E59 N60 L61 A66 S67 | E59-R63 PolarHBondContact O-N 2.99Å; E59-R63 IonicContact OE1-CZ 3.88Å; E59-R63 IonicContact OE1-NH1 3.23Å; E59-R63 PolarHBondContact OE1-NH1 3.31Å; E59-R63 IonicContact OE1-NH2 2.7Å; N60-R63 PolarHBondContact O-N 3.22Å; N60-R63 PolarHBondContact OD1-NH2 3.41Å; L61-R63 VanDerWaalsContact C-N 3.34Å; L61-R63 PolarHBondContact O-N 3.05Å; R63-A66 PolarHBondContact O-N 2.91Å; R63-S67 PolarHBondContact O-N 3.3Å |
| 64 | K | 98.8 | Very high | 98.7 | Very high | 156 Ų | 156 | 100.1 Ų | 100.1 | 68% | 0.678 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.9 | -40.4 | 178.1 | -74.1 | -174.3 | 177.4 | -162.2 | 0 | 112.1 | N60 L61 A62 S67 R68 | N60-K64 WeakPolarHBondContact O-CG 3.44Å; N60-K64 PolarHBondContact O-N 3.3Å; L61-K64 PolarHBondContact O-N 3.08Å; A62-K64 PolarHBondContact O-N 2.85Å; K64-S67 PolarHBondContact O-N 3.36Å; K64-R68 VanDerWaalsContact O-CB 3.25Å; K64-R68 WeakPolarHBondContact O-CB 3.29Å; K64-R68 PolarHBondContact O-N 3.07Å |
| 65 | I | 98.8 | Very high | 98.7 | Very high | 67 Ų | 67 | 99.3 Ų | 99.3 | 34% | 0.344 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.5 | -47.5 | 175.3 | -72.3 | 171.5 | 0 | 0 | 0 | 110.3 | L61 A62 R68 N69 | L61-I65 HydrophobicContact CD1-CD1 4.15Å; L61-I65 HydrophobicContact CD1-CG1 4.31Å; L61-I65 HydrophobicContact CG-CD1 3.89Å; L61-I65 HydrophobicContact CG-CG1 4.45Å; L61-I65 WeakPolarHBondContact O-CB 3.32Å; L61-I65 VanDerWaalsContact O-CG1 3.28Å; L61-I65 WeakPolarHBondContact O-CG1 3.33Å; L61-I65 PolarHBondContact O-N 3.25Å; A62-I65 PolarHBondContact O-N 3.16Å; I65-R68 PolarHBondContact O-N 3.44Å; I65-N69 PolarHBondContact O-N 3.34Å; I65-N69 PolarHBondContact O-OD1 2.97Å; I65-N69 VanDerWaalsContact O-OD1 3.07Å |
| 66 | A | 98.6 | Very high | 98.7 | Very high | 58 Ų | 58 | 99 Ų | 99 | 48% | 0.479 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.9 | -48.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | A62 R63 R68 N69 E70 | A62-A66 PolarHBondContact O-N 3.41Å; R63-A66 PolarHBondContact O-N 2.91Å; A66-R68 PolarHBondContact O-N 3.11Å; A66-N69 PolarHBondContact O-N 3.03Å; A66-E70 PolarHBondContact O-N 3.44Å |
| 67 | S | 98.7 | Very high | 98.7 | Very high | 50 Ų | 50 | 95.8 Ų | 95.8 | 35% | 0.35 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.7 | -42 | 177.8 | 175.7 | 0 | 0 | 0 | 0 | 112.4 | R63 K64 N69 E70 F71 | R63-S67 PolarHBondContact O-N 3.3Å; K64-S67 PolarHBondContact O-N 3.36Å; S67-N69 VanDerWaalsContact C-N 3.34Å; S67-N69 PolarHBondContact O-N 2.74Å; S67-E70 WeakPolarHBondContact O-CB 3.45Å; S67-E70 PolarHBondContact O-N 2.85Å; S67-F71 WeakPolarHBondContact O-CD2 3.39Å; S67-F71 PolarHBondContact O-N 3.28Å; S67-F71 VanDerWaalsContact OG-CE2 3.3Å; S67-F71 WeakPolarHBondContact OG-CE2 3.38Å |
| 68 | R | 98.8 | Very high | 98.7 | Very high | 118 Ų | 118 | 95.8 Ų | 95.8 | 45% | 0.445 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 175.2 | 179.5 | -87.9 | -44.1 | -73 | -0.3 | 111.5 | K64 I65 A66 E70 F71 D72 | K64-R68 VanDerWaalsContact O-CB 3.25Å; K64-R68 WeakPolarHBondContact O-CB 3.29Å; K64-R68 PolarHBondContact O-N 3.07Å; I65-R68 PolarHBondContact O-N 3.44Å; A66-R68 PolarHBondContact O-N 3.11Å; R68-E70 VanDerWaalsContact C-N 3.3Å; R68-E70 PolarHBondContact O-N 3.47Å; R68-F71 PolarHBondContact O-N 2.98Å; R68-D72 VanDerWaalsContact CD-OD2 3.25Å; R68-D72 WeakPolarHBondContact CD-OD2 3.47Å; R68-D72 VanDerWaalsContact O-CG 3.27Å; R68-D72 PolarHBondContact O-N 3.13Å |
| 69 | N | 98.7 | Very high | 98.7 | Very high | 84 Ų | 84 | 97.4 Ų | 97.4 | 45% | 0.449 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65 | -33.9 | 176.1 | -63.7 | -1 | 0 | 0 | 0 | 112.5 | I65 A66 S67 R73 | I65-N69 PolarHBondContact O-N 3.34Å; I65-N69 PolarHBondContact O-OD1 2.97Å; I65-N69 VanDerWaalsContact O-OD1 3.07Å; A66-N69 PolarHBondContact O-N 3.03Å; S67-N69 VanDerWaalsContact C-N 3.34Å; S67-N69 PolarHBondContact O-N 2.74Å; N69-R73 WeakPolarHBondContact O-CB 3.21Å; N69-R73 PolarHBondContact O-N 3.1Å |
| 70 | E | 98.8 | Very high | 98.7 | Very high | 136 Ų | 136 | 94.6 Ų | 94.6 | 64% | 0.636 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68.7 | -39.6 | 175.3 | -172.7 | 173.1 | -165.1 | 0 | 0 | 112.1 | A66 S67 R68 R73 T74 | A66-E70 PolarHBondContact O-N 3.44Å; S67-E70 WeakPolarHBondContact O-CB 3.45Å; S67-E70 PolarHBondContact O-N 2.85Å; R68-E70 VanDerWaalsContact C-N 3.3Å; R68-E70 PolarHBondContact O-N 3.47Å; E70-R73 PolarHBondContact O-N 3.39Å; E70-T74 PolarHBondContact O-N 2.97Å; E70-T74 PolarHBondContact O-OG1 2.89Å |
| 71 | F | 98.8 | Very high | 98.7 | Very high | 131 Ų | 131 | 93.3 Ų | 93.3 | 58% | 0.575 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.1 | -49.3 | 171 | -72.7 | -57.5 | 0 | 0 | 0 | 111.7 | S67 R68 R73 T74 I75 | S67-F71 WeakPolarHBondContact O-CD2 3.39Å; S67-F71 PolarHBondContact O-N 3.28Å; S67-F71 VanDerWaalsContact OG-CE2 3.3Å; S67-F71 WeakPolarHBondContact OG-CE2 3.38Å; R68-F71 PolarHBondContact O-N 2.98Å; F71-R73 PolarHBondContact O-N 3.31Å; F71-T74 PolarHBondContact O-N 3.25Å; F71-T74 VanDerWaalsContact O-N 3.1Å; F71-I75 VanDerWaalsContact O-CG1 3.28Å; F71-I75 WeakPolarHBondContact O-CG1 3.45Å; F71-I75 PolarHBondContact O-N 2.92Å |
| 72 | D | 98.8 | Very high | 98.7 | Very high | 86 Ų | 86 | 95.8 Ų | 95.8 | 46% | 0.46 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -56.8 | -42.3 | 179.2 | -68.4 | -17.3 | 0 | 0 | 0 | 111.2 | R68 I75 A76 | R68-D72 VanDerWaalsContact CD-OD2 3.25Å; R68-D72 WeakPolarHBondContact CD-OD2 3.47Å; R68-D72 VanDerWaalsContact O-CG 3.27Å; R68-D72 PolarHBondContact O-N 3.13Å; D72-I75 PolarHBondContact O-N 3.02Å; D72-A76 WeakPolarHBondContact O-CB 3.49Å; D72-A76 PolarHBondContact O-N 2.95Å |
| 73 | R | 98.8 | Very high | 98.6 | Very high | 167 Ų | 167 | 98 Ų | 98 | 63% | 0.63 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.7 | -49 | 175.3 | -178.4 | 178.8 | 179.9 | 165.9 | 2.7 | 112 | N69 E70 F71 I75 A76 E77 | N69-R73 WeakPolarHBondContact O-CB 3.21Å; N69-R73 PolarHBondContact O-N 3.1Å; E70-R73 PolarHBondContact O-N 3.39Å; F71-R73 PolarHBondContact O-N 3.31Å; R73-I75 VanDerWaalsContact C-N 3.31Å; R73-I75 PolarHBondContact O-N 3.44Å; R73-A76 PolarHBondContact O-N 3.48Å; R73-E77 HydrophobicContact CG-CG 4.41Å; R73-E77 WeakPolarHBondContact CG-OE1 3.27Å; R73-E77 IonicContact CZ-OE1 3.54Å; R73-E77 IonicContact NE-OE1 2.78Å; R73-E77 PolarHBondContact NE-OE1 3.43Å; R73-E77 IonicContact NH2-OE1 3.39Å; R73-E77 PolarHBondContact NH2-OE1 3.4Å; R73-E77 WeakPolarHBondContact O-CB 3.4Å; R73-E77 WeakPolarHBondContact O-CG 3.45Å; R73-E77 PolarHBondContact O-N 3.14Å |
| 74 | T | 98.7 | Very high | 98.6 | Very high | 72 Ų | 72 | 98.1 Ų | 98.1 | 44% | 0.442 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62 | -41.3 | -179.4 | -58 | 0 | 0 | 0 | 0 | 111.3 | E70 F71 T78 | E70-T74 PolarHBondContact O-N 2.97Å; E70-T74 PolarHBondContact O-OG1 2.89Å; F71-T74 PolarHBondContact O-N 3.25Å; F71-T74 VanDerWaalsContact O-N 3.1Å; T74-T78 VanDerWaalsContact O-CB 3.29Å; T74-T78 WeakPolarHBondContact O-CB 3.48Å; T74-T78 PolarHBondContact O-N 2.95Å; T74-T78 PolarHBondContact O-OG1 3.44Å |
| 75 | I | 98.6 | Very high | 98.6 | Very high | 86 Ų | 86 | 95.5 Ų | 95.5 | 44% | 0.441 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.3 | -53 | 175.7 | -69.4 | 165.5 | 0 | 0 | 0 | 109.5 | F71 D72 R73 E77 T78 E79 | F71-I75 VanDerWaalsContact O-CG1 3.28Å; F71-I75 WeakPolarHBondContact O-CG1 3.45Å; F71-I75 PolarHBondContact O-N 2.92Å; D72-I75 PolarHBondContact O-N 3.02Å; R73-I75 VanDerWaalsContact C-N 3.31Å; R73-I75 PolarHBondContact O-N 3.44Å; I75-E77 PolarHBondContact O-N 2.9Å; I75-T78 PolarHBondContact O-N 3.47Å; I75-T78 VanDerWaalsContact O-N 3.15Å; I75-E79 HydrophobicContact CG2-CG 4.28Å; I75-E79 WeakPolarHBondContact O-CB 3.42Å; I75-E79 WeakPolarHBondContact O-CG 3.37Å; I75-E79 PolarHBondContact O-N 2.88Å |
| 76 | A | 98.7 | Very high | 98.6 | Very high | 53 Ų | 53 | 95.5 Ų | 95.5 | 44% | 0.438 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.2 | -42.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | D72 R73 T78 A80 | D72-A76 WeakPolarHBondContact O-CB 3.49Å; D72-A76 PolarHBondContact O-N 2.95Å; R73-A76 PolarHBondContact O-N 3.48Å; A76-T78 VanDerWaalsContact C-N 3.35Å; A76-A80 WeakPolarHBondContact O-CB 3.45Å; A76-A80 PolarHBondContact O-N 3.49Å |
| 77 | E | 98.6 | Very high | 98.5 | Very high | 104 Ų | 104 | 98.6 Ų | 98.6 | 49% | 0.486 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.7 | -40.7 | 176.6 | -73.4 | 177.2 | -174.8 | 0 | 0 | 111.6 | R73 I75 A81 | R73-E77 HydrophobicContact CG-CG 4.41Å; R73-E77 WeakPolarHBondContact CG-OE1 3.27Å; R73-E77 IonicContact CZ-OE1 3.54Å; R73-E77 IonicContact NE-OE1 2.78Å; R73-E77 PolarHBondContact NE-OE1 3.43Å; R73-E77 IonicContact NH2-OE1 3.39Å; R73-E77 PolarHBondContact NH2-OE1 3.4Å; R73-E77 WeakPolarHBondContact O-CB 3.4Å; R73-E77 WeakPolarHBondContact O-CG 3.45Å; R73-E77 PolarHBondContact O-N 3.14Å; I75-E77 PolarHBondContact O-N 2.9Å; E77-A81 WeakPolarHBondContact O-CB 3.36Å; E77-A81 PolarHBondContact O-N 3.33Å |
| 78 | T | 98.6 | Very high | 98.5 | Very high | 87 Ų | 87 | 99.8 Ų | 99.8 | 53% | 0.534 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -69.3 | -43 | 178.8 | -56.5 | 0 | 0 | 0 | 0 | 111.7 | T74 I75 A76 A81 Y82 | T74-T78 VanDerWaalsContact O-CB 3.29Å; T74-T78 WeakPolarHBondContact O-CB 3.48Å; T74-T78 PolarHBondContact O-N 2.95Å; T74-T78 PolarHBondContact O-OG1 3.44Å; I75-T78 PolarHBondContact O-N 3.47Å; I75-T78 VanDerWaalsContact O-N 3.15Å; A76-T78 VanDerWaalsContact C-N 3.35Å; T78-A81 PolarHBondContact O-N 3.01Å; T78-Y82 WeakPolarHBondContact O-CB 3.35Å; T78-Y82 PolarHBondContact O-N 3.3Å |
| 79 | E | 98.4 | Very high | 98.5 | Very high | 120 Ų | 120 | 97.2 Ų | 97.2 | 56% | 0.561 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61 | -45 | 175.4 | -73.7 | 177 | 165.3 | 0 | 0 | 111.1 | I75 A81 Y82 L83 | I75-E79 HydrophobicContact CG2-CG 4.28Å; I75-E79 WeakPolarHBondContact O-CB 3.42Å; I75-E79 WeakPolarHBondContact O-CG 3.37Å; I75-E79 PolarHBondContact O-N 2.88Å; E79-A81 VanDerWaalsContact C-N 3.34Å; E79-A81 PolarHBondContact O-N 3.04Å; E79-Y82 PolarHBondContact O-N 3.08Å; E79-L83 WeakPolarHBondContact O-CG 3.49Å; E79-L83 PolarHBondContact O-N 3.44Å |
| 80 | A | 98.5 | Very high | 98.4 | Very high | 48 Ų | 48 | 98.7 Ų | 98.7 | 40% | 0.397 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.6 | -40.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A76 K84 | A76-A80 WeakPolarHBondContact O-CB 3.45Å; A76-A80 PolarHBondContact O-N 3.49Å; A80-K84 WeakPolarHBondContact O-CG 3.45Å; A80-K84 PolarHBondContact O-N 3.49Å |
| 81 | A | 98.5 | Very high | 98.4 | Very high | 49 Ų | 49 | 96.5 Ų | 96.5 | 41% | 0.405 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.8 | -41.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | E77 T78 E79 L83 K84 I85 | E77-A81 WeakPolarHBondContact O-CB 3.36Å; E77-A81 PolarHBondContact O-N 3.33Å; T78-A81 PolarHBondContact O-N 3.01Å; E79-A81 VanDerWaalsContact C-N 3.34Å; E79-A81 PolarHBondContact O-N 3.04Å; A81-L83 PolarHBondContact O-N 3.15Å; A81-K84 WeakPolarHBondContact O-CB 3.42Å; A81-K84 PolarHBondContact O-N 2.91Å; A81-I85 PolarHBondContact O-N 3.32Å; A81-I85 VanDerWaalsContact O-N 3.16Å |
| 82 | Y | 98.4 | Very high | 98.3 | Very high | 145 Ų | 145 | 96.2 Ų | 96.2 | 57% | 0.569 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.5 | -42 | 177.6 | -177.2 | -105.4 | 0 | 0 | 0 | 112.1 | T78 E79 K84 I85 L86 | T78-Y82 WeakPolarHBondContact O-CB 3.35Å; T78-Y82 PolarHBondContact O-N 3.3Å; E79-Y82 PolarHBondContact O-N 3.08Å; Y82-K84 VanDerWaalsContact C-N 3.31Å; Y82-K84 PolarHBondContact O-N 3.43Å; Y82-I85 WeakPolarHBondContact O-CB 3.48Å; Y82-I85 PolarHBondContact O-N 3.31Å; Y82-I85 VanDerWaalsContact O-N 3.14Å; Y82-L86 HydrophobicContact CD1-CD1 4.37Å; Y82-L86 HydrophobicContact CE1-CD1 3.68Å; Y82-L86 PolarHBondContact O-N 2.87Å |
| 83 | L | 98.2 | Very high | 98.3 | Very high | 104 Ų | 104 | 96.2 Ų | 96.2 | 55% | 0.545 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57.8 | -42.7 | 174.8 | -72.7 | 173.3 | 0 | 0 | 0 | 112.1 | E79 A81 I85 L86 E87 | E79-L83 WeakPolarHBondContact O-CG 3.49Å; E79-L83 PolarHBondContact O-N 3.44Å; A81-L83 PolarHBondContact O-N 3.15Å; L83-I85 VanDerWaalsContact C-N 3.33Å; L83-I85 PolarHBondContact O-N 3Å; L83-L86 WeakPolarHBondContact O-CB 3.27Å; L83-L86 PolarHBondContact O-N 3.45Å; L83-L86 VanDerWaalsContact O-N 3.13Å; L83-E87 WeakPolarHBondContact O-CG 3.48Å; L83-E87 PolarHBondContact O-N 2.99Å |
| 84 | K | 98.4 | Very high | 98.2 | Very high | 139 Ų | 139 | 91.9 Ų | 91.9 | 60% | 0.604 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.7 | -37.8 | 176.1 | -68.2 | 175.5 | -177.8 | 177.6 | 0 | 112.9 | A80 A81 Y82 L86 S88 | A80-K84 WeakPolarHBondContact O-CG 3.45Å; A80-K84 PolarHBondContact O-N 3.49Å; A81-K84 WeakPolarHBondContact O-CB 3.42Å; A81-K84 PolarHBondContact O-N 2.91Å; Y82-K84 VanDerWaalsContact C-N 3.31Å; Y82-K84 PolarHBondContact O-N 3.43Å; K84-L86 VanDerWaalsContact C-N 3.31Å; K84-S88 WeakPolarHBondContact O-CB 3.49Å; K84-S88 PolarHBondContact O-N 3.25Å; K84-S88 PolarHBondContact O-OG 2.99Å |
| 85 | I | 98.3 | Very high | 98.2 | Very high | 101 Ų | 101 | 91.2 Ų | 91.2 | 52% | 0.518 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.9 | -41.9 | 174.8 | -67.9 | 170.8 | 0 | 0 | 0 | 110.1 | A81 Y82 L83 S88 S89 | A81-I85 PolarHBondContact O-N 3.32Å; A81-I85 VanDerWaalsContact O-N 3.16Å; Y82-I85 WeakPolarHBondContact O-CB 3.48Å; Y82-I85 PolarHBondContact O-N 3.31Å; Y82-I85 VanDerWaalsContact O-N 3.14Å; L83-I85 VanDerWaalsContact C-N 3.33Å; L83-I85 PolarHBondContact O-N 3Å; I85-S88 PolarHBondContact O-N 3.3Å; I85-S89 WeakPolarHBondContact O-CB 3.41Å; I85-S89 PolarHBondContact O-N 3.45Å; I85-S89 PolarHBondContact O-OG 3.3Å |
| 86 | L | 98.1 | Very high | 98.1 | Very high | 67 Ų | 67 | 92.6 Ų | 92.6 | 35% | 0.351 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.1 | -46.6 | -179.9 | -140.3 | 155.2 | 0 | 0 | 0 | 111.1 | Y82 L83 K84 S88 S89 Q90 | Y82-L86 HydrophobicContact CD1-CD1 4.37Å; Y82-L86 HydrophobicContact CE1-CD1 3.68Å; Y82-L86 PolarHBondContact O-N 2.87Å; L83-L86 WeakPolarHBondContact O-CB 3.27Å; L83-L86 PolarHBondContact O-N 3.45Å; L83-L86 VanDerWaalsContact O-N 3.13Å; K84-L86 VanDerWaalsContact C-N 3.31Å; L86-S88 PolarHBondContact O-N 3.19Å; L86-S89 PolarHBondContact O-N 3.03Å; L86-Q90 HydrophobicContact CD2-CG 4.39Å; L86-Q90 WeakPolarHBondContact O-CG 3.33Å; L86-Q90 PolarHBondContact O-N 3.31Å |
| 87 | E | 97.7 | Very high | 98 | Very high | 123 Ų | 123 | 96.8 Ų | 96.8 | 58% | 0.575 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60 | -44.4 | 173.6 | -71.9 | 175.8 | 179 | 0 | 0 | 112.3 | L83 S89 Q90 T91 | L83-E87 WeakPolarHBondContact O-CG 3.48Å; L83-E87 PolarHBondContact O-N 2.99Å; E87-S89 VanDerWaalsContact C-N 3.31Å; E87-S89 PolarHBondContact O-N 3.29Å; E87-Q90 PolarHBondContact O-N 2.99Å; E87-T91 PolarHBondContact O-N 2.96Å; E87-T91 PolarHBondContact O-OG1 3Å |
| 88 | S | 98 | Very high | 98 | Very high | 75 Ų | 75 | 98.7 Ų | 98.7 | 52% | 0.524 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 177 | -60 | 0 | 0 | 0 | 0 | 111.5 | K84 I85 L86 T91 L92 | K84-S88 WeakPolarHBondContact O-CB 3.49Å; K84-S88 PolarHBondContact O-N 3.25Å; K84-S88 PolarHBondContact O-OG 2.99Å; I85-S88 PolarHBondContact O-N 3.3Å; L86-S88 PolarHBondContact O-N 3.19Å; S88-T91 PolarHBondContact O-N 2.89Å; S88-L92 WeakPolarHBondContact O-CB 3.29Å; S88-L92 PolarHBondContact O-N 3.02Å |
| 89 | S | 98.1 | Very high | 97.9 | Very high | 64 Ų | 64 | 98.3 Ų | 98.3 | 45% | 0.448 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.9 | -40.9 | 177.8 | -59.3 | 0 | 0 | 0 | 0 | 112 | I85 L86 E87 T91 L92 L93 | I85-S89 WeakPolarHBondContact O-CB 3.41Å; I85-S89 PolarHBondContact O-N 3.45Å; I85-S89 PolarHBondContact O-OG 3.3Å; L86-S89 PolarHBondContact O-N 3.03Å; E87-S89 VanDerWaalsContact C-N 3.31Å; E87-S89 PolarHBondContact O-N 3.29Å; S89-T91 VanDerWaalsContact C-N 3.34Å; S89-L92 PolarHBondContact O-N 2.82Å; S89-L93 WeakPolarHBondContact O-CB 3.49Å; S89-L93 PolarHBondContact O-N 3.23Å |
| 90 | Q | 97.7 | Very high | 97.7 | Very high | 115 Ų | 115 | 94.8 Ų | 94.8 | 54% | 0.537 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 173.9 | -72.6 | 176.7 | 5.1 | 0 | 0 | 111.8 | L86 E87 L93 S94 | L86-Q90 HydrophobicContact CD2-CG 4.39Å; L86-Q90 WeakPolarHBondContact O-CG 3.33Å; L86-Q90 PolarHBondContact O-N 3.31Å; E87-Q90 PolarHBondContact O-N 2.99Å; Q90-L93 PolarHBondContact O-N 2.7Å; Q90-S94 WeakPolarHBondContact O-CB 3.28Å; Q90-S94 PolarHBondContact O-N 3.38Å; Q90-S94 PolarHBondContact O-OG 2.95Å |
| 91 | T | 98.1 | Very high | 97.6 | Very high | 90 Ų | 90 | 94 Ų | 94 | 55% | 0.552 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.2 | -48.7 | 175.9 | -59 | 0 | 0 | 0 | 0 | 110.7 | E87 S88 S89 L93 S94 V95 | E87-T91 PolarHBondContact O-N 2.96Å; E87-T91 PolarHBondContact O-OG1 3Å; S88-T91 PolarHBondContact O-N 2.89Å; S89-T91 VanDerWaalsContact C-N 3.34Å; T91-L93 PolarHBondContact O-N 2.93Å; T91-S94 WeakPolarHBondContact O-CB 3.28Å; T91-S94 PolarHBondContact O-N 3.4Å; T91-S94 VanDerWaalsContact O-N 3.15Å; T91-V95 PolarHBondContact O-N 3.41Å |
| 92 | L | 98.1 | Very high | 97.4 | Very high | 126 Ų | 126 | 95.2 Ų | 95.2 | 66% | 0.66 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.7 | -44.7 | 177.9 | -177.9 | 62.2 | 0 | 0 | 0 | 112 | S88 S89 S94 V95 L96 | S88-L92 WeakPolarHBondContact O-CB 3.29Å; S88-L92 PolarHBondContact O-N 3.02Å; S89-L92 PolarHBondContact O-N 2.82Å; L92-S94 VanDerWaalsContact C-N 3.29Å; L92-S94 PolarHBondContact O-N 2.96Å; L92-V95 PolarHBondContact O-N 3.31Å; L92-L96 WeakPolarHBondContact O-CB 3.44Å; L92-L96 PolarHBondContact O-N 2.88Å |
| 93 | L | 97.8 | Very high | 97.1 | Very high | 85 Ų | 85 | 93.9 Ų | 93.9 | 45% | 0.445 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61 | -38.7 | 176.3 | -179.7 | 61.9 | 0 | 0 | 0 | 112 | S89 Q90 T91 L96 K97 | S89-L93 WeakPolarHBondContact O-CB 3.49Å; S89-L93 PolarHBondContact O-N 3.23Å; Q90-L93 PolarHBondContact O-N 2.7Å; T91-L93 PolarHBondContact O-N 2.93Å; L93-L96 PolarHBondContact O-N 3.24Å; L93-K97 HydrophobicContact CD1-CG 4.45Å; L93-K97 HydrophobicContact CG-CD 4.44Å; L93-K97 WeakPolarHBondContact O-CG 3.38Å; L93-K97 PolarHBondContact O-N 3.04Å |
| 94 | S | 97.6 | Very high | 96.8 | Very high | 76 Ų | 76 | 93.4 Ų | 93.4 | 53% | 0.531 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.1 | -43.7 | 178.5 | -59.8 | 0 | 0 | 0 | 0 | 111.6 | Q90 T91 L92 R98 | Q90-S94 WeakPolarHBondContact O-CB 3.28Å; Q90-S94 PolarHBondContact O-N 3.38Å; Q90-S94 PolarHBondContact O-OG 2.95Å; T91-S94 WeakPolarHBondContact O-CB 3.28Å; T91-S94 PolarHBondContact O-N 3.4Å; T91-S94 VanDerWaalsContact O-N 3.15Å; L92-S94 VanDerWaalsContact C-N 3.29Å; L92-S94 PolarHBondContact O-N 2.96Å; S94-R98 PolarHBondContact O-N 3.47Å; S94-R98 VanDerWaalsContact O-N 3.11Å |
| 95 | V | 97.8 | Very high | 96.4 | Very high | 59 Ų | 59 | 94.1 Ų | 94.1 | 36% | 0.358 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.4 | -48.2 | 173.7 | 174.2 | 0 | 0 | 0 | 0 | 110.4 | T91 L92 K97 R98 E99 | T91-V95 PolarHBondContact O-N 3.41Å; L92-V95 PolarHBondContact O-N 3.31Å; V95-K97 PolarHBondContact O-N 3.49Å; V95-R98 WeakPolarHBondContact O-CB 3.4Å; V95-R98 PolarHBondContact O-N 3.31Å; V95-R98 VanDerWaalsContact O-N 3.13Å; V95-E99 HydrophobicContact CG1-CG 4.2Å; V95-E99 WeakPolarHBondContact O-CG 3.46Å; V95-E99 PolarHBondContact O-N 2.97Å |
| 96 | L | 97.5 | Very high | 95.9 | Very high | 114 Ų | 114 | 91.6 Ų | 91.6 | 60% | 0.597 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -57.6 | -47.2 | 179.6 | -178.1 | 66.9 | 0 | 0 | 0 | 112.3 | L92 L93 R98 E99 A100 | L92-L96 WeakPolarHBondContact O-CB 3.44Å; L92-L96 PolarHBondContact O-N 2.88Å; L93-L96 PolarHBondContact O-N 3.24Å; L96-R98 VanDerWaalsContact C-N 3.3Å; L96-R98 PolarHBondContact O-N 3.44Å; L96-E99 PolarHBondContact O-N 2.69Å; L96-A100 VanDerWaalsContact O-CB 3.28Å; L96-A100 WeakPolarHBondContact O-CB 3.46Å; L96-A100 PolarHBondContact O-N 3.16Å |
| 97 | K | 96.7 | Very high | 95.3 | Very high | 142 Ų | 142 | 92.6 Ų | 92.6 | 62% | 0.617 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.2 | -39.9 | 177 | -77 | 179.3 | 177.5 | 179.5 | 0 | 112.1 | L93 V95 G101 | L93-K97 HydrophobicContact CD1-CG 4.45Å; L93-K97 HydrophobicContact CG-CD 4.44Å; L93-K97 WeakPolarHBondContact O-CG 3.38Å; L93-K97 PolarHBondContact O-N 3.04Å; V95-K97 PolarHBondContact O-N 3.49Å; K97-G101 PolarHBondContact O-N 2.93Å |
| 98 | R | 96.9 | Very high | 94.4 | Very high | 143 Ų | 143 | 89.2 Ų | 89.2 | 54% | 0.54 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.2 | -50.7 | 177.7 | -174.2 | -175.7 | 69.2 | -163.3 | -0.7 | 111.5 | S94 V95 L96 A100 G101 N102 | S94-R98 PolarHBondContact O-N 3.47Å; S94-R98 VanDerWaalsContact O-N 3.11Å; V95-R98 WeakPolarHBondContact O-CB 3.4Å; V95-R98 PolarHBondContact O-N 3.31Å; V95-R98 VanDerWaalsContact O-N 3.13Å; L96-R98 VanDerWaalsContact C-N 3.3Å; L96-R98 PolarHBondContact O-N 3.44Å; R98-A100 PolarHBondContact O-N 3.42Å; R98-G101 PolarHBondContact O-N 2.93Å; R98-N102 VanDerWaalsContact O-CG 3.28Å; R98-N102 PolarHBondContact O-N 3.4Å |
| 99 | E | 96.5 | Very high | 93.1 | Very high | 79 Ų | 79 | 88.9 Ų | 88.9 | 37% | 0.369 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | -179.5 | -60.6 | -45.8 | 136.8 | 0 | 0 | 111.7 | V95 L96 G101 N102 L103 | V95-E99 HydrophobicContact CG1-CG 4.2Å; V95-E99 WeakPolarHBondContact O-CG 3.46Å; V95-E99 PolarHBondContact O-N 2.97Å; L96-E99 PolarHBondContact O-N 2.69Å; E99-G101 VanDerWaalsContact C-N 3.34Å; E99-G101 PolarHBondContact O-N 3.42Å; E99-N102 PolarHBondContact O-N 3.4Å; E99-L103 WeakPolarHBondContact O-CG 3.4Å; E99-L103 PolarHBondContact O-N 3.49Å |
| 100 | A | 95.9 | Very high | 91.4 | Very high | 47 Ų | 47 | 91.2 Ų | 91.2 | 39% | 0.388 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.3 | -42 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L96 R98 L103 T104 | L96-A100 VanDerWaalsContact O-CB 3.28Å; L96-A100 WeakPolarHBondContact O-CB 3.46Å; L96-A100 PolarHBondContact O-N 3.16Å; R98-A100 PolarHBondContact O-N 3.42Å; A100-L103 PolarHBondContact O-N 2.97Å; A100-T104 PolarHBondContact O-N 3.01Å; A100-T104 VanDerWaalsContact O-N 3.08Å; A100-T104 PolarHBondContact O-OG1 3.44Å |
| 101 | G | 94.8 | Very high | 89.6 | Confident | 30 Ų | 30 | 93 Ų | 93 | 31% | 0.309 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.2 | -39.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | K97 R98 E99 T104 K105 | K97-G101 PolarHBondContact O-N 2.93Å; R98-G101 PolarHBondContact O-N 2.93Å; E99-G101 VanDerWaalsContact C-N 3.34Å; E99-G101 PolarHBondContact O-N 3.42Å; G101-T104 PolarHBondContact O-N 3.46Å; G101-K105 WeakPolarHBondContact O-CG 3.43Å; G101-K105 PolarHBondContact O-N 3.43Å |
| 102 | N | 94.3 | Very high | 87.7 | Confident | 75 Ų | 75 | 97.7 Ų | 97.7 | 40% | 0.401 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.3 | -44.8 | 175.3 | -70.8 | -17.5 | 0 | 0 | 0 | 111.7 | R98 E99 T104 K105 A106 | R98-N102 VanDerWaalsContact O-CG 3.28Å; R98-N102 PolarHBondContact O-N 3.4Å; E99-N102 PolarHBondContact O-N 3.4Å; N102-T104 VanDerWaalsContact C-N 3.33Å; N102-T104 PolarHBondContact O-N 3.47Å; N102-K105 PolarHBondContact O-N 3.38Å; N102-A106 PolarHBondContact O-N 3.32Å |
| 103 | L | 93.3 | Very high | 85.7 | Confident | 117 Ų | 117 | 96 Ų | 96 | 61% | 0.613 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -59.3 | -43.4 | 176.3 | -75.9 | 166.7 | 0 | 0 | 0 | 111.8 | E99 A100 K105 A106 T107 | E99-L103 WeakPolarHBondContact O-CG 3.4Å; E99-L103 PolarHBondContact O-N 3.49Å; A100-L103 PolarHBondContact O-N 2.97Å; L103-K105 VanDerWaalsContact C-N 3.3Å; L103-K105 PolarHBondContact O-N 3.01Å; L103-A106 PolarHBondContact O-N 2.92Å; L103-T107 WeakPolarHBondContact O-CG2 3.34Å; L103-T107 PolarHBondContact O-N 2.97Å; L103-T107 PolarHBondContact O-OG1 3.45Å |
| 104 | T | 92.1 | Very high | 83.7 | Confident | 95 Ų | 95 | 96.5 Ų | 96.5 | 58% | 0.583 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64 | -35.6 | 178.9 | -54.5 | 0 | 0 | 0 | 0 | 112.1 | A100 G101 N102 T107 A108 | A100-T104 PolarHBondContact O-N 3.01Å; A100-T104 VanDerWaalsContact O-N 3.08Å; A100-T104 PolarHBondContact O-OG1 3.44Å; G101-T104 PolarHBondContact O-N 3.46Å; N102-T104 VanDerWaalsContact C-N 3.33Å; N102-T104 PolarHBondContact O-N 3.47Å; T104-T107 PolarHBondContact O-OG1 3.45Å; T104-A108 WeakPolarHBondContact O-CB 3.06Å; T104-A108 PolarHBondContact O-N 3.18Å |
| 105 | K | 89.6 | Confident | 81.6 | Confident | 153 Ų | 153 | 96.3 Ų | 96.3 | 67% | 0.665 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -69.7 | -43.5 | 174.5 | -71.1 | 173.6 | -176.9 | 176.4 | 0 | 111.8 | G101 N102 L103 A108 S109 | G101-K105 WeakPolarHBondContact O-CG 3.43Å; G101-K105 PolarHBondContact O-N 3.43Å; N102-K105 PolarHBondContact O-N 3.38Å; L103-K105 VanDerWaalsContact C-N 3.3Å; L103-K105 PolarHBondContact O-N 3.01Å; K105-A108 PolarHBondContact O-N 3.49Å; K105-S109 PolarHBondContact O-N 3.43Å; K105-S109 VanDerWaalsContact O-N 3.12Å; K105-S109 PolarHBondContact O-OG 3.47Å |
| 106 | A | 87.6 | Confident | 79.4 | Confident | 49 Ų | 49 | 96.9 Ų | 96.9 | 41% | 0.405 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.5 | -45.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | N102 L103 A108 S109 D110 | N102-A106 PolarHBondContact O-N 3.32Å; L103-A106 PolarHBondContact O-N 2.92Å; A106-A108 VanDerWaalsContact C-N 3.3Å; A106-A108 PolarHBondContact O-N 3.35Å; A106-S109 WeakPolarHBondContact CA-OG 3.36Å; A106-S109 PolarHBondContact O-N 3.04Å; A106-S109 PolarHBondContact O-OG 3.06Å; A106-D110 PolarHBondContact O-N 2.99Å |
| 107 | T | 86.3 | Confident | 77.3 | Confident | 88 Ų | 88 | 102.5 Ų | 102.5 | 54% | 0.54 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -67.3 | -29.6 | 178.3 | 55.9 | 0 | 0 | 0 | 0 | 113 | L103 T104 | L103-T107 WeakPolarHBondContact O-CG2 3.34Å; L103-T107 PolarHBondContact O-N 2.97Å; L103-T107 PolarHBondContact O-OG1 3.45Å; T104-T107 PolarHBondContact O-OG1 3.45Å |
| 108 | A | 77.5 | Confident | 75 | Confident | 51 Ų | 51 | 103.8 Ų | 103.8 | 42% | 0.421 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -74.5 | -31.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | T104 K105 A106 | T104-A108 WeakPolarHBondContact O-CB 3.06Å; T104-A108 PolarHBondContact O-N 3.18Å; K105-A108 PolarHBondContact O-N 3.49Å; A106-A108 VanDerWaalsContact C-N 3.3Å; A106-A108 PolarHBondContact O-N 3.35Å |
| 109 | S | 71.2 | Confident | 72.7 | Confident | 69 Ų | 69 | 106.3 Ų | 106.3 | 48% | 0.483 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -72 | -36 | 175.2 | 38.1 | 0 | 0 | 0 | 0 | 113.2 | K105 A106 Q111 K112 S113 | K105-S109 PolarHBondContact O-N 3.43Å; K105-S109 VanDerWaalsContact O-N 3.12Å; K105-S109 PolarHBondContact O-OG 3.47Å; A106-S109 WeakPolarHBondContact CA-OG 3.36Å; A106-S109 PolarHBondContact O-N 3.04Å; A106-S109 PolarHBondContact O-OG 3.06Å; S109-Q111 PolarHBondContact O-N 3.43Å; S109-K112 PolarHBondContact O-N 3.42Å; S109-S113 PolarHBondContact O-N 3.45Å |
| 110 | D | 62.2 | Low | 71.5 | Confident | 112 Ų | 112 | 107.7 Ų | 107.7 | 60% | 0.599 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -64.2 | -40.6 | 178.4 | -84.3 | -23.4 | 0 | 0 | 0 | 111.9 | A106 K112 S113 S114 | A106-D110 PolarHBondContact O-N 2.99Å; D110-K112 VanDerWaalsContact C-N 3.31Å; D110-K112 PolarHBondContact O-N 3.19Å; D110-S113 PolarHBondContact O-N 3.17Å; D110-S113 PolarHBondContact O-OG 3.05Å; D110-S114 PolarHBondContact O-N 3.46Å |
| 111 | Q | 59.8 | Low | 70.2 | Confident | 153 Ų | 153 | 110.9 Ų | 110.9 | 72% | 0.715 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -65.7 | -27.3 | 178 | -74.5 | -176.9 | -22 | 0 | 0 | 114.3 | S109 S114 | S109-Q111 PolarHBondContact O-N 3.43Å; Q111-S114 PolarHBondContact O-OG 3.21Å |
| 112 | K | 58.2 | Low | 68.8 | Low | 188 Ų | 188 | 115.4 Ų | 115.4 | 82% | 0.817 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -78.8 | -25.4 | 175.1 | -82.9 | -174.3 | 177.8 | -179.9 | 0 | 113 | S109 D110 | S109-K112 PolarHBondContact O-N 3.42Å; D110-K112 VanDerWaalsContact C-N 3.31Å; D110-K112 PolarHBondContact O-N 3.19Å |
| 113 | S | 56.2 | Low | 67.3 | Low | 92 Ų | 92 | 117.8 Ų | 117.8 | 64% | 0.643 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -79.4 | -24.2 | 178.9 | 76.6 | 0 | 0 | 0 | 0 | 113.3 | S109 D110 | S109-S113 PolarHBondContact O-N 3.45Å; D110-S113 PolarHBondContact O-N 3.17Å; D110-S113 PolarHBondContact O-OG 3.05Å |
| 114 | S | 55.3 | Low | 65.7 | Low | 95 Ų | 95 | 117.8 Ų | 117.8 | 66% | 0.664 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -9 | -179.3 | 65.3 | 0 | 0 | 0 | 0 | 114.9 | D110 Q111 | D110-S114 PolarHBondContact O-N 3.46Å; Q111-S114 PolarHBondContact O-OG 3.21Å |
| 115 | G | 53.8 | Low | 63.9 | Low | 72 Ų | 72 | 119.3 Ų | 119.3 | 74% | 0.742 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | 7.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||
| 116 | G | 52.7 | Low | 62.1 | Low | 70 Ų | 70 | 116.9 Ų | 116.9 | 72% | 0.722 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -107.3 | 20.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 116 | ||
| 117 | R | 52.5 | Low | 60.1 | Low | 232 Ų | 232 | 122.2 Ų | 122.2 | 88% | 0.875 | 73% | 0.731 | S | S | * | * | trans | -136.1 | 88.1 | 171.5 | -83.6 | 179 | 173.9 | 157.6 | -2.3 | 108.6 | ||||
| 118 | D | 47.9 | Very low | 58 | Low | 169 Ų | 169 | 125 Ų | 125 | 90% | 0.904 | 75% | 0.747 | S | S | * | * | -163.8 | 132.4 | 129.1 | -89.3 | -25.3 | 0 | 0 | 0 | 108.5 | |||||
| 119 | S | 48.2 | Very low | 56.2 | Low | 197 Ų | 197 | 131.7 Ų | 131.7 | 100% | 1.378 | 78% | 0.777 | S | S | * | * | trans | -84.4 | 0 | 179.7 | -56.1 | 0 | 0 | 0 | 0 | 111.4 |
Retrieved 119 of 119 residues in 150.3 ms
(Link to these results)