| 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 | 50.5 | Low | 84.1 | Confident | 241 Ų | 241 | 111.2 Ų | 111.2 | 100% | 1.187 | 61% | 0.607 | S | S | * | * | 0 | 123.1 | 0 | -65.8 | 179.7 | -179.6 | 0 | 0 | 106.6 | N3 | M1-N3 PolarHBondContact O-N 3.45Š| |||
| 2 | A | 69.1 | Low | 85 | Confident | 72 Ų | 72 | 110.6 Ų | 110.6 | 60% | 0.595 | 60% | 0.602 | S | S | * | * | trans | -54.9 | 135.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | P4 | A2-P4 WeakPolarHBondContact O-CD 3.1Š| ||
| 3 | N | 82.3 | Confident | 85.8 | Confident | 102 Ų | 102 | 106.4 Ų | 106.4 | 55% | 0.545 | 59% | 0.591 | S | S | . | * | trans | -78.3 | 103.9 | -178.4 | -178 | -5.1 | 0 | 0 | 0 | 108.2 | M1 K5 A6 E7 | M1-N3 PolarHBondContact O-N 3.45Å; N3-K5 PolarHBondContact O-N 3.37Å; N3-K5 WeakPolarHBondContact OD1-CB 3.46Å; N3-K5 PolarHBondContact OD1-N 3.31Å; N3-A6 HydrophobicContact CB-CB 4.16Å; N3-A6 WeakPolarHBondContact O-CB 3.34Å; N3-A6 PolarHBondContact O-N 2.93Å; N3-E7 PolarHBondContact O-N 3.06Å | ||
| 4 | P | 84.7 | Confident | 86.4 | Confident | 87 Ų | 87 | 104 Ų | 104 | 57% | 0.565 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61 | -26.3 | -172.7 | 25.9 | -35.1 | 0 | 0 | 0 | 112.2 | A2 L8 | A2-P4 WeakPolarHBondContact O-CD 3.1Å; P4-L8 WeakPolarHBondContact O-CG 3.46Å; P4-L8 PolarHBondContact O-N 2.95Å |
| 5 | K | 90.5 | Very high | 86.9 | Confident | 140 Ų | 140 | 105 Ų | 105 | 61% | 0.609 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67 | -37.7 | 175.7 | -171 | 177.9 | 179.5 | -180 | 0 | 112.3 | N3 Q9 | N3-K5 PolarHBondContact O-N 3.37Å; N3-K5 WeakPolarHBondContact OD1-CB 3.46Å; N3-K5 PolarHBondContact OD1-N 3.31Å; K5-Q9 WeakPolarHBondContact O-CG 3.35Å; K5-Q9 PolarHBondContact O-N 2.88Å; K5-Q9 VanDerWaalsContact O-N 3.1Å |
| 6 | A | 90.1 | Very high | 87.3 | Confident | 50 Ų | 50 | 106.7 Ų | 106.7 | 41% | 0.413 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -70.9 | -38.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | N3 Q9 S10 | N3-A6 HydrophobicContact CB-CB 4.16Å; N3-A6 WeakPolarHBondContact O-CB 3.34Å; N3-A6 PolarHBondContact O-N 2.93Å; A6-Q9 PolarHBondContact O-N 3.33Å; A6-S10 PolarHBondContact O-N 3.07Å |
| 7 | E | 90.3 | Very high | 87.8 | Confident | 111 Ų | 111 | 107.6 Ų | 107.6 | 52% | 0.519 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.1 | -45.6 | 174.3 | -73.2 | -177.5 | 173.8 | 0 | 0 | 111.8 | N3 Q9 S10 I11 | N3-E7 PolarHBondContact O-N 3.06Å; E7-Q9 VanDerWaalsContact C-N 3.29Å; E7-Q9 PolarHBondContact O-N 3.13Å; E7-S10 WeakPolarHBondContact O-CB 3.37Å; E7-S10 PolarHBondContact O-N 3.1Å; E7-S10 VanDerWaalsContact O-N 3.13Å; E7-I11 WeakPolarHBondContact O-CG1 3.45Å; E7-I11 PolarHBondContact O-N 3.36Å |
| 8 | L | 88.5 | Confident | 88.1 | Confident | 119 Ų | 119 | 105.8 Ų | 105.8 | 62% | 0.623 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -60.8 | -38.1 | 176 | -72.9 | 174.5 | 0 | 0 | 0 | 112.3 | P4 L12 | P4-L8 WeakPolarHBondContact O-CG 3.46Å; P4-L8 PolarHBondContact O-N 2.95Å; L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 PolarHBondContact O-N 3.47Å |
| 9 | Q | 93.2 | Very high | 88.4 | Confident | 121 Ų | 121 | 106.4 Ų | 106.4 | 57% | 0.565 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.2 | -40.5 | 173.9 | -76.8 | -179.8 | -17.9 | 0 | 0 | 112.2 | K5 A6 E7 L12 A13 | K5-Q9 WeakPolarHBondContact O-CG 3.35Å; K5-Q9 PolarHBondContact O-N 2.88Å; K5-Q9 VanDerWaalsContact O-N 3.1Å; A6-Q9 PolarHBondContact O-N 3.33Å; E7-Q9 VanDerWaalsContact C-N 3.29Å; E7-Q9 PolarHBondContact O-N 3.13Å; Q9-L12 PolarHBondContact O-N 2.95Å; Q9-A13 WeakPolarHBondContact O-CB 3.45Å; Q9-A13 PolarHBondContact O-N 3.47Å |
| 10 | S | 93.2 | Very high | 88.6 | Confident | 73 Ų | 73 | 107.3 Ų | 107.3 | 51% | 0.51 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.4 | -42.9 | 176.3 | -172.6 | 0 | 0 | 0 | 0 | 112.2 | A6 E7 A13 T14 | A6-S10 PolarHBondContact O-N 3.07Å; E7-S10 WeakPolarHBondContact O-CB 3.37Å; E7-S10 PolarHBondContact O-N 3.1Å; E7-S10 VanDerWaalsContact O-N 3.13Å; S10-A13 PolarHBondContact O-N 3.36Å; S10-T14 WeakPolarHBondContact O-CB 3.35Å; S10-T14 PolarHBondContact O-N 2.95Å; S10-T14 PolarHBondContact O-OG1 2.92Å |
| 11 | I | 93.2 | Very high | 88.8 | Confident | 107 Ų | 107 | 108.1 Ų | 108.1 | 55% | 0.549 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.7 | -44.9 | 178 | -67.6 | 166.2 | 0 | 0 | 0 | 110.1 | E7 A13 T14 Q15 | E7-I11 WeakPolarHBondContact O-CG1 3.45Å; E7-I11 PolarHBondContact O-N 3.36Å; I11-A13 PolarHBondContact O-N 3.49Å; I11-T14 PolarHBondContact O-N 3.36Å; I11-Q15 WeakPolarHBondContact O-CB 3.33Å; I11-Q15 PolarHBondContact O-N 2.76Å |
| 12 | L | 94.9 | Very high | 90.7 | Very high | 104 Ų | 104 | 100.9 Ų | 100.9 | 55% | 0.545 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 177.2 | -176.5 | 64.9 | 0 | 0 | 0 | 111.8 | L8 Q9 T14 Q15 Q16 | L8-L12 WeakPolarHBondContact O-CB 3.39Å; L8-L12 PolarHBondContact O-N 3.47Å; Q9-L12 PolarHBondContact O-N 2.95Å; L12-T14 VanDerWaalsContact C-N 3.34Å; L12-T14 PolarHBondContact O-N 3.02Å; L12-Q15 PolarHBondContact O-N 3.29Å; L12-Q16 WeakPolarHBondContact O-CB 3.47Å; L12-Q16 PolarHBondContact O-N 2.97Å |
| 13 | A | 95.2 | Very high | 91.8 | Very high | 56 Ų | 56 | 100 Ų | 100 | 46% | 0.463 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.9 | -41.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q9 S10 I11 Q16 Q17 | Q9-A13 WeakPolarHBondContact O-CB 3.45Å; Q9-A13 PolarHBondContact O-N 3.47Å; S10-A13 PolarHBondContact O-N 3.36Å; I11-A13 PolarHBondContact O-N 3.49Å; A13-Q16 PolarHBondContact O-N 3.44Å; A13-Q17 WeakPolarHBondContact O-CB 3.49Å; A13-Q17 PolarHBondContact O-N 2.93Å |
| 14 | T | 93.7 | Very high | 92.3 | Very high | 73 Ų | 73 | 100.5 Ų | 100.5 | 45% | 0.448 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.3 | -41.3 | 178.3 | -53.3 | 0 | 0 | 0 | 0 | 111.5 | S10 I11 L12 Q17 T18 | S10-T14 WeakPolarHBondContact O-CB 3.35Å; S10-T14 PolarHBondContact O-N 2.95Å; S10-T14 PolarHBondContact O-OG1 2.92Å; I11-T14 PolarHBondContact O-N 3.36Å; L12-T14 VanDerWaalsContact C-N 3.34Å; L12-T14 PolarHBondContact O-N 3.02Å; T14-Q17 PolarHBondContact O-N 3.41Å; T14-T18 WeakPolarHBondContact O-CB 3.46Å; T14-T18 PolarHBondContact O-N 3.29Å; T14-T18 PolarHBondContact O-OG1 3.02Å |
| 15 | Q | 93.9 | Very high | 92.6 | Very high | 119 Ų | 119 | 103.4 Ų | 103.4 | 56% | 0.556 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -63.8 | -42.6 | 175.9 | -169.6 | -177.1 | 33.1 | 0 | 0 | 111.2 | I11 L12 T18 L19 | I11-Q15 WeakPolarHBondContact O-CB 3.33Å; I11-Q15 PolarHBondContact O-N 2.76Å; L12-Q15 PolarHBondContact O-N 3.29Å; Q15-T18 PolarHBondContact O-N 3.5Å; Q15-L19 WeakPolarHBondContact O-CG 3.43Å; Q15-L19 PolarHBondContact O-N 3.06Å |
| 16 | Q | 94.2 | Very high | 92.3 | Very high | 132 Ų | 132 | 103.3 Ų | 103.3 | 62% | 0.617 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.3 | -40 | 178.1 | -163.6 | 162.1 | 25.5 | 0 | 0 | 111.8 | L12 A13 L19 Q20 | L12-Q16 WeakPolarHBondContact O-CB 3.47Å; L12-Q16 PolarHBondContact O-N 2.97Å; A13-Q16 PolarHBondContact O-N 3.44Å; Q16-L19 PolarHBondContact O-N 3.27Å; Q16-Q20 PolarHBondContact O-N 3.12Å; Q16-Q20 VanDerWaalsContact O-N 3.13Å |
| 17 | Q | 94.9 | Very high | 92.2 | Very high | 122 Ų | 122 | 107 Ų | 107 | 57% | 0.57 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -63.6 | -41.3 | 173.5 | -174.6 | -179.8 | -0.8 | 0 | 0 | 112.3 | A13 T14 Q20 Q21 | A13-Q17 WeakPolarHBondContact O-CB 3.49Å; A13-Q17 PolarHBondContact O-N 2.93Å; T14-Q17 PolarHBondContact O-N 3.41Å; Q17-Q20 PolarHBondContact O-N 2.78Å; Q17-Q21 PolarHBondContact O-N 2.95Å |
| 18 | T | 93.9 | Very high | 92.1 | Very high | 75 Ų | 75 | 107.6 Ų | 107.6 | 46% | 0.46 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65 | -43.5 | 179.5 | -54.3 | 0 | 0 | 0 | 0 | 111.2 | T14 Q15 Q20 Q21 V22 | T14-T18 WeakPolarHBondContact O-CB 3.46Å; T14-T18 PolarHBondContact O-N 3.29Å; T14-T18 PolarHBondContact O-OG1 3.02Å; Q15-T18 PolarHBondContact O-N 3.5Å; T18-Q20 VanDerWaalsContact C-N 3.28Å; T18-Q20 PolarHBondContact O-N 3.39Å; T18-Q21 PolarHBondContact O-N 3.08Å; T18-V22 WeakPolarHBondContact O-CG2 3.45Å; T18-V22 PolarHBondContact O-N 3.13Å; T18-V22 VanDerWaalsContact O-N 3.12Å |
| 19 | L | 93.3 | Very high | 92.1 | Very high | 117 Ų | 117 | 108 Ų | 108 | 61% | 0.613 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.8 | -36.8 | 175.4 | -73.4 | 171.6 | 0 | 0 | 0 | 112.1 | Q15 Q16 V22 A23 | Q15-L19 WeakPolarHBondContact O-CG 3.43Å; Q15-L19 PolarHBondContact O-N 3.06Å; Q16-L19 PolarHBondContact O-N 3.27Å; L19-V22 PolarHBondContact O-N 3.39Å; L19-A23 PolarHBondContact O-N 3.03Å |
| 20 | Q | 93.1 | Very high | 91.6 | Very high | 124 Ų | 124 | 104.6 Ų | 104.6 | 58% | 0.579 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -68.9 | -37.4 | 177.8 | -164.5 | 166.6 | 5.1 | 0 | 0 | 112.5 | Q16 Q17 T18 A23 Q24 | Q16-Q20 PolarHBondContact O-N 3.12Å; Q16-Q20 VanDerWaalsContact O-N 3.13Å; Q17-Q20 PolarHBondContact O-N 2.78Å; T18-Q20 VanDerWaalsContact C-N 3.28Å; T18-Q20 PolarHBondContact O-N 3.39Å; Q20-A23 PolarHBondContact O-N 3.28Å; Q20-Q24 WeakPolarHBondContact O-CG 3.41Å; Q20-Q24 PolarHBondContact O-N 3.45Å; Q20-Q24 VanDerWaalsContact O-N 3.08Å |
| 21 | Q | 91.6 | Very high | 91.1 | Very high | 126 Ų | 126 | 106.4 Ų | 106.4 | 59% | 0.589 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.3 | -42.1 | 172.3 | -91.7 | -173.7 | 1.4 | 0 | 0 | 112.5 | Q17 T18 Q24 F25 | Q17-Q21 PolarHBondContact O-N 2.95Å; T18-Q21 PolarHBondContact O-N 3.08Å; Q21-Q24 PolarHBondContact O-N 3.3Å; Q21-F25 PolarHBondContact O-N 2.99Å |
| 22 | V | 91.5 | Very high | 90.5 | Very high | 89 Ų | 89 | 105.1 Ų | 105.1 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 178.4 | 174.1 | 0 | 0 | 0 | 0 | 111.1 | T18 L19 F25 Q26 | T18-V22 WeakPolarHBondContact O-CG2 3.45Å; T18-V22 PolarHBondContact O-N 3.13Å; T18-V22 VanDerWaalsContact O-N 3.12Å; L19-V22 PolarHBondContact O-N 3.39Å; V22-F25 PolarHBondContact O-N 3.29Å; V22-Q26 PolarHBondContact O-N 3.04Å |
| 23 | A | 92.7 | Very high | 89.7 | Confident | 54 Ų | 54 | 104.6 Ų | 104.6 | 45% | 0.446 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L19 Q20 F25 Q26 E27 | L19-A23 PolarHBondContact O-N 3.03Å; Q20-A23 PolarHBondContact O-N 3.28Å; A23-F25 PolarHBondContact O-N 3.02Å; A23-Q26 PolarHBondContact O-N 3.37Å; A23-E27 PolarHBondContact O-N 3.46Å |
| 24 | Q | 92.7 | Very high | 89 | Confident | 111 Ų | 111 | 107.8 Ų | 107.8 | 52% | 0.519 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 177 | -75.4 | -179.6 | -22.6 | 0 | 0 | 112.4 | Q20 Q21 Q26 E27 Q28 | Q20-Q24 WeakPolarHBondContact O-CG 3.41Å; Q20-Q24 PolarHBondContact O-N 3.45Å; Q20-Q24 VanDerWaalsContact O-N 3.08Å; Q21-Q24 PolarHBondContact O-N 3.3Å; Q24-Q26 VanDerWaalsContact C-N 3.33Å; Q24-Q26 PolarHBondContact O-N 3.49Å; Q24-E27 PolarHBondContact O-N 3.4Å; Q24-Q28 WeakPolarHBondContact O-CG 3.47Å; Q24-Q28 PolarHBondContact O-N 3.36Å |
| 25 | F | 89.5 | Confident | 88.2 | Confident | 149 Ų | 149 | 113.5 Ų | 113.5 | 65% | 0.654 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.1 | -39.2 | 177.8 | -169.5 | -99.4 | 0 | 0 | 0 | 111.8 | Q21 V22 A23 F29 | Q21-F25 PolarHBondContact O-N 2.99Å; V22-F25 PolarHBondContact O-N 3.29Å; A23-F25 PolarHBondContact O-N 3.02Å; F25-F29 PolarHBondContact O-N 2.93Å |
| 26 | Q | 84.4 | Confident | 87.3 | Confident | 137 Ų | 137 | 112.7 Ų | 112.7 | 64% | 0.64 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.4 | -39.8 | 175.1 | -173.1 | -178.5 | -16.8 | 0 | 0 | 112 | V22 A23 Q24 F29 A30 | V22-Q26 PolarHBondContact O-N 3.04Å; A23-Q26 PolarHBondContact O-N 3.37Å; Q24-Q26 VanDerWaalsContact C-N 3.33Å; Q24-Q26 PolarHBondContact O-N 3.49Å; Q26-F29 PolarHBondContact O-N 3.01Å; Q26-A30 WeakPolarHBondContact O-CB 3.46Å; Q26-A30 PolarHBondContact O-N 2.79Å |
| 27 | E | 89.1 | Confident | 86.3 | Confident | 128 Ų | 128 | 109.8 Ų | 109.8 | 60% | 0.598 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67.3 | -42.9 | 178.7 | -160.6 | 169.4 | -156 | 0 | 0 | 111.6 | A23 Q24 F29 A30 E31 | A23-E27 PolarHBondContact O-N 3.46Å; Q24-E27 PolarHBondContact O-N 3.4Å; E27-F29 VanDerWaalsContact C-N 3.29Å; E27-F29 PolarHBondContact O-N 3Å; E27-A30 PolarHBondContact O-N 2.85Å; E27-E31 WeakPolarHBondContact O-CG 3.47Å; E27-E31 PolarHBondContact O-N 3.2Å |
| 28 | Q | 88.1 | Confident | 84.7 | Confident | 124 Ų | 124 | 108.9 Ų | 108.9 | 58% | 0.579 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -60.5 | -38.8 | 173.1 | -74.3 | -173.9 | -27.1 | 0 | 0 | 112.7 | Q24 T32 | Q24-Q28 WeakPolarHBondContact O-CG 3.47Å; Q24-Q28 PolarHBondContact O-N 3.36Å; Q28-T32 WeakPolarHBondContact O-CB 3.48Å; Q28-T32 PolarHBondContact O-N 3.35Å; Q28-T32 PolarHBondContact O-OG1 3.06Å |
| 29 | F | 87.7 | Confident | 82.8 | Confident | 126 Ų | 126 | 108.9 Ų | 108.9 | 55% | 0.553 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.5 | -44.4 | 175.8 | -175.2 | -103.8 | 0 | 0 | 0 | 111.5 | F25 Q26 E27 T32 L33 | F25-F29 PolarHBondContact O-N 2.93Å; Q26-F29 PolarHBondContact O-N 3.01Å; E27-F29 VanDerWaalsContact C-N 3.29Å; E27-F29 PolarHBondContact O-N 3Å; F29-T32 PolarHBondContact O-N 3.43Å; F29-L33 HydrophobicContact CD1-CD1 3.99Å; F29-L33 HydrophobicContact CD1-CG 4.49Å; F29-L33 HydrophobicContact CE1-CD1 3.45Å; F29-L33 VanDerWaalsContact CE1-CD1 3.45Å; F29-L33 HydrophobicContact CE1-CG 4.12Å; F29-L33 HydrophobicContact CZ-CD1 3.93Å; F29-L33 HydrophobicContact CZ-CD2 4.48Å; F29-L33 HydrophobicContact CZ-CG 4.25Å; F29-L33 PolarHBondContact O-N 3.33Å |
| 30 | A | 82.5 | Confident | 81 | Confident | 50 Ų | 50 | 110.1 Ų | 110.1 | 41% | 0.413 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.3 | -43.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q26 E27 T32 L33 Q34 | Q26-A30 WeakPolarHBondContact O-CB 3.46Å; Q26-A30 PolarHBondContact O-N 2.79Å; E27-A30 PolarHBondContact O-N 2.85Å; A30-T32 VanDerWaalsContact C-N 3.31Å; A30-T32 PolarHBondContact O-N 3.24Å; A30-L33 PolarHBondContact O-N 3.04Å; A30-Q34 WeakPolarHBondContact O-CB 3.35Å; A30-Q34 PolarHBondContact O-N 3.49Å |
| 31 | E | 82.7 | Confident | 78.8 | Confident | 112 Ų | 112 | 106.1 Ų | 106.1 | 52% | 0.523 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -60.9 | -40.1 | 174.4 | -77.7 | -170.6 | 160.6 | 0 | 0 | 112 | E27 Q34 R35 | E27-E31 WeakPolarHBondContact O-CG 3.47Å; E27-E31 PolarHBondContact O-N 3.2Å; E31-Q34 PolarHBondContact O-N 3.3Å; E31-R35 WeakPolarHBondContact O-CB 3.36Å; E31-R35 WeakPolarHBondContact O-CG 3.41Å; E31-R35 PolarHBondContact O-N 3.02Å |
| 32 | T | 81.2 | Confident | 76.4 | Confident | 80 Ų | 80 | 105.4 Ų | 105.4 | 49% | 0.491 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.6 | -43.7 | 178.1 | -57.3 | 0 | 0 | 0 | 0 | 110.9 | Q28 F29 A30 R35 L36 | Q28-T32 WeakPolarHBondContact O-CB 3.48Å; Q28-T32 PolarHBondContact O-N 3.35Å; Q28-T32 PolarHBondContact O-OG1 3.06Å; F29-T32 PolarHBondContact O-N 3.43Å; A30-T32 VanDerWaalsContact C-N 3.31Å; A30-T32 PolarHBondContact O-N 3.24Å; T32-R35 PolarHBondContact O-N 2.84Å; T32-L36 HydrophobicContact CG2-CD1 4.33Å; T32-L36 WeakPolarHBondContact O-CG 3.41Å; T32-L36 PolarHBondContact O-N 2.87Å |
| 33 | L | 77.9 | Confident | 74 | Confident | 92 Ų | 92 | 106 Ų | 106 | 48% | 0.482 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.6 | -40.4 | 174.6 | -71.7 | -179.2 | 0 | 0 | 0 | 112.3 | F29 A30 L36 S37 | F29-L33 HydrophobicContact CD1-CD1 3.99Å; F29-L33 HydrophobicContact CD1-CG 4.49Å; F29-L33 HydrophobicContact CE1-CD1 3.45Å; F29-L33 VanDerWaalsContact CE1-CD1 3.45Å; F29-L33 HydrophobicContact CE1-CG 4.12Å; F29-L33 HydrophobicContact CZ-CD1 3.93Å; F29-L33 HydrophobicContact CZ-CD2 4.48Å; F29-L33 HydrophobicContact CZ-CG 4.25Å; F29-L33 PolarHBondContact O-N 3.33Å; A30-L33 PolarHBondContact O-N 3.04Å; L33-L36 PolarHBondContact O-N 2.9Å; L33-S37 WeakPolarHBondContact O-CB 3.37Å; L33-S37 PolarHBondContact O-N 3.37Å |
| 34 | Q | 80.5 | Confident | 71.5 | Confident | 124 Ų | 124 | 110.7 Ų | 110.7 | 58% | 0.579 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -69.6 | -36.2 | 179.1 | -161.5 | 176.6 | 1.8 | 0 | 0 | 111.8 | A30 E31 S37 L38 | A30-Q34 WeakPolarHBondContact O-CB 3.35Å; A30-Q34 PolarHBondContact O-N 3.49Å; E31-Q34 PolarHBondContact O-N 3.3Å; Q34-S37 PolarHBondContact O-N 3.45Å; Q34-L38 HydrophobicContact CG-CD1 4.14Å; Q34-L38 WeakPolarHBondContact O-CB 3.38Å; Q34-L38 WeakPolarHBondContact O-CG 3.37Å; Q34-L38 PolarHBondContact O-N 2.8Å |
| 35 | R | 77.9 | Confident | 68.8 | Low | 193 Ų | 193 | 115.3 Ų | 115.3 | 73% | 0.728 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.3 | -42.8 | 172.1 | -80.7 | -178.3 | 156.7 | -165.1 | -4.5 | 112.2 | E31 T32 S39 | E31-R35 WeakPolarHBondContact O-CB 3.36Å; E31-R35 WeakPolarHBondContact O-CG 3.41Å; E31-R35 PolarHBondContact O-N 3.02Å; T32-R35 PolarHBondContact O-N 2.84Å; R35-S39 WeakPolarHBondContact O-CB 3.41Å; R35-S39 PolarHBondContact O-N 3.2Å; R35-S39 PolarHBondContact O-OG 3.32Å |
| 36 | L | 74.8 | Confident | 66.1 | Low | 102 Ų | 102 | 114.5 Ų | 114.5 | 53% | 0.534 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -63.1 | -42.8 | 174 | -72.5 | 164.5 | 0 | 0 | 0 | 110.9 | T32 L33 S39 Q40 | T32-L36 HydrophobicContact CG2-CD1 4.33Å; T32-L36 WeakPolarHBondContact O-CG 3.41Å; T32-L36 PolarHBondContact O-N 2.87Å; L33-L36 PolarHBondContact O-N 2.9Å; L36-S39 PolarHBondContact O-N 3.4Å; L36-S39 PolarHBondContact O-OG 2.87Å; L36-Q40 PolarHBondContact O-N 3.29Å |
| 37 | S | 71.7 | Confident | 63.9 | Low | 71 Ų | 71 | 114.3 Ų | 114.3 | 50% | 0.497 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -64.4 | -46.1 | 176.2 | -177.2 | 0 | 0 | 0 | 0 | 113.1 | L33 Q34 S39 Q40 A41 | L33-S37 WeakPolarHBondContact O-CB 3.37Å; L33-S37 PolarHBondContact O-N 3.37Å; Q34-S37 PolarHBondContact O-N 3.45Å; S37-S39 VanDerWaalsContact C-N 3.29Å; S37-S39 PolarHBondContact O-N 3.46Å; S37-Q40 WeakPolarHBondContact O-CA 3.48Å; S37-Q40 WeakPolarHBondContact O-CB 3.33Å; S37-Q40 PolarHBondContact O-N 3Å; S37-A41 PolarHBondContact O-N 3.37Å |
| 38 | L | 61.5 | Low | 61.5 | Low | 103 Ų | 103 | 117.2 Ų | 117.2 | 54% | 0.539 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.9 | -31.7 | 176.3 | -77.8 | 162.5 | 0 | 0 | 0 | 112.6 | Q34 Q40 A41 S42 | Q34-L38 HydrophobicContact CG-CD1 4.14Å; Q34-L38 WeakPolarHBondContact O-CB 3.38Å; Q34-L38 WeakPolarHBondContact O-CG 3.37Å; Q34-L38 PolarHBondContact O-N 2.8Å; L38-Q40 PolarHBondContact O-N 2.96Å; L38-A41 PolarHBondContact O-N 3.36Å; L38-S42 PolarHBondContact O-N 3.07Å; L38-S42 VanDerWaalsContact O-N 3.07Å |
| 39 | S | 55.6 | Low | 59.3 | Low | 75 Ų | 75 | 116.4 Ų | 116.4 | 52% | 0.524 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -66.7 | -24.7 | 172.9 | 77.2 | 0 | 0 | 0 | 0 | 112.7 | R35 L36 S37 | R35-S39 WeakPolarHBondContact O-CB 3.41Å; R35-S39 PolarHBondContact O-N 3.2Å; R35-S39 PolarHBondContact O-OG 3.32Å; L36-S39 PolarHBondContact O-N 3.4Å; L36-S39 PolarHBondContact O-OG 2.87Å; S37-S39 VanDerWaalsContact C-N 3.29Å; S37-S39 PolarHBondContact O-N 3.46Å |
| 40 | Q | 53.8 | Low | 57.1 | Low | 143 Ų | 143 | 119 Ų | 119 | 67% | 0.668 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -78.5 | -38 | 169.8 | -64.4 | -179.6 | -15.9 | 0 | 0 | 111.4 | L36 S37 L38 S42 T43 | L36-Q40 PolarHBondContact O-N 3.29Å; S37-Q40 WeakPolarHBondContact O-CA 3.48Å; S37-Q40 WeakPolarHBondContact O-CB 3.33Å; S37-Q40 PolarHBondContact O-N 3Å; L38-Q40 PolarHBondContact O-N 2.96Å; Q40-S42 PolarHBondContact O-N 3.07Å; Q40-T43 PolarHBondContact O-N 3.28Å; Q40-T43 PolarHBondContact O-OG1 3.18Å |
| 41 | A | 48.4 | Very low | 55.4 | Low | 39 Ų | 39 | 120.4 Ų | 120.4 | 32% | 0.322 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -68.2 | -28.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | S37 L38 T43 E44 | S37-A41 PolarHBondContact O-N 3.37Å; L38-A41 PolarHBondContact O-N 3.36Å; A41-T43 PolarHBondContact O-N 2.86Å; A41-E44 WeakPolarHBondContact O-CB 3.37Å; A41-E44 WeakPolarHBondContact O-CG 3.36Å; A41-E44 PolarHBondContact O-N 2.66Å |
| 42 | S | 40.4 | Very low | 54.2 | Low | 111 Ų | 111 | 119.1 Ų | 119.1 | 78% | 0.776 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.5 | 6.6 | 173.3 | -73.2 | 0 | 0 | 0 | 0 | 114.5 | L38 Q40 | L38-S42 PolarHBondContact O-N 3.07Å; L38-S42 VanDerWaalsContact O-N 3.07Å; Q40-S42 PolarHBondContact O-N 3.07Å |
| 43 | T | 40.7 | Very low | 52.9 | Low | 103 Ų | 103 | 120.2 Ų | 120.2 | 63% | 0.632 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | 4.7 | 165.4 | 65.4 | 0 | 0 | 0 | 0 | 113.9 | Q40 A41 K45 M46 | Q40-T43 PolarHBondContact O-N 3.28Å; Q40-T43 PolarHBondContact O-OG1 3.18Å; A41-T43 PolarHBondContact O-N 2.86Å; T43-K45 PolarHBondContact O-N 3.41Å; T43-K45 VanDerWaalsContact O-N 3.09Å; T43-M46 PolarHBondContact O-N 3.19Å |
| 44 | E | 40.3 | Very low | 51.9 | Low | 152 Ų | 152 | 121.7 Ų | 121.7 | 71% | 0.71 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.6 | -3.9 | 179.3 | -74.2 | -179.6 | 175.3 | 0 | 0 | 115.1 | A41 | A41-E44 WeakPolarHBondContact O-CB 3.37Å; A41-E44 WeakPolarHBondContact O-CG 3.36Å; A41-E44 PolarHBondContact O-N 2.66Å |
| 45 | K | 36.4 | Very low | 51.2 | Low | 208 Ų | 208 | 119.4 Ų | 119.4 | 90% | 0.904 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.3 | 44.5 | 166.3 | -73.8 | -168.8 | -179.8 | 179.5 | 0 | 113.2 | T43 | T43-K45 PolarHBondContact O-N 3.41Å; T43-K45 VanDerWaalsContact O-N 3.09Å |
| 46 | M | 33.1 | Very low | 49.9 | Very low | 131 Ų | 131 | 112.2 Ų | 112.2 | 65% | 0.645 | 61% | 0.609 | S | S | * | * | trans | -157.4 | 58.4 | 151.4 | -159.9 | 65.8 | 166.2 | 0 | 0 | 111 | T43 R48 | T43-M46 PolarHBondContact O-N 3.19Å; M46-R48 HydrophobicContact CE-CG 4.34Å; M46-R48 PolarHBondContact O-N 3.5Å | ||
| 47 | V | 37.8 | Very low | 49.1 | Very low | 133 Ų | 133 | 110.1 Ų | 110.1 | 81% | 0.806 | 61% | 0.606 | S | S | * | * | trans | -66.8 | 85.8 | 160 | 177.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 48 | R | 38.4 | Very low | 49 | Very low | 190 Ų | 190 | 110.9 Ų | 110.9 | 72% | 0.717 | 62% | 0.617 | S | S | * | * | trans | -104.4 | 107.6 | 149 | -81.3 | -170.6 | -167.3 | 178.9 | 4 | 105.7 | M46 H50 | M46-R48 HydrophobicContact CE-CG 4.34Å; M46-R48 PolarHBondContact O-N 3.5Å; R48-H50 PolarHBondContact O-N 3.43Å; R48-H50 VanDerWaalsContact O-N 3.08Å | ||
| 49 | S | 43 | Very low | 49.2 | Very low | 107 Ų | 107 | 109.3 Ų | 109.3 | 75% | 0.748 | 61% | 0.614 | S | S | * | * | trans | -26.4 | 112.9 | 164 | 52.1 | 0 | 0 | 0 | 0 | 110.8 | P51 | S49-P51 VanDerWaalsContact O-CD 3.3Å; S49-P51 WeakPolarHBondContact O-CD 3.47Å; S49-P51 VanDerWaalsContact O-N 3.12Å | ||
| 50 | H | 40.6 | Very low | 50 | Low | 179 Ų | 179 | 109.3 Ų | 109.3 | 83% | 0.829 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 119.2 | 177.5 | -79.2 | -87.5 | 0 | 0 | 0 | 108.5 | R48 T52 | R48-H50 PolarHBondContact O-N 3.43Å; R48-H50 VanDerWaalsContact O-N 3.08Å; H50-T52 PolarHBondContact O-N 3.03Å |
| 51 | P | 47.8 | Very low | 50.9 | Low | 81 Ų | 81 | 105.4 Ų | 105.4 | 53% | 0.526 | 60% | 0.596 | S | S | . | * | P | Polyproline II helix | trans | -60.6 | 129.6 | 173.7 | 22.2 | -29.4 | 0 | 0 | 0 | 108.4 | S49 T55 | S49-P51 VanDerWaalsContact O-CD 3.3Å; S49-P51 WeakPolarHBondContact O-CD 3.47Å; S49-P51 VanDerWaalsContact O-N 3.12Å; P51-T55 HydrophobicContact CB-CG2 3.73Å |
| 52 | T | 57.5 | Low | 52 | Low | 85 Ų | 85 | 112.4 Ų | 112.4 | 52% | 0.521 | 62% | 0.622 | S | S | . | * | P | Polyproline II helix | trans | -59.5 | 160.2 | 171.6 | 56 | 0 | 0 | 0 | 0 | 109.8 | H50 D54 T55 L56 | H50-T52 PolarHBondContact O-N 3.03Å; T52-D54 PolarHBondContact O-N 2.86Å; T52-T55 WeakPolarHBondContact O-CA 3.34Å; T52-T55 WeakPolarHBondContact O-CB 3.35Å; T52-T55 PolarHBondContact O-N 3.49Å; T52-T55 PolarHBondContact OG1-OG1 3.28Å; T52-L56 PolarHBondContact O-N 3.34Å |
| 53 | L | 52.1 | Low | 53.6 | Low | 103 Ų | 103 | 110.3 Ų | 110.3 | 54% | 0.539 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -54.6 | -37.3 | -178.8 | -169.1 | 146.8 | 0 | 0 | 0 | 111.8 | L56 A57 | L53-L56 WeakPolarHBondContact O-CB 3.38Å; L53-L56 PolarHBondContact O-N 2.93Å; L53-A57 PolarHBondContact O-N 2.97Å |
| 54 | D | 56.9 | Low | 55 | Low | 123 Ų | 123 | 112.5 Ų | 112.5 | 66% | 0.658 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -67.8 | -37.7 | 176 | -53.2 | -53.3 | 0 | 0 | 0 | 112.7 | T52 L56 A57 A58 | T52-D54 PolarHBondContact O-N 2.86Å; D54-L56 VanDerWaalsContact C-N 3.29Å; D54-L56 PolarHBondContact O-N 3.42Å; D54-A57 PolarHBondContact O-N 3.45Å; D54-A58 VanDerWaalsContact O-CB 3.29Å; D54-A58 WeakPolarHBondContact O-CB 3.18Å; D54-A58 PolarHBondContact O-N 3.18Å |
| 55 | T | 65.8 | Low | 56.3 | Low | 76 Ų | 76 | 112.1 Ų | 112.1 | 47% | 0.466 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64.2 | -37.7 | 174.4 | -53.1 | 0 | 0 | 0 | 0 | 110.8 | P51 T52 S59 | P51-T55 HydrophobicContact CB-CG2 3.73Å; T52-T55 WeakPolarHBondContact O-CA 3.34Å; T52-T55 WeakPolarHBondContact O-CB 3.35Å; T52-T55 PolarHBondContact O-N 3.49Å; T52-T55 PolarHBondContact OG1-OG1 3.28Å; T55-S59 WeakPolarHBondContact O-CB 3.17Å; T55-S59 PolarHBondContact O-N 2.96Å |
| 56 | L | 52.1 | Low | 57.9 | Low | 42 Ų | 42 | 105.5 Ų | 105.5 | 22% | 0.22 | 58% | 0.575 | C | S | . | * | H | α-helix | trans | -69.2 | -46.9 | 176.5 | 180 | 69.6 | 0 | 0 | 0 | 111.4 | T52 L53 D54 A58 S59 I60 | T52-L56 PolarHBondContact O-N 3.34Å; L53-L56 WeakPolarHBondContact O-CB 3.38Å; L53-L56 PolarHBondContact O-N 2.93Å; D54-L56 VanDerWaalsContact C-N 3.29Å; D54-L56 PolarHBondContact O-N 3.42Å; L56-A58 VanDerWaalsContact C-N 3.3Å; L56-A58 PolarHBondContact O-N 3.22Å; L56-S59 WeakPolarHBondContact O-CB 2.89Å; L56-S59 PolarHBondContact O-N 3.43Å; L56-S59 PolarHBondContact O-OG 2.95Å; L56-I60 PolarHBondContact O-N 3.04Å |
| 57 | A | 58.2 | Low | 59.9 | Low | 58 Ų | 58 | 104 Ų | 104 | 48% | 0.479 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -58 | -45.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | L53 D54 S59 I60 | L53-A57 PolarHBondContact O-N 2.97Å; D54-A57 PolarHBondContact O-N 3.45Å; A57-S59 PolarHBondContact O-N 2.95Å; A57-I60 PolarHBondContact O-N 3.36Å; A57-I60 VanDerWaalsContact O-N 3.12Å |
| 58 | A | 68.6 | Low | 61.9 | Low | 87 Ų | 87 | 102.3 Ų | 102.3 | 72% | 0.719 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.6 | -24 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | D54 L56 | D54-A58 VanDerWaalsContact O-CB 3.29Å; D54-A58 WeakPolarHBondContact O-CB 3.18Å; D54-A58 PolarHBondContact O-N 3.18Å; L56-A58 VanDerWaalsContact C-N 3.3Å; L56-A58 PolarHBondContact O-N 3.22Å |
| 59 | S | 66.3 | Low | 63.4 | Low | 69 Ų | 69 | 97.1 Ų | 97.1 | 48% | 0.483 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -80.1 | -17.8 | 176.5 | 80.1 | 0 | 0 | 0 | 0 | 113.7 | T55 L56 A57 S61 K80 | T55-S59 WeakPolarHBondContact O-CB 3.17Å; T55-S59 PolarHBondContact O-N 2.96Å; L56-S59 WeakPolarHBondContact O-CB 2.89Å; L56-S59 PolarHBondContact O-N 3.43Å; L56-S59 PolarHBondContact O-OG 2.95Å; A57-S59 PolarHBondContact O-N 2.95Å; S59-S61 PolarHBondContact O-N 2.68Å; S59-K80 PolarHBondContact O-NZ 3.34Å; S59-K80 VanDerWaalsContact O-NZ 3.12Å |
| 60 | I | 71.1 | Confident | 64.7 | Low | 76 Ų | 76 | 100.3 Ų | 100.3 | 39% | 0.39 | 56% | 0.561 | S | S | . | * | S | Bend | trans | -87.9 | 90.7 | 173.5 | -57.2 | 170.3 | 0 | 0 | 0 | 106.8 | L56 A57 E62 W76 | L56-I60 PolarHBondContact O-N 3.04Å; A57-I60 PolarHBondContact O-N 3.36Å; A57-I60 VanDerWaalsContact O-N 3.12Å; I60-E62 PolarHBondContact O-N 3.21Å; I60-W76 HydrophobicContact CG2-CH2 4.03Å; I60-W76 HydrophobicContact CG2-CZ2 3.82Å |
| 61 | S | 73.2 | Confident | 66.1 | Low | 60 Ų | 60 | 94.1 Ų | 94.1 | 42% | 0.42 | 53% | 0.534 | S | S | . | . | trans | -45.8 | 122.7 | 168.1 | 53.4 | 0 | 0 | 0 | 0 | 110.5 | S59 W76 K80 | S59-S61 PolarHBondContact O-N 2.68Å; S61-W76 VanDerWaalsContact O-CZ2 3.26Å; S61-W76 WeakPolarHBondContact O-CZ2 3.28Å; S61-W76 PolarHBondContact O-NE1 2.91Å; S61-K80 WeakPolarHBondContact OG-CE 3.48Å; S61-K80 PolarHBondContact OG-NZ 3.03Å | ||
| 62 | E | 72 | Confident | 67.5 | Low | 186 Ų | 186 | 93.8 Ų | 93.8 | 87% | 0.869 | 53% | 0.531 | S | S | * | . | trans | -54.2 | 142 | 176.4 | -163.9 | 163.2 | -164.5 | 0 | 0 | 110.3 | I60 D64 | I60-E62 PolarHBondContact O-N 3.21Å; E62-D64 PolarHBondContact O-N 3.03Å | ||
| 63 | F | 73.7 | Confident | 68.3 | Low | 67 Ų | 67 | 95 Ų | 95 | 29% | 0.294 | 53% | 0.529 | S | S | . | . | trans | -84.2 | 111.1 | 177 | 173 | -103.1 | 0 | 0 | 0 | 108.3 | Y65 F73 W76 | F63-Y65 HydrophobicContact CZ-CD2 4.16Å; F63-F73 HydrophobicContact CD1-CD2 4.02Å; F63-F73 HydrophobicContact CD2-CD2 4.41Å; F63-F73 HydrophobicContact CE1-CB 4.16Å; F63-F73 HydrophobicContact CE1-CD2 4.19Å; F63-F73 HydrophobicContact CE2-CB 4.21Å; F63-F73 HydrophobicContact CG-CD2 4.13Å; F63-F73 HydrophobicContact CZ-CB 3.85Å; F63-F73 HydrophobicContact CZ-CD2 4.47Å; F63-W76 HydrophobicContact CB-CD2 4.17Å; F63-W76 HydrophobicContact CB-CG 4.5Å; F63-W76 HydrophobicContact CB-CZ2 4.37Å; F63-W76 HydrophobicContact CD2-CB 3.8Å; F63-W76 AromaticContact CD2-CD1 3.97Å; F63-W76 HydrophobicContact CD2-CD2 4.13Å; F63-W76 AromaticContact CD2-CG 3.72Å; F63-W76 HydrophobicContact CD2-CG 3.72Å; F63-W76 HydrophobicContact CE2-CB 4.13Å | ||
| 64 | D | 69.9 | Low | 69.3 | Low | 149 Ų | 149 | 96 Ų | 96 | 80% | 0.797 | 53% | 0.531 | S | S | * | . | trans | -109.2 | 126.8 | 170.2 | -165.3 | 5.7 | 0 | 0 | 0 | 108.9 | E62 D66 | E62-D64 PolarHBondContact O-N 3.03Å; D64-D66 PolarHBondContact O-N 3.08Å | ||
| 65 | Y | 67.3 | Low | 70 | Confident | 144 Ų | 144 | 92.1 Ų | 92.1 | 57% | 0.565 | 52% | 0.515 | S | S | * | . | trans | -89.4 | 105.2 | -175.4 | 176.3 | -103.1 | 0 | 0 | 0 | 109.8 | F63 P67 | F63-Y65 HydrophobicContact CZ-CD2 4.16Å; Y65-P67 HydrophobicContact CE1-CB 4.23Å | ||
| 66 | D | 70 | Confident | 70.6 | Confident | 70 Ų | 70 | 90 Ų | 90 | 37% | 0.374 | 50% | 0.499 | S | S | . | . | trans | -98.9 | 111.6 | 172.4 | -177.4 | -11.5 | 0 | 0 | 0 | 110.6 | D64 S68 T69 | D64-D66 PolarHBondContact O-N 3.08Å; D66-S68 PolarHBondContact O-N 3.11Å; D66-S68 VanDerWaalsContact O-N 3.09Å; D66-S68 WeakPolarHBondContact OD1-CB 3.46Å; D66-S68 PolarHBondContact OD1-N 3.16Å; D66-S68 PolarHBondContact OD1-OG 3.48Å; D66-S68 PolarHBondContact OD2-OG 2.88Å; D66-S68 VanDerWaalsContact OD2-OG 3.1Å; D66-T69 HydrophobicContact CB-CG2 4Å; D66-T69 PolarHBondContact O-N 3.46Å; D66-T69 VanDerWaalsContact O-N 3.07Å; D66-T69 PolarHBondContact O-OG1 2.61Å; D66-T69 WeakPolarHBondContact OD2-CG2 3.26Å | ||
| 67 | P | 75.1 | Confident | 71.4 | Confident | 99 Ų | 99 | 92.3 Ų | 92.3 | 64% | 0.643 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -16.2 | -179 | 25.9 | -33.7 | 0 | 0 | 0 | 114.1 | Y65 | Y65-P67 HydrophobicContact CE1-CB 4.23Š|
| 68 | S | 81 | Confident | 72.2 | Confident | 97 Ų | 97 | 92.2 Ų | 92.2 | 68% | 0.678 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -17.4 | 176.4 | 72.9 | 0 | 0 | 0 | 0 | 114 | D66 | D66-S68 PolarHBondContact O-N 3.11Å; D66-S68 VanDerWaalsContact O-N 3.09Å; D66-S68 WeakPolarHBondContact OD1-CB 3.46Å; D66-S68 PolarHBondContact OD1-N 3.16Å; D66-S68 PolarHBondContact OD1-OG 3.48Å; D66-S68 PolarHBondContact OD2-OG 2.88Å; D66-S68 VanDerWaalsContact OD2-OG 3.1Å |
| 69 | T | 70.2 | Confident | 72.2 | Confident | 81 Ų | 81 | 93.8 Ų | 93.8 | 50% | 0.497 | 49% | 0.49 | S | S | . | . | S | Bend | trans | -97.6 | -8.7 | -173.7 | 62.5 | 0 | 0 | 0 | 0 | 114.5 | D66 D71 | D66-T69 HydrophobicContact CB-CG2 4Å; D66-T69 PolarHBondContact O-N 3.46Å; D66-T69 VanDerWaalsContact O-N 3.07Å; D66-T69 PolarHBondContact O-OG1 2.61Å; D66-T69 WeakPolarHBondContact OD2-CG2 3.26Å; T69-D71 PolarHBondContact O-N 3.03Å |
| 70 | E | 70.3 | Confident | 72.2 | Confident | 174 Ų | 174 | 92.7 Ų | 92.7 | 81% | 0.813 | 48% | 0.477 | S | S | * | . | trans | 49.8 | 10 | -171.1 | -64.9 | -169.9 | 168.6 | 0 | 0 | 114.9 | T72 | E70-T72 PolarHBondContact O-N 3.26Š| ||
| 71 | D | 69.7 | Low | 71.6 | Confident | 50 Ų | 50 | 96 Ų | 96 | 27% | 0.267 | 49% | 0.489 | S | S | . | . | trans | -70.6 | 109.3 | 178.6 | -159 | 17.6 | 0 | 0 | 0 | 108.5 | T69 A75 R79 | T69-D71 PolarHBondContact O-N 3.03Å; D71-A75 VanDerWaalsContact OD1-CB 3.25Å; D71-A75 WeakPolarHBondContact OD1-CB 3.26Å; D71-R79 IonicContact OD1-NH1 2.97Å; D71-R79 IonicContact OD2-CZ 3.64Å; D71-R79 IonicContact OD2-NH1 3.04Å; D71-R79 PolarHBondContact OD2-NH1 2.67Å; D71-R79 VanDerWaalsContact OD2-NH1 3.15Å; D71-R79 IonicContact OD2-NH2 2.67Å; D71-R79 PolarHBondContact OD2-NH2 2.85Å | ||
| 72 | T | 77.2 | Confident | 70.7 | Confident | 74 Ų | 74 | 98.5 Ų | 98.5 | 45% | 0.454 | 50% | 0.502 | S | S | . | . | trans | -82.3 | 155.5 | 178.7 | 60.2 | 0 | 0 | 0 | 0 | 110.4 | E70 E74 A75 W76 | E70-T72 PolarHBondContact O-N 3.26Å; T72-E74 PolarHBondContact O-N 3.05Å; T72-E74 VanDerWaalsContact O-N 3.12Å; T72-A75 PolarHBondContact O-N 2.69Å; T72-A75 PolarHBondContact OG1-N 3.15Å; T72-W76 PolarHBondContact O-N 3.46Å | ||
| 73 | F | 72.9 | Confident | 69.5 | Low | 110 Ų | 110 | 92.3 Ų | 92.3 | 48% | 0.482 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -51.1 | -36.8 | 171 | 178 | -97.1 | 0 | 0 | 0 | 111.9 | F63 W76 F77 | F63-F73 HydrophobicContact CD1-CD2 4.02Å; F63-F73 HydrophobicContact CD2-CD2 4.41Å; F63-F73 HydrophobicContact CE1-CB 4.16Å; F63-F73 HydrophobicContact CE1-CD2 4.19Å; F63-F73 HydrophobicContact CE2-CB 4.21Å; F63-F73 HydrophobicContact CG-CD2 4.13Å; F63-F73 HydrophobicContact CZ-CB 3.85Å; F63-F73 HydrophobicContact CZ-CD2 4.47Å; F73-W76 HydrophobicContact CD2-CE3 4.21Å; F73-W76 AromaticContact CE2-CE3 4Å; F73-W76 HydrophobicContact CE2-CE3 4Å; F73-W76 AromaticContact CE2-CZ3 3.87Å; F73-W76 HydrophobicContact CE2-CZ3 3.87Å; F73-W76 HydrophobicContact CZ-CZ3 4.34Å; F73-W76 PolarHBondContact O-N 3.11Å; F73-F77 HydrophobicContact CE1-CB 4.39Å; F73-F77 WeakPolarHBondContact O-CB 3.41Å; F73-F77 PolarHBondContact O-N 2.97Å |
| 74 | E | 74.8 | Confident | 68.1 | Low | 125 Ų | 125 | 93.4 Ų | 93.4 | 58% | 0.584 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.1 | -40.6 | 179.3 | -147.1 | 66.5 | -148.2 | 0 | 0 | 112.7 | T72 S78 | T72-E74 PolarHBondContact O-N 3.05Å; T72-E74 VanDerWaalsContact O-N 3.12Å; E74-S78 VanDerWaalsContact O-CB 3.23Å; E74-S78 WeakPolarHBondContact O-CB 3.35Å; E74-S78 PolarHBondContact O-N 3.06Å; E74-S78 PolarHBondContact O-OG 3.06Å |
| 75 | A | 71.8 | Confident | 66.5 | Low | 40 Ų | 40 | 91.6 Ų | 91.6 | 33% | 0.331 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -71.4 | -42.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | D71 T72 S78 R79 | D71-A75 VanDerWaalsContact OD1-CB 3.25Å; D71-A75 WeakPolarHBondContact OD1-CB 3.26Å; T72-A75 PolarHBondContact O-N 2.69Å; T72-A75 PolarHBondContact OG1-N 3.15Å; A75-S78 PolarHBondContact O-N 3.18Å; A75-R79 WeakPolarHBondContact O-CB 3.35Å; A75-R79 PolarHBondContact O-N 3.42Å |
| 76 | W | 77.7 | Confident | 64.9 | Low | 33 Ų | 33 | 88.6 Ų | 88.6 | 13% | 0.125 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -58.7 | -47.2 | 171.3 | 173.6 | 99 | 0 | 0 | 0 | 111.7 | I60 S61 F63 T72 F73 R79 K80 | I60-W76 HydrophobicContact CG2-CH2 4.03Å; I60-W76 HydrophobicContact CG2-CZ2 3.82Å; S61-W76 VanDerWaalsContact O-CZ2 3.26Å; S61-W76 WeakPolarHBondContact O-CZ2 3.28Å; S61-W76 PolarHBondContact O-NE1 2.91Å; F63-W76 HydrophobicContact CB-CD2 4.17Å; F63-W76 HydrophobicContact CB-CG 4.5Å; F63-W76 HydrophobicContact CB-CZ2 4.37Å; F63-W76 HydrophobicContact CD2-CB 3.8Å; F63-W76 AromaticContact CD2-CD1 3.97Å; F63-W76 HydrophobicContact CD2-CD2 4.13Å; F63-W76 AromaticContact CD2-CG 3.72Å; F63-W76 HydrophobicContact CD2-CG 3.72Å; F63-W76 HydrophobicContact CE2-CB 4.13Å; T72-W76 PolarHBondContact O-N 3.46Å; F73-W76 HydrophobicContact CD2-CE3 4.21Å; F73-W76 AromaticContact CE2-CE3 4Å; F73-W76 HydrophobicContact CE2-CE3 4Å; F73-W76 AromaticContact CE2-CZ3 3.87Å; F73-W76 HydrophobicContact CE2-CZ3 3.87Å; F73-W76 HydrophobicContact CZ-CZ3 4.34Å; F73-W76 PolarHBondContact O-N 3.11Å; W76-R79 WeakPolarHBondContact O-CB 3.33Å; W76-R79 PolarHBondContact O-N 3.07Å; W76-K80 HydrophobicContact CD2-CG 4.44Å; W76-K80 HydrophobicContact CZ2-CG 4.16Å; W76-K80 PolarHBondContact O-N 3.27Å |
| 77 | F | 67.6 | Low | 63.6 | Low | 90 Ų | 90 | 93.8 Ų | 93.8 | 40% | 0.395 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.9 | -43 | 179.4 | -178 | -104.9 | 0 | 0 | 0 | 111.1 | F73 R79 K80 K81 | F73-F77 HydrophobicContact CE1-CB 4.39Å; F73-F77 WeakPolarHBondContact O-CB 3.41Å; F73-F77 PolarHBondContact O-N 2.97Å; F77-R79 VanDerWaalsContact C-N 3.34Å; F77-R79 PolarHBondContact O-N 2.97Å; F77-K80 PolarHBondContact O-N 2.75Å; F77-K81 HydrophobicContact CD1-CD 4.45Å; F77-K81 HydrophobicContact CE1-CD 3.87Å; F77-K81 HydrophobicContact CZ-CD 4.46Å; F77-K81 WeakPolarHBondContact O-CB 3.33Å; F77-K81 PolarHBondContact O-N 2.99Å |
| 78 | S | 75.1 | Confident | 61.9 | Low | 55 Ų | 55 | 94 Ų | 94 | 39% | 0.385 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.4 | -40.9 | 175.3 | -66.5 | 0 | 0 | 0 | 0 | 112.3 | E74 A75 K81 T82 | E74-S78 VanDerWaalsContact O-CB 3.23Å; E74-S78 WeakPolarHBondContact O-CB 3.35Å; E74-S78 PolarHBondContact O-N 3.06Å; E74-S78 PolarHBondContact O-OG 3.06Å; A75-S78 PolarHBondContact O-N 3.18Å; S78-K81 PolarHBondContact O-N 3.41Å; S78-T82 WeakPolarHBondContact O-CB 3.35Å; S78-T82 VanDerWaalsContact O-CG2 3.27Å; S78-T82 WeakPolarHBondContact O-CG2 3.28Å; S78-T82 PolarHBondContact O-N 3.1Å; S78-T82 PolarHBondContact O-OG1 3.34Å |
| 79 | R | 69.7 | Low | 59.4 | Low | 120 Ų | 120 | 94.1 Ų | 94.1 | 45% | 0.453 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 175.2 | -177.9 | 171.5 | 62 | -113.2 | 11.3 | 111.9 | D71 A75 W76 F77 T82 S83 | D71-R79 IonicContact OD1-NH1 2.97Å; D71-R79 IonicContact OD2-CZ 3.64Å; D71-R79 IonicContact OD2-NH1 3.04Å; D71-R79 PolarHBondContact OD2-NH1 2.67Å; D71-R79 VanDerWaalsContact OD2-NH1 3.15Å; D71-R79 IonicContact OD2-NH2 2.67Å; D71-R79 PolarHBondContact OD2-NH2 2.85Å; A75-R79 WeakPolarHBondContact O-CB 3.35Å; A75-R79 PolarHBondContact O-N 3.42Å; W76-R79 WeakPolarHBondContact O-CB 3.33Å; W76-R79 PolarHBondContact O-N 3.07Å; F77-R79 VanDerWaalsContact C-N 3.34Å; F77-R79 PolarHBondContact O-N 2.97Å; R79-T82 PolarHBondContact O-OG1 3.13Å; R79-S83 PolarHBondContact O-N 2.86Å; R79-S83 VanDerWaalsContact O-N 3.09Å |
| 80 | K | 65.1 | Low | 57.8 | Low | 47 Ų | 47 | 93.8 Ų | 93.8 | 20% | 0.204 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -69.3 | -38.2 | 175.3 | -70.7 | -66.3 | -173.5 | -176.6 | 0 | 112.1 | S59 S61 W76 F77 S83 L86 | S59-K80 PolarHBondContact O-NZ 3.34Å; S59-K80 VanDerWaalsContact O-NZ 3.12Å; S61-K80 WeakPolarHBondContact OG-CE 3.48Å; S61-K80 PolarHBondContact OG-NZ 3.03Å; W76-K80 HydrophobicContact CD2-CG 4.44Å; W76-K80 HydrophobicContact CZ2-CG 4.16Å; W76-K80 PolarHBondContact O-N 3.27Å; F77-K80 PolarHBondContact O-N 2.75Å; K80-S83 PolarHBondContact O-N 2.88Å; K80-L86 VanDerWaalsContact O-CD1 3.23Å; K80-L86 WeakPolarHBondContact O-CD1 3.43Å |
| 81 | K | 59.5 | Low | 56.1 | Low | 146 Ų | 146 | 88.2 Ų | 88.2 | 64% | 0.635 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -65.6 | -36.7 | 177.2 | -175.3 | 169.3 | -176.3 | 164.4 | 0 | 112.8 | F77 S78 | F77-K81 HydrophobicContact CD1-CD 4.45Å; F77-K81 HydrophobicContact CE1-CD 3.87Å; F77-K81 HydrophobicContact CZ-CD 4.46Å; F77-K81 WeakPolarHBondContact O-CB 3.33Å; F77-K81 PolarHBondContact O-N 2.99Å; S78-K81 PolarHBondContact O-N 3.41Å |
| 82 | T | 54.5 | Low | 54.2 | Low | 112 Ų | 112 | 90.4 Ų | 90.4 | 69% | 0.687 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -84.1 | -20.4 | 178.7 | 53.1 | 0 | 0 | 0 | 0 | 113.4 | S78 R79 S84 | S78-T82 WeakPolarHBondContact O-CB 3.35Å; S78-T82 VanDerWaalsContact O-CG2 3.27Å; S78-T82 WeakPolarHBondContact O-CG2 3.28Å; S78-T82 PolarHBondContact O-N 3.1Å; S78-T82 PolarHBondContact O-OG1 3.34Å; R79-T82 PolarHBondContact O-OG1 3.13Å; T82-S84 PolarHBondContact O-N 3.43Å |
| 83 | S | 45.9 | Very low | 52 | Low | 55 Ų | 55 | 93.7 Ų | 93.7 | 39% | 0.385 | 49% | 0.491 | S | S | . | . | S | Bend | trans | -60.9 | 107.3 | 167.4 | -175.1 | 0 | 0 | 0 | 0 | 109.1 | R79 K80 T85 L86 | R79-S83 PolarHBondContact O-N 2.86Å; R79-S83 VanDerWaalsContact O-N 3.09Å; K80-S83 PolarHBondContact O-N 2.88Å; S83-T85 PolarHBondContact O-N 3.21Å; S83-T85 PolarHBondContact OG-OG1 2.68Å; S83-L86 PolarHBondContact O-N 2.97Å |
| 84 | S | 44.8 | Very low | 50.4 | Low | 91 Ų | 91 | 94.5 Ų | 94.5 | 64% | 0.636 | 50% | 0.497 | S | S | * | . | G | 310 helix | trans | -54 | -4.1 | -178.4 | 41.1 | 0 | 0 | 0 | 0 | 115.3 | T82 K87 | T82-S84 PolarHBondContact O-N 3.43Å; S84-K87 WeakPolarHBondContact O-CG 3.5Å |
| 85 | T | 36.5 | Very low | 48.5 | Very low | 110 Ų | 110 | 95.7 Ų | 95.7 | 68% | 0.675 | 50% | 0.502 | S | S | * | . | G | 310 helix | trans | -78.6 | -12 | 178.5 | -33.2 | 0 | 0 | 0 | 0 | 113.6 | S83 K87 | S83-T85 PolarHBondContact O-N 3.21Å; S83-T85 PolarHBondContact OG-OG1 2.68Å; T85-K87 VanDerWaalsContact C-N 3.28Å; T85-K87 PolarHBondContact O-N 3.1Å |
| 86 | L | 33.7 | Very low | 46.9 | Very low | 82 Ų | 82 | 96.8 Ų | 96.8 | 43% | 0.429 | 51% | 0.511 | S | S | . | . | G | 310 helix | trans | -84.3 | 6.1 | 173.2 | -72.9 | 178.2 | 0 | 0 | 0 | 114.4 | K80 S83 | K80-L86 VanDerWaalsContact O-CD1 3.23Å; K80-L86 WeakPolarHBondContact O-CD1 3.43Å; S83-L86 PolarHBondContact O-N 2.97Å |
| 87 | K | 42.5 | Very low | 45 | Very low | 179 Ų | 179 | 97.7 Ų | 97.7 | 78% | 0.778 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.6 | -29.1 | -170.1 | -79.1 | -164.2 | 173.9 | -173.3 | 0 | 117 | S84 T85 | S84-K87 WeakPolarHBondContact O-CG 3.5Å; T85-K87 VanDerWaalsContact C-N 3.28Å; T85-K87 PolarHBondContact O-N 3.1Å |
| 88 | P | 38.6 | Very low | 43.5 | Very low | 102 Ų | 102 | 94.4 Ų | 94.4 | 66% | 0.662 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.8 | 4 | -179.1 | -6.4 | 27.4 | 0 | 0 | 0 | 118.2 | S91 | P88-S91 PolarHBondContact O-OG 3.27Š|
| 89 | R | 30.1 | Very low | 41.5 | Very low | 101 Ų | 101 | 95.8 Ų | 95.8 | 38% | 0.381 | 52% | 0.516 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -125.5 | -1.8 | -176.2 | -128.5 | 177.7 | 91.8 | 108.6 | 8.5 | 117.9 | S91 M92 | R89-S91 PolarHBondContact O-N 2.72Å; R89-M92 HydrophobicContact CG-CB 4.01Å; R89-M92 HydrophobicContact CG-CE 4.2Å; R89-M92 VanDerWaalsContact CZ-SD 3.5Å; R89-M92 PolarHBondContact NH1-SD 3.09Å; R89-M92 PolarHBondContact O-N 3.34Å; R89-M92 VanDerWaalsContact O-N 3.11Å |
| 90 | S | 35.5 | Very low | 40.1 | Very low | 73 Ų | 73 | 93 Ų | 93 | 51% | 0.51 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.1 | -27.1 | 157.9 | 177.5 | 0 | 0 | 0 | 0 | 111.3 | M92 M93 Q94 | S90-M92 VanDerWaalsContact C-N 3.3Å; S90-M92 PolarHBondContact O-N 3.07Å; S90-M93 PolarHBondContact O-N 3.34Å; S90-Q94 WeakPolarHBondContact O-CG 3.44Å; S90-Q94 PolarHBondContact O-N 2.94Å |
| 91 | S | 34.1 | Very low | 38.7 | Very low | 57 Ų | 57 | 92 Ų | 92 | 40% | 0.399 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62 | -27.5 | 172.7 | 59.2 | 0 | 0 | 0 | 0 | 114.9 | P88 R89 H95 | P88-S91 PolarHBondContact O-OG 3.27Å; R89-S91 PolarHBondContact O-N 2.72Å; S91-H95 PolarHBondContact O-N 3.07Å; S91-H95 PolarHBondContact O-ND1 2.97Å |
| 92 | M | 30.6 | Very low | 38.1 | Very low | 96 Ų | 96 | 85.8 Ų | 85.8 | 47% | 0.473 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -81.3 | -33.9 | 175.3 | -169.7 | 174.6 | -59 | 0 | 0 | 111.5 | R89 S90 Q94 H95 A96 | R89-M92 HydrophobicContact CG-CB 4.01Å; R89-M92 HydrophobicContact CG-CE 4.2Å; R89-M92 VanDerWaalsContact CZ-SD 3.5Å; R89-M92 PolarHBondContact NH1-SD 3.09Å; R89-M92 PolarHBondContact O-N 3.34Å; R89-M92 VanDerWaalsContact O-N 3.11Å; S90-M92 VanDerWaalsContact C-N 3.3Å; S90-M92 PolarHBondContact O-N 3.07Å; M92-Q94 VanDerWaalsContact C-N 3.27Å; M92-H95 PolarHBondContact O-N 3.11Å; M92-A96 PolarHBondContact O-N 3.37Å |
| 93 | M | 31.5 | Very low | 37.8 | Very low | 144 Ų | 144 | 81.8 Ų | 81.8 | 71% | 0.709 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -67.8 | -33.3 | 170 | -158.2 | 169.8 | -87.2 | 0 | 0 | 110.1 | S90 A96 F97 | S90-M93 PolarHBondContact O-N 3.34Å; M93-A96 PolarHBondContact O-N 3.18Å; M93-F97 VanDerWaalsContact O-CB 3.3Å; M93-F97 WeakPolarHBondContact O-CB 3.25Å; M93-F97 PolarHBondContact O-N 3.01Å |
| 94 | Q | 38.9 | Very low | 37.7 | Very low | 127 Ų | 127 | 83.7 Ų | 83.7 | 59% | 0.593 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -68 | -31.1 | 168.3 | -74 | 171.3 | -14.6 | 0 | 0 | 113.8 | S90 M92 F97 G98 | S90-Q94 WeakPolarHBondContact O-CG 3.44Å; S90-Q94 PolarHBondContact O-N 2.94Å; M92-Q94 VanDerWaalsContact C-N 3.27Å; Q94-F97 PolarHBondContact O-N 3.2Å; Q94-G98 PolarHBondContact O-N 2.95Å |
| 95 | H | 34.2 | Very low | 37.8 | Very low | 150 Ų | 150 | 81.1 Ų | 81.1 | 69% | 0.694 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -70.8 | -42.2 | 169.2 | -97.1 | 85.4 | 0 | 0 | 0 | 112.2 | S91 M92 F97 G98 C99 | S91-H95 PolarHBondContact O-N 3.07Å; S91-H95 PolarHBondContact O-ND1 2.97Å; M92-H95 PolarHBondContact O-N 3.11Å; H95-F97 PolarHBondContact O-N 2.99Å; H95-G98 PolarHBondContact O-N 3.4Å; H95-C99 PolarHBondContact O-N 2.99Å |
| 96 | A | 39 | Very low | 38.2 | Very low | 63 Ų | 63 | 82.2 Ų | 82.2 | 52% | 0.521 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.5 | -32.4 | 172 | 0 | 0 | 0 | 0 | 0 | 111.4 | M92 M93 C100 | M92-A96 PolarHBondContact O-N 3.37Å; M93-A96 PolarHBondContact O-N 3.18Å; A96-C100 PolarHBondContact O-N 2.88Å; A96-C100 PolarHBondContact O-SG 2.8Å |
| 97 | F | 38.6 | Very low | 38.4 | Very low | 52 Ų | 52 | 78.9 Ų | 78.9 | 23% | 0.228 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -75.4 | -33.9 | 173.2 | -131.4 | -81.4 | 0 | 0 | 0 | 113.9 | M93 Q94 H95 C99 C100 Y101 F145 I149 | M93-F97 VanDerWaalsContact O-CB 3.3Å; M93-F97 WeakPolarHBondContact O-CB 3.25Å; M93-F97 PolarHBondContact O-N 3.01Å; Q94-F97 PolarHBondContact O-N 3.2Å; H95-F97 PolarHBondContact O-N 2.99Å; F97-C99 VanDerWaalsContact C-N 3.25Å; F97-C99 PolarHBondContact O-N 3.13Å; F97-C100 CarbonylContact O-C 3.1Å; F97-C100 WeakPolarHBondContact O-CA 3.34Å; F97-C100 PolarHBondContact O-N 3.25Å; F97-Y101 HydrophobicContact CE1-CD2 4.04Å; F97-Y101 HydrophobicContact CE1-CG 4.34Å; F97-Y101 PolarHBondContact O-N 2.81Å; F97-F145 AromaticContact CD1-CE2 3.62Å; F97-F145 HydrophobicContact CD1-CE2 3.62Å; F97-F145 AromaticContact CD1-CZ 3.78Å; F97-F145 HydrophobicContact CD1-CZ 3.78Å; F97-F145 HydrophobicContact CD2-CZ 4.12Å; F97-F145 AromaticContact CE1-CD2 3.79Å; F97-F145 HydrophobicContact CE1-CD2 3.79Å; F97-F145 AromaticContact CE1-CE1 3.99Å; F97-F145 HydrophobicContact CE1-CE1 3.99Å; F97-F145 AromaticContact CE1-CE2 2.9Å; F97-F145 HydrophobicContact CE1-CE2 2.9Å; F97-F145 AromaticContact CE1-CZ 3.06Å; F97-F145 HydrophobicContact CE1-CZ 3.06Å; F97-F145 AromaticContact CE2-CE1 3.88Å; F97-F145 HydrophobicContact CE2-CE1 3.88Å; F97-F145 HydrophobicContact CE2-CE2 4.19Å; F97-F145 AromaticContact CE2-CZ 3.42Å; F97-F145 HydrophobicContact CE2-CZ 3.42Å; F97-F145 VanDerWaalsContact CE2-CZ 3.42Å; F97-F145 HydrophobicContact CG-CZ 4.26Å; F97-F145 HydrophobicContact CZ-CD1 4.2Å; F97-F145 HydrophobicContact CZ-CD2 4.08Å; F97-F145 AromaticContact CZ-CE1 3.34Å; F97-F145 HydrophobicContact CZ-CE1 3.34Å; F97-F145 AromaticContact CZ-CE2 3.23Å; F97-F145 HydrophobicContact CZ-CE2 3.23Å; F97-F145 AromaticContact CZ-CZ 2.81Å; F97-F145 HydrophobicContact CZ-CZ 2.81Å; F97-I149 HydrophobicContact CE1-CD1 3.94Å; F97-I149 HydrophobicContact CE2-CD1 3.59Å; F97-I149 HydrophobicContact CE2-CG1 4.26Å; F97-I149 HydrophobicContact CZ-CD1 3.09Å; F97-I149 HydrophobicContact CZ-CG1 3.59Å |
| 98 | G | 35.6 | Very low | 38.3 | Very low | 20 Ų | 20 | 73.2 Ų | 73.2 | 21% | 0.206 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -63 | -30.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q94 H95 V128 | Q94-G98 PolarHBondContact O-N 2.95Å; H95-G98 PolarHBondContact O-N 3.4Å; G98-V128 WeakPolarHBondContact O-CG1 3.31Å |
| 99 | C | 33.4 | Very low | 38.7 | Very low | 85 Ų | 85 | 72.4 Ų | 72.4 | 57% | 0.574 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -19.9 | 166.5 | -72.6 | 0 | 0 | 0 | 0 | 113.9 | H95 F97 | H95-C99 PolarHBondContact O-N 2.99Å; F97-C99 VanDerWaalsContact C-N 3.25Å; F97-C99 PolarHBondContact O-N 3.13Å |
| 100 | C | 38.7 | Very low | 39.1 | Very low | 62 Ų | 62 | 76.7 Ų | 76.7 | 42% | 0.419 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.9 | -2.1 | -172.1 | -78.1 | 0 | 0 | 0 | 0 | 115.9 | A96 F97 C152 | A96-C100 PolarHBondContact O-N 2.88Å; A96-C100 PolarHBondContact O-SG 2.8Å; F97-C100 CarbonylContact O-C 3.1Å; F97-C100 WeakPolarHBondContact O-CA 3.34Å; F97-C100 PolarHBondContact O-N 3.25Å; C100-C152 PolarHBondContact O-SG 3.4Å |
| 101 | Y | 37.3 | Very low | 39.3 | Very low | 26 Ų | 26 | 75.2 Ų | 75.2 | 10% | 0.102 | 40% | 0.401 | C | S | . | . | S | Bend | trans | -122 | -61.2 | -175.4 | -165 | -94.6 | 0 | 0 | 0 | 117 | F97 S103 F135 L137 L140 F145 L148 | F97-Y101 HydrophobicContact CE1-CD2 4.04Å; F97-Y101 HydrophobicContact CE1-CG 4.34Å; F97-Y101 PolarHBondContact O-N 2.81Å; Y101-S103 PolarHBondContact O-N 3.21Å; Y101-S103 VanDerWaalsContact O-N 3.1Å; Y101-F135 HydrophobicContact CE1-CD1 4.12Å; Y101-F135 AromaticContact CE1-CE1 3.54Å; Y101-F135 HydrophobicContact CE1-CE1 3.54Å; Y101-F135 AromaticContact CE1-CZ 3.77Å; Y101-F135 HydrophobicContact CE1-CZ 3.77Å; Y101-L137 HydrophobicContact CD1-CD2 4.29Å; Y101-L137 HydrophobicContact CE1-CD2 4.12Å; Y101-L140 HydrophobicContact CE1-CD2 3.9Å; Y101-L140 HydrophobicContact CE2-CD2 3.75Å; Y101-L140 WeakPolarHBondContact OH-CD1 3.27Å; Y101-L140 WeakPolarHBondContact OH-CD2 3.32Å; Y101-L140 WeakPolarHBondContact OH-CG 3.49Å; Y101-F145 HydrophobicContact CD2-CD2 4.17Å; Y101-F145 HydrophobicContact CE2-CD2 4.01Å; Y101-L148 HydrophobicContact CD2-CB 4.1Å; Y101-L148 HydrophobicContact CD2-CD1 4.23Å; Y101-L148 HydrophobicContact CE1-CD1 4.47Å; Y101-L148 HydrophobicContact CE2-CB 3.6Å; Y101-L148 HydrophobicContact CE2-CD1 3.12Å; Y101-L148 HydrophobicContact CE2-CG 3.91Å; Y101-L148 WeakPolarHBondContact OH-CD1 3.27Å |
| 102 | A | 45.4 | Very low | 39.5 | Very low | 15 Ų | 15 | 77.2 Ų | 77.2 | 12% | 0.124 | 41% | 0.406 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | 18.1 | -137.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | F132 | A102-F132 HydrophobicContact CB-CD2 4.31Š|
| 103 | S | 48.3 | Very low | 39.9 | Very low | 27 Ų | 27 | 81.6 Ų | 81.6 | 19% | 0.189 | 42% | 0.423 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -142.7 | -5.6 | 178 | 72.9 | 0 | 0 | 0 | 0 | 113.9 | Y101 G105 Q106 M107 | Y101-S103 PolarHBondContact O-N 3.21Å; Y101-S103 VanDerWaalsContact O-N 3.1Å; S103-G105 VanDerWaalsContact C-N 3.26Å; S103-G105 PolarHBondContact O-N 3.21Å; S103-Q106 PolarHBondContact O-N 3.34Å; S103-M107 VanDerWaalsContact C-CB 3.44Å; S103-M107 WeakPolarHBondContact CB-SD 3.22Å; S103-M107 WeakPolarHBondContact O-CA 3.07Å; S103-M107 WeakPolarHBondContact O-CB 3.41Å; S103-M107 PolarHBondContact O-N 3.15Å; S103-M107 WeakPolarHBondContact OG-CB 3.39Å; S103-M107 WeakPolarHBondContact OG-CE 2.92Å; S103-M107 VanDerWaalsContact OG-CG 3.26Å; S103-M107 WeakPolarHBondContact OG-CG 3.46Å; S103-M107 PolarHBondContact OG-SD 2.92Å |
| 104 | Y | 45.1 | Very low | 40.2 | Very low | 95 Ų | 95 | 76.7 Ų | 76.7 | 37% | 0.373 | 41% | 0.406 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.1 | -5.3 | -160.8 | -143.6 | -95.7 | 0 | 0 | 0 | 117.8 | Y108 L167 | Y104-Y108 AromaticContact CD1-CD2 3.82Å; Y104-Y108 HydrophobicContact CD1-CD2 3.82Å; Y104-Y108 HydrophobicContact CD1-CE2 4.49Å; Y104-Y108 HydrophobicContact CD1-CG 4.12Å; Y104-Y108 HydrophobicContact CD2-CD2 4.25Å; Y104-Y108 AromaticContact CE1-CD2 3.28Å; Y104-Y108 HydrophobicContact CE1-CD2 3.28Å; Y104-Y108 AromaticContact CE1-CE2 3.55Å; Y104-Y108 HydrophobicContact CE1-CE2 3.55Å; Y104-Y108 AromaticContact CE1-CG 3.95Å; Y104-Y108 HydrophobicContact CE1-CG 3.95Å; Y104-Y108 AromaticContact CE2-CD2 3.78Å; Y104-Y108 HydrophobicContact CE2-CD2 3.78Å; Y104-Y108 HydrophobicContact CE2-CE2 4.24Å; Y104-Y108 HydrophobicContact CG-CD2 4.28Å; Y104-Y108 AromaticContact CZ-CD2 3.28Å; Y104-Y108 AromaticContact CZ-CE2 3.42Å; Y104-Y108 VanDerWaalsContact CZ-CE2 3.42Å; Y104-Y108 WeakPolarHBondContact O-CB 3.37Å; Y104-Y108 WeakPolarHBondContact OH-CE2 3.35Å; Y104-L167 HydrophobicContact CD1-CD1 4.37Å |
| 105 | G | 45.6 | Very low | 40.5 | Very low | 37 Ų | 37 | 73.6 Ų | 73.6 | 38% | 0.381 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86 | -70.8 | 168 | 0 | 0 | 0 | 0 | 0 | 111.4 | S103 T109 | S103-G105 VanDerWaalsContact C-N 3.26Å; S103-G105 PolarHBondContact O-N 3.21Å; G105-T109 PolarHBondContact O-N 2.96Å; G105-T109 PolarHBondContact O-OG1 3.45Å; G105-T109 VanDerWaalsContact O-OG1 3.13Å |
| 106 | Q | 44.9 | Very low | 41.1 | Very low | 133 Ų | 133 | 73.5 Ų | 73.5 | 62% | 0.621 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -76.2 | -25.3 | -178.8 | -66.2 | -164.3 | 13.7 | 0 | 0 | 113.5 | S103 T109 R110 | S103-Q106 PolarHBondContact O-N 3.34Å; Q106-T109 PolarHBondContact O-OG1 2.99Å; Q106-T109 VanDerWaalsContact O-OG1 3.08Å; Q106-R110 VanDerWaalsContact O-CB 3.26Å; Q106-R110 WeakPolarHBondContact O-CB 2.79Å; Q106-R110 WeakPolarHBondContact O-CG 3.07Å; Q106-R110 PolarHBondContact O-N 3.36Å |
| 107 | M | 39.3 | Very low | 41.6 | Very low | 13 Ų | 13 | 77.1 Ų | 77.1 | 6% | 0.064 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -88.8 | -31.1 | 172 | -159.7 | 148.5 | 125.9 | 0 | 0 | 111.5 | S103 T109 R110 T111 Y124 I127 V128 E131 | S103-M107 VanDerWaalsContact C-CB 3.44Å; S103-M107 WeakPolarHBondContact CB-SD 3.22Å; S103-M107 WeakPolarHBondContact O-CA 3.07Å; S103-M107 WeakPolarHBondContact O-CB 3.41Å; S103-M107 PolarHBondContact O-N 3.15Å; S103-M107 WeakPolarHBondContact OG-CB 3.39Å; S103-M107 WeakPolarHBondContact OG-CE 2.92Å; S103-M107 VanDerWaalsContact OG-CG 3.26Å; S103-M107 WeakPolarHBondContact OG-CG 3.46Å; S103-M107 PolarHBondContact OG-SD 2.92Å; M107-T109 PolarHBondContact O-N 3.37Å; M107-R110 CarbonylContact O-C 3.45Å; M107-R110 PolarHBondContact O-N 2.93Å; M107-R110 VanDerWaalsContact O-N 3.15Å; M107-T111 HydrophobicContact CE-CG2 4.09Å; M107-T111 HydrophobicContact CG-CG2 3.24Å; M107-T111 VanDerWaalsContact CG-OG1 3.28Å; M107-T111 WeakPolarHBondContact CG-OG1 3.34Å; M107-T111 WeakPolarHBondContact O-CA 2.97Å; M107-T111 WeakPolarHBondContact O-CB 3.4Å; M107-T111 PolarHBondContact O-N 3.42Å; M107-T111 PolarHBondContact O-OG1 3.21Å; M107-T111 HydrophobicContact SD-CG2 4.01Å; M107-Y124 HydrophobicContact CE-CE2 4.18Å; M107-I127 HydrophobicContact CE-CB 4.36Å; M107-I127 HydrophobicContact CE-CG2 3.5Å; M107-I127 HydrophobicContact SD-CG2 3.41Å; M107-I127 WeakPolarHBondContact SD-CG2 2.8Å; M107-V128 HydrophobicContact CE-CG2 4.12Å; M107-E131 HydrophobicContact SD-CG 4.18Å |
| 108 | Y | 40.8 | Very low | 42.4 | Very low | 59 Ų | 59 | 82 Ų | 82 | 23% | 0.231 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -59.6 | -37.4 | 169.1 | -170.9 | -100.6 | 0 | 0 | 0 | 111.2 | Y104 N112 R163 | Y104-Y108 AromaticContact CD1-CD2 3.82Å; Y104-Y108 HydrophobicContact CD1-CD2 3.82Å; Y104-Y108 HydrophobicContact CD1-CE2 4.49Å; Y104-Y108 HydrophobicContact CD1-CG 4.12Å; Y104-Y108 HydrophobicContact CD2-CD2 4.25Å; Y104-Y108 AromaticContact CE1-CD2 3.28Å; Y104-Y108 HydrophobicContact CE1-CD2 3.28Å; Y104-Y108 AromaticContact CE1-CE2 3.55Å; Y104-Y108 HydrophobicContact CE1-CE2 3.55Å; Y104-Y108 AromaticContact CE1-CG 3.95Å; Y104-Y108 HydrophobicContact CE1-CG 3.95Å; Y104-Y108 AromaticContact CE2-CD2 3.78Å; Y104-Y108 HydrophobicContact CE2-CD2 3.78Å; Y104-Y108 HydrophobicContact CE2-CE2 4.24Å; Y104-Y108 HydrophobicContact CG-CD2 4.28Å; Y104-Y108 AromaticContact CZ-CD2 3.28Å; Y104-Y108 AromaticContact CZ-CE2 3.42Å; Y104-Y108 VanDerWaalsContact CZ-CE2 3.42Å; Y104-Y108 WeakPolarHBondContact O-CB 3.37Å; Y104-Y108 WeakPolarHBondContact OH-CE2 3.35Å; Y108-N112 WeakPolarHBondContact CE1-ND2 3.49Å; Y108-N112 WeakPolarHBondContact CE2-ND2 3.39Å; Y108-N112 WeakPolarHBondContact O-CB 3.25Å; Y108-N112 PolarHBondContact O-N 2.92Å; Y108-N112 PolarHBondContact OH-ND2 3.45Å; Y108-R163 PolarHBondContact OH-NH2 3.14Å |
| 109 | T | 45.7 | Very low | 43.5 | Very low | 86 Ų | 86 | 85.3 Ų | 85.3 | 53% | 0.528 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -72.7 | -39.2 | 172.2 | 50.5 | 0 | 0 | 0 | 0 | 113.6 | G105 Q106 M107 | G105-T109 PolarHBondContact O-N 2.96Å; G105-T109 PolarHBondContact O-OG1 3.45Å; G105-T109 VanDerWaalsContact O-OG1 3.13Å; Q106-T109 PolarHBondContact O-OG1 2.99Å; Q106-T109 VanDerWaalsContact O-OG1 3.08Å; M107-T109 PolarHBondContact O-N 3.37Å |
| 110 | R | 39.1 | Very low | 45.4 | Very low | 190 Ų | 190 | 85.9 Ų | 85.9 | 72% | 0.717 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -78.6 | -41.1 | 177.8 | -84 | 178.2 | 163.5 | 154.9 | -1.4 | 115 | Q106 M107 A114 | Q106-R110 VanDerWaalsContact O-CB 3.26Å; Q106-R110 WeakPolarHBondContact O-CB 2.79Å; Q106-R110 WeakPolarHBondContact O-CG 3.07Å; Q106-R110 PolarHBondContact O-N 3.36Å; M107-R110 CarbonylContact O-C 3.45Å; M107-R110 PolarHBondContact O-N 2.93Å; M107-R110 VanDerWaalsContact O-N 3.15Å; R110-A114 PolarHBondContact O-N 3.47Å |
| 111 | T | 38.5 | Very low | 47 | Very low | 43 Ų | 43 | 92.5 Ų | 92.5 | 26% | 0.264 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -90.6 | -20.1 | 178.4 | 60.7 | 0 | 0 | 0 | 0 | 115.4 | M107 K113 A114 | M107-T111 HydrophobicContact CE-CG2 4.09Å; M107-T111 HydrophobicContact CG-CG2 3.24Å; M107-T111 VanDerWaalsContact CG-OG1 3.28Å; M107-T111 WeakPolarHBondContact CG-OG1 3.34Å; M107-T111 WeakPolarHBondContact O-CA 2.97Å; M107-T111 WeakPolarHBondContact O-CB 3.4Å; M107-T111 PolarHBondContact O-N 3.42Å; M107-T111 PolarHBondContact O-OG1 3.21Å; M107-T111 HydrophobicContact SD-CG2 4.01Å; T111-K113 PolarHBondContact O-N 3.2Å; T111-A114 CarbonylContact O-C 3.56Å; T111-A114 WeakPolarHBondContact O-CA 3.44Å; T111-A114 PolarHBondContact O-N 3.32Å; T111-A114 VanDerWaalsContact O-N 3.1Å |
| 112 | N | 39.3 | Very low | 48.8 | Very low | 98 Ų | 98 | 97.5 Ų | 97.5 | 52% | 0.524 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -22.6 | 162.8 | -86 | -11.7 | 0 | 0 | 0 | 111.7 | Y108 | Y108-N112 WeakPolarHBondContact CE1-ND2 3.49Å; Y108-N112 WeakPolarHBondContact CE2-ND2 3.39Å; Y108-N112 WeakPolarHBondContact O-CB 3.25Å; Y108-N112 PolarHBondContact O-N 2.92Å; Y108-N112 PolarHBondContact OH-ND2 3.45Å |
| 113 | K | 39.3 | Very low | 50.3 | Low | 188 Ų | 188 | 99.9 Ų | 99.9 | 82% | 0.817 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.4 | -28.6 | 169.4 | -130.3 | 179 | -174.8 | -179.5 | 0 | 112.2 | T111 S115 | T111-K113 PolarHBondContact O-N 3.2Å; K113-S115 PolarHBondContact O-N 3.05Å |
| 114 | A | 38 | Very low | 51.1 | Low | 42 Ų | 42 | 103 Ų | 103 | 35% | 0.347 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -77.8 | 72.8 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108.5 | R110 T111 L116 | R110-A114 PolarHBondContact O-N 3.47Å; T111-A114 CarbonylContact O-C 3.56Å; T111-A114 WeakPolarHBondContact O-CA 3.44Å; T111-A114 PolarHBondContact O-N 3.32Å; T111-A114 VanDerWaalsContact O-N 3.1Å; A114-L116 PolarHBondContact O-N 3.2Å; A114-L116 VanDerWaalsContact O-N 3.07Å |
| 115 | S | 43.6 | Very low | 52.5 | Low | 61 Ų | 61 | 100.1 Ų | 100.1 | 43% | 0.427 | 52% | 0.517 | S | S | . | . | trans | -33.3 | 123.7 | 155.2 | -176 | 0 | 0 | 0 | 0 | 108.4 | K113 N117 | K113-S115 PolarHBondContact O-N 3.05Å; S115-N117 PolarHBondContact O-N 3.24Å; S115-N117 WeakPolarHBondContact OG-CB 3.35Å; S115-N117 PolarHBondContact OG-ND2 3.25Å; S115-N117 PolarHBondContact OG-OD1 3.45Å | ||
| 116 | L | 47 | Very low | 53.7 | Low | 148 Ų | 148 | 100.4 Ų | 100.4 | 78% | 0.775 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -57.4 | 18.7 | 169.4 | -101.4 | 148.7 | 0 | 0 | 0 | 112.9 | A114 N118 | A114-L116 PolarHBondContact O-N 3.2Å; A114-L116 VanDerWaalsContact O-N 3.07Å; L116-N118 PolarHBondContact O-N 2.89Å |
| 117 | N | 49.4 | Very low | 54.9 | Low | 139 Ų | 139 | 96.9 Ų | 96.9 | 74% | 0.743 | 51% | 0.505 | S | S | * | . | S | Bend | trans | -76.5 | 77.8 | 164.1 | -65.2 | -5.6 | 0 | 0 | 0 | 108.2 | S115 | S115-N117 PolarHBondContact O-N 3.24Å; S115-N117 WeakPolarHBondContact OG-CB 3.35Å; S115-N117 PolarHBondContact OG-ND2 3.25Å; S115-N117 PolarHBondContact OG-OD1 3.45Å |
| 118 | N | 56.8 | Low | 56.1 | Low | 156 Ų | 156 | 97.3 Ų | 97.3 | 83% | 0.834 | 51% | 0.508 | S | S | * | . | S | Bend | trans | 114.4 | 6.3 | 153.5 | -147.2 | 30.7 | 0 | 0 | 0 | 119.2 | L116 | L116-N118 PolarHBondContact O-N 2.89Š|
| 119 | D | 57.6 | Low | 57.6 | Low | 89 Ų | 89 | 98.8 Ų | 98.8 | 48% | 0.476 | 52% | 0.52 | S | S | . | . | trans | -91.4 | 121.9 | 170.3 | -72.3 | -32.4 | 0 | 0 | 0 | 111.1 | T123 | D119-T123 HydrophobicContact CB-CG2 4.45Š| ||
| 120 | D | 73.8 | Confident | 58.7 | Low | 97 Ų | 97 | 101.5 Ų | 101.5 | 52% | 0.519 | 52% | 0.52 | S | S | . | . | trans | -67.1 | 154.3 | 177 | -176.7 | 22.1 | 0 | 0 | 0 | 111.8 | I122 T123 Y124 | D120-I122 PolarHBondContact O-N 3.47Å; D120-I122 WeakPolarHBondContact OD2-CG1 3.5Å; D120-T123 WeakPolarHBondContact O-CB 3.31Å; D120-T123 PolarHBondContact O-N 3.08Å; D120-Y124 PolarHBondContact O-N 3.43Å; D120-Y124 VanDerWaalsContact O-N 3.16Å | ||
| 121 | Y | 73.1 | Confident | 59.7 | Low | 200 Ų | 200 | 95.1 Ų | 95.1 | 78% | 0.784 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -51.7 | -28.9 | 176.6 | -70.3 | -73.2 | 0 | 0 | 0 | 112.8 | G125 | Y121-G125 PolarHBondContact O-N 3.38Å |
| 122 | I | 75.3 | Confident | 60.8 | Low | 132 Ų | 132 | 97.3 Ų | 97.3 | 68% | 0.677 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.7 | -48.5 | 173.1 | -59.1 | -61.4 | 0 | 0 | 0 | 111.6 | D120 G125 G126 | D120-I122 PolarHBondContact O-N 3.47Å; D120-I122 WeakPolarHBondContact OD2-CG1 3.5Å; I122-G125 PolarHBondContact O-N 2.88Å; I122-G126 PolarHBondContact O-N 2.82Å |
| 123 | T | 75.4 | Confident | 62 | Low | 65 Ų | 65 | 99.5 Ų | 99.5 | 40% | 0.399 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64 | -46.5 | 178.5 | -58.7 | 0 | 0 | 0 | 0 | 110.4 | D119 D120 G125 G126 I127 | D119-T123 HydrophobicContact CB-CG2 4.45Å; D120-T123 WeakPolarHBondContact O-CB 3.31Å; D120-T123 PolarHBondContact O-N 3.08Å; T123-G125 PolarHBondContact O-N 3.37Å; T123-G126 PolarHBondContact O-N 3.33Å; T123-I127 HydrophobicContact CG2-CD1 4.04Å; T123-I127 WeakPolarHBondContact O-CG1 3.37Å; T123-I127 PolarHBondContact O-N 2.92Å |
| 124 | Y | 65.9 | Low | 63 | Low | 91 Ų | 91 | 97.8 Ų | 97.8 | 36% | 0.357 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -48.8 | 177.7 | -178.9 | -105.3 | 0 | 0 | 0 | 111.7 | M107 D120 G126 I127 V128 | M107-Y124 HydrophobicContact CE-CE2 4.18Å; D120-Y124 PolarHBondContact O-N 3.43Å; D120-Y124 VanDerWaalsContact O-N 3.16Å; Y124-G126 VanDerWaalsContact C-N 3.3Å; Y124-G126 PolarHBondContact O-N 3.1Å; Y124-I127 PolarHBondContact O-N 2.88Å; Y124-V128 HydrophobicContact CD1-CG2 4.22Å; Y124-V128 HydrophobicContact CE1-CG2 3.81Å; Y124-V128 HydrophobicContact CE2-CG2 4.12Å; Y124-V128 WeakPolarHBondContact O-CG2 3.49Å; Y124-V128 PolarHBondContact O-N 2.86Å |
| 125 | G | 73.5 | Confident | 64 | Low | 36 Ų | 36 | 99.5 Ų | 99.5 | 37% | 0.371 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -39.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y121 I122 T123 V128 N129 | Y121-G125 PolarHBondContact O-N 3.38Å; I122-G125 PolarHBondContact O-N 2.88Å; T123-G125 PolarHBondContact O-N 3.37Å; G125-V128 PolarHBondContact O-N 3.27Å; G125-N129 WeakPolarHBondContact O-CB 3.43Å; G125-N129 PolarHBondContact O-N 3.21Å |
| 126 | G | 72.4 | Confident | 64.8 | Low | 43 Ų | 43 | 103.2 Ų | 103.2 | 44% | 0.443 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.4 | -42.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | I122 T123 Y124 R130 | I122-G126 PolarHBondContact O-N 2.82Å; T123-G126 PolarHBondContact O-N 3.33Å; Y124-G126 VanDerWaalsContact C-N 3.3Å; Y124-G126 PolarHBondContact O-N 3.1Å; G126-R130 WeakPolarHBondContact O-CB 3.43Å; G126-R130 PolarHBondContact O-N 3.1Å |
| 127 | I | 69.9 | Low | 65.6 | Low | 59 Ų | 59 | 99 Ų | 99 | 30% | 0.303 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.6 | -46.7 | 176.7 | -64.7 | 166.8 | 0 | 0 | 0 | 110.4 | M107 T123 Y124 N129 R130 E131 | M107-I127 HydrophobicContact CE-CB 4.36Å; M107-I127 HydrophobicContact CE-CG2 3.5Å; M107-I127 HydrophobicContact SD-CG2 3.41Å; M107-I127 WeakPolarHBondContact SD-CG2 2.8Å; T123-I127 HydrophobicContact CG2-CD1 4.04Å; T123-I127 WeakPolarHBondContact O-CG1 3.37Å; T123-I127 PolarHBondContact O-N 2.92Å; Y124-I127 PolarHBondContact O-N 2.88Å; I127-N129 VanDerWaalsContact C-N 3.35Å; I127-N129 PolarHBondContact O-N 3.2Å; I127-R130 PolarHBondContact O-N 3.34Å; I127-E131 HydrophobicContact CG2-CG 4.42Å; I127-E131 PolarHBondContact O-N 3.05Å |
| 128 | V | 63.6 | Low | 66.3 | Low | 21 Ų | 21 | 100.4 Ų | 100.4 | 13% | 0.127 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -58.5 | -47.5 | 178.6 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | G98 M107 Y124 G125 R130 E131 F132 | G98-V128 WeakPolarHBondContact O-CG1 3.31Å; M107-V128 HydrophobicContact CE-CG2 4.12Å; Y124-V128 HydrophobicContact CD1-CG2 4.22Å; Y124-V128 HydrophobicContact CE1-CG2 3.81Å; Y124-V128 HydrophobicContact CE2-CG2 4.12Å; Y124-V128 WeakPolarHBondContact O-CG2 3.49Å; Y124-V128 PolarHBondContact O-N 2.86Å; G125-V128 PolarHBondContact O-N 3.27Å; V128-R130 VanDerWaalsContact C-N 3.32Å; V128-R130 PolarHBondContact O-N 3.11Å; V128-E131 PolarHBondContact O-N 3.42Å; V128-F132 VanDerWaalsContact O-CB 3.25Å; V128-F132 WeakPolarHBondContact O-CB 3.4Å; V128-F132 PolarHBondContact O-N 3.45Å |
| 129 | N | 72.4 | Confident | 67 | Low | 90 Ų | 90 | 97.6 Ų | 97.6 | 48% | 0.481 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.3 | -37.4 | 179.4 | -171.6 | 41.2 | 0 | 0 | 0 | 112.3 | G125 I127 F132 Q133 | G125-N129 WeakPolarHBondContact O-CB 3.43Å; G125-N129 PolarHBondContact O-N 3.21Å; I127-N129 VanDerWaalsContact C-N 3.35Å; I127-N129 PolarHBondContact O-N 3.2Å; N129-F132 PolarHBondContact O-N 3.2Å; N129-Q133 PolarHBondContact ND2-NE2 2.98Å; N129-Q133 WeakPolarHBondContact O-CG 3.48Å; N129-Q133 PolarHBondContact O-N 3.44Å |
| 130 | R | 68.8 | Low | 67.8 | Low | 143 Ų | 143 | 95.1 Ų | 95.1 | 54% | 0.54 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.8 | -46.3 | 175.7 | 179.7 | -175.8 | 175.2 | -175.4 | -0.3 | 112 | G126 I127 V128 F132 Q133 R134 | G126-R130 WeakPolarHBondContact O-CB 3.43Å; G126-R130 PolarHBondContact O-N 3.1Å; I127-R130 PolarHBondContact O-N 3.34Å; V128-R130 VanDerWaalsContact C-N 3.32Å; V128-R130 PolarHBondContact O-N 3.11Å; R130-F132 VanDerWaalsContact C-N 3.33Å; R130-Q133 PolarHBondContact O-N 2.91Å; R130-R134 VanDerWaalsContact NH2-NH2 3.14Å; R130-R134 WeakPolarHBondContact O-CG 3.26Å; R130-R134 PolarHBondContact O-N 2.83Å |
| 131 | E | 59.9 | Low | 68.1 | Low | 56 Ų | 56 | 92.4 Ų | 92.4 | 26% | 0.262 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -69.6 | -34.3 | 179 | -66.5 | -53.8 | 130.5 | 0 | 0 | 111.2 | M107 I127 V128 Q133 R134 F135 | M107-E131 HydrophobicContact SD-CG 4.18Å; I127-E131 HydrophobicContact CG2-CG 4.42Å; I127-E131 PolarHBondContact O-N 3.05Å; V128-E131 PolarHBondContact O-N 3.42Å; E131-Q133 PolarHBondContact O-N 3.28Å; E131-R134 WeakPolarHBondContact O-CB 3.48Å; E131-R134 PolarHBondContact O-N 3.38Å; E131-R134 IonicContact OE1-NH1 3.6Å; E131-F135 WeakPolarHBondContact O-CB 3.21Å; E131-F135 PolarHBondContact O-N 2.89Å |
| 132 | F | 62 | Low | 68.7 | Low | 90 Ų | 90 | 89.2 Ų | 89.2 | 40% | 0.395 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -61 | -44 | 172.4 | -173.3 | -88.3 | 0 | 0 | 0 | 112.9 | A102 V128 N129 R130 R134 F135 L137 | A102-F132 HydrophobicContact CB-CD2 4.31Å; V128-F132 VanDerWaalsContact O-CB 3.25Å; V128-F132 WeakPolarHBondContact O-CB 3.4Å; V128-F132 PolarHBondContact O-N 3.45Å; N129-F132 PolarHBondContact O-N 3.2Å; R130-F132 VanDerWaalsContact C-N 3.33Å; F132-R134 VanDerWaalsContact C-N 3.27Å; F132-R134 PolarHBondContact O-N 3.42Å; F132-F135 PolarHBondContact O-N 3.02Å; F132-L137 HydrophobicContact CD2-CD1 4.11Å; F132-L137 HydrophobicContact CE1-CD1 3.92Å; F132-L137 HydrophobicContact CE2-CD1 3.25Å; F132-L137 HydrophobicContact CE2-CG 4.25Å; F132-L137 HydrophobicContact CZ-CD1 3.12Å; F132-L137 HydrophobicContact CZ-CG 4.34Å |
| 133 | Q | 63.8 | Low | 69.3 | Low | 143 Ų | 143 | 86.3 Ų | 86.3 | 67% | 0.668 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -67.5 | -28.1 | 176 | -71.9 | 172.2 | 25.3 | 0 | 0 | 113.1 | N129 R130 E131 | N129-Q133 PolarHBondContact ND2-NE2 2.98Å; N129-Q133 WeakPolarHBondContact O-CG 3.48Å; N129-Q133 PolarHBondContact O-N 3.44Å; R130-Q133 PolarHBondContact O-N 2.91Å; E131-Q133 PolarHBondContact O-N 3.28Å |
| 134 | R | 60.3 | Low | 69.6 | Low | 152 Ų | 152 | 83.9 Ų | 83.9 | 57% | 0.574 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -76.5 | -32.4 | 174.9 | -73.3 | 171.7 | 162.3 | -147.9 | -13.8 | 111.9 | R130 E131 F132 Q136 | R130-R134 VanDerWaalsContact NH2-NH2 3.14Å; R130-R134 WeakPolarHBondContact O-CG 3.26Å; R130-R134 PolarHBondContact O-N 2.83Å; E131-R134 WeakPolarHBondContact O-CB 3.48Å; E131-R134 PolarHBondContact O-N 3.38Å; E131-R134 IonicContact OE1-NH1 3.6Å; F132-R134 VanDerWaalsContact C-N 3.27Å; F132-R134 PolarHBondContact O-N 3.42Å; R134-Q136 PolarHBondContact O-N 3.03Å |
| 135 | F | 60.2 | Low | 70.3 | Confident | 79 Ų | 79 | 83.1 Ų | 83.1 | 35% | 0.346 | 42% | 0.421 | S | S | . | . | S | Bend | trans | -77.7 | 117.6 | 179.7 | -162.9 | -90.9 | 0 | 0 | 0 | 109.8 | Y101 E131 F132 L137 L140 | Y101-F135 HydrophobicContact CE1-CD1 4.12Å; Y101-F135 AromaticContact CE1-CE1 3.54Å; Y101-F135 HydrophobicContact CE1-CE1 3.54Å; Y101-F135 AromaticContact CE1-CZ 3.77Å; Y101-F135 HydrophobicContact CE1-CZ 3.77Å; E131-F135 WeakPolarHBondContact O-CB 3.21Å; E131-F135 PolarHBondContact O-N 2.89Å; F132-F135 PolarHBondContact O-N 3.02Å; F135-L137 VanDerWaalsContact C-N 3.25Å; F135-L137 HydrophobicContact CD1-CD2 3.73Å; F135-L137 HydrophobicContact CD1-CG 4.04Å; F135-L137 HydrophobicContact CE1-CD2 3.94Å; F135-L137 PolarHBondContact O-N 3.04Å; F135-L140 HydrophobicContact CE1-CB 4.45Å; F135-L140 HydrophobicContact CZ-CD1 4.41Å |
| 136 | Q | 60.9 | Low | 70.9 | Confident | 138 Ų | 138 | 85.2 Ų | 85.2 | 65% | 0.645 | 42% | 0.42 | S | S | * | . | trans | -76.8 | 77.9 | 177.8 | -62.9 | -179.8 | 15.8 | 0 | 0 | 109.7 | R134 D138 T139 | R134-Q136 PolarHBondContact O-N 3.03Å; Q136-D138 PolarHBondContact O-N 3Å; Q136-T139 HydrophobicContact CB-CG2 3.89Å; Q136-T139 WeakPolarHBondContact O-CB 3.14Å; Q136-T139 PolarHBondContact O-N 3.23Å; Q136-T139 PolarHBondContact O-OG1 2.93Å | ||
| 137 | L | 62 | Low | 71.6 | Confident | 59 Ų | 59 | 83.2 Ų | 83.2 | 31% | 0.309 | 40% | 0.399 | S | S | . | . | G | 310 helix | trans | -52 | -31.9 | 179.7 | -82.4 | -179.1 | 0 | 0 | 0 | 113.5 | Y101 F132 F135 T139 L140 | Y101-L137 HydrophobicContact CD1-CD2 4.29Å; Y101-L137 HydrophobicContact CE1-CD2 4.12Å; F132-L137 HydrophobicContact CD2-CD1 4.11Å; F132-L137 HydrophobicContact CE1-CD1 3.92Å; F132-L137 HydrophobicContact CE2-CD1 3.25Å; F132-L137 HydrophobicContact CE2-CG 4.25Å; F132-L137 HydrophobicContact CZ-CD1 3.12Å; F132-L137 HydrophobicContact CZ-CG 4.34Å; F135-L137 VanDerWaalsContact C-N 3.25Å; F135-L137 HydrophobicContact CD1-CD2 3.73Å; F135-L137 HydrophobicContact CD1-CG 4.04Å; F135-L137 HydrophobicContact CE1-CD2 3.94Å; F135-L137 PolarHBondContact O-N 3.04Å; L137-T139 PolarHBondContact O-N 3.28Å; L137-T139 VanDerWaalsContact O-N 3.11Å; L137-L140 HydrophobicContact CD2-CD2 4.44Å; L137-L140 VanDerWaalsContact O-CB 3.28Å; L137-L140 WeakPolarHBondContact O-CB 3.15Å; L137-L140 PolarHBondContact O-N 3.33Å |
| 138 | D | 65.9 | Low | 72.2 | Confident | 169 Ų | 169 | 81.5 Ų | 81.5 | 90% | 0.904 | 39% | 0.391 | S | S | * | . | G | 310 helix | trans | -60.8 | -20.7 | 178.1 | -58.8 | -24.5 | 0 | 0 | 0 | 113 | Q136 | Q136-D138 PolarHBondContact O-N 3Š|
| 139 | T | 71.1 | Confident | 73 | Confident | 98 Ų | 98 | 84 Ų | 84 | 60% | 0.601 | 40% | 0.402 | S | S | * | . | G | 310 helix | trans | -89.4 | -7.8 | 177 | 67 | 0 | 0 | 0 | 0 | 113.4 | Q136 L137 S141 | Q136-T139 HydrophobicContact CB-CG2 3.89Å; Q136-T139 WeakPolarHBondContact O-CB 3.14Å; Q136-T139 PolarHBondContact O-N 3.23Å; Q136-T139 PolarHBondContact O-OG1 2.93Å; L137-T139 PolarHBondContact O-N 3.28Å; L137-T139 VanDerWaalsContact O-N 3.11Å; T139-S141 PolarHBondContact O-N 3.21Å |
| 140 | L | 73.3 | Confident | 73.6 | Confident | 37 Ų | 37 | 82.3 Ų | 82.3 | 19% | 0.194 | 39% | 0.391 | C | S | . | . | trans | -82.2 | 118.4 | -176.8 | -172.3 | 71.1 | 0 | 0 | 0 | 111 | Y101 F135 L137 N144 F145 L148 | Y101-L140 HydrophobicContact CE1-CD2 3.9Å; Y101-L140 HydrophobicContact CE2-CD2 3.75Å; Y101-L140 WeakPolarHBondContact OH-CD1 3.27Å; Y101-L140 WeakPolarHBondContact OH-CD2 3.32Å; Y101-L140 WeakPolarHBondContact OH-CG 3.49Å; F135-L140 HydrophobicContact CE1-CB 4.45Å; F135-L140 HydrophobicContact CZ-CD1 4.41Å; L137-L140 HydrophobicContact CD2-CD2 4.44Å; L137-L140 VanDerWaalsContact O-CB 3.28Å; L137-L140 WeakPolarHBondContact O-CB 3.15Å; L137-L140 PolarHBondContact O-N 3.33Å; L140-N144 HydrophobicContact CD1-CB 3.48Å; L140-N144 VanDerWaalsContact CD1-CB 3.48Å; L140-N144 HydrophobicContact CG-CB 4.22Å; L140-F145 HydrophobicContact CD2-CB 3.85Å; L140-F145 HydrophobicContact CD2-CD2 3.81Å; L140-F145 HydrophobicContact CD2-CG 4.35Å; L140-F145 HydrophobicContact CG-CB 4.43Å; L140-L148 HydrophobicContact CD1-CD1 4.45Å | ||
| 141 | S | 81.1 | Confident | 74.3 | Confident | 40 Ų | 40 | 75.6 Ų | 75.6 | 28% | 0.28 | 37% | 0.366 | S | S | . | . | trans | -67.9 | 151.5 | 172.9 | 75.3 | 0 | 0 | 0 | 0 | 111.7 | T139 D143 N144 F145 | T139-S141 PolarHBondContact O-N 3.21Å; S141-D143 PolarHBondContact O-N 3.43Å; S141-N144 PolarHBondContact O-N 3.4Å; S141-N144 VanDerWaalsContact O-N 3.13Å; S141-N144 WeakPolarHBondContact OG-CB 3.47Å; S141-N144 PolarHBondContact OG-N 2.78Å; S141-N144 PolarHBondContact OG-ND2 2.78Å; S141-N144 PolarHBondContact OG-OD1 2.72Å; S141-F145 PolarHBondContact O-N 3.48Å | ||
| 142 | E | 84.8 | Confident | 75.2 | Confident | 133 Ų | 133 | 74.7 Ų | 74.7 | 62% | 0.621 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -55.6 | -37 | 173.8 | -171.5 | -172.7 | 143.4 | 0 | 0 | 111.6 | F145 K146 | E142-F145 WeakPolarHBondContact O-CB 3.42Å; E142-F145 PolarHBondContact O-N 3.11Å; E142-K146 VanDerWaalsContact O-CG 3.32Å; E142-K146 WeakPolarHBondContact O-CG 3.48Å; E142-K146 PolarHBondContact O-N 3.1Å; E142-K146 WeakPolarHBondContact OE1-CE 3.48Å; E142-K146 IonicContact OE1-NZ 3.05Å; E142-K146 PolarHBondContact OE1-NZ 3.33Å |
| 143 | D | 87.8 | Confident | 76 | Confident | 70 Ų | 70 | 73 Ų | 73 | 37% | 0.374 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -71 | -38.2 | 177.8 | -71.6 | -24.6 | 0 | 0 | 0 | 112.5 | S141 F145 K146 C147 | S141-D143 PolarHBondContact O-N 3.43Å; D143-F145 VanDerWaalsContact C-N 3.28Å; D143-F145 PolarHBondContact O-N 3.48Å; D143-K146 PolarHBondContact O-N 3.47Å; D143-K146 IonicContact OD1-NZ 3.15Å; D143-C147 VanDerWaalsContact O-CB 3.27Å; D143-C147 WeakPolarHBondContact O-CB 3.3Å; D143-C147 PolarHBondContact O-N 3.01Å; D143-C147 PolarHBondContact O-SG 3.26Å |
| 144 | N | 81.8 | Confident | 76.8 | Confident | 15 Ų | 15 | 67.7 Ų | 67.7 | 8% | 0.08 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 173.3 | -68.9 | -13.2 | 0 | 0 | 0 | 110.8 | L140 S141 C147 L148 P174 V176 | L140-N144 HydrophobicContact CD1-CB 3.48Å; L140-N144 VanDerWaalsContact CD1-CB 3.48Å; L140-N144 HydrophobicContact CG-CB 4.22Å; S141-N144 PolarHBondContact O-N 3.4Å; S141-N144 VanDerWaalsContact O-N 3.13Å; S141-N144 WeakPolarHBondContact OG-CB 3.47Å; S141-N144 PolarHBondContact OG-N 2.78Å; S141-N144 PolarHBondContact OG-ND2 2.78Å; S141-N144 PolarHBondContact OG-OD1 2.72Å; N144-C147 WeakPolarHBondContact O-CB 3.41Å; N144-C147 PolarHBondContact O-N 3.26Å; N144-L148 WeakPolarHBondContact O-CB 3.47Å; N144-L148 WeakPolarHBondContact O-CD1 3.42Å; N144-L148 VanDerWaalsContact O-CG 3.31Å; N144-L148 WeakPolarHBondContact O-CG 3.35Å; N144-L148 PolarHBondContact O-N 3.12Å; N144-P174 PolarHBondContact ND2-O 3.28Å; N144-P174 PolarHBondContact OD1-O 3.05Å; N144-P174 VanDerWaalsContact OD1-O 3.11Å; N144-V176 WeakPolarHBondContact OD1-CG1 3.39Å |
| 145 | F | 80.8 | Confident | 77.8 | Confident | 75 Ų | 75 | 68.4 Ų | 68.4 | 33% | 0.329 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63.4 | -48 | 174.2 | -176.5 | -100 | 0 | 0 | 0 | 112.3 | F97 Y101 L140 S141 E142 D143 C147 L148 I149 | F97-F145 AromaticContact CD1-CE2 3.62Å; F97-F145 HydrophobicContact CD1-CE2 3.62Å; F97-F145 AromaticContact CD1-CZ 3.78Å; F97-F145 HydrophobicContact CD1-CZ 3.78Å; F97-F145 HydrophobicContact CD2-CZ 4.12Å; F97-F145 AromaticContact CE1-CD2 3.79Å; F97-F145 HydrophobicContact CE1-CD2 3.79Å; F97-F145 AromaticContact CE1-CE1 3.99Å; F97-F145 HydrophobicContact CE1-CE1 3.99Å; F97-F145 AromaticContact CE1-CE2 2.9Å; F97-F145 HydrophobicContact CE1-CE2 2.9Å; F97-F145 AromaticContact CE1-CZ 3.06Å; F97-F145 HydrophobicContact CE1-CZ 3.06Å; F97-F145 AromaticContact CE2-CE1 3.88Å; F97-F145 HydrophobicContact CE2-CE1 3.88Å; F97-F145 HydrophobicContact CE2-CE2 4.19Å; F97-F145 AromaticContact CE2-CZ 3.42Å; F97-F145 HydrophobicContact CE2-CZ 3.42Å; F97-F145 VanDerWaalsContact CE2-CZ 3.42Å; F97-F145 HydrophobicContact CG-CZ 4.26Å; F97-F145 HydrophobicContact CZ-CD1 4.2Å; F97-F145 HydrophobicContact CZ-CD2 4.08Å; F97-F145 AromaticContact CZ-CE1 3.34Å; F97-F145 HydrophobicContact CZ-CE1 3.34Å; F97-F145 AromaticContact CZ-CE2 3.23Å; F97-F145 HydrophobicContact CZ-CE2 3.23Å; F97-F145 AromaticContact CZ-CZ 2.81Å; F97-F145 HydrophobicContact CZ-CZ 2.81Å; Y101-F145 HydrophobicContact CD2-CD2 4.17Å; Y101-F145 HydrophobicContact CE2-CD2 4.01Å; L140-F145 HydrophobicContact CD2-CB 3.85Å; L140-F145 HydrophobicContact CD2-CD2 3.81Å; L140-F145 HydrophobicContact CD2-CG 4.35Å; L140-F145 HydrophobicContact CG-CB 4.43Å; S141-F145 PolarHBondContact O-N 3.48Å; E142-F145 WeakPolarHBondContact O-CB 3.42Å; E142-F145 PolarHBondContact O-N 3.11Å; D143-F145 VanDerWaalsContact C-N 3.28Å; D143-F145 PolarHBondContact O-N 3.48Å; F145-C147 VanDerWaalsContact C-N 3.32Å; F145-C147 PolarHBondContact O-N 3.36Å; F145-L148 PolarHBondContact O-N 3.24Å; F145-I149 WeakPolarHBondContact O-CG1 3.49Å; F145-I149 PolarHBondContact O-N 3.45Å |
| 146 | K | 86.1 | Confident | 78.8 | Confident | 80 Ų | 80 | 66.8 Ų | 66.8 | 35% | 0.348 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -58.2 | -43.1 | 173 | -75.2 | 171.8 | -174.1 | 160.3 | 0 | 112 | E142 D143 L148 I149 F150 I178 | E142-K146 VanDerWaalsContact O-CG 3.32Å; E142-K146 WeakPolarHBondContact O-CG 3.48Å; E142-K146 PolarHBondContact O-N 3.1Å; E142-K146 WeakPolarHBondContact OE1-CE 3.48Å; E142-K146 IonicContact OE1-NZ 3.05Å; E142-K146 PolarHBondContact OE1-NZ 3.33Å; D143-K146 PolarHBondContact O-N 3.47Å; D143-K146 IonicContact OD1-NZ 3.15Å; K146-L148 VanDerWaalsContact C-N 3.31Å; K146-L148 PolarHBondContact O-N 2.77Å; K146-I149 PolarHBondContact O-N 3.27Å; K146-F150 PolarHBondContact O-N 2.74Å; K146-I178 HydrophobicContact CB-CD1 3.9Å; K146-I178 HydrophobicContact CB-CG1 4.28Å |
| 147 | C | 87.8 | Confident | 79.8 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -60 | -41.2 | 176 | -76.4 | 0 | 0 | 0 | 0 | 112 | D143 N144 F145 F150 V151 I170 V176 T177 I178 L181 | D143-C147 VanDerWaalsContact O-CB 3.27Å; D143-C147 WeakPolarHBondContact O-CB 3.3Å; D143-C147 PolarHBondContact O-N 3.01Å; D143-C147 PolarHBondContact O-SG 3.26Å; N144-C147 WeakPolarHBondContact O-CB 3.41Å; N144-C147 PolarHBondContact O-N 3.26Å; F145-C147 VanDerWaalsContact C-N 3.32Å; F145-C147 PolarHBondContact O-N 3.36Å; C147-F150 WeakPolarHBondContact O-CB 3.23Å; C147-F150 PolarHBondContact O-N 2.97Å; C147-V151 WeakPolarHBondContact O-CG2 3.48Å; C147-V151 PolarHBondContact O-N 3.36Å; C147-I170 HydrophobicContact CB-CD1 4.06Å; C147-I170 HydrophobicContact CB-CG1 4.09Å; C147-V176 HydrophobicContact CB-CG1 4.21Å; C147-V176 PolarHBondContact SG-O 3.24Å; C147-V176 VanDerWaalsContact SG-O 3.37Å; C147-T177 VanDerWaalsContact SG-CA 3.55Å; C147-I178 PolarHBondContact SG-N 2.97Å; C147-I178 VanDerWaalsContact SG-N 3.42Å; C147-L181 HydrophobicContact CB-CD1 3.64Å; C147-L181 HydrophobicContact CB-CG 4.47Å |
| 148 | L | 82.1 | Confident | 80.9 | Confident | 24 Ų | 24 | 68.8 Ų | 68.8 | 13% | 0.126 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -69.3 | -39.5 | 177.4 | -74.6 | 159.8 | 0 | 0 | 0 | 111.8 | Y101 L140 N144 F145 K146 F150 V151 C152 L167 I170 | Y101-L148 HydrophobicContact CD2-CB 4.1Å; Y101-L148 HydrophobicContact CD2-CD1 4.23Å; Y101-L148 HydrophobicContact CE1-CD1 4.47Å; Y101-L148 HydrophobicContact CE2-CB 3.6Å; Y101-L148 HydrophobicContact CE2-CD1 3.12Å; Y101-L148 HydrophobicContact CE2-CG 3.91Å; Y101-L148 WeakPolarHBondContact OH-CD1 3.27Å; L140-L148 HydrophobicContact CD1-CD1 4.45Å; N144-L148 WeakPolarHBondContact O-CB 3.47Å; N144-L148 WeakPolarHBondContact O-CD1 3.42Å; N144-L148 VanDerWaalsContact O-CG 3.31Å; N144-L148 WeakPolarHBondContact O-CG 3.35Å; N144-L148 PolarHBondContact O-N 3.12Å; F145-L148 PolarHBondContact O-N 3.24Å; K146-L148 VanDerWaalsContact C-N 3.31Å; K146-L148 PolarHBondContact O-N 2.77Å; L148-F150 VanDerWaalsContact C-N 3.29Å; L148-F150 PolarHBondContact O-N 2.67Å; L148-V151 PolarHBondContact O-N 3.08Å; L148-C152 PolarHBondContact O-N 3.18Å; L148-C152 PolarHBondContact O-SG 3.3Å; L148-L167 HydrophobicContact CD2-CD2 3.74Å; L148-I170 HydrophobicContact CD1-CG2 4.09Å; L148-I170 HydrophobicContact CD2-CD1 3.8Å; L148-I170 HydrophobicContact CD2-CG2 4.29Å; L148-I170 HydrophobicContact CG-CD1 4.01Å; L148-I170 HydrophobicContact CG-CG2 4.12Å |
| 149 | I | 80.5 | Confident | 81.8 | Confident | 73 Ų | 73 | 63.1 Ų | 63.1 | 37% | 0.374 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.5 | -42.2 | 170.5 | -69.6 | -60.8 | 0 | 0 | 0 | 111.9 | F97 F145 K146 C152 G153 | F97-I149 HydrophobicContact CE1-CD1 3.94Å; F97-I149 HydrophobicContact CE2-CD1 3.59Å; F97-I149 HydrophobicContact CE2-CG1 4.26Å; F97-I149 HydrophobicContact CZ-CD1 3.09Å; F97-I149 HydrophobicContact CZ-CG1 3.59Å; F145-I149 WeakPolarHBondContact O-CG1 3.49Å; F145-I149 PolarHBondContact O-N 3.45Å; K146-I149 PolarHBondContact O-N 3.27Å; I149-C152 PolarHBondContact O-N 2.86Å; I149-G153 PolarHBondContact O-N 3.45Å; I149-G153 VanDerWaalsContact O-N 3.14Å |
| 150 | F | 85.6 | Confident | 82.3 | Confident | 55 Ų | 55 | 60.4 Ų | 60.4 | 24% | 0.241 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60 | -47.6 | 175.5 | 176.7 | -92.3 | 0 | 0 | 0 | 111.9 | K146 C147 L148 C152 G153 L166 I178 L181 V182 | K146-F150 PolarHBondContact O-N 2.74Å; C147-F150 WeakPolarHBondContact O-CB 3.23Å; C147-F150 PolarHBondContact O-N 2.97Å; L148-F150 VanDerWaalsContact C-N 3.29Å; L148-F150 PolarHBondContact O-N 2.67Å; F150-C152 VanDerWaalsContact C-N 3.33Å; F150-C152 PolarHBondContact O-N 3.29Å; F150-G153 PolarHBondContact O-N 3.08Å; F150-G153 VanDerWaalsContact O-N 3.13Å; F150-L166 HydrophobicContact CE1-CD1 4.29Å; F150-I178 HydrophobicContact CB-CD1 4.31Å; F150-I178 HydrophobicContact CB-CG1 4.14Å; F150-I178 HydrophobicContact CD2-CG2 3.86Å; F150-I178 HydrophobicContact CE2-CG2 4.2Å; F150-I178 HydrophobicContact CG-CG2 4.3Å; F150-L181 HydrophobicContact CD1-CB 4Å; F150-L181 HydrophobicContact CD1-CD1 3.74Å; F150-L181 HydrophobicContact CE1-CB 3.91Å; F150-L181 HydrophobicContact CE1-CD1 4.44Å; F150-L181 HydrophobicContact CG-CD1 4.49Å; F150-V182 HydrophobicContact CE2-CG2 3.85Å; F150-V182 HydrophobicContact CZ-CG2 3.68Å |
| 151 | V | 83.1 | Confident | 82.8 | Confident | 1 Ų | 1 | 62 Ų | 62 | 1% | 0.006 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.2 | -38.2 | 177.6 | 176.5 | 0 | 0 | 0 | 0 | 111.9 | C147 L148 G153 L154 R163 L166 L167 I170 L181 | C147-V151 WeakPolarHBondContact O-CG2 3.48Å; C147-V151 PolarHBondContact O-N 3.36Å; L148-V151 PolarHBondContact O-N 3.08Å; V151-G153 PolarHBondContact O-N 3.41Å; V151-L154 WeakPolarHBondContact O-CB 3.46Å; V151-L154 PolarHBondContact O-N 2.94Å; V151-L154 VanDerWaalsContact O-N 3.1Å; V151-R163 HydrophobicContact CG1-CB 4.25Å; V151-R163 HydrophobicContact CG1-CG 4.16Å; V151-L166 HydrophobicContact CG2-CB 3.63Å; V151-L166 HydrophobicContact CG2-CD1 3.86Å; V151-L166 HydrophobicContact CG2-CG 4.43Å; V151-L167 HydrophobicContact CG1-CD2 4.14Å; V151-L167 HydrophobicContact CG1-CG 4.1Å; V151-I170 HydrophobicContact CG2-CD1 3.75Å; V151-L181 HydrophobicContact CG2-CD1 4.01Å |
| 152 | C | 78.4 | Confident | 83.1 | Confident | 37 Ų | 37 | 61.5 Ų | 61.5 | 25% | 0.25 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64 | -26.5 | 175.6 | -69.4 | 0 | 0 | 0 | 0 | 113.3 | C100 L148 I149 F150 L154 Q155 | C100-C152 PolarHBondContact O-SG 3.4Å; L148-C152 PolarHBondContact O-N 3.18Å; L148-C152 PolarHBondContact O-SG 3.3Å; I149-C152 PolarHBondContact O-N 2.86Å; F150-C152 VanDerWaalsContact C-N 3.33Å; F150-C152 PolarHBondContact O-N 3.29Å; C152-L154 VanDerWaalsContact C-N 3.27Å; C152-L154 PolarHBondContact O-N 2.87Å; C152-Q155 WeakPolarHBondContact O-CG 3.5Å |
| 153 | G | 78.9 | Confident | 83.2 | Confident | 54 Ų | 54 | 55.9 Ų | 55.9 | 56% | 0.557 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -70.1 | -19.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114 | I149 F150 V151 Q155 | I149-G153 PolarHBondContact O-N 3.45Å; I149-G153 VanDerWaalsContact O-N 3.14Å; F150-G153 PolarHBondContact O-N 3.08Å; F150-G153 VanDerWaalsContact O-N 3.13Å; V151-G153 PolarHBondContact O-N 3.41Å; G153-Q155 VanDerWaalsContact C-N 3.27Å; G153-Q155 PolarHBondContact O-N 3.29Å |
| 154 | L | 80.8 | Confident | 83 | Confident | 32 Ų | 32 | 56.9 Ų | 56.9 | 17% | 0.168 | 33% | 0.327 | C | S | . | . | trans | -80.3 | 68.8 | 179.1 | -57 | -176.6 | 0 | 0 | 0 | 111.2 | V151 C152 D159 V162 R163 L166 | V151-L154 WeakPolarHBondContact O-CB 3.46Å; V151-L154 PolarHBondContact O-N 2.94Å; V151-L154 VanDerWaalsContact O-N 3.1Å; C152-L154 VanDerWaalsContact C-N 3.27Å; C152-L154 PolarHBondContact O-N 2.87Å; L154-D159 HydrophobicContact CB-CB 4.08Å; L154-V162 HydrophobicContact CD1-CG1 4.11Å; L154-R163 HydrophobicContact CB-CG 3.98Å; L154-R163 VanDerWaalsContact O-CD 3.27Å; L154-R163 WeakPolarHBondContact O-CD 3.06Å; L154-R163 PolarHBondContact O-NH1 2.93Å; L154-L166 HydrophobicContact CD1-CD1 3.61Å | ||
| 155 | Q | 81.7 | Confident | 83.3 | Confident | 167 Ų | 167 | 61 Ų | 61 | 78% | 0.78 | 35% | 0.345 | S | S | * | . | trans | -81.5 | -13.7 | -172 | -64.8 | -178.4 | -16.7 | 0 | 0 | 114.3 | C152 G153 | C152-Q155 WeakPolarHBondContact O-CG 3.5Å; G153-Q155 VanDerWaalsContact C-N 3.27Å; G153-Q155 PolarHBondContact O-N 3.29Å | ||
| 156 | S | 80.8 | Confident | 83.7 | Confident | 45 Ų | 45 | 57.4 Ų | 57.4 | 32% | 0.315 | 33% | 0.329 | S | S | . | . | trans | -60 | 138.6 | -179.1 | -176.4 | 0 | 0 | 0 | 0 | 111.1 | D158 D159 R163 | S156-D158 PolarHBondContact O-N 3.12Å; S156-D158 PolarHBondContact OG-N 2.93Å; S156-D159 WeakPolarHBondContact CB-OD2 3.42Å; S156-D159 PolarHBondContact O-N 3.29Å; S156-D159 VanDerWaalsContact O-N 3.12Å; S156-R163 PolarHBondContact O-NH1 3.34Å | ||
| 157 | P | 82.5 | Confident | 83.7 | Confident | 106 Ų | 106 | 54.6 Ų | 54.6 | 69% | 0.688 | 32% | 0.318 | S | S | * | . | G | 310 helix | trans | -59 | -30 | 171 | 24.5 | -33.5 | 0 | 0 | 0 | 112.4 | D159 A160 | P157-D159 PolarHBondContact O-N 2.86Å; P157-A160 VanDerWaalsContact O-CB 3.25Å; P157-A160 WeakPolarHBondContact O-CB 3.25Å; P157-A160 PolarHBondContact O-N 3.24Å; P157-A160 VanDerWaalsContact O-N 3.11Å |
| 158 | D | 85.2 | Confident | 83.5 | Confident | 133 Ų | 133 | 58.6 Ų | 58.6 | 71% | 0.711 | 34% | 0.339 | S | S | * | . | G | 310 helix | trans | -65.1 | -24.5 | 177.7 | -64.8 | -29.7 | 0 | 0 | 0 | 112.8 | S156 A160 | S156-D158 PolarHBondContact O-N 3.12Å; S156-D158 PolarHBondContact OG-N 2.93Å; D158-A160 VanDerWaalsContact C-N 3.3Å; D158-A160 PolarHBondContact O-N 3.13Å |
| 159 | D | 83.3 | Confident | 83.7 | Confident | 50 Ų | 50 | 59.3 Ų | 59.3 | 27% | 0.267 | 34% | 0.341 | S | S | . | . | G | 310 helix | trans | -85.8 | 3.3 | 178.1 | -63.3 | -39.6 | 0 | 0 | 0 | 112.7 | L154 S156 P157 A161 V162 R163 | L154-D159 HydrophobicContact CB-CB 4.08Å; S156-D159 WeakPolarHBondContact CB-OD2 3.42Å; S156-D159 PolarHBondContact O-N 3.29Å; S156-D159 VanDerWaalsContact O-N 3.12Å; P157-D159 PolarHBondContact O-N 2.86Å; D159-A161 VanDerWaalsContact C-N 3.3Å; D159-A161 PolarHBondContact O-N 3.14Å; D159-V162 HydrophobicContact CB-CB 4.48Å; D159-V162 CarbonylContact O-C 3.57Å; D159-V162 WeakPolarHBondContact O-CA 3.29Å; D159-V162 WeakPolarHBondContact O-CB 3.27Å; D159-V162 PolarHBondContact O-N 3.41Å; D159-R163 PolarHBondContact O-N 2.89Å |
| 160 | A | 81.7 | Confident | 83.9 | Confident | 42 Ų | 42 | 56.6 Ų | 56.6 | 35% | 0.347 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -56.7 | -42.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | P157 D158 L164 | P157-A160 VanDerWaalsContact O-CB 3.25Å; P157-A160 WeakPolarHBondContact O-CB 3.25Å; P157-A160 PolarHBondContact O-N 3.24Å; P157-A160 VanDerWaalsContact O-N 3.11Å; D158-A160 VanDerWaalsContact C-N 3.3Å; D158-A160 PolarHBondContact O-N 3.13Å; A160-L164 PolarHBondContact O-N 3.46Å |
| 161 | A | 84.1 | Confident | 83.7 | Confident | 71 Ų | 71 | 60.8 Ų | 60.8 | 59% | 0.587 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -69.4 | -35.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | D159 K165 | D159-A161 VanDerWaalsContact C-N 3.3Å; D159-A161 PolarHBondContact O-N 3.14Å; A161-K165 PolarHBondContact O-N 3.49Å |
| 162 | V | 87.7 | Confident | 83.8 | Confident | 28 Ų | 28 | 65.7 Ų | 65.7 | 17% | 0.17 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -66 | -50.6 | 176.9 | 178.4 | 0 | 0 | 0 | 0 | 109.7 | L154 D159 L164 K165 L166 L188 | L154-V162 HydrophobicContact CD1-CG1 4.11Å; D159-V162 HydrophobicContact CB-CB 4.48Å; D159-V162 CarbonylContact O-C 3.57Å; D159-V162 WeakPolarHBondContact O-CA 3.29Å; D159-V162 WeakPolarHBondContact O-CB 3.27Å; D159-V162 PolarHBondContact O-N 3.41Å; V162-L164 VanDerWaalsContact C-N 3.28Å; V162-L164 PolarHBondContact O-N 3.26Å; V162-K165 PolarHBondContact O-N 3.42Å; V162-L166 HydrophobicContact CG1-CD1 3.89Å; V162-L166 HydrophobicContact CG1-CG 4.09Å; V162-L166 WeakPolarHBondContact O-CG 3.3Å; V162-L166 PolarHBondContact O-N 3.34Å; V162-L188 HydrophobicContact CG1-CD1 4.23Å; V162-L188 HydrophobicContact CG2-CD1 4.33Å |
| 163 | R | 87.2 | Confident | 84.2 | Confident | 15 Ų | 15 | 66.7 Ų | 66.7 | 6% | 0.057 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -49.6 | -48.8 | 175.5 | -74.4 | -164.2 | -63.2 | -82.3 | 0.4 | 111.7 | Y108 V151 L154 S156 D159 K165 L166 L167 | Y108-R163 PolarHBondContact OH-NH2 3.14Å; V151-R163 HydrophobicContact CG1-CB 4.25Å; V151-R163 HydrophobicContact CG1-CG 4.16Å; L154-R163 HydrophobicContact CB-CG 3.98Å; L154-R163 VanDerWaalsContact O-CD 3.27Å; L154-R163 WeakPolarHBondContact O-CD 3.06Å; L154-R163 PolarHBondContact O-NH1 2.93Å; S156-R163 PolarHBondContact O-NH1 3.34Å; D159-R163 PolarHBondContact O-N 2.89Å; R163-K165 PolarHBondContact O-N 2.95Å; R163-L166 PolarHBondContact O-N 3.41Å; R163-L167 WeakPolarHBondContact O-CB 3.37Å; R163-L167 VanDerWaalsContact O-CG 3.26Å; R163-L167 WeakPolarHBondContact O-CG 3.16Å; R163-L167 PolarHBondContact O-N 2.95Å |
| 164 | L | 83.6 | Confident | 84.3 | Confident | 91 Ų | 91 | 68.1 Ų | 68.1 | 48% | 0.476 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.5 | -44.2 | 179.9 | -178.7 | 61.3 | 0 | 0 | 0 | 112.3 | A160 V162 N168 | A160-L164 PolarHBondContact O-N 3.46Å; V162-L164 VanDerWaalsContact C-N 3.28Å; V162-L164 PolarHBondContact O-N 3.26Å; L164-N168 PolarHBondContact O-N 2.95Å; L164-N168 VanDerWaalsContact O-N 3.14Å |
| 165 | K | 88.2 | Confident | 84.6 | Confident | 102 Ų | 102 | 72.4 Ų | 72.4 | 44% | 0.443 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.3 | -42.4 | 177.3 | -75.6 | -169.8 | 175.1 | -169.7 | 0 | 112.5 | A161 V162 R163 N168 K169 L188 | A161-K165 PolarHBondContact O-N 3.49Å; V162-K165 PolarHBondContact O-N 3.42Å; R163-K165 PolarHBondContact O-N 2.95Å; K165-N168 PolarHBondContact O-N 3.31Å; K165-K169 PolarHBondContact O-N 3.26Å; K165-L188 HydrophobicContact CB-CD1 4.16Å; K165-L188 HydrophobicContact CD-CD1 3.72Å; K165-L188 HydrophobicContact CD-CD2 3.43Å; K165-L188 VanDerWaalsContact CD-CD2 3.43Å; K165-L188 HydrophobicContact CD-CG 4.23Å |
| 166 | L | 88 | Confident | 85 | Confident | 0 Ų | 0 | 64.5 Ų | 64.5 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -66.5 | -38.8 | 178.8 | -59.9 | -180 | 0 | 0 | 0 | 111.9 | F150 V151 L154 V162 R163 K169 I170 L181 E184 | F150-L166 HydrophobicContact CE1-CD1 4.29Å; V151-L166 HydrophobicContact CG2-CB 3.63Å; V151-L166 HydrophobicContact CG2-CD1 3.86Å; V151-L166 HydrophobicContact CG2-CG 4.43Å; L154-L166 HydrophobicContact CD1-CD1 3.61Å; V162-L166 HydrophobicContact CG1-CD1 3.89Å; V162-L166 HydrophobicContact CG1-CG 4.09Å; V162-L166 WeakPolarHBondContact O-CG 3.3Å; V162-L166 PolarHBondContact O-N 3.34Å; R163-L166 PolarHBondContact O-N 3.41Å; L166-K169 WeakPolarHBondContact O-CB 3.47Å; L166-K169 PolarHBondContact O-N 3.06Å; L166-K169 VanDerWaalsContact O-N 3.15Å; L166-I170 WeakPolarHBondContact O-CD1 3.44Å; L166-I170 VanDerWaalsContact O-CG1 3.31Å; L166-I170 WeakPolarHBondContact O-CG1 3.41Å; L166-I170 PolarHBondContact O-N 3.14Å; L166-L181 HydrophobicContact CB-CD2 4.36Å; L166-L181 HydrophobicContact CD2-CB 4.31Å; L166-L181 HydrophobicContact CD2-CD2 3.99Å; L166-E184 HydrophobicContact CD2-CB 3.92Å; L166-E184 HydrophobicContact CD2-CG 3.88Å |
| 167 | L | 85.6 | Confident | 85.7 | Confident | 21 Ų | 21 | 64.6 Ų | 64.6 | 11% | 0.11 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 174.5 | -72.1 | 169.7 | 0 | 0 | 0 | 111.5 | Y104 L148 V151 R163 K169 I170 E171 | Y104-L167 HydrophobicContact CD1-CD1 4.37Å; L148-L167 HydrophobicContact CD2-CD2 3.74Å; V151-L167 HydrophobicContact CG1-CD2 4.14Å; V151-L167 HydrophobicContact CG1-CG 4.1Å; R163-L167 WeakPolarHBondContact O-CB 3.37Å; R163-L167 VanDerWaalsContact O-CG 3.26Å; R163-L167 WeakPolarHBondContact O-CG 3.16Å; R163-L167 PolarHBondContact O-N 2.95Å; L167-K169 VanDerWaalsContact C-N 3.26Å; L167-K169 PolarHBondContact O-N 3.5Å; L167-I170 PolarHBondContact O-N 2.91Å; L167-E171 PolarHBondContact O-N 3.13Å |
| 168 | N | 83.8 | Confident | 86.3 | Confident | 83 Ų | 83 | 62.7 Ų | 62.7 | 44% | 0.444 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.6 | -37 | 174.1 | -72.3 | -12.9 | 0 | 0 | 0 | 111.9 | L164 K165 E171 T172 | L164-N168 PolarHBondContact O-N 2.95Å; L164-N168 VanDerWaalsContact O-N 3.14Å; K165-N168 PolarHBondContact O-N 3.31Å; N168-E171 PolarHBondContact O-N 3.41Å; N168-T172 WeakPolarHBondContact O-CB 3.38Å; N168-T172 WeakPolarHBondContact O-CG2 3.39Å; N168-T172 PolarHBondContact O-N 3.27Å; N168-T172 PolarHBondContact O-OG1 3.09Å |
| 169 | K | 87.2 | Confident | 86.9 | Confident | 39 Ų | 39 | 59.3 Ų | 59.3 | 17% | 0.17 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.5 | -41.7 | 176.4 | -163.1 | 178.2 | -177.3 | 75 | 0 | 111.8 | K165 L166 L167 E171 T172 E173 L181 E184 | K165-K169 PolarHBondContact O-N 3.26Å; L166-K169 WeakPolarHBondContact O-CB 3.47Å; L166-K169 PolarHBondContact O-N 3.06Å; L166-K169 VanDerWaalsContact O-N 3.15Å; L167-K169 VanDerWaalsContact C-N 3.26Å; L167-K169 PolarHBondContact O-N 3.5Å; K169-E171 VanDerWaalsContact C-N 3.33Å; K169-T172 WeakPolarHBondContact CA-OG1 3.18Å; K169-T172 PolarHBondContact O-N 3.04Å; K169-T172 PolarHBondContact O-OG1 3.38Å; K169-E173 VanDerWaalsContact CE-OE1 3.25Å; K169-E173 WeakPolarHBondContact CE-OE1 3.39Å; K169-E173 HydrophobicContact CG-CG 4.44Å; K169-E173 WeakPolarHBondContact CG-OE1 3.32Å; K169-E173 IonicContact NZ-OE1 3.61Å; K169-E173 PolarHBondContact NZ-OE1 2.97Å; K169-E173 WeakPolarHBondContact O-CB 3.47Å; K169-E173 PolarHBondContact O-N 3.48Å; K169-L181 HydrophobicContact CD-CD2 4.16Å; K169-E184 HydrophobicContact CD-CB 4.28Å; K169-E184 HydrophobicContact CD-CG 4.14Å; K169-E184 IonicContact NZ-OE2 3.61Å; K169-E184 PolarHBondContact NZ-OE2 3.41Å |
| 170 | I | 85 | Confident | 87.5 | Confident | 16 Ų | 16 | 60.9 Ų | 60.9 | 8% | 0.082 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -65.7 | -36.7 | 176 | -63.8 | 156.5 | 0 | 0 | 0 | 111.6 | C147 L148 V151 L166 L167 V176 L181 | C147-I170 HydrophobicContact CB-CD1 4.06Å; C147-I170 HydrophobicContact CB-CG1 4.09Å; L148-I170 HydrophobicContact CD1-CG2 4.09Å; L148-I170 HydrophobicContact CD2-CD1 3.8Å; L148-I170 HydrophobicContact CD2-CG2 4.29Å; L148-I170 HydrophobicContact CG-CD1 4.01Å; L148-I170 HydrophobicContact CG-CG2 4.12Å; V151-I170 HydrophobicContact CG2-CD1 3.75Å; L166-I170 WeakPolarHBondContact O-CD1 3.44Å; L166-I170 VanDerWaalsContact O-CG1 3.31Å; L166-I170 WeakPolarHBondContact O-CG1 3.41Å; L166-I170 PolarHBondContact O-N 3.14Å; L167-I170 PolarHBondContact O-N 2.91Å; I170-V176 HydrophobicContact CB-CG1 4.19Å; I170-V176 HydrophobicContact CG1-CG1 3.8Å; I170-V176 HydrophobicContact CG2-CG1 4.3Å; I170-L181 HydrophobicContact CD1-CD1 4.22Å; I170-L181 HydrophobicContact CG1-CD2 4.32Å |
| 171 | E | 80.9 | Confident | 88.2 | Confident | 144 Ų | 144 | 58.9 Ų | 58.9 | 67% | 0.673 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -69.5 | -34.1 | 176.5 | -173.8 | 172.9 | -166.9 | 0 | 0 | 112.6 | L167 N168 K169 | L167-E171 PolarHBondContact O-N 3.13Å; N168-E171 PolarHBondContact O-N 3.41Å; K169-E171 VanDerWaalsContact C-N 3.33Å |
| 172 | T | 85.3 | Confident | 88.8 | Confident | 103 Ų | 103 | 58 Ų | 58 | 63% | 0.632 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -92.1 | -28.5 | -175.7 | 51.5 | 0 | 0 | 0 | 0 | 114.1 | N168 K169 | N168-T172 WeakPolarHBondContact O-CB 3.38Å; N168-T172 WeakPolarHBondContact O-CG2 3.39Å; N168-T172 PolarHBondContact O-N 3.27Å; N168-T172 PolarHBondContact O-OG1 3.09Å; K169-T172 WeakPolarHBondContact CA-OG1 3.18Å; K169-T172 PolarHBondContact O-N 3.04Å; K169-T172 PolarHBondContact O-OG1 3.38Å |
| 173 | E | 86.7 | Confident | 89.3 | Confident | 58 Ų | 58 | 61.6 Ų | 61.6 | 27% | 0.271 | 33% | 0.33 | S | S | . | . | trans | -112.9 | 99.1 | -179 | -65.3 | -177 | -140.4 | 0 | 0 | 111.1 | K169 N175 V176 K180 | K169-E173 VanDerWaalsContact CE-OE1 3.25Å; K169-E173 WeakPolarHBondContact CE-OE1 3.39Å; K169-E173 HydrophobicContact CG-CG 4.44Å; K169-E173 WeakPolarHBondContact CG-OE1 3.32Å; K169-E173 IonicContact NZ-OE1 3.61Å; K169-E173 PolarHBondContact NZ-OE1 2.97Å; K169-E173 WeakPolarHBondContact O-CB 3.47Å; K169-E173 PolarHBondContact O-N 3.48Å; E173-N175 PolarHBondContact O-N 3.29Å; E173-V176 HydrophobicContact CB-CB 4.17Å; E173-V176 WeakPolarHBondContact O-CG1 3.41Å; E173-V176 PolarHBondContact O-N 3.13Å; E173-K180 IonicContact OE2-NZ 2.81Å | ||
| 174 | P | 80.1 | Confident | 89.7 | Confident | 85 Ų | 85 | 63.1 Ų | 63.1 | 55% | 0.552 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | -13.6 | -176.1 | 26 | -35.4 | 0 | 0 | 0 | 114.9 | N144 | N144-P174 PolarHBondContact ND2-O 3.28Å; N144-P174 PolarHBondContact OD1-O 3.05Å; N144-P174 VanDerWaalsContact OD1-O 3.11Å |
| 175 | N | 88.2 | Confident | 90.3 | Very high | 122 Ų | 122 | 60 Ų | 60 | 65% | 0.652 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117.6 | 40 | 178.5 | -58.9 | -48.6 | 0 | 0 | 0 | 110.6 | E173 K180 | E173-N175 PolarHBondContact O-N 3.29Å; N175-K180 PolarHBondContact O-NZ 3.16Å; N175-K180 VanDerWaalsContact O-NZ 3.08Å |
| 176 | V | 89.9 | Confident | 90.6 | Very high | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 32% | 0.315 | C | S | . | . | trans | -74.6 | 141.5 | 173.2 | 66.7 | 0 | 0 | 0 | 0 | 109.3 | N144 C147 I170 E173 K180 L181 | N144-V176 WeakPolarHBondContact OD1-CG1 3.39Å; C147-V176 HydrophobicContact CB-CG1 4.21Å; C147-V176 PolarHBondContact SG-O 3.24Å; C147-V176 VanDerWaalsContact SG-O 3.37Å; I170-V176 HydrophobicContact CB-CG1 4.19Å; I170-V176 HydrophobicContact CG1-CG1 3.8Å; I170-V176 HydrophobicContact CG2-CG1 4.3Å; E173-V176 HydrophobicContact CB-CB 4.17Å; E173-V176 WeakPolarHBondContact O-CG1 3.41Å; E173-V176 PolarHBondContact O-N 3.13Å; V176-K180 HydrophobicContact CG2-CB 4.2Å; V176-K180 HydrophobicContact CG2-CD 4.46Å; V176-L181 HydrophobicContact CG2-CD2 3.53Å; V176-L181 HydrophobicContact CG2-CG 4.05Å | ||
| 177 | T | 95.6 | Very high | 91 | Very high | 47 Ų | 47 | 62.8 Ų | 62.8 | 29% | 0.288 | 34% | 0.339 | S | S | . | . | trans | -120.9 | 159.9 | 178 | 63.9 | 0 | 0 | 0 | 0 | 109.2 | C147 A179 K180 L181 | C147-T177 VanDerWaalsContact SG-CA 3.55Å; T177-A179 PolarHBondContact O-N 3.34Å; T177-K180 WeakPolarHBondContact O-CB 3.38Å; T177-K180 PolarHBondContact O-N 3.05Å; T177-K180 PolarHBondContact OG1-N 2.89Å; T177-L181 PolarHBondContact O-N 3.44Å; T177-L181 VanDerWaalsContact O-N 3.1Å | ||
| 178 | I | 95.4 | Very high | 91.5 | Very high | 67 Ų | 67 | 62.6 Ų | 62.6 | 34% | 0.344 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -54.6 | -39.2 | 175.7 | -70 | 178.3 | 0 | 0 | 0 | 110.7 | K146 C147 F150 K180 L181 V182 | K146-I178 HydrophobicContact CB-CD1 3.9Å; K146-I178 HydrophobicContact CB-CG1 4.28Å; C147-I178 PolarHBondContact SG-N 2.97Å; C147-I178 VanDerWaalsContact SG-N 3.42Å; F150-I178 HydrophobicContact CB-CD1 4.31Å; F150-I178 HydrophobicContact CB-CG1 4.14Å; F150-I178 HydrophobicContact CD2-CG2 3.86Å; F150-I178 HydrophobicContact CE2-CG2 4.2Å; F150-I178 HydrophobicContact CG-CG2 4.3Å; I178-K180 PolarHBondContact O-N 3.23Å; I178-L181 WeakPolarHBondContact O-CB 3.05Å; I178-L181 PolarHBondContact O-N 2.78Å; I178-L181 VanDerWaalsContact O-N 3.08Å; I178-V182 HydrophobicContact CG2-CG2 4.13Å; I178-V182 WeakPolarHBondContact O-CG2 3.33Å; I178-V182 PolarHBondContact O-N 3.25Å |
| 179 | A | 97 | Very high | 91.9 | Very high | 61 Ų | 61 | 64.5 Ų | 64.5 | 50% | 0.504 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -56.3 | -47.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | T177 L181 V182 D183 | T177-A179 PolarHBondContact O-N 3.34Å; A179-L181 VanDerWaalsContact C-N 3.29Å; A179-L181 PolarHBondContact O-N 2.77Å; A179-V182 PolarHBondContact O-N 2.99Å; A179-D183 PolarHBondContact O-N 3Å |
| 180 | K | 96.8 | Very high | 92.2 | Very high | 83 Ų | 83 | 66.6 Ų | 66.6 | 36% | 0.361 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.3 | -35.4 | 175.7 | -70.4 | 177.6 | 173.7 | -179.1 | 0 | 112.8 | E173 N175 V176 T177 I178 E184 | E173-K180 IonicContact OE2-NZ 2.81Å; N175-K180 PolarHBondContact O-NZ 3.16Å; N175-K180 VanDerWaalsContact O-NZ 3.08Å; V176-K180 HydrophobicContact CG2-CB 4.2Å; V176-K180 HydrophobicContact CG2-CD 4.46Å; T177-K180 WeakPolarHBondContact O-CB 3.38Å; T177-K180 PolarHBondContact O-N 3.05Å; T177-K180 PolarHBondContact OG1-N 2.89Å; I178-K180 PolarHBondContact O-N 3.23Å; K180-E184 WeakPolarHBondContact O-CB 3.43Å; K180-E184 PolarHBondContact O-N 3.37Å |
| 181 | L | 95.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 69.7 Ų | 69.7 | 0% | 0 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -68.2 | -41.1 | 175.3 | -62.7 | -169.2 | 0 | 0 | 0 | 111.6 | C147 F150 V151 L166 K169 I170 V176 T177 I178 A179 D183 E184 C185 | C147-L181 HydrophobicContact CB-CD1 3.64Å; C147-L181 HydrophobicContact CB-CG 4.47Å; F150-L181 HydrophobicContact CD1-CB 4Å; F150-L181 HydrophobicContact CD1-CD1 3.74Å; F150-L181 HydrophobicContact CE1-CB 3.91Å; F150-L181 HydrophobicContact CE1-CD1 4.44Å; F150-L181 HydrophobicContact CG-CD1 4.49Å; V151-L181 HydrophobicContact CG2-CD1 4.01Å; L166-L181 HydrophobicContact CB-CD2 4.36Å; L166-L181 HydrophobicContact CD2-CB 4.31Å; L166-L181 HydrophobicContact CD2-CD2 3.99Å; K169-L181 HydrophobicContact CD-CD2 4.16Å; I170-L181 HydrophobicContact CD1-CD1 4.22Å; I170-L181 HydrophobicContact CG1-CD2 4.32Å; V176-L181 HydrophobicContact CG2-CD2 3.53Å; V176-L181 HydrophobicContact CG2-CG 4.05Å; T177-L181 PolarHBondContact O-N 3.44Å; T177-L181 VanDerWaalsContact O-N 3.1Å; I178-L181 WeakPolarHBondContact O-CB 3.05Å; I178-L181 PolarHBondContact O-N 2.78Å; I178-L181 VanDerWaalsContact O-N 3.08Å; A179-L181 VanDerWaalsContact C-N 3.29Å; A179-L181 PolarHBondContact O-N 2.77Å; L181-D183 VanDerWaalsContact C-N 3.33Å; L181-E184 PolarHBondContact O-N 2.96Å; L181-C185 PolarHBondContact O-N 2.88Å; L181-C185 PolarHBondContact O-SG 3.36Å |
| 182 | V | 97.1 | Very high | 93.2 | Very high | 52 Ų | 52 | 68.8 Ų | 68.8 | 32% | 0.315 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.1 | -42.6 | 175.6 | 170.8 | 0 | 0 | 0 | 0 | 110.6 | F150 I178 A179 C185 N186 | F150-V182 HydrophobicContact CE2-CG2 3.85Å; F150-V182 HydrophobicContact CZ-CG2 3.68Å; I178-V182 HydrophobicContact CG2-CG2 4.13Å; I178-V182 WeakPolarHBondContact O-CG2 3.33Å; I178-V182 PolarHBondContact O-N 3.25Å; A179-V182 PolarHBondContact O-N 2.99Å; V182-C185 WeakPolarHBondContact O-CB 3.23Å; V182-C185 PolarHBondContact O-N 2.77Å; V182-N186 VanDerWaalsContact O-CG 3.28Å; V182-N186 PolarHBondContact O-N 3.23Å; V182-N186 PolarHBondContact O-ND2 3.02Å; V182-N186 VanDerWaalsContact O-ND2 3.12Å |
| 183 | D | 97.5 | Very high | 93.4 | Very high | 105 Ų | 105 | 70.5 Ų | 70.5 | 56% | 0.561 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -60.8 | -44.6 | 175.1 | -68.5 | -24.8 | 0 | 0 | 0 | 111.6 | A179 L181 N186 H187 | A179-D183 PolarHBondContact O-N 3Å; L181-D183 VanDerWaalsContact C-N 3.33Å; D183-N186 PolarHBondContact O-N 3.43Å; D183-H187 WeakPolarHBondContact O-CB 3.23Å; D183-H187 PolarHBondContact O-N 3.3Å |
| 184 | E | 96.2 | Very high | 93.7 | Very high | 47 Ų | 47 | 72 Ų | 72 | 22% | 0.22 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.3 | -44.1 | 175.3 | -169.1 | 73 | -143.7 | 0 | 0 | 111.4 | L166 K169 K180 L181 N186 H187 L188 | L166-E184 HydrophobicContact CD2-CB 3.92Å; L166-E184 HydrophobicContact CD2-CG 3.88Å; K169-E184 HydrophobicContact CD-CB 4.28Å; K169-E184 HydrophobicContact CD-CG 4.14Å; K169-E184 IonicContact NZ-OE2 3.61Å; K169-E184 PolarHBondContact NZ-OE2 3.41Å; K180-E184 WeakPolarHBondContact O-CB 3.43Å; K180-E184 PolarHBondContact O-N 3.37Å; L181-E184 PolarHBondContact O-N 2.96Å; E184-N186 VanDerWaalsContact C-N 3.33Å; E184-N186 PolarHBondContact O-N 3.44Å; E184-H187 PolarHBondContact O-N 2.92Å; E184-L188 HydrophobicContact CG-CD1 4.26Å; E184-L188 WeakPolarHBondContact O-CB 3.48Å; E184-L188 VanDerWaalsContact O-CG 3.23Å; E184-L188 WeakPolarHBondContact O-CG 3.25Å; E184-L188 PolarHBondContact O-N 3.44Å |
| 185 | C | 95.5 | Very high | 94.3 | Very high | 25 Ų | 25 | 71 Ų | 71 | 17% | 0.169 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -57.5 | -46.1 | 174.6 | -72.2 | 0 | 0 | 0 | 0 | 111.9 | L181 V182 L188 R189 | L181-C185 PolarHBondContact O-N 2.88Å; L181-C185 PolarHBondContact O-SG 3.36Å; V182-C185 WeakPolarHBondContact O-CB 3.23Å; V182-C185 PolarHBondContact O-N 2.77Å; C185-L188 PolarHBondContact O-N 3.29Å; C185-R189 WeakPolarHBondContact O-CB 3.5Å; C185-R189 PolarHBondContact O-N 2.87Å |
| 186 | N | 95.8 | Very high | 94.4 | Very high | 50 Ų | 50 | 68.5 Ų | 68.5 | 27% | 0.267 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.9 | -42 | 178.4 | -71 | -37.9 | 0 | 0 | 0 | 111.3 | V182 D183 E184 R189 N190 | V182-N186 VanDerWaalsContact O-CG 3.28Å; V182-N186 PolarHBondContact O-N 3.23Å; V182-N186 PolarHBondContact O-ND2 3.02Å; V182-N186 VanDerWaalsContact O-ND2 3.12Å; D183-N186 PolarHBondContact O-N 3.43Å; E184-N186 VanDerWaalsContact C-N 3.33Å; E184-N186 PolarHBondContact O-N 3.44Å; N186-R189 PolarHBondContact O-N 3.09Å; N186-R189 PolarHBondContact OD1-NH1 3.17Å; N186-R189 PolarHBondContact OD1-NH2 2.89Å; N186-N190 PolarHBondContact O-N 3.3Å; N186-N190 PolarHBondContact O-ND2 2.65Å; N186-N190 PolarHBondContact O-OD1 3.41Å |
| 187 | H | 96.5 | Very high | 94.4 | Very high | 110 Ų | 110 | 73.9 Ų | 73.9 | 51% | 0.509 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.1 | -46.8 | 175.4 | 178.5 | 63.3 | 0 | 0 | 0 | 111.7 | D183 E184 R189 N190 L191 | D183-H187 WeakPolarHBondContact O-CB 3.23Å; D183-H187 PolarHBondContact O-N 3.3Å; E184-H187 PolarHBondContact O-N 2.92Å; H187-R189 VanDerWaalsContact C-N 3.34Å; H187-R189 PolarHBondContact O-N 3.01Å; H187-N190 PolarHBondContact O-N 3.44Å; H187-L191 WeakPolarHBondContact O-CB 3.37Å; H187-L191 PolarHBondContact O-N 3.25Å |
| 188 | L | 94.8 | Very high | 94 | Very high | 18 Ų | 18 | 76.2 Ų | 76.2 | 9% | 0.094 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63.7 | -38.7 | 177.6 | -68.6 | 173.8 | 0 | 0 | 0 | 112.7 | V162 K165 E184 C185 K192 | V162-L188 HydrophobicContact CG1-CD1 4.23Å; V162-L188 HydrophobicContact CG2-CD1 4.33Å; K165-L188 HydrophobicContact CB-CD1 4.16Å; K165-L188 HydrophobicContact CD-CD1 3.72Å; K165-L188 HydrophobicContact CD-CD2 3.43Å; K165-L188 VanDerWaalsContact CD-CD2 3.43Å; K165-L188 HydrophobicContact CD-CG 4.23Å; E184-L188 HydrophobicContact CG-CD1 4.26Å; E184-L188 WeakPolarHBondContact O-CB 3.48Å; E184-L188 VanDerWaalsContact O-CG 3.23Å; E184-L188 WeakPolarHBondContact O-CG 3.25Å; E184-L188 PolarHBondContact O-N 3.44Å; C185-L188 PolarHBondContact O-N 3.29Å; L188-K192 PolarHBondContact O-N 3.34Å |
| 189 | R | 93 | Very high | 93.5 | Very high | 123 Ų | 123 | 79 Ų | 79 | 46% | 0.464 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.1 | -47.2 | 175.6 | -176.4 | 179.9 | 67.6 | -126.4 | -6.1 | 111.3 | C185 N186 H187 L191 K192 Y193 | C185-R189 WeakPolarHBondContact O-CB 3.5Å; C185-R189 PolarHBondContact O-N 2.87Å; N186-R189 PolarHBondContact O-N 3.09Å; N186-R189 PolarHBondContact OD1-NH1 3.17Å; N186-R189 PolarHBondContact OD1-NH2 2.89Å; H187-R189 VanDerWaalsContact C-N 3.34Å; H187-R189 PolarHBondContact O-N 3.01Å; R189-L191 VanDerWaalsContact C-N 3.35Å; R189-L191 PolarHBondContact O-N 2.92Å; R189-K192 WeakPolarHBondContact O-CB 3.22Å; R189-K192 PolarHBondContact O-N 3.43Å; R189-Y193 HydrophobicContact CG-CD2 3.94Å; R189-Y193 HydrophobicContact CG-CE2 3.49Å; R189-Y193 VanDerWaalsContact CG-CE2 3.49Å; R189-Y193 WeakPolarHBondContact O-CD2 3.49Å; R189-Y193 PolarHBondContact O-N 3.03Å; R189-Y193 VanDerWaalsContact O-N 3.13Å |
| 190 | N | 93.7 | Very high | 92.8 | Very high | 83 Ų | 83 | 83.2 Ų | 83.2 | 44% | 0.444 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -62.7 | -43.5 | 178.3 | -66.4 | -10 | 0 | 0 | 0 | 111.1 | N186 H187 K192 Y193 D194 | N186-N190 PolarHBondContact O-N 3.3Å; N186-N190 PolarHBondContact O-ND2 2.65Å; N186-N190 PolarHBondContact O-OD1 3.41Å; H187-N190 PolarHBondContact O-N 3.44Å; N190-K192 VanDerWaalsContact C-N 3.27Å; N190-K192 PolarHBondContact O-N 3.05Å; N190-Y193 PolarHBondContact O-N 2.95Å; N190-Y193 VanDerWaalsContact O-N 3.14Å; N190-D194 PolarHBondContact O-N 2.78Å |
| 191 | L | 93.8 | Very high | 92 | Very high | 81 Ų | 81 | 83.6 Ų | 83.6 | 42% | 0.424 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.9 | -37.9 | 177 | -174.7 | 65 | 0 | 0 | 0 | 112.4 | H187 R189 T195 | H187-L191 WeakPolarHBondContact O-CB 3.37Å; H187-L191 PolarHBondContact O-N 3.25Å; R189-L191 VanDerWaalsContact C-N 3.35Å; R189-L191 PolarHBondContact O-N 2.92Å; L191-T195 WeakPolarHBondContact O-CB 3.11Å; L191-T195 PolarHBondContact O-N 3.12Å; L191-T195 PolarHBondContact O-OG1 3.12Å |
| 192 | K | 91.5 | Very high | 90.6 | Very high | 125 Ų | 125 | 87.2 Ų | 87.2 | 54% | 0.543 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.9 | -48.5 | 174.4 | 179.9 | 178.8 | 174.3 | -176.1 | 0 | 111.2 | L188 R189 N190 D194 T195 E196 | L188-K192 PolarHBondContact O-N 3.34Å; R189-K192 WeakPolarHBondContact O-CB 3.22Å; R189-K192 PolarHBondContact O-N 3.43Å; N190-K192 VanDerWaalsContact C-N 3.27Å; N190-K192 PolarHBondContact O-N 3.05Å; K192-D194 PolarHBondContact O-N 3.15Å; K192-T195 WeakPolarHBondContact O-CB 3.45Å; K192-T195 PolarHBondContact O-N 3.25Å; K192-E196 WeakPolarHBondContact CE-OE1 3.26Å; K192-E196 WeakPolarHBondContact O-CG 3.41Å; K192-E196 PolarHBondContact O-N 3.05Å |
| 193 | Y | 91.2 | Very high | 88.6 | Confident | 139 Ų | 139 | 87.5 Ų | 87.5 | 55% | 0.545 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.3 | -43.9 | 177 | -73.8 | -59 | 0 | 0 | 0 | 112.7 | R189 N190 T195 E196 M197 | R189-Y193 HydrophobicContact CG-CD2 3.94Å; R189-Y193 HydrophobicContact CG-CE2 3.49Å; R189-Y193 VanDerWaalsContact CG-CE2 3.49Å; R189-Y193 WeakPolarHBondContact O-CD2 3.49Å; R189-Y193 PolarHBondContact O-N 3.03Å; R189-Y193 VanDerWaalsContact O-N 3.13Å; N190-Y193 PolarHBondContact O-N 2.95Å; N190-Y193 VanDerWaalsContact O-N 3.14Å; Y193-T195 VanDerWaalsContact C-N 3.3Å; Y193-T195 PolarHBondContact O-N 3.19Å; Y193-E196 PolarHBondContact O-N 3.12Å; Y193-M197 PolarHBondContact O-N 2.81Å |
| 194 | D | 92.2 | Very high | 86.5 | Confident | 88 Ų | 88 | 87.1 Ų | 87.1 | 47% | 0.471 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.5 | -39.7 | 178.1 | -68.3 | -22.7 | 0 | 0 | 0 | 111.6 | N190 K192 M197 V198 | N190-D194 PolarHBondContact O-N 2.78Å; K192-D194 PolarHBondContact O-N 3.15Å; D194-M197 PolarHBondContact O-N 3.25Å; D194-V198 WeakPolarHBondContact O-CG2 3.48Å; D194-V198 PolarHBondContact O-N 2.97Å; D194-V198 VanDerWaalsContact O-N 3.09Å |
| 195 | T | 91.7 | Very high | 84.4 | Confident | 65 Ų | 65 | 91.6 Ų | 91.6 | 40% | 0.399 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 176.9 | -57.4 | 0 | 0 | 0 | 0 | 111.3 | L191 K192 Y193 V198 Q199 | L191-T195 WeakPolarHBondContact O-CB 3.11Å; L191-T195 PolarHBondContact O-N 3.12Å; L191-T195 PolarHBondContact O-OG1 3.12Å; K192-T195 WeakPolarHBondContact O-CB 3.45Å; K192-T195 PolarHBondContact O-N 3.25Å; Y193-T195 VanDerWaalsContact C-N 3.3Å; Y193-T195 PolarHBondContact O-N 3.19Å; T195-V198 PolarHBondContact O-N 3.3Å; T195-Q199 VanDerWaalsContact O-CG 3.29Å; T195-Q199 WeakPolarHBondContact O-CG 3.36Å; T195-Q199 PolarHBondContact O-N 3.48Å |
| 196 | E | 91.5 | Very high | 81.9 | Confident | 70 Ų | 70 | 95.2 Ų | 95.2 | 33% | 0.327 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.8 | -39.9 | 177.8 | -71 | 171.9 | -173.7 | 0 | 0 | 111.7 | K192 Y193 Q199 Q200 | K192-E196 WeakPolarHBondContact CE-OE1 3.26Å; K192-E196 WeakPolarHBondContact O-CG 3.41Å; K192-E196 PolarHBondContact O-N 3.05Å; Y193-E196 PolarHBondContact O-N 3.12Å; E196-Q199 PolarHBondContact O-N 3.37Å; E196-Q200 WeakPolarHBondContact O-CG 3.29Å; E196-Q200 PolarHBondContact O-N 3.25Å |
| 197 | M | 89.1 | Confident | 79.4 | Confident | 112 Ų | 112 | 100.8 Ų | 100.8 | 55% | 0.552 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.5 | -43 | 177 | -177.6 | 178.4 | 62.1 | 0 | 0 | 112.4 | Y193 D194 S201 | Y193-M197 PolarHBondContact O-N 2.81Å; D194-M197 PolarHBondContact O-N 3.25Å; M197-S201 PolarHBondContact O-N 3.04Å; M197-S201 PolarHBondContact O-OG 2.91Å |
| 198 | V | 87.5 | Confident | 76.8 | Confident | 96 Ų | 96 | 102.4 Ų | 102.4 | 58% | 0.582 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -67.2 | -40.4 | 176.7 | 173.5 | 0 | 0 | 0 | 0 | 111.2 | D194 T195 S201 A202 | D194-V198 WeakPolarHBondContact O-CG2 3.48Å; D194-V198 PolarHBondContact O-N 2.97Å; D194-V198 VanDerWaalsContact O-N 3.09Å; T195-V198 PolarHBondContact O-N 3.3Å; V198-S201 PolarHBondContact O-N 3.06Å; V198-A202 PolarHBondContact O-N 3.05Å; V198-A202 VanDerWaalsContact O-N 3.13Å |
| 199 | Q | 85.4 | Confident | 74.5 | Confident | 126 Ų | 126 | 108.4 Ų | 108.4 | 59% | 0.589 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.6 | -41.3 | 178.1 | -75.2 | 174.9 | -6.2 | 0 | 0 | 112.7 | T195 E196 S201 A202 G203 | T195-Q199 VanDerWaalsContact O-CG 3.29Å; T195-Q199 WeakPolarHBondContact O-CG 3.36Å; T195-Q199 PolarHBondContact O-N 3.48Å; E196-Q199 PolarHBondContact O-N 3.37Å; Q199-S201 PolarHBondContact O-N 2.89Å; Q199-A202 PolarHBondContact O-N 3.07Å; Q199-G203 PolarHBondContact O-N 3.09Å |
| 200 | Q | 81.7 | Confident | 72.1 | Confident | 149 Ų | 149 | 109.2 Ų | 109.2 | 70% | 0.696 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62.4 | -34.4 | 175.3 | -72.2 | 174 | 29.8 | 0 | 0 | 112.1 | E196 | E196-Q200 WeakPolarHBondContact O-CG 3.29Å; E196-Q200 PolarHBondContact O-N 3.25Å |
| 201 | S | 79.4 | Confident | 69.7 | Low | 92 Ų | 92 | 113.3 Ų | 113.3 | 64% | 0.643 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -75.1 | -23.7 | 178.5 | -53.1 | 0 | 0 | 0 | 0 | 113.3 | M197 V198 Q199 | M197-S201 PolarHBondContact O-N 3.04Å; M197-S201 PolarHBondContact O-OG 2.91Å; V198-S201 PolarHBondContact O-N 3.06Å; Q199-S201 PolarHBondContact O-N 2.89Å |
| 202 | A | 66.6 | Low | 67.1 | Low | 76 Ų | 76 | 115.6 Ų | 115.6 | 63% | 0.628 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -93.4 | -21.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | V198 Q199 S204 | V198-A202 PolarHBondContact O-N 3.05Å; V198-A202 VanDerWaalsContact O-N 3.13Å; Q199-A202 PolarHBondContact O-N 3.07Å; A202-S204 VanDerWaalsContact C-N 3.28Å; A202-S204 PolarHBondContact O-N 2.9Å |
| 203 | G | 55.7 | Low | 64.7 | Low | 57 Ų | 57 | 114.1 Ų | 114.1 | 59% | 0.588 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -77.8 | -3 | -175.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q199 | Q199-G203 PolarHBondContact O-N 3.09Š|
| 204 | S | 53.2 | Low | 62.2 | Low | 97 Ų | 97 | 112 Ų | 112 | 68% | 0.678 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -106.2 | 51.1 | 174.4 | 59.2 | 0 | 0 | 0 | 0 | 112.2 | A202 | A202-S204 VanDerWaalsContact C-N 3.28Å; A202-S204 PolarHBondContact O-N 2.9Å |
| 205 | D | 51.9 | Low | 59.7 | Low | 142 Ų | 142 | 117.6 Ų | 117.6 | 76% | 0.759 | 68% | 0.678 | S | S | * | * | trans | -170.1 | 91.1 | 141.2 | -136.9 | -20.2 | 0 | 0 | 0 | 112.9 | ||||
| 206 | P | 43.8 | Very low | 57.1 | Low | 101 Ų | 101 | 125.9 Ų | 125.9 | 66% | 0.656 | 70% | 0.702 | S | S | * | * | trans | -94.4 | 112 | 157.6 | -12 | 30 | 0 | 0 | 0 | 111.1 | ||||
| 207 | L | 42 | Very low | 54.3 | Low | 166 Ų | 166 | 129 Ų | 129 | 87% | 0.869 | 72% | 0.721 | S | S | * | * | trans | 84.4 | 100.9 | 151.2 | -46.3 | 168.9 | 0 | 0 | 0 | 118.3 | ||||
| 208 | E | 42.2 | Very low | 52.2 | Low | 144 Ų | 144 | 129.8 Ų | 129.8 | 67% | 0.673 | 74% | 0.737 | S | S | * | * | -172 | 71.8 | 115 | -158.6 | -178.1 | 174.8 | 0 | 0 | 110.1 | K211 | E208-K211 IonicContact OE1-NZ 3.63Å; E208-K211 PolarHBondContact OE1-NZ 3.44Å | |||
| 209 | V | 46.5 | Very low | 49.7 | Very low | 144 Ų | 144 | 136.6 Ų | 136.6 | 87% | 0.873 | 75% | 0.753 | S | S | * | * | trans | -120.2 | 54.5 | 161.6 | -161.6 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 210 | D | 43.3 | Very low | 47.8 | Very low | 140 Ų | 140 | 135.3 Ų | 135.3 | 75% | 0.749 | 76% | 0.758 | S | S | * | * | trans | -129.4 | 67.3 | 157.1 | -160.7 | 26.9 | 0 | 0 | 0 | 109.9 | ||||
| 211 | K | 42.8 | Very low | 45.7 | Very low | 169 Ų | 169 | 133.7 Ų | 133.7 | 74% | 0.735 | 76% | 0.758 | S | S | * | * | trans | -137 | 60.2 | 151.1 | -78.8 | -171.4 | -174 | 122.5 | 0 | 109.1 | E208 A213 | E208-K211 IonicContact OE1-NZ 3.63Å; E208-K211 PolarHBondContact OE1-NZ 3.44Å; K211-A213 PolarHBondContact O-N 2.7Å | ||
| 212 | V | 40.3 | Very low | 43.6 | Very low | 129 Ų | 129 | 138.1 Ų | 138.1 | 78% | 0.782 | 77% | 0.766 | S | S | * | * | trans | -70.6 | 122.2 | 149.3 | 176 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 213 | A | 40.3 | Very low | 42.5 | Very low | 95 Ų | 95 | 140.4 Ų | 140.4 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | 95.2 | 76.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 117.6 | K211 | K211-A213 PolarHBondContact O-N 2.7Š| ||
| 214 | A | 38.9 | Very low | 41.9 | Very low | 95 Ų | 95 | 144.6 Ų | 144.6 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | -163.4 | 121.8 | 123.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 215 | K | 39 | Very low | 41 | Very low | 204 Ų | 204 | 146.2 Ų | 146.2 | 89% | 0.887 | 79% | 0.787 | S | S | * | * | trans | 86.6 | 75.3 | 148.1 | -133.7 | 156.3 | -175.3 | 173 | 0 | 119.3 | ||||
| 216 | R | 38 | Very low | 40.5 | Very low | 239 Ų | 239 | 145.4 Ų | 145.4 | 90% | 0.902 | 78% | 0.782 | S | S | * | * | 27.4 | 119.2 | 113.8 | -125.2 | 177 | 175.5 | 139.7 | -2.1 | 117.4 | |||||
| 217 | N | 33 | Very low | 40.1 | Very low | 137 Ų | 137 | 151.2 Ų | 151.2 | 73% | 0.733 | 79% | 0.791 | S | S | * | * | trans | 76.1 | 91.4 | 138.5 | -164.6 | 61 | 0 | 0 | 0 | 119.1 | ||||
| 218 | S | 44.1 | Very low | 39.7 | Very low | 128 Ų | 128 | 148 Ų | 148 | 90% | 0.895 | 78% | 0.782 | S | S | * | * | trans | -136.7 | 95.6 | 141.2 | -75.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 219 | R | 36.5 | Very low | 39.9 | Very low | 239 Ų | 239 | 147.1 Ų | 147.1 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | trans | -73.7 | 115.8 | 163.8 | -172.1 | -176.9 | -153 | 159.5 | 4.2 | 107.3 | ||||
| 220 | S | 44.5 | Very low | 39.7 | Very low | 99 Ų | 99 | 147.7 Ų | 147.7 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | -155.3 | 109.3 | 159.3 | -160.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 221 | T | 37.9 | Very low | 40 | Very low | 115 Ų | 115 | 151.3 Ų | 151.3 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | trans | 57.5 | 90 | 140.7 | 54.6 | 0 | 0 | 0 | 0 | 119 | T223 | T221-T223 PolarHBondContact O-N 3.1Š| ||
| 222 | F | 35.7 | Very low | 39.8 | Very low | 184 Ų | 184 | 151.2 Ų | 151.2 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | trans | -60.9 | 103.8 | 147.7 | 178.4 | -102.4 | 0 | 0 | 0 | 109.6 | Q224 | F222-Q224 HydrophobicContact CD1-CB 4.26Å; F222-Q224 HydrophobicContact CE1-CB 3.85Å; F222-Q224 HydrophobicContact CE1-CG 4.37Å | ||
| 223 | T | 42 | Very low | 39.9 | Very low | 124 Ų | 124 | 151 Ų | 151 | 76% | 0.761 | 80% | 0.795 | S | S | * | * | trans | -89.7 | 102.4 | 165.2 | 44.6 | 0 | 0 | 0 | 0 | 108.7 | T221 | T221-T223 PolarHBondContact O-N 3.1Š| ||
| 224 | Q | 43.7 | Very low | 40.6 | Very low | 145 Ų | 145 | 155 Ų | 155 | 68% | 0.678 | 83% | 0.828 | S | S | * | * | trans | -63.1 | 125.6 | 169 | -177.8 | 174.3 | -30 | 0 | 0 | 110.2 | F222 D226 | F222-Q224 HydrophobicContact CD1-CB 4.26Å; F222-Q224 HydrophobicContact CE1-CB 3.85Å; F222-Q224 HydrophobicContact CE1-CG 4.37Å; Q224-D226 PolarHBondContact O-N 2.85Å | ||
| 225 | C | 34.4 | Very low | 40.7 | Very low | 132 Ų | 132 | 158 Ų | 158 | 89% | 0.892 | 83% | 0.83 | S | S | * | * | trans | -72.3 | 114.3 | 170.1 | -62.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 226 | D | 41.1 | Very low | 40.8 | Very low | 124 Ų | 124 | 155.6 Ų | 155.6 | 66% | 0.663 | 83% | 0.827 | S | S | * | * | trans | -99.5 | 137.9 | 179.2 | -154.8 | -15.2 | 0 | 0 | 0 | 111.4 | Q224 | Q224-D226 PolarHBondContact O-N 2.85Š| ||
| 227 | R | 35.6 | Very low | 41 | Very low | 223 Ų | 223 | 150.9 Ų | 150.9 | 84% | 0.842 | 82% | 0.822 | S | S | * | * | trans | 47.6 | 112.3 | 155 | -90.8 | 165.6 | -166.7 | -144.6 | -0.5 | 123.2 | ||||
| 228 | S | 34.8 | Very low | 41.4 | Very low | 98 Ų | 98 | 151.8 Ų | 151.8 | 69% | 0.685 | 83% | 0.828 | S | S | * | * | 12 | 142.9 | 116.3 | -146.9 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 229 | P | 46 | Very low | 41.3 | Very low | 126 Ų | 126 | 153.3 Ų | 153.3 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | -139.1 | 141.1 | 104.1 | 35.2 | -21.6 | 0 | 0 | 0 | 116.2 | |||||
| 230 | H | 41 | Very low | 41.6 | Very low | 157 Ų | 157 | 147.5 Ų | 147.5 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | trans | -24.7 | 140 | 155.4 | -86.4 | -78.9 | 0 | 0 | 0 | 118.1 | ||||
| 231 | K | 49.5 | Very low | 41.4 | Very low | 216 Ų | 216 | 151 Ų | 151 | 94% | 0.939 | 83% | 0.827 | S | S | * | * | trans | -134.6 | 119.9 | 134.6 | -113.5 | -177.6 | -178.9 | -173.1 | 0 | 110 | ||||
| 232 | Q | 39 | Very low | 41.6 | Very low | 166 Ų | 166 | 153.8 Ų | 153.8 | 78% | 0.776 | 84% | 0.837 | S | S | * | * | trans | -79.2 | 161.7 | 178.5 | -81 | 176.8 | -63.9 | 0 | 0 | 112.4 | ||||
| 233 | P | 42.9 | Very low | 42.1 | Very low | 126 Ų | 126 | 151.3 Ų | 151.3 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | trans | -92.4 | 152 | -179.4 | 36.4 | -32.1 | 0 | 0 | 0 | 113.4 | ||||
| 234 | A | 55.5 | Low | 42.1 | Very low | 178 Ų | 178 | 153.7 Ų | 153.7 | 100% | 1.471 | 85% | 0.846 | S | S | * | * | trans | -144.5 | 0 | 149.3 | 0 | 0 | 0 | 0 | 0 | 107.4 |
Retrieved 234 of 234 residues in 84.6 ms
(Link to these results)