| 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 | 57 | Low | 83.9 | Confident | 201 Ų | 201 | 123 Ų | 123 | 99% | 0.99 | 63% | 0.632 | S | S | * | * | 0 | -43.7 | 0 | -118 | -179.3 | -159.9 | 0 | 0 | 110.8 | N3 L4 L5 | M1-N3 PolarHBondContact O-N 2.86Å; M1-L4 PolarHBondContact O-N 3.25Å; M1-L5 PolarHBondContact O-N 3.1Å | |||
| 2 | D | 69.7 | Low | 84.8 | Confident | 128 Ų | 128 | 121 Ų | 121 | 68% | 0.684 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -59.5 | -35.8 | -175.1 | -57.7 | -20.1 | 0 | 0 | 0 | 115.5 | L4 L5 Q6 | D2-L4 VanDerWaalsContact C-N 3.34Å; D2-L4 PolarHBondContact O-N 2.92Å; D2-L5 PolarHBondContact O-N 2.92Å; D2-Q6 PolarHBondContact O-N 3.23Å |
| 3 | N | 79.5 | Confident | 85.4 | Confident | 134 Ų | 134 | 122.9 Ų | 122.9 | 72% | 0.717 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -61.1 | -38.2 | 176.5 | -88.2 | -0.9 | 0 | 0 | 0 | 113.5 | M1 Q6 E7 | M1-N3 PolarHBondContact O-N 2.86Å; N3-Q6 PolarHBondContact O-N 3.45Å; N3-E7 WeakPolarHBondContact O-CB 3.5Å; N3-E7 PolarHBondContact O-N 2.89Å |
| 4 | L | 83.5 | Confident | 85.9 | Confident | 125 Ų | 125 | 123.4 Ų | 123.4 | 65% | 0.654 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -71.9 | -35.2 | 179.7 | -78.6 | 164.8 | 0 | 0 | 0 | 111.7 | M1 D2 N8 | M1-L4 PolarHBondContact O-N 3.25Å; D2-L4 VanDerWaalsContact C-N 3.34Å; D2-L4 PolarHBondContact O-N 2.92Å; L4-N8 VanDerWaalsContact O-CB 3.25Å; L4-N8 WeakPolarHBondContact O-CB 3.3Å; L4-N8 PolarHBondContact O-N 3.31Å |
| 5 | L | 86.9 | Confident | 86.5 | Confident | 120 Ų | 120 | 121.4 Ų | 121.4 | 63% | 0.628 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -66.1 | -42.1 | 174.6 | -88.7 | 156.2 | 0 | 0 | 0 | 111.4 | M1 D2 N8 H9 | M1-L5 PolarHBondContact O-N 3.1Å; D2-L5 PolarHBondContact O-N 2.92Å; L5-N8 PolarHBondContact O-N 3.42Å; L5-H9 WeakPolarHBondContact O-CB 3.41Å; L5-H9 PolarHBondContact O-N 3.14Å |
| 6 | Q | 87 | Confident | 87 | Confident | 141 Ų | 141 | 121.6 Ų | 121.6 | 66% | 0.659 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -68.5 | -39.9 | 177.7 | -166.3 | 173.5 | 2 | 0 | 0 | 112.2 | D2 N3 H9 S10 | D2-Q6 PolarHBondContact O-N 3.23Å; N3-Q6 PolarHBondContact O-N 3.45Å; Q6-H9 PolarHBondContact O-N 3.43Å; Q6-S10 WeakPolarHBondContact O-CB 3.35Å; Q6-S10 PolarHBondContact O-N 3.06Å |
| 7 | E | 90.2 | Very high | 87.4 | Confident | 114 Ų | 114 | 120.2 Ų | 120.2 | 53% | 0.533 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -64 | -44.5 | 173.9 | -174.1 | 175.6 | -169.5 | 0 | 0 | 111.6 | N3 H9 S10 L11 | N3-E7 WeakPolarHBondContact O-CB 3.5Å; N3-E7 PolarHBondContact O-N 2.89Å; E7-H9 PolarHBondContact O-N 3.36Å; E7-S10 WeakPolarHBondContact O-CB 3.32Å; E7-S10 PolarHBondContact O-N 2.69Å; E7-S10 VanDerWaalsContact O-N 3.14Å; E7-L11 HydrophobicContact CG-CD1 4.18Å; E7-L11 WeakPolarHBondContact O-CG 3.49Å; E7-L11 PolarHBondContact O-N 3Å |
| 8 | N | 91.9 | Very high | 87.8 | Confident | 96 Ų | 96 | 121.8 Ų | 121.8 | 51% | 0.513 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -62.1 | -43 | 177.4 | -161.6 | -55.8 | 0 | 0 | 0 | 111.4 | L4 L5 S10 L11 L12 | L4-N8 VanDerWaalsContact O-CB 3.25Å; L4-N8 WeakPolarHBondContact O-CB 3.3Å; L4-N8 PolarHBondContact O-N 3.31Å; L5-N8 PolarHBondContact O-N 3.42Å; N8-S10 VanDerWaalsContact C-N 3.33Å; N8-S10 PolarHBondContact O-N 3.22Å; N8-L11 PolarHBondContact O-N 2.97Å; N8-L12 WeakPolarHBondContact O-CG 3.42Å; N8-L12 PolarHBondContact O-N 3.38Å; N8-L12 WeakPolarHBondContact OD1-CD1 3.38Å |
| 9 | H | 91.5 | Very high | 88.1 | Confident | 132 Ų | 132 | 122.3 Ų | 122.3 | 61% | 0.611 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62.6 | -38.9 | 174 | -166.4 | -23.4 | 0 | 0 | 0 | 112.1 | L5 Q6 E7 K13 | L5-H9 WeakPolarHBondContact O-CB 3.41Å; L5-H9 PolarHBondContact O-N 3.14Å; Q6-H9 PolarHBondContact O-N 3.43Å; E7-H9 PolarHBondContact O-N 3.36Å; H9-K13 PolarHBondContact O-N 2.86Å; H9-K13 VanDerWaalsContact O-N 3.11Å |
| 10 | S | 91.9 | Very high | 88.4 | Confident | 63 Ų | 63 | 122.5 Ų | 122.5 | 44% | 0.441 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65.3 | -41.2 | 175.7 | -168 | 0 | 0 | 0 | 0 | 112.2 | Q6 E7 N8 K13 K14 | Q6-S10 WeakPolarHBondContact O-CB 3.35Å; Q6-S10 PolarHBondContact O-N 3.06Å; E7-S10 WeakPolarHBondContact O-CB 3.32Å; E7-S10 PolarHBondContact O-N 2.69Å; E7-S10 VanDerWaalsContact O-N 3.14Å; N8-S10 VanDerWaalsContact C-N 3.33Å; N8-S10 PolarHBondContact O-N 3.22Å; S10-K13 PolarHBondContact O-N 3.39Å; S10-K14 PolarHBondContact O-N 2.77Å |
| 11 | L | 94.3 | Very high | 88.7 | Confident | 99 Ų | 99 | 121 Ų | 121 | 52% | 0.518 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -66.7 | -42 | 177.3 | -73.8 | 171.3 | 0 | 0 | 0 | 112.1 | E7 N8 K13 K14 L15 | E7-L11 HydrophobicContact CG-CD1 4.18Å; E7-L11 WeakPolarHBondContact O-CG 3.49Å; E7-L11 PolarHBondContact O-N 3Å; N8-L11 PolarHBondContact O-N 2.97Å; L11-K13 VanDerWaalsContact C-N 3.34Å; L11-K13 PolarHBondContact O-N 3.36Å; L11-K14 PolarHBondContact O-N 2.83Å; L11-L15 WeakPolarHBondContact O-CB 3.22Å; L11-L15 PolarHBondContact O-N 2.81Å |
| 12 | L | 94.3 | Very high | 90.5 | Very high | 99 Ų | 99 | 117.5 Ų | 117.5 | 52% | 0.518 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -59.5 | -44.8 | 174.3 | -79.4 | 167.8 | 0 | 0 | 0 | 111.5 | N8 K14 L15 E16 | N8-L12 WeakPolarHBondContact O-CG 3.42Å; N8-L12 PolarHBondContact O-N 3.38Å; N8-L12 WeakPolarHBondContact OD1-CD1 3.38Å; L12-K14 PolarHBondContact O-N 3.5Å; L12-L15 WeakPolarHBondContact O-CB 3.38Å; L12-L15 PolarHBondContact O-N 3.38Å; L12-E16 WeakPolarHBondContact O-CB 3.29Å; L12-E16 PolarHBondContact O-N 2.87Å |
| 13 | K | 92.1 | Very high | 91.6 | Very high | 146 Ų | 146 | 114.2 Ų | 114.2 | 64% | 0.635 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.2 | -37.2 | 177.7 | -161.8 | 174.1 | -175.8 | 176.7 | 0 | 112.6 | H9 S10 L11 L17 | H9-K13 PolarHBondContact O-N 2.86Å; H9-K13 VanDerWaalsContact O-N 3.11Å; S10-K13 PolarHBondContact O-N 3.39Å; L11-K13 VanDerWaalsContact C-N 3.34Å; L11-K13 PolarHBondContact O-N 3.36Å; K13-L17 PolarHBondContact O-N 2.85Å; K13-L17 VanDerWaalsContact O-N 3.07Å |
| 14 | K | 93.2 | Very high | 92.3 | Very high | 130 Ų | 130 | 110.7 Ų | 110.7 | 57% | 0.565 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67.6 | -37.3 | 172.9 | -78.3 | -178.7 | -179.5 | 176.2 | 0 | 112.5 | S10 L11 L12 K18 | S10-K14 PolarHBondContact O-N 2.77Å; L11-K14 PolarHBondContact O-N 2.83Å; L12-K14 PolarHBondContact O-N 3.5Å; K14-K18 WeakPolarHBondContact O-CG 3.3Å; K14-K18 PolarHBondContact O-N 2.88Å |
| 15 | L | 94.1 | Very high | 92.8 | Very high | 93 Ų | 93 | 111.1 Ų | 111.1 | 49% | 0.487 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -65.5 | -42.5 | 176.6 | -174.4 | 74.5 | 0 | 0 | 0 | 110.8 | L11 L12 K18 K19 | L11-L15 WeakPolarHBondContact O-CB 3.22Å; L11-L15 PolarHBondContact O-N 2.81Å; L12-L15 WeakPolarHBondContact O-CB 3.38Å; L12-L15 PolarHBondContact O-N 3.38Å; L15-K18 PolarHBondContact O-N 3.41Å; L15-K19 WeakPolarHBondContact O-CG 3.47Å; L15-K19 PolarHBondContact O-N 2.9Å |
| 16 | E | 94.4 | Very high | 93.2 | Very high | 125 Ų | 125 | 110.5 Ų | 110.5 | 58% | 0.584 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.1 | -47.6 | 176.7 | -163.8 | 162.4 | -146.8 | 0 | 0 | 111.4 | L12 K18 K19 E20 | L12-E16 WeakPolarHBondContact O-CB 3.29Å; L12-E16 PolarHBondContact O-N 2.87Å; E16-K18 VanDerWaalsContact C-N 3.32Å; E16-K18 PolarHBondContact O-N 2.8Å; E16-K19 WeakPolarHBondContact O-CB 3.32Å; E16-K19 PolarHBondContact O-N 2.78Å; E16-K19 VanDerWaalsContact O-N 3.12Å; E16-E20 PolarHBondContact O-N 2.94Å |
| 17 | L | 94 | Very high | 93.5 | Very high | 98 Ų | 98 | 107.8 Ų | 107.8 | 51% | 0.513 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -59 | -40.3 | 174.2 | -175.7 | 68.3 | 0 | 0 | 0 | 112.6 | K13 K19 E20 M21 | K13-L17 PolarHBondContact O-N 2.85Å; K13-L17 VanDerWaalsContact O-N 3.07Å; L17-K19 VanDerWaalsContact C-N 3.35Å; L17-E20 PolarHBondContact O-N 3.5Å; L17-M21 WeakPolarHBondContact O-CG 3.33Å; L17-M21 PolarHBondContact O-N 3.1Å |
| 18 | K | 94.4 | Very high | 93.7 | Very high | 148 Ų | 148 | 107.3 Ų | 107.3 | 64% | 0.643 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.9 | -38 | 176.7 | -80.9 | -171.6 | 175.1 | -170.1 | 0 | 112.4 | K14 L15 E16 M21 E22 | K14-K18 WeakPolarHBondContact O-CG 3.3Å; K14-K18 PolarHBondContact O-N 2.88Å; L15-K18 PolarHBondContact O-N 3.41Å; E16-K18 VanDerWaalsContact C-N 3.32Å; E16-K18 PolarHBondContact O-N 2.8Å; K18-M21 PolarHBondContact O-N 3.31Å; K18-E22 WeakPolarHBondContact O-CB 3.41Å; K18-E22 PolarHBondContact O-N 3.32Å |
| 19 | K | 95.1 | Very high | 93.8 | Very high | 132 Ų | 132 | 106.8 Ų | 106.8 | 57% | 0.574 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.6 | -39.1 | 175.6 | -73.5 | 179.3 | 176.3 | -175.7 | 0 | 111.8 | L15 E16 L17 E22 A23 | L15-K19 WeakPolarHBondContact O-CG 3.47Å; L15-K19 PolarHBondContact O-N 2.9Å; E16-K19 WeakPolarHBondContact O-CB 3.32Å; E16-K19 PolarHBondContact O-N 2.78Å; E16-K19 VanDerWaalsContact O-N 3.12Å; L17-K19 VanDerWaalsContact C-N 3.35Å; K19-E22 PolarHBondContact O-N 2.89Å; K19-A23 WeakPolarHBondContact O-CB 3.21Å; K19-A23 PolarHBondContact O-N 2.65Å |
| 20 | E | 93.5 | Very high | 93.9 | Very high | 126 Ų | 126 | 107.1 Ų | 107.1 | 59% | 0.589 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.1 | -43.5 | 173.6 | -72.3 | 178.5 | 172.2 | 0 | 0 | 111.7 | E16 L17 A23 A24 | E16-E20 PolarHBondContact O-N 2.94Å; L17-E20 PolarHBondContact O-N 3.5Å; E20-A23 PolarHBondContact O-N 2.84Å; E20-A24 PolarHBondContact O-N 3.47Å |
| 21 | M | 93.5 | Very high | 94 | Very high | 92 Ų | 92 | 109.5 Ų | 109.5 | 45% | 0.453 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.2 | -41.7 | 175.6 | -72.4 | -172.7 | 70 | 0 | 0 | 112.6 | L17 K18 A23 A24 Y25 | L17-M21 WeakPolarHBondContact O-CG 3.33Å; L17-M21 PolarHBondContact O-N 3.1Å; K18-M21 PolarHBondContact O-N 3.31Å; M21-A23 VanDerWaalsContact C-N 3.34Å; M21-A24 PolarHBondContact O-N 3.46Å; M21-Y25 HydrophobicContact CE-CE2 4.17Å; M21-Y25 VanDerWaalsContact O-CD2 3.24Å; M21-Y25 WeakPolarHBondContact O-CD2 3.39Å; M21-Y25 PolarHBondContact O-N 2.81Å |
| 22 | E | 94.7 | Very high | 94 | Very high | 126 Ų | 126 | 109.6 Ų | 109.6 | 59% | 0.589 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.8 | -42.2 | 176.4 | -175.4 | 175.5 | -171.9 | 0 | 0 | 111.6 | K18 K19 A24 Y25 L26 | K18-E22 WeakPolarHBondContact O-CB 3.41Å; K18-E22 PolarHBondContact O-N 3.32Å; K19-E22 PolarHBondContact O-N 2.89Å; E22-A24 PolarHBondContact O-N 3.18Å; E22-Y25 PolarHBondContact O-N 3.43Å; E22-L26 HydrophobicContact CG-CD1 4.38Å; E22-L26 WeakPolarHBondContact O-CG 3.24Å; E22-L26 PolarHBondContact O-N 2.88Å |
| 23 | A | 94.3 | Very high | 94 | Very high | 59 Ų | 59 | 113.4 Ų | 113.4 | 49% | 0.488 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.5 | -41.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | K19 E20 M21 L26 D27 | K19-A23 WeakPolarHBondContact O-CB 3.21Å; K19-A23 PolarHBondContact O-N 2.65Å; E20-A23 PolarHBondContact O-N 2.84Å; M21-A23 VanDerWaalsContact C-N 3.34Å; A23-L26 PolarHBondContact O-N 3.33Å; A23-D27 PolarHBondContact O-N 3.29Å; A23-D27 VanDerWaalsContact O-N 3.09Å |
| 24 | A | 93.5 | Very high | 94 | Very high | 61 Ų | 61 | 110 Ų | 110 | 50% | 0.504 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.7 | -41.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | E20 M21 E22 D27 E28 | E20-A24 PolarHBondContact O-N 3.47Å; M21-A24 PolarHBondContact O-N 3.46Å; E22-A24 PolarHBondContact O-N 3.18Å; A24-D27 PolarHBondContact O-N 2.83Å; A24-E28 PolarHBondContact O-N 3.07Å |
| 25 | Y | 94.4 | Very high | 94.1 | Very high | 133 Ų | 133 | 107.4 Ų | 107.4 | 52% | 0.522 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -68.3 | -35.7 | 176.8 | -74 | -49.6 | 0 | 0 | 0 | 113 | M21 E22 E28 I29 | M21-Y25 HydrophobicContact CE-CE2 4.17Å; M21-Y25 VanDerWaalsContact O-CD2 3.24Å; M21-Y25 WeakPolarHBondContact O-CD2 3.39Å; M21-Y25 PolarHBondContact O-N 2.81Å; E22-Y25 PolarHBondContact O-N 3.43Å; Y25-E28 PolarHBondContact O-N 2.87Å; Y25-I29 VanDerWaalsContact O-CG1 3.25Å; Y25-I29 WeakPolarHBondContact O-CG1 3.2Å; Y25-I29 PolarHBondContact O-N 3.31Å |
| 26 | L | 95.3 | Very high | 94 | Very high | 107 Ų | 107 | 107.4 Ų | 107.4 | 56% | 0.56 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.5 | -39.8 | 175.4 | -73.9 | 171.1 | 0 | 0 | 0 | 111.7 | E22 A23 I29 E30 | E22-L26 HydrophobicContact CG-CD1 4.38Å; E22-L26 WeakPolarHBondContact O-CG 3.24Å; E22-L26 PolarHBondContact O-N 2.88Å; A23-L26 PolarHBondContact O-N 3.33Å; L26-I29 PolarHBondContact O-N 2.91Å; L26-E30 PolarHBondContact O-N 2.99Å |
| 27 | D | 94.1 | Very high | 94 | Very high | 84 Ų | 84 | 104.6 Ų | 104.6 | 45% | 0.449 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.7 | -43.6 | 174.5 | -169.1 | 60.3 | 0 | 0 | 0 | 111.7 | A23 A24 I29 E30 Q31 | A23-D27 PolarHBondContact O-N 3.29Å; A23-D27 VanDerWaalsContact O-N 3.09Å; A24-D27 PolarHBondContact O-N 2.83Å; D27-I29 VanDerWaalsContact C-N 3.35Å; D27-I29 PolarHBondContact O-N 2.74Å; D27-E30 PolarHBondContact O-N 2.88Å; D27-E30 VanDerWaalsContact O-N 3.16Å; D27-Q31 WeakPolarHBondContact O-CG 3.41Å; D27-Q31 PolarHBondContact O-N 3.18Å; D27-Q31 PolarHBondContact OD2-NE2 2.91Å |
| 28 | E | 93.8 | Very high | 93.9 | Very high | 105 Ų | 105 | 104.6 Ų | 104.6 | 49% | 0.491 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.3 | -41.5 | 176.1 | -173.2 | 176.9 | -166.7 | 0 | 0 | 112.2 | A24 Y25 E30 Q31 L32 | A24-E28 PolarHBondContact O-N 3.07Å; Y25-E28 PolarHBondContact O-N 2.87Å; E28-E30 VanDerWaalsContact C-N 3.31Å; E28-E30 PolarHBondContact O-N 2.89Å; E28-Q31 PolarHBondContact O-N 3.49Å; E28-L32 HydrophobicContact CG-CD1 4.4Å; E28-L32 WeakPolarHBondContact O-CG 3.4Å; E28-L32 PolarHBondContact O-N 3.39Å |
| 29 | I | 93 | Very high | 93.7 | Very high | 85 Ų | 85 | 102.4 Ų | 102.4 | 44% | 0.436 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.8 | -39.6 | 175.8 | -71.2 | 166.9 | 0 | 0 | 0 | 111 | Y25 L26 D27 R33 | Y25-I29 VanDerWaalsContact O-CG1 3.25Å; Y25-I29 WeakPolarHBondContact O-CG1 3.2Å; Y25-I29 PolarHBondContact O-N 3.31Å; L26-I29 PolarHBondContact O-N 2.91Å; D27-I29 VanDerWaalsContact C-N 3.35Å; D27-I29 PolarHBondContact O-N 2.74Å; I29-R33 WeakPolarHBondContact O-CG 3.29Å; I29-R33 PolarHBondContact O-N 2.91Å; I29-R33 VanDerWaalsContact O-N 3.09Å |
| 30 | E | 94.5 | Very high | 93.5 | Very high | 139 Ų | 139 | 102 Ų | 102 | 65% | 0.65 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -69.3 | -40.5 | 178.6 | -167 | 162.8 | -163.9 | 0 | 0 | 111.8 | L26 D27 E28 L32 R33 S34 | L26-E30 PolarHBondContact O-N 2.99Å; D27-E30 PolarHBondContact O-N 2.88Å; D27-E30 VanDerWaalsContact O-N 3.16Å; E28-E30 VanDerWaalsContact C-N 3.31Å; E28-E30 PolarHBondContact O-N 2.89Å; E30-L32 PolarHBondContact O-N 3.41Å; E30-R33 PolarHBondContact O-N 3.27Å; E30-S34 PolarHBondContact O-N 3.47Å |
| 31 | Q | 93.3 | Very high | 93.2 | Very high | 113 Ų | 113 | 103 Ų | 103 | 53% | 0.528 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.6 | -46.5 | 172.9 | -70.2 | 179.8 | 23.5 | 0 | 0 | 111.9 | D27 E28 R33 S34 V35 | D27-Q31 WeakPolarHBondContact O-CG 3.41Å; D27-Q31 PolarHBondContact O-N 3.18Å; D27-Q31 PolarHBondContact OD2-NE2 2.91Å; E28-Q31 PolarHBondContact O-N 3.49Å; Q31-R33 VanDerWaalsContact C-N 3.34Å; Q31-R33 PolarHBondContact O-N 2.96Å; Q31-S34 WeakPolarHBondContact O-CB 3.45Å; Q31-S34 PolarHBondContact O-N 2.98Å; Q31-V35 WeakPolarHBondContact O-CG2 3.33Å; Q31-V35 PolarHBondContact O-N 3.22Å |
| 32 | L | 93.6 | Very high | 92.7 | Very high | 101 Ų | 101 | 102.9 Ų | 102.9 | 53% | 0.529 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.7 | -38.8 | 178.2 | -73.5 | 171.2 | 0 | 0 | 0 | 112.5 | E28 E30 S34 V35 I36 | E28-L32 HydrophobicContact CG-CD1 4.4Å; E28-L32 WeakPolarHBondContact O-CG 3.4Å; E28-L32 PolarHBondContact O-N 3.39Å; E30-L32 PolarHBondContact O-N 3.41Å; L32-S34 VanDerWaalsContact C-N 3.33Å; L32-S34 PolarHBondContact O-N 2.89Å; L32-V35 PolarHBondContact O-N 3.2Å; L32-I36 WeakPolarHBondContact O-CG1 3.36Å; L32-I36 PolarHBondContact O-N 3.13Å |
| 33 | R | 95.5 | Very high | 92.2 | Very high | 178 Ų | 178 | 104.1 Ų | 104.1 | 67% | 0.672 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.4 | -38.7 | 174.7 | -75.7 | 176.5 | 175.4 | -168.9 | 0.3 | 112.2 | I29 E30 Q31 T37 | I29-R33 WeakPolarHBondContact O-CG 3.29Å; I29-R33 PolarHBondContact O-N 2.91Å; I29-R33 VanDerWaalsContact O-N 3.09Å; E30-R33 PolarHBondContact O-N 3.27Å; Q31-R33 VanDerWaalsContact C-N 3.34Å; Q31-R33 PolarHBondContact O-N 2.96Å; R33-T37 PolarHBondContact O-N 3.36Å; R33-T37 VanDerWaalsContact O-N 3.11Å; R33-T37 PolarHBondContact O-OG1 2.92Å |
| 34 | S | 92.6 | Very high | 91.4 | Very high | 75 Ų | 75 | 105.5 Ų | 105.5 | 52% | 0.524 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 175.2 | -172.4 | 0 | 0 | 0 | 0 | 111.6 | E30 Q31 L32 I36 T37 Q38 | E30-S34 PolarHBondContact O-N 3.47Å; Q31-S34 WeakPolarHBondContact O-CB 3.45Å; Q31-S34 PolarHBondContact O-N 2.98Å; L32-S34 VanDerWaalsContact C-N 3.33Å; L32-S34 PolarHBondContact O-N 2.89Å; S34-I36 PolarHBondContact O-N 3.38Å; S34-T37 PolarHBondContact O-N 2.9Å; S34-Q38 PolarHBondContact O-N 2.96Å |
| 35 | V | 93.9 | Very high | 90.4 | Very high | 75 Ų | 75 | 106 Ų | 106 | 46% | 0.455 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61 | -45.3 | 178.4 | 173.5 | 0 | 0 | 0 | 0 | 112 | Q31 L32 T37 Q38 L39 | Q31-V35 WeakPolarHBondContact O-CG2 3.33Å; Q31-V35 PolarHBondContact O-N 3.22Å; L32-V35 PolarHBondContact O-N 3.2Å; V35-T37 VanDerWaalsContact C-N 3.3Å; V35-T37 PolarHBondContact O-N 3.41Å; V35-Q38 PolarHBondContact O-N 2.99Å; V35-L39 HydrophobicContact CG1-CD1 3.96Å; V35-L39 HydrophobicContact CG1-CG 4.39Å; V35-L39 WeakPolarHBondContact O-CG 3.46Å; V35-L39 PolarHBondContact O-N 3.12Å |
| 36 | I | 93.3 | Very high | 88.9 | Confident | 93 Ų | 93 | 103.7 Ų | 103.7 | 48% | 0.477 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.2 | -43.7 | 177.6 | -70.5 | 169.7 | 0 | 0 | 0 | 110.7 | L32 S34 Q38 L39 Q40 | L32-I36 WeakPolarHBondContact O-CG1 3.36Å; L32-I36 PolarHBondContact O-N 3.13Å; S34-I36 PolarHBondContact O-N 3.38Å; I36-Q38 VanDerWaalsContact C-N 3.31Å; I36-Q38 PolarHBondContact O-N 2.93Å; I36-L39 PolarHBondContact O-N 3.39Å; I36-Q40 WeakPolarHBondContact O-CG 3.44Å; I36-Q40 PolarHBondContact O-N 2.9Å |
| 37 | T | 93.1 | Very high | 87.2 | Confident | 67 Ų | 67 | 101.8 Ų | 101.8 | 41% | 0.411 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.3 | -38.7 | 179.2 | -52.1 | 0 | 0 | 0 | 0 | 111.2 | R33 S34 V35 R41 | R33-T37 PolarHBondContact O-N 3.36Å; R33-T37 VanDerWaalsContact O-N 3.11Å; R33-T37 PolarHBondContact O-OG1 2.92Å; S34-T37 PolarHBondContact O-N 2.9Å; V35-T37 VanDerWaalsContact C-N 3.3Å; V35-T37 PolarHBondContact O-N 3.41Å; T37-R41 PolarHBondContact O-N 3.46Å; T37-R41 VanDerWaalsContact O-N 3.16Å |
| 38 | Q | 91.5 | Very high | 85.5 | Confident | 98 Ų | 98 | 103.2 Ų | 103.2 | 46% | 0.458 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.1 | -48.7 | 175.4 | -177.6 | 174.3 | -10.1 | 0 | 0 | 112.1 | S34 V35 I36 Q40 R41 E42 | S34-Q38 PolarHBondContact O-N 2.96Å; V35-Q38 PolarHBondContact O-N 2.99Å; I36-Q38 VanDerWaalsContact C-N 3.31Å; I36-Q38 PolarHBondContact O-N 2.93Å; Q38-Q40 VanDerWaalsContact C-N 3.29Å; Q38-Q40 PolarHBondContact O-N 3.14Å; Q38-R41 WeakPolarHBondContact O-CB 3.49Å; Q38-R41 PolarHBondContact O-N 3.38Å; Q38-E42 PolarHBondContact NE2-OE1 3.11Å; Q38-E42 VanDerWaalsContact NE2-OE1 3.09Å; Q38-E42 PolarHBondContact O-N 3.23Å |
| 39 | L | 91.4 | Very high | 83.6 | Confident | 102 Ų | 102 | 102 Ų | 102 | 53% | 0.534 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.2 | -37.1 | 179 | -73.6 | 171.9 | 0 | 0 | 0 | 112.4 | V35 I36 R41 K43 | V35-L39 HydrophobicContact CG1-CD1 3.96Å; V35-L39 HydrophobicContact CG1-CG 4.39Å; V35-L39 WeakPolarHBondContact O-CG 3.46Å; V35-L39 PolarHBondContact O-N 3.12Å; I36-L39 PolarHBondContact O-N 3.39Å; L39-R41 VanDerWaalsContact C-N 3.34Å; L39-K43 WeakPolarHBondContact O-CB 3.31Å; L39-K43 PolarHBondContact O-N 3.45Å |
| 40 | Q | 90.4 | Very high | 81.7 | Confident | 123 Ų | 123 | 105 Ų | 105 | 58% | 0.575 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64 | -41.3 | 174 | -76.3 | 178.2 | -16.4 | 0 | 0 | 111.8 | I36 Q38 K43 T44 | I36-Q40 WeakPolarHBondContact O-CG 3.44Å; I36-Q40 PolarHBondContact O-N 2.9Å; Q38-Q40 VanDerWaalsContact C-N 3.29Å; Q38-Q40 PolarHBondContact O-N 3.14Å; Q40-K43 PolarHBondContact O-N 2.95Å; Q40-T44 PolarHBondContact O-N 2.92Å; Q40-T44 PolarHBondContact O-OG1 2.98Å |
| 41 | R | 86.7 | Confident | 79.8 | Confident | 148 Ų | 148 | 103.4 Ų | 103.4 | 56% | 0.558 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.4 | -45.6 | 177.7 | -151 | -178.6 | -64 | 114.8 | -4.5 | 111.2 | T37 Q38 L39 K43 T44 S45 | T37-R41 PolarHBondContact O-N 3.46Å; T37-R41 VanDerWaalsContact O-N 3.16Å; Q38-R41 WeakPolarHBondContact O-CB 3.49Å; Q38-R41 PolarHBondContact O-N 3.38Å; L39-R41 VanDerWaalsContact C-N 3.34Å; R41-K43 PolarHBondContact O-N 2.9Å; R41-T44 WeakPolarHBondContact CA-OG1 3.47Å; R41-T44 PolarHBondContact O-N 3.4Å; R41-T44 PolarHBondContact O-OG1 3.08Å; R41-S45 PolarHBondContact O-N 2.94Å; R41-S45 PolarHBondContact O-OG 2.9Å; R41-S45 VanDerWaalsContact O-OG 3.14Å |
| 42 | E | 84.5 | Confident | 78.1 | Confident | 89 Ų | 89 | 103.8 Ų | 103.8 | 42% | 0.416 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.3 | -44.1 | 175.2 | -73.3 | 174.6 | -168.1 | 0 | 0 | 111.7 | Q38 T44 S45 I46 | Q38-E42 PolarHBondContact NE2-OE1 3.11Å; Q38-E42 VanDerWaalsContact NE2-OE1 3.09Å; Q38-E42 PolarHBondContact O-N 3.23Å; E42-T44 PolarHBondContact O-N 3.37Å; E42-S45 PolarHBondContact O-N 3.49Å; E42-I46 WeakPolarHBondContact O-CB 3.21Å; E42-I46 WeakPolarHBondContact O-CD1 3.42Å; E42-I46 VanDerWaalsContact O-CG1 3.22Å; E42-I46 WeakPolarHBondContact O-CG1 3.41Å; E42-I46 PolarHBondContact O-N 3.27Å |
| 43 | K | 83.1 | Confident | 76.5 | Confident | 152 Ų | 152 | 104.4 Ų | 104.4 | 66% | 0.661 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -57.3 | -47.5 | 175.4 | -176.2 | -178.2 | 177.7 | -177.9 | 0 | 111.6 | L39 Q40 R41 S47 | L39-K43 WeakPolarHBondContact O-CB 3.31Å; L39-K43 PolarHBondContact O-N 3.45Å; Q40-K43 PolarHBondContact O-N 2.95Å; R41-K43 PolarHBondContact O-N 2.9Å; K43-S47 PolarHBondContact O-N 3.3Å; K43-S47 VanDerWaalsContact O-N 3.09Å; K43-S47 PolarHBondContact O-OG 2.9Å; K43-S47 VanDerWaalsContact O-OG 3.11Å |
| 44 | T | 78.6 | Confident | 75.1 | Confident | 87 Ų | 87 | 100.5 Ų | 100.5 | 53% | 0.534 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.7 | -42.9 | 177.8 | 38.3 | 0 | 0 | 0 | 0 | 112.5 | Q40 R41 E42 I46 S47 T48 | Q40-T44 PolarHBondContact O-N 2.92Å; Q40-T44 PolarHBondContact O-OG1 2.98Å; R41-T44 WeakPolarHBondContact CA-OG1 3.47Å; R41-T44 PolarHBondContact O-N 3.4Å; R41-T44 PolarHBondContact O-OG1 3.08Å; E42-T44 PolarHBondContact O-N 3.37Å; T44-I46 VanDerWaalsContact C-N 3.35Å; T44-I46 PolarHBondContact O-N 2.88Å; T44-S47 PolarHBondContact O-N 2.94Å; T44-T48 PolarHBondContact O-N 3.47Å; T44-T48 VanDerWaalsContact O-N 3.12Å; T44-T48 PolarHBondContact O-OG1 3.11Å |
| 45 | S | 71.2 | Confident | 74 | Confident | 72 Ų | 72 | 100.1 Ų | 100.1 | 50% | 0.503 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 179.1 | -63.3 | 0 | 0 | 0 | 0 | 112.5 | R41 E42 S49 | R41-S45 PolarHBondContact O-N 2.94Å; R41-S45 PolarHBondContact O-OG 2.9Å; R41-S45 VanDerWaalsContact O-OG 3.14Å; E42-S45 PolarHBondContact O-N 3.49Å; S45-S49 PolarHBondContact O-N 2.9Å |
| 46 | I | 64.1 | Low | 73 | Confident | 85 Ų | 85 | 100.3 Ų | 100.3 | 44% | 0.436 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.1 | -39.5 | 177.2 | -66.3 | 164.8 | 0 | 0 | 0 | 110.9 | E42 T44 | E42-I46 WeakPolarHBondContact O-CB 3.21Å; E42-I46 WeakPolarHBondContact O-CD1 3.42Å; E42-I46 VanDerWaalsContact O-CG1 3.22Å; E42-I46 WeakPolarHBondContact O-CG1 3.41Å; E42-I46 PolarHBondContact O-N 3.27Å; T44-I46 VanDerWaalsContact C-N 3.35Å; T44-I46 PolarHBondContact O-N 2.88Å |
| 47 | S | 58.7 | Low | 72 | Confident | 66 Ų | 66 | 100.8 Ų | 100.8 | 46% | 0.462 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -70 | -33.7 | -178.8 | -66 | 0 | 0 | 0 | 0 | 113.6 | K43 T44 I51 | K43-S47 PolarHBondContact O-N 3.3Å; K43-S47 VanDerWaalsContact O-N 3.09Å; K43-S47 PolarHBondContact O-OG 2.9Å; K43-S47 VanDerWaalsContact O-OG 3.11Å; T44-S47 PolarHBondContact O-N 2.94Å; S47-I51 WeakPolarHBondContact O-CD1 3.37Å; S47-I51 VanDerWaalsContact O-CG1 3.31Å; S47-I51 WeakPolarHBondContact O-CG1 3.49Å |
| 48 | T | 59.3 | Low | 71.1 | Confident | 115 Ų | 115 | 102.4 Ų | 102.4 | 71% | 0.706 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -88.8 | -31.3 | -178.8 | 35.3 | 0 | 0 | 0 | 0 | 114.7 | T44 | T44-T48 PolarHBondContact O-N 3.47Å; T44-T48 VanDerWaalsContact O-N 3.12Å; T44-T48 PolarHBondContact O-OG1 3.11Å |
| 49 | S | 54.3 | Low | 70.4 | Confident | 78 Ų | 78 | 106.1 Ų | 106.1 | 55% | 0.545 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -89.8 | -21.7 | -174.6 | 109.6 | 0 | 0 | 0 | 0 | 114.4 | S45 | S45-S49 PolarHBondContact O-N 2.9Å |
| 50 | R | 51.7 | Low | 69.7 | Low | 149 Ų | 149 | 106.5 Ų | 106.5 | 56% | 0.562 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -91 | -16.9 | -174.6 | -72.7 | -169.7 | 178.9 | 179.2 | -2.3 | 114.9 | N54 | R50-N54 WeakPolarHBondContact O-CB 3.44Å; R50-N54 PolarHBondContact O-N 3.48Å; R50-N54 VanDerWaalsContact O-N 3.1Å; R50-N54 PolarHBondContact O-ND2 3.1Å |
| 51 | I | 54.9 | Low | 69.1 | Low | 105 Ų | 105 | 105 Ų | 105 | 54% | 0.538 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -70.6 | -40.9 | -173.2 | -64.4 | 176.8 | 0 | 0 | 0 | 110.7 | S47 S55 | S47-I51 WeakPolarHBondContact O-CD1 3.37Å; S47-I51 VanDerWaalsContact O-CG1 3.31Å; S47-I51 WeakPolarHBondContact O-CG1 3.49Å; I51-S55 WeakPolarHBondContact O-CB 3.47Å; I51-S55 PolarHBondContact O-N 2.94Å; I51-S55 VanDerWaalsContact O-N 3.15Å; I51-S55 PolarHBondContact O-OG 3.25Å |
| 52 | D | 57.6 | Low | 68.9 | Low | 122 Ų | 122 | 103.3 Ų | 103.3 | 65% | 0.652 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -72.4 | -41.2 | -178.7 | -76.1 | -14.5 | 0 | 0 | 0 | 112.8 | S55 S56 | D52-S55 PolarHBondContact O-N 3.22Å; D52-S56 PolarHBondContact O-N 3.41Å |
| 53 | D | 60.3 | Low | 68.9 | Low | 113 Ų | 113 | 100.5 Ų | 100.5 | 60% | 0.604 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68 | -39.9 | 177.9 | -72.2 | -14.5 | 0 | 0 | 0 | 112 | S55 L57 | D53-S55 VanDerWaalsContact C-N 3.27Å; D53-S55 PolarHBondContact O-N 2.92Å; D53-L57 PolarHBondContact O-N 2.87Å |
| 54 | N | 65.5 | Low | 69 | Low | 96 Ų | 96 | 101.9 Ų | 101.9 | 51% | 0.513 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67 | -31 | 177 | -76 | -14.1 | 0 | 0 | 0 | 112 | R50 L57 L58 | R50-N54 WeakPolarHBondContact O-CB 3.44Å; R50-N54 PolarHBondContact O-N 3.48Å; R50-N54 VanDerWaalsContact O-N 3.1Å; R50-N54 PolarHBondContact O-ND2 3.1Å; N54-L57 PolarHBondContact O-N 3.37Å; N54-L58 VanDerWaalsContact O-CB 3.25Å; N54-L58 WeakPolarHBondContact O-CB 3.38Å; N54-L58 PolarHBondContact O-N 3.45Å |
| 55 | S | 69.5 | Low | 69.2 | Low | 67 Ų | 67 | 101.2 Ų | 101.2 | 47% | 0.469 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65.9 | -43.9 | -179.6 | -59.5 | 0 | 0 | 0 | 0 | 111.6 | I51 D52 D53 L58 Y59 | I51-S55 WeakPolarHBondContact O-CB 3.47Å; I51-S55 PolarHBondContact O-N 2.94Å; I51-S55 VanDerWaalsContact O-N 3.15Å; I51-S55 PolarHBondContact O-OG 3.25Å; D52-S55 PolarHBondContact O-N 3.22Å; D53-S55 VanDerWaalsContact C-N 3.27Å; D53-S55 PolarHBondContact O-N 2.92Å; S55-L58 PolarHBondContact O-N 3.45Å; S55-Y59 PolarHBondContact O-N 3.31Å; S55-Y59 VanDerWaalsContact O-N 3.08Å |
| 56 | S | 72.7 | Confident | 69.9 | Low | 79 Ų | 79 | 103.6 Ų | 103.6 | 55% | 0.552 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.8 | -42.3 | 176.9 | -61.7 | 0 | 0 | 0 | 0 | 111.7 | D52 L58 Y59 D60 | D52-S56 PolarHBondContact O-N 3.41Å; S56-L58 VanDerWaalsContact C-N 3.32Å; S56-L58 PolarHBondContact O-N 3.4Å; S56-Y59 PolarHBondContact O-N 2.9Å; S56-D60 PolarHBondContact O-N 3.49Å |
| 57 | L | 73.7 | Confident | 71 | Confident | 104 Ų | 104 | 106.9 Ų | 106.9 | 55% | 0.545 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.6 | -36.2 | 177.7 | -121 | 152.2 | 0 | 0 | 0 | 112.5 | D53 N54 L61 | D53-L57 PolarHBondContact O-N 2.87Å; N54-L57 PolarHBondContact O-N 3.37Å; L57-L61 HydrophobicContact CD2-CD1 4.28Å; L57-L61 WeakPolarHBondContact O-CB 3.42Å; L57-L61 VanDerWaalsContact O-CG 3.27Å; L57-L61 WeakPolarHBondContact O-CG 3.42Å; L57-L61 PolarHBondContact O-N 3.34Å |
| 58 | L | 73.5 | Confident | 72 | Confident | 101 Ų | 101 | 106.7 Ų | 106.7 | 53% | 0.529 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -68.6 | -43.2 | 176.9 | -153.3 | 118.4 | 0 | 0 | 0 | 110.9 | N54 S55 S56 D60 L61 E62 | N54-L58 VanDerWaalsContact O-CB 3.25Å; N54-L58 WeakPolarHBondContact O-CB 3.38Å; N54-L58 PolarHBondContact O-N 3.45Å; S55-L58 PolarHBondContact O-N 3.45Å; S56-L58 VanDerWaalsContact C-N 3.32Å; S56-L58 PolarHBondContact O-N 3.4Å; L58-D60 PolarHBondContact O-N 2.94Å; L58-L61 PolarHBondContact O-N 3.49Å; L58-E62 WeakPolarHBondContact CD2-OE1 3.36Å; L58-E62 WeakPolarHBondContact O-CB 3.5Å; L58-E62 WeakPolarHBondContact O-CG 3.3Å; L58-E62 PolarHBondContact O-N 3.23Å |
| 59 | Y | 76.6 | Confident | 73.2 | Confident | 175 Ų | 175 | 107 Ų | 107 | 69% | 0.686 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.4 | -41.3 | 175.9 | -166.2 | -92.8 | 0 | 0 | 0 | 112.2 | S55 S56 E62 G63 | S55-Y59 PolarHBondContact O-N 3.31Å; S55-Y59 VanDerWaalsContact O-N 3.08Å; S56-Y59 PolarHBondContact O-N 2.9Å; Y59-E62 PolarHBondContact O-N 3.43Å; Y59-G63 PolarHBondContact O-N 2.95Å |
| 60 | D | 77.4 | Confident | 74.8 | Confident | 111 Ų | 111 | 109.1 Ų | 109.1 | 59% | 0.594 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.7 | -38.9 | 175.1 | -81.1 | -12.5 | 0 | 0 | 0 | 112.3 | S56 L58 R64 | S56-D60 PolarHBondContact O-N 3.49Å; L58-D60 PolarHBondContact O-N 2.94Å; D60-R64 VanDerWaalsContact O-CG 3.31Å; D60-R64 WeakPolarHBondContact O-CG 3.36Å; D60-R64 PolarHBondContact O-N 3.39Å |
| 61 | L | 77.3 | Confident | 76.6 | Confident | 90 Ų | 90 | 108.6 Ų | 108.6 | 47% | 0.471 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -67.6 | -42.7 | 175.7 | -77.2 | 171 | 0 | 0 | 0 | 111.5 | L57 L58 R64 V65 | L57-L61 HydrophobicContact CD2-CD1 4.28Å; L57-L61 WeakPolarHBondContact O-CB 3.42Å; L57-L61 VanDerWaalsContact O-CG 3.27Å; L57-L61 WeakPolarHBondContact O-CG 3.42Å; L57-L61 PolarHBondContact O-N 3.34Å; L58-L61 PolarHBondContact O-N 3.49Å; L61-R64 PolarHBondContact O-N 3.02Å; L61-V65 WeakPolarHBondContact O-CG2 3.39Å; L61-V65 PolarHBondContact O-N 3.08Å |
| 62 | E | 82.8 | Confident | 78 | Confident | 114 Ų | 114 | 107.9 Ų | 107.9 | 53% | 0.533 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -59.5 | -47.1 | 174.6 | -76.4 | 176.7 | 168.9 | 0 | 0 | 110.9 | L58 Y59 R64 V65 E66 | L58-E62 WeakPolarHBondContact CD2-OE1 3.36Å; L58-E62 WeakPolarHBondContact O-CB 3.5Å; L58-E62 WeakPolarHBondContact O-CG 3.3Å; L58-E62 PolarHBondContact O-N 3.23Å; Y59-E62 PolarHBondContact O-N 3.43Å; E62-R64 VanDerWaalsContact C-N 3.28Å; E62-R64 PolarHBondContact O-N 3.05Å; E62-V65 PolarHBondContact O-N 3.4Å; E62-V65 VanDerWaalsContact O-N 3.14Å; E62-E66 PolarHBondContact O-N 3.37Å |
| 63 | G | 84.3 | Confident | 79.5 | Confident | 29 Ų | 29 | 105 Ų | 105 | 30% | 0.299 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.1 | -30 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y59 K67 | Y59-G63 PolarHBondContact O-N 2.95Å; G63-K67 WeakPolarHBondContact O-CG 3.44Å; G63-K67 PolarHBondContact O-N 2.97Å |
| 64 | R | 84.5 | Confident | 80.8 | Confident | 182 Ų | 182 | 105 Ų | 105 | 69% | 0.687 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -74 | -38.2 | 173 | -76.4 | 178.9 | 65 | -176 | -0.4 | 112.4 | D60 L61 E62 S68 | D60-R64 VanDerWaalsContact O-CG 3.31Å; D60-R64 WeakPolarHBondContact O-CG 3.36Å; D60-R64 PolarHBondContact O-N 3.39Å; L61-R64 PolarHBondContact O-N 3.02Å; E62-R64 VanDerWaalsContact C-N 3.28Å; E62-R64 PolarHBondContact O-N 3.05Å; R64-S68 WeakPolarHBondContact O-CB 3.43Å; R64-S68 PolarHBondContact O-N 3.38Å |
| 65 | V | 83.3 | Confident | 81.6 | Confident | 72 Ų | 72 | 105 Ų | 105 | 44% | 0.436 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.4 | -48.7 | 175.3 | 169.7 | 0 | 0 | 0 | 0 | 109.4 | L61 E62 K67 S68 E69 | L61-V65 WeakPolarHBondContact O-CG2 3.39Å; L61-V65 PolarHBondContact O-N 3.08Å; E62-V65 PolarHBondContact O-N 3.4Å; E62-V65 VanDerWaalsContact O-N 3.14Å; V65-K67 PolarHBondContact O-N 2.68Å; V65-S68 CarbonylContact O-C 3.59Å; V65-S68 WeakPolarHBondContact O-CA 3.47Å; V65-S68 WeakPolarHBondContact O-CB 3.39Å; V65-S68 PolarHBondContact O-N 2.95Å; V65-S68 PolarHBondContact O-OG 3.16Å; V65-E69 HydrophobicContact CG1-CG 4.33Å; V65-E69 WeakPolarHBondContact O-CG 3.4Å; V65-E69 PolarHBondContact O-N 2.92Å |
| 66 | E | 85.9 | Confident | 82.5 | Confident | 122 Ų | 122 | 105 Ų | 105 | 57% | 0.57 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -57.6 | -47.4 | 178.9 | -169.3 | 171.3 | -152 | 0 | 0 | 111.9 | E62 S68 E69 E70 | E62-E66 PolarHBondContact O-N 3.37Å; E66-S68 VanDerWaalsContact C-N 3.27Å; E66-S68 PolarHBondContact O-N 2.97Å; E66-E69 PolarHBondContact O-N 3.33Å; E66-E70 WeakPolarHBondContact O-CG 3.39Å; E66-E70 PolarHBondContact O-N 3.34Å |
| 67 | K | 87.2 | Confident | 83.4 | Confident | 155 Ų | 155 | 108 Ų | 108 | 67% | 0.674 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -60.3 | -35.4 | 173.9 | -77.3 | 179 | -179 | 175.9 | 0 | 113.4 | G63 V65 K71 | G63-K67 WeakPolarHBondContact O-CG 3.44Å; G63-K67 PolarHBondContact O-N 2.97Å; V65-K67 PolarHBondContact O-N 2.68Å; K67-K71 PolarHBondContact O-N 3.23Å |
| 68 | S | 78.8 | Confident | 84.1 | Confident | 61 Ų | 61 | 108.9 Ų | 108.9 | 43% | 0.427 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -72 | -37.1 | 178.5 | 76 | 0 | 0 | 0 | 0 | 111.7 | R64 V65 E66 K71 V72 | R64-S68 WeakPolarHBondContact O-CB 3.43Å; R64-S68 PolarHBondContact O-N 3.38Å; V65-S68 CarbonylContact O-C 3.59Å; V65-S68 WeakPolarHBondContact O-CA 3.47Å; V65-S68 WeakPolarHBondContact O-CB 3.39Å; V65-S68 PolarHBondContact O-N 2.95Å; V65-S68 PolarHBondContact O-OG 3.16Å; E66-S68 VanDerWaalsContact C-N 3.27Å; E66-S68 PolarHBondContact O-N 2.97Å; S68-K71 PolarHBondContact O-N 3.22Å; S68-V72 WeakPolarHBondContact O-CG2 3.42Å; S68-V72 PolarHBondContact O-N 2.91Å |
| 69 | E | 85.4 | Confident | 84.7 | Confident | 123 Ų | 123 | 108.6 Ų | 108.6 | 58% | 0.575 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -67.2 | -43 | 176 | -71 | 179.8 | 165.7 | 0 | 0 | 111.5 | V65 E66 K71 V72 A73 | V65-E69 HydrophobicContact CG1-CG 4.33Å; V65-E69 WeakPolarHBondContact O-CG 3.4Å; V65-E69 PolarHBondContact O-N 2.92Å; E66-E69 PolarHBondContact O-N 3.33Å; E69-K71 VanDerWaalsContact C-N 3.29Å; E69-K71 PolarHBondContact O-N 3.04Å; E69-V72 PolarHBondContact O-N 3.35Å; E69-A73 PolarHBondContact O-N 3.02Å |
| 70 | E | 87.6 | Confident | 85.3 | Confident | 121 Ų | 121 | 104.6 Ų | 104.6 | 57% | 0.565 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -57.7 | -42.3 | 172.7 | -73.5 | -176.9 | 162.5 | 0 | 0 | 111.9 | E66 A73 L74 | E66-E70 WeakPolarHBondContact O-CG 3.39Å; E66-E70 PolarHBondContact O-N 3.34Å; E70-A73 PolarHBondContact O-N 3.3Å; E70-L74 WeakPolarHBondContact O-CG 3.28Å; E70-L74 PolarHBondContact O-N 3.42Å |
| 71 | K | 89 | Confident | 86 | Confident | 139 Ų | 139 | 103.2 Ų | 103.2 | 60% | 0.604 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.6 | -40.2 | 177.8 | -168.9 | 172.6 | -175.9 | 177.2 | 0 | 112 | K67 S68 E69 A73 L74 L75 | K67-K71 PolarHBondContact O-N 3.23Å; S68-K71 PolarHBondContact O-N 3.22Å; E69-K71 VanDerWaalsContact C-N 3.29Å; E69-K71 PolarHBondContact O-N 3.04Å; K71-A73 VanDerWaalsContact C-N 3.34Å; K71-L74 PolarHBondContact O-N 3.48Å; K71-L75 HydrophobicContact CG-CD1 4.26Å; K71-L75 WeakPolarHBondContact O-CB 3.5Å; K71-L75 WeakPolarHBondContact O-CG 3.3Å; K71-L75 PolarHBondContact O-N 3.18Å |
| 72 | V | 84.7 | Confident | 86.4 | Confident | 89 Ų | 89 | 101.1 Ų | 101.1 | 54% | 0.539 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.8 | -41.3 | 174.8 | 169.7 | 0 | 0 | 0 | 0 | 110.7 | S68 E69 L75 T76 | S68-V72 WeakPolarHBondContact O-CG2 3.42Å; S68-V72 PolarHBondContact O-N 2.91Å; E69-V72 PolarHBondContact O-N 3.35Å; V72-L75 PolarHBondContact O-N 3.39Å; V72-T76 WeakPolarHBondContact O-CB 3.48Å; V72-T76 PolarHBondContact O-N 2.87Å; V72-T76 PolarHBondContact O-OG1 3.34Å |
| 73 | A | 88.6 | Confident | 86.6 | Confident | 62 Ų | 62 | 101.1 Ų | 101.1 | 51% | 0.512 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.8 | -42.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | E69 E70 K71 T76 K77 | E69-A73 PolarHBondContact O-N 3.02Å; E70-A73 PolarHBondContact O-N 3.3Å; K71-A73 VanDerWaalsContact C-N 3.34Å; A73-T76 PolarHBondContact O-N 3.43Å; A73-K77 PolarHBondContact O-N 2.81Å |
| 74 | L | 89 | Confident | 86.9 | Confident | 114 Ų | 114 | 106.3 Ų | 106.3 | 60% | 0.597 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.3 | -48.9 | 174.9 | -76.8 | 170 | 0 | 0 | 0 | 112.1 | E70 K71 T76 K77 E78 | E70-L74 WeakPolarHBondContact O-CG 3.28Å; E70-L74 PolarHBondContact O-N 3.42Å; K71-L74 PolarHBondContact O-N 3.48Å; L74-T76 VanDerWaalsContact C-N 3.3Å; L74-T76 PolarHBondContact O-N 3.31Å; L74-K77 WeakPolarHBondContact O-CB 3.46Å; L74-K77 PolarHBondContact O-N 3.49Å; L74-E78 PolarHBondContact O-N 3.15Å |
| 75 | L | 82.6 | Confident | 87.1 | Confident | 94 Ų | 94 | 105.5 Ų | 105.5 | 49% | 0.492 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.5 | -35.3 | 179.3 | -72.1 | 172.5 | 0 | 0 | 0 | 112.3 | K71 V72 E78 L79 | K71-L75 HydrophobicContact CG-CD1 4.26Å; K71-L75 WeakPolarHBondContact O-CB 3.5Å; K71-L75 WeakPolarHBondContact O-CG 3.3Å; K71-L75 PolarHBondContact O-N 3.18Å; V72-L75 PolarHBondContact O-N 3.39Å; L75-E78 PolarHBondContact O-N 3.48Å; L75-L79 WeakPolarHBondContact O-CB 3.47Å; L75-L79 PolarHBondContact O-N 2.93Å |
| 76 | T | 88.2 | Confident | 87.3 | Confident | 68 Ų | 68 | 107.7 Ų | 107.7 | 42% | 0.417 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.5 | -43.4 | 175 | -55.8 | 0 | 0 | 0 | 0 | 110.6 | V72 A73 L74 E78 L79 D80 | V72-T76 WeakPolarHBondContact O-CB 3.48Å; V72-T76 PolarHBondContact O-N 2.87Å; V72-T76 PolarHBondContact O-OG1 3.34Å; A73-T76 PolarHBondContact O-N 3.43Å; L74-T76 VanDerWaalsContact C-N 3.3Å; L74-T76 PolarHBondContact O-N 3.31Å; T76-E78 PolarHBondContact O-N 3.1Å; T76-L79 WeakPolarHBondContact O-CB 3.45Å; T76-L79 PolarHBondContact O-N 3.38Å; T76-D80 PolarHBondContact O-N 3.38Å |
| 77 | K | 91.4 | Very high | 87.3 | Confident | 143 Ų | 143 | 104.5 Ų | 104.5 | 62% | 0.622 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64 | -39.6 | 175.7 | -172.1 | 179.4 | 179.5 | -179 | 0 | 112.3 | A73 L74 D80 L81 | A73-K77 PolarHBondContact O-N 2.81Å; L74-K77 WeakPolarHBondContact O-CB 3.46Å; L74-K77 PolarHBondContact O-N 3.49Å; K77-D80 PolarHBondContact O-N 3.13Å; K77-L81 WeakPolarHBondContact O-CG 3.41Å; K77-L81 PolarHBondContact O-N 2.81Å |
| 78 | E | 87.6 | Confident | 87.4 | Confident | 122 Ų | 122 | 100.5 Ų | 100.5 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.4 | -40.1 | 174.4 | -75.2 | -178 | 173.9 | 0 | 0 | 112.1 | L74 L75 T76 L81 A82 | L74-E78 PolarHBondContact O-N 3.15Å; L75-E78 PolarHBondContact O-N 3.48Å; T76-E78 PolarHBondContact O-N 3.1Å; E78-L81 PolarHBondContact O-N 3.06Å; E78-A82 WeakPolarHBondContact O-CB 3.38Å; E78-A82 PolarHBondContact O-N 2.82Å |
| 79 | L | 86.5 | Confident | 87.9 | Confident | 94 Ų | 94 | 102.8 Ų | 102.8 | 49% | 0.492 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 176 | -176.1 | 66.6 | 0 | 0 | 0 | 111.6 | L75 T76 L81 A82 K83 | L75-L79 WeakPolarHBondContact O-CB 3.47Å; L75-L79 PolarHBondContact O-N 2.93Å; T76-L79 WeakPolarHBondContact O-CB 3.45Å; T76-L79 PolarHBondContact O-N 3.38Å; L79-L81 VanDerWaalsContact C-N 3.35Å; L79-A82 PolarHBondContact O-N 2.88Å; L79-K83 HydrophobicContact CG-CD 4.49Å; L79-K83 WeakPolarHBondContact O-CG 3.25Å; L79-K83 PolarHBondContact O-N 2.85Å |
| 80 | D | 89.5 | Confident | 88 | Confident | 91 Ų | 91 | 101.7 Ų | 101.7 | 49% | 0.487 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.8 | -38.5 | 177.1 | -72.5 | -20.5 | 0 | 0 | 0 | 111.7 | T76 K77 K83 K84 | T76-D80 PolarHBondContact O-N 3.38Å; K77-D80 PolarHBondContact O-N 3.13Å; D80-K83 PolarHBondContact O-N 3.27Å; D80-K84 WeakPolarHBondContact O-CB 3.46Å; D80-K84 PolarHBondContact O-N 3.24Å |
| 81 | L | 91 | Very high | 87.9 | Confident | 82 Ų | 82 | 102.8 Ų | 102.8 | 43% | 0.429 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.8 | -39.2 | 172.4 | -74.5 | 170.8 | 0 | 0 | 0 | 112.1 | K77 E78 L79 K84 R85 | K77-L81 WeakPolarHBondContact O-CG 3.41Å; K77-L81 PolarHBondContact O-N 2.81Å; E78-L81 PolarHBondContact O-N 3.06Å; L79-L81 VanDerWaalsContact C-N 3.35Å; L81-K84 PolarHBondContact O-N 3.26Å; L81-R85 WeakPolarHBondContact O-CG 3.44Å; L81-R85 PolarHBondContact O-N 3.45Å |
| 82 | A | 85.9 | Confident | 87.9 | Confident | 46 Ų | 46 | 101 Ų | 101 | 38% | 0.38 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.9 | -45.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | E78 L79 K84 R85 E86 | E78-A82 WeakPolarHBondContact O-CB 3.38Å; E78-A82 PolarHBondContact O-N 2.82Å; L79-A82 PolarHBondContact O-N 2.88Å; A82-K84 VanDerWaalsContact C-N 3.31Å; A82-K84 PolarHBondContact O-N 2.97Å; A82-R85 PolarHBondContact O-N 3.19Å; A82-E86 WeakPolarHBondContact O-CB 3.18Å; A82-E86 PolarHBondContact O-N 2.97Å |
| 83 | K | 88.1 | Confident | 87.9 | Confident | 115 Ų | 115 | 101.8 Ų | 101.8 | 50% | 0.5 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.9 | -39 | 174.5 | -75.2 | 177.3 | 177.6 | 175.6 | 0 | 112.4 | L79 D80 E86 A87 | L79-K83 HydrophobicContact CG-CD 4.49Å; L79-K83 WeakPolarHBondContact O-CG 3.25Å; L79-K83 PolarHBondContact O-N 2.85Å; D80-K83 PolarHBondContact O-N 3.27Å; K83-E86 PolarHBondContact O-N 3.48Å; K83-A87 PolarHBondContact O-N 3.35Å |
| 84 | K | 89.4 | Confident | 87.6 | Confident | 138 Ų | 138 | 103.6 Ų | 103.6 | 60% | 0.6 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.7 | -44.1 | 175.4 | -167.7 | 176.4 | -179 | -179.3 | 0 | 111.6 | D80 L81 A82 E86 A87 D88 | D80-K84 WeakPolarHBondContact O-CB 3.46Å; D80-K84 PolarHBondContact O-N 3.24Å; L81-K84 PolarHBondContact O-N 3.26Å; A82-K84 VanDerWaalsContact C-N 3.31Å; A82-K84 PolarHBondContact O-N 2.97Å; K84-E86 VanDerWaalsContact C-N 3.32Å; K84-E86 PolarHBondContact O-N 2.8Å; K84-A87 PolarHBondContact O-N 2.8Å; K84-D88 VanDerWaalsContact O-CG 3.23Å; K84-D88 PolarHBondContact O-N 2.97Å |
| 85 | R | 89.6 | Confident | 87.3 | Confident | 164 Ų | 164 | 100.5 Ų | 100.5 | 62% | 0.619 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.9 | -39.9 | 174.1 | -73.7 | 178.4 | -176.4 | 133.2 | -1.5 | 112.3 | L81 A82 D88 L89 | L81-R85 WeakPolarHBondContact O-CG 3.44Å; L81-R85 PolarHBondContact O-N 3.45Å; A82-R85 PolarHBondContact O-N 3.19Å; R85-D88 PolarHBondContact O-N 3.06Å; R85-L89 WeakPolarHBondContact O-CB 3.46Å; R85-L89 VanDerWaalsContact O-CG 3.29Å; R85-L89 WeakPolarHBondContact O-CG 3.29Å; R85-L89 PolarHBondContact O-N 3.22Å |
| 86 | E | 86.3 | Confident | 87.2 | Confident | 119 Ų | 119 | 101.8 Ų | 101.8 | 56% | 0.556 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.5 | -45.2 | 175.9 | -174.8 | -178.7 | -174.1 | 0 | 0 | 111.2 | A82 K83 K84 L89 L90 | A82-E86 WeakPolarHBondContact O-CB 3.18Å; A82-E86 PolarHBondContact O-N 2.97Å; K83-E86 PolarHBondContact O-N 3.48Å; K84-E86 VanDerWaalsContact C-N 3.32Å; K84-E86 PolarHBondContact O-N 2.8Å; E86-L89 PolarHBondContact O-N 3.08Å; E86-L90 HydrophobicContact CG-CD1 4.27Å; E86-L90 WeakPolarHBondContact O-CB 3.31Å; E86-L90 WeakPolarHBondContact O-CG 3.42Å; E86-L90 PolarHBondContact O-N 3.08Å |
| 87 | A | 86.8 | Confident | 86.8 | Confident | 54 Ų | 54 | 101.6 Ų | 101.6 | 45% | 0.446 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.3 | -45.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | K83 K84 L89 L90 E91 | K83-A87 PolarHBondContact O-N 3.35Å; K84-A87 PolarHBondContact O-N 2.8Å; A87-L89 VanDerWaalsContact C-N 3.3Å; A87-L89 PolarHBondContact O-N 3.36Å; A87-L90 PolarHBondContact O-N 2.98Å; A87-E91 PolarHBondContact O-N 2.75Å |
| 88 | D | 89.5 | Confident | 86 | Confident | 72 Ų | 72 | 99.1 Ų | 99.1 | 39% | 0.385 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.6 | -37.9 | 176.8 | -66 | -19.1 | 0 | 0 | 0 | 111.5 | K84 R85 Q92 | K84-D88 VanDerWaalsContact O-CG 3.23Å; K84-D88 PolarHBondContact O-N 2.97Å; R85-D88 PolarHBondContact O-N 3.06Å; D88-Q92 WeakPolarHBondContact O-CB 3.21Å; D88-Q92 VanDerWaalsContact O-CG 3.28Å; D88-Q92 WeakPolarHBondContact O-CG 3.3Å; D88-Q92 PolarHBondContact O-N 2.72Å; D88-Q92 PolarHBondContact O-NE2 3.26Å |
| 89 | L | 88.7 | Confident | 85.6 | Confident | 108 Ų | 108 | 98.8 Ų | 98.8 | 57% | 0.565 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -71.7 | -38.7 | 176.4 | -75.5 | 171.9 | 0 | 0 | 0 | 112.3 | R85 E86 A87 E91 Q92 L93 | R85-L89 WeakPolarHBondContact O-CB 3.46Å; R85-L89 VanDerWaalsContact O-CG 3.29Å; R85-L89 WeakPolarHBondContact O-CG 3.29Å; R85-L89 PolarHBondContact O-N 3.22Å; E86-L89 PolarHBondContact O-N 3.08Å; A87-L89 VanDerWaalsContact C-N 3.3Å; A87-L89 PolarHBondContact O-N 3.36Å; L89-E91 VanDerWaalsContact C-N 3.35Å; L89-Q92 PolarHBondContact O-N 2.75Å; L89-L93 VanDerWaalsContact O-CB 3.31Å; L89-L93 WeakPolarHBondContact O-CB 3.47Å; L89-L93 PolarHBondContact O-N 3.18Å |
| 90 | L | 87.9 | Confident | 84.9 | Confident | 101 Ų | 101 | 98.5 Ų | 98.5 | 53% | 0.529 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.4 | -39.6 | 174.5 | -76.1 | 172.6 | 0 | 0 | 0 | 111.2 | E86 A87 L93 N94 | E86-L90 HydrophobicContact CG-CD1 4.27Å; E86-L90 WeakPolarHBondContact O-CB 3.31Å; E86-L90 WeakPolarHBondContact O-CG 3.42Å; E86-L90 PolarHBondContact O-N 3.08Å; A87-L90 PolarHBondContact O-N 2.98Å; L90-L93 PolarHBondContact O-N 2.97Å; L90-N94 WeakPolarHBondContact O-CB 3.4Å; L90-N94 PolarHBondContact O-N 3.41Å |
| 91 | E | 86 | Confident | 83.8 | Confident | 143 Ų | 143 | 98.8 Ų | 98.8 | 67% | 0.668 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.8 | -43.7 | 174.1 | -172.7 | 174.8 | -170 | 0 | 0 | 111.4 | A87 L89 L93 N94 S95 | A87-E91 PolarHBondContact O-N 2.75Å; L89-E91 VanDerWaalsContact C-N 3.35Å; E91-L93 PolarHBondContact O-N 3.22Å; E91-N94 PolarHBondContact O-N 3.36Å; E91-S95 WeakPolarHBondContact O-CB 3.48Å; E91-S95 PolarHBondContact O-N 2.81Å |
| 92 | Q | 88.8 | Confident | 82.5 | Confident | 102 Ų | 102 | 99.2 Ų | 99.2 | 48% | 0.477 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 173.2 | -77.3 | 174.8 | 54 | 0 | 0 | 111.6 | D88 L89 N94 S95 F96 | D88-Q92 WeakPolarHBondContact O-CB 3.21Å; D88-Q92 VanDerWaalsContact O-CG 3.28Å; D88-Q92 WeakPolarHBondContact O-CG 3.3Å; D88-Q92 PolarHBondContact O-N 2.72Å; D88-Q92 PolarHBondContact O-NE2 3.26Å; L89-Q92 PolarHBondContact O-N 2.75Å; Q92-N94 PolarHBondContact O-N 3.23Å; Q92-S95 WeakPolarHBondContact O-CB 3.41Å; Q92-S95 PolarHBondContact O-N 3.33Å; Q92-F96 WeakPolarHBondContact O-CD2 3.28Å; Q92-F96 PolarHBondContact O-N 2.77Å |
| 93 | L | 84.8 | Confident | 81 | Confident | 105 Ų | 105 | 102.5 Ų | 102.5 | 55% | 0.55 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -44.8 | 178.2 | -174.7 | 66.1 | 0 | 0 | 0 | 110.9 | L89 L90 E91 S95 F96 V97 | L89-L93 VanDerWaalsContact O-CB 3.31Å; L89-L93 WeakPolarHBondContact O-CB 3.47Å; L89-L93 PolarHBondContact O-N 3.18Å; L90-L93 PolarHBondContact O-N 2.97Å; E91-L93 PolarHBondContact O-N 3.22Å; L93-S95 VanDerWaalsContact C-N 3.33Å; L93-S95 PolarHBondContact O-N 2.91Å; L93-F96 CarbonylContact O-C 3.6Å; L93-F96 WeakPolarHBondContact O-CB 3.21Å; L93-F96 PolarHBondContact O-N 2.83Å; L93-F96 VanDerWaalsContact O-N 3.1Å; L93-V97 WeakPolarHBondContact O-CG2 3.49Å; L93-V97 PolarHBondContact O-N 3.42Å |
| 94 | N | 82.2 | Confident | 79.2 | Confident | 101 Ų | 101 | 101.6 Ų | 101.6 | 54% | 0.54 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.4 | -37 | 178.8 | -147.3 | 23.2 | 0 | 0 | 0 | 111.5 | L90 E91 Q92 V97 N98 | L90-N94 WeakPolarHBondContact O-CB 3.4Å; L90-N94 PolarHBondContact O-N 3.41Å; E91-N94 PolarHBondContact O-N 3.36Å; Q92-N94 PolarHBondContact O-N 3.23Å; N94-V97 PolarHBondContact O-N 2.91Å; N94-N98 WeakPolarHBondContact O-CB 3.19Å; N94-N98 PolarHBondContact O-N 3.4Å; N94-N98 PolarHBondContact O-ND2 3.45Å; N94-N98 VanDerWaalsContact O-ND2 3.13Å |
| 95 | S | 82.5 | Confident | 77.2 | Confident | 48 Ų | 48 | 103.6 Ų | 103.6 | 34% | 0.336 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.8 | -42.1 | 169.3 | 151.1 | 0 | 0 | 0 | 0 | 111.9 | E91 Q92 L93 K99 | E91-S95 WeakPolarHBondContact O-CB 3.48Å; E91-S95 PolarHBondContact O-N 2.81Å; Q92-S95 WeakPolarHBondContact O-CB 3.41Å; Q92-S95 PolarHBondContact O-N 3.33Å; L93-S95 VanDerWaalsContact C-N 3.33Å; L93-S95 PolarHBondContact O-N 2.91Å; S95-K99 WeakPolarHBondContact O-CB 3.31Å; S95-K99 VanDerWaalsContact O-CG 3.29Å; S95-K99 WeakPolarHBondContact O-CG 3.48Å; S95-K99 PolarHBondContact O-N 3.33Å |
| 96 | F | 80.9 | Confident | 74.7 | Confident | 122 Ų | 122 | 100.2 Ų | 100.2 | 54% | 0.535 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.7 | -42.3 | 176.2 | -86.5 | -68 | 0 | 0 | 0 | 112.1 | Q92 L93 K99 V100 | Q92-F96 WeakPolarHBondContact O-CD2 3.28Å; Q92-F96 PolarHBondContact O-N 2.77Å; L93-F96 CarbonylContact O-C 3.6Å; L93-F96 WeakPolarHBondContact O-CB 3.21Å; L93-F96 PolarHBondContact O-N 2.83Å; L93-F96 VanDerWaalsContact O-N 3.1Å; F96-K99 PolarHBondContact O-N 3.07Å; F96-V100 WeakPolarHBondContact O-CB 3.31Å; F96-V100 VanDerWaalsContact O-CG2 3.3Å; F96-V100 WeakPolarHBondContact O-CG2 3.44Å; F96-V100 PolarHBondContact O-N 3.46Å |
| 97 | V | 79.2 | Confident | 72.2 | Confident | 64 Ų | 64 | 100.5 Ų | 100.5 | 39% | 0.388 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -60.1 | -49.4 | 175.2 | 171 | 0 | 0 | 0 | 0 | 110 | L93 N94 K99 V100 D101 | L93-V97 WeakPolarHBondContact O-CG2 3.49Å; L93-V97 PolarHBondContact O-N 3.42Å; N94-V97 PolarHBondContact O-N 2.91Å; V97-K99 VanDerWaalsContact C-N 3.28Å; V97-K99 PolarHBondContact O-N 3.46Å; V97-V100 PolarHBondContact O-N 2.86Å; V97-D101 WeakPolarHBondContact O-CB 3.32Å; V97-D101 VanDerWaalsContact O-CG 3.32Å; V97-D101 PolarHBondContact O-N 3.01Å |
| 98 | N | 75.9 | Confident | 69.9 | Low | 90 Ų | 90 | 104 Ų | 104 | 48% | 0.481 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -59.7 | -37.2 | 175.9 | -71.1 | -30.9 | 0 | 0 | 0 | 112.8 | N94 S102 | N94-N98 WeakPolarHBondContact O-CB 3.19Å; N94-N98 PolarHBondContact O-N 3.4Å; N94-N98 PolarHBondContact O-ND2 3.45Å; N94-N98 VanDerWaalsContact O-ND2 3.13Å; N98-S102 WeakPolarHBondContact O-CB 3.36Å; N98-S102 PolarHBondContact O-N 2.87Å; N98-S102 PolarHBondContact O-OG 3.28Å |
| 99 | K | 77.8 | Confident | 67.7 | Low | 115 Ų | 115 | 106.7 Ų | 106.7 | 50% | 0.5 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -67.6 | -43 | 173.7 | -76.1 | 173.8 | -175.2 | 177.4 | 0 | 111.6 | S95 F96 V97 S102 I103 | S95-K99 WeakPolarHBondContact O-CB 3.31Å; S95-K99 VanDerWaalsContact O-CG 3.29Å; S95-K99 WeakPolarHBondContact O-CG 3.48Å; S95-K99 PolarHBondContact O-N 3.33Å; F96-K99 PolarHBondContact O-N 3.07Å; V97-K99 VanDerWaalsContact C-N 3.28Å; V97-K99 PolarHBondContact O-N 3.46Å; K99-S102 CarbonylContact O-C 3.58Å; K99-S102 WeakPolarHBondContact O-CB 3.4Å; K99-S102 PolarHBondContact O-N 2.9Å; K99-I103 HydrophobicContact CB-CD1 4.5Å; K99-I103 WeakPolarHBondContact O-CB 3.36Å; K99-I103 VanDerWaalsContact O-CD1 3.28Å; K99-I103 WeakPolarHBondContact O-CD1 3.43Å; K99-I103 WeakPolarHBondContact O-CG1 3.49Å; K99-I103 PolarHBondContact O-N 3.48Å |
| 100 | V | 71.8 | Confident | 65.2 | Low | 89 Ų | 89 | 107.5 Ų | 107.5 | 54% | 0.539 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -64.4 | -42.9 | 177.7 | 169.1 | 0 | 0 | 0 | 0 | 110.4 | F96 V97 S102 I103 S104 | F96-V100 WeakPolarHBondContact O-CB 3.31Å; F96-V100 VanDerWaalsContact O-CG2 3.3Å; F96-V100 WeakPolarHBondContact O-CG2 3.44Å; F96-V100 PolarHBondContact O-N 3.46Å; V97-V100 PolarHBondContact O-N 2.86Å; V100-S102 VanDerWaalsContact C-N 3.29Å; V100-S102 PolarHBondContact O-N 3.34Å; V100-I103 CarbonylContact O-C 3.56Å; V100-I103 PolarHBondContact O-N 2.91Å; V100-I103 VanDerWaalsContact O-N 3.07Å; V100-S104 WeakPolarHBondContact O-CB 3.42Å; V100-S104 PolarHBondContact O-N 3.49Å |
| 101 | D | 65.8 | Low | 63 | Low | 97 Ų | 97 | 108.4 Ų | 108.4 | 52% | 0.519 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -62.6 | -38.4 | 174.6 | -67.5 | -18.9 | 0 | 0 | 0 | 111.1 | V97 I103 S104 | V97-D101 WeakPolarHBondContact O-CB 3.32Å; V97-D101 VanDerWaalsContact O-CG 3.32Å; V97-D101 PolarHBondContact O-N 3.01Å; D101-I103 VanDerWaalsContact C-N 3.32Å; D101-I103 PolarHBondContact O-N 3.35Å; D101-S104 PolarHBondContact O-N 2.99Å |
| 102 | S | 63.9 | Low | 60.8 | Low | 91 Ų | 91 | 109.2 Ų | 109.2 | 64% | 0.636 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -70.3 | -24.8 | 174 | -55.7 | 0 | 0 | 0 | 0 | 113.7 | N98 K99 V100 | N98-S102 WeakPolarHBondContact O-CB 3.36Å; N98-S102 PolarHBondContact O-N 2.87Å; N98-S102 PolarHBondContact O-OG 3.28Å; K99-S102 CarbonylContact O-C 3.58Å; K99-S102 WeakPolarHBondContact O-CB 3.4Å; K99-S102 PolarHBondContact O-N 2.9Å; V100-S102 VanDerWaalsContact C-N 3.29Å; V100-S102 PolarHBondContact O-N 3.34Å |
| 103 | I | 56.2 | Low | 59.1 | Low | 114 Ų | 114 | 108.7 Ų | 108.7 | 59% | 0.585 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -90.8 | -24.2 | 178.4 | -66 | 161.1 | 0 | 0 | 0 | 110.6 | K99 V100 D101 E105 C106 | K99-I103 HydrophobicContact CB-CD1 4.5Å; K99-I103 WeakPolarHBondContact O-CB 3.36Å; K99-I103 VanDerWaalsContact O-CD1 3.28Å; K99-I103 WeakPolarHBondContact O-CD1 3.43Å; K99-I103 WeakPolarHBondContact O-CG1 3.49Å; K99-I103 PolarHBondContact O-N 3.48Å; V100-I103 CarbonylContact O-C 3.56Å; V100-I103 PolarHBondContact O-N 2.91Å; V100-I103 VanDerWaalsContact O-N 3.07Å; D101-I103 VanDerWaalsContact C-N 3.32Å; D101-I103 PolarHBondContact O-N 3.35Å; I103-E105 PolarHBondContact O-N 3.46Å; I103-E105 VanDerWaalsContact O-N 3.17Å; I103-C106 PolarHBondContact O-N 2.82Å |
| 104 | S | 49.9 | Very low | 57.4 | Low | 97 Ų | 97 | 110 Ų | 110 | 68% | 0.678 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -15.2 | 178.4 | -169.3 | 0 | 0 | 0 | 0 | 113.5 | V100 D101 | V100-S104 WeakPolarHBondContact O-CB 3.42Å; V100-S104 PolarHBondContact O-N 3.49Å; D101-S104 PolarHBondContact O-N 2.99Å |
| 105 | E | 47 | Very low | 56.4 | Low | 179 Ų | 179 | 111 Ų | 111 | 84% | 0.836 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | 6.8 | 171.8 | -70.8 | -171.6 | 164.7 | 0 | 0 | 114.2 | I103 | I103-E105 PolarHBondContact O-N 3.46Å; I103-E105 VanDerWaalsContact O-N 3.17Å |
| 106 | C | 36.6 | Very low | 55.7 | Low | 93 Ų | 93 | 112.2 Ų | 112.2 | 63% | 0.628 | 64% | 0.639 | S | S | * | * | trans | -136.5 | 95 | 177.8 | -91.5 | 0 | 0 | 0 | 0 | 112.5 | I103 V108 | I103-C106 PolarHBondContact O-N 2.82Å; C106-V108 PolarHBondContact O-N 3.13Å; C106-V108 VanDerWaalsContact O-N 3.11Å | ||
| 107 | S | 33.2 | Very low | 55.3 | Low | 125 Ų | 125 | 111.6 Ų | 111.6 | 87% | 0.874 | 64% | 0.641 | S | S | * | * | trans | -73 | 94.1 | 170.5 | -44.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 108 | V | 40 | Very low | 55.1 | Low | 127 Ų | 127 | 110.8 Ų | 110.8 | 77% | 0.77 | 64% | 0.641 | S | S | * | * | trans | -138.2 | 111.8 | 163.1 | -175.8 | 0 | 0 | 0 | 0 | 111.3 | C106 | C106-V108 PolarHBondContact O-N 3.13Å; C106-V108 VanDerWaalsContact O-N 3.11Å | ||
| 109 | T | 41.8 | Very low | 55.4 | Low | 129 Ų | 129 | 112.3 Ų | 112.3 | 79% | 0.791 | 65% | 0.645 | S | S | * | * | trans | -2 | 126.4 | 160.3 | 53.2 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 110 | V | 36.9 | Very low | 55.6 | Low | 125 Ų | 125 | 110.7 Ų | 110.7 | 76% | 0.758 | 64% | 0.639 | S | S | * | * | trans | -18.7 | 139.4 | 156.9 | -175.1 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 111 | P | 42.3 | Very low | 56 | Low | 121 Ų | 121 | 110.5 Ų | 110.5 | 79% | 0.786 | 64% | 0.638 | S | S | * | * | -126.9 | 151.4 | 109.8 | 9.4 | 12.1 | 0 | 0 | 0 | 113.8 | |||||
| 112 | E | 39.8 | Very low | 57.1 | Low | 160 Ų | 160 | 110.5 Ų | 110.5 | 75% | 0.748 | 64% | 0.637 | S | S | * | * | trans | -53 | 138 | -175.5 | -59.9 | 176.2 | 132.1 | 0 | 0 | 116.6 | ||||
| 113 | P | 52.9 | Low | 58.4 | Low | 90 Ų | 90 | 112.4 Ų | 112.4 | 58% | 0.584 | 63% | 0.63 | S | S | * | * | trans | -121.2 | 14.8 | 147.1 | 37.8 | -27.5 | 0 | 0 | 0 | 112.6 | N115 S116 L117 | P113-N115 PolarHBondContact O-N 3.34Å; P113-S116 PolarHBondContact O-N 2.96Å; P113-L117 PolarHBondContact O-N 2.86Å | ||
| 114 | H | 49.7 | Very low | 60 | Low | 134 Ų | 134 | 111.5 Ų | 111.5 | 62% | 0.62 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -57.4 | -27.2 | -168.6 | -71.5 | -64.2 | 0 | 0 | 0 | 114.5 | A118 | H114-A118 WeakPolarHBondContact O-CB 3.38Å; H114-A118 PolarHBondContact O-N 3.02Å; H114-A118 VanDerWaalsContact O-N 3.14Å |
| 115 | N | 60.3 | Low | 62 | Low | 120 Ų | 120 | 114.4 Ų | 114.4 | 64% | 0.642 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -71.8 | -40.1 | 174.6 | -73 | -11 | 0 | 0 | 0 | 113 | P113 A118 E119 | P113-N115 PolarHBondContact O-N 3.34Å; N115-A118 PolarHBondContact O-N 2.89Å; N115-E119 WeakPolarHBondContact O-CB 3.32Å; N115-E119 VanDerWaalsContact O-CG 3.24Å; N115-E119 WeakPolarHBondContact O-CG 3.27Å; N115-E119 PolarHBondContact O-N 3.37Å |
| 116 | S | 68 | Low | 64.1 | Low | 75 Ų | 75 | 112.1 Ų | 112.1 | 52% | 0.524 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -67.6 | -40.7 | -178.2 | -176.6 | 0 | 0 | 0 | 0 | 112.1 | P113 E120 | P113-S116 PolarHBondContact O-N 2.96Å; S116-E120 WeakPolarHBondContact O-CB 3.41Å; S116-E120 PolarHBondContact O-N 3.19Å |
| 117 | L | 72 | Confident | 66.8 | Low | 108 Ų | 108 | 112 Ų | 112 | 57% | 0.565 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -72.2 | -38.3 | 177.6 | -173.9 | 66.1 | 0 | 0 | 0 | 111.1 | P113 E120 V121 | P113-L117 PolarHBondContact O-N 2.86Å; L117-E120 PolarHBondContact O-N 3.32Å; L117-V121 VanDerWaalsContact O-CG2 3.29Å; L117-V121 WeakPolarHBondContact O-CG2 3.43Å; L117-V121 PolarHBondContact O-N 3.36Å |
| 118 | A | 75.4 | Confident | 69.5 | Low | 47 Ų | 47 | 111.6 Ų | 111.6 | 39% | 0.388 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -64.3 | -43.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | H114 N115 E120 V121 I122 | H114-A118 WeakPolarHBondContact O-CB 3.38Å; H114-A118 PolarHBondContact O-N 3.02Å; H114-A118 VanDerWaalsContact O-N 3.14Å; N115-A118 PolarHBondContact O-N 2.89Å; A118-E120 VanDerWaalsContact C-N 3.33Å; A118-E120 PolarHBondContact O-N 3.07Å; A118-V121 PolarHBondContact O-N 3.28Å; A118-I122 VanDerWaalsContact O-CG1 3.28Å; A118-I122 WeakPolarHBondContact O-CG1 3.13Å; A118-I122 PolarHBondContact O-N 3.39Å |
| 119 | E | 82.2 | Confident | 72 | Confident | 123 Ų | 123 | 108.6 Ų | 108.6 | 58% | 0.575 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.6 | -39.6 | 173.6 | -76 | 172.9 | -168.4 | 0 | 0 | 112 | N115 I122 R123 | N115-E119 WeakPolarHBondContact O-CB 3.32Å; N115-E119 VanDerWaalsContact O-CG 3.24Å; N115-E119 WeakPolarHBondContact O-CG 3.27Å; N115-E119 PolarHBondContact O-N 3.37Å; E119-I122 PolarHBondContact O-N 3.46Å; E119-R123 WeakPolarHBondContact O-CB 3.43Å; E119-R123 PolarHBondContact O-N 3.01Å |
| 120 | E | 81.5 | Confident | 74.4 | Confident | 81 Ų | 81 | 106 Ų | 106 | 38% | 0.379 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -67.3 | -40.5 | 176.1 | -177.6 | 158 | -139.2 | 0 | 0 | 112.9 | S116 L117 A118 R123 L124 | S116-E120 WeakPolarHBondContact O-CB 3.41Å; S116-E120 PolarHBondContact O-N 3.19Å; L117-E120 PolarHBondContact O-N 3.32Å; A118-E120 VanDerWaalsContact C-N 3.33Å; A118-E120 PolarHBondContact O-N 3.07Å; E120-R123 PolarHBondContact O-N 3.42Å; E120-R123 IonicContact OE1-NH2 3.6Å; E120-L124 HydrophobicContact CG-CD1 4.12Å; E120-L124 HydrophobicContact CG-CG 4.49Å; E120-L124 WeakPolarHBondContact O-CB 3.44Å; E120-L124 WeakPolarHBondContact O-CG 3.37Å; E120-L124 PolarHBondContact O-N 2.93Å |
| 121 | V | 81.6 | Confident | 77 | Confident | 84 Ų | 84 | 106.1 Ų | 106.1 | 51% | 0.509 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.5 | -41.1 | 174.3 | 170 | 0 | 0 | 0 | 0 | 111.1 | L117 A118 L124 K125 | L117-V121 VanDerWaalsContact O-CG2 3.29Å; L117-V121 WeakPolarHBondContact O-CG2 3.43Å; L117-V121 PolarHBondContact O-N 3.36Å; A118-V121 PolarHBondContact O-N 3.28Å; V121-L124 PolarHBondContact O-N 3.3Å; V121-K125 VanDerWaalsContact O-CB 3.26Å; V121-K125 WeakPolarHBondContact O-CB 3.44Å; V121-K125 PolarHBondContact O-N 3.12Å |
| 122 | I | 87 | Confident | 79.2 | Confident | 97 Ų | 97 | 106.8 Ų | 106.8 | 50% | 0.497 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.3 | -48.4 | 175.1 | -68.9 | 165.6 | 0 | 0 | 0 | 110.1 | A118 E119 L124 K125 E126 | A118-I122 VanDerWaalsContact O-CG1 3.28Å; A118-I122 WeakPolarHBondContact O-CG1 3.13Å; A118-I122 PolarHBondContact O-N 3.39Å; E119-I122 PolarHBondContact O-N 3.46Å; I122-L124 PolarHBondContact O-N 2.97Å; I122-K125 WeakPolarHBondContact O-CB 3.42Å; I122-K125 PolarHBondContact O-N 2.98Å; I122-E126 WeakPolarHBondContact O-CG 3.4Å; I122-E126 PolarHBondContact O-N 3.12Å |
| 123 | R | 91.6 | Very high | 81.7 | Confident | 131 Ų | 131 | 103.3 Ų | 103.3 | 49% | 0.494 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -58.3 | -45.8 | 176.9 | 175.7 | 176.2 | 54 | -133.6 | -1.7 | 112.5 | E119 E120 K125 E126 E127 | E119-R123 WeakPolarHBondContact O-CB 3.43Å; E119-R123 PolarHBondContact O-N 3.01Å; E120-R123 PolarHBondContact O-N 3.42Å; E120-R123 IonicContact OE1-NH2 3.6Å; R123-K125 VanDerWaalsContact C-N 3.32Å; R123-K125 PolarHBondContact O-N 3.11Å; R123-E126 PolarHBondContact O-N 3.03Å; R123-E127 WeakPolarHBondContact O-CB 3.39Å; R123-E127 PolarHBondContact O-N 3.03Å |
| 124 | L | 90.3 | Very high | 83.6 | Confident | 96 Ų | 96 | 102.3 Ų | 102.3 | 50% | 0.503 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.4 | -35 | 177.8 | -74.7 | 171.8 | 0 | 0 | 0 | 112 | E120 V121 I122 E127 L128 | E120-L124 HydrophobicContact CG-CD1 4.12Å; E120-L124 HydrophobicContact CG-CG 4.49Å; E120-L124 WeakPolarHBondContact O-CB 3.44Å; E120-L124 WeakPolarHBondContact O-CG 3.37Å; E120-L124 PolarHBondContact O-N 2.93Å; V121-L124 PolarHBondContact O-N 3.3Å; I122-L124 PolarHBondContact O-N 2.97Å; L124-E127 PolarHBondContact O-N 3.24Å; L124-L128 VanDerWaalsContact O-CB 3.29Å; L124-L128 WeakPolarHBondContact O-CB 3.39Å; L124-L128 PolarHBondContact O-N 3.48Å |
| 125 | K | 91.4 | Very high | 85.5 | Confident | 157 Ų | 157 | 100.8 Ų | 100.8 | 68% | 0.683 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -68.7 | -39 | 175.8 | -167.6 | 175.9 | -178.1 | -179.1 | 0 | 111.8 | V121 I122 R123 S129 | V121-K125 VanDerWaalsContact O-CB 3.26Å; V121-K125 WeakPolarHBondContact O-CB 3.44Å; V121-K125 PolarHBondContact O-N 3.12Å; I122-K125 WeakPolarHBondContact O-CB 3.42Å; I122-K125 PolarHBondContact O-N 2.98Å; R123-K125 VanDerWaalsContact C-N 3.32Å; R123-K125 PolarHBondContact O-N 3.11Å; K125-S129 WeakPolarHBondContact O-CB 3.44Å; K125-S129 PolarHBondContact O-N 2.86Å |
| 126 | E | 92.6 | Very high | 87 | Confident | 131 Ų | 131 | 104.4 Ų | 104.4 | 61% | 0.612 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.7 | -43.1 | 171.8 | -72.1 | 176.1 | 175.5 | 0 | 0 | 111.6 | I122 R123 S129 S130 | I122-E126 WeakPolarHBondContact O-CG 3.4Å; I122-E126 PolarHBondContact O-N 3.12Å; R123-E126 PolarHBondContact O-N 3.03Å; E126-S129 PolarHBondContact O-N 3.46Å; E126-S130 WeakPolarHBondContact O-CB 3.49Å; E126-S130 PolarHBondContact O-N 3.36Å |
| 127 | E | 92.2 | Very high | 88.3 | Confident | 90 Ų | 90 | 107 Ų | 107 | 42% | 0.421 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.3 | -41.2 | 176.5 | -164.1 | -170.8 | 151.9 | 0 | 0 | 111.8 | R123 L124 S130 K131 | R123-E127 WeakPolarHBondContact O-CB 3.39Å; R123-E127 PolarHBondContact O-N 3.03Å; L124-E127 PolarHBondContact O-N 3.24Å; E127-S130 PolarHBondContact O-N 3.5Å; E127-K131 WeakPolarHBondContact O-CB 3.32Å; E127-K131 PolarHBondContact O-N 2.88Å; E127-K131 IonicContact OE1-NZ 3.49Å; E127-K131 PolarHBondContact OE1-NZ 3.18Å |
| 128 | L | 89.8 | Confident | 89.2 | Confident | 117 Ų | 117 | 107 Ų | 107 | 61% | 0.613 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.6 | -46.6 | 175.2 | -168 | 81.5 | 0 | 0 | 0 | 110.8 | L124 S130 K131 E132 | L124-L128 VanDerWaalsContact O-CB 3.29Å; L124-L128 WeakPolarHBondContact O-CB 3.39Å; L124-L128 PolarHBondContact O-N 3.48Å; L128-S130 VanDerWaalsContact C-N 3.33Å; L128-S130 PolarHBondContact O-N 2.95Å; L128-K131 PolarHBondContact O-N 3.23Å; L128-E132 VanDerWaalsContact O-CB 3.32Å; L128-E132 WeakPolarHBondContact O-CB 3.09Å; L128-E132 PolarHBondContact O-N 3.35Å |
| 129 | S | 92.3 | Very high | 89.8 | Confident | 64 Ų | 64 | 110.6 Ų | 110.6 | 45% | 0.448 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.4 | -39.4 | 176.6 | -174.1 | 0 | 0 | 0 | 0 | 112 | K125 E126 E132 T133 | K125-S129 WeakPolarHBondContact O-CB 3.44Å; K125-S129 PolarHBondContact O-N 2.86Å; E126-S129 PolarHBondContact O-N 3.46Å; S129-E132 PolarHBondContact O-N 2.91Å; S129-T133 WeakPolarHBondContact O-CG2 3.5Å; S129-T133 PolarHBondContact O-N 2.99Å; S129-T133 PolarHBondContact O-OG1 2.96Å |
| 130 | S | 91.9 | Very high | 90.4 | Very high | 76 Ų | 76 | 107.9 Ų | 107.9 | 53% | 0.531 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.7 | -42.4 | 174.3 | -174.9 | 0 | 0 | 0 | 0 | 112.2 | E126 E127 L128 T133 S134 | E126-S130 WeakPolarHBondContact O-CB 3.49Å; E126-S130 PolarHBondContact O-N 3.36Å; E127-S130 PolarHBondContact O-N 3.5Å; L128-S130 VanDerWaalsContact C-N 3.33Å; L128-S130 PolarHBondContact O-N 2.95Å; S130-T133 WeakPolarHBondContact CA-OG1 3.35Å; S130-T133 PolarHBondContact O-OG1 2.9Å; S130-S134 WeakPolarHBondContact O-CB 3.37Å; S130-S134 PolarHBondContact O-N 3.47Å |
| 131 | K | 92.2 | Very high | 91 | Very high | 127 Ų | 127 | 111.2 Ų | 111.2 | 55% | 0.552 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -66.1 | -39.5 | 174.3 | -83.2 | 175.6 | 170.9 | 155.3 | 0 | 112.3 | E127 L128 S134 N135 | E127-K131 WeakPolarHBondContact O-CB 3.32Å; E127-K131 PolarHBondContact O-N 2.88Å; E127-K131 IonicContact OE1-NZ 3.49Å; E127-K131 PolarHBondContact OE1-NZ 3.18Å; L128-K131 PolarHBondContact O-N 3.23Å; K131-S134 PolarHBondContact O-N 3.35Å; K131-N135 VanDerWaalsContact O-CB 3.26Å; K131-N135 WeakPolarHBondContact O-CB 3.36Å; K131-N135 PolarHBondContact O-N 2.86Å |
| 132 | E | 89.3 | Confident | 91.4 | Very high | 134 Ų | 134 | 111.4 Ų | 111.4 | 63% | 0.626 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.3 | -44 | 178 | -170.4 | 176.2 | -178.6 | 0 | 0 | 111.3 | L128 S129 N135 R136 | L128-E132 VanDerWaalsContact O-CB 3.32Å; L128-E132 WeakPolarHBondContact O-CB 3.09Å; L128-E132 PolarHBondContact O-N 3.35Å; S129-E132 PolarHBondContact O-N 2.91Å; E132-N135 PolarHBondContact O-N 2.82Å; E132-R136 WeakPolarHBondContact O-CB 3.35Å; E132-R136 PolarHBondContact O-N 2.95Å |
| 133 | T | 92.5 | Very high | 91.5 | Very high | 87 Ų | 87 | 110.9 Ų | 110.9 | 53% | 0.534 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -65.9 | -41 | 174.3 | 51 | 0 | 0 | 0 | 0 | 112.6 | S129 S130 R136 L137 | S129-T133 WeakPolarHBondContact O-CG2 3.5Å; S129-T133 PolarHBondContact O-N 2.99Å; S129-T133 PolarHBondContact O-OG1 2.96Å; S130-T133 WeakPolarHBondContact CA-OG1 3.35Å; S130-T133 PolarHBondContact O-OG1 2.9Å; T133-R136 PolarHBondContact O-N 3.33Å; T133-L137 PolarHBondContact O-N 3.38Å |
| 134 | S | 91 | Very high | 91.6 | Very high | 70 Ų | 70 | 112.7 Ų | 112.7 | 49% | 0.49 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60.9 | -45.9 | 174 | -174.7 | 0 | 0 | 0 | 0 | 111.9 | S130 K131 L137 E138 | S130-S134 WeakPolarHBondContact O-CB 3.37Å; S130-S134 PolarHBondContact O-N 3.47Å; K131-S134 PolarHBondContact O-N 3.35Å; S134-L137 WeakPolarHBondContact O-CB 3.41Å; S134-L137 PolarHBondContact O-N 2.94Å; S134-E138 PolarHBondContact O-N 3.36Å |
| 135 | N | 90.5 | Very high | 91.7 | Very high | 102 Ų | 102 | 113.1 Ų | 113.1 | 55% | 0.545 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.3 | -39.4 | 179.5 | -165.3 | 4.5 | 0 | 0 | 0 | 111.2 | K131 E132 L137 E138 Q139 | K131-N135 VanDerWaalsContact O-CB 3.26Å; K131-N135 WeakPolarHBondContact O-CB 3.36Å; K131-N135 PolarHBondContact O-N 2.86Å; E132-N135 PolarHBondContact O-N 2.82Å; N135-L137 VanDerWaalsContact C-N 3.32Å; N135-L137 PolarHBondContact O-N 3.17Å; N135-E138 PolarHBondContact O-N 3.35Å; N135-Q139 WeakPolarHBondContact O-CB 3.5Å; N135-Q139 PolarHBondContact O-N 2.95Å |
| 136 | R | 92.7 | Very high | 91.6 | Very high | 195 Ų | 195 | 110.3 Ų | 110.3 | 74% | 0.736 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.2 | -37.4 | 174.4 | -168 | 175.8 | 179.9 | 169.7 | 0.4 | 112.4 | E132 T133 S140 | E132-R136 WeakPolarHBondContact O-CB 3.35Å; E132-R136 PolarHBondContact O-N 2.95Å; T133-R136 PolarHBondContact O-N 3.33Å; R136-S140 WeakPolarHBondContact O-CB 3.49Å; R136-S140 PolarHBondContact O-N 3.27Å |
| 137 | L | 94 | Very high | 91.7 | Very high | 129 Ų | 129 | 108.8 Ų | 108.8 | 68% | 0.675 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.3 | -43.3 | 174.2 | -174.7 | 69.9 | 0 | 0 | 0 | 111.5 | T133 S134 N135 S140 K141 | T133-L137 PolarHBondContact O-N 3.38Å; S134-L137 WeakPolarHBondContact O-CB 3.41Å; S134-L137 PolarHBondContact O-N 2.94Å; N135-L137 VanDerWaalsContact C-N 3.32Å; N135-L137 PolarHBondContact O-N 3.17Å; L137-S140 WeakPolarHBondContact O-CB 3.3Å; L137-S140 PolarHBondContact O-N 3.47Å; L137-K141 PolarHBondContact O-N 3.47Å |
| 138 | E | 91.2 | Very high | 91.8 | Very high | 110 Ų | 110 | 109.6 Ų | 109.6 | 51% | 0.514 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 176.3 | -173.2 | 173.7 | -174.3 | 0 | 0 | 111.7 | S134 N135 S140 K141 L142 | S134-E138 PolarHBondContact O-N 3.36Å; N135-E138 PolarHBondContact O-N 3.35Å; E138-S140 VanDerWaalsContact C-N 3.32Å; E138-S140 PolarHBondContact O-N 2.93Å; E138-K141 WeakPolarHBondContact O-CB 3.27Å; E138-K141 PolarHBondContact O-N 2.93Å; E138-K141 VanDerWaalsContact O-N 3.14Å; E138-L142 HydrophobicContact CG-CD1 4.28Å; E138-L142 WeakPolarHBondContact O-CG 3.38Å; E138-L142 PolarHBondContact O-N 3.34Å |
| 139 | Q | 88.8 | Confident | 91.8 | Very high | 121 Ų | 121 | 107.3 Ų | 107.3 | 57% | 0.565 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.7 | -40.7 | 174.6 | -170.9 | -178.2 | 14.3 | 0 | 0 | 112 | N135 L142 T143 | N135-Q139 WeakPolarHBondContact O-CB 3.5Å; N135-Q139 PolarHBondContact O-N 2.95Å; Q139-L142 PolarHBondContact O-N 2.92Å; Q139-T143 WeakPolarHBondContact O-CB 3.34Å; Q139-T143 PolarHBondContact O-N 2.76Å; Q139-T143 PolarHBondContact O-OG1 3.34Å |
| 140 | S | 93.2 | Very high | 91.8 | Very high | 67 Ų | 67 | 108.9 Ų | 108.9 | 47% | 0.469 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64 | -41.1 | 174.4 | -174.9 | 0 | 0 | 0 | 0 | 111.7 | R136 L137 E138 T143 R144 | R136-S140 WeakPolarHBondContact O-CB 3.49Å; R136-S140 PolarHBondContact O-N 3.27Å; L137-S140 WeakPolarHBondContact O-CB 3.3Å; L137-S140 PolarHBondContact O-N 3.47Å; E138-S140 VanDerWaalsContact C-N 3.32Å; E138-S140 PolarHBondContact O-N 2.93Å; S140-T143 PolarHBondContact O-N 3.46Å; S140-R144 PolarHBondContact O-N 3.3Å |
| 141 | K | 94.4 | Very high | 91.9 | Very high | 151 Ų | 151 | 109 Ų | 109 | 66% | 0.657 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.4 | -46.6 | 175.7 | -174.7 | -176.1 | 176.2 | -172.7 | 0 | 112 | L137 E138 R144 Q145 | L137-K141 PolarHBondContact O-N 3.47Å; E138-K141 WeakPolarHBondContact O-CB 3.27Å; E138-K141 PolarHBondContact O-N 2.93Å; E138-K141 VanDerWaalsContact O-N 3.14Å; K141-R144 PolarHBondContact O-N 3Å; K141-Q145 PolarHBondContact O-N 2.89Å |
| 142 | L | 90 | Very high | 92.1 | Very high | 87 Ų | 87 | 107.9 Ų | 107.9 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.5 | -42.4 | 177.9 | -71.4 | 172.6 | 0 | 0 | 0 | 111.6 | E138 Q139 R144 Q145 I146 | E138-L142 HydrophobicContact CG-CD1 4.28Å; E138-L142 WeakPolarHBondContact O-CG 3.38Å; E138-L142 PolarHBondContact O-N 3.34Å; Q139-L142 PolarHBondContact O-N 2.92Å; L142-R144 VanDerWaalsContact C-N 3.31Å; L142-R144 PolarHBondContact O-N 2.69Å; L142-Q145 PolarHBondContact O-N 2.8Å; L142-I146 WeakPolarHBondContact O-CG1 3.5Å; L142-I146 PolarHBondContact O-N 3.45Å |
| 143 | T | 90.7 | Very high | 92.2 | Very high | 87 Ų | 87 | 108 Ų | 108 | 53% | 0.534 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.3 | -43.8 | 174.9 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | Q139 S140 I146 Q147 | Q139-T143 WeakPolarHBondContact O-CB 3.34Å; Q139-T143 PolarHBondContact O-N 2.76Å; Q139-T143 PolarHBondContact O-OG1 3.34Å; S140-T143 PolarHBondContact O-N 3.46Å; T143-I146 PolarHBondContact O-N 3.41Å; T143-Q147 PolarHBondContact O-N 3.07Å |
| 144 | R | 92.3 | Very high | 92.3 | Very high | 168 Ų | 168 | 107.3 Ų | 107.3 | 63% | 0.634 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.7 | -43.4 | 176.4 | -171.7 | -177.8 | -70 | 167 | -2.4 | 112 | S140 K141 L142 I146 Q147 E148 | S140-R144 PolarHBondContact O-N 3.3Å; K141-R144 PolarHBondContact O-N 3Å; L142-R144 VanDerWaalsContact C-N 3.31Å; L142-R144 PolarHBondContact O-N 2.69Å; R144-I146 VanDerWaalsContact C-N 3.32Å; R144-I146 PolarHBondContact O-N 3.25Å; R144-Q147 PolarHBondContact O-N 3.11Å; R144-E148 WeakPolarHBondContact O-CG 3.39Å; R144-E148 PolarHBondContact O-N 3.14Å |
| 145 | Q | 92.4 | Very high | 92.5 | Very high | 106 Ų | 106 | 108.8 Ų | 108.8 | 50% | 0.495 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.4 | -35.2 | 179.2 | -170.7 | 175.2 | 3.6 | 0 | 0 | 112.5 | K141 L142 S149 | K141-Q145 PolarHBondContact O-N 2.89Å; L142-Q145 PolarHBondContact O-N 2.8Å; Q145-S149 WeakPolarHBondContact O-CB 3.28Å; Q145-S149 PolarHBondContact O-N 3.47Å; Q145-S149 PolarHBondContact O-OG 2.85Å |
| 146 | I | 90.5 | Very high | 92.6 | Very high | 98 Ų | 98 | 109.2 Ų | 109.2 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.7 | -48 | 172.6 | -70.7 | 166.8 | 0 | 0 | 0 | 109.8 | L142 T143 R144 E148 S149 E150 | L142-I146 WeakPolarHBondContact O-CG1 3.5Å; L142-I146 PolarHBondContact O-N 3.45Å; T143-I146 PolarHBondContact O-N 3.41Å; R144-I146 VanDerWaalsContact C-N 3.32Å; R144-I146 PolarHBondContact O-N 3.25Å; I146-E148 PolarHBondContact O-N 3Å; I146-S149 PolarHBondContact O-N 2.94Å; I146-S149 VanDerWaalsContact O-N 3.17Å; I146-E150 HydrophobicContact CG2-CG 4.33Å; I146-E150 WeakPolarHBondContact O-CG 3.4Å; I146-E150 PolarHBondContact O-N 3Å |
| 147 | Q | 93.3 | Very high | 92.7 | Very high | 98 Ų | 98 | 103.9 Ų | 103.9 | 46% | 0.458 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.4 | -46.6 | 178.1 | -172.5 | 64.6 | 48.8 | 0 | 0 | 112.1 | T143 R144 S149 E150 D151 | T143-Q147 PolarHBondContact O-N 3.07Å; R144-Q147 PolarHBondContact O-N 3.11Å; Q147-S149 VanDerWaalsContact C-N 3.29Å; Q147-S149 PolarHBondContact O-N 3.48Å; Q147-E150 PolarHBondContact O-N 3.37Å; Q147-E150 VanDerWaalsContact O-N 3.16Å; Q147-D151 PolarHBondContact NE2-OD1 2.86Å; Q147-D151 VanDerWaalsContact O-CG 3.27Å; Q147-D151 PolarHBondContact O-N 2.94Å |
| 148 | E | 93.9 | Very high | 92.7 | Very high | 108 Ų | 108 | 101.6 Ų | 101.6 | 51% | 0.505 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.2 | -42.3 | 176.1 | -72.7 | 169 | -171.2 | 0 | 0 | 111.4 | R144 I146 D151 D152 | R144-E148 WeakPolarHBondContact O-CG 3.39Å; R144-E148 PolarHBondContact O-N 3.14Å; I146-E148 PolarHBondContact O-N 3Å; E148-D151 PolarHBondContact O-N 3.36Å; E148-D152 PolarHBondContact O-N 3.24Å |
| 149 | S | 90.8 | Very high | 92.9 | Very high | 69 Ų | 69 | 103.3 Ų | 103.3 | 48% | 0.483 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -69 | -33.5 | 177.6 | -55.8 | 0 | 0 | 0 | 0 | 112.8 | Q145 I146 Q147 R153 | Q145-S149 WeakPolarHBondContact O-CB 3.28Å; Q145-S149 PolarHBondContact O-N 3.47Å; Q145-S149 PolarHBondContact O-OG 2.85Å; I146-S149 PolarHBondContact O-N 2.94Å; I146-S149 VanDerWaalsContact O-N 3.17Å; Q147-S149 VanDerWaalsContact C-N 3.29Å; Q147-S149 PolarHBondContact O-N 3.48Å; S149-R153 VanDerWaalsContact O-CB 3.28Å; S149-R153 WeakPolarHBondContact O-CB 3.42Å; S149-R153 PolarHBondContact O-N 3.37Å |
| 150 | E | 91.4 | Very high | 93.1 | Very high | 96 Ų | 96 | 102.2 Ų | 102.2 | 45% | 0.449 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -69.8 | -40.4 | 175.6 | -76.2 | 178.2 | 173.7 | 0 | 0 | 111.8 | I146 Q147 R153 Q154 | I146-E150 HydrophobicContact CG2-CG 4.33Å; I146-E150 WeakPolarHBondContact O-CG 3.4Å; I146-E150 PolarHBondContact O-N 3Å; Q147-E150 PolarHBondContact O-N 3.37Å; Q147-E150 VanDerWaalsContact O-N 3.16Å; E150-R153 PolarHBondContact O-N 2.97Å; E150-Q154 WeakPolarHBondContact O-CB 3.47Å; E150-Q154 PolarHBondContact O-N 3.36Å |
| 151 | D | 95.2 | Very high | 93.1 | Very high | 80 Ų | 80 | 103.9 Ų | 103.9 | 43% | 0.428 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.3 | -45.6 | 174.7 | -66.8 | -12.2 | 0 | 0 | 0 | 110.5 | Q147 E148 R153 Q154 N155 | Q147-D151 PolarHBondContact NE2-OD1 2.86Å; Q147-D151 VanDerWaalsContact O-CG 3.27Å; Q147-D151 PolarHBondContact O-N 2.94Å; E148-D151 PolarHBondContact O-N 3.36Å; D151-R153 PolarHBondContact O-N 3.27Å; D151-Q154 PolarHBondContact O-N 3.21Å; D151-N155 VanDerWaalsContact O-CG 3.3Å; D151-N155 PolarHBondContact O-N 2.8Å; D151-N155 PolarHBondContact O-ND2 2.79Å |
| 152 | D | 95.2 | Very high | 93.1 | Very high | 103 Ų | 103 | 99.9 Ų | 99.9 | 55% | 0.551 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.8 | -43.7 | 174.9 | -80 | -15.6 | 0 | 0 | 0 | 112.2 | E148 Q154 N155 L156 | E148-D152 PolarHBondContact O-N 3.24Å; D152-Q154 VanDerWaalsContact C-N 3.28Å; D152-Q154 PolarHBondContact O-N 2.94Å; D152-N155 PolarHBondContact O-N 3.46Å; D152-L156 WeakPolarHBondContact O-CG 3.29Å; D152-L156 PolarHBondContact O-N 3.13Å |
| 153 | R | 92.8 | Very high | 93.3 | Very high | 135 Ų | 135 | 98.8 Ų | 98.8 | 51% | 0.509 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.4 | -40.7 | 175.9 | -172.9 | -162.1 | 62.9 | 65.3 | 9.6 | 111 | S149 E150 D151 Q157 | S149-R153 VanDerWaalsContact O-CB 3.28Å; S149-R153 WeakPolarHBondContact O-CB 3.42Å; S149-R153 PolarHBondContact O-N 3.37Å; E150-R153 PolarHBondContact O-N 2.97Å; D151-R153 PolarHBondContact O-N 3.27Å; R153-Q157 WeakPolarHBondContact O-CB 3.32Å; R153-Q157 PolarHBondContact O-N 3.12Å |
| 154 | Q | 93.9 | Very high | 93.5 | Very high | 73 Ų | 73 | 99.5 Ų | 99.5 | 34% | 0.341 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -67.3 | -44.4 | 177.9 | -170.7 | 58 | 45.8 | 0 | 0 | 111.5 | E150 D151 D152 L156 Q157 D158 | E150-Q154 WeakPolarHBondContact O-CB 3.47Å; E150-Q154 PolarHBondContact O-N 3.36Å; D151-Q154 PolarHBondContact O-N 3.21Å; D152-Q154 VanDerWaalsContact C-N 3.28Å; D152-Q154 PolarHBondContact O-N 2.94Å; Q154-L156 VanDerWaalsContact C-N 3.33Å; Q154-L156 PolarHBondContact O-N 2.99Å; Q154-Q157 WeakPolarHBondContact O-CB 3.29Å; Q154-Q157 PolarHBondContact O-N 3.41Å; Q154-Q157 VanDerWaalsContact O-N 3.13Å; Q154-D158 PolarHBondContact NE2-OD1 3.07Å; Q154-D158 VanDerWaalsContact NE2-OD1 3.08Å; Q154-D158 PolarHBondContact O-N 2.97Å |
| 155 | N | 95.1 | Very high | 93.5 | Very high | 102 Ų | 102 | 97.6 Ų | 97.6 | 55% | 0.545 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -58.8 | -43.1 | 175.6 | -70.6 | -31.2 | 0 | 0 | 0 | 112.2 | D151 D152 Q157 D158 Y159 | D151-N155 VanDerWaalsContact O-CG 3.3Å; D151-N155 PolarHBondContact O-N 2.8Å; D151-N155 PolarHBondContact O-ND2 2.79Å; D152-N155 PolarHBondContact O-N 3.46Å; N155-Q157 VanDerWaalsContact C-N 3.34Å; N155-D158 PolarHBondContact O-N 2.82Å; N155-Y159 PolarHBondContact O-N 3.26Å |
| 156 | L | 93.3 | Very high | 93.7 | Very high | 110 Ų | 110 | 96.9 Ų | 96.9 | 58% | 0.576 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.9 | -38.5 | 175.7 | -74.1 | 172.8 | 0 | 0 | 0 | 112.1 | D152 Q154 Y159 I160 | D152-L156 WeakPolarHBondContact O-CG 3.29Å; D152-L156 PolarHBondContact O-N 3.13Å; Q154-L156 VanDerWaalsContact C-N 3.33Å; Q154-L156 PolarHBondContact O-N 2.99Å; L156-Y159 PolarHBondContact O-N 2.83Å; L156-I160 VanDerWaalsContact O-CG1 3.27Å; L156-I160 WeakPolarHBondContact O-CG1 3.33Å; L156-I160 PolarHBondContact O-N 3.46Å |
| 157 | Q | 93.7 | Very high | 93.8 | Very high | 83 Ų | 83 | 96.6 Ų | 96.6 | 39% | 0.388 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 177.2 | -172.2 | 172.8 | -2.3 | 0 | 0 | 111.5 | R153 Q154 N155 Y159 I160 I161 | R153-Q157 WeakPolarHBondContact O-CB 3.32Å; R153-Q157 PolarHBondContact O-N 3.12Å; Q154-Q157 WeakPolarHBondContact O-CB 3.29Å; Q154-Q157 PolarHBondContact O-N 3.41Å; Q154-Q157 VanDerWaalsContact O-N 3.13Å; N155-Q157 VanDerWaalsContact C-N 3.34Å; Q157-Y159 VanDerWaalsContact C-N 3.34Å; Q157-I160 PolarHBondContact O-N 2.86Å; Q157-I161 HydrophobicContact CG-CD1 4.45Å; Q157-I161 WeakPolarHBondContact O-CG1 3.48Å; Q157-I161 PolarHBondContact O-N 3.01Å |
| 158 | D | 94.1 | Very high | 93.9 | Very high | 82 Ų | 82 | 98.6 Ų | 98.6 | 44% | 0.439 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.4 | -39 | 176.5 | -65.6 | -12.9 | 0 | 0 | 0 | 111.3 | Q154 N155 I161 E162 | Q154-D158 PolarHBondContact NE2-OD1 3.07Å; Q154-D158 VanDerWaalsContact NE2-OD1 3.08Å; Q154-D158 PolarHBondContact O-N 2.97Å; N155-D158 PolarHBondContact O-N 2.82Å; D158-I161 PolarHBondContact O-N 3.21Å; D158-E162 PolarHBondContact O-N 2.9Å; D158-E162 VanDerWaalsContact O-N 3.08Å |
| 159 | Y | 96.4 | Very high | 93.9 | Very high | 145 Ų | 145 | 96.5 Ų | 96.5 | 57% | 0.569 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -63.6 | -41.1 | 174.4 | -174.1 | -114.6 | 0 | 0 | 0 | 112.8 | N155 L156 Q157 I161 E162 L163 | N155-Y159 PolarHBondContact O-N 3.26Å; L156-Y159 PolarHBondContact O-N 2.83Å; Q157-Y159 VanDerWaalsContact C-N 3.34Å; Y159-I161 VanDerWaalsContact C-N 3.34Å; Y159-I161 PolarHBondContact O-N 2.89Å; Y159-E162 PolarHBondContact O-N 2.86Å; Y159-L163 HydrophobicContact CD1-CD1 3.88Å; Y159-L163 HydrophobicContact CD1-CG 4.41Å; Y159-L163 HydrophobicContact CE1-CD1 3.41Å; Y159-L163 VanDerWaalsContact CE1-CD1 3.41Å; Y159-L163 HydrophobicContact CE1-CG 4.05Å; Y159-L163 HydrophobicContact CE2-CG 4.4Å; Y159-L163 WeakPolarHBondContact O-CG 3.39Å; Y159-L163 PolarHBondContact O-N 2.86Å |
| 160 | I | 91.9 | Very high | 93.9 | Very high | 98 Ų | 98 | 96.7 Ų | 96.7 | 50% | 0.503 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.5 | -43.5 | 175.2 | -71.7 | 164.8 | 0 | 0 | 0 | 110.7 | L156 Q157 E162 L163 D164 | L156-I160 VanDerWaalsContact O-CG1 3.27Å; L156-I160 WeakPolarHBondContact O-CG1 3.33Å; L156-I160 PolarHBondContact O-N 3.46Å; Q157-I160 PolarHBondContact O-N 2.86Å; I160-E162 VanDerWaalsContact C-N 3.31Å; I160-E162 PolarHBondContact O-N 3.39Å; I160-L163 PolarHBondContact O-N 3.24Å; I160-D164 PolarHBondContact O-N 3.38Å |
| 161 | I | 93.6 | Very high | 94.1 | Very high | 102 Ų | 102 | 100.6 Ų | 100.6 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.7 | -42.1 | 177.9 | -69.1 | 165.2 | 0 | 0 | 0 | 110.9 | Q157 D158 Y159 D164 R165 | Q157-I161 HydrophobicContact CG-CD1 4.45Å; Q157-I161 WeakPolarHBondContact O-CG1 3.48Å; Q157-I161 PolarHBondContact O-N 3.01Å; D158-I161 PolarHBondContact O-N 3.21Å; Y159-I161 VanDerWaalsContact C-N 3.34Å; Y159-I161 PolarHBondContact O-N 2.89Å; I161-D164 PolarHBondContact O-N 3.34Å; I161-R165 PolarHBondContact O-N 3.49Å |
| 162 | E | 94.9 | Very high | 94 | Very high | 68 Ų | 68 | 101.4 Ų | 101.4 | 32% | 0.318 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.1 | -39.9 | 177.9 | -179.1 | 55.3 | -156.9 | 0 | 0 | 112.2 | D158 Y159 I160 R165 Q166 | D158-E162 PolarHBondContact O-N 2.9Å; D158-E162 VanDerWaalsContact O-N 3.08Å; Y159-E162 PolarHBondContact O-N 2.86Å; I160-E162 VanDerWaalsContact C-N 3.31Å; I160-E162 PolarHBondContact O-N 3.39Å; E162-R165 WeakPolarHBondContact O-CB 3.09Å; E162-R165 PolarHBondContact O-N 3.49Å; E162-R165 IonicContact OE1-CZ 2.9Å; E162-R165 IonicContact OE1-NE 2.74Å; E162-R165 PolarHBondContact OE1-NE 2.82Å; E162-R165 IonicContact OE1-NH2 3.7Å; E162-R165 PolarHBondContact OE1-NH2 3.07Å; E162-R165 IonicContact OE2-CZ 3.19Å; E162-R165 IonicContact OE2-NE 3.62Å; E162-R165 PolarHBondContact OE2-NE 2.83Å; E162-R165 IonicContact OE2-NH2 3.82Å; E162-Q166 WeakPolarHBondContact O-CG 3.3Å; E162-Q166 PolarHBondContact O-N 3.37Å; E162-Q166 PolarHBondContact OE1-NE2 3.03Å; E162-Q166 VanDerWaalsContact OE1-NE2 3.11Å |
| 163 | L | 95 | Very high | 93.9 | Very high | 63 Ų | 63 | 102.6 Ų | 102.6 | 33% | 0.33 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.7 | -40.9 | 173.7 | -76.2 | 179.1 | 0 | 0 | 0 | 112.5 | Y159 I160 R165 Q166 L167 | Y159-L163 HydrophobicContact CD1-CD1 3.88Å; Y159-L163 HydrophobicContact CD1-CG 4.41Å; Y159-L163 HydrophobicContact CE1-CD1 3.41Å; Y159-L163 VanDerWaalsContact CE1-CD1 3.41Å; Y159-L163 HydrophobicContact CE1-CG 4.05Å; Y159-L163 HydrophobicContact CE2-CG 4.4Å; Y159-L163 WeakPolarHBondContact O-CG 3.39Å; Y159-L163 PolarHBondContact O-N 2.86Å; I160-L163 PolarHBondContact O-N 3.24Å; L163-R165 VanDerWaalsContact C-N 3.28Å; L163-R165 PolarHBondContact O-N 3.46Å; L163-Q166 PolarHBondContact O-N 3.28Å; L163-L167 WeakPolarHBondContact O-CB 3.28Å; L163-L167 PolarHBondContact O-N 3Å |
| 164 | D | 93.8 | Very high | 93.9 | Very high | 102 Ų | 102 | 100.2 Ų | 100.2 | 55% | 0.545 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63 | -37.2 | 175.4 | -90 | -17.8 | 0 | 0 | 0 | 111.7 | I160 I161 K168 | I160-D164 PolarHBondContact O-N 3.38Å; I161-D164 PolarHBondContact O-N 3.34Å; D164-K168 WeakPolarHBondContact O-CB 3.32Å; D164-K168 PolarHBondContact O-N 3.33Å |
| 165 | R | 93.3 | Very high | 93.9 | Very high | 129 Ų | 129 | 100.2 Ų | 100.2 | 49% | 0.487 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.5 | -49.6 | 173.1 | -169.3 | -175.6 | 74.8 | 80.2 | -2.6 | 111 | I161 E162 L163 L167 K168 D169 | I161-R165 PolarHBondContact O-N 3.49Å; E162-R165 WeakPolarHBondContact O-CB 3.09Å; E162-R165 PolarHBondContact O-N 3.49Å; E162-R165 IonicContact OE1-CZ 2.9Å; E162-R165 IonicContact OE1-NE 2.74Å; E162-R165 PolarHBondContact OE1-NE 2.82Å; E162-R165 IonicContact OE1-NH2 3.7Å; E162-R165 PolarHBondContact OE1-NH2 3.07Å; E162-R165 IonicContact OE2-CZ 3.19Å; E162-R165 IonicContact OE2-NE 3.62Å; E162-R165 PolarHBondContact OE2-NE 2.83Å; E162-R165 IonicContact OE2-NH2 3.82Å; L163-R165 VanDerWaalsContact C-N 3.28Å; L163-R165 PolarHBondContact O-N 3.46Å; R165-L167 PolarHBondContact O-N 3.31Å; R165-K168 WeakPolarHBondContact O-CB 3.4Å; R165-K168 PolarHBondContact O-N 3.28Å; R165-K168 VanDerWaalsContact O-N 3.12Å; R165-D169 IonicContact NH1-OD2 2.72Å; R165-D169 PolarHBondContact NH1-OD2 2.91Å; R165-D169 VanDerWaalsContact NH1-OD2 3.15Å; R165-D169 PolarHBondContact O-N 3.1Å |
| 166 | Q | 95.3 | Very high | 93.7 | Very high | 90 Ų | 90 | 100 Ų | 100 | 42% | 0.421 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.1 | -41.6 | 178.4 | -70.1 | 175.5 | 16.3 | 0 | 0 | 112.3 | E162 L163 K168 D169 C170 | E162-Q166 WeakPolarHBondContact O-CG 3.3Å; E162-Q166 PolarHBondContact O-N 3.37Å; E162-Q166 PolarHBondContact OE1-NE2 3.03Å; E162-Q166 VanDerWaalsContact OE1-NE2 3.11Å; L163-Q166 PolarHBondContact O-N 3.28Å; Q166-K168 VanDerWaalsContact C-N 3.26Å; Q166-K168 PolarHBondContact O-N 2.88Å; Q166-D169 PolarHBondContact O-N 3.4Å; Q166-C170 PolarHBondContact O-N 3.49Å; Q166-C170 PolarHBondContact O-SG 2.98Å; Q166-C170 VanDerWaalsContact O-SG 3.41Å |
| 167 | L | 93.3 | Very high | 93.6 | Very high | 92 Ų | 92 | 98.2 Ų | 98.2 | 48% | 0.482 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.3 | -37.8 | 174.4 | -86.4 | 169.9 | 0 | 0 | 0 | 112.2 | L163 R165 R171 | L163-L167 WeakPolarHBondContact O-CB 3.28Å; L163-L167 PolarHBondContact O-N 3Å; R165-L167 PolarHBondContact O-N 3.31Å; L167-R171 WeakPolarHBondContact O-CB 3.3Å; L167-R171 VanDerWaalsContact O-CG 3.24Å; L167-R171 WeakPolarHBondContact O-CG 3.43Å; L167-R171 PolarHBondContact O-N 3.19Å |
| 168 | K | 94.6 | Very high | 93.5 | Very high | 141 Ų | 141 | 102 Ų | 102 | 61% | 0.613 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -66.8 | -43.2 | 176 | -168.1 | -179.4 | 178.7 | -173.5 | 0 | 111.4 | D164 R165 Q166 R171 L172 | D164-K168 WeakPolarHBondContact O-CB 3.32Å; D164-K168 PolarHBondContact O-N 3.33Å; R165-K168 WeakPolarHBondContact O-CB 3.4Å; R165-K168 PolarHBondContact O-N 3.28Å; R165-K168 VanDerWaalsContact O-N 3.12Å; Q166-K168 VanDerWaalsContact C-N 3.26Å; Q166-K168 PolarHBondContact O-N 2.88Å; K168-R171 PolarHBondContact O-N 3.46Å; K168-L172 WeakPolarHBondContact O-CG 3.28Å; K168-L172 PolarHBondContact O-N 3.3Å; K168-L172 VanDerWaalsContact O-N 3.1Å |
| 169 | D | 93.6 | Very high | 93.3 | Very high | 64 Ų | 64 | 100.8 Ų | 100.8 | 34% | 0.342 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -47.1 | 177.7 | -66.2 | -15.9 | 0 | 0 | 0 | 110.9 | R165 Q166 R171 L172 E173 | R165-D169 IonicContact NH1-OD2 2.72Å; R165-D169 PolarHBondContact NH1-OD2 2.91Å; R165-D169 VanDerWaalsContact NH1-OD2 3.15Å; R165-D169 PolarHBondContact O-N 3.1Å; Q166-D169 PolarHBondContact O-N 3.4Å; D169-R171 VanDerWaalsContact C-N 3.29Å; D169-R171 PolarHBondContact O-N 3.02Å; D169-L172 WeakPolarHBondContact O-CB 3.37Å; D169-L172 PolarHBondContact O-N 3.37Å; D169-E173 PolarHBondContact O-N 3.33Å |
| 170 | C | 92.6 | Very high | 93 | Very high | 73 Ų | 73 | 99.8 Ų | 99.8 | 49% | 0.493 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.1 | -35.3 | 175.2 | -69.7 | 0 | 0 | 0 | 0 | 113 | Q166 L172 L174 | Q166-C170 PolarHBondContact O-N 3.49Å; Q166-C170 PolarHBondContact O-SG 2.98Å; Q166-C170 VanDerWaalsContact O-SG 3.41Å; C170-L172 VanDerWaalsContact C-N 3.34Å; C170-L174 WeakPolarHBondContact O-CB 3.47Å; C170-L174 PolarHBondContact O-N 3.43Å |
| 171 | R | 94.4 | Very high | 92.8 | Very high | 177 Ų | 177 | 100.4 Ų | 100.4 | 67% | 0.668 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.6 | -37.9 | 174.8 | -79.7 | 173.7 | 177.1 | 170.2 | 2.5 | 111.7 | L167 K168 D169 L174 T175 | L167-R171 WeakPolarHBondContact O-CB 3.3Å; L167-R171 VanDerWaalsContact O-CG 3.24Å; L167-R171 WeakPolarHBondContact O-CG 3.43Å; L167-R171 PolarHBondContact O-N 3.19Å; K168-R171 PolarHBondContact O-N 3.46Å; D169-R171 VanDerWaalsContact C-N 3.29Å; D169-R171 PolarHBondContact O-N 3.02Å; R171-L174 PolarHBondContact O-N 3.04Å; R171-T175 WeakPolarHBondContact O-CG2 3.38Å; R171-T175 PolarHBondContact O-N 2.9Å; R171-T175 PolarHBondContact O-OG1 2.94Å |
| 172 | L | 92.5 | Very high | 92.5 | Very high | 97 Ų | 97 | 101.5 Ų | 101.5 | 51% | 0.508 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.2 | -45.3 | 175.5 | -70.2 | 169.7 | 0 | 0 | 0 | 111.5 | K168 D169 C170 L174 T175 D176 | K168-L172 WeakPolarHBondContact O-CG 3.28Å; K168-L172 PolarHBondContact O-N 3.3Å; K168-L172 VanDerWaalsContact O-N 3.1Å; D169-L172 WeakPolarHBondContact O-CB 3.37Å; D169-L172 PolarHBondContact O-N 3.37Å; C170-L172 VanDerWaalsContact C-N 3.34Å; L172-L174 VanDerWaalsContact C-N 3.3Å; L172-L174 PolarHBondContact O-N 3.26Å; L172-T175 WeakPolarHBondContact CA-OG1 3.45Å; L172-T175 PolarHBondContact O-N 3.4Å; L172-T175 VanDerWaalsContact O-N 3.14Å; L172-T175 PolarHBondContact O-OG1 2.87Å; L172-D176 PolarHBondContact O-N 2.95Å |
| 173 | E | 93.3 | Very high | 91.9 | Very high | 129 Ų | 129 | 100.5 Ų | 100.5 | 60% | 0.603 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.5 | -39.5 | 174.5 | -69.6 | -179.7 | 175.4 | 0 | 0 | 112.1 | D169 T175 D176 T177 | D169-E173 PolarHBondContact O-N 3.33Å; E173-T175 VanDerWaalsContact C-N 3.34Å; E173-T175 PolarHBondContact O-N 3.45Å; E173-D176 PolarHBondContact O-N 2.86Å; E173-T177 WeakPolarHBondContact O-CG2 3.46Å; E173-T177 PolarHBondContact O-N 2.95Å; E173-T177 PolarHBondContact O-OG1 3.04Å |
| 174 | L | 93.3 | Very high | 91.4 | Very high | 84 Ų | 84 | 102.8 Ų | 102.8 | 44% | 0.44 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65 | -38 | 175.9 | -173.6 | 68.3 | 0 | 0 | 0 | 111.9 | C170 R171 L172 T177 R178 | C170-L174 WeakPolarHBondContact O-CB 3.47Å; C170-L174 PolarHBondContact O-N 3.43Å; R171-L174 PolarHBondContact O-N 3.04Å; L172-L174 VanDerWaalsContact C-N 3.3Å; L172-L174 PolarHBondContact O-N 3.26Å; L174-T177 WeakPolarHBondContact CA-OG1 3.47Å; L174-T177 PolarHBondContact O-OG1 3.4Å; L174-T177 VanDerWaalsContact O-OG1 3.04Å; L174-R178 WeakPolarHBondContact O-CB 3.49Å; L174-R178 VanDerWaalsContact O-CG 3.27Å; L174-R178 WeakPolarHBondContact O-CG 3.31Å; L174-R178 PolarHBondContact O-N 2.75Å; L174-R178 VanDerWaalsContact O-N 3.09Å |
| 175 | T | 93.4 | Very high | 90.9 | Very high | 73 Ų | 73 | 103.1 Ų | 103.1 | 45% | 0.448 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.7 | -40.2 | 175.3 | 46.2 | 0 | 0 | 0 | 0 | 112 | R171 L172 E173 R178 A179 | R171-T175 WeakPolarHBondContact O-CG2 3.38Å; R171-T175 PolarHBondContact O-N 2.9Å; R171-T175 PolarHBondContact O-OG1 2.94Å; L172-T175 WeakPolarHBondContact CA-OG1 3.45Å; L172-T175 PolarHBondContact O-N 3.4Å; L172-T175 VanDerWaalsContact O-N 3.14Å; L172-T175 PolarHBondContact O-OG1 2.87Å; E173-T175 VanDerWaalsContact C-N 3.34Å; E173-T175 PolarHBondContact O-N 3.45Å; T175-R178 PolarHBondContact O-N 3.02Å; T175-A179 PolarHBondContact O-N 3.37Å |
| 176 | D | 91.2 | Very high | 90.1 | Very high | 98 Ų | 98 | 101.9 Ų | 101.9 | 52% | 0.524 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.2 | -44.4 | 178.5 | -74 | -10.4 | 0 | 0 | 0 | 111.8 | L172 E173 R178 A179 Q180 | L172-D176 PolarHBondContact O-N 2.95Å; E173-D176 PolarHBondContact O-N 2.86Å; D176-R178 VanDerWaalsContact C-N 3.34Å; D176-R178 PolarHBondContact O-N 2.9Å; D176-A179 PolarHBondContact O-N 2.84Å; D176-Q180 WeakPolarHBondContact O-CG 3.38Å; D176-Q180 PolarHBondContact O-N 3.27Å |
| 177 | T | 91.6 | Very high | 89 | Confident | 73 Ų | 73 | 103.7 Ų | 103.7 | 45% | 0.448 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.1 | -36.4 | 176.8 | 50.5 | 0 | 0 | 0 | 0 | 112.4 | E173 L174 Q180 L181 | E173-T177 WeakPolarHBondContact O-CG2 3.46Å; E173-T177 PolarHBondContact O-N 2.95Å; E173-T177 PolarHBondContact O-OG1 3.04Å; L174-T177 WeakPolarHBondContact CA-OG1 3.47Å; L174-T177 PolarHBondContact O-OG1 3.4Å; L174-T177 VanDerWaalsContact O-OG1 3.04Å; T177-Q180 PolarHBondContact O-N 2.97Å; T177-L181 WeakPolarHBondContact O-CB 3.45Å; T177-L181 PolarHBondContact O-N 3.14Å |
| 178 | R | 92 | Very high | 87.8 | Confident | 163 Ų | 163 | 102.9 Ų | 102.9 | 62% | 0.615 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.3 | -44.5 | 171.9 | -79.5 | 176 | 177.2 | 171.7 | 0.5 | 112.1 | L174 T175 D176 Q180 L181 E182 | L174-R178 WeakPolarHBondContact O-CB 3.49Å; L174-R178 VanDerWaalsContact O-CG 3.27Å; L174-R178 WeakPolarHBondContact O-CG 3.31Å; L174-R178 PolarHBondContact O-N 2.75Å; L174-R178 VanDerWaalsContact O-N 3.09Å; T175-R178 PolarHBondContact O-N 3.02Å; D176-R178 VanDerWaalsContact C-N 3.34Å; D176-R178 PolarHBondContact O-N 2.9Å; R178-Q180 VanDerWaalsContact C-N 3.32Å; R178-Q180 PolarHBondContact O-N 3.33Å; R178-L181 PolarHBondContact O-N 3.13Å; R178-E182 PolarHBondContact O-N 3.38Å |
| 179 | A | 88.9 | Confident | 86.2 | Confident | 55 Ų | 55 | 101.9 Ų | 101.9 | 46% | 0.455 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.1 | -40.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | T175 D176 E182 A183 | T175-A179 PolarHBondContact O-N 3.37Å; D176-A179 PolarHBondContact O-N 2.84Å; A179-E182 PolarHBondContact O-N 3.29Å; A179-A183 WeakPolarHBondContact O-CB 3.18Å; A179-A183 PolarHBondContact O-N 3.4Å |
| 180 | Q | 90.5 | Very high | 84.4 | Confident | 125 Ų | 125 | 102.9 Ų | 102.9 | 58% | 0.584 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.7 | -41.4 | 173.8 | -70.6 | 173.3 | 29.3 | 0 | 0 | 112.2 | D176 T177 R178 A183 L184 | D176-Q180 WeakPolarHBondContact O-CG 3.38Å; D176-Q180 PolarHBondContact O-N 3.27Å; T177-Q180 PolarHBondContact O-N 2.97Å; R178-Q180 VanDerWaalsContact C-N 3.32Å; R178-Q180 PolarHBondContact O-N 3.33Å; Q180-A183 PolarHBondContact O-N 3.5Å; Q180-L184 WeakPolarHBondContact O-CG 3.32Å; Q180-L184 PolarHBondContact O-N 2.87Å |
| 181 | L | 88.5 | Confident | 82.3 | Confident | 111 Ų | 111 | 105.3 Ų | 105.3 | 58% | 0.581 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.9 | -41.7 | 178.3 | -167.5 | 146.1 | 0 | 0 | 0 | 111.6 | T177 R178 L184 Q185 | T177-L181 WeakPolarHBondContact O-CB 3.45Å; T177-L181 PolarHBondContact O-N 3.14Å; R178-L181 PolarHBondContact O-N 3.13Å; L181-L184 PolarHBondContact O-N 3.24Å; L181-Q185 WeakPolarHBondContact O-CB 3.32Å; L181-Q185 PolarHBondContact O-N 2.93Å |
| 182 | E | 87.5 | Confident | 80 | Confident | 125 Ų | 125 | 105.8 Ų | 105.8 | 58% | 0.584 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.3 | -42.4 | 174.2 | -171.1 | 171.8 | -169 | 0 | 0 | 111.4 | R178 A179 L184 Q185 I186 | R178-E182 PolarHBondContact O-N 3.38Å; A179-E182 PolarHBondContact O-N 3.29Å; E182-L184 PolarHBondContact O-N 3.01Å; E182-Q185 PolarHBondContact O-N 2.92Å; E182-I186 HydrophobicContact CG-CD1 4.37Å; E182-I186 WeakPolarHBondContact O-CG1 3.43Å; E182-I186 PolarHBondContact O-N 3.21Å |
| 183 | A | 82.2 | Confident | 77.5 | Confident | 46 Ų | 46 | 106.8 Ų | 106.8 | 38% | 0.38 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.8 | -43 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | A179 Q180 Q185 I186 Q187 | A179-A183 WeakPolarHBondContact O-CB 3.18Å; A179-A183 PolarHBondContact O-N 3.4Å; Q180-A183 PolarHBondContact O-N 3.5Å; A183-Q185 VanDerWaalsContact C-N 3.33Å; A183-I186 PolarHBondContact O-N 3.44Å; A183-Q187 WeakPolarHBondContact O-CG 3.46Å; A183-Q187 PolarHBondContact O-N 2.95Å; A183-Q187 VanDerWaalsContact O-N 3.09Å |
| 184 | L | 83.5 | Confident | 75.1 | Confident | 112 Ų | 112 | 107 Ų | 107 | 59% | 0.586 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -64.1 | -37.9 | 174.8 | -74.7 | 171.7 | 0 | 0 | 0 | 112 | Q180 L181 E182 Q187 S188 | Q180-L184 WeakPolarHBondContact O-CG 3.32Å; Q180-L184 PolarHBondContact O-N 2.87Å; L181-L184 PolarHBondContact O-N 3.24Å; E182-L184 PolarHBondContact O-N 3.01Å; L184-Q187 PolarHBondContact O-N 2.96Å; L184-S188 PolarHBondContact O-N 3.41Å |
| 185 | Q | 83 | Confident | 73 | Confident | 109 Ų | 109 | 115 Ų | 115 | 51% | 0.509 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69 | -35.4 | 178.2 | -167.3 | 166.5 | -1.1 | 0 | 0 | 112.4 | L181 E182 A183 Q187 S188 N189 | L181-Q185 WeakPolarHBondContact O-CB 3.32Å; L181-Q185 PolarHBondContact O-N 2.93Å; E182-Q185 PolarHBondContact O-N 2.92Å; A183-Q185 VanDerWaalsContact C-N 3.33Å; Q185-Q187 VanDerWaalsContact C-N 3.34Å; Q185-S188 WeakPolarHBondContact CA-OG 3.44Å; Q185-S188 PolarHBondContact O-N 3.5Å; Q185-S188 PolarHBondContact O-OG 3.46Å; Q185-N189 VanDerWaalsContact O-CG 3.24Å; Q185-N189 PolarHBondContact O-N 2.86Å; Q185-N189 PolarHBondContact O-ND2 3.44Å |
| 186 | I | 76.1 | Confident | 70.9 | Confident | 103 Ų | 103 | 113.3 Ų | 113.3 | 53% | 0.528 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -63.8 | -41.5 | 170.8 | -67.8 | 165.2 | 0 | 0 | 0 | 110.3 | E182 A183 S190 | E182-I186 HydrophobicContact CG-CD1 4.37Å; E182-I186 WeakPolarHBondContact O-CG1 3.43Å; E182-I186 PolarHBondContact O-N 3.21Å; A183-I186 PolarHBondContact O-N 3.44Å; I186-S190 PolarHBondContact O-N 2.95Å |
| 187 | Q | 73.9 | Confident | 69.1 | Low | 128 Ų | 128 | 116 Ų | 116 | 60% | 0.598 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -65.9 | -42.7 | 176.9 | -72.1 | 179.4 | 0.3 | 0 | 0 | 112.3 | A183 L184 Q185 N189 S190 | A183-Q187 WeakPolarHBondContact O-CG 3.46Å; A183-Q187 PolarHBondContact O-N 2.95Å; A183-Q187 VanDerWaalsContact O-N 3.09Å; L184-Q187 PolarHBondContact O-N 2.96Å; Q185-Q187 VanDerWaalsContact C-N 3.34Å; Q187-N189 VanDerWaalsContact C-N 3.26Å; Q187-N189 PolarHBondContact O-N 3.02Å; Q187-S190 PolarHBondContact O-N 3.4Å; Q187-S190 PolarHBondContact O-OG 3.36Å |
| 188 | S | 67.8 | Low | 67.7 | Low | 74 Ų | 74 | 116.8 Ų | 116.8 | 52% | 0.517 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -65 | -30 | -179.7 | 66.4 | 0 | 0 | 0 | 0 | 113.2 | L184 Q185 S190 | L184-S188 PolarHBondContact O-N 3.41Å; Q185-S188 WeakPolarHBondContact CA-OG 3.44Å; Q185-S188 PolarHBondContact O-N 3.5Å; Q185-S188 PolarHBondContact O-OG 3.46Å; S188-S190 VanDerWaalsContact C-N 3.31Å |
| 189 | N | 61.6 | Low | 66.5 | Low | 121 Ų | 121 | 113.2 Ų | 113.2 | 65% | 0.647 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | -0.4 | 179.6 | -64.8 | -12.7 | 0 | 0 | 0 | 113.1 | Q185 Q187 T191 | Q185-N189 VanDerWaalsContact O-CG 3.24Å; Q185-N189 PolarHBondContact O-N 2.86Å; Q185-N189 PolarHBondContact O-ND2 3.44Å; Q187-N189 VanDerWaalsContact C-N 3.26Å; Q187-N189 PolarHBondContact O-N 3.02Å; N189-T191 PolarHBondContact O-N 2.9Å |
| 190 | S | 54 | Low | 65.6 | Low | 85 Ų | 85 | 117.2 Ų | 117.2 | 59% | 0.594 | 64% | 0.635 | S | S | * | * | trans | -92.6 | 20.8 | -174.5 | 77.5 | 0 | 0 | 0 | 0 | 115.1 | I186 Q187 S188 E192 | I186-S190 PolarHBondContact O-N 2.95Å; Q187-S190 PolarHBondContact O-N 3.4Å; Q187-S190 PolarHBondContact O-OG 3.36Å; S188-S190 VanDerWaalsContact C-N 3.31Å; S190-E192 VanDerWaalsContact C-N 3.28Å; S190-E192 PolarHBondContact O-N 3.24Å | ||
| 191 | T | 48.6 | Very low | 65 | Low | 123 Ų | 123 | 114.1 Ų | 114.1 | 76% | 0.755 | 63% | 0.627 | S | S | * | * | trans | -87.6 | 57.1 | 172.2 | 59.2 | 0 | 0 | 0 | 0 | 111.9 | N189 | N189-T191 PolarHBondContact O-N 2.9Š| ||
| 192 | E | 47.2 | Very low | 64.6 | Low | 188 Ų | 188 | 113 Ų | 113 | 88% | 0.879 | 62% | 0.619 | S | S | * | * | trans | -156.6 | 87.4 | 164.6 | -117 | 161.7 | -162.4 | 0 | 0 | 110.3 | S190 T194 | S190-E192 VanDerWaalsContact C-N 3.28Å; S190-E192 PolarHBondContact O-N 3.24Å; E192-T194 PolarHBondContact O-N 3.48Å | ||
| 193 | S | 38.6 | Very low | 64.5 | Low | 118 Ų | 118 | 111.9 Ų | 111.9 | 83% | 0.825 | 62% | 0.615 | S | S | * | * | trans | -67.9 | 95 | 168.7 | 175.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 194 | T | 43.5 | Very low | 64.6 | Low | 134 Ų | 134 | 113.3 Ų | 113.3 | 82% | 0.822 | 61% | 0.614 | S | S | * | * | S | Bend | trans | 176.1 | 129.8 | 133.2 | 25.3 | 0 | 0 | 0 | 0 | 110.6 | E192 | E192-T194 PolarHBondContact O-N 3.48Š|
| 195 | R | 49.1 | Very low | 64.8 | Low | 250 Ų | 250 | 112 Ų | 112 | 94% | 0.943 | 61% | 0.608 | S | S | * | * | trans | 95.8 | 45.3 | 169.3 | -143.2 | 174.5 | -172.9 | 177.9 | 0.7 | 117.1 | ||||
| 196 | G | 49.5 | Very low | 65.1 | Low | 39 Ų | 39 | 113.6 Ų | 113.6 | 40% | 0.402 | 61% | 0.609 | S | S | . | * | trans | -108.9 | 44.5 | -171.7 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 197 | N | 54.4 | Low | 65.8 | Low | 155 Ų | 155 | 114 Ų | 114 | 83% | 0.829 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -113.9 | -13.2 | 175.7 | -80.1 | 4.4 | 0 | 0 | 0 | 115.8 | S201 | N197-S201 PolarHBondContact O-OG 2.96Š|
| 198 | S | 62.3 | Low | 66.7 | Low | 88 Ų | 88 | 110.7 Ų | 110.7 | 62% | 0.615 | 59% | 0.59 | S | S | * | * | S | Bend | trans | -101.6 | -32.9 | -178.2 | -173.6 | 0 | 0 | 0 | 0 | 114.1 | S201 E202 | S198-S201 PolarHBondContact O-OG 2.91Å; S198-S201 VanDerWaalsContact O-OG 3.07Å; S198-E202 PolarHBondContact O-N 3.3Å |
| 199 | V | 66.9 | Low | 67.9 | Low | 89 Ų | 89 | 113.3 Ų | 113.3 | 54% | 0.539 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -81.2 | -38.9 | -175.5 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | E202 I203 | V199-E202 PolarHBondContact O-N 3.46Å; V199-I203 HydrophobicContact CG1-CD1 3.72Å; V199-I203 HydrophobicContact CG1-CG1 4.31Å; V199-I203 WeakPolarHBondContact O-CB 3.39Å; V199-I203 VanDerWaalsContact O-CG1 3.29Å; V199-I203 WeakPolarHBondContact O-CG1 3.28Å; V199-I203 PolarHBondContact O-N 2.91Å |
| 200 | F | 70 | Confident | 69.5 | Low | 138 Ų | 138 | 110 Ų | 110 | 61% | 0.605 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -65.3 | -40.4 | 176.4 | -76 | -77.4 | 0 | 0 | 0 | 112.5 | E204 | F200-E204 WeakPolarHBondContact O-CB 3.28Å; F200-E204 PolarHBondContact O-N 2.86Å |
| 201 | S | 76 | Confident | 71.4 | Confident | 60 Ų | 60 | 110.3 Ų | 110.3 | 42% | 0.42 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.8 | -40.4 | 175.5 | 56.6 | 0 | 0 | 0 | 0 | 111.8 | N197 S198 E204 D205 | N197-S201 PolarHBondContact O-OG 2.96Å; S198-S201 PolarHBondContact O-OG 2.91Å; S198-S201 VanDerWaalsContact O-OG 3.07Å; S201-E204 PolarHBondContact O-N 3.42Å; S201-D205 WeakPolarHBondContact O-CB 3.29Å; S201-D205 VanDerWaalsContact O-CG 3.28Å; S201-D205 PolarHBondContact O-N 3.46Å |
| 202 | E | 81.3 | Confident | 73.6 | Confident | 89 Ų | 89 | 111.4 Ų | 111.4 | 42% | 0.416 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -69 | -41.1 | 178 | -166.9 | -174.6 | 166.4 | 0 | 0 | 112.8 | S198 V199 E204 D205 R206 | S198-E202 PolarHBondContact O-N 3.3Å; V199-E202 PolarHBondContact O-N 3.46Å; E202-E204 VanDerWaalsContact C-N 3.34Å; E202-D205 PolarHBondContact O-N 3.49Å; E202-R206 WeakPolarHBondContact O-CB 3.42Å; E202-R206 VanDerWaalsContact O-CG 3.29Å; E202-R206 WeakPolarHBondContact O-CG 3.37Å; E202-R206 PolarHBondContact O-N 2.94Å; E202-R206 IonicContact OE1-CZ 3.93Å; E202-R206 IonicContact OE1-NE 3.88Å; E202-R206 PolarHBondContact OE1-NE 3.36Å; E202-R206 IonicContact OE1-NH2 2.88Å; E202-R206 PolarHBondContact OE1-NH2 3.07Å |
| 203 | I | 84 | Confident | 75.9 | Confident | 100 Ų | 100 | 107 Ų | 107 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.7 | -43.5 | 175.4 | -70.6 | 172 | 0 | 0 | 0 | 110.1 | V199 R206 R207 | V199-I203 HydrophobicContact CG1-CD1 3.72Å; V199-I203 HydrophobicContact CG1-CG1 4.31Å; V199-I203 WeakPolarHBondContact O-CB 3.39Å; V199-I203 VanDerWaalsContact O-CG1 3.29Å; V199-I203 WeakPolarHBondContact O-CG1 3.28Å; V199-I203 PolarHBondContact O-N 2.91Å; I203-R206 WeakPolarHBondContact O-CB 3.36Å; I203-R206 PolarHBondContact O-N 3.01Å; I203-R207 PolarHBondContact O-N 3.19Å |
| 204 | E | 85 | Confident | 78.7 | Confident | 77 Ų | 77 | 104.7 Ų | 104.7 | 36% | 0.36 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.7 | -42.1 | 177.7 | -175.7 | 57.3 | -162.1 | 0 | 0 | 111.4 | F200 S201 E202 R206 R207 I208 | F200-E204 WeakPolarHBondContact O-CB 3.28Å; F200-E204 PolarHBondContact O-N 2.86Å; S201-E204 PolarHBondContact O-N 3.42Å; E202-E204 VanDerWaalsContact C-N 3.34Å; E204-R206 VanDerWaalsContact C-N 3.32Å; E204-R206 PolarHBondContact O-N 3.49Å; E204-R207 WeakPolarHBondContact O-CB 3.48Å; E204-R207 PolarHBondContact O-N 3.37Å; E204-R207 IonicContact OE1-CZ 2.93Å; E204-R207 IonicContact OE1-NE 3.45Å; E204-R207 PolarHBondContact OE1-NE 3.34Å; E204-R207 IonicContact OE1-NH2 3.15Å; E204-R207 PolarHBondContact OE1-NH2 2.87Å; E204-R207 IonicContact OE2-CZ 3.65Å; E204-R207 IonicContact OE2-NE 3.38Å; E204-R207 PolarHBondContact OE2-NE 2.88Å; E204-R207 IonicContact OE2-NH2 2.58Å; E204-I208 HydrophobicContact CG-CD1 4.06Å; E204-I208 VanDerWaalsContact O-CG1 3.28Å; E204-I208 WeakPolarHBondContact O-CG1 3.5Å; E204-I208 PolarHBondContact O-N 3.49Å |
| 205 | D | 87.2 | Confident | 81.1 | Confident | 84 Ų | 84 | 101.8 Ų | 101.8 | 45% | 0.449 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.5 | -37.7 | 173.5 | -80.5 | -17.9 | 0 | 0 | 0 | 112.2 | S201 E202 R209 | S201-D205 WeakPolarHBondContact O-CB 3.29Å; S201-D205 VanDerWaalsContact O-CG 3.28Å; S201-D205 PolarHBondContact O-N 3.46Å; E202-D205 PolarHBondContact O-N 3.49Å; D205-R209 WeakPolarHBondContact O-CB 3.39Å; D205-R209 WeakPolarHBondContact O-CG 3.46Å; D205-R209 PolarHBondContact O-N 2.63Å; D205-R209 PolarHBondContact O-NH1 3.41Å |
| 206 | R | 89.5 | Confident | 83.4 | Confident | 143 Ų | 143 | 96 Ų | 96 | 54% | 0.54 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.1 | -42.3 | 173.5 | -74.7 | 173.8 | -174 | -154.9 | 3.5 | 111.4 | E202 I203 E204 R209 A210 | E202-R206 WeakPolarHBondContact O-CB 3.42Å; E202-R206 VanDerWaalsContact O-CG 3.29Å; E202-R206 WeakPolarHBondContact O-CG 3.37Å; E202-R206 PolarHBondContact O-N 2.94Å; E202-R206 IonicContact OE1-CZ 3.93Å; E202-R206 IonicContact OE1-NE 3.88Å; E202-R206 PolarHBondContact OE1-NE 3.36Å; E202-R206 IonicContact OE1-NH2 2.88Å; E202-R206 PolarHBondContact OE1-NH2 3.07Å; I203-R206 WeakPolarHBondContact O-CB 3.36Å; I203-R206 PolarHBondContact O-N 3.01Å; E204-R206 VanDerWaalsContact C-N 3.32Å; E204-R206 PolarHBondContact O-N 3.49Å; R206-R209 PolarHBondContact O-N 2.98Å; R206-A210 WeakPolarHBondContact O-CB 3.44Å; R206-A210 PolarHBondContact O-N 3.04Å |
| 207 | R | 92.4 | Very high | 85.6 | Confident | 110 Ų | 110 | 99.1 Ų | 99.1 | 42% | 0.415 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.9 | -52.3 | 175.3 | -172.1 | -170.6 | 72.9 | 82.4 | 6 | 110.4 | I203 E204 R209 A210 E211 | I203-R207 PolarHBondContact O-N 3.19Å; E204-R207 WeakPolarHBondContact O-CB 3.48Å; E204-R207 PolarHBondContact O-N 3.37Å; E204-R207 IonicContact OE1-CZ 2.93Å; E204-R207 IonicContact OE1-NE 3.45Å; E204-R207 PolarHBondContact OE1-NE 3.34Å; E204-R207 IonicContact OE1-NH2 3.15Å; E204-R207 PolarHBondContact OE1-NH2 2.87Å; E204-R207 IonicContact OE2-CZ 3.65Å; E204-R207 IonicContact OE2-NE 3.38Å; E204-R207 PolarHBondContact OE2-NE 2.88Å; E204-R207 IonicContact OE2-NH2 2.58Å; R207-R209 VanDerWaalsContact C-N 3.29Å; R207-R209 PolarHBondContact O-N 3.46Å; R207-A210 PolarHBondContact O-N 3.48Å; R207-A210 VanDerWaalsContact O-N 3.14Å; R207-E211 IonicContact CZ-OE1 3.32Å; R207-E211 IonicContact CZ-OE2 3.37Å; R207-E211 IonicContact NH1-OE1 2.66Å; R207-E211 PolarHBondContact NH1-OE1 2.94Å; R207-E211 IonicContact NH1-OE2 3.32Å; R207-E211 PolarHBondContact NH1-OE2 3.37Å; R207-E211 IonicContact NH2-OE2 2.7Å; R207-E211 WeakPolarHBondContact O-CG 3.5Å; R207-E211 PolarHBondContact O-N 2.71Å |
| 208 | I | 91.9 | Very high | 87.6 | Confident | 60 Ų | 60 | 96.9 Ų | 96.9 | 31% | 0.308 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.1 | -39.7 | 178.6 | -66.7 | 166.9 | 0 | 0 | 0 | 111.1 | E204 K212 | E204-I208 HydrophobicContact CG-CD1 4.06Å; E204-I208 VanDerWaalsContact O-CG1 3.28Å; E204-I208 WeakPolarHBondContact O-CG1 3.5Å; E204-I208 PolarHBondContact O-N 3.49Å; I208-K212 HydrophobicContact CG2-CD 4.49Å; I208-K212 WeakPolarHBondContact O-CG 3.18Å; I208-K212 PolarHBondContact O-N 3.05Å; I208-K212 VanDerWaalsContact O-N 3.09Å |
| 209 | R | 93.9 | Very high | 89.2 | Confident | 128 Ų | 128 | 98.6 Ų | 98.6 | 48% | 0.483 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -67.1 | -44.2 | 175.3 | -76.4 | -168.8 | -59.1 | -88.2 | 4.9 | 112.6 | D205 R206 R207 K212 I213 | D205-R209 WeakPolarHBondContact O-CB 3.39Å; D205-R209 WeakPolarHBondContact O-CG 3.46Å; D205-R209 PolarHBondContact O-N 2.63Å; D205-R209 PolarHBondContact O-NH1 3.41Å; R206-R209 PolarHBondContact O-N 2.98Å; R207-R209 VanDerWaalsContact C-N 3.29Å; R207-R209 PolarHBondContact O-N 3.46Å; R209-K212 PolarHBondContact O-N 3.26Å; R209-I213 WeakPolarHBondContact O-CG1 3.36Å; R209-I213 PolarHBondContact O-N 3.4Å |
| 210 | A | 93.2 | Very high | 90.7 | Very high | 52 Ų | 52 | 99 Ų | 99 | 43% | 0.43 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.6 | -43.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | R206 R207 K212 I213 V214 | R206-A210 WeakPolarHBondContact O-CB 3.44Å; R206-A210 PolarHBondContact O-N 3.04Å; R207-A210 PolarHBondContact O-N 3.48Å; R207-A210 VanDerWaalsContact O-N 3.14Å; A210-K212 PolarHBondContact O-N 3.34Å; A210-I213 WeakPolarHBondContact O-CB 3.32Å; A210-I213 PolarHBondContact O-N 2.97Å; A210-I213 VanDerWaalsContact O-N 3.11Å; A210-V214 WeakPolarHBondContact O-CG2 3.36Å; A210-V214 PolarHBondContact O-N 2.88Å |
| 211 | E | 94.4 | Very high | 92 | Very high | 92 Ų | 92 | 96.5 Ų | 96.5 | 43% | 0.43 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59.8 | -44.7 | 175.5 | -75.2 | 178.5 | 175.1 | 0 | 0 | 111.9 | R207 I213 V214 V215 | R207-E211 IonicContact CZ-OE1 3.32Å; R207-E211 IonicContact CZ-OE2 3.37Å; R207-E211 IonicContact NH1-OE1 2.66Å; R207-E211 PolarHBondContact NH1-OE1 2.94Å; R207-E211 IonicContact NH1-OE2 3.32Å; R207-E211 PolarHBondContact NH1-OE2 3.37Å; R207-E211 IonicContact NH2-OE2 2.7Å; R207-E211 WeakPolarHBondContact O-CG 3.5Å; R207-E211 PolarHBondContact O-N 2.71Å; E211-I213 VanDerWaalsContact C-N 3.28Å; E211-I213 PolarHBondContact O-N 3.48Å; E211-V214 PolarHBondContact O-N 2.79Å; E211-V215 VanDerWaalsContact O-CG2 3.3Å; E211-V215 WeakPolarHBondContact O-CG2 3.29Å; E211-V215 PolarHBondContact O-N 2.88Å |
| 212 | K | 95.5 | Very high | 93 | Very high | 146 Ų | 146 | 98.3 Ų | 98.3 | 64% | 0.635 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -59.9 | -37.7 | 174.2 | -77.1 | 177.5 | -179.8 | 178.8 | 0 | 112.8 | I208 R209 A210 K216 | I208-K212 HydrophobicContact CG2-CD 4.49Å; I208-K212 WeakPolarHBondContact O-CG 3.18Å; I208-K212 PolarHBondContact O-N 3.05Å; I208-K212 VanDerWaalsContact O-N 3.09Å; R209-K212 PolarHBondContact O-N 3.26Å; A210-K212 PolarHBondContact O-N 3.34Å; K212-K216 WeakPolarHBondContact O-CB 3.42Å; K212-K216 PolarHBondContact O-N 3.37Å; K212-K216 VanDerWaalsContact O-N 3.08Å |
| 213 | I | 95.8 | Very high | 93.7 | Very high | 95 Ų | 95 | 98.7 Ų | 98.7 | 49% | 0.487 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -68.8 | -45.1 | 176.9 | -68.6 | 166.4 | 0 | 0 | 0 | 110.6 | R209 A210 E211 K216 Q217 | R209-I213 WeakPolarHBondContact O-CG1 3.36Å; R209-I213 PolarHBondContact O-N 3.4Å; A210-I213 WeakPolarHBondContact O-CB 3.32Å; A210-I213 PolarHBondContact O-N 2.97Å; A210-I213 VanDerWaalsContact O-N 3.11Å; E211-I213 VanDerWaalsContact C-N 3.28Å; E211-I213 PolarHBondContact O-N 3.48Å; I213-K216 PolarHBondContact O-N 3.5Å; I213-Q217 HydrophobicContact CG2-CG 4.36Å; I213-Q217 WeakPolarHBondContact O-CG 3.4Å; I213-Q217 PolarHBondContact O-N 2.93Å |
| 214 | V | 95.9 | Very high | 94.4 | Very high | 70 Ų | 70 | 99.1 Ų | 99.1 | 42% | 0.424 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60.5 | -47.6 | 177.9 | 171.7 | 0 | 0 | 0 | 0 | 110.4 | A210 E211 K216 Q217 E218 | A210-V214 WeakPolarHBondContact O-CG2 3.36Å; A210-V214 PolarHBondContact O-N 2.88Å; E211-V214 PolarHBondContact O-N 2.79Å; V214-K216 VanDerWaalsContact C-N 3.32Å; V214-K216 PolarHBondContact O-N 3.4Å; V214-Q217 PolarHBondContact O-N 2.85Å; V214-Q217 VanDerWaalsContact O-N 3.11Å; V214-E218 HydrophobicContact CG1-CG 4.35Å; V214-E218 WeakPolarHBondContact O-CG 3.36Å; V214-E218 PolarHBondContact O-N 2.87Å |
| 215 | V | 95.5 | Very high | 95 | Very high | 73 Ų | 73 | 100.8 Ų | 100.8 | 44% | 0.442 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -57.2 | -45.5 | 175.8 | 171.6 | 0 | 0 | 0 | 0 | 111 | E211 Q217 E218 E219 | E211-V215 VanDerWaalsContact O-CG2 3.3Å; E211-V215 WeakPolarHBondContact O-CG2 3.29Å; E211-V215 PolarHBondContact O-N 2.88Å; V215-Q217 VanDerWaalsContact C-N 3.34Å; V215-Q217 PolarHBondContact O-N 3.43Å; V215-E218 PolarHBondContact O-N 3.18Å; V215-E219 WeakPolarHBondContact O-CG 3.48Å; V215-E219 PolarHBondContact O-N 3.45Å |
| 216 | K | 96.3 | Very high | 95.4 | Very high | 129 Ų | 129 | 101.4 Ų | 101.4 | 56% | 0.561 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63 | -38.6 | 176.8 | -172.9 | 179.9 | -179.7 | -177.6 | 0 | 112.6 | K212 I213 V214 Q220 | K212-K216 WeakPolarHBondContact O-CB 3.42Å; K212-K216 PolarHBondContact O-N 3.37Å; K212-K216 VanDerWaalsContact O-N 3.08Å; I213-K216 PolarHBondContact O-N 3.5Å; V214-K216 VanDerWaalsContact C-N 3.32Å; V214-K216 PolarHBondContact O-N 3.4Å; K216-Q220 WeakPolarHBondContact O-CG 3.41Å; K216-Q220 PolarHBondContact O-N 2.64Å; K216-Q220 VanDerWaalsContact O-N 3.08Å |
| 217 | Q | 96.5 | Very high | 95.8 | Very high | 103 Ų | 103 | 101 Ų | 101 | 48% | 0.481 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -69.3 | -39.8 | 176.2 | -74.4 | 177.3 | -17.8 | 0 | 0 | 111.6 | I213 V214 V215 Q220 I221 | I213-Q217 HydrophobicContact CG2-CG 4.36Å; I213-Q217 WeakPolarHBondContact O-CG 3.4Å; I213-Q217 PolarHBondContact O-N 2.93Å; V214-Q217 PolarHBondContact O-N 2.85Å; V214-Q217 VanDerWaalsContact O-N 3.11Å; V215-Q217 VanDerWaalsContact C-N 3.34Å; V215-Q217 PolarHBondContact O-N 3.43Å; Q217-Q220 PolarHBondContact O-N 3.49Å; Q217-I221 WeakPolarHBondContact O-CB 3.36Å; Q217-I221 VanDerWaalsContact O-CG1 3.26Å; Q217-I221 WeakPolarHBondContact O-CG1 3.33Å; Q217-I221 PolarHBondContact O-N 2.93Å |
| 218 | E | 96.5 | Very high | 96 | Very high | 109 Ų | 109 | 100.7 Ų | 100.7 | 51% | 0.509 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.7 | -43.4 | 174.5 | -74.6 | -177.7 | 164.2 | 0 | 0 | 111.5 | V214 V215 I221 N222 | V214-E218 HydrophobicContact CG1-CG 4.35Å; V214-E218 WeakPolarHBondContact O-CG 3.36Å; V214-E218 PolarHBondContact O-N 2.87Å; V215-E218 PolarHBondContact O-N 3.18Å; E218-I221 PolarHBondContact O-N 3.49Å; E218-N222 WeakPolarHBondContact O-CB 3.41Å; E218-N222 PolarHBondContact O-N 2.96Å; E218-N222 PolarHBondContact O-ND2 3.48Å; E218-N222 VanDerWaalsContact O-ND2 3.17Å |
| 219 | E | 96.4 | Very high | 96.3 | Very high | 123 Ų | 123 | 105.8 Ų | 105.8 | 58% | 0.575 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -58 | -47.1 | 172.7 | -73.4 | 173.2 | 174.9 | 0 | 0 | 111.7 | V215 N222 E223 | V215-E219 WeakPolarHBondContact O-CG 3.48Å; V215-E219 PolarHBondContact O-N 3.45Å; E219-N222 PolarHBondContact O-N 3.35Å; E219-E223 PolarHBondContact O-N 2.91Å |
| 220 | Q | 97.2 | Very high | 96.4 | Very high | 98 Ų | 98 | 104.4 Ų | 104.4 | 46% | 0.458 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.4 | -41.9 | 176.9 | -74.4 | 179 | -17.4 | 0 | 0 | 112.8 | K216 Q217 N222 E223 L224 | K216-Q220 WeakPolarHBondContact O-CG 3.41Å; K216-Q220 PolarHBondContact O-N 2.64Å; K216-Q220 VanDerWaalsContact O-N 3.08Å; Q217-Q220 PolarHBondContact O-N 3.49Å; Q220-N222 VanDerWaalsContact C-N 3.32Å; Q220-N222 PolarHBondContact O-N 2.93Å; Q220-E223 PolarHBondContact O-N 2.8Å; Q220-L224 WeakPolarHBondContact O-CB 3.33Å; Q220-L224 WeakPolarHBondContact O-CG 3.28Å; Q220-L224 PolarHBondContact O-N 2.9Å |
| 221 | I | 96.7 | Very high | 96.6 | Very high | 85 Ų | 85 | 106.3 Ų | 106.3 | 44% | 0.436 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.3 | -41.5 | 176.4 | -72.4 | 166.6 | 0 | 0 | 0 | 110.1 | Q217 E218 L224 K225 | Q217-I221 WeakPolarHBondContact O-CB 3.36Å; Q217-I221 VanDerWaalsContact O-CG1 3.26Å; Q217-I221 WeakPolarHBondContact O-CG1 3.33Å; Q217-I221 PolarHBondContact O-N 2.93Å; E218-I221 PolarHBondContact O-N 3.49Å; I221-L224 PolarHBondContact O-N 3.35Å; I221-K225 HydrophobicContact CG2-CD 4.01Å; I221-K225 HydrophobicContact CG2-CG 4.42Å; I221-K225 WeakPolarHBondContact O-CB 3.43Å; I221-K225 VanDerWaalsContact O-CG 3.27Å; I221-K225 WeakPolarHBondContact O-CG 3.36Å; I221-K225 PolarHBondContact O-N 3.41Å |
| 222 | N | 97.3 | Very high | 96.6 | Very high | 98 Ų | 98 | 106.4 Ų | 106.4 | 52% | 0.524 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.5 | -40.3 | 177.3 | -72.1 | -27.9 | 0 | 0 | 0 | 111.8 | E218 E219 Q220 K225 L226 | E218-N222 WeakPolarHBondContact O-CB 3.41Å; E218-N222 PolarHBondContact O-N 2.96Å; E218-N222 PolarHBondContact O-ND2 3.48Å; E218-N222 VanDerWaalsContact O-ND2 3.17Å; E219-N222 PolarHBondContact O-N 3.35Å; Q220-N222 VanDerWaalsContact C-N 3.32Å; Q220-N222 PolarHBondContact O-N 2.93Å; N222-K225 PolarHBondContact O-N 3.48Å; N222-L226 PolarHBondContact O-N 3.26Å |
| 223 | E | 97.4 | Very high | 96.7 | Very high | 97 Ų | 97 | 103.4 Ų | 103.4 | 45% | 0.453 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.1 | -45.9 | 173.8 | -172.1 | -179.9 | -173.9 | 0 | 0 | 112 | E219 Q220 L226 R227 | E219-E223 PolarHBondContact O-N 2.91Å; Q220-E223 PolarHBondContact O-N 2.8Å; E223-L226 WeakPolarHBondContact O-CB 3.26Å; E223-L226 PolarHBondContact O-N 3.08Å; E223-R227 WeakPolarHBondContact O-CG 3.34Å; E223-R227 PolarHBondContact O-N 3.36Å; E223-R227 IonicContact OE1-CZ 2.63Å; E223-R227 IonicContact OE1-NE 2.64Å; E223-R227 PolarHBondContact OE1-NE 3.46Å; E223-R227 IonicContact OE1-NH2 3.33Å; E223-R227 PolarHBondContact OE1-NH2 2.91Å |
| 224 | L | 97.3 | Very high | 96.8 | Very high | 110 Ų | 110 | 102.1 Ų | 102.1 | 58% | 0.576 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.1 | -40.9 | 177.5 | -73.1 | 173.9 | 0 | 0 | 0 | 112.1 | Q220 I221 L226 R227 L228 | Q220-L224 WeakPolarHBondContact O-CB 3.33Å; Q220-L224 WeakPolarHBondContact O-CG 3.28Å; Q220-L224 PolarHBondContact O-N 2.9Å; I221-L224 PolarHBondContact O-N 3.35Å; L224-L226 VanDerWaalsContact C-N 3.29Å; L224-L226 PolarHBondContact O-N 2.99Å; L224-R227 PolarHBondContact O-N 2.81Å; L224-L228 WeakPolarHBondContact O-CB 3.27Å; L224-L228 PolarHBondContact O-N 3.19Å |
| 225 | K | 97.7 | Very high | 96.8 | Very high | 112 Ų | 112 | 101.4 Ų | 101.4 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.9 | -40.3 | 173.6 | -78 | 174.2 | 179 | 174.1 | 0 | 111.5 | I221 N222 R229 | I221-K225 HydrophobicContact CG2-CD 4.01Å; I221-K225 HydrophobicContact CG2-CG 4.42Å; I221-K225 WeakPolarHBondContact O-CB 3.43Å; I221-K225 VanDerWaalsContact O-CG 3.27Å; I221-K225 WeakPolarHBondContact O-CG 3.36Å; I221-K225 PolarHBondContact O-N 3.41Å; N222-K225 PolarHBondContact O-N 3.48Å; K225-R229 WeakPolarHBondContact O-CG 3.24Å; K225-R229 PolarHBondContact O-N 3.37Å; K225-R229 VanDerWaalsContact O-N 3.08Å |
| 226 | L | 96.9 | Very high | 96.8 | Very high | 97 Ų | 97 | 104.7 Ų | 104.7 | 51% | 0.508 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.6 | -47 | 176.5 | -175.6 | 65.8 | 0 | 0 | 0 | 111.4 | N222 E223 L224 L228 R229 Q230 | N222-L226 PolarHBondContact O-N 3.26Å; E223-L226 WeakPolarHBondContact O-CB 3.26Å; E223-L226 PolarHBondContact O-N 3.08Å; L224-L226 VanDerWaalsContact C-N 3.29Å; L224-L226 PolarHBondContact O-N 2.99Å; L226-L228 VanDerWaalsContact C-N 3.34Å; L226-L228 PolarHBondContact O-N 2.89Å; L226-R229 PolarHBondContact O-N 3.2Å; L226-Q230 WeakPolarHBondContact O-CG 3.35Å; L226-Q230 PolarHBondContact O-N 2.98Å |
| 227 | R | 97.3 | Very high | 96.9 | Very high | 134 Ų | 134 | 104.2 Ų | 104.2 | 51% | 0.506 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -39.1 | 177.4 | -70.9 | -177.8 | -173.5 | 179.5 | 1.7 | 112.6 | E223 L224 Q230 T231 | E223-R227 WeakPolarHBondContact O-CG 3.34Å; E223-R227 PolarHBondContact O-N 3.36Å; E223-R227 IonicContact OE1-CZ 2.63Å; E223-R227 IonicContact OE1-NE 2.64Å; E223-R227 PolarHBondContact OE1-NE 3.46Å; E223-R227 IonicContact OE1-NH2 3.33Å; E223-R227 PolarHBondContact OE1-NH2 2.91Å; L224-R227 PolarHBondContact O-N 2.81Å; R227-Q230 PolarHBondContact O-N 3.4Å; R227-T231 WeakPolarHBondContact O-CB 3.34Å; R227-T231 PolarHBondContact O-N 3.48Å; R227-T231 PolarHBondContact O-OG1 2.93Å |
| 228 | L | 96.4 | Very high | 96.9 | Very high | 103 Ų | 103 | 105.5 Ų | 105.5 | 54% | 0.539 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.2 | -49.8 | 175.9 | -177.5 | 65.6 | 0 | 0 | 0 | 110.5 | L224 L226 Q230 T231 E232 | L224-L228 WeakPolarHBondContact O-CB 3.27Å; L224-L228 PolarHBondContact O-N 3.19Å; L226-L228 VanDerWaalsContact C-N 3.34Å; L226-L228 PolarHBondContact O-N 2.89Å; L228-Q230 VanDerWaalsContact C-N 3.32Å; L228-Q230 PolarHBondContact O-N 2.88Å; L228-T231 PolarHBondContact O-N 3.33Å; L228-T231 VanDerWaalsContact O-N 3.14Å; L228-E232 WeakPolarHBondContact O-CG 3.38Å; L228-E232 PolarHBondContact O-N 3.37Å |
| 229 | R | 97.3 | Very high | 96.9 | Very high | 167 Ų | 167 | 105.4 Ų | 105.4 | 63% | 0.63 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.5 | -44.3 | 176.2 | -74.2 | 178.1 | -174.6 | 168.3 | 1.3 | 112 | K225 L226 T231 E232 T233 | K225-R229 WeakPolarHBondContact O-CG 3.24Å; K225-R229 PolarHBondContact O-N 3.37Å; K225-R229 VanDerWaalsContact O-N 3.08Å; L226-R229 PolarHBondContact O-N 3.2Å; R229-T231 PolarHBondContact O-N 3.29Å; R229-E232 PolarHBondContact O-N 3.46Å; R229-T233 WeakPolarHBondContact O-CG2 3.49Å; R229-T233 PolarHBondContact O-N 3.14Å; R229-T233 PolarHBondContact O-OG1 3.27Å; R229-T233 VanDerWaalsContact O-OG1 3.08Å |
| 230 | Q | 96.7 | Very high | 96.9 | Very high | 100 Ų | 100 | 103 Ų | 103 | 47% | 0.467 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.1 | -44.9 | 176.1 | -74.6 | 173.6 | -14 | 0 | 0 | 111.9 | L226 R227 L228 E232 T233 D234 | L226-Q230 WeakPolarHBondContact O-CG 3.35Å; L226-Q230 PolarHBondContact O-N 2.98Å; R227-Q230 PolarHBondContact O-N 3.4Å; L228-Q230 VanDerWaalsContact C-N 3.32Å; L228-Q230 PolarHBondContact O-N 2.88Å; Q230-E232 PolarHBondContact O-N 3.46Å; Q230-T233 WeakPolarHBondContact CA-OG1 3.5Å; Q230-T233 PolarHBondContact O-N 2.86Å; Q230-T233 PolarHBondContact O-OG1 3.02Å; Q230-D234 WeakPolarHBondContact O-CB 3.46Å; Q230-D234 PolarHBondContact O-N 2.97Å |
| 231 | T | 96.6 | Very high | 96.9 | Very high | 91 Ų | 91 | 102.1 Ų | 102.1 | 56% | 0.558 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.2 | -41.1 | 179.2 | -53.3 | 0 | 0 | 0 | 0 | 111.4 | R227 L228 R229 D234 A235 | R227-T231 WeakPolarHBondContact O-CB 3.34Å; R227-T231 PolarHBondContact O-N 3.48Å; R227-T231 PolarHBondContact O-OG1 2.93Å; L228-T231 PolarHBondContact O-N 3.33Å; L228-T231 VanDerWaalsContact O-N 3.14Å; R229-T231 PolarHBondContact O-N 3.29Å; T231-D234 PolarHBondContact O-N 3.18Å; T231-A235 WeakPolarHBondContact O-CB 3.5Å; T231-A235 PolarHBondContact O-N 2.98Å |
| 232 | E | 96.3 | Very high | 96.8 | Very high | 94 Ų | 94 | 101.5 Ų | 101.5 | 44% | 0.439 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.5 | -43.5 | 175.3 | -73.3 | 177.1 | 175.4 | 0 | 0 | 112.1 | L228 R229 Q230 D234 A235 K236 | L228-E232 WeakPolarHBondContact O-CG 3.38Å; L228-E232 PolarHBondContact O-N 3.37Å; R229-E232 PolarHBondContact O-N 3.46Å; Q230-E232 PolarHBondContact O-N 3.46Å; E232-D234 VanDerWaalsContact C-N 3.31Å; E232-D234 PolarHBondContact O-N 3.33Å; E232-A235 PolarHBondContact O-N 3.29Å; E232-K236 WeakPolarHBondContact O-CB 3.34Å; E232-K236 WeakPolarHBondContact O-CG 3.29Å; E232-K236 PolarHBondContact O-N 2.97Å |
| 233 | T | 96.6 | Very high | 96.7 | Very high | 83 Ų | 83 | 100.6 Ų | 100.6 | 51% | 0.509 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64 | -38.7 | 176.2 | 50.7 | 0 | 0 | 0 | 0 | 111.7 | R229 Q230 R237 | R229-T233 WeakPolarHBondContact O-CG2 3.49Å; R229-T233 PolarHBondContact O-N 3.14Å; R229-T233 PolarHBondContact O-OG1 3.27Å; R229-T233 VanDerWaalsContact O-OG1 3.08Å; Q230-T233 WeakPolarHBondContact CA-OG1 3.5Å; Q230-T233 PolarHBondContact O-N 2.86Å; Q230-T233 PolarHBondContact O-OG1 3.02Å; T233-R237 VanDerWaalsContact O-CB 3.27Å; T233-R237 WeakPolarHBondContact O-CB 3.45Å; T233-R237 PolarHBondContact O-N 2.96Å |
| 234 | D | 96.9 | Very high | 96.6 | Very high | 68 Ų | 68 | 101.2 Ų | 101.2 | 36% | 0.364 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -69.8 | -40.7 | 178.7 | -76.5 | 9.6 | 0 | 0 | 0 | 111.9 | Q230 T231 E232 R237 K238 | Q230-D234 WeakPolarHBondContact O-CB 3.46Å; Q230-D234 PolarHBondContact O-N 2.97Å; T231-D234 PolarHBondContact O-N 3.18Å; E232-D234 VanDerWaalsContact C-N 3.31Å; E232-D234 PolarHBondContact O-N 3.33Å; D234-R237 IonicContact OD1-CZ 3.62Å; D234-R237 IonicContact OD1-NH2 3.46Å; D234-R237 PolarHBondContact OD1-NH2 3.42Å; D234-R237 IonicContact OD2-NH2 3.71Å; D234-R237 PolarHBondContact OD2-NH2 3.01Å; D234-K238 WeakPolarHBondContact O-CG 3.37Å; D234-K238 PolarHBondContact O-N 3.11Å |
| 235 | A | 95.9 | Very high | 96.6 | Very high | 56 Ų | 56 | 102.2 Ų | 102.2 | 46% | 0.463 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.1 | -46.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | T231 E232 R237 K238 L239 | T231-A235 WeakPolarHBondContact O-CB 3.5Å; T231-A235 PolarHBondContact O-N 2.98Å; E232-A235 PolarHBondContact O-N 3.29Å; A235-R237 PolarHBondContact O-N 3.04Å; A235-K238 PolarHBondContact O-N 3.47Å; A235-L239 WeakPolarHBondContact O-CB 3.33Å; A235-L239 PolarHBondContact O-N 2.87Å |
| 236 | K | 97.4 | Very high | 96.5 | Very high | 142 Ų | 142 | 100.8 Ų | 100.8 | 62% | 0.617 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -58.9 | -47.2 | 175.7 | -76.8 | 178.1 | 179.4 | 177.1 | 0 | 111.3 | E232 K238 L239 T240 | E232-K236 WeakPolarHBondContact O-CB 3.34Å; E232-K236 WeakPolarHBondContact O-CG 3.29Å; E232-K236 PolarHBondContact O-N 2.97Å; K236-K238 PolarHBondContact O-N 3.45Å; K236-L239 PolarHBondContact O-N 3.46Å; K236-T240 PolarHBondContact O-N 3.14Å; K236-T240 PolarHBondContact O-OG1 3.36Å |
| 237 | R | 97.1 | Very high | 96.4 | Very high | 118 Ų | 118 | 100.9 Ų | 100.9 | 45% | 0.445 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.2 | -49 | 177 | 174.8 | 168.1 | 46.3 | 92.4 | -4.3 | 112.3 | T233 D234 A235 L239 T240 E241 | T233-R237 VanDerWaalsContact O-CB 3.27Å; T233-R237 WeakPolarHBondContact O-CB 3.45Å; T233-R237 PolarHBondContact O-N 2.96Å; D234-R237 IonicContact OD1-CZ 3.62Å; D234-R237 IonicContact OD1-NH2 3.46Å; D234-R237 PolarHBondContact OD1-NH2 3.42Å; D234-R237 IonicContact OD2-NH2 3.71Å; D234-R237 PolarHBondContact OD2-NH2 3.01Å; A235-R237 PolarHBondContact O-N 3.04Å; R237-L239 VanDerWaalsContact C-N 3.32Å; R237-L239 PolarHBondContact O-N 3.32Å; R237-T240 PolarHBondContact O-N 3.37Å; R237-E241 WeakPolarHBondContact CG-OE1 3.33Å; R237-E241 WeakPolarHBondContact O-CG 3.32Å; R237-E241 PolarHBondContact O-N 2.95Å |
| 238 | K | 97.3 | Very high | 96.3 | Very high | 130 Ų | 130 | 98 Ų | 98 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61 | -38.8 | 176.8 | -75.4 | 177.4 | -178.9 | 177.3 | 0 | 112.8 | D234 A235 K236 S242 | D234-K238 WeakPolarHBondContact O-CG 3.37Å; D234-K238 PolarHBondContact O-N 3.11Å; A235-K238 PolarHBondContact O-N 3.47Å; K236-K238 PolarHBondContact O-N 3.45Å; K238-S242 WeakPolarHBondContact O-CB 3.34Å; K238-S242 PolarHBondContact O-N 3.07Å; K238-S242 PolarHBondContact O-OG 2.74Å |
| 239 | L | 96.4 | Very high | 96.3 | Very high | 108 Ų | 108 | 100.3 Ų | 100.3 | 57% | 0.565 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -65.4 | -48.4 | 176.7 | -179.7 | 61.8 | 0 | 0 | 0 | 110.8 | A235 K236 R237 E241 S242 I243 | A235-L239 WeakPolarHBondContact O-CB 3.33Å; A235-L239 PolarHBondContact O-N 2.87Å; K236-L239 PolarHBondContact O-N 3.46Å; R237-L239 VanDerWaalsContact C-N 3.32Å; R237-L239 PolarHBondContact O-N 3.32Å; L239-E241 PolarHBondContact O-N 3.43Å; L239-S242 WeakPolarHBondContact O-CB 3.43Å; L239-S242 PolarHBondContact O-N 3.21Å; L239-S242 VanDerWaalsContact O-N 3.13Å; L239-I243 HydrophobicContact CD1-CD1 4.11Å; L239-I243 HydrophobicContact CD1-CG1 4.36Å; L239-I243 HydrophobicContact CG-CD1 3.93Å; L239-I243 WeakPolarHBondContact O-CG1 3.35Å; L239-I243 PolarHBondContact O-N 3.08Å |
| 240 | T | 96 | Very high | 96.1 | Very high | 73 Ų | 73 | 98 Ų | 98 | 45% | 0.448 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.7 | -44.8 | 177 | -55.5 | 0 | 0 | 0 | 0 | 111.8 | K236 R237 S242 I243 Q244 | K236-T240 PolarHBondContact O-N 3.14Å; K236-T240 PolarHBondContact O-OG1 3.36Å; R237-T240 PolarHBondContact O-N 3.37Å; T240-S242 VanDerWaalsContact C-N 3.29Å; T240-S242 PolarHBondContact O-N 3.33Å; T240-I243 PolarHBondContact O-N 3.02Å; T240-Q244 WeakPolarHBondContact O-CB 3.37Å; T240-Q244 WeakPolarHBondContact O-CG 3.4Å; T240-Q244 PolarHBondContact O-N 2.86Å |
| 241 | E | 96.8 | Very high | 96.1 | Very high | 79 Ų | 79 | 101.7 Ų | 101.7 | 37% | 0.369 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.8 | -37.6 | 175 | -73.6 | 172.1 | -161.7 | 0 | 0 | 112.3 | R237 L239 K245 | R237-E241 WeakPolarHBondContact CG-OE1 3.33Å; R237-E241 WeakPolarHBondContact O-CG 3.32Å; R237-E241 PolarHBondContact O-N 2.95Å; L239-E241 PolarHBondContact O-N 3.43Å; E241-K245 WeakPolarHBondContact O-CB 3.48Å; E241-K245 VanDerWaalsContact O-CG 3.28Å; E241-K245 WeakPolarHBondContact O-CG 3.48Å; E241-K245 PolarHBondContact O-N 2.92Å |
| 242 | S | 95.9 | Very high | 96 | Very high | 71 Ų | 71 | 101.6 Ų | 101.6 | 50% | 0.497 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -71.1 | -40.1 | 178.8 | -59.2 | 0 | 0 | 0 | 0 | 112 | K238 L239 T240 L246 | K238-S242 WeakPolarHBondContact O-CB 3.34Å; K238-S242 PolarHBondContact O-N 3.07Å; K238-S242 PolarHBondContact O-OG 2.74Å; L239-S242 WeakPolarHBondContact O-CB 3.43Å; L239-S242 PolarHBondContact O-N 3.21Å; L239-S242 VanDerWaalsContact O-N 3.13Å; T240-S242 VanDerWaalsContact C-N 3.29Å; T240-S242 PolarHBondContact O-N 3.33Å; S242-L246 WeakPolarHBondContact O-CB 3.44Å; S242-L246 PolarHBondContact O-N 3.44Å |
| 243 | I | 94.4 | Very high | 95.9 | Very high | 80 Ų | 80 | 104.4 Ų | 104.4 | 41% | 0.41 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.3 | -49.6 | 174.6 | -69.5 | 168.2 | 0 | 0 | 0 | 109.8 | L239 T240 K245 L246 E247 | L239-I243 HydrophobicContact CD1-CD1 4.11Å; L239-I243 HydrophobicContact CD1-CG1 4.36Å; L239-I243 HydrophobicContact CG-CD1 3.93Å; L239-I243 WeakPolarHBondContact O-CG1 3.35Å; L239-I243 PolarHBondContact O-N 3.08Å; T240-I243 PolarHBondContact O-N 3.02Å; I243-K245 VanDerWaalsContact C-N 3.35Å; I243-K245 PolarHBondContact O-N 2.81Å; I243-L246 CarbonylContact O-C 3.6Å; I243-L246 WeakPolarHBondContact O-CA 3.25Å; I243-L246 WeakPolarHBondContact O-CB 3.4Å; I243-L246 PolarHBondContact O-N 2.86Å; I243-E247 HydrophobicContact CG2-CG 4.27Å; I243-E247 WeakPolarHBondContact O-CG 3.44Å; I243-E247 PolarHBondContact O-N 3.25Å |
| 244 | Q | 96.1 | Very high | 95.9 | Very high | 109 Ų | 109 | 104.7 Ų | 104.7 | 51% | 0.509 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -57.5 | -45.8 | 177.6 | -74.8 | 177.2 | -11.3 | 0 | 0 | 111.9 | T240 L246 E247 T248 | T240-Q244 WeakPolarHBondContact O-CB 3.37Å; T240-Q244 WeakPolarHBondContact O-CG 3.4Å; T240-Q244 PolarHBondContact O-N 2.86Å; Q244-L246 PolarHBondContact O-N 3.41Å; Q244-E247 PolarHBondContact O-N 2.91Å; Q244-T248 PolarHBondContact O-N 3.42Å; Q244-T248 PolarHBondContact O-OG1 2.91Å |
| 245 | K | 96.7 | Very high | 95.8 | Very high | 132 Ų | 132 | 105 Ų | 105 | 57% | 0.574 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62 | -31.1 | 175 | -75.7 | 173.1 | -176.9 | 172.1 | 0 | 113.2 | E241 I243 R249 | E241-K245 WeakPolarHBondContact O-CB 3.48Å; E241-K245 VanDerWaalsContact O-CG 3.28Å; E241-K245 WeakPolarHBondContact O-CG 3.48Å; E241-K245 PolarHBondContact O-N 2.92Å; I243-K245 VanDerWaalsContact C-N 3.35Å; I243-K245 PolarHBondContact O-N 2.81Å; K245-R249 VanDerWaalsContact O-CG 3.3Å; K245-R249 WeakPolarHBondContact O-CG 3.44Å; K245-R249 PolarHBondContact O-N 3.4Å; K245-R249 PolarHBondContact O-NE 3.29Å |
| 246 | L | 95.3 | Very high | 95.8 | Very high | 82 Ų | 82 | 106.8 Ų | 106.8 | 43% | 0.429 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -74.3 | -46.9 | 176.3 | -168 | 66.9 | 0 | 0 | 0 | 110.3 | S242 I243 Q244 T248 R249 Y250 | S242-L246 WeakPolarHBondContact O-CB 3.44Å; S242-L246 PolarHBondContact O-N 3.44Å; I243-L246 CarbonylContact O-C 3.6Å; I243-L246 WeakPolarHBondContact O-CA 3.25Å; I243-L246 WeakPolarHBondContact O-CB 3.4Å; I243-L246 PolarHBondContact O-N 2.86Å; Q244-L246 PolarHBondContact O-N 3.41Å; L246-T248 PolarHBondContact O-N 2.93Å; L246-R249 PolarHBondContact O-N 2.95Å; L246-Y250 HydrophobicContact CD1-CD2 4.1Å; L246-Y250 HydrophobicContact CD1-CE2 3.74Å; L246-Y250 HydrophobicContact CD2-CE2 4.2Å; L246-Y250 HydrophobicContact CG-CD2 3.83Å; L246-Y250 HydrophobicContact CG-CE2 3.71Å; L246-Y250 VanDerWaalsContact O-CD2 3.32Å; L246-Y250 WeakPolarHBondContact O-CD2 3.35Å; L246-Y250 PolarHBondContact O-N 2.97Å |
| 247 | E | 95.7 | Very high | 95.7 | Very high | 99 Ų | 99 | 105.7 Ų | 105.7 | 46% | 0.463 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.1 | -45.6 | 176.3 | -71.6 | 177.2 | 168.4 | 0 | 0 | 112.2 | I243 Q244 R249 Y250 R251 | I243-E247 HydrophobicContact CG2-CG 4.27Å; I243-E247 WeakPolarHBondContact O-CG 3.44Å; I243-E247 PolarHBondContact O-N 3.25Å; Q244-E247 PolarHBondContact O-N 2.91Å; E247-R249 PolarHBondContact O-N 3.43Å; E247-Y250 PolarHBondContact O-N 2.9Å; E247-R251 WeakPolarHBondContact O-CB 3.45Å; E247-R251 VanDerWaalsContact O-CG 3.32Å; E247-R251 WeakPolarHBondContact O-CG 3.41Å; E247-R251 PolarHBondContact O-N 3.38Å |
| 248 | T | 95.1 | Very high | 95.6 | Very high | 74 Ų | 74 | 103.8 Ų | 103.8 | 45% | 0.454 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.2 | -46 | 175.3 | -53.4 | 0 | 0 | 0 | 0 | 111 | Q244 L246 Y250 R251 D252 | Q244-T248 PolarHBondContact O-N 3.42Å; Q244-T248 PolarHBondContact O-OG1 2.91Å; L246-T248 PolarHBondContact O-N 2.93Å; T248-Y250 VanDerWaalsContact C-N 3.35Å; T248-Y250 PolarHBondContact O-N 2.97Å; T248-R251 PolarHBondContact O-N 2.67Å; T248-D252 WeakPolarHBondContact O-CB 3.47Å; T248-D252 PolarHBondContact O-N 3.42Å |
| 249 | R | 96.2 | Very high | 95.5 | Very high | 151 Ų | 151 | 102 Ų | 102 | 57% | 0.57 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.9 | -36.3 | 178.3 | -76.7 | -176.6 | -67.6 | 175.4 | 1.9 | 113.5 | K245 L246 E247 R253 | K245-R249 VanDerWaalsContact O-CG 3.3Å; K245-R249 WeakPolarHBondContact O-CG 3.44Å; K245-R249 PolarHBondContact O-N 3.4Å; K245-R249 PolarHBondContact O-NE 3.29Å; L246-R249 PolarHBondContact O-N 2.95Å; E247-R249 PolarHBondContact O-N 3.43Å; R249-R253 WeakPolarHBondContact O-CB 3.48Å; R249-R253 PolarHBondContact O-N 2.84Å; R249-R253 VanDerWaalsContact O-N 3.12Å |
| 250 | Y | 93.7 | Very high | 95.6 | Very high | 119 Ų | 119 | 103.3 Ų | 103.3 | 47% | 0.467 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.7 | -46.9 | 174.2 | -89.3 | -78.3 | 0 | 0 | 0 | 111 | L246 E247 T248 D252 R253 D254 | L246-Y250 HydrophobicContact CD1-CD2 4.1Å; L246-Y250 HydrophobicContact CD1-CE2 3.74Å; L246-Y250 HydrophobicContact CD2-CE2 4.2Å; L246-Y250 HydrophobicContact CG-CD2 3.83Å; L246-Y250 HydrophobicContact CG-CE2 3.71Å; L246-Y250 VanDerWaalsContact O-CD2 3.32Å; L246-Y250 WeakPolarHBondContact O-CD2 3.35Å; L246-Y250 PolarHBondContact O-N 2.97Å; E247-Y250 PolarHBondContact O-N 2.9Å; T248-Y250 VanDerWaalsContact C-N 3.35Å; T248-Y250 PolarHBondContact O-N 2.97Å; Y250-D252 PolarHBondContact O-N 2.87Å; Y250-R253 PolarHBondContact O-N 3.2Å; Y250-D254 WeakPolarHBondContact O-CB 3.38Å; Y250-D254 VanDerWaalsContact O-CG 3.28Å; Y250-D254 PolarHBondContact O-N 3.28Å |
| 251 | R | 95 | Very high | 95.6 | Very high | 177 Ų | 177 | 104.5 Ų | 104.5 | 67% | 0.668 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58.1 | -48.2 | 176 | -73 | 178.8 | -172.9 | -124.5 | 4.3 | 111.8 | E247 T248 R253 D254 T255 | E247-R251 WeakPolarHBondContact O-CB 3.45Å; E247-R251 VanDerWaalsContact O-CG 3.32Å; E247-R251 WeakPolarHBondContact O-CG 3.41Å; E247-R251 PolarHBondContact O-N 3.38Å; T248-R251 PolarHBondContact O-N 2.67Å; R251-R253 VanDerWaalsContact C-N 3.31Å; R251-R253 PolarHBondContact O-N 3.47Å; R251-D254 PolarHBondContact O-N 3.03Å; R251-T255 WeakPolarHBondContact O-CB 3.35Å; R251-T255 PolarHBondContact O-N 3.12Å; R251-T255 PolarHBondContact O-OG1 2.9Å |
| 252 | D | 95.1 | Very high | 95.6 | Very high | 89 Ų | 89 | 104.7 Ų | 104.7 | 48% | 0.476 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.4 | -40.7 | 178.9 | -66.2 | -15.6 | 0 | 0 | 0 | 111.5 | T248 Y250 N256 | T248-D252 WeakPolarHBondContact O-CB 3.47Å; T248-D252 PolarHBondContact O-N 3.42Å; Y250-D252 PolarHBondContact O-N 2.87Å; D252-N256 WeakPolarHBondContact O-CB 3.44Å; D252-N256 PolarHBondContact O-N 3.31Å; D252-N256 PolarHBondContact O-ND2 2.92Å; D252-N256 VanDerWaalsContact O-ND2 3.14Å |
| 253 | R | 95.5 | Very high | 95.6 | Very high | 152 Ų | 152 | 103.9 Ų | 103.9 | 57% | 0.574 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.1 | -46.2 | 176.1 | -176.4 | -174.8 | -64.6 | 154.4 | -0.3 | 111.7 | R249 Y250 R251 N256 F257 | R249-R253 WeakPolarHBondContact O-CB 3.48Å; R249-R253 PolarHBondContact O-N 2.84Å; R249-R253 VanDerWaalsContact O-N 3.12Å; Y250-R253 PolarHBondContact O-N 3.2Å; R251-R253 VanDerWaalsContact C-N 3.31Å; R251-R253 PolarHBondContact O-N 3.47Å; R253-N256 PolarHBondContact O-N 3.33Å; R253-F257 WeakPolarHBondContact O-CB 3.48Å; R253-F257 PolarHBondContact O-N 3.43Å |
| 254 | D | 95.3 | Very high | 95.7 | Very high | 90 Ų | 90 | 103.9 Ų | 103.9 | 48% | 0.481 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.5 | -40.4 | -179.6 | -70.1 | -11.7 | 0 | 0 | 0 | 110.9 | Y250 R251 F257 V258 | Y250-D254 WeakPolarHBondContact O-CB 3.38Å; Y250-D254 VanDerWaalsContact O-CG 3.28Å; Y250-D254 PolarHBondContact O-N 3.28Å; R251-D254 PolarHBondContact O-N 3.03Å; D254-F257 PolarHBondContact O-N 3.29Å; D254-V258 WeakPolarHBondContact O-CB 3.47Å; D254-V258 VanDerWaalsContact O-CG2 3.28Å; D254-V258 WeakPolarHBondContact O-CG2 3.33Å; D254-V258 PolarHBondContact O-N 3.37Å |
| 255 | T | 94.2 | Very high | 95.8 | Very high | 73 Ų | 73 | 106.9 Ų | 106.9 | 45% | 0.448 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.5 | -48.8 | 173.7 | -62.5 | 0 | 0 | 0 | 0 | 111.2 | R251 F257 V258 D259 | R251-T255 WeakPolarHBondContact O-CB 3.35Å; R251-T255 PolarHBondContact O-N 3.12Å; R251-T255 PolarHBondContact O-OG1 2.9Å; T255-F257 VanDerWaalsContact C-N 3.31Å; T255-F257 PolarHBondContact O-N 3.05Å; T255-V258 PolarHBondContact O-N 3.05Å; T255-D259 WeakPolarHBondContact O-CB 3.4Å; T255-D259 VanDerWaalsContact O-CG 3.28Å; T255-D259 PolarHBondContact O-N 3.41Å |
| 256 | N | 96 | Very high | 95.8 | Very high | 95 Ų | 95 | 106.1 Ų | 106.1 | 51% | 0.508 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 176.9 | -70.2 | -24.5 | 0 | 0 | 0 | 112.1 | D252 R253 D259 E260 | D252-N256 WeakPolarHBondContact O-CB 3.44Å; D252-N256 PolarHBondContact O-N 3.31Å; D252-N256 PolarHBondContact O-ND2 2.92Å; D252-N256 VanDerWaalsContact O-ND2 3.14Å; R253-N256 PolarHBondContact O-N 3.33Å; N256-D259 PolarHBondContact O-N 3.01Å; N256-E260 WeakPolarHBondContact O-CB 3.26Å; N256-E260 WeakPolarHBondContact O-CG 3.34Å; N256-E260 PolarHBondContact O-N 3.43Å |
| 257 | F | 95.8 | Very high | 96 | Very high | 118 Ų | 118 | 109.2 Ų | 109.2 | 52% | 0.518 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.6 | -42 | 177 | 178.3 | -108.2 | 0 | 0 | 0 | 112.2 | R253 D254 T255 E260 L261 | R253-F257 WeakPolarHBondContact O-CB 3.48Å; R253-F257 PolarHBondContact O-N 3.43Å; D254-F257 PolarHBondContact O-N 3.29Å; T255-F257 VanDerWaalsContact C-N 3.31Å; T255-F257 PolarHBondContact O-N 3.05Å; F257-E260 PolarHBondContact O-N 2.99Å; F257-L261 HydrophobicContact CD1-CD1 3.95Å; F257-L261 HydrophobicContact CE1-CD1 3.38Å; F257-L261 HydrophobicContact CE1-CG 4.22Å; F257-L261 HydrophobicContact CE2-CD1 4.32Å; F257-L261 HydrophobicContact CE2-CG 4.34Å; F257-L261 HydrophobicContact CZ-CD1 3.6Å; F257-L261 HydrophobicContact CZ-CD2 4.43Å; F257-L261 HydrophobicContact CZ-CG 4.09Å; F257-L261 WeakPolarHBondContact O-CG 3.33Å; F257-L261 PolarHBondContact O-N 3.4Å |
| 258 | V | 95.3 | Very high | 96.1 | Very high | 78 Ų | 78 | 108.9 Ų | 108.9 | 47% | 0.473 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.2 | -43.3 | 174.9 | 169.2 | 0 | 0 | 0 | 0 | 110.9 | D254 T255 E260 L261 V262 | D254-V258 WeakPolarHBondContact O-CB 3.47Å; D254-V258 VanDerWaalsContact O-CG2 3.28Å; D254-V258 WeakPolarHBondContact O-CG2 3.33Å; D254-V258 PolarHBondContact O-N 3.37Å; T255-V258 PolarHBondContact O-N 3.05Å; V258-E260 PolarHBondContact O-N 3.38Å; V258-L261 PolarHBondContact O-N 3.45Å; V258-V262 HydrophobicContact CG1-CG2 4.31Å; V258-V262 VanDerWaalsContact O-CG2 3.29Å; V258-V262 WeakPolarHBondContact O-CG2 3.37Å; V258-V262 PolarHBondContact O-N 2.9Å |
| 259 | D | 96.2 | Very high | 96.2 | Very high | 94 Ų | 94 | 108.8 Ų | 108.8 | 50% | 0.503 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.7 | -41.8 | 178.2 | -71.3 | -17.7 | 0 | 0 | 0 | 111.5 | T255 N256 V262 A263 | T255-D259 WeakPolarHBondContact O-CB 3.4Å; T255-D259 VanDerWaalsContact O-CG 3.28Å; T255-D259 PolarHBondContact O-N 3.41Å; N256-D259 PolarHBondContact O-N 3.01Å; D259-V262 PolarHBondContact O-N 3.21Å; D259-A263 WeakPolarHBondContact O-CB 3.36Å; D259-A263 PolarHBondContact O-N 3.05Å |
| 260 | E | 97.1 | Very high | 96.2 | Very high | 135 Ų | 135 | 106.2 Ų | 106.2 | 63% | 0.631 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.6 | -44.1 | 173.1 | -75.9 | 176.1 | -171.8 | 0 | 0 | 112.1 | N256 F257 V258 A263 E264 | N256-E260 WeakPolarHBondContact O-CB 3.26Å; N256-E260 WeakPolarHBondContact O-CG 3.34Å; N256-E260 PolarHBondContact O-N 3.43Å; F257-E260 PolarHBondContact O-N 2.99Å; V258-E260 PolarHBondContact O-N 3.38Å; E260-A263 PolarHBondContact O-N 3.22Å; E260-E264 PolarHBondContact O-N 2.98Å |
| 261 | L | 95.4 | Very high | 96.4 | Very high | 97 Ų | 97 | 104.9 Ų | 104.9 | 51% | 0.508 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.8 | -38.6 | 176.4 | -76.5 | 178.9 | 0 | 0 | 0 | 112.5 | F257 V258 R265 | F257-L261 HydrophobicContact CD1-CD1 3.95Å; F257-L261 HydrophobicContact CE1-CD1 3.38Å; F257-L261 HydrophobicContact CE1-CG 4.22Å; F257-L261 HydrophobicContact CE2-CD1 4.32Å; F257-L261 HydrophobicContact CE2-CG 4.34Å; F257-L261 HydrophobicContact CZ-CD1 3.6Å; F257-L261 HydrophobicContact CZ-CD2 4.43Å; F257-L261 HydrophobicContact CZ-CG 4.09Å; F257-L261 WeakPolarHBondContact O-CG 3.33Å; F257-L261 PolarHBondContact O-N 3.4Å; V258-L261 PolarHBondContact O-N 3.45Å; L261-R265 VanDerWaalsContact O-CB 3.28Å; L261-R265 WeakPolarHBondContact O-CB 3.42Å; L261-R265 PolarHBondContact O-N 3.36Å |
| 262 | V | 96.8 | Very high | 96.5 | Very high | 83 Ų | 83 | 101.3 Ų | 101.3 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.8 | -43.7 | 176.1 | 170 | 0 | 0 | 0 | 0 | 110.5 | V258 D259 R265 E266 | V258-V262 HydrophobicContact CG1-CG2 4.31Å; V258-V262 VanDerWaalsContact O-CG2 3.29Å; V258-V262 WeakPolarHBondContact O-CG2 3.37Å; V258-V262 PolarHBondContact O-N 2.9Å; D259-V262 PolarHBondContact O-N 3.21Å; V262-R265 PolarHBondContact O-N 3Å; V262-E266 PolarHBondContact O-N 3.34Å |
| 263 | A | 96.8 | Very high | 96.6 | Very high | 55 Ų | 55 | 100.1 Ų | 100.1 | 46% | 0.455 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | D259 E260 E266 R267 | D259-A263 WeakPolarHBondContact O-CB 3.36Å; D259-A263 PolarHBondContact O-N 3.05Å; E260-A263 PolarHBondContact O-N 3.22Å; A263-E266 PolarHBondContact O-N 3.2Å; A263-R267 WeakPolarHBondContact O-CB 3.33Å; A263-R267 PolarHBondContact O-N 2.94Å |
| 264 | E | 97.5 | Very high | 96.7 | Very high | 80 Ų | 80 | 99.2 Ų | 99.2 | 37% | 0.374 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.4 | -37.7 | 176.9 | -171.9 | 63.4 | -171.2 | 0 | 0 | 111.5 | E260 E266 R267 L268 | E260-E264 PolarHBondContact O-N 2.98Å; E264-E266 VanDerWaalsContact C-N 3.35Å; E264-E266 PolarHBondContact O-N 2.84Å; E264-R267 PolarHBondContact O-N 2.93Å; E264-R267 IonicContact OE1-CZ 3.84Å; E264-R267 IonicContact OE1-NH1 3.03Å; E264-R267 PolarHBondContact OE1-NH1 3.34Å; E264-R267 WeakPolarHBondContact OE2-CD 3.45Å; E264-R267 IonicContact OE2-NH1 3.12Å; E264-R267 PolarHBondContact OE2-NH1 3.48Å; E264-R267 VanDerWaalsContact OE2-NH1 3.12Å; E264-L268 HydrophobicContact CG-CD1 4.38Å; E264-L268 WeakPolarHBondContact O-CG 3.49Å; E264-L268 PolarHBondContact O-N 3.49Å |
| 265 | R | 97.5 | Very high | 96.8 | Very high | 171 Ų | 171 | 99.1 Ų | 99.1 | 65% | 0.645 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.1 | -45.6 | 172.1 | 179.7 | -176.8 | 178.2 | -85.4 | -1.8 | 111.4 | L261 V262 L268 I269 | L261-R265 VanDerWaalsContact O-CB 3.28Å; L261-R265 WeakPolarHBondContact O-CB 3.42Å; L261-R265 PolarHBondContact O-N 3.36Å; V262-R265 PolarHBondContact O-N 3Å; R265-L268 PolarHBondContact O-N 2.9Å; R265-I269 HydrophobicContact CG-CD1 4.03Å; R265-I269 VanDerWaalsContact O-CG1 3.3Å; R265-I269 WeakPolarHBondContact O-CG1 3.37Å; R265-I269 PolarHBondContact O-N 3.04Å |
| 266 | E | 97.4 | Very high | 96.9 | Very high | 117 Ų | 117 | 98.6 Ų | 98.6 | 55% | 0.547 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.7 | -41.8 | 178.7 | -171.6 | 172.6 | -174.8 | 0 | 0 | 111.7 | V262 A263 E264 L268 I269 N270 | V262-E266 PolarHBondContact O-N 3.34Å; A263-E266 PolarHBondContact O-N 3.2Å; E264-E266 VanDerWaalsContact C-N 3.35Å; E264-E266 PolarHBondContact O-N 2.84Å; E266-L268 PolarHBondContact O-N 2.89Å; E266-I269 PolarHBondContact O-N 3.27Å; E266-N270 PolarHBondContact O-N 3.22Å; E266-N270 PolarHBondContact O-ND2 3.08Å |
| 267 | R | 98.4 | Very high | 97 | Very high | 146 Ų | 146 | 101.9 Ų | 101.9 | 55% | 0.551 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -57.4 | -47.7 | 172.8 | -178.8 | -168.6 | 162.4 | -154.6 | -6.5 | 111.9 | A263 E264 I269 N270 E271 | A263-R267 WeakPolarHBondContact O-CB 3.33Å; A263-R267 PolarHBondContact O-N 2.94Å; E264-R267 PolarHBondContact O-N 2.93Å; E264-R267 IonicContact OE1-CZ 3.84Å; E264-R267 IonicContact OE1-NH1 3.03Å; E264-R267 PolarHBondContact OE1-NH1 3.34Å; E264-R267 WeakPolarHBondContact OE2-CD 3.45Å; E264-R267 IonicContact OE2-NH1 3.12Å; E264-R267 PolarHBondContact OE2-NH1 3.48Å; E264-R267 VanDerWaalsContact OE2-NH1 3.12Å; R267-I269 VanDerWaalsContact C-N 3.34Å; R267-I269 PolarHBondContact O-N 3.29Å; R267-N270 WeakPolarHBondContact O-CB 3.5Å; R267-N270 PolarHBondContact O-N 3.42Å; R267-E271 PolarHBondContact O-N 2.91Å |
| 268 | L | 97.5 | Very high | 97 | Very high | 93 Ų | 93 | 101 Ų | 101 | 49% | 0.487 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.5 | -35.5 | 179.4 | -72.1 | 172.4 | 0 | 0 | 0 | 112.4 | E264 R265 E266 E271 N272 | E264-L268 HydrophobicContact CG-CD1 4.38Å; E264-L268 WeakPolarHBondContact O-CG 3.49Å; E264-L268 PolarHBondContact O-N 3.49Å; R265-L268 PolarHBondContact O-N 2.9Å; E266-L268 PolarHBondContact O-N 2.89Å; L268-E271 PolarHBondContact O-N 3.48Å; L268-N272 VanDerWaalsContact O-CB 3.27Å; L268-N272 WeakPolarHBondContact O-CB 3.46Å; L268-N272 PolarHBondContact O-N 3.41Å |
| 269 | I | 97.5 | Very high | 97 | Very high | 72 Ų | 72 | 101 Ų | 101 | 37% | 0.369 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64 | -43 | 173.1 | -71.1 | 166.6 | 0 | 0 | 0 | 110.8 | R265 E266 R267 E271 N272 T273 | R265-I269 HydrophobicContact CG-CD1 4.03Å; R265-I269 VanDerWaalsContact O-CG1 3.3Å; R265-I269 WeakPolarHBondContact O-CG1 3.37Å; R265-I269 PolarHBondContact O-N 3.04Å; E266-I269 PolarHBondContact O-N 3.27Å; R267-I269 VanDerWaalsContact C-N 3.34Å; R267-I269 PolarHBondContact O-N 3.29Å; I269-E271 VanDerWaalsContact C-N 3.32Å; I269-E271 PolarHBondContact O-N 2.85Å; I269-N272 PolarHBondContact O-N 2.93Å; I269-T273 HydrophobicContact CG2-CG2 4.47Å; I269-T273 VanDerWaalsContact O-CG2 3.32Å; I269-T273 WeakPolarHBondContact O-CG2 3.49Å; I269-T273 PolarHBondContact O-N 2.91Å; I269-T273 PolarHBondContact O-OG1 3.48Å |
| 270 | N | 97.1 | Very high | 97 | Very high | 96 Ų | 96 | 101 Ų | 101 | 51% | 0.513 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.9 | -35.9 | 176.6 | -71 | -28.9 | 0 | 0 | 0 | 112.2 | E266 R267 T273 K274 | E266-N270 PolarHBondContact O-N 3.22Å; E266-N270 PolarHBondContact O-ND2 3.08Å; R267-N270 WeakPolarHBondContact O-CB 3.5Å; R267-N270 PolarHBondContact O-N 3.42Å; N270-T273 WeakPolarHBondContact CA-OG1 3.43Å; N270-T273 PolarHBondContact O-OG1 3.41Å; N270-K274 WeakPolarHBondContact O-CB 3.24Å; N270-K274 PolarHBondContact O-N 2.91Å |
| 271 | E | 97.6 | Very high | 97 | Very high | 92 Ų | 92 | 100.1 Ų | 100.1 | 43% | 0.43 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -70 | -43.6 | 174 | -174.9 | 168.2 | -172.5 | 0 | 0 | 111.9 | R267 L268 I269 T273 K274 L275 | R267-E271 PolarHBondContact O-N 2.91Å; L268-E271 PolarHBondContact O-N 3.48Å; I269-E271 VanDerWaalsContact C-N 3.32Å; I269-E271 PolarHBondContact O-N 2.85Å; E271-T273 PolarHBondContact O-N 2.71Å; E271-K274 WeakPolarHBondContact O-CB 3.46Å; E271-K274 PolarHBondContact O-N 3.14Å; E271-L275 HydrophobicContact CG-CD1 4.18Å; E271-L275 WeakPolarHBondContact O-CG 3.27Å; E271-L275 PolarHBondContact O-N 2.95Å |
| 272 | N | 96.6 | Very high | 97 | Very high | 102 Ų | 102 | 100.7 Ų | 100.7 | 55% | 0.545 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.3 | -42.1 | 179.1 | -167.5 | -45.8 | 0 | 0 | 0 | 111.9 | L268 I269 K274 L275 S276 | L268-N272 VanDerWaalsContact O-CB 3.27Å; L268-N272 WeakPolarHBondContact O-CB 3.46Å; L268-N272 PolarHBondContact O-N 3.41Å; I269-N272 PolarHBondContact O-N 2.93Å; N272-K274 VanDerWaalsContact C-N 3.35Å; N272-K274 PolarHBondContact O-N 3.03Å; N272-L275 PolarHBondContact O-N 3.35Å; N272-S276 WeakPolarHBondContact O-CB 3.45Å; N272-S276 PolarHBondContact O-N 3.31Å; N272-S276 PolarHBondContact O-OG 3.26Å; N272-S276 PolarHBondContact OD1-OG 2.99Å |
| 273 | T | 96.9 | Very high | 97 | Very high | 63 Ų | 63 | 102.1 Ų | 102.1 | 39% | 0.387 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.8 | -42.7 | 174 | 49.7 | 0 | 0 | 0 | 0 | 111.5 | I269 N270 E271 S276 Y277 | I269-T273 HydrophobicContact CG2-CG2 4.47Å; I269-T273 VanDerWaalsContact O-CG2 3.32Å; I269-T273 WeakPolarHBondContact O-CG2 3.49Å; I269-T273 PolarHBondContact O-N 2.91Å; I269-T273 PolarHBondContact O-OG1 3.48Å; N270-T273 WeakPolarHBondContact CA-OG1 3.43Å; N270-T273 PolarHBondContact O-OG1 3.41Å; E271-T273 PolarHBondContact O-N 2.71Å; T273-S276 PolarHBondContact O-N 3.06Å; T273-Y277 WeakPolarHBondContact O-CD2 3.41Å; T273-Y277 PolarHBondContact O-N 3.08Å |
| 274 | K | 97.6 | Very high | 97 | Very high | 134 Ų | 134 | 104.1 Ų | 104.1 | 58% | 0.583 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.5 | -45.8 | 174.2 | -177.9 | -175.8 | 176.3 | -173.1 | 0 | 112.2 | N270 E271 N272 Y277 Q278 | N270-K274 WeakPolarHBondContact O-CB 3.24Å; N270-K274 PolarHBondContact O-N 2.91Å; E271-K274 WeakPolarHBondContact O-CB 3.46Å; E271-K274 PolarHBondContact O-N 3.14Å; N272-K274 VanDerWaalsContact C-N 3.35Å; N272-K274 PolarHBondContact O-N 3.03Å; K274-Y277 PolarHBondContact O-N 3.05Å; K274-Q278 WeakPolarHBondContact O-CG 3.49Å; K274-Q278 PolarHBondContact O-N 3Å; K274-Q278 VanDerWaalsContact O-N 3.12Å |
| 275 | L | 97.4 | Very high | 96.9 | Very high | 87 Ų | 87 | 104.1 Ų | 104.1 | 46% | 0.455 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65 | -40.3 | 177.5 | -71.7 | 172.4 | 0 | 0 | 0 | 111.5 | E271 N272 Y277 Q278 V279 | E271-L275 HydrophobicContact CG-CD1 4.18Å; E271-L275 WeakPolarHBondContact O-CG 3.27Å; E271-L275 PolarHBondContact O-N 2.95Å; N272-L275 PolarHBondContact O-N 3.35Å; L275-Y277 VanDerWaalsContact C-N 3.34Å; L275-Y277 PolarHBondContact O-N 3.45Å; L275-Q278 WeakPolarHBondContact O-CB 3.4Å; L275-Q278 PolarHBondContact O-N 3.39Å; L275-Q278 VanDerWaalsContact O-N 3.07Å; L275-V279 WeakPolarHBondContact O-CG2 3.38Å; L275-V279 PolarHBondContact O-N 2.84Å |
| 276 | S | 97.3 | Very high | 96.9 | Very high | 63 Ų | 63 | 101.2 Ų | 101.2 | 44% | 0.441 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.6 | -43 | 175.8 | -63.1 | 0 | 0 | 0 | 0 | 111.8 | N272 T273 Q278 V279 Q280 | N272-S276 WeakPolarHBondContact O-CB 3.45Å; N272-S276 PolarHBondContact O-N 3.31Å; N272-S276 PolarHBondContact O-OG 3.26Å; N272-S276 PolarHBondContact OD1-OG 2.99Å; T273-S276 PolarHBondContact O-N 3.06Å; S276-Q278 VanDerWaalsContact C-N 3.33Å; S276-Q278 PolarHBondContact O-N 3.23Å; S276-V279 PolarHBondContact O-N 2.94Å; S276-Q280 PolarHBondContact O-N 3.14Å |
| 277 | Y | 96.5 | Very high | 96.8 | Very high | 164 Ų | 164 | 99.7 Ų | 99.7 | 64% | 0.643 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63 | -37.4 | 173 | -77.5 | -59.4 | 0 | 0 | 0 | 113 | T273 K274 L275 H281 | T273-Y277 WeakPolarHBondContact O-CD2 3.41Å; T273-Y277 PolarHBondContact O-N 3.08Å; K274-Y277 PolarHBondContact O-N 3.05Å; L275-Y277 VanDerWaalsContact C-N 3.34Å; L275-Y277 PolarHBondContact O-N 3.45Å; Y277-H281 WeakPolarHBondContact O-CB 3.37Å; Y277-H281 PolarHBondContact O-N 3.33Å |
| 278 | Q | 96.6 | Very high | 96.6 | Very high | 99 Ų | 99 | 97.1 Ų | 97.1 | 46% | 0.463 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67 | -42.3 | 176.6 | -72.1 | 179.7 | -12.4 | 0 | 0 | 112 | K274 L275 S276 H281 L282 | K274-Q278 WeakPolarHBondContact O-CG 3.49Å; K274-Q278 PolarHBondContact O-N 3Å; K274-Q278 VanDerWaalsContact O-N 3.12Å; L275-Q278 WeakPolarHBondContact O-CB 3.4Å; L275-Q278 PolarHBondContact O-N 3.39Å; L275-Q278 VanDerWaalsContact O-N 3.07Å; S276-Q278 VanDerWaalsContact C-N 3.33Å; S276-Q278 PolarHBondContact O-N 3.23Å; Q278-H281 PolarHBondContact O-N 3.48Å; Q278-L282 WeakPolarHBondContact O-CG 3.43Å; Q278-L282 PolarHBondContact O-N 3Å |
| 279 | V | 96.2 | Very high | 96.5 | Very high | 78 Ų | 78 | 98.8 Ų | 98.8 | 47% | 0.473 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61 | -50 | 175.6 | 171.4 | 0 | 0 | 0 | 0 | 110.3 | L275 S276 H281 L282 E283 | L275-V279 WeakPolarHBondContact O-CG2 3.38Å; L275-V279 PolarHBondContact O-N 2.84Å; S276-V279 PolarHBondContact O-N 2.94Å; V279-H281 VanDerWaalsContact C-N 3.27Å; V279-H281 PolarHBondContact O-N 3.3Å; V279-L282 PolarHBondContact O-N 3.39Å; V279-E283 HydrophobicContact CG1-CG 4.42Å; V279-E283 WeakPolarHBondContact O-CG 3.27Å; V279-E283 PolarHBondContact O-N 3.16Å |
| 280 | Q | 96.4 | Very high | 96.3 | Very high | 93 Ų | 93 | 100 Ų | 100 | 44% | 0.435 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.7 | -42.4 | 177 | -173.7 | -173.7 | -13.6 | 0 | 0 | 111.8 | S276 L282 E283 E284 | S276-Q280 PolarHBondContact O-N 3.14Å; Q280-L282 VanDerWaalsContact C-N 3.34Å; Q280-L282 PolarHBondContact O-N 3.05Å; Q280-E283 PolarHBondContact O-N 3.05Å; Q280-E284 PolarHBondContact NE2-OE1 3.42Å; Q280-E284 VanDerWaalsContact NE2-OE1 3.11Å; Q280-E284 WeakPolarHBondContact O-CG 3.34Å; Q280-E284 PolarHBondContact O-N 3.42Å |
| 281 | H | 96.2 | Very high | 96.2 | Very high | 118 Ų | 118 | 102.6 Ų | 102.6 | 55% | 0.546 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.1 | -38.4 | 177.7 | -176.3 | 54 | 0 | 0 | 0 | 112.8 | Y277 Q278 V279 L285 | Y277-H281 WeakPolarHBondContact O-CB 3.37Å; Y277-H281 PolarHBondContact O-N 3.33Å; Q278-H281 PolarHBondContact O-N 3.48Å; V279-H281 VanDerWaalsContact C-N 3.27Å; V279-H281 PolarHBondContact O-N 3.3Å; H281-L285 WeakPolarHBondContact O-CB 3.38Å; H281-L285 PolarHBondContact O-N 3.39Å |
| 282 | L | 96.5 | Very high | 96 | Very high | 109 Ų | 109 | 99.5 Ų | 99.5 | 57% | 0.571 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -68.7 | -39.7 | 176.5 | -71.6 | 172.7 | 0 | 0 | 0 | 111.8 | Q278 V279 Q280 L285 Q286 | Q278-L282 WeakPolarHBondContact O-CG 3.43Å; Q278-L282 PolarHBondContact O-N 3Å; V279-L282 PolarHBondContact O-N 3.39Å; Q280-L282 VanDerWaalsContact C-N 3.34Å; Q280-L282 PolarHBondContact O-N 3.05Å; L282-L285 PolarHBondContact O-N 3.37Å; L282-Q286 WeakPolarHBondContact O-CB 3.49Å; L282-Q286 PolarHBondContact O-N 3.49Å |
| 283 | E | 96.4 | Very high | 95.7 | Very high | 113 Ų | 113 | 97.4 Ų | 97.4 | 53% | 0.528 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.9 | -44.4 | 174 | -70.7 | 174.1 | 171 | 0 | 0 | 111.4 | V279 Q280 L285 Q286 L287 | V279-E283 HydrophobicContact CG1-CG 4.42Å; V279-E283 WeakPolarHBondContact O-CG 3.27Å; V279-E283 PolarHBondContact O-N 3.16Å; Q280-E283 PolarHBondContact O-N 3.05Å; E283-L285 PolarHBondContact O-N 2.92Å; E283-Q286 PolarHBondContact O-N 3.31Å; E283-L287 WeakPolarHBondContact O-CG 3.38Å; E283-L287 PolarHBondContact O-N 3.06Å |
| 284 | E | 95.5 | Very high | 95.3 | Very high | 96 Ų | 96 | 98.8 Ų | 98.8 | 45% | 0.449 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61 | -44.2 | 174.8 | -74.9 | 174.4 | -170.1 | 0 | 0 | 111.7 | Q280 Q286 L287 D288 | Q280-E284 PolarHBondContact NE2-OE1 3.42Å; Q280-E284 VanDerWaalsContact NE2-OE1 3.11Å; Q280-E284 WeakPolarHBondContact O-CG 3.34Å; Q280-E284 PolarHBondContact O-N 3.42Å; E284-Q286 VanDerWaalsContact C-N 3.34Å; E284-Q286 PolarHBondContact O-N 3.09Å; E284-L287 PolarHBondContact O-N 3.17Å; E284-D288 PolarHBondContact O-N 3.05Å |
| 285 | L | 96.6 | Very high | 94.9 | Very high | 81 Ų | 81 | 99.7 Ų | 99.7 | 42% | 0.424 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.7 | -41 | 176.6 | -176.1 | 66.4 | 0 | 0 | 0 | 111.7 | H281 L282 E283 D288 Q289 | H281-L285 WeakPolarHBondContact O-CB 3.38Å; H281-L285 PolarHBondContact O-N 3.39Å; L282-L285 PolarHBondContact O-N 3.37Å; E283-L285 PolarHBondContact O-N 2.92Å; L285-D288 PolarHBondContact O-N 3.09Å; L285-Q289 VanDerWaalsContact O-CG 3.31Å; L285-Q289 WeakPolarHBondContact O-CG 3.44Å; L285-Q289 PolarHBondContact O-N 3.41Å |
| 286 | Q | 95.9 | Very high | 94.4 | Very high | 110 Ų | 110 | 100.4 Ų | 100.4 | 51% | 0.514 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.7 | -45 | 176.3 | -177.3 | 178.1 | -20.5 | 0 | 0 | 111.2 | L282 E283 E284 D288 Q289 E290 | L282-Q286 WeakPolarHBondContact O-CB 3.49Å; L282-Q286 PolarHBondContact O-N 3.49Å; E283-Q286 PolarHBondContact O-N 3.31Å; E284-Q286 VanDerWaalsContact C-N 3.34Å; E284-Q286 PolarHBondContact O-N 3.09Å; Q286-D288 VanDerWaalsContact C-N 3.27Å; Q286-D288 PolarHBondContact O-N 3.46Å; Q286-Q289 WeakPolarHBondContact O-CB 3.48Å; Q286-Q289 PolarHBondContact O-N 3.48Å; Q286-Q289 VanDerWaalsContact O-N 3.13Å; Q286-E290 HydrophobicContact CG-CG 4.49Å; Q286-E290 PolarHBondContact NE2-OE1 3.49Å; Q286-E290 WeakPolarHBondContact O-CG 3.4Å; Q286-E290 PolarHBondContact O-N 3.4Å |
| 287 | L | 95.5 | Very high | 93.7 | Very high | 84 Ų | 84 | 100 Ų | 100 | 44% | 0.44 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.1 | -39.4 | 174.9 | -74.3 | 173.6 | 0 | 0 | 0 | 111.7 | E283 E284 E290 R291 | E283-L287 WeakPolarHBondContact O-CG 3.38Å; E283-L287 PolarHBondContact O-N 3.06Å; E284-L287 PolarHBondContact O-N 3.17Å; L287-E290 PolarHBondContact O-N 2.94Å; L287-R291 VanDerWaalsContact O-CB 3.32Å; L287-R291 WeakPolarHBondContact O-CB 3.32Å; L287-R291 WeakPolarHBondContact O-CD 3.41Å; L287-R291 WeakPolarHBondContact O-CG 3.36Å; L287-R291 PolarHBondContact O-N 3.05Å |
| 288 | D | 95.2 | Very high | 93 | Very high | 93 Ų | 93 | 99 Ų | 99 | 50% | 0.497 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.4 | -36.4 | 176 | -81.4 | -10.8 | 0 | 0 | 0 | 112.6 | E284 L285 Q286 R291 G292 | E284-D288 PolarHBondContact O-N 3.05Å; L285-D288 PolarHBondContact O-N 3.09Å; Q286-D288 VanDerWaalsContact C-N 3.27Å; Q286-D288 PolarHBondContact O-N 3.46Å; D288-R291 IonicContact OD1-NH1 3.19Å; D288-R291 PolarHBondContact OD1-NH1 3.48Å; D288-G292 PolarHBondContact O-N 3.36Å |
| 289 | Q | 94.6 | Very high | 92 | Very high | 127 Ų | 127 | 97.5 Ų | 97.5 | 59% | 0.593 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.2 | -44.7 | 171.5 | -73.5 | 175.9 | 12.7 | 0 | 0 | 111.6 | L285 Q286 G292 A293 | L285-Q289 VanDerWaalsContact O-CG 3.31Å; L285-Q289 WeakPolarHBondContact O-CG 3.44Å; L285-Q289 PolarHBondContact O-N 3.41Å; Q286-Q289 WeakPolarHBondContact O-CB 3.48Å; Q286-Q289 PolarHBondContact O-N 3.48Å; Q286-Q289 VanDerWaalsContact O-N 3.13Å; Q289-G292 CarbonylContact O-C 3.6Å; Q289-G292 WeakPolarHBondContact O-CA 3.5Å; Q289-G292 PolarHBondContact O-N 2.93Å; Q289-A293 WeakPolarHBondContact O-CB 3.36Å; Q289-A293 PolarHBondContact O-N 3.22Å |
| 290 | E | 94.1 | Very high | 90.8 | Very high | 99 Ų | 99 | 101.2 Ų | 101.2 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.8 | -42.7 | 176.4 | -73.5 | 174.6 | -171.4 | 0 | 0 | 111.4 | Q286 L287 G292 A293 L294 | Q286-E290 HydrophobicContact CG-CG 4.49Å; Q286-E290 PolarHBondContact NE2-OE1 3.49Å; Q286-E290 WeakPolarHBondContact O-CG 3.4Å; Q286-E290 PolarHBondContact O-N 3.4Å; L287-E290 PolarHBondContact O-N 2.94Å; E290-G292 VanDerWaalsContact C-N 3.31Å; E290-G292 PolarHBondContact O-N 3.3Å; E290-A293 PolarHBondContact O-N 2.9Å; E290-L294 VanDerWaalsContact O-CB 3.27Å; E290-L294 WeakPolarHBondContact O-CB 3.36Å; E290-L294 PolarHBondContact O-N 3.43Å |
| 291 | R | 94 | Very high | 89.2 | Confident | 149 Ų | 149 | 101.2 Ų | 101.2 | 56% | 0.562 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.4 | -40.5 | 171.9 | -74.1 | 165.7 | 177.7 | 175.8 | 0.2 | 111.5 | L287 D288 L294 K295 | L287-R291 VanDerWaalsContact O-CB 3.32Å; L287-R291 WeakPolarHBondContact O-CB 3.32Å; L287-R291 WeakPolarHBondContact O-CD 3.41Å; L287-R291 WeakPolarHBondContact O-CG 3.36Å; L287-R291 PolarHBondContact O-N 3.05Å; D288-R291 IonicContact OD1-NH1 3.19Å; D288-R291 PolarHBondContact OD1-NH1 3.48Å; R291-L294 PolarHBondContact O-N 3.04Å; R291-K295 WeakPolarHBondContact O-CB 3.38Å; R291-K295 VanDerWaalsContact O-CG 3.31Å; R291-K295 WeakPolarHBondContact O-CG 3.25Å; R291-K295 PolarHBondContact O-N 3.09Å |
| 292 | G | 93.1 | Very high | 87.4 | Confident | 27 Ų | 27 | 100.6 Ų | 100.6 | 28% | 0.278 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.7 | -49.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | D288 Q289 E290 L294 K295 I296 | D288-G292 PolarHBondContact O-N 3.36Å; Q289-G292 CarbonylContact O-C 3.6Å; Q289-G292 WeakPolarHBondContact O-CA 3.5Å; Q289-G292 PolarHBondContact O-N 2.93Å; E290-G292 VanDerWaalsContact C-N 3.31Å; E290-G292 PolarHBondContact O-N 3.3Å; G292-L294 VanDerWaalsContact C-N 3.3Å; G292-L294 PolarHBondContact O-N 2.87Å; G292-K295 WeakPolarHBondContact O-CB 3.36Å; G292-K295 PolarHBondContact O-N 2.86Å; G292-I296 VanDerWaalsContact O-CG1 3.3Å; G292-I296 WeakPolarHBondContact O-CG1 3.49Å; G292-I296 PolarHBondContact O-N 3.47Å |
| 293 | A | 91.1 | Very high | 85.1 | Confident | 58 Ų | 58 | 103.9 Ų | 103.9 | 48% | 0.479 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.5 | -39.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q289 E290 I296 S297 | Q289-A293 WeakPolarHBondContact O-CB 3.36Å; Q289-A293 PolarHBondContact O-N 3.22Å; E290-A293 PolarHBondContact O-N 2.9Å; A293-I296 PolarHBondContact O-N 2.99Å; A293-S297 WeakPolarHBondContact O-CB 3.39Å; A293-S297 PolarHBondContact O-N 2.98Å |
| 294 | L | 88.9 | Confident | 83.1 | Confident | 93 Ų | 93 | 101 Ų | 101 | 49% | 0.487 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -70.9 | -36.5 | 177 | -169 | 138.4 | 0 | 0 | 0 | 112.3 | E290 R291 G292 K298 | E290-L294 VanDerWaalsContact O-CB 3.27Å; E290-L294 WeakPolarHBondContact O-CB 3.36Å; E290-L294 PolarHBondContact O-N 3.43Å; R291-L294 PolarHBondContact O-N 3.04Å; G292-L294 VanDerWaalsContact C-N 3.3Å; G292-L294 PolarHBondContact O-N 2.87Å; L294-K298 HydrophobicContact CD2-CD 3.85Å; L294-K298 VanDerWaalsContact CD2-CE 3.47Å; L294-K298 HydrophobicContact CD2-CG 4.42Å; L294-K298 WeakPolarHBondContact O-CB 3.36Å; L294-K298 VanDerWaalsContact O-CG 3.32Å; L294-K298 WeakPolarHBondContact O-CG 3.37Å; L294-K298 PolarHBondContact O-N 3.17Å |
| 295 | K | 89.3 | Confident | 81.2 | Confident | 152 Ų | 152 | 102.8 Ų | 102.8 | 66% | 0.661 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.4 | -44.7 | 170.8 | -76.8 | 173.3 | -177 | 175.2 | 0 | 111.5 | R291 G292 K298 A299 | R291-K295 WeakPolarHBondContact O-CB 3.38Å; R291-K295 VanDerWaalsContact O-CG 3.31Å; R291-K295 WeakPolarHBondContact O-CG 3.25Å; R291-K295 PolarHBondContact O-N 3.09Å; G292-K295 WeakPolarHBondContact O-CB 3.36Å; G292-K295 PolarHBondContact O-N 2.86Å; K295-K298 PolarHBondContact O-N 3.28Å; K295-A299 WeakPolarHBondContact O-CB 3.47Å; K295-A299 PolarHBondContact O-N 2.82Å |
| 296 | I | 86.4 | Confident | 79.6 | Confident | 102 Ų | 102 | 101.5 Ų | 101.5 | 52% | 0.523 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.4 | -50 | 175.8 | -69.1 | 167.9 | 0 | 0 | 0 | 109.5 | G292 A293 K298 A299 F300 | G292-I296 VanDerWaalsContact O-CG1 3.3Å; G292-I296 WeakPolarHBondContact O-CG1 3.49Å; G292-I296 PolarHBondContact O-N 3.47Å; A293-I296 PolarHBondContact O-N 2.99Å; I296-K298 VanDerWaalsContact C-N 3.33Å; I296-K298 PolarHBondContact O-N 3.11Å; I296-A299 WeakPolarHBondContact O-CA 3.46Å; I296-A299 WeakPolarHBondContact O-CB 3.25Å; I296-A299 PolarHBondContact O-N 3.42Å; I296-F300 HydrophobicContact CG2-CD2 3.67Å; I296-F300 HydrophobicContact CG2-CE2 3.78Å; I296-F300 VanDerWaalsContact O-CD2 3.31Å; I296-F300 WeakPolarHBondContact O-CD2 3.44Å; I296-F300 PolarHBondContact O-N 3.24Å |
| 297 | S | 82 | Confident | 78.3 | Confident | 55 Ų | 55 | 102.1 Ų | 102.1 | 39% | 0.385 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -55.5 | -46.5 | 176.6 | -178.1 | 0 | 0 | 0 | 0 | 111.2 | A293 A299 F300 N301 | A293-S297 WeakPolarHBondContact O-CB 3.39Å; A293-S297 PolarHBondContact O-N 2.98Å; S297-A299 VanDerWaalsContact C-N 3.31Å; S297-A299 PolarHBondContact O-N 3.08Å; S297-F300 PolarHBondContact O-N 2.86Å; S297-N301 WeakPolarHBondContact O-CA 3.47Å; S297-N301 WeakPolarHBondContact O-CB 3.42Å; S297-N301 PolarHBondContact O-N 3.36Å; S297-N301 PolarHBondContact OG-ND2 2.95Å |
| 298 | K | 81.7 | Confident | 77.3 | Confident | 142 Ų | 142 | 104.5 Ų | 104.5 | 62% | 0.617 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.8 | -31.9 | 173.9 | -77.6 | 179.1 | 175.8 | 176 | 0 | 114.1 | L294 K295 I296 N301 | L294-K298 HydrophobicContact CD2-CD 3.85Å; L294-K298 VanDerWaalsContact CD2-CE 3.47Å; L294-K298 HydrophobicContact CD2-CG 4.42Å; L294-K298 WeakPolarHBondContact O-CB 3.36Å; L294-K298 VanDerWaalsContact O-CG 3.32Å; L294-K298 WeakPolarHBondContact O-CG 3.37Å; L294-K298 PolarHBondContact O-N 3.17Å; K295-K298 PolarHBondContact O-N 3.28Å; I296-K298 VanDerWaalsContact C-N 3.33Å; I296-K298 PolarHBondContact O-N 3.11Å; K298-N301 CarbonylContact O-C 3.51Å |
| 299 | A | 76 | Confident | 76.6 | Confident | 68 Ų | 68 | 101.6 Ų | 101.6 | 56% | 0.562 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -73.6 | -33.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | K295 I296 S297 | K295-A299 WeakPolarHBondContact O-CB 3.47Å; K295-A299 PolarHBondContact O-N 2.82Å; I296-A299 WeakPolarHBondContact O-CA 3.46Å; I296-A299 WeakPolarHBondContact O-CB 3.25Å; I296-A299 PolarHBondContact O-N 3.42Å; S297-A299 VanDerWaalsContact C-N 3.31Å; S297-A299 PolarHBondContact O-N 3.08Å |
| 300 | F | 70.5 | Confident | 76 | Confident | 156 Ų | 156 | 99.8 Ų | 99.8 | 68% | 0.684 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -87 | -42.8 | 178 | -79.8 | -78.9 | 0 | 0 | 0 | 112.6 | I296 S297 L302 | I296-F300 HydrophobicContact CG2-CD2 3.67Å; I296-F300 HydrophobicContact CG2-CE2 3.78Å; I296-F300 VanDerWaalsContact O-CD2 3.31Å; I296-F300 WeakPolarHBondContact O-CD2 3.44Å; I296-F300 PolarHBondContact O-N 3.24Å; S297-F300 PolarHBondContact O-N 2.86Å; F300-L302 PolarHBondContact O-N 2.97Å |
| 301 | N | 62.9 | Low | 75.5 | Confident | 94 Ų | 94 | 99.3 Ų | 99.3 | 50% | 0.503 | 54% | 0.537 | S | S | . | . | trans | -82.3 | 65.6 | 167.5 | -62.5 | -30.3 | 0 | 0 | 0 | 109 | S297 K298 E303 | S297-N301 WeakPolarHBondContact O-CA 3.47Å; S297-N301 WeakPolarHBondContact O-CB 3.42Å; S297-N301 PolarHBondContact O-N 3.36Å; S297-N301 PolarHBondContact OG-ND2 2.95Å; K298-N301 CarbonylContact O-C 3.51Å; N301-E303 HydrophobicContact CB-CG 4.37Å; N301-E303 PolarHBondContact O-N 3.16Å | ||
| 302 | L | 58.7 | Low | 75.2 | Confident | 105 Ų | 105 | 94.5 Ų | 94.5 | 55% | 0.55 | 53% | 0.526 | S | S | . | . | trans | -65.9 | 65.1 | 149.3 | -76.4 | 162.7 | 0 | 0 | 0 | 107.6 | F300 G304 | F300-L302 PolarHBondContact O-N 2.97Å; L302-G304 PolarHBondContact O-N 3.17Å | ||
| 303 | E | 49.3 | Very low | 74.9 | Confident | 178 Ų | 178 | 97.3 Ų | 97.3 | 83% | 0.832 | 54% | 0.535 | S | S | * | . | trans | -55.7 | 118 | 168.4 | -96 | 179.7 | 149.6 | 0 | 0 | 107.2 | N301 | N301-E303 HydrophobicContact CB-CG 4.37Å; N301-E303 PolarHBondContact O-N 3.16Å | ||
| 304 | G | 52.9 | Low | 74.9 | Confident | 52 Ų | 52 | 98.9 Ų | 98.9 | 54% | 0.536 | 54% | 0.535 | S | S | . | . | S | Bend | trans | 101.7 | 105.7 | 174 | 0 | 0 | 0 | 0 | 0 | 113.9 | L302 S306 | L302-G304 PolarHBondContact O-N 3.17Å; G304-S306 PolarHBondContact O-N 3.37Å; G304-S306 VanDerWaalsContact O-N 3.08Å |
| 305 | N | 56.9 | Low | 75.1 | Confident | 133 Ų | 133 | 100.1 Ų | 100.1 | 71% | 0.711 | 54% | 0.538 | S | S | * | . | S | Bend | trans | 77.8 | -22.8 | 152 | -55.7 | -21.6 | 0 | 0 | 0 | 119.6 | G309 | N305-G309 VanDerWaalsContact O-CA 3.28Å; N305-G309 WeakPolarHBondContact O-CA 3.46Å; N305-G309 PolarHBondContact O-N 3.45Å; N305-G309 VanDerWaalsContact O-N 3.08Å |
| 306 | S | 62.5 | Low | 75.2 | Confident | 54 Ų | 54 | 100 Ų | 100 | 38% | 0.378 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -79.2 | -55.5 | -178.2 | 71.6 | 0 | 0 | 0 | 0 | 112.5 | G304 V310 | G304-S306 PolarHBondContact O-N 3.37Å; G304-S306 VanDerWaalsContact O-N 3.08Å; S306-V310 WeakPolarHBondContact O-CB 3.22Å; S306-V310 WeakPolarHBondContact O-CG2 3.49Å; S306-V310 PolarHBondContact O-N 2.79Å |
| 307 | Q | 69.1 | Low | 75.5 | Confident | 124 Ų | 124 | 102.5 Ų | 102.5 | 58% | 0.579 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -71 | -47.8 | 179.4 | -68.3 | -174.8 | -2.6 | 0 | 0 | 111.7 | G309 V310 I311 | Q307-G309 VanDerWaalsContact C-N 3.27Å; Q307-G309 PolarHBondContact O-N 3.04Å; Q307-V310 PolarHBondContact O-N 3.45Å; Q307-I311 WeakPolarHBondContact O-CB 3.21Å; Q307-I311 VanDerWaalsContact O-CG1 3.25Å; Q307-I311 WeakPolarHBondContact O-CG1 3.31Å; Q307-I311 PolarHBondContact O-N 3.41Å |
| 308 | E | 74.2 | Confident | 76 | Confident | 134 Ų | 134 | 104.3 Ų | 104.3 | 63% | 0.626 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.3 | -36 | 175.1 | -74.9 | -179.5 | 162.7 | 0 | 0 | 112.4 | I311 S312 | E308-I311 PolarHBondContact O-N 3.01Å; E308-S312 WeakPolarHBondContact O-CB 3.4Å; E308-S312 PolarHBondContact O-N 3.32Å; E308-S312 PolarHBondContact O-OG 2.97Å |
| 309 | G | 80.4 | Confident | 76.6 | Confident | 32 Ų | 32 | 104.2 Ų | 104.2 | 33% | 0.33 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.3 | -42.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | N305 Q307 N313 | N305-G309 VanDerWaalsContact O-CA 3.28Å; N305-G309 WeakPolarHBondContact O-CA 3.46Å; N305-G309 PolarHBondContact O-N 3.45Å; N305-G309 VanDerWaalsContact O-N 3.08Å; Q307-G309 VanDerWaalsContact C-N 3.27Å; Q307-G309 PolarHBondContact O-N 3.04Å; G309-N313 VanDerWaalsContact O-CB 3.29Å; G309-N313 WeakPolarHBondContact O-CB 3.37Å; G309-N313 PolarHBondContact O-N 3Å |
| 310 | V | 81.5 | Confident | 77.4 | Confident | 88 Ų | 88 | 107.7 Ų | 107.7 | 53% | 0.533 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 173.7 | 170.3 | 0 | 0 | 0 | 0 | 110.7 | S306 Q307 N313 L314 | S306-V310 WeakPolarHBondContact O-CB 3.22Å; S306-V310 WeakPolarHBondContact O-CG2 3.49Å; S306-V310 PolarHBondContact O-N 2.79Å; Q307-V310 PolarHBondContact O-N 3.45Å; V310-N313 PolarHBondContact O-N 2.92Å; V310-L314 HydrophobicContact CG1-CD1 3.92Å; V310-L314 HydrophobicContact CG1-CG 4.39Å; V310-L314 WeakPolarHBondContact O-CB 3.26Å; V310-L314 VanDerWaalsContact O-CG 3.3Å; V310-L314 WeakPolarHBondContact O-CG 3.37Å; V310-L314 PolarHBondContact O-N 2.94Å |
| 311 | I | 84.9 | Confident | 78.3 | Confident | 89 Ų | 89 | 105.2 Ų | 105.2 | 46% | 0.456 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.2 | -51.7 | 177.2 | -68.6 | 166.2 | 0 | 0 | 0 | 110.1 | Q307 E308 N313 L314 E315 | Q307-I311 WeakPolarHBondContact O-CB 3.21Å; Q307-I311 VanDerWaalsContact O-CG1 3.25Å; Q307-I311 WeakPolarHBondContact O-CG1 3.31Å; Q307-I311 PolarHBondContact O-N 3.41Å; E308-I311 PolarHBondContact O-N 3.01Å; I311-N313 VanDerWaalsContact C-N 3.26Å; I311-N313 PolarHBondContact O-N 3.43Å; I311-L314 CarbonylContact O-C 3.56Å; I311-L314 WeakPolarHBondContact O-CB 3.45Å; I311-L314 PolarHBondContact O-N 3.22Å; I311-L314 VanDerWaalsContact O-N 3.1Å; I311-E315 HydrophobicContact CG2-CG 4.36Å; I311-E315 WeakPolarHBondContact O-CG 3.28Å; I311-E315 PolarHBondContact O-N 3.05Å |
| 312 | S | 86.1 | Confident | 79.7 | Confident | 49 Ų | 49 | 106.7 Ų | 106.7 | 34% | 0.343 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.8 | -34.4 | 178.7 | -64.8 | 0 | 0 | 0 | 0 | 113 | E308 R316 | E308-S312 WeakPolarHBondContact O-CB 3.4Å; E308-S312 PolarHBondContact O-N 3.32Å; E308-S312 PolarHBondContact O-OG 2.97Å; S312-R316 WeakPolarHBondContact O-CB 3.42Å; S312-R316 PolarHBondContact O-N 3.11Å; S312-R316 PolarHBondContact O-NE 3.08Å |
| 313 | N | 88.1 | Confident | 81.3 | Confident | 85 Ų | 85 | 107.8 Ų | 107.8 | 46% | 0.455 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -71.8 | -44.1 | 175.5 | -168.5 | -18.5 | 0 | 0 | 0 | 111.1 | G309 V310 I311 E315 R316 R317 | G309-N313 VanDerWaalsContact O-CB 3.29Å; G309-N313 WeakPolarHBondContact O-CB 3.37Å; G309-N313 PolarHBondContact O-N 3Å; V310-N313 PolarHBondContact O-N 2.92Å; I311-N313 VanDerWaalsContact C-N 3.26Å; I311-N313 PolarHBondContact O-N 3.43Å; N313-E315 VanDerWaalsContact C-N 3.35Å; N313-E315 PolarHBondContact O-N 3.26Å; N313-R316 PolarHBondContact O-N 3.25Å; N313-R317 WeakPolarHBondContact O-CB 3.5Å; N313-R317 PolarHBondContact O-N 3.43Å |
| 314 | L | 91.5 | Very high | 83.2 | Confident | 92 Ų | 92 | 101.7 Ų | 101.7 | 48% | 0.482 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.5 | -45.1 | 174.2 | -72.5 | 172 | 0 | 0 | 0 | 111.1 | V310 I311 R316 R317 I318 | V310-L314 HydrophobicContact CG1-CD1 3.92Å; V310-L314 HydrophobicContact CG1-CG 4.39Å; V310-L314 WeakPolarHBondContact O-CB 3.26Å; V310-L314 VanDerWaalsContact O-CG 3.3Å; V310-L314 WeakPolarHBondContact O-CG 3.37Å; V310-L314 PolarHBondContact O-N 2.94Å; I311-L314 CarbonylContact O-C 3.56Å; I311-L314 WeakPolarHBondContact O-CB 3.45Å; I311-L314 PolarHBondContact O-N 3.22Å; I311-L314 VanDerWaalsContact O-N 3.1Å; L314-R316 PolarHBondContact O-N 2.78Å; L314-R317 WeakPolarHBondContact O-CB 3.38Å; L314-R317 PolarHBondContact O-N 3.03Å; L314-R317 VanDerWaalsContact O-N 3.15Å; L314-I318 WeakPolarHBondContact O-CB 3.42Å; L314-I318 VanDerWaalsContact O-CG1 3.28Å; L314-I318 WeakPolarHBondContact O-CG1 3.41Å; L314-I318 PolarHBondContact O-N 2.77Å |
| 315 | E | 92.9 | Very high | 85 | Confident | 118 Ų | 118 | 105.4 Ų | 105.4 | 55% | 0.551 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.6 | -46.2 | 174.8 | -72.8 | -179.7 | 159.1 | 0 | 0 | 112.1 | I311 N313 R317 I318 K319 | I311-E315 HydrophobicContact CG2-CG 4.36Å; I311-E315 WeakPolarHBondContact O-CG 3.28Å; I311-E315 PolarHBondContact O-N 3.05Å; N313-E315 VanDerWaalsContact C-N 3.35Å; N313-E315 PolarHBondContact O-N 3.26Å; E315-R317 VanDerWaalsContact C-N 3.29Å; E315-R317 PolarHBondContact O-N 3.42Å; E315-I318 PolarHBondContact O-N 3.38Å; E315-K319 WeakPolarHBondContact O-CB 3.07Å; E315-K319 PolarHBondContact O-N 3.43Å |
| 316 | R | 91.3 | Very high | 86.7 | Confident | 150 Ų | 150 | 104.7 Ų | 104.7 | 57% | 0.566 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61 | -37.4 | 174.4 | -96.6 | -178.4 | -78.5 | 151.4 | -8.1 | 112.6 | S312 N313 L314 R320 | S312-R316 WeakPolarHBondContact O-CB 3.42Å; S312-R316 PolarHBondContact O-N 3.11Å; S312-R316 PolarHBondContact O-NE 3.08Å; N313-R316 PolarHBondContact O-N 3.25Å; L314-R316 PolarHBondContact O-N 2.78Å; R316-R320 WeakPolarHBondContact O-CG 3.38Å; R316-R320 PolarHBondContact O-N 3.09Å; R316-R320 VanDerWaalsContact O-N 3.13Å; R316-R320 PolarHBondContact O-NE 2.93Å |
| 317 | R | 92.8 | Very high | 88 | Confident | 155 Ų | 155 | 107.9 Ų | 107.9 | 59% | 0.585 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -69.1 | -45.2 | 176.9 | -177 | 174 | 169.8 | 175.4 | -4.1 | 110.8 | N313 L314 E315 K319 R320 L321 | N313-R317 WeakPolarHBondContact O-CB 3.5Å; N313-R317 PolarHBondContact O-N 3.43Å; L314-R317 WeakPolarHBondContact O-CB 3.38Å; L314-R317 PolarHBondContact O-N 3.03Å; L314-R317 VanDerWaalsContact O-N 3.15Å; E315-R317 VanDerWaalsContact C-N 3.29Å; E315-R317 PolarHBondContact O-N 3.42Å; R317-K319 VanDerWaalsContact C-N 3.33Å; R317-K319 PolarHBondContact O-N 3.22Å; R317-R320 PolarHBondContact O-N 3.12Å; R317-L321 HydrophobicContact CG-CD1 4.19Å; R317-L321 WeakPolarHBondContact O-CG 3.31Å; R317-L321 PolarHBondContact O-N 2.66Å |
| 318 | I | 92.6 | Very high | 88.9 | Confident | 93 Ų | 93 | 104.9 Ų | 104.9 | 48% | 0.477 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57.8 | -46.3 | 174.5 | -70.1 | 166.2 | 0 | 0 | 0 | 110.2 | L314 E315 R320 L321 K322 | L314-I318 WeakPolarHBondContact O-CB 3.42Å; L314-I318 VanDerWaalsContact O-CG1 3.28Å; L314-I318 WeakPolarHBondContact O-CG1 3.41Å; L314-I318 PolarHBondContact O-N 2.77Å; E315-I318 PolarHBondContact O-N 3.38Å; I318-R320 VanDerWaalsContact C-N 3.3Å; I318-R320 PolarHBondContact O-N 3.15Å; I318-L321 PolarHBondContact O-N 3.41Å; I318-K322 HydrophobicContact CG2-CD 4.49Å; I318-K322 PolarHBondContact O-N 3.31Å |
| 319 | K | 93.8 | Very high | 89.7 | Confident | 140 Ų | 140 | 101.6 Ų | 101.6 | 61% | 0.609 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.9 | -31.9 | 178.6 | -166.8 | 173.8 | -175.4 | 175.6 | 0 | 113.3 | E315 R317 R323 | E315-K319 WeakPolarHBondContact O-CB 3.07Å; E315-K319 PolarHBondContact O-N 3.43Å; R317-K319 VanDerWaalsContact C-N 3.33Å; R317-K319 PolarHBondContact O-N 3.22Å; K319-R323 PolarHBondContact O-N 2.95Å; K319-R323 PolarHBondContact O-NE 3.06Å |
| 320 | R | 91.8 | Very high | 90.2 | Very high | 140 Ų | 140 | 107 Ų | 107 | 53% | 0.528 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -71.7 | -44.7 | 173.1 | -80.9 | -177.5 | -82.3 | 169.8 | -6.6 | 111.6 | R316 R317 I318 K322 R323 A324 | R316-R320 WeakPolarHBondContact O-CG 3.38Å; R316-R320 PolarHBondContact O-N 3.09Å; R316-R320 VanDerWaalsContact O-N 3.13Å; R316-R320 PolarHBondContact O-NE 2.93Å; R317-R320 PolarHBondContact O-N 3.12Å; I318-R320 VanDerWaalsContact C-N 3.3Å; I318-R320 PolarHBondContact O-N 3.15Å; R320-K322 VanDerWaalsContact C-N 3.34Å; R320-K322 PolarHBondContact O-N 3.11Å; R320-R323 PolarHBondContact O-N 2.93Å; R320-A324 PolarHBondContact O-N 3.16Å |
| 321 | L | 90.7 | Very high | 90.6 | Very high | 105 Ų | 105 | 107.9 Ų | 107.9 | 55% | 0.55 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.1 | -39.7 | 178.4 | -70.9 | 172.1 | 0 | 0 | 0 | 112 | R317 I318 A324 Q325 | R317-L321 HydrophobicContact CG-CD1 4.19Å; R317-L321 WeakPolarHBondContact O-CG 3.31Å; R317-L321 PolarHBondContact O-N 2.66Å; I318-L321 PolarHBondContact O-N 3.41Å; L321-A324 PolarHBondContact O-N 3.14Å; L321-Q325 WeakPolarHBondContact O-CB 3.49Å; L321-Q325 PolarHBondContact O-N 2.95Å |
| 322 | K | 92.7 | Very high | 90.8 | Very high | 124 Ų | 124 | 107.3 Ų | 107.3 | 54% | 0.539 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.5 | -46.1 | 174 | -77 | -172.3 | 174.9 | -173.1 | 0 | 112.6 | I318 R320 Q325 E326 | I318-K322 HydrophobicContact CG2-CD 4.49Å; I318-K322 PolarHBondContact O-N 3.31Å; R320-K322 VanDerWaalsContact C-N 3.34Å; R320-K322 PolarHBondContact O-N 3.11Å; K322-Q325 WeakPolarHBondContact O-CB 3.39Å; K322-Q325 PolarHBondContact O-N 3.24Å; K322-E326 WeakPolarHBondContact O-CG 3.35Å; K322-E326 PolarHBondContact O-N 3.42Å |
| 323 | R | 90.7 | Very high | 91 | Very high | 128 Ų | 128 | 109.1 Ų | 109.1 | 48% | 0.483 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.1 | -45.6 | 176.4 | -79.9 | -176.5 | -82.1 | 155.2 | -11.8 | 112.6 | K319 R320 Q325 E326 E327 | K319-R323 PolarHBondContact O-N 2.95Å; K319-R323 PolarHBondContact O-NE 3.06Å; R320-R323 PolarHBondContact O-N 2.93Å; R323-Q325 PolarHBondContact O-N 3.28Å; R323-E326 PolarHBondContact O-N 3.22Å; R323-E326 VanDerWaalsContact O-N 3.16Å; R323-E327 WeakPolarHBondContact O-CG 3.4Å; R323-E327 PolarHBondContact O-N 3.09Å |
| 324 | A | 89.2 | Confident | 91.1 | Very high | 51 Ų | 51 | 106.6 Ų | 106.6 | 42% | 0.421 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.8 | -35.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | R320 L321 S328 | R320-A324 PolarHBondContact O-N 3.16Å; L321-A324 PolarHBondContact O-N 3.14Å; A324-S328 WeakPolarHBondContact O-CB 3.49Å; A324-S328 PolarHBondContact O-N 2.94Å |
| 325 | Q | 91.5 | Very high | 91.1 | Very high | 130 Ų | 130 | 106.5 Ų | 106.5 | 61% | 0.607 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66 | -44.6 | 173.8 | -178 | -173.5 | -12.9 | 0 | 0 | 111.6 | L321 K322 R323 S328 T329 | L321-Q325 WeakPolarHBondContact O-CB 3.49Å; L321-Q325 PolarHBondContact O-N 2.95Å; K322-Q325 WeakPolarHBondContact O-CB 3.39Å; K322-Q325 PolarHBondContact O-N 3.24Å; R323-Q325 PolarHBondContact O-N 3.28Å; Q325-S328 PolarHBondContact O-N 3.1Å; Q325-T329 WeakPolarHBondContact O-CB 3.46Å; Q325-T329 PolarHBondContact O-N 3.05Å; Q325-T329 PolarHBondContact O-OG1 2.88Å |
| 326 | E | 92.1 | Very high | 91.1 | Very high | 118 Ų | 118 | 108.6 Ų | 108.6 | 55% | 0.551 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.6 | -49.8 | 176.6 | -73 | 162.3 | -175.3 | 0 | 0 | 111.2 | K322 R323 S328 T329 E330 | K322-E326 WeakPolarHBondContact O-CG 3.35Å; K322-E326 PolarHBondContact O-N 3.42Å; R323-E326 PolarHBondContact O-N 3.22Å; R323-E326 VanDerWaalsContact O-N 3.16Å; E326-S328 VanDerWaalsContact C-N 3.34Å; E326-S328 PolarHBondContact O-N 3.36Å; E326-T329 WeakPolarHBondContact O-CB 3.32Å; E326-T329 PolarHBondContact O-N 2.9Å; E326-E330 PolarHBondContact O-N 3.34Å |
| 327 | E | 91.3 | Very high | 91 | Very high | 121 Ų | 121 | 106.2 Ų | 106.2 | 57% | 0.565 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -57.1 | -45.2 | 176.1 | -71.5 | 170.7 | -171.1 | 0 | 0 | 112 | R323 T329 E330 I331 | R323-E327 WeakPolarHBondContact O-CG 3.4Å; R323-E327 PolarHBondContact O-N 3.09Å; E327-T329 VanDerWaalsContact C-N 3.28Å; E327-T329 PolarHBondContact O-N 3.25Å; E327-E330 PolarHBondContact O-N 3.11Å; E327-I331 WeakPolarHBondContact O-CG1 3.36Å; E327-I331 PolarHBondContact O-N 3.13Å; E327-I331 VanDerWaalsContact O-N 3.08Å |
| 328 | S | 88 | Confident | 90.8 | Very high | 61 Ų | 61 | 106.5 Ų | 106.5 | 43% | 0.427 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.2 | -38.1 | 176.4 | -177.1 | 0 | 0 | 0 | 0 | 112 | A324 Q325 E326 I331 I332 | A324-S328 WeakPolarHBondContact O-CB 3.49Å; A324-S328 PolarHBondContact O-N 2.94Å; Q325-S328 PolarHBondContact O-N 3.1Å; E326-S328 VanDerWaalsContact C-N 3.34Å; E326-S328 PolarHBondContact O-N 3.36Å; S328-I331 PolarHBondContact O-N 3.45Å; S328-I332 VanDerWaalsContact O-CG1 3.3Å; S328-I332 WeakPolarHBondContact O-CG1 3.3Å; S328-I332 PolarHBondContact O-N 3.02Å |
| 329 | T | 90.6 | Very high | 90.6 | Very high | 65 Ų | 65 | 107.6 Ų | 107.6 | 40% | 0.399 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.1 | -40.8 | 179.2 | -50.7 | 0 | 0 | 0 | 0 | 111.1 | Q325 E326 E327 I332 N333 | Q325-T329 WeakPolarHBondContact O-CB 3.46Å; Q325-T329 PolarHBondContact O-N 3.05Å; Q325-T329 PolarHBondContact O-OG1 2.88Å; E326-T329 WeakPolarHBondContact O-CB 3.32Å; E326-T329 PolarHBondContact O-N 2.9Å; E327-T329 VanDerWaalsContact C-N 3.28Å; E327-T329 PolarHBondContact O-N 3.25Å; T329-I332 PolarHBondContact O-N 3.35Å; T329-N333 VanDerWaalsContact O-CG 3.3Å; T329-N333 PolarHBondContact O-N 3.42Å; T329-N333 PolarHBondContact O-ND2 3.07Å |
| 330 | E | 90.1 | Very high | 90.5 | Very high | 144 Ų | 144 | 105.7 Ų | 105.7 | 67% | 0.673 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.4 | -44.6 | 173.7 | -75.6 | -175.9 | 170.6 | 0 | 0 | 112.2 | E326 E327 I332 N333 G334 | E326-E330 PolarHBondContact O-N 3.34Å; E327-E330 PolarHBondContact O-N 3.11Å; E330-I332 VanDerWaalsContact C-N 3.33Å; E330-I332 PolarHBondContact O-N 2.94Å; E330-N333 PolarHBondContact O-N 2.94Å; E330-G334 PolarHBondContact O-N 3.49Å |
| 331 | I | 90 | Very high | 90.5 | Very high | 108 Ų | 108 | 102 Ų | 102 | 55% | 0.554 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.9 | -45.2 | 176.6 | -66.9 | 166.7 | 0 | 0 | 0 | 110.8 | E327 S328 N333 G334 L335 | E327-I331 WeakPolarHBondContact O-CG1 3.36Å; E327-I331 PolarHBondContact O-N 3.13Å; E327-I331 VanDerWaalsContact O-N 3.08Å; S328-I331 PolarHBondContact O-N 3.45Å; I331-N333 VanDerWaalsContact C-N 3.34Å; I331-N333 PolarHBondContact O-N 3.32Å; I331-G334 PolarHBondContact O-N 3.32Å; I331-L335 HydrophobicContact CG2-CD1 4.13Å; I331-L335 WeakPolarHBondContact O-CG 3.27Å; I331-L335 PolarHBondContact O-N 3.4Å |
| 332 | I | 89.2 | Confident | 90.4 | Very high | 76 Ų | 76 | 99 Ų | 99 | 39% | 0.39 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 177.9 | -70.1 | 168.4 | 0 | 0 | 0 | 110.5 | S328 T329 E330 G334 L335 R336 | S328-I332 VanDerWaalsContact O-CG1 3.3Å; S328-I332 WeakPolarHBondContact O-CG1 3.3Å; S328-I332 PolarHBondContact O-N 3.02Å; T329-I332 PolarHBondContact O-N 3.35Å; E330-I332 VanDerWaalsContact C-N 3.33Å; E330-I332 PolarHBondContact O-N 2.94Å; I332-G334 PolarHBondContact O-N 2.97Å; I332-L335 PolarHBondContact O-N 3.47Å; I332-R336 HydrophobicContact CG2-CG 4.46Å; I332-R336 WeakPolarHBondContact O-CG 3.39Å; I332-R336 PolarHBondContact O-N 2.92Å |
| 333 | N | 90.4 | Very high | 90.2 | Very high | 87 Ų | 87 | 94 Ų | 94 | 47% | 0.465 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.9 | -41.9 | 177.4 | -72.9 | -21.5 | 0 | 0 | 0 | 111.7 | T329 E330 I331 L335 R336 Q337 | T329-N333 VanDerWaalsContact O-CG 3.3Å; T329-N333 PolarHBondContact O-N 3.42Å; T329-N333 PolarHBondContact O-ND2 3.07Å; E330-N333 PolarHBondContact O-N 2.94Å; I331-N333 VanDerWaalsContact C-N 3.34Å; I331-N333 PolarHBondContact O-N 3.32Å; N333-L335 VanDerWaalsContact C-N 3.34Å; N333-L335 PolarHBondContact O-N 3.41Å; N333-R336 WeakPolarHBondContact O-CB 3.41Å; N333-R336 PolarHBondContact O-N 3.19Å; N333-Q337 PolarHBondContact O-N 2.98Å |
| 334 | G | 90.8 | Very high | 90.2 | Very high | 33 Ų | 33 | 92.9 Ų | 92.9 | 34% | 0.34 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.2 | -35 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E330 I331 I332 R338 | E330-G334 PolarHBondContact O-N 3.49Å; I331-G334 PolarHBondContact O-N 3.32Å; I332-G334 PolarHBondContact O-N 2.97Å; G334-R338 WeakPolarHBondContact O-CG 3.4Å; G334-R338 PolarHBondContact O-N 2.88Å; G334-R338 VanDerWaalsContact O-N 3.1Å; G334-R338 PolarHBondContact O-NE 3.41Å |
| 335 | L | 90.9 | Very high | 90.2 | Very high | 90 Ų | 90 | 95.2 Ų | 95.2 | 47% | 0.471 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -67.9 | -42.7 | 172.2 | -75.1 | 168.4 | 0 | 0 | 0 | 112 | I331 I332 N333 Q337 R338 L339 | I331-L335 HydrophobicContact CG2-CD1 4.13Å; I331-L335 WeakPolarHBondContact O-CG 3.27Å; I331-L335 PolarHBondContact O-N 3.4Å; I332-L335 PolarHBondContact O-N 3.47Å; N333-L335 VanDerWaalsContact C-N 3.34Å; N333-L335 PolarHBondContact O-N 3.41Å; L335-Q337 VanDerWaalsContact C-N 3.33Å; L335-Q337 PolarHBondContact O-N 3.41Å; L335-R338 PolarHBondContact O-N 3.26Å; L335-L339 WeakPolarHBondContact O-CB 3.33Å; L335-L339 PolarHBondContact O-N 3.32Å |
| 336 | R | 91.8 | Very high | 90 | Very high | 161 Ų | 161 | 95.5 Ų | 95.5 | 61% | 0.608 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -59.5 | -44.2 | 175.2 | -74.9 | 175.8 | 176.8 | -171.4 | -0.9 | 111.3 | I332 N333 L339 L340 | I332-R336 HydrophobicContact CG2-CG 4.46Å; I332-R336 WeakPolarHBondContact O-CG 3.39Å; I332-R336 PolarHBondContact O-N 2.92Å; N333-R336 WeakPolarHBondContact O-CB 3.41Å; N333-R336 PolarHBondContact O-N 3.19Å; R336-L339 PolarHBondContact O-N 3.4Å; R336-L340 WeakPolarHBondContact O-CG 3.29Å; R336-L340 PolarHBondContact O-N 3.01Å |
| 337 | Q | 89.7 | Confident | 89.8 | Confident | 101 Ų | 101 | 97.3 Ų | 97.3 | 47% | 0.472 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.5 | -48.6 | 177.3 | -170.5 | 59.4 | 40.1 | 0 | 0 | 111.6 | N333 L335 L339 L340 D341 | N333-Q337 PolarHBondContact O-N 2.98Å; L335-Q337 VanDerWaalsContact C-N 3.33Å; L335-Q337 PolarHBondContact O-N 3.41Å; Q337-L339 VanDerWaalsContact C-N 3.26Å; Q337-L339 PolarHBondContact O-N 3.21Å; Q337-L340 WeakPolarHBondContact O-CB 3.42Å; Q337-L340 PolarHBondContact O-N 2.88Å; Q337-L340 VanDerWaalsContact O-N 3.08Å; Q337-D341 PolarHBondContact NE2-OD1 2.87Å; Q337-D341 VanDerWaalsContact O-CG 3.24Å; Q337-D341 PolarHBondContact O-N 3.14Å |
| 338 | R | 89 | Confident | 89.7 | Confident | 160 Ų | 160 | 97 Ų | 97 | 60% | 0.604 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -58.4 | -37.6 | 176.2 | -76.7 | -174.6 | -73.8 | -177.8 | -6.3 | 112.9 | G334 L335 S342 | G334-R338 WeakPolarHBondContact O-CG 3.4Å; G334-R338 PolarHBondContact O-N 2.88Å; G334-R338 VanDerWaalsContact O-N 3.1Å; G334-R338 PolarHBondContact O-NE 3.41Å; L335-R338 PolarHBondContact O-N 3.26Å; R338-S342 WeakPolarHBondContact O-CB 3.47Å; R338-S342 PolarHBondContact O-N 2.84Å |
| 339 | L | 89.1 | Confident | 89.6 | Confident | 116 Ų | 116 | 98.8 Ų | 98.8 | 61% | 0.607 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -66 | -42.5 | 176.1 | -177.4 | 64.8 | 0 | 0 | 0 | 111.6 | L335 R336 Q337 S342 G343 | L335-L339 WeakPolarHBondContact O-CB 3.33Å; L335-L339 PolarHBondContact O-N 3.32Å; R336-L339 PolarHBondContact O-N 3.4Å; Q337-L339 VanDerWaalsContact C-N 3.26Å; Q337-L339 PolarHBondContact O-N 3.21Å; L339-S342 PolarHBondContact O-N 3.45Å; L339-G343 PolarHBondContact O-N 2.9Å |
| 340 | L | 91.8 | Very high | 89.6 | Confident | 101 Ų | 101 | 101.1 Ų | 101.1 | 53% | 0.529 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.4 | -48.5 | 174.8 | -73.7 | 169.3 | 0 | 0 | 0 | 111.2 | R336 Q337 S342 G343 Q344 | R336-L340 WeakPolarHBondContact O-CG 3.29Å; R336-L340 PolarHBondContact O-N 3.01Å; Q337-L340 WeakPolarHBondContact O-CB 3.42Å; Q337-L340 PolarHBondContact O-N 2.88Å; Q337-L340 VanDerWaalsContact O-N 3.08Å; L340-S342 PolarHBondContact O-N 2.87Å; L340-G343 CarbonylContact O-C 3.48Å; L340-G343 WeakPolarHBondContact O-CA 3.42Å; L340-G343 PolarHBondContact O-N 3.2Å; L340-G343 VanDerWaalsContact O-N 3.11Å; L340-Q344 WeakPolarHBondContact O-CG 3.28Å; L340-Q344 PolarHBondContact O-N 2.86Å |
| 341 | D | 91.6 | Very high | 89.6 | Confident | 62 Ų | 62 | 98.9 Ų | 98.9 | 33% | 0.332 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 178.5 | -61.3 | -17.3 | 0 | 0 | 0 | 111 | Q337 G343 Q344 I345 | Q337-D341 PolarHBondContact NE2-OD1 2.87Å; Q337-D341 VanDerWaalsContact O-CG 3.24Å; Q337-D341 PolarHBondContact O-N 3.14Å; D341-G343 VanDerWaalsContact C-N 3.29Å; D341-G343 PolarHBondContact O-N 3.3Å; D341-Q344 WeakPolarHBondContact O-CB 3.32Å; D341-Q344 PolarHBondContact O-N 3.28Å; D341-Q344 VanDerWaalsContact O-N 3.12Å; D341-I345 WeakPolarHBondContact O-CG1 3.48Å; D341-I345 PolarHBondContact O-N 3.44Å |
| 342 | S | 87.4 | Confident | 89.4 | Confident | 43 Ų | 43 | 99.1 Ų | 99.1 | 30% | 0.301 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.5 | -39.9 | 174.1 | -178.7 | 0 | 0 | 0 | 0 | 112 | R338 L339 L340 I345 R346 | R338-S342 WeakPolarHBondContact O-CB 3.47Å; R338-S342 PolarHBondContact O-N 2.84Å; L339-S342 PolarHBondContact O-N 3.45Å; L340-S342 PolarHBondContact O-N 2.87Å; S342-I345 PolarHBondContact O-N 3.29Å; S342-R346 PolarHBondContact O-N 3.42Å; S342-R346 PolarHBondContact OG-NH1 3.33Å |
| 343 | G | 89.4 | Confident | 89.4 | Confident | 17 Ų | 17 | 100.7 Ų | 100.7 | 18% | 0.175 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -66 | -35.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | L339 L340 D341 R347 | L339-G343 PolarHBondContact O-N 2.9Å; L340-G343 CarbonylContact O-C 3.48Å; L340-G343 WeakPolarHBondContact O-CA 3.42Å; L340-G343 PolarHBondContact O-N 3.2Å; L340-G343 VanDerWaalsContact O-N 3.11Å; D341-G343 VanDerWaalsContact C-N 3.29Å; D341-G343 PolarHBondContact O-N 3.3Å; G343-R347 PolarHBondContact O-N 2.88Å; G343-R347 VanDerWaalsContact O-N 3.11Å |
| 344 | Q | 90.9 | Very high | 89.3 | Confident | 105 Ų | 105 | 103.2 Ų | 103.2 | 49% | 0.491 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.7 | -43.5 | 173.8 | -70.7 | -179.5 | -1.8 | 0 | 0 | 111.6 | L340 D341 R347 K348 | L340-Q344 WeakPolarHBondContact O-CG 3.28Å; L340-Q344 PolarHBondContact O-N 2.86Å; D341-Q344 WeakPolarHBondContact O-CB 3.32Å; D341-Q344 PolarHBondContact O-N 3.28Å; D341-Q344 VanDerWaalsContact O-N 3.12Å; Q344-R347 PolarHBondContact O-N 2.58Å; Q344-K348 PolarHBondContact O-N 3.05Å |
| 345 | I | 88.1 | Confident | 89.2 | Confident | 100 Ų | 100 | 107.7 Ų | 107.7 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.3 | -45.6 | 175.8 | -66.6 | 165.8 | 0 | 0 | 0 | 110.5 | D341 S342 R347 K348 L349 | D341-I345 WeakPolarHBondContact O-CG1 3.48Å; D341-I345 PolarHBondContact O-N 3.44Å; S342-I345 PolarHBondContact O-N 3.29Å; I345-R347 VanDerWaalsContact C-N 3.31Å; I345-R347 PolarHBondContact O-N 3.12Å; I345-K348 PolarHBondContact O-N 3Å; I345-K348 VanDerWaalsContact O-N 3.14Å; I345-L349 HydrophobicContact CG2-CD1 3.98Å; I345-L349 HydrophobicContact CG2-CG 4.46Å; I345-L349 PolarHBondContact O-N 3.04Å |
| 346 | R | 87.9 | Confident | 88.9 | Confident | 136 Ų | 136 | 106.7 Ų | 106.7 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -56.5 | -44.3 | 174.7 | -83.7 | -168.6 | -70.1 | -87.8 | -5.8 | 112.1 | S342 L349 Q350 | S342-R346 PolarHBondContact O-N 3.42Å; S342-R346 PolarHBondContact OG-NH1 3.33Å; R346-L349 PolarHBondContact O-N 2.98Å; R346-Q350 VanDerWaalsContact O-CB 3.31Å; R346-Q350 WeakPolarHBondContact O-CB 3.43Å; R346-Q350 PolarHBondContact O-N 2.95Å |
| 347 | R | 87.4 | Confident | 88.7 | Confident | 156 Ų | 156 | 102.5 Ų | 102.5 | 59% | 0.589 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62.3 | -41.8 | 175.5 | -91.9 | -175.2 | -83.8 | 170.4 | -9.3 | 112.4 | G343 Q344 I345 Q350 N351 | G343-R347 PolarHBondContact O-N 2.88Å; G343-R347 VanDerWaalsContact O-N 3.11Å; Q344-R347 PolarHBondContact O-N 2.58Å; I345-R347 VanDerWaalsContact C-N 3.31Å; I345-R347 PolarHBondContact O-N 3.12Å; R347-Q350 PolarHBondContact O-N 3.36Å; R347-N351 VanDerWaalsContact O-CG 3.26Å; R347-N351 PolarHBondContact O-N 3.01Å; R347-N351 PolarHBondContact O-OD1 2.9Å |
| 348 | K | 89.1 | Confident | 88.5 | Confident | 114 Ų | 114 | 101.9 Ų | 101.9 | 50% | 0.496 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.2 | -50.3 | 175.5 | -73.8 | -177 | 178.5 | -178.7 | 0 | 111.8 | Q344 I345 Q350 N351 E352 | Q344-K348 PolarHBondContact O-N 3.05Å; I345-K348 PolarHBondContact O-N 3Å; I345-K348 VanDerWaalsContact O-N 3.14Å; K348-Q350 VanDerWaalsContact C-N 3.29Å; K348-Q350 PolarHBondContact O-N 3.28Å; K348-N351 WeakPolarHBondContact O-CB 3.44Å; K348-N351 PolarHBondContact O-N 3.38Å; K348-N351 VanDerWaalsContact O-N 3.13Å; K348-E352 WeakPolarHBondContact O-CG 3.44Å; K348-E352 PolarHBondContact O-N 2.7Å |
| 349 | L | 87.2 | Confident | 88.3 | Confident | 100 Ų | 100 | 100.6 Ų | 100.6 | 52% | 0.524 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.7 | -39.7 | 176.9 | -75.2 | 168 | 0 | 0 | 0 | 112.2 | I345 R346 E352 L353 | I345-L349 HydrophobicContact CG2-CD1 3.98Å; I345-L349 HydrophobicContact CG2-CG 4.46Å; I345-L349 PolarHBondContact O-N 3.04Å; R346-L349 PolarHBondContact O-N 2.98Å; L349-E352 PolarHBondContact O-N 3.32Å; L349-L353 WeakPolarHBondContact O-CB 3.36Å; L349-L353 PolarHBondContact O-N 3.07Å |
| 350 | Q | 90.4 | Very high | 88.1 | Confident | 113 Ų | 113 | 99.8 Ų | 99.8 | 53% | 0.528 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.2 | -40.8 | 176.5 | -173.5 | 175.8 | 8.5 | 0 | 0 | 111.8 | R346 R347 K348 L353 W354 | R346-Q350 VanDerWaalsContact O-CB 3.31Å; R346-Q350 WeakPolarHBondContact O-CB 3.43Å; R346-Q350 PolarHBondContact O-N 2.95Å; R347-Q350 PolarHBondContact O-N 3.36Å; K348-Q350 VanDerWaalsContact C-N 3.29Å; K348-Q350 PolarHBondContact O-N 3.28Å; Q350-L353 PolarHBondContact O-N 3.3Å; Q350-W354 PolarHBondContact O-N 3.08Å |
| 351 | N | 89.1 | Confident | 87.7 | Confident | 98 Ų | 98 | 98.2 Ų | 98.2 | 52% | 0.524 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.4 | -42 | 175.5 | -69 | -7.5 | 0 | 0 | 0 | 111.7 | R347 K348 L353 W354 H355 | R347-N351 VanDerWaalsContact O-CG 3.26Å; R347-N351 PolarHBondContact O-N 3.01Å; R347-N351 PolarHBondContact O-OD1 2.9Å; K348-N351 WeakPolarHBondContact O-CB 3.44Å; K348-N351 PolarHBondContact O-N 3.38Å; K348-N351 VanDerWaalsContact O-N 3.13Å; N351-L353 VanDerWaalsContact C-N 3.34Å; N351-W354 PolarHBondContact O-N 2.92Å; N351-H355 PolarHBondContact O-N 3.43Å |
| 352 | E | 86.8 | Confident | 87.2 | Confident | 112 Ų | 112 | 97.9 Ų | 97.9 | 52% | 0.523 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 175.5 | -73.3 | 170.5 | -170.3 | 0 | 0 | 112.1 | K348 L349 H355 S356 | K348-E352 WeakPolarHBondContact O-CG 3.44Å; K348-E352 PolarHBondContact O-N 2.7Å; L349-E352 PolarHBondContact O-N 3.32Å; E352-H355 PolarHBondContact O-N 3.29Å; E352-S356 PolarHBondContact O-N 3.47Å; E352-S356 PolarHBondContact O-OG 3.37Å |
| 353 | L | 88.9 | Confident | 86.9 | Confident | 109 Ų | 109 | 100 Ų | 100 | 57% | 0.571 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.2 | -45.2 | 174.2 | -175.9 | 67.4 | 0 | 0 | 0 | 111 | L349 Q350 N351 S356 I357 | L349-L353 WeakPolarHBondContact O-CB 3.36Å; L349-L353 PolarHBondContact O-N 3.07Å; Q350-L353 PolarHBondContact O-N 3.3Å; N351-L353 VanDerWaalsContact C-N 3.34Å; L353-S356 PolarHBondContact O-N 2.92Å; L353-I357 HydrophobicContact CG-CD1 4.05Å; L353-I357 VanDerWaalsContact O-CG1 3.29Å; L353-I357 WeakPolarHBondContact O-CG1 3.46Å; L353-I357 PolarHBondContact O-N 3.48Å |
| 354 | W | 89.2 | Confident | 86.4 | Confident | 140 Ų | 140 | 101.8 Ų | 101.8 | 53% | 0.53 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -58.8 | -46.6 | 174.9 | -92.5 | 115.4 | 0 | 0 | 0 | 112 | Q350 N351 S356 I357 D358 | Q350-W354 PolarHBondContact O-N 3.08Å; N351-W354 PolarHBondContact O-N 2.92Å; W354-S356 VanDerWaalsContact C-N 3.32Å; W354-S356 PolarHBondContact O-N 2.9Å; W354-I357 PolarHBondContact O-N 3.05Å; W354-D358 VanDerWaalsContact O-CG 3.29Å; W354-D358 PolarHBondContact O-N 3.31Å |
| 355 | H | 87.7 | Confident | 85.9 | Confident | 128 Ų | 128 | 103 Ų | 103 | 59% | 0.593 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.7 | -41 | 174.6 | -77.7 | -14 | 0 | 0 | 0 | 112.7 | N351 E352 I357 D358 E359 | N351-H355 PolarHBondContact O-N 3.43Å; E352-H355 PolarHBondContact O-N 3.29Å; H355-I357 VanDerWaalsContact C-N 3.34Å; H355-I357 PolarHBondContact O-N 3.23Å; H355-D358 PolarHBondContact O-N 3.03Å; H355-E359 WeakPolarHBondContact O-CB 3.39Å; H355-E359 WeakPolarHBondContact O-CG 3.2Å; H355-E359 PolarHBondContact O-N 2.66Å |
| 356 | S | 84.9 | Confident | 85.4 | Confident | 69 Ų | 69 | 102.4 Ų | 102.4 | 48% | 0.483 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.4 | -36.6 | 177 | -60 | 0 | 0 | 0 | 0 | 112.1 | E352 L353 W354 N360 | E352-S356 PolarHBondContact O-N 3.47Å; E352-S356 PolarHBondContact O-OG 3.37Å; L353-S356 PolarHBondContact O-N 2.92Å; W354-S356 VanDerWaalsContact C-N 3.32Å; W354-S356 PolarHBondContact O-N 2.9Å; S356-N360 WeakPolarHBondContact O-CB 3.47Å; S356-N360 PolarHBondContact O-N 2.93Å |
| 357 | I | 87.2 | Confident | 84.9 | Confident | 73 Ų | 73 | 99.8 Ų | 99.8 | 37% | 0.374 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.2 | -47 | 174.1 | -70.1 | 166.1 | 0 | 0 | 0 | 109.8 | L353 W354 H355 N360 T361 | L353-I357 HydrophobicContact CG-CD1 4.05Å; L353-I357 VanDerWaalsContact O-CG1 3.29Å; L353-I357 WeakPolarHBondContact O-CG1 3.46Å; L353-I357 PolarHBondContact O-N 3.48Å; W354-I357 PolarHBondContact O-N 3.05Å; H355-I357 VanDerWaalsContact C-N 3.34Å; H355-I357 PolarHBondContact O-N 3.23Å; I357-N360 PolarHBondContact O-N 3.3Å; I357-T361 WeakPolarHBondContact O-CB 3.24Å; I357-T361 PolarHBondContact O-N 2.7Å; I357-T361 PolarHBondContact O-OG1 3.06Å |
| 358 | D | 85.2 | Confident | 84.4 | Confident | 88 Ų | 88 | 95.8 Ų | 95.8 | 47% | 0.471 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.3 | -45.3 | 178.5 | -67.7 | -21.5 | 0 | 0 | 0 | 111.3 | W354 H355 T361 S362 | W354-D358 VanDerWaalsContact O-CG 3.29Å; W354-D358 PolarHBondContact O-N 3.31Å; H355-D358 PolarHBondContact O-N 3.03Å; D358-T361 PolarHBondContact O-N 3.46Å; D358-S362 WeakPolarHBondContact O-CB 3.41Å; D358-S362 PolarHBondContact O-N 3.1Å |
| 359 | E | 85.2 | Confident | 83.8 | Confident | 132 Ų | 132 | 95.2 Ų | 95.2 | 62% | 0.617 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61 | -45.6 | 174.4 | -79.4 | -174.3 | 168.7 | 0 | 0 | 112 | H355 T361 S362 L363 | H355-E359 WeakPolarHBondContact O-CB 3.39Å; H355-E359 WeakPolarHBondContact O-CG 3.2Å; H355-E359 PolarHBondContact O-N 2.66Å; E359-T361 VanDerWaalsContact C-N 3.29Å; E359-T361 PolarHBondContact O-N 3.19Å; E359-S362 PolarHBondContact O-N 2.97Å; E359-L363 WeakPolarHBondContact O-CB 3.4Å; E359-L363 WeakPolarHBondContact O-CG 3.46Å; E359-L363 PolarHBondContact O-N 2.88Å |
| 360 | N | 84 | Confident | 83.1 | Confident | 100 Ų | 100 | 95.1 Ų | 95.1 | 54% | 0.535 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66 | -34.2 | 178.6 | -169.5 | 29.6 | 0 | 0 | 0 | 111.9 | S356 I357 S364 | S356-N360 WeakPolarHBondContact O-CB 3.47Å; S356-N360 PolarHBondContact O-N 2.93Å; I357-N360 PolarHBondContact O-N 3.3Å; N360-S364 WeakPolarHBondContact O-CB 3.44Å; N360-S364 PolarHBondContact O-N 3.41Å; N360-S364 PolarHBondContact O-OG 3.15Å |
| 361 | T | 83.9 | Confident | 82.4 | Confident | 68 Ų | 68 | 98 Ų | 98 | 42% | 0.417 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.4 | -47.1 | 174.9 | -49.2 | 0 | 0 | 0 | 0 | 110 | I357 D358 E359 L363 S364 E365 | I357-T361 WeakPolarHBondContact O-CB 3.24Å; I357-T361 PolarHBondContact O-N 2.7Å; I357-T361 PolarHBondContact O-OG1 3.06Å; D358-T361 PolarHBondContact O-N 3.46Å; E359-T361 VanDerWaalsContact C-N 3.29Å; E359-T361 PolarHBondContact O-N 3.19Å; T361-L363 PolarHBondContact O-N 3.21Å; T361-S364 PolarHBondContact O-N 2.97Å; T361-E365 WeakPolarHBondContact O-CG 3.29Å; T361-E365 PolarHBondContact O-N 2.72Å |
| 362 | S | 80.9 | Confident | 81.5 | Confident | 54 Ų | 54 | 98.9 Ų | 98.9 | 38% | 0.378 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.4 | -44.2 | 174.2 | 176.8 | 0 | 0 | 0 | 0 | 112.6 | D358 E359 E365 Q366 | D358-S362 WeakPolarHBondContact O-CB 3.41Å; D358-S362 PolarHBondContact O-N 3.1Å; E359-S362 PolarHBondContact O-N 2.97Å; S362-E365 PolarHBondContact O-N 3.35Å; S362-Q366 WeakPolarHBondContact O-CG 3.5Å; S362-Q366 PolarHBondContact O-N 3.47Å; S362-Q366 PolarHBondContact OG-NE2 3.26Å |
| 363 | L | 80.7 | Confident | 80.6 | Confident | 89 Ų | 89 | 98.2 Ų | 98.2 | 47% | 0.466 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.2 | -38.7 | 175.1 | -74.5 | 170.7 | 0 | 0 | 0 | 111.9 | E359 T361 E365 Q366 I367 | E359-L363 WeakPolarHBondContact O-CB 3.4Å; E359-L363 WeakPolarHBondContact O-CG 3.46Å; E359-L363 PolarHBondContact O-N 2.88Å; T361-L363 PolarHBondContact O-N 3.21Å; L363-E365 VanDerWaalsContact C-N 3.35Å; L363-Q366 PolarHBondContact O-N 2.98Å; L363-I367 WeakPolarHBondContact O-CB 3.33Å; L363-I367 VanDerWaalsContact O-CG1 3.24Å; L363-I367 WeakPolarHBondContact O-CG1 3.45Å; L363-I367 PolarHBondContact O-N 3Å |
| 364 | S | 79 | Confident | 79.2 | Confident | 54 Ų | 54 | 97.8 Ų | 97.8 | 38% | 0.378 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.5 | -38.3 | 176 | -66.9 | 0 | 0 | 0 | 0 | 111.9 | N360 T361 S368 | N360-S364 WeakPolarHBondContact O-CB 3.44Å; N360-S364 PolarHBondContact O-N 3.41Å; N360-S364 PolarHBondContact O-OG 3.15Å; T361-S364 PolarHBondContact O-N 2.97Å; S364-S368 WeakPolarHBondContact O-CB 3.39Å; S364-S368 PolarHBondContact O-N 3.11Å; S364-S368 PolarHBondContact O-OG 3.04Å |
| 365 | E | 80.3 | Confident | 77.9 | Confident | 130 Ų | 130 | 95.4 Ų | 95.4 | 61% | 0.607 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.5 | -47.3 | 170.8 | -75.4 | 178 | 177.5 | 0 | 0 | 111.1 | T361 S362 L363 I367 S368 E369 | T361-E365 WeakPolarHBondContact O-CG 3.29Å; T361-E365 PolarHBondContact O-N 2.72Å; S362-E365 PolarHBondContact O-N 3.35Å; L363-E365 VanDerWaalsContact C-N 3.35Å; E365-I367 VanDerWaalsContact C-N 3.35Å; E365-I367 PolarHBondContact O-N 2.92Å; E365-S368 CarbonylContact O-C 3.6Å; E365-S368 WeakPolarHBondContact O-CB 3.33Å; E365-S368 PolarHBondContact O-N 3.39Å; E365-S368 VanDerWaalsContact O-N 3.1Å; E365-E369 PolarHBondContact O-N 2.91Å |
| 366 | Q | 78 | Confident | 76.5 | Confident | 87 Ų | 87 | 93.9 Ų | 93.9 | 41% | 0.407 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.3 | -41.5 | 175.7 | -73.8 | 174.9 | 36 | 0 | 0 | 112.6 | S362 L363 S368 E369 L370 | S362-Q366 WeakPolarHBondContact O-CG 3.5Å; S362-Q366 PolarHBondContact O-N 3.47Å; S362-Q366 PolarHBondContact OG-NE2 3.26Å; L363-Q366 PolarHBondContact O-N 2.98Å; Q366-S368 VanDerWaalsContact C-N 3.31Å; Q366-S368 PolarHBondContact O-N 3.09Å; Q366-E369 PolarHBondContact O-N 3.49Å; Q366-L370 WeakPolarHBondContact O-CB 3.45Å; Q366-L370 VanDerWaalsContact O-CG 3.29Å; Q366-L370 WeakPolarHBondContact O-CG 3.27Å; Q366-L370 PolarHBondContact O-N 2.94Å |
| 367 | I | 77.6 | Confident | 74.9 | Confident | 81 Ų | 81 | 97.6 Ų | 97.6 | 42% | 0.415 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.1 | -39.7 | 175.2 | -72.8 | 167 | 0 | 0 | 0 | 110.2 | L363 E365 L370 R371 | L363-I367 WeakPolarHBondContact O-CB 3.33Å; L363-I367 VanDerWaalsContact O-CG1 3.24Å; L363-I367 WeakPolarHBondContact O-CG1 3.45Å; L363-I367 PolarHBondContact O-N 3Å; E365-I367 VanDerWaalsContact C-N 3.35Å; E365-I367 PolarHBondContact O-N 2.92Å; I367-L370 PolarHBondContact O-N 3.21Å; I367-R371 HydrophobicContact CG2-CG 4.41Å; I367-R371 VanDerWaalsContact O-CB 3.3Å; I367-R371 WeakPolarHBondContact O-CB 3.36Å; I367-R371 WeakPolarHBondContact O-CG 3.41Å; I367-R371 PolarHBondContact O-N 3.46Å |
| 368 | S | 77.2 | Confident | 73.2 | Confident | 72 Ų | 72 | 104.5 Ų | 104.5 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.3 | -42.1 | 176.8 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | S364 E365 Q366 R371 K372 | S364-S368 WeakPolarHBondContact O-CB 3.39Å; S364-S368 PolarHBondContact O-N 3.11Å; S364-S368 PolarHBondContact O-OG 3.04Å; E365-S368 CarbonylContact O-C 3.6Å; E365-S368 WeakPolarHBondContact O-CB 3.33Å; E365-S368 PolarHBondContact O-N 3.39Å; E365-S368 VanDerWaalsContact O-N 3.1Å; Q366-S368 VanDerWaalsContact C-N 3.31Å; Q366-S368 PolarHBondContact O-N 3.09Å; S368-R371 PolarHBondContact O-N 3.47Å; S368-K372 WeakPolarHBondContact O-CB 3.44Å; S368-K372 PolarHBondContact O-N 3.36Å |
| 369 | E | 76.4 | Confident | 71.4 | Confident | 102 Ų | 102 | 104.3 Ų | 104.3 | 48% | 0.477 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.8 | -45.7 | 175.2 | -162.3 | 65.7 | -151.2 | 0 | 0 | 111.5 | E365 Q366 R371 K372 Q373 | E365-E369 PolarHBondContact O-N 2.91Å; Q366-E369 PolarHBondContact O-N 3.49Å; E369-R371 VanDerWaalsContact C-N 3.33Å; E369-R371 PolarHBondContact O-N 3.14Å; E369-K372 WeakPolarHBondContact O-CA 3.38Å; E369-K372 VanDerWaalsContact O-CB 3.32Å; E369-K372 WeakPolarHBondContact O-CB 3.41Å; E369-K372 PolarHBondContact O-N 2.94Å; E369-K372 VanDerWaalsContact O-N 3.14Å; E369-Q373 WeakPolarHBondContact O-CG 3.34Å; E369-Q373 PolarHBondContact O-N 3.37Å |
| 370 | L | 73.5 | Confident | 69.1 | Low | 98 Ų | 98 | 106.7 Ų | 106.7 | 51% | 0.513 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.7 | -39.3 | 175.6 | -77.6 | 169.3 | 0 | 0 | 0 | 111.8 | Q366 I367 K372 Q373 L374 | Q366-L370 WeakPolarHBondContact O-CB 3.45Å; Q366-L370 VanDerWaalsContact O-CG 3.29Å; Q366-L370 WeakPolarHBondContact O-CG 3.27Å; Q366-L370 PolarHBondContact O-N 2.94Å; I367-L370 PolarHBondContact O-N 3.21Å; L370-K372 VanDerWaalsContact C-N 3.31Å; L370-Q373 PolarHBondContact O-N 2.96Å; L370-L374 WeakPolarHBondContact O-CB 3.46Å; L370-L374 PolarHBondContact O-N 3.09Å |
| 371 | R | 74.2 | Confident | 66.8 | Low | 173 Ų | 173 | 111 Ų | 111 | 65% | 0.653 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -64 | -37.8 | 174.1 | -79.3 | 175.7 | 178.2 | 176.1 | 1.9 | 111.5 | I367 S368 E369 L374 T375 | I367-R371 HydrophobicContact CG2-CG 4.41Å; I367-R371 VanDerWaalsContact O-CB 3.3Å; I367-R371 WeakPolarHBondContact O-CB 3.36Å; I367-R371 WeakPolarHBondContact O-CG 3.41Å; I367-R371 PolarHBondContact O-N 3.46Å; S368-R371 PolarHBondContact O-N 3.47Å; E369-R371 VanDerWaalsContact C-N 3.33Å; E369-R371 PolarHBondContact O-N 3.14Å; R371-L374 PolarHBondContact O-N 2.94Å; R371-T375 PolarHBondContact O-N 3.35Å; R371-T375 PolarHBondContact O-OG1 2.92Å |
| 372 | K | 70.6 | Confident | 64.3 | Low | 117 Ų | 117 | 114.2 Ų | 114.2 | 51% | 0.509 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64 | -48.5 | 173.6 | -166.1 | -179 | 175.6 | -169.4 | 0 | 111.1 | S368 E369 L370 L374 T375 D376 | S368-K372 WeakPolarHBondContact O-CB 3.44Å; S368-K372 PolarHBondContact O-N 3.36Å; E369-K372 WeakPolarHBondContact O-CA 3.38Å; E369-K372 VanDerWaalsContact O-CB 3.32Å; E369-K372 WeakPolarHBondContact O-CB 3.41Å; E369-K372 PolarHBondContact O-N 2.94Å; E369-K372 VanDerWaalsContact O-N 3.14Å; L370-K372 VanDerWaalsContact C-N 3.31Å; K372-L374 VanDerWaalsContact C-N 3.3Å; K372-L374 PolarHBondContact O-N 3.4Å; K372-T375 VanDerWaalsContact CA-OG1 3.3Å; K372-T375 WeakPolarHBondContact CA-OG1 3.32Å; K372-T375 PolarHBondContact O-N 2.94Å; K372-T375 PolarHBondContact O-OG1 3.49Å; K372-D376 VanDerWaalsContact O-CG 3.3Å; K372-D376 PolarHBondContact O-N 2.94Å |
| 373 | Q | 67.4 | Low | 62 | Low | 99 Ų | 99 | 115.9 Ų | 115.9 | 46% | 0.463 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -59.2 | -38.8 | 174.2 | -69.4 | 176.8 | 7.8 | 0 | 0 | 112.8 | E369 L370 T375 D376 L377 | E369-Q373 WeakPolarHBondContact O-CG 3.34Å; E369-Q373 PolarHBondContact O-N 3.37Å; L370-Q373 PolarHBondContact O-N 2.96Å; Q373-T375 VanDerWaalsContact C-N 3.34Å; Q373-D376 PolarHBondContact O-N 3.41Å; Q373-L377 WeakPolarHBondContact O-CB 3.43Å; Q373-L377 PolarHBondContact O-N 3.33Å |
| 374 | L | 59.6 | Low | 59.8 | Low | 100 Ų | 100 | 117.9 Ų | 117.9 | 52% | 0.524 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -67.9 | -31.7 | 175.6 | -113.3 | 156.6 | 0 | 0 | 0 | 113.2 | L370 R371 K372 R378 | L370-L374 WeakPolarHBondContact O-CB 3.46Å; L370-L374 PolarHBondContact O-N 3.09Å; R371-L374 PolarHBondContact O-N 2.94Å; K372-L374 VanDerWaalsContact C-N 3.3Å; K372-L374 PolarHBondContact O-N 3.4Å; L374-R378 PolarHBondContact O-N 3.33Å |
| 375 | T | 62.6 | Low | 57.8 | Low | 89 Ų | 89 | 123.2 Ų | 123.2 | 55% | 0.546 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -75.7 | -39.3 | 175 | 21.7 | 0 | 0 | 0 | 0 | 111 | R371 K372 Q373 R378 | R371-T375 PolarHBondContact O-N 3.35Å; R371-T375 PolarHBondContact O-OG1 2.92Å; K372-T375 VanDerWaalsContact CA-OG1 3.3Å; K372-T375 WeakPolarHBondContact CA-OG1 3.32Å; K372-T375 PolarHBondContact O-N 2.94Å; K372-T375 PolarHBondContact O-OG1 3.49Å; Q373-T375 VanDerWaalsContact C-N 3.34Å; T375-R378 PolarHBondContact O-N 3.23Å |
| 376 | D | 57.4 | Low | 55.6 | Low | 97 Ų | 97 | 125.2 Ų | 125.2 | 52% | 0.519 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -62.6 | -46 | 174.1 | -65.4 | -20.6 | 0 | 0 | 0 | 111.1 | K372 Q373 R378 S379 | K372-D376 VanDerWaalsContact O-CG 3.3Å; K372-D376 PolarHBondContact O-N 2.94Å; Q373-D376 PolarHBondContact O-N 3.41Å; D376-R378 PolarHBondContact O-N 3.46Å; D376-S379 PolarHBondContact O-N 2.95Å; D376-S379 VanDerWaalsContact O-N 3.1Å; D376-S379 PolarHBondContact O-OG 3.04Å |
| 377 | L | 52.6 | Low | 53.4 | Low | 146 Ų | 146 | 130.5 Ų | 130.5 | 76% | 0.764 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -61.7 | -25 | 175.7 | -89.7 | 159.1 | 0 | 0 | 0 | 114.5 | Q373 S379 | Q373-L377 WeakPolarHBondContact O-CB 3.43Å; Q373-L377 PolarHBondContact O-N 3.33Å; L377-S379 VanDerWaalsContact C-N 3.32Å |
| 378 | R | 51.6 | Low | 51.3 | Low | 219 Ų | 219 | 130.6 Ų | 130.6 | 83% | 0.826 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -5.7 | 177.8 | -89.9 | -179.3 | 173.7 | 173 | -0.6 | 113.4 | L374 T375 D376 | L374-R378 PolarHBondContact O-N 3.33Å; T375-R378 PolarHBondContact O-N 3.23Å; D376-R378 PolarHBondContact O-N 3.46Å |
| 379 | S | 46 | Very low | 49.3 | Very low | 84 Ų | 84 | 134.1 Ų | 134.1 | 59% | 0.587 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.8 | -17.3 | -166.9 | 68.6 | 0 | 0 | 0 | 0 | 117.2 | D376 L377 | D376-S379 PolarHBondContact O-N 2.95Å; D376-S379 VanDerWaalsContact O-N 3.1Å; D376-S379 PolarHBondContact O-OG 3.04Å; L377-S379 VanDerWaalsContact C-N 3.32Å |
| 380 | E | 37.3 | Very low | 47.5 | Very low | 182 Ų | 182 | 136 Ų | 136 | 85% | 0.85 | 70% | 0.695 | S | S | * | * | trans | -159.5 | 160.4 | 178.3 | -127.7 | 167.5 | -179.8 | 0 | 0 | 117.1 | ||||
| 381 | K | 35.2 | Very low | 45.6 | Very low | 190 Ų | 190 | 137.8 Ų | 137.8 | 83% | 0.826 | 71% | 0.71 | S | S | * | * | trans | -74.9 | 145.1 | -161.2 | -78.8 | 172.6 | 175.6 | 173.1 | 0 | 116 | ||||
| 382 | V | 31.4 | Very low | 43.6 | Very low | 136 Ų | 136 | 136.6 Ų | 136.6 | 82% | 0.824 | 71% | 0.712 | S | S | * | * | trans | 77.8 | 130.4 | 137.7 | 173 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 383 | S | 33.1 | Very low | 41.9 | Very low | 89 Ų | 89 | 137.7 Ų | 137.7 | 62% | 0.622 | 72% | 0.722 | S | S | * | * | trans | 89 | 111 | 150 | -174.5 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 384 | D | 34.6 | Very low | 40.4 | Very low | 131 Ų | 131 | 140 Ų | 140 | 70% | 0.701 | 73% | 0.731 | S | S | * | * | trans | 45.9 | 97.1 | 131.8 | -47.6 | -45 | 0 | 0 | 0 | 116.9 | ||||
| 385 | N | 38.3 | Very low | 39.2 | Very low | 166 Ų | 166 | 142.1 Ų | 142.1 | 89% | 0.888 | 74% | 0.741 | S | S | * | * | -170 | 68.3 | 129.6 | -87.7 | -38.1 | 0 | 0 | 0 | 110 | K387 | N385-K387 VanDerWaalsContact C-N 3.34Å; N385-K387 PolarHBondContact O-N 3.18Å | |||
| 386 | L | 32.3 | Very low | 38 | Very low | 172 Ų | 172 | 146.3 Ų | 146.3 | 90% | 0.901 | 75% | 0.752 | S | S | * | * | trans | -75.4 | 89 | 154.4 | -85.2 | 159.5 | 0 | 0 | 0 | 107.7 | ||||
| 387 | K | 32.6 | Very low | 36.8 | Very low | 198 Ų | 198 | 150.3 Ų | 150.3 | 86% | 0.861 | 77% | 0.767 | S | S | * | * | trans | -179.7 | 133.2 | 153 | -100.6 | 156.1 | -171 | -176 | 0 | 110.5 | N385 | N385-K387 VanDerWaalsContact C-N 3.34Å; N385-K387 PolarHBondContact O-N 3.18Å | ||
| 388 | A | 32.9 | Very low | 35.9 | Very low | 83 Ų | 83 | 148.4 Ų | 148.4 | 69% | 0.686 | 77% | 0.766 | S | S | * | * | trans | 73 | 96.9 | 164.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 389 | N | 36.1 | Very low | 35.1 | Very low | 145 Ų | 145 | 143.6 Ų | 143.6 | 78% | 0.775 | 77% | 0.766 | S | S | * | * | -179.7 | 117.1 | 95.8 | -87.2 | -30.5 | 0 | 0 | 0 | 111.3 | |||||
| 390 | N | 37.8 | Very low | 34.8 | Very low | 142 Ų | 142 | 145.4 Ų | 145.4 | 76% | 0.759 | 78% | 0.776 | S | S | * | * | trans | 5.9 | 113.7 | 144.1 | -59.4 | -25.6 | 0 | 0 | 0 | 114.3 | ||||
| 391 | V | 33.9 | Very low | 34.7 | Very low | 136 Ų | 136 | 142.1 Ų | 142.1 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | 35.6 | 73.2 | 65.7 | -166 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 392 | E | 32.3 | Very low | 34.6 | Very low | 148 Ų | 148 | 140.2 Ų | 140.2 | 69% | 0.692 | 77% | 0.771 | S | S | * | * | trans | -125.2 | 75.9 | 148.4 | -95.3 | -162.2 | -177.5 | 0 | 0 | 108.2 | K394 | E392-K394 PolarHBondContact O-N 2.81Å; E392-K394 VanDerWaalsContact O-N 3.07Å; E392-K394 IonicContact OE1-NZ 3.89Å; E392-K394 IonicContact OE2-NZ 2.74Å; E392-K394 PolarHBondContact OE2-NZ 3.5Å | ||
| 393 | L | 35.5 | Very low | 34.6 | Very low | 139 Ų | 139 | 139.5 Ų | 139.5 | 73% | 0.728 | 77% | 0.767 | S | S | * | * | trans | -75.2 | 86.7 | 155.9 | -85.8 | 162.1 | 0 | 0 | 0 | 106.8 | I395 | L393-I395 PolarHBondContact O-N 3.34Š| ||
| 394 | K | 36.4 | Very low | 34.7 | Very low | 149 Ų | 149 | 144.7 Ų | 144.7 | 65% | 0.648 | 78% | 0.782 | S | S | * | * | trans | -66 | 85.6 | 165.3 | -90.2 | -179.7 | 173.4 | 105.4 | 0 | 108.5 | E392 K396 | E392-K394 PolarHBondContact O-N 2.81Å; E392-K394 VanDerWaalsContact O-N 3.07Å; E392-K394 IonicContact OE1-NZ 3.89Å; E392-K394 IonicContact OE2-NZ 2.74Å; E392-K394 PolarHBondContact OE2-NZ 3.5Å; K394-K396 VanDerWaalsContact C-N 3.26Å; K394-K396 PolarHBondContact O-N 3.17Å | ||
| 395 | I | 33.7 | Very low | 34.7 | Very low | 144 Ų | 144 | 144.4 Ų | 144.4 | 74% | 0.738 | 79% | 0.79 | S | S | * | * | trans | -67.4 | 92.5 | 158.4 | -61 | 173.2 | 0 | 0 | 0 | 105.6 | L393 Q397 | L393-I395 PolarHBondContact O-N 3.34Å; I395-Q397 HydrophobicContact CG2-CG 4.27Å; I395-Q397 PolarHBondContact O-N 3.49Å | ||
| 396 | K | 37.1 | Very low | 34.7 | Very low | 177 Ų | 177 | 140.9 Ų | 140.9 | 77% | 0.77 | 78% | 0.784 | S | S | * | * | trans | -71.1 | 89.7 | 166.4 | -81.5 | -173.8 | 176.3 | -179.6 | 0 | 107.6 | K394 S398 | K394-K396 VanDerWaalsContact C-N 3.26Å; K394-K396 PolarHBondContact O-N 3.17Å; K396-S398 PolarHBondContact O-N 3.21Å | ||
| 397 | Q | 32.7 | Very low | 34.9 | Very low | 181 Ų | 181 | 142.4 Ų | 142.4 | 85% | 0.846 | 78% | 0.783 | S | S | * | * | trans | -59.9 | 110.2 | 154.2 | -73 | 180 | -21.8 | 0 | 0 | 107.8 | I395 | I395-Q397 HydrophobicContact CG2-CG 4.27Å; I395-Q397 PolarHBondContact O-N 3.49Å | ||
| 398 | S | 32.9 | Very low | 35.5 | Very low | 105 Ų | 105 | 140.5 Ų | 140.5 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | trans | -143.1 | 92.2 | 163.3 | 51 | 0 | 0 | 0 | 0 | 109.5 | K396 | K396-S398 PolarHBondContact O-N 3.21Š| ||
| 399 | S | 36.2 | Very low | 35.7 | Very low | 118 Ų | 118 | 144.1 Ų | 144.1 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | trans | -115.9 | 165.6 | 154.9 | -48.2 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 400 | P | 39.3 | Very low | 36.2 | Very low | 122 Ų | 122 | 144.8 Ų | 144.8 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | -126.4 | 147.6 | -70.5 | 32.8 | -17.3 | 0 | 0 | 0 | 110.6 | |||||
| 401 | S | 35.2 | Very low | 36.3 | Very low | 113 Ų | 113 | 146.8 Ų | 146.8 | 79% | 0.79 | 80% | 0.796 | S | S | * | * | trans | -127.6 | 95.4 | 168.1 | 59.5 | 0 | 0 | 0 | 0 | 110.6 | T403 | S401-T403 PolarHBondContact O-N 2.89Š| ||
| 402 | L | 33.4 | Very low | 36.5 | Very low | 150 Ų | 150 | 148.3 Ų | 148.3 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -80.2 | 96.2 | 164 | -82.4 | 162.7 | 0 | 0 | 0 | 108.4 | ||||
| 403 | T | 31.8 | Very low | 36.9 | Very low | 122 Ų | 122 | 152.8 Ų | 152.8 | 75% | 0.748 | 81% | 0.81 | S | S | * | * | trans | -151.6 | 97.6 | 159.8 | 40.5 | 0 | 0 | 0 | 0 | 107.3 | S401 | S401-T403 PolarHBondContact O-N 2.89Š| ||
| 404 | E | 33.8 | Very low | 37 | Very low | 197 Ų | 197 | 153.2 Ų | 153.2 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | trans | -158.7 | 119.5 | 138.5 | -126.1 | 169 | 174.4 | 0 | 0 | 112 | ||||
| 405 | S | 35.8 | Very low | 37.5 | Very low | 126 Ų | 126 | 151.9 Ų | 151.9 | 88% | 0.881 | 82% | 0.82 | S | S | * | * | trans | -72.3 | 121.2 | 171.5 | -40.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 406 | A | 37.4 | Very low | 37.6 | Very low | 92 Ų | 92 | 153 Ų | 153 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | trans | -127.5 | 106.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 407 | K | 36.5 | Very low | 37.5 | Very low | 203 Ų | 203 | 153.6 Ų | 153.6 | 88% | 0.883 | 83% | 0.825 | S | S | * | * | trans | -48.9 | 131.9 | 163.7 | -69.8 | 169.7 | 173.6 | 178.6 | 0 | 109.4 | ||||
| 408 | L | 45.9 | Very low | 37.8 | Very low | 158 Ų | 158 | 150.1 Ų | 150.1 | 83% | 0.827 | 82% | 0.82 | S | S | * | * | trans | -130.6 | 104.1 | 160.8 | -88.6 | 165.8 | 0 | 0 | 0 | 108 | ||||
| 409 | D | 36.2 | Very low | 37.9 | Very low | 159 Ų | 159 | 151.9 Ų | 151.9 | 85% | 0.85 | 82% | 0.822 | S | S | * | * | trans | -55.9 | 127.9 | 160 | -75.2 | -46.7 | 0 | 0 | 0 | 109 | ||||
| 410 | I | 47.3 | Very low | 37.9 | Very low | 160 Ų | 160 | 150.8 Ų | 150.8 | 82% | 0.821 | 81% | 0.814 | S | S | * | * | trans | -129.6 | 110.5 | 163.4 | -61.8 | -178.3 | 0 | 0 | 0 | 108 | ||||
| 411 | E | 40 | Very low | 37.9 | Very low | 183 Ų | 183 | 151.4 Ų | 151.4 | 86% | 0.855 | 81% | 0.811 | S | S | * | * | trans | -43.9 | 138.2 | 175.6 | -98.4 | 170.7 | 139.5 | 0 | 0 | 115.1 | R413 | E411-R413 PolarHBondContact O-N 3.24Š| ||
| 412 | N | 36.5 | Very low | 37.9 | Very low | 168 Ų | 168 | 155 Ų | 155 | 90% | 0.898 | 81% | 0.812 | S | S | * | * | trans | -55.7 | 122.1 | 160.1 | -78.2 | -46.7 | 0 | 0 | 0 | 110.9 | ||||
| 413 | R | 42.4 | Very low | 38.3 | Very low | 242 Ų | 242 | 154.6 Ų | 154.6 | 91% | 0.913 | 82% | 0.815 | S | S | * | * | trans | -134.5 | 109.6 | 159.4 | -116.3 | -175.5 | 178.3 | -174.2 | 1 | 110.9 | E411 | E411-R413 PolarHBondContact O-N 3.24Š| ||
| 414 | D | 36.6 | Very low | 38.5 | Very low | 149 Ų | 149 | 157.6 Ų | 157.6 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | trans | -63.8 | 138.1 | 172.6 | -153.1 | -0.7 | 0 | 0 | 0 | 111.1 | ||||
| 415 | P | 46 | Very low | 38.7 | Very low | 121 Ų | 121 | 158.4 Ų | 158.4 | 79% | 0.786 | 81% | 0.814 | S | S | * | * | trans | -120.4 | 92.7 | 163.2 | 32.6 | -17.3 | 0 | 0 | 0 | 111 | ||||
| 416 | Q | 36.8 | Very low | 38.9 | Very low | 167 Ų | 167 | 157.3 Ų | 157.3 | 78% | 0.78 | 81% | 0.805 | S | S | * | * | trans | -73.9 | 139.9 | 152.5 | -94.8 | -165.6 | -5.2 | 0 | 0 | 110.1 | ||||
| 417 | K | 35.7 | Very low | 38.9 | Very low | 189 Ų | 189 | 158.4 Ų | 158.4 | 82% | 0.822 | 80% | 0.803 | S | S | * | * | trans | 72.5 | 102.4 | 166.6 | -63.8 | 176.2 | 178.4 | 175.7 | 0 | 116.5 | ||||
| 418 | S | 37.2 | Very low | 39.1 | Very low | 108 Ų | 108 | 156 Ų | 156 | 76% | 0.755 | 80% | 0.799 | S | S | * | * | 176.1 | 156.1 | 118.9 | 42 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 419 | N | 36.8 | Very low | 38.9 | Very low | 143 Ų | 143 | 153.7 Ų | 153.7 | 77% | 0.765 | 79% | 0.794 | S | S | * | * | trans | 101.2 | 82.6 | 161 | -59.7 | -16.1 | 0 | 0 | 0 | 118.7 | ||||
| 420 | S | 34.5 | Very low | 39.1 | Very low | 94 Ų | 94 | 154.9 Ų | 154.9 | 66% | 0.657 | 80% | 0.799 | S | S | * | * | -20.8 | 125.5 | 120.7 | 53.5 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 421 | N | 39.3 | Very low | 38.9 | Very low | 136 Ų | 136 | 156.8 Ų | 156.8 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | 175.4 | 127.2 | 116.3 | -96.8 | -35.6 | 0 | 0 | 0 | 112.7 | |||||
| 422 | K | 36.9 | Very low | 38.5 | Very low | 189 Ų | 189 | 157 Ų | 157 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | trans | 35.8 | 116.3 | 140.2 | -70.2 | 175.5 | 175.7 | 172 | 0 | 118.9 | ||||
| 423 | V | 40.2 | Very low | 38.6 | Very low | 140 Ų | 140 | 155.5 Ų | 155.5 | 85% | 0.848 | 80% | 0.8 | S | S | * | * | trans | -142.2 | 123 | 133.4 | -179.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 424 | K | 36.3 | Very low | 38.2 | Very low | 185 Ų | 185 | 149.3 Ų | 149.3 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | -67.3 | 152.2 | 167.8 | -73.7 | 171.7 | 168.7 | 179 | 0 | 110.4 | ||||
| 425 | Y | 39 | Very low | 38.2 | Very low | 214 Ų | 214 | 148.4 Ų | 148.4 | 84% | 0.839 | 79% | 0.793 | S | S | * | * | -174.7 | 123.2 | 126.1 | -94.1 | -68.3 | 0 | 0 | 0 | 111.2 | |||||
| 426 | C | 38.8 | Very low | 37.8 | Very low | 103 Ų | 103 | 151.3 Ų | 151.3 | 70% | 0.696 | 80% | 0.796 | S | S | * | * | trans | 36 | 146.2 | 138.5 | -63.9 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 427 | T | 39.1 | Very low | 37.5 | Very low | 116 Ų | 116 | 151.6 Ų | 151.6 | 71% | 0.712 | 80% | 0.802 | S | S | * | * | cis | -179.3 | 132.5 | -2.3 | 22.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 428 | N | 39.4 | Very low | 37.6 | Very low | 152 Ų | 152 | 147.7 Ų | 147.7 | 81% | 0.813 | 80% | 0.799 | S | S | * | * | trans | 41.7 | 166.7 | 137.8 | -69.4 | -4.4 | 0 | 0 | 0 | 123.8 | ||||
| 429 | P | 42.2 | Very low | 37.6 | Very low | 110 Ų | 110 | 151.9 Ų | 151.9 | 71% | 0.714 | 80% | 0.803 | S | S | * | * | cis | -141.8 | 167.9 | -44.9 | 39.6 | -23 | 0 | 0 | 0 | 113.2 | ||||
| 430 | L | 39.9 | Very low | 37.4 | Very low | 183 Ų | 183 | 150.2 Ų | 150.2 | 96% | 0.958 | 80% | 0.803 | S | S | * | * | trans | -139.5 | 134.2 | 158.3 | -95.9 | 167.7 | 0 | 0 | 0 | 111.5 | ||||
| 431 | K | 42.5 | Very low | 37.5 | Very low | 200 Ų | 200 | 152.1 Ų | 152.1 | 87% | 0.87 | 81% | 0.81 | S | S | * | * | trans | -73.6 | 134.3 | -164.5 | -70.5 | 170.6 | 171.7 | 178.3 | 0 | 113.1 | ||||
| 432 | E | 32.8 | Very low | 37.3 | Very low | 187 Ų | 187 | 154.5 Ų | 154.5 | 87% | 0.874 | 82% | 0.817 | S | S | * | * | trans | -84.3 | 134.5 | 153.9 | -72.6 | 175.5 | 159.3 | 0 | 0 | 109.3 | ||||
| 433 | T | 39.2 | Very low | 37.3 | Very low | 138 Ų | 138 | 155.2 Ų | 155.2 | 85% | 0.847 | 82% | 0.82 | S | S | * | * | trans | -114.9 | 115.3 | 164.1 | 14.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 434 | S | 32.3 | Very low | 37.1 | Very low | 112 Ų | 112 | 154.4 Ų | 154.4 | 78% | 0.783 | 82% | 0.815 | S | S | * | * | trans | -86.5 | 129.6 | 167.4 | -59.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 435 | V | 36.9 | Very low | 37.2 | Very low | 129 Ų | 129 | 153 Ų | 153 | 78% | 0.782 | 82% | 0.816 | S | S | * | * | trans | -146.7 | 107.8 | 155.6 | -179.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 436 | E | 37.5 | Very low | 37.2 | Very low | 182 Ų | 182 | 154.7 Ų | 154.7 | 85% | 0.85 | 82% | 0.821 | S | S | * | * | trans | 52.2 | 109.6 | 139 | -59.9 | -175.2 | 156.9 | 0 | 0 | 122.4 | ||||
| 437 | L | 31.2 | Very low | 37.4 | Very low | 173 Ų | 173 | 155.6 Ų | 155.6 | 91% | 0.906 | 83% | 0.825 | S | S | * | * | trans | -58.7 | 129.3 | 143.7 | -79.3 | 133.9 | 0 | 0 | 0 | 110.8 | ||||
| 438 | S | 37.3 | Very low | 37.2 | Very low | 107 Ų | 107 | 153.8 Ų | 153.8 | 75% | 0.748 | 83% | 0.83 | S | S | * | * | trans | -173 | 122.1 | 142.2 | -85.1 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 439 | K | 37.5 | Very low | 37.2 | Very low | 197 Ų | 197 | 151.7 Ų | 151.7 | 86% | 0.857 | 83% | 0.834 | S | S | * | * | trans | 86.5 | 108.3 | 143.7 | -65.3 | 175.4 | -178.9 | 176.1 | 0 | 120 | ||||
| 440 | S | 32 | Very low | 36.9 | Very low | 107 Ų | 107 | 150 Ų | 150 | 75% | 0.748 | 84% | 0.836 | S | S | * | * | trans | -29.8 | 142.5 | 145.3 | 58.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 441 | V | 37.2 | Very low | 36.9 | Very low | 135 Ų | 135 | 149.4 Ų | 149.4 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | -155.5 | 116.8 | 129.3 | 171.5 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 442 | H | 35.2 | Very low | 36.8 | Very low | 186 Ų | 186 | 148.6 Ų | 148.6 | 86% | 0.861 | 83% | 0.832 | S | S | * | * | trans | -62.1 | 131.2 | 156.5 | -86 | -55.8 | 0 | 0 | 0 | 109.6 | ||||
| 443 | K | 37.4 | Very low | 37.1 | Very low | 204 Ų | 204 | 144.9 Ų | 144.9 | 89% | 0.887 | 83% | 0.826 | S | S | * | * | trans | -165.7 | 127.5 | 134.8 | -111.4 | 170.4 | -177.2 | -174.4 | 0 | 112.5 | ||||
| 444 | V | 34.7 | Very low | 37.3 | Very low | 123 Ų | 123 | 146.7 Ų | 146.7 | 75% | 0.745 | 82% | 0.822 | S | S | * | * | trans | -61.4 | 138.6 | 166.2 | 177.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 445 | D | 38.6 | Very low | 37.8 | Very low | 154 Ų | 154 | 148.1 Ų | 148.1 | 82% | 0.824 | 82% | 0.821 | S | S | * | * | 177.5 | 111.6 | 128.9 | -87.3 | -26.1 | 0 | 0 | 0 | 110.3 | |||||
| 446 | R | 40.7 | Very low | 38.1 | Very low | 251 Ų | 251 | 148.2 Ų | 148.2 | 95% | 0.947 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -97.1 | 120.7 | 165.2 | -109.3 | -178.6 | 177.7 | 170.4 | -0.3 | 107.3 | ||
| 447 | P | 42.6 | Very low | 38.3 | Very low | 121 Ų | 121 | 144.9 Ų | 144.9 | 79% | 0.786 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -92.6 | 132.5 | 156.4 | 30.8 | -21.4 | 0 | 0 | 0 | 109.3 | ||
| 448 | G | 35 | Very low | 38.9 | Very low | 78 Ų | 78 | 144.8 Ų | 144.8 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 165.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 449 | A | 38.1 | Very low | 39.3 | Very low | 109 Ų | 109 | 147.1 Ų | 147.1 | 90% | 0.901 | 82% | 0.815 | S | S | * | * | trans | -178.6 | 137.1 | 143.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 450 | G | 35.5 | Very low | 39.7 | Very low | 74 Ų | 74 | 143.7 Ų | 143.7 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | trans | 103.1 | 118.7 | 168 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 451 | I | 41.9 | Very low | 40.2 | Very low | 171 Ų | 171 | 142.7 Ų | 142.7 | 88% | 0.877 | 81% | 0.812 | S | S | * | * | cis | -153.3 | 139.3 | 48 | -75.9 | 157.5 | 0 | 0 | 0 | 110.2 | ||||
| 452 | Q | 38.7 | Very low | 41 | Very low | 183 Ų | 183 | 142.9 Ų | 142.9 | 86% | 0.855 | 81% | 0.814 | S | S | * | * | trans | -75.7 | 142.9 | 170.6 | -68.4 | 172.8 | -15.6 | 0 | 0 | 112 | ||||
| 453 | S | 39.8 | Very low | 41.6 | Very low | 109 Ų | 109 | 143.5 Ų | 143.5 | 76% | 0.762 | 84% | 0.84 | S | S | * | * | trans | -176.7 | 144.1 | 151.4 | -83 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 454 | K | 43.4 | Very low | 41.8 | Very low | 176 Ų | 176 | 140.5 Ų | 140.5 | 77% | 0.765 | 84% | 0.837 | S | S | * | * | cis | -174.7 | 135.1 | -14.9 | -114.8 | 175.3 | 174.9 | -178.5 | 0 | 103.4 | ||||
| 455 | D | 42 | Very low | 42.2 | Very low | 141 Ų | 141 | 141.4 Ų | 141.4 | 75% | 0.754 | 84% | 0.842 | S | S | * | * | trans | 47.6 | 99.9 | 142.7 | -51.8 | -35 | 0 | 0 | 0 | 122.4 | ||||
| 456 | V | 43.5 | Very low | 42.4 | Very low | 131 Ų | 131 | 140.7 Ų | 140.7 | 79% | 0.794 | 84% | 0.843 | S | S | * | * | 6.4 | 142.6 | 120.5 | -177.7 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 457 | P | 41.6 | Very low | 42.5 | Very low | 112 Ų | 112 | 134.2 Ų | 134.2 | 73% | 0.727 | 84% | 0.837 | S | S | * | * | -149.3 | 146.4 | 70.3 | 29.4 | -3.1 | 0 | 0 | 0 | 118.4 | |||||
| 458 | Q | 45 | Very low | 42.5 | Very low | 171 Ų | 171 | 135.1 Ų | 135.1 | 80% | 0.799 | 84% | 0.84 | S | S | * | * | 64.8 | 109.9 | 87.9 | -147 | -179.2 | 14.7 | 0 | 0 | 114.2 | |||||
| 459 | N | 44.4 | Very low | 43 | Very low | 156 Ų | 156 | 138.9 Ų | 138.9 | 83% | 0.834 | 84% | 0.843 | S | S | * | * | trans | 174.7 | 119 | 144.5 | -95.3 | -17.3 | 0 | 0 | 0 | 114.4 | ||||
| 460 | C | 46.1 | Very low | 43.3 | Very low | 125 Ų | 125 | 141 Ų | 141 | 85% | 0.845 | 84% | 0.838 | S | S | * | * | 145 | 122.9 | 114 | -86.7 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 461 | A | 42.2 | Very low | 43.9 | Very low | 86 Ų | 86 | 146.2 Ų | 146.2 | 71% | 0.711 | 84% | 0.844 | S | S | * | * | trans | -76 | 153.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 462 | T | 54.2 | Low | 44.1 | Very low | 139 Ų | 139 | 144.1 Ų | 144.1 | 85% | 0.853 | 84% | 0.841 | S | S | * | * | 155.7 | 105.2 | 121 | 39.5 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 463 | S | 48.5 | Very low | 44.6 | Very low | 200 Ų | 200 | 140.5 Ų | 140.5 | 100% | 1.399 | 84% | 0.84 | S | S | * | * | -159.6 | 0 | 121.3 | -81.1 | 0 | 0 | 0 | 0 | 108.2 |
Retrieved 463 of 463 residues in 127.4 ms
(Link to these results)