| 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 | A | 47.9 | Very low | 49.3 | Very low | 149 Ų | 149 | 128.4 Ų | 128.4 | 100% | 1.231 | 68% | 0.684 | S | S | * | * | 0 | 59.8 | 0 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 2 | H | 47 | Very low | 49.7 | Very low | 181 Ų | 181 | 128.9 Ų | 128.9 | 84% | 0.838 | 69% | 0.686 | S | S | * | * | trans | -143.1 | 4.9 | -179.9 | -103.8 | -79 | 0 | 0 | 0 | 115.4 | ||||
| 3 | L | 43.8 | Very low | 50.1 | Low | 150 Ų | 150 | 129.9 Ų | 129.9 | 79% | 0.785 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -110.2 | 9.4 | -175.3 | -131.7 | 79.5 | 0 | 0 | 0 | 114.6 | ||
| 4 | W | 40.3 | Very low | 50.5 | Low | 204 Ų | 204 | 126.4 Ų | 126.4 | 77% | 0.773 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -84.8 | -27.1 | -179.4 | -160.6 | -94.4 | 0 | 0 | 0 | 116.2 | T6 Q7 | W4-T6 VanDerWaalsContact C-N 3.34Å; W4-T6 PolarHBondContact O-N 3.27Å; W4-Q7 PolarHBondContact O-N 2.95Å |
| 5 | P | 51.5 | Low | 50.7 | Low | 88 Ų | 88 | 122.2 Ų | 122.2 | 57% | 0.571 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -76 | -18.7 | -171.5 | 29.3 | -32.9 | 0 | 0 | 0 | 114.1 | ||
| 6 | T | 52.1 | Low | 51 | Low | 92 Ų | 92 | 124.7 Ų | 124.7 | 56% | 0.564 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -82 | -34.3 | 176.9 | 39.2 | 0 | 0 | 0 | 0 | 112.6 | W4 K9 L10 | W4-T6 VanDerWaalsContact C-N 3.34Å; W4-T6 PolarHBondContact O-N 3.27Å; T6-K9 PolarHBondContact O-N 3.49Å; T6-L10 PolarHBondContact O-N 3.29Å |
| 7 | Q | 49.6 | Very low | 51.2 | Low | 105 Ų | 105 | 120.1 Ų | 120.1 | 49% | 0.491 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -70.4 | -37.1 | 179.8 | -69.2 | -71 | 10.5 | 0 | 0 | 112.7 | W4 L10 L11 | W4-Q7 PolarHBondContact O-N 2.95Å; Q7-L10 PolarHBondContact O-N 2.86Å; Q7-L11 WeakPolarHBondContact O-CB 3.49Å; Q7-L11 PolarHBondContact O-N 3.32Å |
| 8 | C | 45.9 | Very low | 51.5 | Low | 61 Ų | 61 | 118.3 Ų | 118.3 | 41% | 0.412 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -66.8 | -34.3 | 173.7 | -88.1 | 0 | 0 | 0 | 0 | 113.2 | L11 L12 | C8-L11 PolarHBondContact O-N 3.13Å; C8-L12 PolarHBondContact O-N 2.8Å |
| 9 | K | 54.2 | Low | 51.6 | Low | 165 Ų | 165 | 119.3 Ų | 119.3 | 72% | 0.717 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -68 | -38.7 | 173 | -78.7 | 179.8 | 176.5 | 179.9 | 0 | 111.6 | T6 L12 F13 | T6-K9 PolarHBondContact O-N 3.49Å; K9-L12 PolarHBondContact O-N 3.38Å; K9-F13 WeakPolarHBondContact O-CB 3.36Å; K9-F13 PolarHBondContact O-N 3.41Å |
| 10 | L | 55.8 | Low | 51.7 | Low | 101 Ų | 101 | 119 Ų | 119 | 53% | 0.529 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -65.9 | -40.6 | 175.7 | -163.9 | 71 | 0 | 0 | 0 | 111.5 | T6 Q7 F13 V14 | T6-L10 PolarHBondContact O-N 3.29Å; Q7-L10 PolarHBondContact O-N 2.86Å; L10-F13 WeakPolarHBondContact O-CB 3.37Å; L10-F13 PolarHBondContact O-N 3.06Å; L10-V14 WeakPolarHBondContact O-CB 3.44Å; L10-V14 WeakPolarHBondContact O-CG2 3.45Å; L10-V14 PolarHBondContact O-N 3.36Å |
| 11 | L | 54.1 | Low | 52.4 | Low | 116 Ų | 116 | 117.8 Ų | 117.8 | 61% | 0.607 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -67.6 | -38.3 | 176.1 | -86.3 | 155.9 | 0 | 0 | 0 | 113.2 | Q7 C8 F13 V14 A15 | Q7-L11 WeakPolarHBondContact O-CB 3.49Å; Q7-L11 PolarHBondContact O-N 3.32Å; C8-L11 PolarHBondContact O-N 3.13Å; L11-F13 VanDerWaalsContact C-N 3.34Å; L11-V14 PolarHBondContact O-N 3.11Å; L11-A15 WeakPolarHBondContact O-CB 3.31Å; L11-A15 PolarHBondContact O-N 3.31Å |
| 12 | L | 54.5 | Low | 53.3 | Low | 135 Ų | 135 | 117.7 Ų | 117.7 | 71% | 0.707 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.5 | -36.9 | 172.6 | -113.8 | 115.1 | 0 | 0 | 0 | 111.8 | C8 K9 A15 E16 | C8-L12 PolarHBondContact O-N 2.8Å; K9-L12 PolarHBondContact O-N 3.38Å; L12-A15 PolarHBondContact O-N 3.43Å; L12-E16 PolarHBondContact O-N 2.93Å |
| 13 | F | 54.8 | Low | 54.5 | Low | 142 Ų | 142 | 114.3 Ų | 114.3 | 62% | 0.623 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.8 | -39.9 | 175.1 | -157.2 | -97.4 | 0 | 0 | 0 | 111.8 | K9 L10 L11 A15 I17 | K9-F13 WeakPolarHBondContact O-CB 3.36Å; K9-F13 PolarHBondContact O-N 3.41Å; L10-F13 WeakPolarHBondContact O-CB 3.37Å; L10-F13 PolarHBondContact O-N 3.06Å; L11-F13 VanDerWaalsContact C-N 3.34Å; F13-A15 VanDerWaalsContact C-N 3.34Å; F13-I17 HydrophobicContact CD1-CD1 3.77Å; F13-I17 HydrophobicContact CE1-CD1 4.04Å; F13-I17 WeakPolarHBondContact O-CD1 3.41Å; F13-I17 WeakPolarHBondContact O-CG1 3.49Å; F13-I17 PolarHBondContact O-N 2.91Å |
| 14 | V | 56.1 | Low | 56.1 | Low | 81 Ų | 81 | 108.9 Ų | 108.9 | 49% | 0.491 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -69.2 | -28.8 | 175.6 | 171.7 | 0 | 0 | 0 | 0 | 112.4 | L10 L11 I17 | L10-V14 WeakPolarHBondContact O-CB 3.44Å; L10-V14 WeakPolarHBondContact O-CG2 3.45Å; L10-V14 PolarHBondContact O-N 3.36Å; L11-V14 PolarHBondContact O-N 3.11Å; V14-I17 WeakPolarHBondContact O-CB 3.26Å |
| 15 | A | 53.1 | Low | 58 | Low | 63 Ų | 63 | 105.2 Ų | 105.2 | 52% | 0.521 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -74.8 | -38 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L11 L12 F13 I17 S18 | L11-A15 WeakPolarHBondContact O-CB 3.31Å; L11-A15 PolarHBondContact O-N 3.31Å; L12-A15 PolarHBondContact O-N 3.43Å; F13-A15 VanDerWaalsContact C-N 3.34Å; A15-I17 PolarHBondContact O-N 3.17Å; A15-S18 PolarHBondContact O-N 3.36Å |
| 16 | E | 55.6 | Low | 59.3 | Low | 162 Ų | 162 | 110 Ų | 110 | 76% | 0.757 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62.3 | -34.3 | 171.3 | -99.5 | -138.5 | 88.3 | 0 | 0 | 112.3 | L12 S18 | L12-E16 PolarHBondContact O-N 2.93Å; E16-S18 VanDerWaalsContact C-N 3.25Å; E16-S18 PolarHBondContact O-N 3.33Å |
| 17 | I | 54.1 | Low | 60.7 | Low | 46 Ų | 46 | 111.2 Ų | 111.2 | 24% | 0.236 | 57% | 0.565 | C | S | . | * | H | α-helix | trans | -61.2 | -30.2 | 177.7 | -80.9 | 171.5 | 0 | 0 | 0 | 112 | F13 V14 A15 I19 L24 | F13-I17 HydrophobicContact CD1-CD1 3.77Å; F13-I17 HydrophobicContact CE1-CD1 4.04Å; F13-I17 WeakPolarHBondContact O-CD1 3.41Å; F13-I17 WeakPolarHBondContact O-CG1 3.49Å; F13-I17 PolarHBondContact O-N 2.91Å; V14-I17 WeakPolarHBondContact O-CB 3.26Å; A15-I17 PolarHBondContact O-N 3.17Å; I17-I19 PolarHBondContact O-N 2.97Å; I17-L24 HydrophobicContact CB-CD1 3.96Å; I17-L24 HydrophobicContact CB-CD2 4.43Å; I17-L24 HydrophobicContact CD1-CD1 4.47Å; I17-L24 HydrophobicContact CG1-CD1 3.73Å; I17-L24 HydrophobicContact CG2-CD1 3.59Å; I17-L24 HydrophobicContact CG2-CD2 3.38Å; I17-L24 HydrophobicContact CG2-CG 4.04Å; I17-L24 WeakPolarHBondContact O-CD2 3.49Å |
| 18 | S | 56.2 | Low | 62.2 | Low | 88 Ų | 88 | 112 Ų | 112 | 62% | 0.615 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -13 | -167.9 | -166.3 | 0 | 0 | 0 | 0 | 116.5 | A15 E16 | A15-S18 PolarHBondContact O-N 3.36Å; E16-S18 VanDerWaalsContact C-N 3.25Å; E16-S18 PolarHBondContact O-N 3.33Å |
| 19 | I | 54.3 | Low | 64 | Low | 138 Ų | 138 | 111.1 Ų | 111.1 | 71% | 0.708 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -21.2 | -170.7 | -69.1 | 176.1 | 0 | 0 | 0 | 113.8 | I17 | I17-I19 PolarHBondContact O-N 2.97Š|
| 20 | M | 52.5 | Low | 65.3 | Low | 112 Ų | 112 | 107.9 Ų | 107.9 | 55% | 0.552 | 56% | 0.563 | S | S | * | * | trans | -127.9 | 54.8 | -169.7 | -67.5 | -88.3 | 95.4 | 0 | 0 | 112.5 | K22 L23 L24 | M20-K22 PolarHBondContact O-N 2.96Å; M20-L23 HydrophobicContact CB-CB 4.28Å; M20-L23 HydrophobicContact CB-CD1 4.34Å; M20-L23 HydrophobicContact CG-CD1 4.47Å; M20-L23 PolarHBondContact O-N 2.94Å; M20-L23 HydrophobicContact SD-CD1 3.95Å; M20-L24 WeakPolarHBondContact O-CB 3.43Å; M20-L24 PolarHBondContact O-N 3.45Å | ||
| 21 | T | 67.8 | Low | 66.5 | Low | 95 Ų | 95 | 106.7 Ų | 106.7 | 58% | 0.583 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -52.3 | -29.8 | -170.4 | 54.8 | 0 | 0 | 0 | 0 | 115.6 | Q25 | T21-Q25 WeakPolarHBondContact O-CB 3.48Å; T21-Q25 PolarHBondContact O-N 3.39Å |
| 22 | K | 66.4 | Low | 67.9 | Low | 147 Ų | 147 | 107 Ų | 107 | 64% | 0.639 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -71.4 | -51.8 | 174.5 | -68.9 | -68.4 | -177.4 | 176.5 | 0 | 112.6 | M20 L24 Q25 W26 | M20-K22 PolarHBondContact O-N 2.96Å; K22-L24 PolarHBondContact O-N 2.89Å; K22-Q25 WeakPolarHBondContact O-CB 3.42Å; K22-Q25 PolarHBondContact O-N 2.93Å; K22-W26 PolarHBondContact O-N 3.49Å; K22-W26 VanDerWaalsContact O-N 3.12Å |
| 23 | L | 71.6 | Confident | 69.2 | Low | 110 Ų | 110 | 106.7 Ų | 106.7 | 58% | 0.576 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62.3 | -39.8 | 176.9 | -67.9 | 175.6 | 0 | 0 | 0 | 110.6 | M20 W26 L27 | M20-L23 HydrophobicContact CB-CB 4.28Å; M20-L23 HydrophobicContact CB-CD1 4.34Å; M20-L23 HydrophobicContact CG-CD1 4.47Å; M20-L23 PolarHBondContact O-N 2.94Å; M20-L23 HydrophobicContact SD-CD1 3.95Å; L23-W26 PolarHBondContact O-N 3.38Å; L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 PolarHBondContact O-N 2.98Å |
| 24 | L | 77.8 | Confident | 70.4 | Confident | 36 Ų | 36 | 101.6 Ų | 101.6 | 19% | 0.188 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -63 | -42.3 | 175.5 | -173.2 | 76 | 0 | 0 | 0 | 112.3 | I17 M20 K22 W26 L27 F28 | I17-L24 HydrophobicContact CB-CD1 3.96Å; I17-L24 HydrophobicContact CB-CD2 4.43Å; I17-L24 HydrophobicContact CD1-CD1 4.47Å; I17-L24 HydrophobicContact CG1-CD1 3.73Å; I17-L24 HydrophobicContact CG2-CD1 3.59Å; I17-L24 HydrophobicContact CG2-CD2 3.38Å; I17-L24 HydrophobicContact CG2-CG 4.04Å; I17-L24 WeakPolarHBondContact O-CD2 3.49Å; M20-L24 WeakPolarHBondContact O-CB 3.43Å; M20-L24 PolarHBondContact O-N 3.45Å; K22-L24 PolarHBondContact O-N 2.89Å; L24-W26 VanDerWaalsContact C-N 3.34Å; L24-W26 PolarHBondContact O-N 3.2Å; L24-L27 PolarHBondContact O-N 2.97Å; L24-F28 HydrophobicContact CD1-CD2 4.08Å; L24-F28 HydrophobicContact CD1-CE2 3.62Å; L24-F28 HydrophobicContact CD1-CZ 4.35Å; L24-F28 HydrophobicContact CD2-CD2 4.21Å; L24-F28 HydrophobicContact CD2-CE2 3.7Å; L24-F28 HydrophobicContact CG-CD2 3.64Å; L24-F28 HydrophobicContact CG-CE2 3.43Å; L24-F28 VanDerWaalsContact CG-CE2 3.43Å; L24-F28 VanDerWaalsContact O-CD2 3.22Å; L24-F28 WeakPolarHBondContact O-CD2 3.36Å; L24-F28 PolarHBondContact O-N 3.11Å |
| 25 | Q | 79.8 | Confident | 71.4 | Confident | 126 Ų | 126 | 99.9 Ų | 99.9 | 59% | 0.589 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59.8 | -44.1 | 175.4 | 179.6 | -176.9 | -14.1 | 0 | 0 | 111.3 | T21 K22 G29 | T21-Q25 WeakPolarHBondContact O-CB 3.48Å; T21-Q25 PolarHBondContact O-N 3.39Å; K22-Q25 WeakPolarHBondContact O-CB 3.42Å; K22-Q25 PolarHBondContact O-N 2.93Å; Q25-G29 PolarHBondContact O-N 3.33Å |
| 26 | W | 80 | Confident | 72.7 | Confident | 189 Ų | 189 | 100.8 Ų | 100.8 | 72% | 0.716 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.3 | -43.4 | 174.6 | -75.3 | 105.5 | 0 | 0 | 0 | 112.1 | K22 L23 L24 G29 V30 | K22-W26 PolarHBondContact O-N 3.49Å; K22-W26 VanDerWaalsContact O-N 3.12Å; L23-W26 PolarHBondContact O-N 3.38Å; L24-W26 VanDerWaalsContact C-N 3.34Å; L24-W26 PolarHBondContact O-N 3.2Å; W26-G29 PolarHBondContact O-N 3.29Å; W26-V30 WeakPolarHBondContact O-CG2 3.43Å; W26-V30 PolarHBondContact O-N 2.98Å |
| 27 | L | 81.1 | Confident | 73.6 | Confident | 117 Ų | 117 | 97.7 Ų | 97.7 | 61% | 0.613 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.2 | -44.5 | 176.3 | -102.8 | 154.6 | 0 | 0 | 0 | 112.2 | L23 L24 V30 S31 | L23-L27 WeakPolarHBondContact O-CB 3.38Å; L23-L27 PolarHBondContact O-N 2.98Å; L24-L27 PolarHBondContact O-N 2.97Å; L27-V30 PolarHBondContact O-N 3.35Å; L27-S31 WeakPolarHBondContact O-CB 3.48Å; L27-S31 PolarHBondContact O-N 2.86Å |
| 28 | F | 81.7 | Confident | 74.4 | Confident | 121 Ų | 121 | 96.8 Ų | 96.8 | 53% | 0.531 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.7 | -41.2 | 175.1 | -84.3 | -62.3 | 0 | 0 | 0 | 111.8 | L24 S31 L32 | L24-F28 HydrophobicContact CD1-CD2 4.08Å; L24-F28 HydrophobicContact CD1-CE2 3.62Å; L24-F28 HydrophobicContact CD1-CZ 4.35Å; L24-F28 HydrophobicContact CD2-CD2 4.21Å; L24-F28 HydrophobicContact CD2-CE2 3.7Å; L24-F28 HydrophobicContact CG-CD2 3.64Å; L24-F28 HydrophobicContact CG-CE2 3.43Å; L24-F28 VanDerWaalsContact CG-CE2 3.43Å; L24-F28 VanDerWaalsContact O-CD2 3.22Å; L24-F28 WeakPolarHBondContact O-CD2 3.36Å; L24-F28 PolarHBondContact O-N 3.11Å; F28-S31 PolarHBondContact O-N 3.48Å; F28-L32 VanDerWaalsContact O-CB 3.27Å; F28-L32 WeakPolarHBondContact O-CB 3.23Å; F28-L32 PolarHBondContact O-N 3.33Å |
| 29 | G | 82.3 | Confident | 75.2 | Confident | 43 Ų | 43 | 96.8 Ų | 96.8 | 44% | 0.443 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.7 | -49 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q25 W26 L32 L33 | Q25-G29 PolarHBondContact O-N 3.33Å; W26-G29 PolarHBondContact O-N 3.29Å; G29-L32 PolarHBondContact O-N 3.09Å; G29-L33 WeakPolarHBondContact O-CB 3.28Å; G29-L33 PolarHBondContact O-N 3.22Å |
| 30 | V | 82.3 | Confident | 76 | Confident | 98 Ų | 98 | 93.4 Ų | 93.4 | 59% | 0.594 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65 | -41 | 177.4 | 172.9 | 0 | 0 | 0 | 0 | 111.1 | W26 L27 L33 G34 | W26-V30 WeakPolarHBondContact O-CG2 3.43Å; W26-V30 PolarHBondContact O-N 2.98Å; L27-V30 PolarHBondContact O-N 3.35Å; V30-L33 PolarHBondContact O-N 3.5Å; V30-G34 PolarHBondContact O-N 2.88Å |
| 31 | S | 80.8 | Confident | 76.8 | Confident | 75 Ų | 75 | 88.5 Ų | 88.5 | 52% | 0.524 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 177.5 | -178.3 | 0 | 0 | 0 | 0 | 111.7 | L27 F28 G34 A35 | L27-S31 WeakPolarHBondContact O-CB 3.48Å; L27-S31 PolarHBondContact O-N 2.86Å; F28-S31 PolarHBondContact O-N 3.48Å; S31-G34 PolarHBondContact O-N 3.24Å; S31-A35 VanDerWaalsContact O-CB 3.28Å; S31-A35 WeakPolarHBondContact O-CB 3.37Å; S31-A35 PolarHBondContact O-N 2.96Å |
| 32 | L | 82.4 | Confident | 76.8 | Confident | 122 Ų | 122 | 91 Ų | 91 | 64% | 0.639 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.1 | -43.6 | 177.4 | -169.1 | 68.7 | 0 | 0 | 0 | 111.4 | F28 G29 A35 V36 | F28-L32 VanDerWaalsContact O-CB 3.27Å; F28-L32 WeakPolarHBondContact O-CB 3.23Å; F28-L32 PolarHBondContact O-N 3.33Å; G29-L32 PolarHBondContact O-N 3.09Å; L32-A35 PolarHBondContact O-N 3.3Å; L32-V36 VanDerWaalsContact O-CG2 3.29Å; L32-V36 WeakPolarHBondContact O-CG2 2.98Å; L32-V36 PolarHBondContact O-N 3.17Å |
| 33 | L | 82.1 | Confident | 76.6 | Confident | 130 Ų | 130 | 86.2 Ų | 86.2 | 68% | 0.681 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -62.3 | -43.7 | 175.1 | -172.8 | 72.8 | 0 | 0 | 0 | 111.6 | G29 V30 V36 W37 | G29-L33 WeakPolarHBondContact O-CB 3.28Å; G29-L33 PolarHBondContact O-N 3.22Å; V30-L33 PolarHBondContact O-N 3.5Å; L33-V36 PolarHBondContact O-N 3.3Å; L33-W37 PolarHBondContact O-N 3.02Å |
| 34 | G | 80.9 | Confident | 75.7 | Confident | 34 Ų | 34 | 86.7 Ų | 86.7 | 35% | 0.351 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -64.2 | -38.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | V30 S31 W37 A38 | V30-G34 PolarHBondContact O-N 2.88Å; S31-G34 PolarHBondContact O-N 3.24Å; G34-W37 PolarHBondContact O-N 3.43Å; G34-A38 VanDerWaalsContact O-CB 3.26Å; G34-A38 WeakPolarHBondContact O-CB 3.18Å; G34-A38 PolarHBondContact O-N 3.29Å |
| 35 | A | 77.2 | Confident | 74.7 | Confident | 46 Ų | 46 | 91.1 Ų | 91.1 | 38% | 0.38 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.4 | -43.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | S31 L32 W37 A38 L39 | S31-A35 VanDerWaalsContact O-CB 3.28Å; S31-A35 WeakPolarHBondContact O-CB 3.37Å; S31-A35 PolarHBondContact O-N 2.96Å; L32-A35 PolarHBondContact O-N 3.3Å; A35-W37 VanDerWaalsContact C-N 3.34Å; A35-W37 PolarHBondContact O-N 3.33Å; A35-A38 PolarHBondContact O-N 2.82Å; A35-L39 WeakPolarHBondContact O-CB 3.31Å; A35-L39 WeakPolarHBondContact O-CD1 3.47Å; A35-L39 VanDerWaalsContact O-CG 3.31Å; A35-L39 WeakPolarHBondContact O-CG 3.25Å; A35-L39 PolarHBondContact O-N 3.45Å |
| 36 | V | 79.2 | Confident | 73.5 | Confident | 81 Ų | 81 | 93.6 Ų | 93.6 | 49% | 0.491 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 173.5 | 171.6 | 0 | 0 | 0 | 0 | 110.6 | L32 L33 L39 V40 | L32-V36 VanDerWaalsContact O-CG2 3.29Å; L32-V36 WeakPolarHBondContact O-CG2 2.98Å; L32-V36 PolarHBondContact O-N 3.17Å; L33-V36 PolarHBondContact O-N 3.3Å; V36-L39 PolarHBondContact O-N 3.13Å; V36-V40 WeakPolarHBondContact O-CG2 3.3Å; V36-V40 PolarHBondContact O-N 3.2Å; V36-V40 VanDerWaalsContact O-N 3.15Å |
| 37 | W | 75.1 | Confident | 72.3 | Confident | 97 Ų | 97 | 89.7 Ų | 89.7 | 37% | 0.367 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.6 | -44.1 | 176.2 | 177 | 75.5 | 0 | 0 | 0 | 112.5 | L33 G34 A35 L39 V40 A41 A57 P61 | L33-W37 PolarHBondContact O-N 3.02Å; G34-W37 PolarHBondContact O-N 3.43Å; A35-W37 VanDerWaalsContact C-N 3.34Å; A35-W37 PolarHBondContact O-N 3.33Å; W37-L39 VanDerWaalsContact C-N 3.32Å; W37-L39 PolarHBondContact O-N 3.33Å; W37-V40 CarbonylContact O-C 3.55Å; W37-V40 WeakPolarHBondContact O-CB 3.2Å; W37-V40 PolarHBondContact O-N 3.16Å; W37-V40 VanDerWaalsContact O-N 3.11Å; W37-A41 HydrophobicContact CD2-CB 4.41Å; W37-A41 HydrophobicContact CH2-CB 4.12Å; W37-A41 HydrophobicContact CZ2-CB 3.86Å; W37-A41 HydrophobicContact CZ3-CB 4.46Å; W37-A41 WeakPolarHBondContact O-CB 3.44Å; W37-A41 PolarHBondContact O-N 3.45Å; W37-A57 PolarHBondContact NE1-O 2.87Å; W37-P61 HydrophobicContact CD2-CG 3.47Å; W37-P61 VanDerWaalsContact CD2-CG 3.47Å; W37-P61 HydrophobicContact CE3-CG 4.22Å; W37-P61 HydrophobicContact CG-CG 3.79Å; W37-P61 HydrophobicContact CH2-CG 4.12Å; W37-P61 HydrophobicContact CZ2-CG 3.39Å; W37-P61 VanDerWaalsContact NE1-CD 3.28Å |
| 38 | A | 71.1 | Confident | 71.1 | Confident | 28 Ų | 28 | 90.2 Ų | 90.2 | 23% | 0.231 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -61.1 | -42.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111 | G34 A35 V40 A41 F42 | G34-A38 VanDerWaalsContact O-CB 3.26Å; G34-A38 WeakPolarHBondContact O-CB 3.18Å; G34-A38 PolarHBondContact O-N 3.29Å; A35-A38 PolarHBondContact O-N 2.82Å; A38-V40 VanDerWaalsContact C-N 3.28Å; A38-V40 PolarHBondContact O-N 3.32Å; A38-A41 PolarHBondContact O-N 3.19Å; A38-A41 VanDerWaalsContact O-N 3.16Å; A38-F42 HydrophobicContact CB-CD2 4.05Å; A38-F42 HydrophobicContact CB-CE2 4.23Å; A38-F42 WeakPolarHBondContact O-CB 3.45Å; A38-F42 WeakPolarHBondContact O-CD2 3.28Å; A38-F42 PolarHBondContact O-N 2.84Å |
| 39 | L | 73.3 | Confident | 70 | Confident | 88 Ų | 88 | 88.4 Ų | 88.4 | 46% | 0.461 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -56.9 | -41.8 | 173.4 | -78.8 | 159.7 | 0 | 0 | 0 | 112.2 | A35 V36 W37 D43 L44 | A35-L39 WeakPolarHBondContact O-CB 3.31Å; A35-L39 WeakPolarHBondContact O-CD1 3.47Å; A35-L39 VanDerWaalsContact O-CG 3.31Å; A35-L39 WeakPolarHBondContact O-CG 3.25Å; A35-L39 PolarHBondContact O-N 3.45Å; V36-L39 PolarHBondContact O-N 3.13Å; W37-L39 VanDerWaalsContact C-N 3.32Å; W37-L39 PolarHBondContact O-N 3.33Å; L39-D43 PolarHBondContact O-N 3.35Å; L39-L44 HydrophobicContact CD2-CB 3.89Å; L39-L44 HydrophobicContact CD2-CD2 3.97Å; L39-L44 PolarHBondContact O-N 2.89Å |
| 40 | V | 70.3 | Confident | 69.1 | Low | 67 Ų | 67 | 90.5 Ų | 90.5 | 41% | 0.406 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -69.3 | -38.9 | 176 | 174.8 | 0 | 0 | 0 | 0 | 111.7 | V36 W37 A38 Y53 A57 | V36-V40 WeakPolarHBondContact O-CG2 3.3Å; V36-V40 PolarHBondContact O-N 3.2Å; V36-V40 VanDerWaalsContact O-N 3.15Å; W37-V40 CarbonylContact O-C 3.55Å; W37-V40 WeakPolarHBondContact O-CB 3.2Å; W37-V40 PolarHBondContact O-N 3.16Å; W37-V40 VanDerWaalsContact O-N 3.11Å; A38-V40 VanDerWaalsContact C-N 3.28Å; A38-V40 PolarHBondContact O-N 3.32Å; V40-Y53 HydrophobicContact CG1-CE1 4.35Å; V40-A57 HydrophobicContact CG1-CB 4.42Å |
| 41 | A | 68.9 | Low | 68.2 | Low | 8 Ų | 8 | 95.9 Ų | 95.9 | 7% | 0.066 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -74.6 | -40.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | W37 A38 D43 | W37-A41 HydrophobicContact CD2-CB 4.41Å; W37-A41 HydrophobicContact CH2-CB 4.12Å; W37-A41 HydrophobicContact CZ2-CB 3.86Å; W37-A41 HydrophobicContact CZ3-CB 4.46Å; W37-A41 WeakPolarHBondContact O-CB 3.44Å; W37-A41 PolarHBondContact O-N 3.45Å; A38-A41 PolarHBondContact O-N 3.19Å; A38-A41 VanDerWaalsContact O-N 3.16Å; A41-D43 VanDerWaalsContact C-N 3.27Å |
| 42 | F | 68.1 | Low | 67.6 | Low | 149 Ų | 149 | 97.1 Ų | 97.1 | 65% | 0.654 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -81.5 | -5.8 | 178.2 | -74.4 | -74.2 | 0 | 0 | 0 | 113.1 | A38 L44 | A38-F42 HydrophobicContact CB-CD2 4.05Å; A38-F42 HydrophobicContact CB-CE2 4.23Å; A38-F42 WeakPolarHBondContact O-CB 3.45Å; A38-F42 WeakPolarHBondContact O-CD2 3.28Å; A38-F42 PolarHBondContact O-N 2.84Å; F42-L44 HydrophobicContact CB-CD1 3.42Å; F42-L44 VanDerWaalsContact CB-CD1 3.42Å; F42-L44 HydrophobicContact CG-CD1 4.37Å; F42-L44 PolarHBondContact O-N 2.88Å |
| 43 | D | 62.2 | Low | 66.8 | Low | 45 Ų | 45 | 97.1 Ų | 97.1 | 24% | 0.241 | 52% | 0.515 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 55.8 | 34.7 | 176.9 | -145.2 | -105.6 | 0 | 0 | 0 | 112.6 | L39 A41 L45 E46 R54 | L39-D43 PolarHBondContact O-N 3.35Å; A41-D43 VanDerWaalsContact C-N 3.27Å; D43-L45 PolarHBondContact O-N 3.07Å; D43-E46 PolarHBondContact O-N 3.26Å; D43-R54 IonicContact OD1-NH2 3.02Å; D43-R54 PolarHBondContact OD1-NH2 3.5Å; D43-R54 IonicContact OD2-CZ 3.17Å; D43-R54 IonicContact OD2-NE 3.89Å; D43-R54 IonicContact OD2-NH1 3.62Å; D43-R54 IonicContact OD2-NH2 2.66Å; D43-R54 PolarHBondContact OD2-NH2 2.89Å |
| 44 | L | 53.9 | Low | 66.1 | Low | 121 Ų | 121 | 96.3 Ų | 96.3 | 63% | 0.634 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -11.1 | -174.8 | -112.4 | 82.5 | 0 | 0 | 0 | 113.7 | L39 F42 | L39-L44 HydrophobicContact CD2-CB 3.89Å; L39-L44 HydrophobicContact CD2-CD2 3.97Å; L39-L44 PolarHBondContact O-N 2.89Å; F42-L44 HydrophobicContact CB-CD1 3.42Å; F42-L44 VanDerWaalsContact CB-CD1 3.42Å; F42-L44 HydrophobicContact CG-CD1 4.37Å; F42-L44 PolarHBondContact O-N 2.88Å |
| 45 | L | 56.1 | Low | 65.6 | Low | 128 Ų | 128 | 101.4 Ų | 101.4 | 67% | 0.67 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.4 | -0.5 | -172.6 | -139.2 | 67.2 | 0 | 0 | 0 | 113.9 | D43 L47 | D43-L45 PolarHBondContact O-N 3.07Å; L45-L47 HydrophobicContact CB-CD1 3.98Å; L45-L47 HydrophobicContact CD2-CD1 3.73Å; L45-L47 HydrophobicContact CG-CD1 3.77Å; L45-L47 WeakPolarHBondContact O-CD1 3.36Å; L45-L47 PolarHBondContact O-N 2.91Å |
| 46 | E | 54.8 | Low | 65.3 | Low | 179 Ų | 179 | 103.5 Ų | 103.5 | 84% | 0.836 | 53% | 0.525 | S | S | * | . | trans | 46.7 | 25.1 | -177.2 | -68.6 | 176 | 141.1 | 0 | 0 | 113.3 | D43 S48 | D43-E46 PolarHBondContact O-N 3.26Å; E46-S48 PolarHBondContact O-N 3.21Å | ||
| 47 | L | 55.7 | Low | 65.1 | Low | 106 Ų | 106 | 100.1 Ų | 100.1 | 56% | 0.555 | 51% | 0.506 | S | S | * | . | trans | -74.3 | 106.8 | 171.3 | -100.9 | 76.5 | 0 | 0 | 0 | 105.3 | L45 L49 | L45-L47 HydrophobicContact CB-CD1 3.98Å; L45-L47 HydrophobicContact CD2-CD1 3.73Å; L45-L47 HydrophobicContact CG-CD1 3.77Å; L45-L47 WeakPolarHBondContact O-CD1 3.36Å; L45-L47 PolarHBondContact O-N 2.91Å; L47-L49 PolarHBondContact O-N 3.31Å | ||
| 48 | S | 54.7 | Low | 64.9 | Low | 128 Ų | 128 | 103.7 Ų | 103.7 | 90% | 0.895 | 52% | 0.52 | S | S | * | . | trans | -51.1 | 74.1 | 172.3 | -170.6 | 0 | 0 | 0 | 0 | 111.5 | E46 | E46-S48 PolarHBondContact O-N 3.21Š| ||
| 49 | L | 58.2 | Low | 65.4 | Low | 83 Ų | 83 | 104.1 Ų | 104.1 | 44% | 0.435 | 52% | 0.52 | S | S | . | . | trans | -86.4 | 134.7 | 175.1 | -86.2 | -174.3 | 0 | 0 | 0 | 108.6 | L47 R51 Y53 | L47-L49 PolarHBondContact O-N 3.31Å; L49-R51 PolarHBondContact O-N 2.88Å; L49-Y53 HydrophobicContact CD1-CD1 3.48Å; L49-Y53 VanDerWaalsContact CD1-CD1 3.48Å; L49-Y53 HydrophobicContact CD1-CE1 3.74Å; L49-Y53 HydrophobicContact CD1-CG 4.27Å | ||
| 50 | P | 63.4 | Low | 65.7 | Low | 87 Ų | 87 | 105 Ų | 105 | 57% | 0.565 | 52% | 0.523 | S | S | * | . | trans | -57.2 | 140.2 | -180 | 22.3 | -31.7 | 0 | 0 | 0 | 110.5 | T52 Y53 | P50-T52 PolarHBondContact O-N 2.9Å; P50-Y53 PolarHBondContact O-N 2.88Å | ||
| 51 | R | 63.7 | Low | 66.1 | Low | 211 Ų | 211 | 104 Ų | 104 | 80% | 0.796 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -49.8 | -34.8 | -173.8 | -61.8 | -171.9 | -172.6 | -140.3 | 2.1 | 113.5 | L49 Y53 R54 E55 | L49-R51 PolarHBondContact O-N 2.88Å; R51-Y53 VanDerWaalsContact C-N 3.28Å; R51-Y53 PolarHBondContact O-N 2.91Å; R51-R54 WeakPolarHBondContact O-CB 3.38Å; R51-R54 PolarHBondContact O-N 3.48Å; R51-R54 VanDerWaalsContact O-N 3.14Å; R51-E55 PolarHBondContact O-N 3.42Å |
| 52 | T | 67.8 | Low | 66.8 | Low | 102 Ų | 102 | 109 Ų | 109 | 63% | 0.626 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -55.2 | -38.1 | 175.7 | -50.9 | 0 | 0 | 0 | 0 | 113.4 | P50 V56 | P50-T52 PolarHBondContact O-N 2.9Å; T52-V56 WeakPolarHBondContact O-CG2 3.47Å; T52-V56 PolarHBondContact O-N 2.78Å |
| 53 | Y | 66.4 | Low | 67.5 | Low | 121 Ų | 121 | 110 Ų | 110 | 48% | 0.475 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -72.6 | -35.3 | 179.8 | -172.2 | -94.4 | 0 | 0 | 0 | 111.8 | V40 L49 P50 R51 V56 A57 | V40-Y53 HydrophobicContact CG1-CE1 4.35Å; L49-Y53 HydrophobicContact CD1-CD1 3.48Å; L49-Y53 VanDerWaalsContact CD1-CD1 3.48Å; L49-Y53 HydrophobicContact CD1-CE1 3.74Å; L49-Y53 HydrophobicContact CD1-CG 4.27Å; P50-Y53 PolarHBondContact O-N 2.88Å; R51-Y53 VanDerWaalsContact C-N 3.28Å; R51-Y53 PolarHBondContact O-N 2.91Å; Y53-V56 PolarHBondContact O-N 3.46Å; Y53-A57 HydrophobicContact CD1-CB 4.24Å; Y53-A57 HydrophobicContact CE1-CB 4.09Å; Y53-A57 WeakPolarHBondContact O-CB 3.28Å; Y53-A57 PolarHBondContact O-N 3.47Å |
| 54 | R | 67.7 | Low | 68.5 | Low | 113 Ų | 113 | 113.4 Ų | 113.4 | 43% | 0.426 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.4 | -41.6 | 177.9 | -172.4 | -177.6 | -67.2 | -112.2 | 11.1 | 112 | D43 R51 V56 A57 W58 | D43-R54 IonicContact OD1-NH2 3.02Å; D43-R54 PolarHBondContact OD1-NH2 3.5Å; D43-R54 IonicContact OD2-CZ 3.17Å; D43-R54 IonicContact OD2-NE 3.89Å; D43-R54 IonicContact OD2-NH1 3.62Å; D43-R54 IonicContact OD2-NH2 2.66Å; D43-R54 PolarHBondContact OD2-NH2 2.89Å; R51-R54 WeakPolarHBondContact O-CB 3.38Å; R51-R54 PolarHBondContact O-N 3.48Å; R51-R54 VanDerWaalsContact O-N 3.14Å; R54-V56 PolarHBondContact O-N 2.8Å; R54-A57 PolarHBondContact O-N 3.38Å; R54-W58 PolarHBondContact O-N 3.41Å; R54-W58 VanDerWaalsContact O-N 3.12Å |
| 55 | E | 70.3 | Confident | 70.1 | Confident | 141 Ų | 141 | 113.1 Ų | 113.1 | 66% | 0.659 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -62.7 | -32.8 | 177.7 | -70.4 | 174.3 | -168.5 | 0 | 0 | 112.3 | R51 P59 | R51-E55 PolarHBondContact O-N 3.42Å; E55-P59 WeakPolarHBondContact O-CD 3.36Å |
| 56 | V | 71.6 | Confident | 71.7 | Confident | 90 Ų | 90 | 111 Ų | 111 | 55% | 0.545 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -85.6 | -35.2 | 177.8 | 178.5 | 0 | 0 | 0 | 0 | 112.3 | T52 Y53 R54 P59 M60 | T52-V56 WeakPolarHBondContact O-CG2 3.47Å; T52-V56 PolarHBondContact O-N 2.78Å; Y53-V56 PolarHBondContact O-N 3.46Å; R54-V56 PolarHBondContact O-N 2.8Å; V56-P59 VanDerWaalsContact O-CD 3.29Å; V56-P59 WeakPolarHBondContact O-CD 3.32Å; V56-M60 VanDerWaalsContact O-CG 3.3Å; V56-M60 WeakPolarHBondContact O-CG 3.19Å |
| 57 | A | 73.4 | Confident | 73.4 | Confident | 11 Ų | 11 | 105.8 Ų | 105.8 | 9% | 0.091 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -72.1 | -28.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | W37 V40 Y53 R54 | W37-A57 PolarHBondContact NE1-O 2.87Å; V40-A57 HydrophobicContact CG1-CB 4.42Å; Y53-A57 HydrophobicContact CD1-CB 4.24Å; Y53-A57 HydrophobicContact CE1-CB 4.09Å; Y53-A57 WeakPolarHBondContact O-CB 3.28Å; Y53-A57 PolarHBondContact O-N 3.47Å; R54-A57 PolarHBondContact O-N 3.38Å |
| 58 | W | 72.2 | Confident | 75 | Confident | 172 Ų | 172 | 107 Ų | 107 | 65% | 0.652 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.1 | -50 | 178.9 | -170.3 | -87.5 | 0 | 0 | 0 | 113.4 | R54 | R54-W58 PolarHBondContact O-N 3.41Å; R54-W58 VanDerWaalsContact O-N 3.12Å |
| 59 | P | 80.6 | Confident | 76.7 | Confident | 37 Ų | 37 | 102.7 Ų | 102.7 | 24% | 0.24 | 51% | 0.512 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | -5.9 | 178.9 | 36 | -40.7 | 0 | 0 | 0 | 114.3 | E55 V56 L62 Y63 | E55-P59 WeakPolarHBondContact O-CD 3.36Å; V56-P59 VanDerWaalsContact O-CD 3.29Å; V56-P59 WeakPolarHBondContact O-CD 3.32Å; P59-L62 WeakPolarHBondContact O-CB 3.39Å; P59-L62 PolarHBondContact O-N 2.93Å; P59-Y63 HydrophobicContact CB-CD2 3.72Å; P59-Y63 HydrophobicContact CB-CE2 3.54Å; P59-Y63 HydrophobicContact CG-CD2 4.09Å; P59-Y63 HydrophobicContact CG-CE2 3.79Å; P59-Y63 VanDerWaalsContact O-CD2 3.26Å; P59-Y63 WeakPolarHBondContact O-CD2 3.27Å; P59-Y63 PolarHBondContact O-N 3.23Å |
| 60 | M | 79.4 | Confident | 78.4 | Confident | 106 Ų | 106 | 102.6 Ų | 102.6 | 52% | 0.522 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -50.4 | -49.4 | -174.9 | -102.4 | -92.8 | -96.8 | 0 | 0 | 114.9 | V56 L62 Y63 L64 | V56-M60 VanDerWaalsContact O-CG 3.3Å; V56-M60 WeakPolarHBondContact O-CG 3.19Å; M60-L62 VanDerWaalsContact C-N 3.31Å; M60-L62 PolarHBondContact O-N 2.85Å; M60-Y63 PolarHBondContact O-N 2.85Å; M60-L64 WeakPolarHBondContact O-CB 3.44Å; M60-L64 PolarHBondContact O-N 3.05Å |
| 61 | P | 78.6 | Confident | 79.7 | Confident | 46 Ų | 46 | 106.1 Ų | 106.1 | 30% | 0.299 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -68.4 | -32.4 | 179.1 | -14.1 | 25.3 | 0 | 0 | 0 | 112.7 | W37 L64 L65 | W37-P61 HydrophobicContact CD2-CG 3.47Å; W37-P61 VanDerWaalsContact CD2-CG 3.47Å; W37-P61 HydrophobicContact CE3-CG 4.22Å; W37-P61 HydrophobicContact CG-CG 3.79Å; W37-P61 HydrophobicContact CH2-CG 4.12Å; W37-P61 HydrophobicContact CZ2-CG 3.39Å; W37-P61 VanDerWaalsContact NE1-CD 3.28Å; P61-L64 PolarHBondContact O-N 3.47Å; P61-L65 WeakPolarHBondContact O-CB 3.43Å; P61-L65 PolarHBondContact O-N 3.37Å |
| 62 | L | 83.4 | Confident | 81 | Confident | 114 Ų | 114 | 98.7 Ų | 98.7 | 60% | 0.597 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.8 | -45.3 | 176.9 | -175.8 | 64.8 | 0 | 0 | 0 | 109.7 | P59 M60 L64 L65 V66 | P59-L62 WeakPolarHBondContact O-CB 3.39Å; P59-L62 PolarHBondContact O-N 2.93Å; M60-L62 VanDerWaalsContact C-N 3.31Å; M60-L62 PolarHBondContact O-N 2.85Å; L62-L64 VanDerWaalsContact C-N 3.35Å; L62-L64 PolarHBondContact O-N 3.39Å; L62-L65 PolarHBondContact O-N 2.81Å; L62-V66 HydrophobicContact CD1-CG2 4.48Å; L62-V66 WeakPolarHBondContact O-CB 3.26Å; L62-V66 WeakPolarHBondContact O-CG2 3.42Å; L62-V66 PolarHBondContact O-N 2.99Å |
| 63 | Y | 83.3 | Confident | 82.1 | Confident | 169 Ų | 169 | 100.4 Ų | 100.4 | 66% | 0.663 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.2 | -42.1 | 174 | -79.4 | -67.5 | 0 | 0 | 0 | 112.5 | P59 M60 V66 S67 | P59-Y63 HydrophobicContact CB-CD2 3.72Å; P59-Y63 HydrophobicContact CB-CE2 3.54Å; P59-Y63 HydrophobicContact CG-CD2 4.09Å; P59-Y63 HydrophobicContact CG-CE2 3.79Å; P59-Y63 VanDerWaalsContact O-CD2 3.26Å; P59-Y63 WeakPolarHBondContact O-CD2 3.27Å; P59-Y63 PolarHBondContact O-N 3.23Å; M60-Y63 PolarHBondContact O-N 2.85Å; Y63-V66 PolarHBondContact O-N 2.96Å; Y63-S67 WeakPolarHBondContact O-CB 3.2Å; Y63-S67 PolarHBondContact O-N 3.46Å; Y63-S67 PolarHBondContact O-OG 3.42Å |
| 64 | L | 84.2 | Confident | 83.3 | Confident | 116 Ų | 116 | 97.7 Ų | 97.7 | 61% | 0.607 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.6 | -38.9 | 178.1 | -158.5 | 144 | 0 | 0 | 0 | 111.5 | M60 P61 L62 S67 F68 | M60-L64 WeakPolarHBondContact O-CB 3.44Å; M60-L64 PolarHBondContact O-N 3.05Å; P61-L64 PolarHBondContact O-N 3.47Å; L62-L64 VanDerWaalsContact C-N 3.35Å; L62-L64 PolarHBondContact O-N 3.39Å; L64-S67 WeakPolarHBondContact CA-OG 3.32Å; L64-S67 PolarHBondContact O-OG 2.81Å; L64-F68 WeakPolarHBondContact O-CB 3.42Å; L64-F68 PolarHBondContact O-N 3.29Å |
| 65 | L | 85.9 | Confident | 84.2 | Confident | 116 Ų | 116 | 94.7 Ų | 94.7 | 61% | 0.607 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -67.6 | -42.9 | 175.8 | -173.9 | 66.2 | 0 | 0 | 0 | 112 | P61 L62 G69 | P61-L65 WeakPolarHBondContact O-CB 3.43Å; P61-L65 PolarHBondContact O-N 3.37Å; L62-L65 PolarHBondContact O-N 2.81Å; L65-G69 PolarHBondContact O-N 2.87Å |
| 66 | V | 89.9 | Confident | 85.1 | Confident | 83 Ų | 83 | 91.9 Ų | 91.9 | 50% | 0.503 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.2 | -49 | 177.7 | 171.2 | 0 | 0 | 0 | 0 | 110.3 | L62 Y63 G69 C70 | L62-V66 HydrophobicContact CD1-CG2 4.48Å; L62-V66 WeakPolarHBondContact O-CB 3.26Å; L62-V66 WeakPolarHBondContact O-CG2 3.42Å; L62-V66 PolarHBondContact O-N 2.99Å; Y63-V66 PolarHBondContact O-N 2.96Å; V66-G69 PolarHBondContact O-N 2.94Å; V66-C70 PolarHBondContact O-N 3.43Å; V66-C70 PolarHBondContact O-SG 2.99Å |
| 67 | S | 90.1 | Very high | 85.8 | Confident | 70 Ų | 70 | 89.4 Ų | 89.4 | 49% | 0.49 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.1 | -42.8 | 177.9 | 55.7 | 0 | 0 | 0 | 0 | 112.3 | Y63 L64 G69 C70 Y71 | Y63-S67 WeakPolarHBondContact O-CB 3.2Å; Y63-S67 PolarHBondContact O-N 3.46Å; Y63-S67 PolarHBondContact O-OG 3.42Å; L64-S67 WeakPolarHBondContact CA-OG 3.32Å; L64-S67 PolarHBondContact O-OG 2.81Å; S67-G69 VanDerWaalsContact C-N 3.35Å; S67-G69 PolarHBondContact O-N 3.34Å; S67-C70 PolarHBondContact O-N 2.88Å; S67-Y71 VanDerWaalsContact O-CB 3.32Å; S67-Y71 WeakPolarHBondContact O-CB 3.12Å; S67-Y71 PolarHBondContact O-N 3.32Å |
| 68 | F | 89.9 | Confident | 86.3 | Confident | 132 Ų | 132 | 97 Ų | 97 | 58% | 0.579 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62 | -41.9 | 173.6 | -178.6 | -100.1 | 0 | 0 | 0 | 112 | L64 Y71 S72 | L64-F68 WeakPolarHBondContact O-CB 3.42Å; L64-F68 PolarHBondContact O-N 3.29Å; F68-Y71 PolarHBondContact O-N 3.14Å; F68-S72 VanDerWaalsContact O-CB 3.27Å; F68-S72 WeakPolarHBondContact O-CB 3.48Å; F68-S72 PolarHBondContact O-N 3.32Å |
| 69 | G | 91 | Very high | 86.7 | Confident | 36 Ų | 36 | 97.6 Ų | 97.6 | 37% | 0.371 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.8 | -49.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L65 V66 S67 Y71 S72 L73 | L65-G69 PolarHBondContact O-N 2.87Å; V66-G69 PolarHBondContact O-N 2.94Å; S67-G69 VanDerWaalsContact C-N 3.35Å; S67-G69 PolarHBondContact O-N 3.34Å; G69-Y71 PolarHBondContact O-N 3.19Å; G69-S72 PolarHBondContact O-N 3.37Å; G69-L73 WeakPolarHBondContact O-CB 3.2Å; G69-L73 PolarHBondContact O-N 3.12Å |
| 70 | C | 93.3 | Very high | 86.7 | Confident | 81 Ų | 81 | 100.5 Ų | 100.5 | 55% | 0.547 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.2 | -44 | 175.5 | -68.7 | 0 | 0 | 0 | 0 | 112 | V66 S67 L73 A74 | V66-C70 PolarHBondContact O-N 3.43Å; V66-C70 PolarHBondContact O-SG 2.99Å; S67-C70 PolarHBondContact O-N 2.88Å; C70-L73 PolarHBondContact O-N 3.3Å; C70-A74 VanDerWaalsContact O-CB 3.28Å; C70-A74 WeakPolarHBondContact O-CB 3.3Å; C70-A74 PolarHBondContact O-N 3.48Å |
| 71 | Y | 91.1 | Very high | 86.6 | Confident | 162 Ų | 162 | 98 Ų | 98 | 64% | 0.635 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.2 | -43.5 | 178.1 | -179 | -96.8 | 0 | 0 | 0 | 112.4 | S67 F68 G69 A74 T75 | S67-Y71 VanDerWaalsContact O-CB 3.32Å; S67-Y71 WeakPolarHBondContact O-CB 3.12Å; S67-Y71 PolarHBondContact O-N 3.32Å; F68-Y71 PolarHBondContact O-N 3.14Å; G69-Y71 PolarHBondContact O-N 3.19Å; Y71-A74 PolarHBondContact O-N 2.84Å; Y71-T75 WeakPolarHBondContact O-CB 3.4Å; Y71-T75 PolarHBondContact O-N 3.16Å; Y71-T75 PolarHBondContact O-OG1 3.39Å |
| 72 | S | 91.6 | Very high | 86.1 | Confident | 54 Ų | 54 | 99 Ų | 99 | 38% | 0.378 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.4 | -47.5 | 175.8 | -175.7 | 0 | 0 | 0 | 0 | 110.8 | F68 G69 A74 T75 V76 | F68-S72 VanDerWaalsContact O-CB 3.27Å; F68-S72 WeakPolarHBondContact O-CB 3.48Å; F68-S72 PolarHBondContact O-N 3.32Å; G69-S72 PolarHBondContact O-N 3.37Å; S72-A74 PolarHBondContact O-N 2.82Å; S72-T75 PolarHBondContact O-N 3.11Å; S72-V76 WeakPolarHBondContact O-CB 3.05Å; S72-V76 VanDerWaalsContact O-CG2 3.32Å; S72-V76 WeakPolarHBondContact O-CG2 3.45Å; S72-V76 PolarHBondContact O-N 2.82Å |
| 73 | L | 91.3 | Very high | 84.9 | Confident | 138 Ų | 138 | 101.4 Ų | 101.4 | 72% | 0.723 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.1 | -41.7 | 179.2 | -151.9 | 79.7 | 0 | 0 | 0 | 112 | G69 C70 G77 | G69-L73 WeakPolarHBondContact O-CB 3.2Å; G69-L73 PolarHBondContact O-N 3.12Å; C70-L73 PolarHBondContact O-N 3.3Å; L73-G77 WeakPolarHBondContact O-CA 3.4Å; L73-G77 PolarHBondContact O-N 3.34Å |
| 74 | A | 89.8 | Confident | 83.6 | Confident | 65 Ų | 65 | 98.8 Ų | 98.8 | 54% | 0.537 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | C70 Y71 S72 Y78 | C70-A74 VanDerWaalsContact O-CB 3.28Å; C70-A74 WeakPolarHBondContact O-CB 3.3Å; C70-A74 PolarHBondContact O-N 3.48Å; Y71-A74 PolarHBondContact O-N 2.84Å; S72-A74 PolarHBondContact O-N 2.82Å; A74-Y78 WeakPolarHBondContact O-CB 3.37Å; A74-Y78 PolarHBondContact O-N 2.9Å |
| 75 | T | 86.8 | Confident | 82.2 | Confident | 49 Ų | 49 | 97.6 Ų | 97.6 | 30% | 0.301 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -67.1 | -45.1 | 179.5 | -58.1 | 0 | 0 | 0 | 0 | 111.7 | Y71 S72 R79 | Y71-T75 WeakPolarHBondContact O-CB 3.4Å; Y71-T75 PolarHBondContact O-N 3.16Å; Y71-T75 PolarHBondContact O-OG1 3.39Å; S72-T75 PolarHBondContact O-N 3.11Å; T75-R79 WeakPolarHBondContact O-CG 3.29Å; T75-R79 PolarHBondContact O-N 3.44Å |
| 76 | V | 89.4 | Confident | 80.7 | Confident | 83 Ų | 83 | 95.2 Ų | 95.2 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.8 | -45.3 | 177 | 174.4 | 0 | 0 | 0 | 0 | 110.1 | S72 Y78 R79 V80 | S72-V76 WeakPolarHBondContact O-CB 3.05Å; S72-V76 VanDerWaalsContact O-CG2 3.32Å; S72-V76 WeakPolarHBondContact O-CG2 3.45Å; S72-V76 PolarHBondContact O-N 2.82Å; V76-Y78 PolarHBondContact O-N 3.39Å; V76-R79 PolarHBondContact O-N 2.89Å; V76-V80 HydrophobicContact CG1-CG2 4.27Å; V76-V80 VanDerWaalsContact O-CG2 3.28Å; V76-V80 WeakPolarHBondContact O-CG2 3.36Å; V76-V80 PolarHBondContact O-N 3.42Å |
| 77 | G | 87.8 | Confident | 79.2 | Confident | 38 Ų | 38 | 97.4 Ų | 97.4 | 39% | 0.392 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -58.8 | -44.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L73 V80 A81 | L73-G77 WeakPolarHBondContact O-CA 3.4Å; L73-G77 PolarHBondContact O-N 3.34Å; G77-V80 PolarHBondContact O-N 3.12Å; G77-A81 VanDerWaalsContact O-CB 3.3Å; G77-A81 WeakPolarHBondContact O-CB 3.36Å; G77-A81 PolarHBondContact O-N 3.24Å |
| 78 | Y | 82.4 | Confident | 77.8 | Confident | 169 Ų | 169 | 100.4 Ų | 100.4 | 66% | 0.663 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.1 | -46.8 | 174.5 | -177.6 | -93.2 | 0 | 0 | 0 | 111.7 | A74 V76 V80 A81 T82 | A74-Y78 WeakPolarHBondContact O-CB 3.37Å; A74-Y78 PolarHBondContact O-N 2.9Å; V76-Y78 PolarHBondContact O-N 3.39Å; Y78-V80 PolarHBondContact O-N 3.45Å; Y78-A81 PolarHBondContact O-N 3.49Å; Y78-T82 PolarHBondContact O-N 2.62Å; Y78-T82 PolarHBondContact O-OG1 3.02Å; Y78-T82 VanDerWaalsContact O-OG1 3.13Å |
| 79 | R | 81.2 | Confident | 76.3 | Confident | 186 Ų | 186 | 96.6 Ų | 96.6 | 70% | 0.702 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65 | -37.2 | 178.4 | -72.7 | -172.7 | -177.9 | -142.9 | 1.9 | 113.3 | T75 V76 F83 | T75-R79 WeakPolarHBondContact O-CG 3.29Å; T75-R79 PolarHBondContact O-N 3.44Å; V76-R79 PolarHBondContact O-N 2.89Å; R79-F83 PolarHBondContact O-N 3.23Å |
| 80 | V | 81.4 | Confident | 74.8 | Confident | 98 Ų | 98 | 97.2 Ų | 97.2 | 59% | 0.594 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -69.8 | -41.1 | 175.9 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | V76 G77 Y78 F83 N84 | V76-V80 HydrophobicContact CG1-CG2 4.27Å; V76-V80 VanDerWaalsContact O-CG2 3.28Å; V76-V80 WeakPolarHBondContact O-CG2 3.36Å; V76-V80 PolarHBondContact O-N 3.42Å; G77-V80 PolarHBondContact O-N 3.12Å; Y78-V80 PolarHBondContact O-N 3.45Å; V80-F83 WeakPolarHBondContact O-CB 3.49Å; V80-F83 PolarHBondContact O-N 2.66Å; V80-N84 PolarHBondContact O-N 3.21Å |
| 81 | A | 76.3 | Confident | 73.4 | Confident | 53 Ų | 53 | 101.2 Ų | 101.2 | 44% | 0.438 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.5 | -44.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | G77 Y78 F83 N84 D85 | G77-A81 VanDerWaalsContact O-CB 3.3Å; G77-A81 WeakPolarHBondContact O-CB 3.36Å; G77-A81 PolarHBondContact O-N 3.24Å; Y78-A81 PolarHBondContact O-N 3.49Å; A81-F83 PolarHBondContact O-N 2.85Å; A81-N84 WeakPolarHBondContact O-CA 3.47Å; A81-N84 VanDerWaalsContact O-CB 3.25Å; A81-N84 WeakPolarHBondContact O-CB 3.29Å; A81-N84 PolarHBondContact O-N 3.26Å; A81-D85 PolarHBondContact O-N 3.06Å |
| 82 | T | 68.6 | Low | 72.1 | Confident | 66 Ų | 66 | 99.4 Ų | 99.4 | 41% | 0.405 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.6 | -28.5 | 173.9 | -62.4 | 0 | 0 | 0 | 0 | 113 | Y78 N84 D85 | Y78-T82 PolarHBondContact O-N 2.62Å; Y78-T82 PolarHBondContact O-OG1 3.02Å; Y78-T82 VanDerWaalsContact O-OG1 3.13Å; T82-N84 VanDerWaalsContact C-N 3.31Å; T82-D85 PolarHBondContact O-N 3.35Å |
| 83 | F | 57.7 | Low | 70.8 | Confident | 165 Ų | 165 | 101.8 Ų | 101.8 | 72% | 0.724 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -71.9 | -25.3 | 173.5 | -156.7 | -93.2 | 0 | 0 | 0 | 112.6 | R79 V80 A81 C86 | R79-F83 PolarHBondContact O-N 3.23Å; V80-F83 WeakPolarHBondContact O-CB 3.49Å; V80-F83 PolarHBondContact O-N 2.66Å; A81-F83 PolarHBondContact O-N 2.85Å; F83-C86 VanDerWaalsContact O-CB 3.31Å; F83-C86 WeakPolarHBondContact O-CB 3.43Å; F83-C86 PolarHBondContact O-N 3.41Å |
| 84 | N | 55.9 | Low | 69.8 | Low | 115 Ų | 115 | 101.4 Ų | 101.4 | 62% | 0.615 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -71.1 | -32.4 | 170.9 | -177.2 | 89 | 0 | 0 | 0 | 111.9 | V80 A81 T82 C86 D87 | V80-N84 PolarHBondContact O-N 3.21Å; A81-N84 WeakPolarHBondContact O-CA 3.47Å; A81-N84 VanDerWaalsContact O-CB 3.25Å; A81-N84 WeakPolarHBondContact O-CB 3.29Å; A81-N84 PolarHBondContact O-N 3.26Å; T82-N84 VanDerWaalsContact C-N 3.31Å; N84-C86 PolarHBondContact O-N 3.43Å; N84-C86 VanDerWaalsContact O-N 3.17Å; N84-D87 PolarHBondContact O-N 2.88Å; N84-D87 VanDerWaalsContact O-N 3.16Å |
| 85 | D | 55.7 | Low | 69.1 | Low | 90 Ų | 90 | 104.4 Ų | 104.4 | 48% | 0.481 | 54% | 0.541 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.5 | -8.5 | 174.8 | -63.3 | -40.2 | 0 | 0 | 0 | 113.4 | A81 T82 D87 E88 A89 | A81-D85 PolarHBondContact O-N 3.06Å; T82-D85 PolarHBondContact O-N 3.35Å; D85-D87 PolarHBondContact O-N 3.15Å; D85-E88 PolarHBondContact O-N 2.8Å; D85-A89 PolarHBondContact O-N 2.92Å |
| 86 | C | 54.5 | Low | 68.5 | Low | 66 Ų | 66 | 107.4 Ų | 107.4 | 45% | 0.446 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.5 | -23.5 | 168.7 | -76.8 | 0 | 0 | 0 | 0 | 112.7 | F83 N84 E88 A90 | F83-C86 VanDerWaalsContact O-CB 3.31Å; F83-C86 WeakPolarHBondContact O-CB 3.43Å; F83-C86 PolarHBondContact O-N 3.41Å; N84-C86 PolarHBondContact O-N 3.43Å; N84-C86 VanDerWaalsContact O-N 3.17Å; C86-E88 VanDerWaalsContact C-N 3.34Å; C86-A90 WeakPolarHBondContact O-CB 3.44Å; C86-A90 PolarHBondContact O-N 3.33Å |
| 87 | D | 58 | Low | 67.9 | Low | 129 Ų | 129 | 107.2 Ų | 107.2 | 69% | 0.69 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.2 | -38.1 | 176.3 | -115.2 | -34.9 | 0 | 0 | 0 | 111.1 | N84 D85 R91 | N84-D87 PolarHBondContact O-N 2.88Å; N84-D87 VanDerWaalsContact O-N 3.16Å; D85-D87 PolarHBondContact O-N 3.15Å; D87-R91 VanDerWaalsContact O-CB 3.28Å; D87-R91 WeakPolarHBondContact O-CB 3.31Å; D87-R91 PolarHBondContact O-N 3.34Å |
| 88 | E | 59.3 | Low | 67.4 | Low | 134 Ų | 134 | 112 Ų | 112 | 63% | 0.626 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -73.1 | -46.1 | -179.7 | -160.2 | 172.4 | -147.5 | 0 | 0 | 111.4 | D85 C86 A90 R91 E92 | D85-E88 PolarHBondContact O-N 2.8Å; C86-E88 VanDerWaalsContact C-N 3.34Å; E88-A90 PolarHBondContact O-N 2.79Å; E88-R91 PolarHBondContact O-N 3.5Å; E88-E92 PolarHBondContact O-N 3.39Å; E88-E92 VanDerWaalsContact O-N 3.09Å |
| 89 | A | 59 | Low | 67.2 | Low | 52 Ų | 52 | 110.7 Ų | 110.7 | 43% | 0.43 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.2 | -35.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | D85 R91 L93 | D85-A89 PolarHBondContact O-N 2.92Å; A89-R91 VanDerWaalsContact C-N 3.34Å; A89-L93 WeakPolarHBondContact O-CB 3.28Å; A89-L93 PolarHBondContact O-N 3.45Å; A89-L93 VanDerWaalsContact O-N 3.11Å |
| 90 | A | 60.9 | Low | 67 | Low | 48 Ų | 48 | 104.2 Ų | 104.2 | 40% | 0.397 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -68 | -34.4 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | C86 E88 Q94 | C86-A90 WeakPolarHBondContact O-CB 3.44Å; C86-A90 PolarHBondContact O-N 3.33Å; E88-A90 PolarHBondContact O-N 2.79Å; A90-Q94 WeakPolarHBondContact O-CB 3.18Å; A90-Q94 WeakPolarHBondContact O-CG 3.34Å; A90-Q94 PolarHBondContact O-N 3.47Å |
| 91 | R | 62.1 | Low | 66.7 | Low | 166 Ų | 166 | 105.2 Ų | 105.2 | 63% | 0.626 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -68.7 | -40.7 | 177.6 | -154.8 | 179 | 77.5 | -163.4 | -0.8 | 111.9 | D87 E88 A89 Q94 E95 | D87-R91 VanDerWaalsContact O-CB 3.28Å; D87-R91 WeakPolarHBondContact O-CB 3.31Å; D87-R91 PolarHBondContact O-N 3.34Å; E88-R91 PolarHBondContact O-N 3.5Å; A89-R91 VanDerWaalsContact C-N 3.34Å; R91-Q94 PolarHBondContact O-N 3.01Å; R91-E95 PolarHBondContact O-N 3.44Å |
| 92 | E | 65.6 | Low | 66.9 | Low | 124 Ų | 124 | 106.5 Ų | 106.5 | 58% | 0.579 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.8 | -42.8 | 175.1 | -165.8 | 177.4 | -169.1 | 0 | 0 | 111.6 | E88 Q94 E95 Q96 | E88-E92 PolarHBondContact O-N 3.39Å; E88-E92 VanDerWaalsContact O-N 3.09Å; E92-Q94 PolarHBondContact O-N 2.85Å; E92-E95 PolarHBondContact O-N 3.07Å; E92-Q96 WeakPolarHBondContact O-CG 3.26Å; E92-Q96 PolarHBondContact O-N 2.8Å |
| 93 | L | 62.6 | Low | 67.3 | Low | 103 Ų | 103 | 106.7 Ų | 106.7 | 54% | 0.539 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.7 | -37.2 | 172.8 | -92.5 | 148.3 | 0 | 0 | 0 | 112.8 | A89 Q96 I97 | A89-L93 WeakPolarHBondContact O-CB 3.28Å; A89-L93 PolarHBondContact O-N 3.45Å; A89-L93 VanDerWaalsContact O-N 3.11Å; L93-Q96 PolarHBondContact O-N 2.82Å; L93-I97 WeakPolarHBondContact O-CD1 3.18Å; L93-I97 VanDerWaalsContact O-CG1 3.23Å; L93-I97 WeakPolarHBondContact O-CG1 3.27Å; L93-I97 PolarHBondContact O-N 2.99Å |
| 94 | Q | 70.4 | Confident | 68 | Low | 130 Ų | 130 | 101.8 Ų | 101.8 | 61% | 0.607 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.2 | -39.1 | 175 | -78 | -81.6 | -61.7 | 0 | 0 | 112.3 | A90 R91 E92 I97 K98 | A90-Q94 WeakPolarHBondContact O-CB 3.18Å; A90-Q94 WeakPolarHBondContact O-CG 3.34Å; A90-Q94 PolarHBondContact O-N 3.47Å; R91-Q94 PolarHBondContact O-N 3.01Å; E92-Q94 PolarHBondContact O-N 2.85Å; Q94-I97 PolarHBondContact O-N 3.06Å; Q94-K98 WeakPolarHBondContact O-CB 3.37Å; Q94-K98 PolarHBondContact O-N 2.84Å |
| 95 | E | 76 | Confident | 68.9 | Low | 129 Ų | 129 | 105.2 Ų | 105.2 | 60% | 0.603 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.9 | -45.8 | 172.7 | -89.7 | -179.9 | 159.4 | 0 | 0 | 111.4 | R91 E92 I97 K98 E99 | R91-E95 PolarHBondContact O-N 3.44Å; E92-E95 PolarHBondContact O-N 3.07Å; E95-I97 VanDerWaalsContact C-N 3.31Å; E95-I97 PolarHBondContact O-N 3.33Å; E95-K98 WeakPolarHBondContact O-CB 3.05Å; E95-K98 PolarHBondContact O-N 2.9Å; E95-K98 VanDerWaalsContact O-N 3.11Å; E95-E99 PolarHBondContact O-N 2.79Å |
| 96 | Q | 73.5 | Confident | 69.9 | Low | 111 Ų | 111 | 108.5 Ų | 108.5 | 52% | 0.519 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.6 | -38.9 | 175.5 | -69.3 | -179.3 | 46.9 | 0 | 0 | 112.4 | E92 L93 A100 | E92-Q96 WeakPolarHBondContact O-CG 3.26Å; E92-Q96 PolarHBondContact O-N 2.8Å; L93-Q96 PolarHBondContact O-N 2.82Å; Q96-A100 VanDerWaalsContact O-CB 3.26Å; Q96-A100 WeakPolarHBondContact O-CB 3.22Å; Q96-A100 PolarHBondContact O-N 2.9Å |
| 97 | I | 76.6 | Confident | 70.9 | Confident | 80 Ų | 80 | 112.3 Ų | 112.3 | 41% | 0.41 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -65.2 | -39.9 | 175.1 | -69.4 | 163.6 | 0 | 0 | 0 | 111.2 | L93 Q94 E95 K101 | L93-I97 WeakPolarHBondContact O-CD1 3.18Å; L93-I97 VanDerWaalsContact O-CG1 3.23Å; L93-I97 WeakPolarHBondContact O-CG1 3.27Å; L93-I97 PolarHBondContact O-N 2.99Å; Q94-I97 PolarHBondContact O-N 3.06Å; E95-I97 VanDerWaalsContact C-N 3.31Å; E95-I97 PolarHBondContact O-N 3.33Å; I97-K101 HydrophobicContact CG2-CD 4.44Å; I97-K101 WeakPolarHBondContact O-CB 3.33Å; I97-K101 WeakPolarHBondContact O-CG 3.37Å; I97-K101 PolarHBondContact O-N 2.93Å |
| 98 | K | 78.1 | Confident | 71.4 | Confident | 137 Ų | 137 | 109.1 Ų | 109.1 | 60% | 0.596 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -67.4 | -44.1 | 179.7 | -170.4 | -179.2 | 177.7 | -173.8 | 0 | 111.2 | Q94 E95 K101 E102 | Q94-K98 WeakPolarHBondContact O-CB 3.37Å; Q94-K98 PolarHBondContact O-N 2.84Å; E95-K98 WeakPolarHBondContact O-CB 3.05Å; E95-K98 PolarHBondContact O-N 2.9Å; E95-K98 VanDerWaalsContact O-N 3.11Å; K98-K101 PolarHBondContact O-N 3.2Å; K98-E102 PolarHBondContact O-N 3.27Å |
| 99 | E | 77.6 | Confident | 71.3 | Confident | 142 Ų | 142 | 108.2 Ų | 108.2 | 66% | 0.664 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.2 | -45 | 176.3 | -168.2 | 172.1 | -160 | 0 | 0 | 111.2 | E95 K101 E102 D103 | E95-E99 PolarHBondContact O-N 2.79Å; E99-K101 VanDerWaalsContact C-N 3.32Å; E99-K101 PolarHBondContact O-N 3.29Å; E99-E102 PolarHBondContact O-N 3.29Å; E99-D103 WeakPolarHBondContact O-CB 3.37Å; E99-D103 PolarHBondContact O-N 3.29Å |
| 100 | A | 77.6 | Confident | 71 | Confident | 51 Ų | 51 | 115.7 Ų | 115.7 | 42% | 0.421 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.4 | -39.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q96 D103 L104 | Q96-A100 VanDerWaalsContact O-CB 3.26Å; Q96-A100 WeakPolarHBondContact O-CB 3.22Å; Q96-A100 PolarHBondContact O-N 2.9Å; A100-D103 PolarHBondContact O-N 3.3Å; A100-L104 WeakPolarHBondContact O-CB 3.22Å; A100-L104 WeakPolarHBondContact O-CD1 3.21Å; A100-L104 WeakPolarHBondContact O-CG 3.35Å; A100-L104 PolarHBondContact O-N 3.02Å |
| 101 | K | 75.4 | Confident | 70.6 | Confident | 118 Ų | 118 | 123.1 Ų | 123.1 | 51% | 0.513 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65.1 | -41.9 | 174.2 | -83.6 | -176.9 | 175.9 | -178 | 0 | 112.5 | I97 K98 E99 D103 L104 R105 M111 | I97-K101 HydrophobicContact CG2-CD 4.44Å; I97-K101 WeakPolarHBondContact O-CB 3.33Å; I97-K101 WeakPolarHBondContact O-CG 3.37Å; I97-K101 PolarHBondContact O-N 2.93Å; K98-K101 PolarHBondContact O-N 3.2Å; E99-K101 VanDerWaalsContact C-N 3.32Å; E99-K101 PolarHBondContact O-N 3.29Å; K101-D103 VanDerWaalsContact C-N 3.33Å; K101-L104 PolarHBondContact O-N 3.38Å; K101-R105 WeakPolarHBondContact O-CB 3.47Å; K101-R105 PolarHBondContact O-N 3.2Å; K101-M111 HydrophobicContact CG-SD 4.19Å |
| 102 | E | 79.3 | Confident | 71 | Confident | 81 Ų | 81 | 121 Ų | 121 | 38% | 0.379 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.3 | -38.2 | 176.6 | -77.5 | -171.6 | -177.1 | 0 | 0 | 112 | K98 E99 R105 K106 | K98-E102 PolarHBondContact O-N 3.27Å; E99-E102 PolarHBondContact O-N 3.29Å; E102-R105 PolarHBondContact O-N 3.41Å; E102-K106 WeakPolarHBondContact O-CB 3.48Å; E102-K106 VanDerWaalsContact O-CG 3.31Å; E102-K106 WeakPolarHBondContact O-CG 3.46Å; E102-K106 PolarHBondContact O-N 3.06Å |
| 103 | D | 78.1 | Confident | 71.3 | Confident | 69 Ų | 69 | 120.8 Ų | 120.8 | 37% | 0.369 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -69.3 | -38.2 | 177.7 | -146.4 | 51.3 | 0 | 0 | 0 | 111.9 | E99 A100 K101 K106 K107 | E99-D103 WeakPolarHBondContact O-CB 3.37Å; E99-D103 PolarHBondContact O-N 3.29Å; A100-D103 PolarHBondContact O-N 3.3Å; K101-D103 VanDerWaalsContact C-N 3.33Å; D103-K106 PolarHBondContact O-N 3.33Å; D103-K107 WeakPolarHBondContact O-CB 3.5Å; D103-K107 WeakPolarHBondContact O-CG 3.38Å; D103-K107 PolarHBondContact O-N 3.39Å; D103-K107 IonicContact OD2-NZ 2.8Å; D103-K107 PolarHBondContact OD2-NZ 3.03Å |
| 104 | L | 72.4 | Confident | 71.8 | Confident | 63 Ų | 63 | 121.8 Ų | 121.8 | 33% | 0.33 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -64.1 | -39.7 | 170.7 | -80 | 159.9 | 0 | 0 | 0 | 112.3 | A100 K101 K107 G108 L109 M111 | A100-L104 WeakPolarHBondContact O-CB 3.22Å; A100-L104 WeakPolarHBondContact O-CD1 3.21Å; A100-L104 WeakPolarHBondContact O-CG 3.35Å; A100-L104 PolarHBondContact O-N 3.02Å; K101-L104 PolarHBondContact O-N 3.38Å; L104-K107 CarbonylContact O-C 3.58Å; L104-K107 PolarHBondContact O-N 3.42Å; L104-G108 PolarHBondContact O-N 3.02Å; L104-L109 HydrophobicContact CD2-CD1 3.77Å; L104-L109 PolarHBondContact O-N 3.5Å; L104-M111 HydrophobicContact CD1-CE 3.87Å |
| 105 | R | 74.1 | Confident | 71.8 | Confident | 186 Ų | 186 | 121.3 Ų | 121.3 | 70% | 0.702 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.3 | -40.3 | 175.2 | -170.6 | 176 | 68.5 | 134.2 | -2 | 111.8 | K101 E102 K107 G108 | K101-R105 WeakPolarHBondContact O-CB 3.47Å; K101-R105 PolarHBondContact O-N 3.2Å; E102-R105 PolarHBondContact O-N 3.41Å; R105-K107 VanDerWaalsContact C-N 3.3Å; R105-K107 PolarHBondContact O-N 2.9Å; R105-G108 PolarHBondContact O-N 2.91Å; R105-G108 VanDerWaalsContact O-N 3.13Å |
| 106 | K | 75.8 | Confident | 71.6 | Confident | 159 Ų | 159 | 120.8 Ų | 120.8 | 69% | 0.691 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64 | -35 | 173.5 | -74.9 | 173.3 | -173.3 | 170.3 | 0 | 111.8 | E102 D103 G108 | E102-K106 WeakPolarHBondContact O-CB 3.48Å; E102-K106 VanDerWaalsContact O-CG 3.31Å; E102-K106 WeakPolarHBondContact O-CG 3.46Å; E102-K106 PolarHBondContact O-N 3.06Å; D103-K106 PolarHBondContact O-N 3.33Å; K106-G108 PolarHBondContact O-N 3.31Å |
| 107 | K | 76.5 | Confident | 71.5 | Confident | 147 Ų | 147 | 121.5 Ų | 121.5 | 64% | 0.639 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | 4.9 | 174.2 | -73.1 | 169.7 | -179.2 | 153.6 | 0 | 113.9 | D103 L104 R105 L109 | D103-K107 WeakPolarHBondContact O-CB 3.5Å; D103-K107 WeakPolarHBondContact O-CG 3.38Å; D103-K107 PolarHBondContact O-N 3.39Å; D103-K107 IonicContact OD2-NZ 2.8Å; D103-K107 PolarHBondContact OD2-NZ 3.03Å; L104-K107 CarbonylContact O-C 3.58Å; L104-K107 PolarHBondContact O-N 3.42Å; R105-K107 VanDerWaalsContact C-N 3.3Å; R105-K107 PolarHBondContact O-N 2.9Å; K107-L109 VanDerWaalsContact C-N 3.32Å; K107-L109 PolarHBondContact O-N 3.49Å |
| 108 | G | 69.1 | Low | 71.1 | Confident | 61 Ų | 61 | 124.4 Ų | 124.4 | 63% | 0.629 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 80.6 | 6.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | L104 R105 K106 K110 | L104-G108 PolarHBondContact O-N 3.02Å; R105-G108 PolarHBondContact O-N 2.91Å; R105-G108 VanDerWaalsContact O-N 3.13Å; K106-G108 PolarHBondContact O-N 3.31Å; G108-K110 PolarHBondContact O-N 3.35Å |
| 109 | L | 56.1 | Low | 70.5 | Confident | 115 Ų | 115 | 123.5 Ų | 123.5 | 60% | 0.602 | 60% | 0.604 | S | S | * | * | trans | -83.5 | 107.4 | 173.9 | -73.5 | 162.9 | 0 | 0 | 0 | 108.6 | L104 K107 M111 | L104-L109 HydrophobicContact CD2-CD1 3.77Å; L104-L109 PolarHBondContact O-N 3.5Å; K107-L109 VanDerWaalsContact C-N 3.32Å; K107-L109 PolarHBondContact O-N 3.49Å; L109-M111 PolarHBondContact O-N 3.49Å | ||
| 110 | K | 54 | Low | 70 | Confident | 209 Ų | 209 | 121.9 Ų | 121.9 | 91% | 0.909 | 60% | 0.599 | S | S | * | * | trans | -73 | 116.5 | 172.4 | -66.5 | -178.6 | 178.3 | 175.1 | 0 | 108.6 | G108 | G108-K110 PolarHBondContact O-N 3.35Š| ||
| 111 | M | 51 | Low | 69.3 | Low | 204 Ų | 204 | 128.4 Ų | 128.4 | 100% | 1.005 | 62% | 0.615 | S | S | * | * | trans | -81.7 | 0 | 157.3 | -76.6 | -178.3 | 173.9 | 0 | 0 | 109.6 | K101 L104 L109 | K101-M111 HydrophobicContact CG-SD 4.19Å; L104-M111 HydrophobicContact CD1-CE 3.87Å; L109-M111 PolarHBondContact O-N 3.49Å |
Retrieved 111 of 111 residues in 153.9 ms
(Link to these results)