| 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 | 51.6 | Low | 67.5 | Low | 219 Ų | 219 | 108 Ų | 108 | 100% | 1.079 | 58% | 0.58 | S | S | * | * | 0 | -23.9 | 0 | -141.7 | 157.2 | 175 | 0 | 0 | 113.2 | L3 | M1-L3 PolarHBondContact O-N 3.22Š| |||
| 2 | S | 57.7 | Low | 67.9 | Low | 76 Ų | 76 | 103.3 Ų | 103.3 | 53% | 0.531 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -70.5 | -26.6 | -177.5 | 67.1 | 0 | 0 | 0 | 0 | 116.8 | N4 E5 H6 | S2-N4 PolarHBondContact O-N 3.28Å; S2-E5 PolarHBondContact O-N 2.79Å; S2-H6 PolarHBondContact O-CD2 3.44Å; S2-H6 PolarHBondContact O-N 3.46Å |
| 3 | L | 60.2 | Low | 68.4 | Low | 152 Ų | 152 | 104 Ų | 104 | 80% | 0.796 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.9 | -34.3 | 177.2 | -91.8 | 166.7 | 0 | 0 | 0 | 112.5 | M1 S7 | M1-L3 PolarHBondContact O-N 3.22Å; L3-S7 PolarHBondContact O-N 3.42Å |
| 4 | N | 67.3 | Low | 69.3 | Low | 105 Ų | 105 | 110.1 Ų | 110.1 | 56% | 0.561 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -71.6 | -37.7 | -179.6 | -153.4 | 38.3 | 0 | 0 | 0 | 110.9 | S2 S7 L8 | S2-N4 PolarHBondContact O-N 3.28Å; N4-S7 PolarHBondContact O-N 3.4Å; N4-S7 PolarHBondContact O-OG 3.12Å; N4-L8 WeakPolarHBondContact O-CB 3.44Å; N4-L8 VanDerWaalsContact O-CG 3.25Å; N4-L8 WeakPolarHBondContact O-CG 3.3Å; N4-L8 PolarHBondContact O-N 3.49Å |
| 5 | E | 66 | Low | 69.9 | Low | 125 Ų | 125 | 112.9 Ų | 112.9 | 58% | 0.584 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -66.6 | -44.7 | 178.5 | -64.8 | -171 | 131.2 | 0 | 0 | 112.5 | S2 S7 L8 Q9 | S2-E5 PolarHBondContact O-N 2.79Å; E5-S7 VanDerWaalsContact C-N 3.29Å; E5-S7 PolarHBondContact O-N 3.21Å; E5-L8 PolarHBondContact O-N 2.96Å; E5-Q9 WeakPolarHBondContact O-CB 3.43Å; E5-Q9 PolarHBondContact O-N 2.97Å |
| 6 | H | 66.8 | Low | 70.3 | Confident | 129 Ų | 129 | 107.4 Ų | 107.4 | 60% | 0.597 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.2 | -38.4 | 173.8 | -80.2 | -70.4 | 0 | 0 | 0 | 112.3 | S2 A10 | S2-H6 PolarHBondContact O-CD2 3.44Å; S2-H6 PolarHBondContact O-N 3.46Å; H6-A10 WeakPolarHBondContact O-CB 3.43Å; H6-A10 PolarHBondContact O-N 3.38Å |
| 7 | S | 74.7 | Confident | 70.9 | Confident | 51 Ų | 51 | 109.1 Ų | 109.1 | 36% | 0.357 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.6 | -40.3 | 177 | 77.9 | 0 | 0 | 0 | 0 | 112.5 | L3 N4 E5 A10 L11 | L3-S7 PolarHBondContact O-N 3.42Å; N4-S7 PolarHBondContact O-N 3.4Å; N4-S7 PolarHBondContact O-OG 3.12Å; E5-S7 VanDerWaalsContact C-N 3.29Å; E5-S7 PolarHBondContact O-N 3.21Å; S7-A10 PolarHBondContact O-N 3.03Å; S7-L11 VanDerWaalsContact O-CG 3.31Å; S7-L11 WeakPolarHBondContact O-CG 3.31Å; S7-L11 PolarHBondContact O-N 3.14Å |
| 8 | L | 73.8 | Confident | 71.5 | Confident | 90 Ų | 90 | 108.4 Ų | 108.4 | 47% | 0.471 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.8 | -39.2 | 177.5 | -72 | 175.1 | 0 | 0 | 0 | 111.8 | N4 E5 L11 S12 | N4-L8 WeakPolarHBondContact O-CB 3.44Å; N4-L8 VanDerWaalsContact O-CG 3.25Å; N4-L8 WeakPolarHBondContact O-CG 3.3Å; N4-L8 PolarHBondContact O-N 3.49Å; E5-L8 PolarHBondContact O-N 2.96Å; L8-L11 PolarHBondContact O-N 2.99Å; L8-S12 PolarHBondContact O-N 3.01Å; L8-S12 PolarHBondContact O-OG 3.12Å |
| 9 | Q | 71.9 | Confident | 71.9 | Confident | 83 Ų | 83 | 104 Ų | 104 | 39% | 0.388 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.7 | -40.2 | 175 | 175.1 | 158.9 | 24.4 | 0 | 0 | 112.3 | E5 L11 S12 W13 L94 | E5-Q9 WeakPolarHBondContact O-CB 3.43Å; E5-Q9 PolarHBondContact O-N 2.97Å; Q9-L11 VanDerWaalsContact C-N 3.35Å; Q9-S12 PolarHBondContact O-OG 3.43Å; Q9-W13 PolarHBondContact O-N 3.31Å; Q9-W13 VanDerWaalsContact O-N 3.15Å; Q9-L94 HydrophobicContact CB-CD1 3.93Å; Q9-L94 HydrophobicContact CG-CD1 3.38Å |
| 10 | A | 75.2 | Confident | 72.4 | Confident | 61 Ų | 61 | 102.6 Ų | 102.6 | 50% | 0.504 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | H6 S7 R14 | H6-A10 WeakPolarHBondContact O-CB 3.43Å; H6-A10 PolarHBondContact O-N 3.38Å; S7-A10 PolarHBondContact O-N 3.03Å; A10-R14 WeakPolarHBondContact O-CB 3.41Å; A10-R14 PolarHBondContact O-N 3.32Å; A10-R14 VanDerWaalsContact O-N 3.09Å |
| 11 | L | 77 | Confident | 73 | Confident | 97 Ų | 97 | 100.5 Ų | 100.5 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -67.7 | -41.9 | 177.5 | -73.9 | 169.8 | 0 | 0 | 0 | 112.6 | S7 L8 Q9 R14 K15 | S7-L11 VanDerWaalsContact O-CG 3.31Å; S7-L11 WeakPolarHBondContact O-CG 3.31Å; S7-L11 PolarHBondContact O-N 3.14Å; L8-L11 PolarHBondContact O-N 2.99Å; Q9-L11 VanDerWaalsContact C-N 3.35Å; L11-R14 PolarHBondContact O-N 2.9Å; L11-K15 WeakPolarHBondContact O-CG 3.31Å; L11-K15 PolarHBondContact O-N 3.2Å |
| 12 | S | 72.9 | Confident | 74.6 | Confident | 51 Ų | 51 | 93.7 Ų | 93.7 | 36% | 0.357 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.4 | -42 | 177.7 | 64.2 | 0 | 0 | 0 | 0 | 111.4 | L8 Q9 R14 K15 L16 | L8-S12 PolarHBondContact O-N 3.01Å; L8-S12 PolarHBondContact O-OG 3.12Å; Q9-S12 PolarHBondContact O-OG 3.43Å; S12-R14 PolarHBondContact O-N 3Å; S12-K15 PolarHBondContact O-N 2.96Å; S12-L16 WeakPolarHBondContact O-CB 3.41Å; S12-L16 PolarHBondContact O-N 3.45Å |
| 13 | W | 74.3 | Confident | 75.8 | Confident | 113 Ų | 113 | 90.5 Ų | 90.5 | 43% | 0.428 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 174.5 | -166.8 | -102.5 | 0 | 0 | 0 | 112.3 | Q9 L16 Y17 | Q9-W13 PolarHBondContact O-N 3.31Å; Q9-W13 VanDerWaalsContact O-N 3.15Å; W13-L16 PolarHBondContact O-N 3.35Å; W13-Y17 AromaticContact CD1-CD2 3.88Å; W13-Y17 HydrophobicContact CD2-CD2 4.39Å; W13-Y17 HydrophobicContact CD2-CE2 4.27Å; W13-Y17 AromaticContact CE2-CD2 3.9Å; W13-Y17 AromaticContact CE2-CE2 3.39Å; W13-Y17 HydrophobicContact CG-CD2 4.4Å; W13-Y17 HydrophobicContact CH2-CE2 4.5Å; W13-Y17 HydrophobicContact CZ2-CD2 4.43Å; W13-Y17 AromaticContact CZ2-CE2 3.55Å; W13-Y17 HydrophobicContact CZ2-CE2 3.55Å; W13-Y17 AromaticContact NE1-CD2 3.53Å; W13-Y17 AromaticContact NE1-CE2 3.21Å; W13-Y17 PolarHBondContact O-N 3.32Å |
| 14 | R | 80.7 | Confident | 77 | Confident | 189 Ų | 189 | 88 Ų | 88 | 71% | 0.713 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -65.5 | -41.6 | 177.5 | -165.2 | 174.4 | -176.8 | 171.3 | 0.7 | 112.1 | A10 L11 S12 L16 L18 | A10-R14 WeakPolarHBondContact O-CB 3.41Å; A10-R14 PolarHBondContact O-N 3.32Å; A10-R14 VanDerWaalsContact O-N 3.09Å; L11-R14 PolarHBondContact O-N 2.9Å; S12-R14 PolarHBondContact O-N 3Å; R14-L16 VanDerWaalsContact C-N 3.32Å; R14-L16 PolarHBondContact O-N 3.41Å; R14-L18 VanDerWaalsContact O-CB 3.25Å; R14-L18 WeakPolarHBondContact O-CB 3.5Å; R14-L18 PolarHBondContact O-N 2.91Å |
| 15 | K | 78.3 | Confident | 78 | Confident | 153 Ų | 153 | 85 Ų | 85 | 67% | 0.665 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -60.6 | -41.8 | 173.5 | -78.8 | -176.6 | 177.5 | -175 | 0 | 111.7 | L11 S12 L18 S19 | L11-K15 WeakPolarHBondContact O-CG 3.31Å; L11-K15 PolarHBondContact O-N 3.2Å; S12-K15 PolarHBondContact O-N 2.96Å; K15-L18 PolarHBondContact O-N 3.45Å; K15-S19 WeakPolarHBondContact O-CB 3.48Å; K15-S19 PolarHBondContact O-N 2.74Å; K15-S19 PolarHBondContact O-OG 2.72Å |
| 16 | L | 76.1 | Confident | 78.9 | Confident | 24 Ų | 24 | 79.2 Ų | 79.2 | 13% | 0.126 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -64.5 | -49.4 | 179.3 | -175.3 | 141.6 | 0 | 0 | 0 | 111.7 | S12 W13 R14 L18 S19 R20 I85 V88 | S12-L16 WeakPolarHBondContact O-CB 3.41Å; S12-L16 PolarHBondContact O-N 3.45Å; W13-L16 PolarHBondContact O-N 3.35Å; R14-L16 VanDerWaalsContact C-N 3.32Å; R14-L16 PolarHBondContact O-N 3.41Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 2.93Å; L16-S19 PolarHBondContact O-N 2.99Å; L16-R20 PolarHBondContact O-N 3.27Å; L16-I85 HydrophobicContact CD2-CG2 4.33Å; L16-I85 HydrophobicContact CG-CG2 4.07Å; L16-V88 HydrophobicContact CD1-CB 3.99Å; L16-V88 HydrophobicContact CD1-CG1 3.71Å |
| 17 | Y | 80.1 | Confident | 79.9 | Confident | 137 Ų | 137 | 75.3 Ų | 75.3 | 54% | 0.537 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -59.3 | -42.2 | 176.4 | -100.4 | -97.6 | 0 | 0 | 0 | 112.3 | W13 R20 A21 | W13-Y17 AromaticContact CD1-CD2 3.88Å; W13-Y17 HydrophobicContact CD2-CD2 4.39Å; W13-Y17 HydrophobicContact CD2-CE2 4.27Å; W13-Y17 AromaticContact CE2-CD2 3.9Å; W13-Y17 AromaticContact CE2-CE2 3.39Å; W13-Y17 HydrophobicContact CG-CD2 4.4Å; W13-Y17 HydrophobicContact CH2-CE2 4.5Å; W13-Y17 HydrophobicContact CZ2-CD2 4.43Å; W13-Y17 AromaticContact CZ2-CE2 3.55Å; W13-Y17 HydrophobicContact CZ2-CE2 3.55Å; W13-Y17 AromaticContact NE1-CD2 3.53Å; W13-Y17 AromaticContact NE1-CE2 3.21Å; W13-Y17 PolarHBondContact O-N 3.32Å; Y17-R20 PolarHBondContact O-N 3.47Å; Y17-A21 WeakPolarHBondContact O-CB 3.45Å; Y17-A21 PolarHBondContact O-N 2.97Å |
| 18 | L | 83.2 | Confident | 80.6 | Confident | 97 Ų | 97 | 81 Ų | 81 | 51% | 0.508 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -66.2 | -40.3 | 178.8 | -170.2 | 147.1 | 0 | 0 | 0 | 111.4 | R14 K15 L16 A21 K22 | R14-L18 VanDerWaalsContact O-CB 3.25Å; R14-L18 WeakPolarHBondContact O-CB 3.5Å; R14-L18 PolarHBondContact O-N 2.91Å; K15-L18 PolarHBondContact O-N 3.45Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 2.93Å; L18-A21 PolarHBondContact O-N 3.29Å; L18-K22 HydrophobicContact CD2-CD 3.38Å; L18-K22 HydrophobicContact CD2-CG 4.11Å; L18-K22 HydrophobicContact CG-CD 4.48Å; L18-K22 WeakPolarHBondContact O-CB 3.5Å; L18-K22 WeakPolarHBondContact O-CG 3.42Å; L18-K22 PolarHBondContact O-N 3.33Å |
| 19 | S | 78.9 | Confident | 81.4 | Confident | 24 Ų | 24 | 79.9 Ų | 79.9 | 17% | 0.168 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.3 | -44.2 | 175.8 | -58.3 | 0 | 0 | 0 | 0 | 111.6 | K15 L16 A21 K22 L23 | K15-S19 WeakPolarHBondContact O-CB 3.48Å; K15-S19 PolarHBondContact O-N 2.74Å; K15-S19 PolarHBondContact O-OG 2.72Å; L16-S19 PolarHBondContact O-N 2.99Å; S19-A21 VanDerWaalsContact C-N 3.34Å; S19-A21 PolarHBondContact O-N 2.89Å; S19-K22 PolarHBondContact O-N 2.92Å; S19-L23 WeakPolarHBondContact O-CG 3.34Å; S19-L23 PolarHBondContact O-N 3.31Å |
| 20 | R | 81.3 | Confident | 82.3 | Confident | 76 Ų | 76 | 75.9 Ų | 75.9 | 29% | 0.287 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -58.3 | -44.3 | 173.2 | -177.8 | -179.9 | 174.8 | 77.9 | -4.4 | 112 | L16 Y17 K24 I85 E86 | L16-R20 PolarHBondContact O-N 3.27Å; Y17-R20 PolarHBondContact O-N 3.47Å; R20-K24 PolarHBondContact O-N 2.9Å; R20-I85 HydrophobicContact CB-CG2 4.23Å; R20-E86 IonicContact CZ-OE1 3.06Å; R20-E86 IonicContact NH1-OE1 3.72Å; R20-E86 PolarHBondContact NH1-OE1 3.38Å; R20-E86 IonicContact NH2-OE1 2.68Å |
| 21 | A | 84.4 | Confident | 83 | Confident | 59 Ų | 59 | 75.5 Ų | 75.5 | 49% | 0.488 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -65.7 | -44 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y17 L18 S19 L23 K24 A25 | Y17-A21 WeakPolarHBondContact O-CB 3.45Å; Y17-A21 PolarHBondContact O-N 2.97Å; L18-A21 PolarHBondContact O-N 3.29Å; S19-A21 VanDerWaalsContact C-N 3.34Å; S19-A21 PolarHBondContact O-N 2.89Å; A21-L23 PolarHBondContact O-N 3.43Å; A21-K24 PolarHBondContact O-N 3.1Å; A21-A25 WeakPolarHBondContact O-CB 3.45Å; A21-A25 PolarHBondContact O-N 2.89Å |
| 22 | K | 85.6 | Confident | 83.8 | Confident | 75 Ų | 75 | 75.9 Ų | 75.9 | 33% | 0.326 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -56.9 | -48.6 | 175.6 | -78.8 | 172.2 | 71 | -174.1 | 0 | 111.4 | L18 S19 K24 A25 S26 E110 W113 | L18-K22 HydrophobicContact CD2-CD 3.38Å; L18-K22 HydrophobicContact CD2-CG 4.11Å; L18-K22 HydrophobicContact CG-CD 4.48Å; L18-K22 WeakPolarHBondContact O-CB 3.5Å; L18-K22 WeakPolarHBondContact O-CG 3.42Å; L18-K22 PolarHBondContact O-N 3.33Å; S19-K22 PolarHBondContact O-N 2.92Å; K22-K24 PolarHBondContact O-N 3.04Å; K22-A25 PolarHBondContact O-N 3.21Å; K22-S26 VanDerWaalsContact O-CB 3.27Å; K22-S26 WeakPolarHBondContact O-CB 3.41Å; K22-S26 PolarHBondContact O-N 3.31Å; K22-E110 IonicContact NZ-OE1 3.66Å; K22-E110 PolarHBondContact NZ-OE1 3.04Å; K22-W113 HydrophobicContact CB-CH2 4.04Å; K22-W113 HydrophobicContact CB-CZ2 4.49Å; K22-W113 VanDerWaalsContact CE-CH2 3.48Å; K22-W113 VanDerWaalsContact CE-CZ3 3.49Å |
| 23 | L | 83 | Confident | 84.7 | Confident | 9 Ų | 9 | 75.3 Ų | 75.3 | 5% | 0.047 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62.5 | -44.4 | -179.8 | -68.7 | 177.8 | 0 | 0 | 0 | 112.6 | S19 A21 A25 S26 S27 I81 I85 W113 | S19-L23 WeakPolarHBondContact O-CG 3.34Å; S19-L23 PolarHBondContact O-N 3.31Å; A21-L23 PolarHBondContact O-N 3.43Å; L23-A25 VanDerWaalsContact C-N 3.34Å; L23-A25 PolarHBondContact O-N 3.01Å; L23-S26 PolarHBondContact O-N 3.2Å; L23-S27 WeakPolarHBondContact O-CB 3.48Å; L23-S27 PolarHBondContact O-N 3.33Å; L23-I81 HydrophobicContact CD1-CB 3.87Å; L23-I81 HydrophobicContact CD1-CG2 3.59Å; L23-I81 HydrophobicContact CD2-CD1 4.05Å; L23-I85 HydrophobicContact CD1-CD1 3.63Å; L23-W113 HydrophobicContact CD2-CD2 4.39Å; L23-W113 HydrophobicContact CD2-CG 4.5Å |
| 24 | K | 85.5 | Confident | 85.4 | Confident | 99 Ų | 99 | 70.4 Ų | 70.4 | 43% | 0.43 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.9 | -37.2 | 177 | -72.7 | -173.1 | 179 | -171.7 | 0 | 112.7 | R20 A21 K22 R28 | R20-K24 PolarHBondContact O-N 2.9Å; A21-K24 PolarHBondContact O-N 3.1Å; K22-K24 PolarHBondContact O-N 3.04Å; K24-R28 WeakPolarHBondContact O-CG 3.26Å; K24-R28 PolarHBondContact O-N 2.97Å; K24-R28 PolarHBondContact O-NE 2.97Å |
| 25 | A | 87.6 | Confident | 86 | Confident | 42 Ų | 42 | 63 Ų | 63 | 35% | 0.347 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -69.1 | -44.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | A21 K22 L23 S27 R28 T29 | A21-A25 WeakPolarHBondContact O-CB 3.45Å; A21-A25 PolarHBondContact O-N 2.89Å; K22-A25 PolarHBondContact O-N 3.21Å; L23-A25 VanDerWaalsContact C-N 3.34Å; L23-A25 PolarHBondContact O-N 3.01Å; A25-S27 VanDerWaalsContact C-N 3.34Å; A25-S27 PolarHBondContact O-N 2.99Å; A25-R28 PolarHBondContact O-N 3.5Å; A25-T29 WeakPolarHBondContact O-CB 3.4Å; A25-T29 WeakPolarHBondContact O-CG2 3.21Å; A25-T29 PolarHBondContact O-N 3.35Å; A25-T29 PolarHBondContact O-OG1 2.9Å |
| 26 | S | 86.2 | Confident | 86.7 | Confident | 5 Ų | 5 | 62 Ų | 62 | 4% | 0.035 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -61.2 | -41.5 | 178.6 | -163.1 | 0 | 0 | 0 | 0 | 113.1 | K22 L23 T29 S30 W113 | K22-S26 VanDerWaalsContact O-CB 3.27Å; K22-S26 WeakPolarHBondContact O-CB 3.41Å; K22-S26 PolarHBondContact O-N 3.31Å; L23-S26 PolarHBondContact O-N 3.2Å; S26-T29 VanDerWaalsContact CA-OG1 3.3Å; S26-T29 WeakPolarHBondContact CA-OG1 3.4Å; S26-T29 PolarHBondContact O-OG1 3.26Å; S26-S30 VanDerWaalsContact O-CB 3.23Å; S26-S30 WeakPolarHBondContact O-CB 3.48Å; S26-S30 PolarHBondContact O-N 3.49Å; S26-S30 PolarHBondContact O-OG 2.93Å; S26-W113 WeakPolarHBondContact OG-CZ2 3.46Å; S26-W113 PolarHBondContact OG-NE1 3.43Å |
| 27 | S | 87.8 | Confident | 87.4 | Confident | 47 Ų | 47 | 61 Ų | 61 | 33% | 0.329 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.8 | -49.3 | 179.5 | 168.6 | 0 | 0 | 0 | 0 | 110.7 | L23 A25 T29 S30 A31 L75 | L23-S27 WeakPolarHBondContact O-CB 3.48Å; L23-S27 PolarHBondContact O-N 3.33Å; A25-S27 VanDerWaalsContact C-N 3.34Å; A25-S27 PolarHBondContact O-N 2.99Å; S27-T29 PolarHBondContact O-N 3.41Å; S27-S30 PolarHBondContact O-N 2.82Å; S27-A31 WeakPolarHBondContact O-CB 3.42Å; S27-A31 PolarHBondContact O-N 3.16Å; S27-L75 VanDerWaalsContact CA-CD2 3.49Å; S27-L75 WeakPolarHBondContact O-CD2 3.48Å; S27-L75 WeakPolarHBondContact OG-CD2 3.25Å |
| 28 | R | 89.1 | Confident | 88 | Confident | 170 Ų | 170 | 59.4 Ų | 59.4 | 64% | 0.642 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -61 | -46.8 | 177.4 | -73.3 | -174.2 | -69.4 | 165.4 | -0.6 | 112.4 | K24 A25 A31 L32 | K24-R28 WeakPolarHBondContact O-CG 3.26Å; K24-R28 PolarHBondContact O-N 2.97Å; K24-R28 PolarHBondContact O-NE 2.97Å; A25-R28 PolarHBondContact O-N 3.5Å; R28-A31 PolarHBondContact O-N 3.19Å; R28-L32 WeakPolarHBondContact O-CB 3.48Å; R28-L32 VanDerWaalsContact O-CG 3.27Å; R28-L32 WeakPolarHBondContact O-CG 3.49Å; R28-L32 PolarHBondContact O-N 2.83Å |
| 29 | T | 90.6 | Very high | 88.5 | Confident | 66 Ų | 66 | 58.6 Ų | 58.6 | 41% | 0.405 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64.2 | -44.9 | 179.9 | 48 | 0 | 0 | 0 | 0 | 112 | A25 S26 S27 A31 L32 L33 | A25-T29 WeakPolarHBondContact O-CB 3.4Å; A25-T29 WeakPolarHBondContact O-CG2 3.21Å; A25-T29 PolarHBondContact O-N 3.35Å; A25-T29 PolarHBondContact O-OG1 2.9Å; S26-T29 VanDerWaalsContact CA-OG1 3.3Å; S26-T29 WeakPolarHBondContact CA-OG1 3.4Å; S26-T29 PolarHBondContact O-OG1 3.26Å; S27-T29 PolarHBondContact O-N 3.41Å; T29-A31 PolarHBondContact O-N 3.3Å; T29-L32 PolarHBondContact O-N 3.42Å; T29-L33 WeakPolarHBondContact O-CB 3.43Å; T29-L33 VanDerWaalsContact O-CG 3.29Å; T29-L33 WeakPolarHBondContact O-CG 3.43Å; T29-L33 PolarHBondContact O-N 3.31Å |
| 30 | S | 90.9 | Very high | 89.1 | Confident | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.7 | -40.6 | 178.9 | -62.1 | 0 | 0 | 0 | 0 | 112.6 | S26 S27 S34 H71 | S26-S30 VanDerWaalsContact O-CB 3.23Å; S26-S30 WeakPolarHBondContact O-CB 3.48Å; S26-S30 PolarHBondContact O-N 3.49Å; S26-S30 PolarHBondContact O-OG 2.93Å; S27-S30 PolarHBondContact O-N 2.82Å; S30-S34 WeakPolarHBondContact O-CB 3.46Å; S30-S34 PolarHBondContact O-N 3.16Å; S30-S34 VanDerWaalsContact O-N 3.08Å; S30-S34 PolarHBondContact O-OG 3.34Å; S30-H71 WeakPolarHBondContact CB-ND1 3.37Å; S30-H71 PolarHBondContact OG-ND1 2.92Å |
| 31 | A | 90.3 | Very high | 89.6 | Confident | 53 Ų | 53 | 58.1 Ų | 58.1 | 44% | 0.438 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S27 R28 T29 G35 | S27-A31 WeakPolarHBondContact O-CB 3.42Å; S27-A31 PolarHBondContact O-N 3.16Å; R28-A31 PolarHBondContact O-N 3.19Å; T29-A31 PolarHBondContact O-N 3.3Å; A31-G35 PolarHBondContact O-N 3.04Å |
| 32 | L | 92.7 | Very high | 89.9 | Confident | 104 Ų | 104 | 60.6 Ų | 60.6 | 55% | 0.545 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -65.9 | -49.1 | 178.6 | -72 | 172 | 0 | 0 | 0 | 112.2 | R28 T29 S34 G35 F36 | R28-L32 WeakPolarHBondContact O-CB 3.48Å; R28-L32 VanDerWaalsContact O-CG 3.27Å; R28-L32 WeakPolarHBondContact O-CG 3.49Å; R28-L32 PolarHBondContact O-N 2.83Å; T29-L32 PolarHBondContact O-N 3.42Å; L32-S34 PolarHBondContact O-N 2.9Å; L32-G35 PolarHBondContact O-N 3.17Å; L32-F36 HydrophobicContact CB-CD2 4.43Å; L32-F36 HydrophobicContact CB-CE2 4.28Å; L32-F36 HydrophobicContact CD2-CE2 4.37Å; L32-F36 WeakPolarHBondContact O-CD2 3.2Å; L32-F36 PolarHBondContact O-N 3.37Å |
| 33 | L | 91.2 | Very high | 90.2 | Very high | 40 Ų | 40 | 63.2 Ų | 63.2 | 21% | 0.209 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -62.3 | -43.5 | -178.8 | -68.7 | 174.6 | 0 | 0 | 0 | 111.8 | T29 F36 A37 F124 | T29-L33 WeakPolarHBondContact O-CB 3.43Å; T29-L33 VanDerWaalsContact O-CG 3.29Å; T29-L33 WeakPolarHBondContact O-CG 3.43Å; T29-L33 PolarHBondContact O-N 3.31Å; L33-F36 PolarHBondContact O-N 3.5Å; L33-A37 WeakPolarHBondContact O-CB 3.47Å; L33-A37 PolarHBondContact O-N 3.38Å; L33-F124 HydrophobicContact CB-CD2 4.12Å; L33-F124 HydrophobicContact CB-CE2 4.36Å; L33-F124 HydrophobicContact CD2-CD1 3.97Å; L33-F124 HydrophobicContact CD2-CD2 3.99Å; L33-F124 HydrophobicContact CD2-CE1 3.8Å; L33-F124 HydrophobicContact CD2-CE2 3.82Å; L33-F124 HydrophobicContact CD2-CG 4.07Å; L33-F124 HydrophobicContact CD2-CZ 3.72Å |
| 34 | S | 91.1 | Very high | 90.6 | Very high | 10 Ų | 10 | 64 Ų | 64 | 7% | 0.07 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -64.9 | -42.1 | 175.9 | -53.6 | 0 | 0 | 0 | 0 | 112 | S30 L32 A37 M38 H71 | S30-S34 WeakPolarHBondContact O-CB 3.46Å; S30-S34 PolarHBondContact O-N 3.16Å; S30-S34 VanDerWaalsContact O-N 3.08Å; S30-S34 PolarHBondContact O-OG 3.34Å; L32-S34 PolarHBondContact O-N 2.9Å; S34-A37 PolarHBondContact O-N 3.06Å; S34-M38 VanDerWaalsContact O-CB 3.32Å; S34-M38 WeakPolarHBondContact O-CB 3.25Å; S34-M38 PolarHBondContact O-N 2.86Å; S34-H71 WeakPolarHBondContact OG-CB 3.42Å |
| 35 | G | 92.2 | Very high | 90.6 | Very high | 32 Ų | 32 | 66.6 Ų | 66.6 | 33% | 0.33 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.8 | -47.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A31 L32 M38 V39 | A31-G35 PolarHBondContact O-N 3.04Å; L32-G35 PolarHBondContact O-N 3.17Å; G35-M38 PolarHBondContact O-N 2.77Å; G35-V39 VanDerWaalsContact O-CG2 3.3Å; G35-V39 WeakPolarHBondContact O-CG2 3.48Å; G35-V39 PolarHBondContact O-N 2.89Å |
| 36 | F | 92.2 | Very high | 90.4 | Very high | 133 Ų | 133 | 68.3 Ų | 68.3 | 58% | 0.583 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -64.6 | -40.9 | 177.7 | -74 | -53.9 | 0 | 0 | 0 | 112.9 | L32 L33 V39 A40 | L32-F36 HydrophobicContact CB-CD2 4.43Å; L32-F36 HydrophobicContact CB-CE2 4.28Å; L32-F36 HydrophobicContact CD2-CE2 4.37Å; L32-F36 WeakPolarHBondContact O-CD2 3.2Å; L32-F36 PolarHBondContact O-N 3.37Å; L33-F36 PolarHBondContact O-N 3.5Å; F36-V39 PolarHBondContact O-N 3.3Å; F36-A40 WeakPolarHBondContact O-CB 3.38Å; F36-A40 PolarHBondContact O-N 3.32Å |
| 37 | A | 91.8 | Very high | 90.4 | Very high | 2 Ų | 2 | 71.5 Ų | 71.5 | 2% | 0.017 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.7 | -44 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L33 S34 A40 M41 L67 F124 E127 | L33-A37 WeakPolarHBondContact O-CB 3.47Å; L33-A37 PolarHBondContact O-N 3.38Å; S34-A37 PolarHBondContact O-N 3.06Å; A37-A40 PolarHBondContact O-N 3.44Å; A37-M41 PolarHBondContact O-N 3.39Å; A37-L67 HydrophobicContact CB-CD1 4Å; A37-L67 HydrophobicContact CB-CD2 3.64Å; A37-F124 HydrophobicContact CB-CD2 4.48Å; A37-E127 HydrophobicContact CB-CG 4.42Å |
| 38 | M | 92.3 | Very high | 90.1 | Very high | 105 Ų | 105 | 76 Ų | 76 | 52% | 0.517 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63 | -43.5 | 177.1 | -174.7 | 179.1 | -68.3 | 0 | 0 | 112.1 | S34 G35 M41 V42 V68 | S34-M38 VanDerWaalsContact O-CB 3.32Å; S34-M38 WeakPolarHBondContact O-CB 3.25Å; S34-M38 PolarHBondContact O-N 2.86Å; G35-M38 PolarHBondContact O-N 2.77Å; M38-M41 PolarHBondContact O-N 2.81Å; M38-V42 PolarHBondContact O-N 3.45Å; M38-V68 HydrophobicContact CE-CG1 4.23Å; M38-V68 HydrophobicContact CE-CG2 4.38Å |
| 39 | V | 93.6 | Very high | 89.7 | Confident | 80 Ų | 80 | 73.8 Ų | 73.8 | 49% | 0.485 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63 | -45.6 | 175.5 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | G35 F36 M41 V42 E43 | G35-V39 VanDerWaalsContact O-CG2 3.3Å; G35-V39 WeakPolarHBondContact O-CG2 3.48Å; G35-V39 PolarHBondContact O-N 2.89Å; F36-V39 PolarHBondContact O-N 3.3Å; V39-M41 VanDerWaalsContact C-N 3.27Å; V39-M41 PolarHBondContact O-N 3.12Å; V39-V42 WeakPolarHBondContact O-CG2 3.35Å; V39-V42 PolarHBondContact O-N 2.94Å; V39-E43 HydrophobicContact CG1-CG 4.04Å; V39-E43 WeakPolarHBondContact O-CB 3.36Å; V39-E43 VanDerWaalsContact O-CG 3.29Å; V39-E43 WeakPolarHBondContact O-CG 3.49Å; V39-E43 PolarHBondContact O-N 3.24Å |
| 40 | A | 90.9 | Very high | 89.4 | Confident | 31 Ų | 31 | 73.3 Ų | 73.3 | 26% | 0.256 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -60.7 | -37.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | F36 A37 V44 L131 | F36-A40 WeakPolarHBondContact O-CB 3.38Å; F36-A40 PolarHBondContact O-N 3.32Å; A37-A40 PolarHBondContact O-N 3.44Å; A40-V44 PolarHBondContact O-N 3.5Å; A40-V44 VanDerWaalsContact O-N 3.08Å; A40-L131 HydrophobicContact CB-CD1 3.74Å; A40-L131 HydrophobicContact CB-CD2 4.45Å |
| 41 | M | 91.6 | Very high | 89.1 | Confident | 58 Ų | 58 | 78.7 Ų | 78.7 | 29% | 0.286 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.1 | -41 | 174.9 | 165.8 | 172.1 | -89.3 | 0 | 0 | 113 | A37 M38 V39 V44 F60 T64 | A37-M41 PolarHBondContact O-N 3.39Å; M38-M41 PolarHBondContact O-N 2.81Å; V39-M41 VanDerWaalsContact C-N 3.27Å; V39-M41 PolarHBondContact O-N 3.12Å; M41-V44 VanDerWaalsContact O-CG1 3.28Å; M41-V44 WeakPolarHBondContact O-CG1 3.44Å; M41-F60 HydrophobicContact CB-CZ 4.22Å; M41-F60 HydrophobicContact CE-CD1 4.31Å; M41-F60 HydrophobicContact CE-CE1 3.92Å; M41-F60 HydrophobicContact CE-CZ 4.26Å; M41-F60 HydrophobicContact CG-CE1 4.44Å; M41-T64 HydrophobicContact CB-CG2 4.11Å; M41-T64 HydrophobicContact CE-CG2 3.7Å; M41-T64 WeakPolarHBondContact CE-OG1 3.33Å; M41-T64 HydrophobicContact SD-CG2 3.75Å |
| 42 | V | 92.4 | Very high | 88.9 | Confident | 111 Ų | 111 | 77.4 Ų | 77.4 | 67% | 0.673 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -79 | -25.9 | 179.6 | -60.3 | 0 | 0 | 0 | 0 | 112.8 | M38 V39 | M38-V42 PolarHBondContact O-N 3.45Å; V39-V42 WeakPolarHBondContact O-CG2 3.35Å; V39-V42 PolarHBondContact O-N 2.94Å |
| 43 | E | 92.2 | Very high | 88.8 | Confident | 130 Ų | 130 | 75.4 Ų | 75.4 | 61% | 0.607 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -83.9 | -9.6 | 177.1 | -70.4 | -67.3 | 158 | 0 | 0 | 113.2 | V39 Q45 | V39-E43 HydrophobicContact CG1-CG 4.04Å; V39-E43 WeakPolarHBondContact O-CB 3.36Å; V39-E43 VanDerWaalsContact O-CG 3.29Å; V39-E43 WeakPolarHBondContact O-CG 3.49Å; V39-E43 PolarHBondContact O-N 3.24Å; E43-Q45 PolarHBondContact O-N 3.27Å; E43-Q45 VanDerWaalsContact O-N 3.08Å |
| 44 | V | 89.4 | Confident | 88.7 | Confident | 26 Ų | 26 | 78 Ų | 78 | 16% | 0.158 | 44% | 0.438 | C | S | . | . | trans | -71.7 | 108.5 | 179.6 | 81.6 | 0 | 0 | 0 | 0 | 110.4 | A40 M41 L46 F60 L131 V134 | A40-V44 PolarHBondContact O-N 3.5Å; A40-V44 VanDerWaalsContact O-N 3.08Å; M41-V44 VanDerWaalsContact O-CG1 3.28Å; M41-V44 WeakPolarHBondContact O-CG1 3.44Å; V44-L46 PolarHBondContact O-N 3.31Å; V44-F60 HydrophobicContact CG1-CE1 3.97Å; V44-F60 HydrophobicContact CG1-CZ 4.27Å; V44-L131 HydrophobicContact CG2-CD2 4.37Å; V44-V134 HydrophobicContact CG2-CG1 3.73Å | ||
| 45 | Q | 85.8 | Confident | 88.8 | Confident | 153 Ų | 153 | 79.9 Ų | 79.9 | 72% | 0.715 | 46% | 0.458 | S | S | * | . | trans | -82.8 | 108.8 | 176.5 | -65.3 | 178.2 | 1.8 | 0 | 0 | 110.1 | E43 | E43-Q45 PolarHBondContact O-N 3.27Å; E43-Q45 VanDerWaalsContact O-N 3.08Å | ||
| 46 | L | 85.1 | Confident | 88.8 | Confident | 79 Ų | 79 | 79.5 Ų | 79.5 | 41% | 0.414 | 45% | 0.449 | S | S | . | . | trans | -86.6 | 124.1 | 174.1 | -64.5 | 172.5 | 0 | 0 | 0 | 110.2 | V44 T48 Y52 L57 V134 | V44-L46 PolarHBondContact O-N 3.31Å; L46-T48 PolarHBondContact O-N 2.94Å; L46-Y52 HydrophobicContact CB-CE2 4.26Å; L46-Y52 HydrophobicContact CD2-CE1 4.32Å; L46-Y52 HydrophobicContact CD2-CE2 4.1Å; L46-L57 HydrophobicContact CD1-CD2 3.87Å; L46-L57 HydrophobicContact CD2-CD2 4.32Å; L46-V134 HydrophobicContact CD2-CG1 3.35Å | ||
| 47 | D | 84.8 | Confident | 88.8 | Confident | 72 Ų | 72 | 76 Ų | 76 | 39% | 0.385 | 44% | 0.435 | S | S | . | . | trans | -67.1 | 115.5 | 169.5 | -171.9 | -18.8 | 0 | 0 | 0 | 111.4 | T49 Y50 Y52 | D47-T49 PolarHBondContact O-N 2.73Å; D47-T49 WeakPolarHBondContact OD1-CB 3.32Å; D47-T49 PolarHBondContact OD1-N 3.31Å; D47-T49 PolarHBondContact OD1-OG1 3.5Å; D47-Y50 PolarHBondContact O-N 3.43Å; D47-Y52 PolarHBondContact N-OH 2.93Å; D47-Y52 VanDerWaalsContact N-OH 3.11Å; D47-Y52 VanDerWaalsContact O-CE2 3.28Å; D47-Y52 WeakPolarHBondContact O-CE2 3.21Å | ||
| 48 | T | 81 | Confident | 88.9 | Confident | 142 Ų | 142 | 81 Ų | 81 | 87% | 0.871 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | -17.2 | -179.6 | 53.5 | 0 | 0 | 0 | 0 | 113.8 | L46 | L46-T48 PolarHBondContact O-N 2.94Š|
| 49 | T | 82.3 | Confident | 89.1 | Confident | 123 Ų | 123 | 78 Ų | 78 | 76% | 0.755 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | -18.8 | -179.5 | -43 | 0 | 0 | 0 | 0 | 111.4 | D47 | D47-T49 PolarHBondContact O-N 2.73Å; D47-T49 WeakPolarHBondContact OD1-CB 3.32Å; D47-T49 PolarHBondContact OD1-N 3.31Å; D47-T49 PolarHBondContact OD1-OG1 3.5Å |
| 50 | Y | 82.7 | Confident | 89.1 | Confident | 56 Ų | 56 | 74.9 Ų | 74.9 | 22% | 0.22 | 43% | 0.433 | C | S | . | . | S | Bend | trans | -87.5 | 122.5 | -178.9 | -172.5 | -90.1 | 0 | 0 | 0 | 111 | D47 Y52 L137 P138 | D47-Y50 PolarHBondContact O-N 3.43Å; Y50-Y52 AromaticContact CD1-CD1 3.72Å; Y50-Y52 HydrophobicContact CD1-CD1 3.72Å; Y50-Y52 AromaticContact CD1-CD2 3.89Å; Y50-Y52 HydrophobicContact CD1-CD2 3.89Å; Y50-Y52 AromaticContact CD1-CE1 3.76Å; Y50-Y52 HydrophobicContact CD1-CE1 3.76Å; Y50-Y52 AromaticContact CD1-CE2 3.92Å; Y50-Y52 HydrophobicContact CD1-CE2 3.92Å; Y50-Y52 AromaticContact CD1-CG 3.78Å; Y50-Y52 HydrophobicContact CD1-CG 3.78Å; Y50-Y52 AromaticContact CD1-CZ 3.85Å; Y50-Y52 AromaticContact CE1-CD1 3.95Å; Y50-Y52 HydrophobicContact CE1-CD1 3.95Å; Y50-Y52 HydrophobicContact CE1-CE1 4.19Å; Y50-Y52 HydrophobicContact CE1-CG 4.26Å; Y50-Y52 HydrophobicContact CG-CE2 4.47Å; Y50-Y52 VanDerWaalsContact O-CD2 3.25Å; Y50-Y52 WeakPolarHBondContact O-CD2 3.48Å; Y50-Y52 PolarHBondContact O-N 3.2Å; Y50-L137 HydrophobicContact CE1-CB 4.06Å; Y50-L137 HydrophobicContact CE1-CD2 3.92Å; Y50-L137 HydrophobicContact CE1-CG 4.14Å; Y50-L137 WeakPolarHBondContact OH-CG 3.41Å; Y50-L137 PolarHBondContact OH-O 3.24Å; Y50-P138 HydrophobicContact CD1-CG 4.4Å; Y50-P138 HydrophobicContact CD2-CB 4.21Å; Y50-P138 HydrophobicContact CG-CB 4.26Å; Y50-P138 HydrophobicContact CG-CG 4.29Å |
| 51 | P | 84.6 | Confident | 89.2 | Confident | 112 Ų | 112 | 76 Ų | 76 | 73% | 0.727 | 44% | 0.439 | S | S | * | . | trans | -76.6 | 86.8 | 177.3 | 31.4 | -33.8 | 0 | 0 | 0 | 110.1 | ||||
| 52 | Y | 87.9 | Confident | 89.5 | Confident | 27 Ų | 27 | 75.5 Ų | 75.5 | 11% | 0.106 | 44% | 0.444 | C | S | . | . | trans | -63.9 | 140.9 | 173.6 | -66.2 | -86.8 | 0 | 0 | 0 | 110.8 | L46 D47 Y50 L57 L137 P138 | L46-Y52 HydrophobicContact CB-CE2 4.26Å; L46-Y52 HydrophobicContact CD2-CE1 4.32Å; L46-Y52 HydrophobicContact CD2-CE2 4.1Å; D47-Y52 PolarHBondContact N-OH 2.93Å; D47-Y52 VanDerWaalsContact N-OH 3.11Å; D47-Y52 VanDerWaalsContact O-CE2 3.28Å; D47-Y52 WeakPolarHBondContact O-CE2 3.21Å; Y50-Y52 AromaticContact CD1-CD1 3.72Å; Y50-Y52 HydrophobicContact CD1-CD1 3.72Å; Y50-Y52 AromaticContact CD1-CD2 3.89Å; Y50-Y52 HydrophobicContact CD1-CD2 3.89Å; Y50-Y52 AromaticContact CD1-CE1 3.76Å; Y50-Y52 HydrophobicContact CD1-CE1 3.76Å; Y50-Y52 AromaticContact CD1-CE2 3.92Å; Y50-Y52 HydrophobicContact CD1-CE2 3.92Å; Y50-Y52 AromaticContact CD1-CG 3.78Å; Y50-Y52 HydrophobicContact CD1-CG 3.78Å; Y50-Y52 AromaticContact CD1-CZ 3.85Å; Y50-Y52 AromaticContact CE1-CD1 3.95Å; Y50-Y52 HydrophobicContact CE1-CD1 3.95Å; Y50-Y52 HydrophobicContact CE1-CE1 4.19Å; Y50-Y52 HydrophobicContact CE1-CG 4.26Å; Y50-Y52 HydrophobicContact CG-CE2 4.47Å; Y50-Y52 VanDerWaalsContact O-CD2 3.25Å; Y50-Y52 WeakPolarHBondContact O-CD2 3.48Å; Y50-Y52 PolarHBondContact O-N 3.2Å; Y52-L57 HydrophobicContact CG-CD1 4.46Å; Y52-L137 HydrophobicContact CD1-CD2 4.36Å; Y52-L137 HydrophobicContact CE1-CB 4.49Å; Y52-P138 HydrophobicContact CE1-CG 3.8Å; Y52-P138 WeakPolarHBondContact OH-CG 3.2Å | ||
| 53 | P | 89.9 | Confident | 89.6 | Confident | 61 Ų | 61 | 70.9 Ų | 70.9 | 40% | 0.396 | 42% | 0.417 | S | S | . | . | trans | -62.5 | 128.5 | 173.5 | 23 | -28.9 | 0 | 0 | 0 | 109.5 | G55 L56 L137 | P53-G55 PolarHBondContact O-N 3.23Å; P53-L56 HydrophobicContact CG-CB 3.82Å; P53-L56 HydrophobicContact CG-CD2 4.24Å; P53-L56 WeakPolarHBondContact O-CB 3.33Å; P53-L56 PolarHBondContact O-N 3.46Å; P53-L137 HydrophobicContact CG-CD2 4.12Å | ||
| 54 | P | 89.8 | Confident | 89.7 | Confident | 96 Ų | 96 | 64.9 Ų | 64.9 | 62% | 0.623 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -60.3 | -34.8 | -174.1 | 20.1 | -30.9 | 0 | 0 | 0 | 112.2 | L56 L57 I58 | P54-L56 VanDerWaalsContact C-N 3.28Å; P54-L56 PolarHBondContact O-N 3.18Å; P54-L57 PolarHBondContact O-N 3.27Å; P54-I58 WeakPolarHBondContact O-CD1 3.25Å; P54-I58 VanDerWaalsContact O-CG1 3.25Å; P54-I58 WeakPolarHBondContact O-CG1 3.31Å; P54-I58 PolarHBondContact O-N 2.87Å |
| 55 | G | 92.9 | Very high | 90 | Very high | 49 Ų | 49 | 68.1 Ų | 68.1 | 51% | 0.505 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -60.1 | -33.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | P53 A59 | P53-G55 PolarHBondContact O-N 3.23Å; G55-A59 WeakPolarHBondContact O-CB 3.44Å; G55-A59 PolarHBondContact O-N 2.9Å |
| 56 | L | 92 | Very high | 90.5 | Very high | 23 Ų | 23 | 64.2 Ų | 64.2 | 12% | 0.12 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -70.1 | -44.3 | 178.6 | 178.7 | 66.3 | 0 | 0 | 0 | 111.4 | P53 P54 A59 F60 L130 W133 V134 L137 | P53-L56 HydrophobicContact CG-CB 3.82Å; P53-L56 HydrophobicContact CG-CD2 4.24Å; P53-L56 WeakPolarHBondContact O-CB 3.33Å; P53-L56 PolarHBondContact O-N 3.46Å; P54-L56 VanDerWaalsContact C-N 3.28Å; P54-L56 PolarHBondContact O-N 3.18Å; L56-A59 PolarHBondContact O-N 3.14Å; L56-F60 VanDerWaalsContact O-CB 3.27Å; L56-F60 WeakPolarHBondContact O-CB 3Å; L56-F60 PolarHBondContact O-N 3.33Å; L56-L130 HydrophobicContact CD1-CD2 3.88Å; L56-W133 HydrophobicContact CD1-CB 3.72Å; L56-W133 HydrophobicContact CD1-CG 4.43Å; L56-W133 HydrophobicContact CD2-CB 4.12Å; L56-V134 HydrophobicContact CD1-CG2 4.44Å; L56-V134 HydrophobicContact CD2-CG2 4.02Å; L56-V134 HydrophobicContact CG-CG2 3.99Å; L56-L137 HydrophobicContact CD2-CD2 3.9Å |
| 57 | L | 91.8 | Very high | 91 | Very high | 59 Ų | 59 | 60.5 Ų | 60.5 | 31% | 0.309 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 177.5 | -76.4 | 153.4 | 0 | 0 | 0 | 111.7 | L46 Y52 P54 S61 | L46-L57 HydrophobicContact CD1-CD2 3.87Å; L46-L57 HydrophobicContact CD2-CD2 4.32Å; Y52-L57 HydrophobicContact CG-CD1 4.46Å; P54-L57 PolarHBondContact O-N 3.27Å; L57-S61 PolarHBondContact O-N 3.37Å; L57-S61 PolarHBondContact O-OG 2.9Å |
| 58 | I | 94.6 | Very high | 91.5 | Very high | 109 Ų | 109 | 58.2 Ų | 58.2 | 56% | 0.559 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -66.5 | -45.4 | 176.3 | -65.5 | 165.1 | 0 | 0 | 0 | 110.5 | P54 F60 S61 A62 | P54-I58 WeakPolarHBondContact O-CD1 3.25Å; P54-I58 VanDerWaalsContact O-CG1 3.25Å; P54-I58 WeakPolarHBondContact O-CG1 3.31Å; P54-I58 PolarHBondContact O-N 2.87Å; I58-F60 VanDerWaalsContact C-N 3.34Å; I58-F60 PolarHBondContact O-N 2.91Å; I58-S61 PolarHBondContact O-N 3.39Å; I58-S61 PolarHBondContact O-OG 3.5Å; I58-S61 VanDerWaalsContact O-OG 3.12Å; I58-A62 WeakPolarHBondContact O-CB 3.1Å; I58-A62 PolarHBondContact O-N 3.16Å |
| 59 | A | 95.2 | Very high | 92.1 | Very high | 42 Ų | 42 | 54 Ų | 54 | 35% | 0.347 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.6 | -42.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | G55 L56 C63 L130 | G55-A59 WeakPolarHBondContact O-CB 3.44Å; G55-A59 PolarHBondContact O-N 2.9Å; L56-A59 PolarHBondContact O-N 3.14Å; A59-C63 WeakPolarHBondContact O-CB 3.44Å; A59-C63 PolarHBondContact O-N 3.47Å; A59-L130 HydrophobicContact CB-CD2 4.19Å |
| 60 | F | 94.3 | Very high | 92.7 | Very high | 13 Ų | 13 | 49.4 Ų | 49.4 | 6% | 0.057 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.4 | -55.8 | 175.3 | 179.6 | -117 | 0 | 0 | 0 | 111.4 | M41 V44 L56 I58 A62 C63 T64 E127 L130 L131 V134 | M41-F60 HydrophobicContact CB-CZ 4.22Å; M41-F60 HydrophobicContact CE-CD1 4.31Å; M41-F60 HydrophobicContact CE-CE1 3.92Å; M41-F60 HydrophobicContact CE-CZ 4.26Å; M41-F60 HydrophobicContact CG-CE1 4.44Å; V44-F60 HydrophobicContact CG1-CE1 3.97Å; V44-F60 HydrophobicContact CG1-CZ 4.27Å; L56-F60 VanDerWaalsContact O-CB 3.27Å; L56-F60 WeakPolarHBondContact O-CB 3Å; L56-F60 PolarHBondContact O-N 3.33Å; I58-F60 VanDerWaalsContact C-N 3.34Å; I58-F60 PolarHBondContact O-N 2.91Å; F60-A62 PolarHBondContact O-N 3.37Å; F60-C63 PolarHBondContact O-N 2.81Å; F60-T64 PolarHBondContact O-N 3.44Å; F60-T64 PolarHBondContact O-OG1 3.42Å; F60-E127 WeakPolarHBondContact CE2-OE1 3.33Å; F60-L130 HydrophobicContact CD2-CB 3.92Å; F60-L131 HydrophobicContact CD2-CD2 4.47Å; F60-L131 HydrophobicContact CE2-CD2 3.35Å; F60-L131 HydrophobicContact CE2-CG 3.73Å; F60-L131 HydrophobicContact CZ-CD2 3.47Å; F60-L131 VanDerWaalsContact CZ-CD2 3.47Å; F60-L131 HydrophobicContact CZ-CG 4.34Å; F60-V134 HydrophobicContact CB-CG2 4.39Å; F60-V134 HydrophobicContact CG-CG2 4.27Å |
| 61 | S | 93.9 | Very high | 93.2 | Very high | 54 Ų | 54 | 46.8 Ų | 46.8 | 38% | 0.378 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -62.4 | -41.1 | -178.6 | 65.9 | 0 | 0 | 0 | 0 | 113.4 | L57 I58 T65 | L57-S61 PolarHBondContact O-N 3.37Å; L57-S61 PolarHBondContact O-OG 2.9Å; I58-S61 PolarHBondContact O-N 3.39Å; I58-S61 PolarHBondContact O-OG 3.5Å; I58-S61 VanDerWaalsContact O-OG 3.12Å; S61-T65 WeakPolarHBondContact O-CB 3.43Å; S61-T65 PolarHBondContact O-N 2.83Å; S61-T65 VanDerWaalsContact O-N 3.12Å; S61-T65 PolarHBondContact O-OG1 3.19Å |
| 62 | A | 96.4 | Very high | 93.6 | Very high | 49 Ų | 49 | 46.3 Ų | 46.3 | 41% | 0.405 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -65.5 | -44.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | I58 F60 T65 V66 | I58-A62 WeakPolarHBondContact O-CB 3.1Å; I58-A62 PolarHBondContact O-N 3.16Å; F60-A62 PolarHBondContact O-N 3.37Å; A62-T65 PolarHBondContact O-N 3.45Å; A62-V66 VanDerWaalsContact O-CG2 3.29Å; A62-V66 WeakPolarHBondContact O-CG2 3.46Å; A62-V66 PolarHBondContact O-N 3.19Å |
| 63 | C | 95.8 | Very high | 93.8 | Very high | 14 Ų | 14 | 49.3 Ų | 49.3 | 10% | 0.095 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -59 | -51.8 | 178.9 | -179.2 | 0 | 0 | 0 | 0 | 111.2 | A59 F60 T65 V66 L67 E127 L130 | A59-C63 WeakPolarHBondContact O-CB 3.44Å; A59-C63 PolarHBondContact O-N 3.47Å; F60-C63 PolarHBondContact O-N 2.81Å; C63-T65 VanDerWaalsContact C-N 3.31Å; C63-T65 PolarHBondContact O-N 3.05Å; C63-V66 PolarHBondContact O-N 3.39Å; C63-L67 WeakPolarHBondContact O-CB 3.22Å; C63-L67 PolarHBondContact O-N 3.21Å; C63-E127 PolarHBondContact SG-OE2 3.11Å; C63-L130 HydrophobicContact CB-CD1 3.5Å |
| 64 | T | 94.8 | Very high | 93.8 | Very high | 4 Ų | 4 | 46.4 Ų | 46.4 | 3% | 0.025 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.4 | -41.8 | 178.8 | -37.2 | 0 | 0 | 0 | 0 | 111.8 | M41 F60 L67 V68 E127 | M41-T64 HydrophobicContact CB-CG2 4.11Å; M41-T64 HydrophobicContact CE-CG2 3.7Å; M41-T64 WeakPolarHBondContact CE-OG1 3.33Å; M41-T64 HydrophobicContact SD-CG2 3.75Å; F60-T64 PolarHBondContact O-N 3.44Å; F60-T64 PolarHBondContact O-OG1 3.42Å; T64-L67 WeakPolarHBondContact O-CB 3.47Å; T64-L67 PolarHBondContact O-N 3.39Å; T64-V68 WeakPolarHBondContact O-CG2 3.38Å; T64-V68 PolarHBondContact O-N 2.87Å; T64-E127 WeakPolarHBondContact CB-OE1 3.4Å; T64-E127 WeakPolarHBondContact CG2-OE1 3.38Å; T64-E127 PolarHBondContact N-OE2 3.4Å; T64-E127 PolarHBondContact OG1-OE1 3.26Å; T64-E127 PolarHBondContact OG1-OE2 2.96Å |
| 65 | T | 95.3 | Very high | 93.7 | Very high | 93 Ų | 93 | 43.5 Ų | 43.5 | 57% | 0.571 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -64.1 | -47.6 | -179.3 | -57.4 | 0 | 0 | 0 | 0 | 111.1 | S61 A62 C63 V68 A69 | S61-T65 WeakPolarHBondContact O-CB 3.43Å; S61-T65 PolarHBondContact O-N 2.83Å; S61-T65 VanDerWaalsContact O-N 3.12Å; S61-T65 PolarHBondContact O-OG1 3.19Å; A62-T65 PolarHBondContact O-N 3.45Å; C63-T65 VanDerWaalsContact C-N 3.31Å; C63-T65 PolarHBondContact O-N 3.05Å; T65-V68 PolarHBondContact O-N 3.41Å; T65-A69 WeakPolarHBondContact O-CB 3.28Å; T65-A69 PolarHBondContact O-N 2.97Å |
| 66 | V | 96.3 | Very high | 93.6 | Very high | 72 Ų | 72 | 46.2 Ų | 46.2 | 44% | 0.436 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -67.4 | -38.6 | 178.6 | -180 | 0 | 0 | 0 | 0 | 110.6 | A62 C63 V68 A69 V70 L123 | A62-V66 VanDerWaalsContact O-CG2 3.29Å; A62-V66 WeakPolarHBondContact O-CG2 3.46Å; A62-V66 PolarHBondContact O-N 3.19Å; C63-V66 PolarHBondContact O-N 3.39Å; V66-V68 PolarHBondContact O-N 2.9Å; V66-A69 PolarHBondContact O-N 2.92Å; V66-V70 HydrophobicContact CG1-CG2 4.05Å; V66-V70 WeakPolarHBondContact O-CB 3.41Å; V66-V70 VanDerWaalsContact O-CG2 3.26Å; V66-V70 WeakPolarHBondContact O-CG2 3.33Å; V66-V70 PolarHBondContact O-N 3.34Å; V66-L123 HydrophobicContact CB-CD1 4.22Å; V66-L123 HydrophobicContact CG1-CD1 3.59Å |
| 67 | L | 94.8 | Very high | 93.3 | Very high | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -55.4 | -52.9 | 175.2 | 178.4 | 161.8 | 0 | 0 | 0 | 111.1 | A37 C63 T64 V70 H71 L123 F124 E127 | A37-L67 HydrophobicContact CB-CD1 4Å; A37-L67 HydrophobicContact CB-CD2 3.64Å; C63-L67 WeakPolarHBondContact O-CB 3.22Å; C63-L67 PolarHBondContact O-N 3.21Å; T64-L67 WeakPolarHBondContact O-CB 3.47Å; T64-L67 PolarHBondContact O-N 3.39Å; L67-V70 PolarHBondContact O-N 2.94Å; L67-H71 PolarHBondContact O-CD2 3.47Å; L67-H71 PolarHBondContact O-N 2.91Å; L67-H71 VanDerWaalsContact O-N 3.12Å; L67-L123 HydrophobicContact CB-CB 3.92Å; L67-L123 HydrophobicContact CD1-CB 4.35Å; L67-L123 HydrophobicContact CG-CB 4.23Å; L67-F124 VanDerWaalsContact CD1-CA 3.41Å; L67-F124 HydrophobicContact CD1-CB 3.95Å; L67-F124 HydrophobicContact CD1-CD2 4.18Å; L67-E127 HydrophobicContact CD1-CB 3.81Å; L67-E127 HydrophobicContact CD1-CG 4.15Å |
| 68 | V | 94.9 | Very high | 93 | Very high | 24 Ų | 24 | 43.1 Ų | 43.1 | 15% | 0.145 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.8 | -46.2 | 179.4 | 173.2 | 0 | 0 | 0 | 0 | 109.9 | M38 T64 T65 V66 V70 H71 L72 | M38-V68 HydrophobicContact CE-CG1 4.23Å; M38-V68 HydrophobicContact CE-CG2 4.38Å; T64-V68 WeakPolarHBondContact O-CG2 3.38Å; T64-V68 PolarHBondContact O-N 2.87Å; T65-V68 PolarHBondContact O-N 3.41Å; V66-V68 PolarHBondContact O-N 2.9Å; V68-V70 PolarHBondContact O-N 3.44Å; V68-H71 PolarHBondContact O-N 3.41Å; V68-L72 HydrophobicContact CG1-CD1 3.9Å; V68-L72 HydrophobicContact CG1-CG 4.22Å; V68-L72 WeakPolarHBondContact O-CB 3.47Å; V68-L72 VanDerWaalsContact O-CG 3.28Å; V68-L72 WeakPolarHBondContact O-CG 3.34Å; V68-L72 PolarHBondContact O-N 3.06Å |
| 69 | A | 95.3 | Very high | 92.6 | Very high | 53 Ų | 53 | 42.7 Ų | 42.7 | 44% | 0.438 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -58.9 | -44.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | T65 V66 L72 F73 | T65-A69 WeakPolarHBondContact O-CB 3.28Å; T65-A69 PolarHBondContact O-N 2.97Å; V66-A69 PolarHBondContact O-N 2.92Å; A69-L72 PolarHBondContact O-N 2.69Å; A69-F73 WeakPolarHBondContact O-CB 3.42Å; A69-F73 PolarHBondContact O-N 3.33Å |
| 70 | V | 94.1 | Very high | 91.8 | Very high | 27 Ų | 27 | 44.6 Ų | 44.6 | 16% | 0.164 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66.3 | -40.5 | -179.8 | 168.7 | 0 | 0 | 0 | 0 | 111.6 | V66 L67 V68 F73 A74 S116 I119 L123 | V66-V70 HydrophobicContact CG1-CG2 4.05Å; V66-V70 WeakPolarHBondContact O-CB 3.41Å; V66-V70 VanDerWaalsContact O-CG2 3.26Å; V66-V70 WeakPolarHBondContact O-CG2 3.33Å; V66-V70 PolarHBondContact O-N 3.34Å; L67-V70 PolarHBondContact O-N 2.94Å; V68-V70 PolarHBondContact O-N 3.44Å; V70-F73 WeakPolarHBondContact O-CB 3.16Å; V70-F73 PolarHBondContact O-N 3.01Å; V70-A74 PolarHBondContact O-N 3.36Å; V70-S116 WeakPolarHBondContact CG1-O 3.42Å; V70-I119 HydrophobicContact CG1-CB 4.2Å; V70-I119 HydrophobicContact CG1-CG2 4.02Å; V70-I119 HydrophobicContact CG2-CG2 4.13Å; V70-L123 HydrophobicContact CG2-CD1 4.17Å |
| 71 | H | 93.7 | Very high | 91.1 | Very high | 1 Ų | 1 | 44.2 Ų | 44.2 | 1% | 0.005 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -70.4 | -35.6 | 176.2 | -83.8 | -59.4 | 0 | 0 | 0 | 113 | S30 S34 L67 V68 F73 A74 L75 G120 | S30-H71 WeakPolarHBondContact CB-ND1 3.37Å; S30-H71 PolarHBondContact OG-ND1 2.92Å; S34-H71 WeakPolarHBondContact OG-CB 3.42Å; L67-H71 PolarHBondContact O-CD2 3.47Å; L67-H71 PolarHBondContact O-N 2.91Å; L67-H71 VanDerWaalsContact O-N 3.12Å; V68-H71 PolarHBondContact O-N 3.41Å; H71-F73 VanDerWaalsContact C-N 3.3Å; H71-A74 PolarHBondContact O-N 3Å; H71-L75 WeakPolarHBondContact O-CG 3.11Å; H71-L75 PolarHBondContact O-N 3.15Å; H71-G120 PolarHBondContact NE2-O 2.98Å |
| 72 | L | 92.3 | Very high | 90.1 | Very high | 102 Ų | 102 | 44 Ų | 44 | 53% | 0.534 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -63.5 | -38.1 | 170.5 | -70.1 | 178.9 | 0 | 0 | 0 | 111.4 | V68 A69 L75 M76 | V68-L72 HydrophobicContact CG1-CD1 3.9Å; V68-L72 HydrophobicContact CG1-CG 4.22Å; V68-L72 WeakPolarHBondContact O-CB 3.47Å; V68-L72 VanDerWaalsContact O-CG 3.28Å; V68-L72 WeakPolarHBondContact O-CG 3.34Å; V68-L72 PolarHBondContact O-N 3.06Å; A69-L72 PolarHBondContact O-N 2.69Å; L72-L75 HydrophobicContact CD2-CD1 4.19Å; L72-L75 WeakPolarHBondContact O-CB 3.39Å; L72-L75 PolarHBondContact O-N 3.21Å; L72-M76 PolarHBondContact O-N 2.94Å |
| 73 | F | 91.6 | Very high | 89 | Confident | 90 Ų | 90 | 45 Ų | 45 | 40% | 0.395 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63.6 | -44.1 | 173.2 | -179.7 | -95.9 | 0 | 0 | 0 | 111.7 | A69 V70 H71 L75 M76 V77 S116 | A69-F73 WeakPolarHBondContact O-CB 3.42Å; A69-F73 PolarHBondContact O-N 3.33Å; V70-F73 WeakPolarHBondContact O-CB 3.16Å; V70-F73 PolarHBondContact O-N 3.01Å; H71-F73 VanDerWaalsContact C-N 3.3Å; F73-L75 VanDerWaalsContact C-N 3.27Å; F73-L75 PolarHBondContact O-N 2.9Å; F73-M76 HydrophobicContact CD2-CE 3.62Å; F73-M76 HydrophobicContact CE2-CE 3.7Å; F73-M76 PolarHBondContact O-N 3.36Å; F73-V77 HydrophobicContact CD1-CG2 4.17Å; F73-V77 HydrophobicContact CE1-CG2 3.77Å; F73-V77 HydrophobicContact CE2-CG2 4.26Å; F73-V77 HydrophobicContact CZ-CG2 3.81Å; F73-V77 WeakPolarHBondContact O-CG2 3.2Å; F73-V77 PolarHBondContact O-N 2.92Å; F73-S116 WeakPolarHBondContact CD1-OG 3.3Å; F73-S116 VanDerWaalsContact CE1-OG 3.22Å; F73-S116 WeakPolarHBondContact CE1-OG 3.43Å |
| 74 | A | 89.8 | Confident | 87.8 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.5 | -36 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V70 H71 S78 | V70-A74 PolarHBondContact O-N 3.36Å; H71-A74 PolarHBondContact O-N 3Å; A74-S78 WeakPolarHBondContact O-CB 3.24Å; A74-S78 PolarHBondContact O-N 2.92Å; A74-S78 PolarHBondContact O-OG 3.33Å |
| 75 | L | 88.8 | Confident | 86.6 | Confident | 35 Ų | 35 | 48 Ų | 48 | 18% | 0.183 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -66.5 | -47.5 | 173.3 | -75.5 | 168.1 | 0 | 0 | 0 | 112 | S27 H71 L72 F73 V77 S78 T79 | S27-L75 VanDerWaalsContact CA-CD2 3.49Å; S27-L75 WeakPolarHBondContact O-CD2 3.48Å; S27-L75 WeakPolarHBondContact OG-CD2 3.25Å; H71-L75 WeakPolarHBondContact O-CG 3.11Å; H71-L75 PolarHBondContact O-N 3.15Å; L72-L75 HydrophobicContact CD2-CD1 4.19Å; L72-L75 WeakPolarHBondContact O-CB 3.39Å; L72-L75 PolarHBondContact O-N 3.21Å; F73-L75 VanDerWaalsContact C-N 3.27Å; F73-L75 PolarHBondContact O-N 2.9Å; L75-V77 VanDerWaalsContact C-N 3.31Å; L75-V77 PolarHBondContact O-N 3.19Å; L75-S78 WeakPolarHBondContact O-CB 3.38Å; L75-S78 PolarHBondContact O-N 3.25Å; L75-S78 VanDerWaalsContact O-N 3.11Å; L75-T79 PolarHBondContact O-N 3.19Å; L75-T79 PolarHBondContact O-OG1 3.2Å; L75-T79 VanDerWaalsContact O-OG1 3.12Å |
| 76 | M | 89.5 | Confident | 85.3 | Confident | 107 Ų | 107 | 47.4 Ų | 47.4 | 53% | 0.527 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -56.6 | -47.5 | 176.8 | -176.2 | -177.4 | 73.7 | 0 | 0 | 110.8 | L72 F73 S78 T79 C80 | L72-M76 PolarHBondContact O-N 2.94Å; F73-M76 HydrophobicContact CD2-CE 3.62Å; F73-M76 HydrophobicContact CE2-CE 3.7Å; F73-M76 PolarHBondContact O-N 3.36Å; M76-S78 VanDerWaalsContact C-N 3.31Å; M76-S78 PolarHBondContact O-N 3.22Å; M76-T79 WeakPolarHBondContact O-CB 3.48Å; M76-T79 PolarHBondContact O-N 3.43Å; M76-T79 VanDerWaalsContact O-N 3.16Å; M76-C80 PolarHBondContact O-N 3.45Å; M76-C80 PolarHBondContact O-SG 3.46Å |
| 77 | V | 86.8 | Confident | 83.9 | Confident | 10 Ų | 10 | 46.7 Ų | 46.7 | 6% | 0.061 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.6 | -39.8 | 177.7 | 179.8 | 0 | 0 | 0 | 0 | 111.1 | F73 L75 T79 C80 I81 I109 W113 | F73-V77 HydrophobicContact CD1-CG2 4.17Å; F73-V77 HydrophobicContact CE1-CG2 3.77Å; F73-V77 HydrophobicContact CE2-CG2 4.26Å; F73-V77 HydrophobicContact CZ-CG2 3.81Å; F73-V77 WeakPolarHBondContact O-CG2 3.2Å; F73-V77 PolarHBondContact O-N 2.92Å; L75-V77 VanDerWaalsContact C-N 3.31Å; L75-V77 PolarHBondContact O-N 3.19Å; V77-T79 VanDerWaalsContact C-N 3.32Å; V77-T79 PolarHBondContact O-N 2.98Å; V77-C80 PolarHBondContact O-N 3.17Å; V77-I81 HydrophobicContact CG1-CD1 3.7Å; V77-I81 HydrophobicContact CG1-CG1 4.19Å; V77-I81 VanDerWaalsContact O-CG1 3.28Å; V77-I81 WeakPolarHBondContact O-CG1 3.42Å; V77-I81 PolarHBondContact O-N 3.14Å; V77-I109 HydrophobicContact CG1-CG2 3.48Å; V77-I109 VanDerWaalsContact CG1-CG2 3.48Å; V77-W113 HydrophobicContact CB-CB 4.36Å; V77-W113 HydrophobicContact CG1-CB 3.67Å |
| 78 | S | 85.4 | Confident | 82.5 | Confident | 7 Ų | 7 | 50.1 Ų | 50.1 | 5% | 0.049 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.9 | -39.8 | 175.6 | -59.3 | 0 | 0 | 0 | 0 | 112.5 | A74 L75 M76 C80 I81 L82 | A74-S78 WeakPolarHBondContact O-CB 3.24Å; A74-S78 PolarHBondContact O-N 2.92Å; A74-S78 PolarHBondContact O-OG 3.33Å; L75-S78 WeakPolarHBondContact O-CB 3.38Å; L75-S78 PolarHBondContact O-N 3.25Å; L75-S78 VanDerWaalsContact O-N 3.11Å; M76-S78 VanDerWaalsContact C-N 3.31Å; M76-S78 PolarHBondContact O-N 3.22Å; S78-C80 VanDerWaalsContact C-N 3.33Å; S78-I81 PolarHBondContact O-N 3.46Å; S78-L82 WeakPolarHBondContact O-CB 3.02Å; S78-L82 PolarHBondContact O-N 3.22Å; S78-L82 VanDerWaalsContact O-N 3.17Å |
| 79 | T | 85.1 | Confident | 80.8 | Confident | 100 Ų | 100 | 50.8 Ų | 50.8 | 61% | 0.613 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -64.8 | -36.9 | 175 | -58.2 | 0 | 0 | 0 | 0 | 111.8 | L75 M76 V77 P83 | L75-T79 PolarHBondContact O-N 3.19Å; L75-T79 PolarHBondContact O-OG1 3.2Å; L75-T79 VanDerWaalsContact O-OG1 3.12Å; M76-T79 WeakPolarHBondContact O-CB 3.48Å; M76-T79 PolarHBondContact O-N 3.43Å; M76-T79 VanDerWaalsContact O-N 3.16Å; V77-T79 VanDerWaalsContact C-N 3.32Å; V77-T79 PolarHBondContact O-N 2.98Å; T79-P83 WeakPolarHBondContact O-CD 3.37Å |
| 80 | C | 78.6 | Confident | 79.2 | Confident | 82 Ų | 82 | 55 Ų | 55 | 55% | 0.554 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -75.5 | -30 | 178.5 | -62.3 | 0 | 0 | 0 | 0 | 113.4 | M76 V77 S78 | M76-C80 PolarHBondContact O-N 3.45Å; M76-C80 PolarHBondContact O-SG 3.46Å; V77-C80 PolarHBondContact O-N 3.17Å; S78-C80 VanDerWaalsContact C-N 3.33Å |
| 81 | I | 79.8 | Confident | 77.6 | Confident | 5 Ų | 5 | 57.7 Ų | 57.7 | 3% | 0.026 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -80 | -36.5 | 179.9 | -64.2 | 165.6 | 0 | 0 | 0 | 111.9 | L23 V77 S78 N84 I85 H106 I109 W113 | L23-I81 HydrophobicContact CD1-CB 3.87Å; L23-I81 HydrophobicContact CD1-CG2 3.59Å; L23-I81 HydrophobicContact CD2-CD1 4.05Å; V77-I81 HydrophobicContact CG1-CD1 3.7Å; V77-I81 HydrophobicContact CG1-CG1 4.19Å; V77-I81 VanDerWaalsContact O-CG1 3.28Å; V77-I81 WeakPolarHBondContact O-CG1 3.42Å; V77-I81 PolarHBondContact O-N 3.14Å; S78-I81 PolarHBondContact O-N 3.46Å; I81-N84 PolarHBondContact O-N 2.87Å; I81-N84 VanDerWaalsContact O-N 3.17Å; I81-I85 HydrophobicContact CG2-CD1 3.5Å; I81-I85 VanDerWaalsContact CG2-CD1 3.5Å; I81-I85 HydrophobicContact CG2-CG1 3.85Å; I81-I85 PolarHBondContact O-N 3.41Å; I81-I85 VanDerWaalsContact O-N 3.14Å; I81-H106 WeakPolarHBondContact CG2-NE2 3.26Å; I81-I109 HydrophobicContact CD1-CG2 3.75Å; I81-I109 HydrophobicContact CG1-CB 4.49Å; I81-I109 HydrophobicContact CG1-CG2 3.48Å; I81-I109 VanDerWaalsContact CG1-CG2 3.48Å; I81-W113 HydrophobicContact CD1-CB 4.37Å |
| 82 | L | 74.4 | Confident | 75.9 | Confident | 49 Ų | 49 | 65.3 Ų | 65.3 | 26% | 0.257 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -57.2 | -43.1 | -170.3 | -170.6 | 65.8 | 0 | 0 | 0 | 114.3 | S78 N84 I85 E86 | S78-L82 WeakPolarHBondContact O-CB 3.02Å; S78-L82 PolarHBondContact O-N 3.22Å; S78-L82 VanDerWaalsContact O-N 3.17Å; L82-N84 VanDerWaalsContact C-N 3.33Å; L82-N84 PolarHBondContact O-N 3.16Å; L82-I85 PolarHBondContact O-N 3.45Å; L82-E86 WeakPolarHBondContact O-CG 3.48Å; L82-E86 PolarHBondContact O-N 3.41Å |
| 83 | P | 72.3 | Confident | 73.9 | Confident | 71 Ų | 71 | 65.4 Ų | 65.4 | 46% | 0.461 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62 | -38.7 | 178.1 | -23.3 | 34.1 | 0 | 0 | 0 | 113.1 | T79 E86 A87 | T79-P83 WeakPolarHBondContact O-CD 3.37Å; P83-E86 PolarHBondContact O-N 2.93Å; P83-A87 WeakPolarHBondContact O-CB 3.44Å; P83-A87 PolarHBondContact O-N 2.99Å |
| 84 | N | 69.9 | Low | 72.1 | Confident | 68 Ų | 68 | 64.7 Ų | 64.7 | 36% | 0.364 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66.4 | -40.2 | 177.5 | -81.2 | -16.1 | 0 | 0 | 0 | 111.5 | I81 L82 V88 H102 | I81-N84 PolarHBondContact O-N 2.87Å; I81-N84 VanDerWaalsContact O-N 3.17Å; L82-N84 VanDerWaalsContact C-N 3.33Å; L82-N84 PolarHBondContact O-N 3.16Å; N84-V88 WeakPolarHBondContact O-CG2 3.41Å; N84-V88 PolarHBondContact O-N 3.17Å; N84-H102 PolarHBondContact ND2-NE2 3.1Å |
| 85 | I | 70.7 | Confident | 70.1 | Confident | 11 Ų | 11 | 71.5 Ų | 71.5 | 6% | 0.056 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.7 | -40.8 | 175.4 | -71.4 | -178.5 | 0 | 0 | 0 | 111.4 | L16 R20 L23 I81 L82 S89 | L16-I85 HydrophobicContact CD2-CG2 4.33Å; L16-I85 HydrophobicContact CG-CG2 4.07Å; R20-I85 HydrophobicContact CB-CG2 4.23Å; L23-I85 HydrophobicContact CD1-CD1 3.63Å; I81-I85 HydrophobicContact CG2-CD1 3.5Å; I81-I85 VanDerWaalsContact CG2-CD1 3.5Å; I81-I85 HydrophobicContact CG2-CG1 3.85Å; I81-I85 PolarHBondContact O-N 3.41Å; I81-I85 VanDerWaalsContact O-N 3.14Å; L82-I85 PolarHBondContact O-N 3.45Å; I85-S89 PolarHBondContact O-N 3.25Å |
| 86 | E | 68.5 | Low | 68 | Low | 82 Ų | 82 | 75 Ų | 75 | 38% | 0.383 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -68.6 | -41 | 179.4 | -72.4 | -175.9 | 167.1 | 0 | 0 | 112.1 | R20 L82 P83 V88 S89 N90 | R20-E86 IonicContact CZ-OE1 3.06Å; R20-E86 IonicContact NH1-OE1 3.72Å; R20-E86 PolarHBondContact NH1-OE1 3.38Å; R20-E86 IonicContact NH2-OE1 2.68Å; L82-E86 WeakPolarHBondContact O-CG 3.48Å; L82-E86 PolarHBondContact O-N 3.41Å; P83-E86 PolarHBondContact O-N 2.93Å; E86-V88 PolarHBondContact O-N 3.28Å; E86-S89 PolarHBondContact O-N 3.25Å; E86-S89 PolarHBondContact O-OG 3.24Å; E86-N90 PolarHBondContact O-N 3.32Å |
| 87 | A | 66.8 | Low | 66.1 | Low | 57 Ų | 57 | 74.6 Ų | 74.6 | 47% | 0.471 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -60.3 | -43.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.6 | P83 S89 N90 V91 | P83-A87 WeakPolarHBondContact O-CB 3.44Å; P83-A87 PolarHBondContact O-N 2.99Å; A87-S89 VanDerWaalsContact C-N 3.32Å; A87-S89 PolarHBondContact O-N 3.44Å; A87-N90 PolarHBondContact O-N 3.47Å; A87-V91 PolarHBondContact O-N 2.98Å |
| 88 | V | 64.9 | Low | 64.3 | Low | 71 Ų | 71 | 83.5 Ų | 83.5 | 43% | 0.43 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -67.4 | -31.4 | 177.2 | 175.4 | 0 | 0 | 0 | 0 | 112 | L16 N84 E86 N90 | L16-V88 HydrophobicContact CD1-CB 3.99Å; L16-V88 HydrophobicContact CD1-CG1 3.71Å; N84-V88 WeakPolarHBondContact O-CG2 3.41Å; N84-V88 PolarHBondContact O-N 3.17Å; E86-V88 PolarHBondContact O-N 3.28Å; V88-N90 VanDerWaalsContact C-N 3.34Å |
| 89 | S | 59.4 | Low | 62.3 | Low | 39 Ų | 39 | 92.2 Ų | 92.2 | 27% | 0.273 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -74.3 | -23.7 | 177.5 | 75.2 | 0 | 0 | 0 | 0 | 114.1 | I85 E86 A87 | I85-S89 PolarHBondContact O-N 3.25Å; E86-S89 PolarHBondContact O-N 3.25Å; E86-S89 PolarHBondContact O-OG 3.24Å; A87-S89 VanDerWaalsContact C-N 3.32Å; A87-S89 PolarHBondContact O-N 3.44Å |
| 90 | N | 61.9 | Low | 60.3 | Low | 140 Ų | 140 | 90.7 Ų | 90.7 | 75% | 0.749 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -88.1 | -25.5 | -174 | -161.5 | 28.8 | 0 | 0 | 0 | 112.8 | E86 A87 V88 H92 | E86-N90 PolarHBondContact O-N 3.32Å; A87-N90 PolarHBondContact O-N 3.47Å; V88-N90 VanDerWaalsContact C-N 3.34Å; N90-H92 PolarHBondContact O-N 3.11Å |
| 91 | V | 60.2 | Low | 58.9 | Low | 85 Ų | 85 | 92.7 Ų | 92.7 | 52% | 0.515 | 52% | 0.515 | S | S | . | . | trans | -92.6 | 99.4 | 177.3 | 177.6 | 0 | 0 | 0 | 0 | 109.4 | A87 N93 | A87-V91 PolarHBondContact O-N 2.98Å; V91-N93 HydrophobicContact CG1-CB 4.13Å; V91-N93 PolarHBondContact O-N 3.47Å | ||
| 92 | H | 57.1 | Low | 57.8 | Low | 161 Ų | 161 | 95.5 Ų | 95.5 | 75% | 0.745 | 53% | 0.528 | S | S | * | . | trans | -69.3 | 21.8 | 179.8 | -130.3 | 82.4 | 0 | 0 | 0 | 114.6 | N90 | N90-H92 PolarHBondContact O-N 3.11Š| ||
| 93 | N | 50.7 | Low | 57.1 | Low | 104 Ų | 104 | 100.9 Ų | 100.9 | 56% | 0.556 | 55% | 0.552 | S | S | * | * | trans | -126.7 | 85.2 | -172.2 | -159.4 | -29.3 | 0 | 0 | 0 | 110.8 | V91 N95 | V91-N93 HydrophobicContact CG1-CB 4.13Å; V91-N93 PolarHBondContact O-N 3.47Å; N93-N95 PolarHBondContact O-N 3.44Å; N93-N95 VanDerWaalsContact O-N 3.14Å | ||
| 94 | L | 53.8 | Low | 56.5 | Low | 75 Ų | 75 | 105.1 Ų | 105.1 | 39% | 0.393 | 56% | 0.559 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -73.6 | 3.3 | -172.9 | -66.1 | 178.5 | 0 | 0 | 0 | 114.8 | Q9 | Q9-L94 HydrophobicContact CB-CD1 3.93Å; Q9-L94 HydrophobicContact CG-CD1 3.38Å |
| 95 | N | 47.1 | Very low | 56.2 | Low | 143 Ų | 143 | 107 Ų | 107 | 77% | 0.765 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | -0.4 | -171.9 | -77.5 | -9.6 | 0 | 0 | 0 | 115.1 | N93 | N93-N95 PolarHBondContact O-N 3.44Å; N93-N95 VanDerWaalsContact O-N 3.14Å |
| 96 | S | 46.1 | Very low | 56.2 | Low | 108 Ų | 108 | 108.2 Ų | 108.2 | 76% | 0.755 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -129.1 | 9.8 | -176.8 | -149.3 | 0 | 0 | 0 | 0 | 115.7 | ||
| 97 | V | 49.1 | Very low | 56.3 | Low | 99 Ų | 99 | 109 Ų | 109 | 60% | 0.6 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -110.3 | 6.3 | -175.9 | -179.3 | 0 | 0 | 0 | 0 | 112.6 | E99 | V97-E99 VanDerWaalsContact C-N 3.33Å; V97-E99 PolarHBondContact O-N 2.86Å |
| 98 | K | 48 | Very low | 56.7 | Low | 196 Ų | 196 | 108.4 Ų | 108.4 | 85% | 0.852 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | 2.3 | -176.6 | -128.8 | 179.2 | -177.7 | -175.1 | 0 | 114.8 | ||
| 99 | E | 44.9 | Very low | 57.4 | Low | 191 Ų | 191 | 107.8 Ų | 107.8 | 89% | 0.893 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.1 | 20.8 | -166.2 | -130.5 | -179.7 | -147.8 | 0 | 0 | 115.5 | V97 | V97-E99 VanDerWaalsContact C-N 3.33Å; V97-E99 PolarHBondContact O-N 2.86Å |
| 100 | S | 43.2 | Very low | 58.4 | Low | 68 Ų | 68 | 108.4 Ų | 108.4 | 48% | 0.476 | 56% | 0.555 | S | S | . | * | S | Bend | trans | -115.2 | 142.8 | 167.6 | 82.6 | 0 | 0 | 0 | 0 | 111.8 | H102 | S100-H102 PolarHBondContact O-N 3.22Å; S100-H102 WeakPolarHBondContact OG-CB 3.25Å |
| 101 | P | 48.9 | Very low | 59.4 | Low | 123 Ų | 123 | 103 Ų | 103 | 80% | 0.799 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.8 | 11 | 176 | 24.1 | -32.7 | 0 | 0 | 0 | 114.7 | ||
| 102 | H | 55.5 | Low | 60.5 | Low | 64 Ų | 64 | 100.2 Ų | 100.2 | 30% | 0.296 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.1 | -29.8 | -178.9 | -171.5 | -80 | 0 | 0 | 0 | 114 | N84 S100 R104 M105 H106 | N84-H102 PolarHBondContact ND2-NE2 3.1Å; S100-H102 PolarHBondContact O-N 3.22Å; S100-H102 WeakPolarHBondContact OG-CB 3.25Å; H102-R104 VanDerWaalsContact C-N 3.33Å; H102-R104 PolarHBondContact O-N 3.02Å; H102-M105 PolarHBondContact O-N 3.5Å; H102-M105 VanDerWaalsContact O-N 3.17Å; H102-H106 WeakPolarHBondContact O-CB 3.2Å; H102-H106 PolarHBondContact O-N 3.36Å |
| 103 | E | 59.9 | Low | 62 | Low | 162 Ų | 162 | 93.6 Ų | 93.6 | 76% | 0.757 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60 | -42.7 | 179.9 | -168.3 | 83 | 179.1 | 0 | 0 | 111.5 | H106 H107 | E103-H106 PolarHBondContact O-N 3.32Å; E103-H107 PolarHBondContact O-N 2.96Å |
| 104 | R | 59.4 | Low | 63.7 | Low | 161 Ų | 161 | 89.6 Ų | 89.6 | 61% | 0.608 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -66.1 | -41.3 | 175.4 | -88 | -174.3 | 164.3 | 160.1 | -4.8 | 111.8 | H102 H106 H107 H108 | H102-R104 VanDerWaalsContact C-N 3.33Å; H102-R104 PolarHBondContact O-N 3.02Å; R104-H106 VanDerWaalsContact C-N 3.35Å; R104-H106 PolarHBondContact O-N 3.23Å; R104-H107 PolarHBondContact O-N 3.45Å; R104-H108 PolarHBondContact O-CD2 2.87Å; R104-H108 PolarHBondContact O-N 3.03Å |
| 105 | M | 63.4 | Low | 65.3 | Low | 106 Ų | 106 | 88.1 Ų | 88.1 | 52% | 0.522 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63.3 | -42 | 177.2 | -171.2 | 163.4 | 70.3 | 0 | 0 | 111.6 | H102 H107 H108 I109 | H102-M105 PolarHBondContact O-N 3.5Å; H102-M105 VanDerWaalsContact O-N 3.17Å; M105-H107 PolarHBondContact O-N 3.32Å; M105-H108 WeakPolarHBondContact O-CB 3.39Å; M105-H108 PolarHBondContact O-N 2.91Å; M105-I109 HydrophobicContact CG-CD1 4.37Å; M105-I109 WeakPolarHBondContact O-CG1 3.29Å; M105-I109 PolarHBondContact O-N 3.02Å |
| 106 | H | 70.6 | Confident | 67.4 | Low | 38 Ų | 38 | 81.7 Ų | 81.7 | 18% | 0.176 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -65.5 | -38.4 | 177.6 | -169.4 | -74.7 | 0 | 0 | 0 | 112.4 | I81 H102 E103 R104 H108 I109 E110 | I81-H106 WeakPolarHBondContact CG2-NE2 3.26Å; H102-H106 WeakPolarHBondContact O-CB 3.2Å; H102-H106 PolarHBondContact O-N 3.36Å; E103-H106 PolarHBondContact O-N 3.32Å; R104-H106 VanDerWaalsContact C-N 3.35Å; R104-H106 PolarHBondContact O-N 3.23Å; H106-H108 VanDerWaalsContact C-N 3.28Å; H106-H108 PolarHBondContact O-N 3.4Å; H106-I109 PolarHBondContact O-N 2.91Å; H106-E110 PolarHBondContact O-N 3.46Å |
| 107 | H | 72.4 | Confident | 69.5 | Low | 98 Ų | 98 | 77.9 Ų | 77.9 | 45% | 0.454 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -60.3 | -38.6 | 175.7 | -169.3 | 63.7 | 0 | 0 | 0 | 112 | E103 R104 M105 E110 L111 | E103-H107 PolarHBondContact O-N 2.96Å; R104-H107 PolarHBondContact O-N 3.45Å; M105-H107 PolarHBondContact O-N 3.32Å; H107-E110 PolarHBondContact O-N 3.09Å; H107-L111 WeakPolarHBondContact O-CB 3.35Å; H107-L111 PolarHBondContact O-N 3.2Å |
| 108 | H | 74.5 | Confident | 71.5 | Confident | 45 Ų | 45 | 74.3 Ų | 74.3 | 21% | 0.208 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -64.7 | -40.5 | 174.8 | -66 | -50.7 | 0 | 0 | 0 | 113 | R104 M105 H106 L111 A112 H186 | R104-H108 PolarHBondContact O-CD2 2.87Å; R104-H108 PolarHBondContact O-N 3.03Å; M105-H108 WeakPolarHBondContact O-CB 3.39Å; M105-H108 PolarHBondContact O-N 2.91Å; H106-H108 VanDerWaalsContact C-N 3.28Å; H106-H108 PolarHBondContact O-N 3.4Å; H108-L111 PolarHBondContact O-N 3.36Å; H108-A112 WeakPolarHBondContact O-CB 3.28Å; H108-A112 PolarHBondContact O-N 2.98Å; H108-H186 AromaticContact CE1-CE1 3.52Å; H108-H186 AromaticContact CE1-CG 3.79Å; H108-H186 AromaticContact CE1-ND1 3.34Å; H108-H186 PolarHBondContact CE1-ND1 2.99Å; H108-H186 VanDerWaalsContact CE1-ND1 3.34Å; H108-H186 AromaticContact NE2-CE1 3.79Å; H108-H186 AromaticContact NE2-ND1 3.9Å |
| 109 | I | 78.9 | Confident | 73.6 | Confident | 57 Ų | 57 | 67.2 Ų | 67.2 | 29% | 0.292 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.9 | -41.2 | 178.3 | -59.6 | 169.5 | 0 | 0 | 0 | 109.7 | V77 I81 M105 H106 A112 W113 | V77-I109 HydrophobicContact CG1-CG2 3.48Å; V77-I109 VanDerWaalsContact CG1-CG2 3.48Å; I81-I109 HydrophobicContact CD1-CG2 3.75Å; I81-I109 HydrophobicContact CG1-CB 4.49Å; I81-I109 HydrophobicContact CG1-CG2 3.48Å; I81-I109 VanDerWaalsContact CG1-CG2 3.48Å; M105-I109 HydrophobicContact CG-CD1 4.37Å; M105-I109 WeakPolarHBondContact O-CG1 3.29Å; M105-I109 PolarHBondContact O-N 3.02Å; H106-I109 PolarHBondContact O-N 2.91Å; I109-A112 PolarHBondContact O-N 3.29Å; I109-W113 WeakPolarHBondContact O-CB 3.47Å; I109-W113 PolarHBondContact O-N 3.42Å |
| 110 | E | 81.4 | Confident | 75.9 | Confident | 53 Ų | 53 | 58.1 Ų | 58.1 | 25% | 0.248 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.4 | -41.1 | 173.8 | -170.3 | -179.8 | 179.8 | 0 | 0 | 111.7 | K22 H106 H107 W113 A114 | K22-E110 IonicContact NZ-OE1 3.66Å; K22-E110 PolarHBondContact NZ-OE1 3.04Å; H106-E110 PolarHBondContact O-N 3.46Å; H107-E110 PolarHBondContact O-N 3.09Å; E110-W113 HydrophobicContact CG-CE3 4.08Å; E110-W113 WeakPolarHBondContact O-CB 3.37Å; E110-W113 PolarHBondContact O-N 2.96Å; E110-A114 WeakPolarHBondContact O-CB 3.41Å; E110-A114 PolarHBondContact O-N 2.81Å |
| 111 | L | 81.3 | Confident | 78.2 | Confident | 26 Ų | 26 | 56.8 Ų | 56.8 | 14% | 0.136 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -69.6 | -38.7 | 179.9 | -143 | 149.3 | 0 | 0 | 0 | 111.6 | H107 H108 A114 F115 F179 L183 | H107-L111 WeakPolarHBondContact O-CB 3.35Å; H107-L111 PolarHBondContact O-N 3.2Å; H108-L111 PolarHBondContact O-N 3.36Å; L111-A114 PolarHBondContact O-N 2.81Å; L111-F115 VanDerWaalsContact O-CB 3.25Å; L111-F115 WeakPolarHBondContact O-CB 3.43Å; L111-F115 PolarHBondContact O-N 3.38Å; L111-F179 HydrophobicContact CD2-CD1 4.49Å; L111-L183 HydrophobicContact CB-CD2 4.03Å; L111-L183 HydrophobicContact CD2-CB 4.43Å; L111-L183 HydrophobicContact CD2-CD1 4.28Å; L111-L183 HydrophobicContact CD2-CD2 3.32Å; L111-L183 HydrophobicContact CD2-CG 3.36Å; L111-L183 HydrophobicContact CG-CD2 4.22Å |
| 112 | A | 83.9 | Confident | 80.4 | Confident | 27 Ų | 27 | 53.1 Ų | 53.1 | 22% | 0.223 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -64 | -40.8 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | H108 I109 S116 | H108-A112 WeakPolarHBondContact O-CB 3.28Å; H108-A112 PolarHBondContact O-N 2.98Å; I109-A112 PolarHBondContact O-N 3.29Å; A112-S116 WeakPolarHBondContact O-CB 3.47Å; A112-S116 PolarHBondContact O-N 2.93Å; A112-S116 PolarHBondContact O-OG 3.12Å |
| 113 | W | 88.4 | Confident | 82.2 | Confident | 22 Ų | 22 | 51.4 Ų | 51.4 | 8% | 0.083 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.6 | -49.7 | 172.8 | 163.4 | 74.5 | 0 | 0 | 0 | 112 | K22 L23 S26 V77 I81 I109 E110 F115 S116 T117 | K22-W113 HydrophobicContact CB-CH2 4.04Å; K22-W113 HydrophobicContact CB-CZ2 4.49Å; K22-W113 VanDerWaalsContact CE-CH2 3.48Å; K22-W113 VanDerWaalsContact CE-CZ3 3.49Å; L23-W113 HydrophobicContact CD2-CD2 4.39Å; L23-W113 HydrophobicContact CD2-CG 4.5Å; S26-W113 WeakPolarHBondContact OG-CZ2 3.46Å; S26-W113 PolarHBondContact OG-NE1 3.43Å; V77-W113 HydrophobicContact CB-CB 4.36Å; V77-W113 HydrophobicContact CG1-CB 3.67Å; I81-W113 HydrophobicContact CD1-CB 4.37Å; I109-W113 WeakPolarHBondContact O-CB 3.47Å; I109-W113 PolarHBondContact O-N 3.42Å; E110-W113 HydrophobicContact CG-CE3 4.08Å; E110-W113 WeakPolarHBondContact O-CB 3.37Å; E110-W113 PolarHBondContact O-N 2.96Å; W113-F115 PolarHBondContact O-N 3.44Å; W113-S116 PolarHBondContact O-N 3.38Å; W113-T117 PolarHBondContact O-N 3.47Å; W113-T117 PolarHBondContact O-OG1 3.34Å |
| 114 | A | 86.7 | Confident | 83.9 | Confident | 20 Ų | 20 | 46.3 Ų | 46.3 | 17% | 0.165 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.4 | -45.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | E110 L111 S116 T117 V118 | E110-A114 WeakPolarHBondContact O-CB 3.41Å; E110-A114 PolarHBondContact O-N 2.81Å; L111-A114 PolarHBondContact O-N 2.81Å; A114-S116 PolarHBondContact O-N 3.24Å; A114-T117 PolarHBondContact O-N 2.91Å; A114-V118 WeakPolarHBondContact O-CG2 3.18Å; A114-V118 PolarHBondContact O-N 3.33Å |
| 115 | F | 87.9 | Confident | 85.5 | Confident | 44 Ų | 44 | 40.2 Ų | 40.2 | 19% | 0.193 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58.4 | -46.3 | 176.9 | 176.9 | -108.9 | 0 | 0 | 0 | 112.6 | L111 W113 T117 V118 I119 F179 Y180 L183 | L111-F115 VanDerWaalsContact O-CB 3.25Å; L111-F115 WeakPolarHBondContact O-CB 3.43Å; L111-F115 PolarHBondContact O-N 3.38Å; W113-F115 PolarHBondContact O-N 3.44Å; F115-T117 VanDerWaalsContact C-N 3.28Å; F115-T117 PolarHBondContact O-N 2.97Å; F115-V118 PolarHBondContact O-N 3.29Å; F115-I119 HydrophobicContact CD1-CD1 3.98Å; F115-I119 HydrophobicContact CD2-CD1 4.19Å; F115-I119 HydrophobicContact CD2-CG1 4.43Å; F115-I119 HydrophobicContact CE1-CD1 3.33Å; F115-I119 HydrophobicContact CE1-CG1 4.38Å; F115-I119 HydrophobicContact CE2-CD1 3.56Å; F115-I119 HydrophobicContact CE2-CG1 4.14Å; F115-I119 HydrophobicContact CG-CD1 4.4Å; F115-I119 HydrophobicContact CZ-CD1 3.11Å; F115-I119 HydrophobicContact CZ-CG1 4.15Å; F115-I119 PolarHBondContact O-N 3.22Å; F115-F179 HydrophobicContact CD2-CB 4.04Å; F115-Y180 HydrophobicContact CE2-CD2 4.48Å; F115-Y180 HydrophobicContact CZ-CD2 4.32Å; F115-L183 HydrophobicContact CB-CD1 4.02Å; F115-L183 HydrophobicContact CD1-CD1 3.95Å; F115-L183 HydrophobicContact CD2-CD1 4.08Å; F115-L183 HydrophobicContact CE1-CD1 4.34Å; F115-L183 HydrophobicContact CE2-CD1 4.48Å; F115-L183 HydrophobicContact CG-CD1 3.76Å |
| 116 | S | 90.2 | Very high | 87 | Confident | 7 Ų | 7 | 36.9 Ų | 36.9 | 5% | 0.049 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.8 | -35.3 | 179.3 | -53.3 | 0 | 0 | 0 | 0 | 111.7 | V70 F73 A112 W113 A114 G120 | V70-S116 WeakPolarHBondContact CG1-O 3.42Å; F73-S116 WeakPolarHBondContact CD1-OG 3.3Å; F73-S116 VanDerWaalsContact CE1-OG 3.22Å; F73-S116 WeakPolarHBondContact CE1-OG 3.43Å; A112-S116 WeakPolarHBondContact O-CB 3.47Å; A112-S116 PolarHBondContact O-N 2.93Å; A112-S116 PolarHBondContact O-OG 3.12Å; W113-S116 PolarHBondContact O-N 3.38Å; A114-S116 PolarHBondContact O-N 3.24Å; S116-G120 PolarHBondContact O-N 3.31Å |
| 117 | T | 90.8 | Very high | 88.2 | Confident | 28 Ų | 28 | 35.2 Ų | 35.2 | 17% | 0.172 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -67.5 | -40.9 | 175.4 | -53.2 | 0 | 0 | 0 | 0 | 111.6 | W113 A114 F115 T121 | W113-T117 PolarHBondContact O-N 3.47Å; W113-T117 PolarHBondContact O-OG1 3.34Å; A114-T117 PolarHBondContact O-N 2.91Å; F115-T117 VanDerWaalsContact C-N 3.28Å; F115-T117 PolarHBondContact O-N 2.97Å; T117-T121 WeakPolarHBondContact O-CB 3.46Å; T117-T121 PolarHBondContact O-N 2.95Å; T117-T121 PolarHBondContact O-OG1 3.32Å |
| 118 | V | 90.9 | Very high | 89.2 | Confident | 24 Ų | 24 | 32.8 Ų | 32.8 | 15% | 0.145 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.6 | -47 | 177.1 | 174.6 | 0 | 0 | 0 | 0 | 111 | A114 F115 T121 L122 F172 F175 A176 F179 | A114-V118 WeakPolarHBondContact O-CG2 3.18Å; A114-V118 PolarHBondContact O-N 3.33Å; F115-V118 PolarHBondContact O-N 3.29Å; V118-T121 PolarHBondContact O-N 3.39Å; V118-L122 PolarHBondContact O-N 3.44Å; V118-F172 HydrophobicContact CG1-CD1 4.49Å; V118-F175 HydrophobicContact CG1-CB 4.37Å; V118-A176 HydrophobicContact CG1-CB 4.17Å; V118-F179 HydrophobicContact CG2-CD2 4.08Å; V118-F179 HydrophobicContact CG2-CE2 3.98Å |
| 119 | I | 92 | Very high | 90.1 | Very high | 47 Ų | 47 | 31.7 Ų | 31.7 | 24% | 0.241 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.6 | -45.1 | 176.6 | -70.9 | -172 | 0 | 0 | 0 | 111.1 | V70 F115 T121 L122 L123 | V70-I119 HydrophobicContact CG1-CB 4.2Å; V70-I119 HydrophobicContact CG1-CG2 4.02Å; V70-I119 HydrophobicContact CG2-CG2 4.13Å; F115-I119 HydrophobicContact CD1-CD1 3.98Å; F115-I119 HydrophobicContact CD2-CD1 4.19Å; F115-I119 HydrophobicContact CD2-CG1 4.43Å; F115-I119 HydrophobicContact CE1-CD1 3.33Å; F115-I119 HydrophobicContact CE1-CG1 4.38Å; F115-I119 HydrophobicContact CE2-CD1 3.56Å; F115-I119 HydrophobicContact CE2-CG1 4.14Å; F115-I119 HydrophobicContact CG-CD1 4.4Å; F115-I119 HydrophobicContact CZ-CD1 3.11Å; F115-I119 HydrophobicContact CZ-CG1 4.15Å; F115-I119 PolarHBondContact O-N 3.22Å; I119-T121 VanDerWaalsContact C-N 3.28Å; I119-T121 PolarHBondContact O-N 2.87Å; I119-L122 PolarHBondContact O-N 3.38Å; I119-L122 VanDerWaalsContact O-N 3.14Å; I119-L123 HydrophobicContact CG2-CD1 3.75Å; I119-L123 HydrophobicContact CG2-CG 4.19Å; I119-L123 WeakPolarHBondContact O-CG 3.32Å; I119-L123 PolarHBondContact O-N 3.12Å |
| 120 | G | 93.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -58.1 | -42.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | H71 S116 L123 F124 | H71-G120 PolarHBondContact NE2-O 2.98Å; S116-G120 PolarHBondContact O-N 3.31Å; G120-L123 PolarHBondContact O-N 3.39Å; G120-F124 WeakPolarHBondContact O-CB 3.45Å; G120-F124 PolarHBondContact O-N 2.84Å |
| 121 | T | 92.6 | Very high | 91.4 | Very high | 41 Ų | 41 | 29.5 Ų | 29.5 | 25% | 0.252 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -64.7 | -40.6 | 175.7 | -51.5 | 0 | 0 | 0 | 0 | 112.2 | T117 V118 I119 F124 L125 F172 | T117-T121 WeakPolarHBondContact O-CB 3.46Å; T117-T121 PolarHBondContact O-N 2.95Å; T117-T121 PolarHBondContact O-OG1 3.32Å; V118-T121 PolarHBondContact O-N 3.39Å; I119-T121 VanDerWaalsContact C-N 3.28Å; I119-T121 PolarHBondContact O-N 2.87Å; T121-F124 PolarHBondContact O-N 2.91Å; T121-L125 PolarHBondContact O-N 3.49Å; T121-F172 HydrophobicContact CG2-CD1 4.45Å; T121-F172 HydrophobicContact CG2-CE1 3.69Å; T121-F172 HydrophobicContact CG2-CE2 4.38Å; T121-F172 HydrophobicContact CG2-CZ 3.66Å |
| 122 | L | 93.4 | Very high | 92 | Very high | 45 Ų | 45 | 29.2 Ų | 29.2 | 24% | 0.236 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.7 | -42.7 | 175.6 | -177.9 | 153.2 | 0 | 0 | 0 | 111.6 | V118 I119 F124 L125 A126 F172 I173 | V118-L122 PolarHBondContact O-N 3.44Å; I119-L122 PolarHBondContact O-N 3.38Å; I119-L122 VanDerWaalsContact O-N 3.14Å; L122-F124 VanDerWaalsContact C-N 3.33Å; L122-L125 VanDerWaalsContact O-CB 3.32Å; L122-L125 WeakPolarHBondContact O-CB 3.33Å; L122-L125 PolarHBondContact O-N 3.47Å; L122-A126 PolarHBondContact O-N 3.38Å; L122-F172 HydrophobicContact CB-CB 4.36Å; L122-F172 HydrophobicContact CD1-CB 4.08Å; L122-I173 HydrophobicContact CD1-CG1 3.68Å |
| 123 | L | 94.6 | Very high | 92.4 | Very high | 28 Ų | 28 | 31.3 Ų | 31.3 | 15% | 0.147 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.6 | -37.5 | 176 | -70.5 | 170.5 | 0 | 0 | 0 | 111.3 | V66 L67 V70 I119 G120 L125 A126 E127 | V66-L123 HydrophobicContact CB-CD1 4.22Å; V66-L123 HydrophobicContact CG1-CD1 3.59Å; L67-L123 HydrophobicContact CB-CB 3.92Å; L67-L123 HydrophobicContact CD1-CB 4.35Å; L67-L123 HydrophobicContact CG-CB 4.23Å; V70-L123 HydrophobicContact CG2-CD1 4.17Å; I119-L123 HydrophobicContact CG2-CD1 3.75Å; I119-L123 HydrophobicContact CG2-CG 4.19Å; I119-L123 WeakPolarHBondContact O-CG 3.32Å; I119-L123 PolarHBondContact O-N 3.12Å; G120-L123 PolarHBondContact O-N 3.39Å; L123-L125 VanDerWaalsContact C-N 3.29Å; L123-L125 PolarHBondContact O-N 3.3Å; L123-A126 PolarHBondContact O-N 2.98Å; L123-E127 WeakPolarHBondContact O-CB 3.37Å; L123-E127 PolarHBondContact O-N 2.79Å |
| 124 | F | 94.8 | Very high | 92.5 | Very high | 56 Ų | 56 | 30.3 Ų | 30.3 | 25% | 0.246 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -61.8 | -38.6 | 173 | -175.2 | -95 | 0 | 0 | 0 | 112.3 | L33 A37 L67 G120 T121 L122 E127 V128 | L33-F124 HydrophobicContact CB-CD2 4.12Å; L33-F124 HydrophobicContact CB-CE2 4.36Å; L33-F124 HydrophobicContact CD2-CD1 3.97Å; L33-F124 HydrophobicContact CD2-CD2 3.99Å; L33-F124 HydrophobicContact CD2-CE1 3.8Å; L33-F124 HydrophobicContact CD2-CE2 3.82Å; L33-F124 HydrophobicContact CD2-CG 4.07Å; L33-F124 HydrophobicContact CD2-CZ 3.72Å; A37-F124 HydrophobicContact CB-CD2 4.48Å; L67-F124 VanDerWaalsContact CD1-CA 3.41Å; L67-F124 HydrophobicContact CD1-CB 3.95Å; L67-F124 HydrophobicContact CD1-CD2 4.18Å; G120-F124 WeakPolarHBondContact O-CB 3.45Å; G120-F124 PolarHBondContact O-N 2.84Å; T121-F124 PolarHBondContact O-N 2.91Å; L122-F124 VanDerWaalsContact C-N 3.33Å; F124-E127 WeakPolarHBondContact O-CB 3.05Å; F124-E127 PolarHBondContact O-N 3.02Å; F124-V128 HydrophobicContact CE1-CG2 4.19Å; F124-V128 HydrophobicContact CZ-CG2 4.45Å; F124-V128 WeakPolarHBondContact O-CG2 3.44Å; F124-V128 PolarHBondContact O-N 3.36Å; F124-V128 VanDerWaalsContact O-N 3.12Å |
| 125 | L | 94.1 | Very high | 92.7 | Very high | 32 Ų | 32 | 34.4 Ų | 34.4 | 17% | 0.168 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.4 | -44.7 | 173.2 | -160.8 | 73.1 | 0 | 0 | 0 | 111.8 | T121 L122 L123 E127 V128 V129 M165 F168 F172 | T121-L125 PolarHBondContact O-N 3.49Å; L122-L125 VanDerWaalsContact O-CB 3.32Å; L122-L125 WeakPolarHBondContact O-CB 3.33Å; L122-L125 PolarHBondContact O-N 3.47Å; L123-L125 VanDerWaalsContact C-N 3.29Å; L123-L125 PolarHBondContact O-N 3.3Å; L125-E127 VanDerWaalsContact C-N 3.33Å; L125-V128 PolarHBondContact O-N 2.9Å; L125-V129 PolarHBondContact O-N 3.12Å; L125-M165 HydrophobicContact CD1-CE 4.28Å; L125-M165 HydrophobicContact CD1-CG 3.55Å; L125-M165 HydrophobicContact CD1-SD 3.27Å; L125-M165 WeakPolarHBondContact CD1-SD 3.5Å; L125-M165 HydrophobicContact CD2-CG 3.89Å; L125-M165 HydrophobicContact CG-CG 3.46Å; L125-M165 VanDerWaalsContact CG-CG 3.46Å; L125-M165 HydrophobicContact CG-SD 3.94Å; L125-F168 HydrophobicContact CD2-CB 4.01Å; L125-F172 HydrophobicContact CD2-CD2 4.42Å |
| 126 | A | 94.6 | Very high | 92.7 | Very high | 37 Ų | 37 | 35.8 Ų | 35.8 | 31% | 0.306 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -63.7 | -39.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L122 L123 V128 V129 L130 | L122-A126 PolarHBondContact O-N 3.38Å; L123-A126 PolarHBondContact O-N 2.98Å; A126-V128 PolarHBondContact O-N 3.3Å; A126-V129 WeakPolarHBondContact O-CB 3.44Å; A126-V129 PolarHBondContact O-N 2.95Å; A126-L130 WeakPolarHBondContact O-CG 3.27Å; A126-L130 PolarHBondContact O-N 3.29Å |
| 127 | E | 94.5 | Very high | 92.4 | Very high | 2 Ų | 2 | 36.1 Ų | 36.1 | 1% | 0.009 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.9 | -46.9 | 176.4 | -172.8 | 70.2 | -179.8 | 0 | 0 | 111.4 | A37 F60 C63 T64 L67 L123 F124 L125 V129 L130 L131 | A37-E127 HydrophobicContact CB-CG 4.42Å; F60-E127 WeakPolarHBondContact CE2-OE1 3.33Å; C63-E127 PolarHBondContact SG-OE2 3.11Å; T64-E127 WeakPolarHBondContact CB-OE1 3.4Å; T64-E127 WeakPolarHBondContact CG2-OE1 3.38Å; T64-E127 PolarHBondContact N-OE2 3.4Å; T64-E127 PolarHBondContact OG1-OE1 3.26Å; T64-E127 PolarHBondContact OG1-OE2 2.96Å; L67-E127 HydrophobicContact CD1-CB 3.81Å; L67-E127 HydrophobicContact CD1-CG 4.15Å; L123-E127 WeakPolarHBondContact O-CB 3.37Å; L123-E127 PolarHBondContact O-N 2.79Å; F124-E127 WeakPolarHBondContact O-CB 3.05Å; F124-E127 PolarHBondContact O-N 3.02Å; L125-E127 VanDerWaalsContact C-N 3.33Å; E127-V129 VanDerWaalsContact C-N 3.27Å; E127-V129 PolarHBondContact O-N 2.92Å; E127-L130 PolarHBondContact O-N 2.91Å; E127-L131 HydrophobicContact CG-CD1 4.28Å; E127-L131 WeakPolarHBondContact O-CB 3.35Å; E127-L131 VanDerWaalsContact O-CG 3.31Å; E127-L131 WeakPolarHBondContact O-CG 3.3Å; E127-L131 PolarHBondContact O-N 3.35Å |
| 128 | V | 93.7 | Very high | 92.1 | Very high | 48 Ų | 48 | 36.6 Ų | 36.6 | 29% | 0.291 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -60.4 | -38.9 | 176.9 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | F124 L125 A126 C132 M165 | F124-V128 HydrophobicContact CE1-CG2 4.19Å; F124-V128 HydrophobicContact CZ-CG2 4.45Å; F124-V128 WeakPolarHBondContact O-CG2 3.44Å; F124-V128 PolarHBondContact O-N 3.36Å; F124-V128 VanDerWaalsContact O-N 3.12Å; L125-V128 PolarHBondContact O-N 2.9Å; A126-V128 PolarHBondContact O-N 3.3Å; V128-C132 PolarHBondContact O-N 2.73Å; V128-C132 VanDerWaalsContact O-N 3.1Å; V128-C132 PolarHBondContact O-SG 2.89Å; V128-M165 HydrophobicContact CB-CE 4.45Å; V128-M165 HydrophobicContact CG1-CE 3.8Å |
| 129 | V | 94.4 | Very high | 91.4 | Very high | 22 Ų | 22 | 40 Ų | 40 | 13% | 0.133 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -65.4 | -50.2 | 175.2 | 172.3 | 0 | 0 | 0 | 0 | 110.4 | L125 A126 E127 L131 C132 W133 T162 M165 | L125-V129 PolarHBondContact O-N 3.12Å; A126-V129 WeakPolarHBondContact O-CB 3.44Å; A126-V129 PolarHBondContact O-N 2.95Å; E127-V129 VanDerWaalsContact C-N 3.27Å; E127-V129 PolarHBondContact O-N 2.92Å; V129-L131 VanDerWaalsContact C-N 3.3Å; V129-L131 PolarHBondContact O-N 3.17Å; V129-C132 WeakPolarHBondContact O-CB 3.39Å; V129-C132 PolarHBondContact O-N 3.13Å; V129-W133 PolarHBondContact O-N 3.21Å; V129-T162 HydrophobicContact CG1-CG2 4.15Å; V129-T162 WeakPolarHBondContact CG1-OG1 3.46Å; V129-M165 HydrophobicContact CG2-CB 3.76Å; V129-M165 HydrophobicContact CG2-CG 3.79Å |
| 130 | L | 94.3 | Very high | 90.1 | Very high | 29 Ų | 29 | 45 Ų | 45 | 15% | 0.152 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.2 | -39.9 | 179.3 | -70.2 | 167.5 | 0 | 0 | 0 | 111.9 | L56 A59 F60 C63 A126 E127 C132 W133 V134 | L56-L130 HydrophobicContact CD1-CD2 3.88Å; A59-L130 HydrophobicContact CB-CD2 4.19Å; F60-L130 HydrophobicContact CD2-CB 3.92Å; C63-L130 HydrophobicContact CB-CD1 3.5Å; A126-L130 WeakPolarHBondContact O-CG 3.27Å; A126-L130 PolarHBondContact O-N 3.29Å; E127-L130 PolarHBondContact O-N 2.91Å; L130-C132 VanDerWaalsContact C-N 3.34Å; L130-C132 PolarHBondContact O-N 3.43Å; L130-W133 WeakPolarHBondContact O-CB 3.4Å; L130-W133 PolarHBondContact O-N 3.01Å; L130-W133 VanDerWaalsContact O-N 3.16Å; L130-V134 WeakPolarHBondContact O-CG2 3.39Å; L130-V134 PolarHBondContact O-N 3.49Å |
| 131 | L | 93.2 | Very high | 88.4 | Confident | 35 Ų | 35 | 48 Ų | 48 | 18% | 0.183 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59.4 | -43 | 172.8 | -76.7 | 172.3 | 0 | 0 | 0 | 112 | A40 V44 F60 E127 V129 W133 V134 K135 | A40-L131 HydrophobicContact CB-CD1 3.74Å; A40-L131 HydrophobicContact CB-CD2 4.45Å; V44-L131 HydrophobicContact CG2-CD2 4.37Å; F60-L131 HydrophobicContact CD2-CD2 4.47Å; F60-L131 HydrophobicContact CE2-CD2 3.35Å; F60-L131 HydrophobicContact CE2-CG 3.73Å; F60-L131 HydrophobicContact CZ-CD2 3.47Å; F60-L131 VanDerWaalsContact CZ-CD2 3.47Å; F60-L131 HydrophobicContact CZ-CG 4.34Å; E127-L131 HydrophobicContact CG-CD1 4.28Å; E127-L131 WeakPolarHBondContact O-CB 3.35Å; E127-L131 VanDerWaalsContact O-CG 3.31Å; E127-L131 WeakPolarHBondContact O-CG 3.3Å; E127-L131 PolarHBondContact O-N 3.35Å; V129-L131 VanDerWaalsContact C-N 3.3Å; V129-L131 PolarHBondContact O-N 3.17Å; L131-W133 VanDerWaalsContact C-N 3.31Å; L131-W133 PolarHBondContact O-N 3.18Å; L131-V134 PolarHBondContact O-N 2.87Å; L131-K135 WeakPolarHBondContact O-CB 3.02Å; L131-K135 PolarHBondContact O-N 3.2Å |
| 132 | C | 92.7 | Very high | 86.7 | Confident | 20 Ų | 20 | 56.4 Ų | 56.4 | 14% | 0.135 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -61.1 | -42.4 | 175.1 | -69 | 0 | 0 | 0 | 0 | 111.1 | V128 V129 L130 F136 S161 | V128-C132 PolarHBondContact O-N 2.73Å; V128-C132 VanDerWaalsContact O-N 3.1Å; V128-C132 PolarHBondContact O-SG 2.89Å; V129-C132 WeakPolarHBondContact O-CB 3.39Å; V129-C132 PolarHBondContact O-N 3.13Å; L130-C132 VanDerWaalsContact C-N 3.34Å; L130-C132 PolarHBondContact O-N 3.43Å; C132-F136 HydrophobicContact CB-CD2 3.98Å; C132-F136 HydrophobicContact CB-CE2 4.12Å; C132-F136 VanDerWaalsContact O-CB 3.31Å; C132-F136 WeakPolarHBondContact O-CB 3.44Å; C132-F136 WeakPolarHBondContact O-CD2 3.27Å; C132-F136 PolarHBondContact O-N 3.4Å; C132-S161 PolarHBondContact SG-OG 3.21Å; C132-S161 VanDerWaalsContact SG-OG 3.37Å |
| 133 | W | 92.1 | Very high | 84.7 | Confident | 70 Ų | 70 | 62 Ų | 62 | 27% | 0.265 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -62.7 | -48.5 | 176 | -79.6 | 95.7 | 0 | 0 | 0 | 112.1 | L56 V129 L130 L131 L137 A158 I159 T162 | L56-W133 HydrophobicContact CD1-CB 3.72Å; L56-W133 HydrophobicContact CD1-CG 4.43Å; L56-W133 HydrophobicContact CD2-CB 4.12Å; V129-W133 PolarHBondContact O-N 3.21Å; L130-W133 WeakPolarHBondContact O-CB 3.4Å; L130-W133 PolarHBondContact O-N 3.01Å; L130-W133 VanDerWaalsContact O-N 3.16Å; L131-W133 VanDerWaalsContact C-N 3.31Å; L131-W133 PolarHBondContact O-N 3.18Å; W133-L137 HydrophobicContact CE3-CD1 3.71Å; W133-L137 HydrophobicContact CZ3-CD1 4.08Å; W133-L137 VanDerWaalsContact O-CB 3.31Å; W133-L137 WeakPolarHBondContact O-CB 3.45Å; W133-L137 PolarHBondContact O-N 3.22Å; W133-L137 VanDerWaalsContact O-N 3.17Å; W133-A158 HydrophobicContact CD2-CB 3.79Å; W133-A158 HydrophobicContact CE3-CB 4.03Å; W133-A158 HydrophobicContact CG-CB 4.16Å; W133-A158 HydrophobicContact CZ2-CB 4.32Å; W133-A158 HydrophobicContact CZ3-CB 4.39Å; W133-I159 HydrophobicContact CH2-CG1 3.94Å; W133-I159 HydrophobicContact CZ2-CG1 4.17Å; W133-T162 PolarHBondContact NE1-OG1 2.74Å |
| 134 | V | 92 | Very high | 82.6 | Confident | 1 Ų | 1 | 63.1 Ų | 63.1 | 1% | 0.006 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -63.5 | -42.8 | 179.5 | 172 | 0 | 0 | 0 | 0 | 111.4 | V44 L46 L56 F60 L130 L131 | V44-V134 HydrophobicContact CG2-CG1 3.73Å; L46-V134 HydrophobicContact CD2-CG1 3.35Å; L56-V134 HydrophobicContact CD1-CG2 4.44Å; L56-V134 HydrophobicContact CD2-CG2 4.02Å; L56-V134 HydrophobicContact CG-CG2 3.99Å; F60-V134 HydrophobicContact CB-CG2 4.39Å; F60-V134 HydrophobicContact CG-CG2 4.27Å; L130-V134 WeakPolarHBondContact O-CG2 3.39Å; L130-V134 PolarHBondContact O-N 3.49Å; L131-V134 PolarHBondContact O-N 2.87Å |
| 135 | K | 90.3 | Very high | 80.8 | Confident | 106 Ų | 106 | 65.9 Ų | 65.9 | 46% | 0.461 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -75.3 | -38.3 | -175.6 | -169 | 67.3 | 175.2 | 179.2 | 0 | 113.4 | L131 | L131-K135 WeakPolarHBondContact O-CB 3.02Å; L131-K135 PolarHBondContact O-N 3.2Å |
| 136 | F | 87.7 | Confident | 78.9 | Confident | 73 Ų | 73 | 69.6 Ų | 69.6 | 32% | 0.32 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -94.7 | -17 | -172.8 | -62.2 | -56.6 | 0 | 0 | 0 | 114.2 | C132 P138 I139 G154 A157 | C132-F136 HydrophobicContact CB-CD2 3.98Å; C132-F136 HydrophobicContact CB-CE2 4.12Å; C132-F136 VanDerWaalsContact O-CB 3.31Å; C132-F136 WeakPolarHBondContact O-CB 3.44Å; C132-F136 WeakPolarHBondContact O-CD2 3.27Å; C132-F136 PolarHBondContact O-N 3.4Å; F136-P138 VanDerWaalsContact C-CD 3.48Å; F136-I139 HydrophobicContact CD1-CD1 3.71Å; F136-I139 HydrophobicContact CE1-CD1 4.42Å; F136-I139 WeakPolarHBondContact O-CB 3.35Å; F136-I139 PolarHBondContact O-N 2.98Å; F136-I139 VanDerWaalsContact O-N 3.14Å; F136-G154 WeakPolarHBondContact CB-O 3.32Å; F136-G154 WeakPolarHBondContact O-CA 3.47Å; F136-A157 HydrophobicContact CD2-CB 4.46Å; F136-A157 HydrophobicContact CG-CB 4.41Å |
| 137 | L | 85 | Confident | 77.1 | Confident | 15 Ų | 15 | 74.5 Ų | 74.5 | 8% | 0.079 | 38% | 0.375 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54.3 | -42.7 | 177.5 | -127.6 | 60.2 | 0 | 0 | 0 | 115 | Y50 Y52 P53 L56 W133 I139 V155 | Y50-L137 HydrophobicContact CE1-CB 4.06Å; Y50-L137 HydrophobicContact CE1-CD2 3.92Å; Y50-L137 HydrophobicContact CE1-CG 4.14Å; Y50-L137 WeakPolarHBondContact OH-CG 3.41Å; Y50-L137 PolarHBondContact OH-O 3.24Å; Y52-L137 HydrophobicContact CD1-CD2 4.36Å; Y52-L137 HydrophobicContact CE1-CB 4.49Å; P53-L137 HydrophobicContact CG-CD2 4.12Å; L56-L137 HydrophobicContact CD2-CD2 3.9Å; W133-L137 HydrophobicContact CE3-CD1 3.71Å; W133-L137 HydrophobicContact CZ3-CD1 4.08Å; W133-L137 VanDerWaalsContact O-CB 3.31Å; W133-L137 WeakPolarHBondContact O-CB 3.45Å; W133-L137 PolarHBondContact O-N 3.22Å; W133-L137 VanDerWaalsContact O-N 3.17Å; L137-I139 PolarHBondContact O-N 3.04Å; L137-V155 HydrophobicContact CD1-CG2 4.33Å |
| 138 | P | 82.9 | Confident | 75.4 | Confident | 37 Ų | 37 | 79.4 Ų | 79.4 | 24% | 0.24 | 40% | 0.401 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -14.6 | -178.8 | -19.8 | 33.8 | 0 | 0 | 0 | 113.7 | Y50 Y52 F136 R140 | Y50-P138 HydrophobicContact CD1-CG 4.4Å; Y50-P138 HydrophobicContact CD2-CB 4.21Å; Y50-P138 HydrophobicContact CG-CB 4.26Å; Y50-P138 HydrophobicContact CG-CG 4.29Å; Y52-P138 HydrophobicContact CE1-CG 3.8Å; Y52-P138 WeakPolarHBondContact OH-CG 3.2Å; F136-P138 VanDerWaalsContact C-CD 3.48Å; P138-R140 PolarHBondContact O-N 3.43Å |
| 139 | I | 76.5 | Confident | 73.8 | Confident | 95 Ų | 95 | 81.3 Ų | 81.3 | 49% | 0.487 | 43% | 0.43 | S | S | . | . | trans | -76.3 | 73.6 | 178.6 | -48.1 | -173.7 | 0 | 0 | 0 | 108.8 | F136 L137 S152 G154 | F136-I139 HydrophobicContact CD1-CD1 3.71Å; F136-I139 HydrophobicContact CE1-CD1 4.42Å; F136-I139 WeakPolarHBondContact O-CB 3.35Å; F136-I139 PolarHBondContact O-N 2.98Å; F136-I139 VanDerWaalsContact O-N 3.14Å; L137-I139 PolarHBondContact O-N 3.04Å; I139-S152 PolarHBondContact O-OG 3.39Å; I139-G154 PolarHBondContact O-N 2.87Å | ||
| 140 | R | 64.9 | Low | 72.3 | Confident | 154 Ų | 154 | 84.3 Ų | 84.3 | 58% | 0.581 | 45% | 0.449 | S | S | * | . | trans | -102.3 | 131.6 | 172.8 | -154 | 176.9 | -170.4 | 115.9 | 1.5 | 109 | P138 K142 | P138-R140 PolarHBondContact O-N 3.43Å; R140-K142 PolarHBondContact O-N 3.34Å | ||
| 141 | P | 58.5 | Low | 71.1 | Confident | 63 Ų | 63 | 88.3 Ų | 88.3 | 41% | 0.409 | 47% | 0.469 | S | S | . | . | trans | -63.6 | 127.7 | 175.3 | 22.4 | -29 | 0 | 0 | 0 | 109.9 | N143 H144 S152 | P141-N143 PolarHBondContact O-N 2.85Å; P141-H144 HydrophobicContact CG-CB 4.45Å; P141-H144 PolarHBondContact O-N 3.14Å; P141-S152 WeakPolarHBondContact CD-OG 2.94Å | ||
| 142 | K | 55.6 | Low | 70.4 | Confident | 217 Ų | 217 | 87 Ų | 87 | 94% | 0.943 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | -14.1 | -178.2 | -129.3 | 172.9 | -177.1 | 173.4 | 0 | 114.1 | R140 | R140-K142 PolarHBondContact O-N 3.34Š|
| 143 | N | 52.1 | Low | 69.9 | Low | 162 Ų | 162 | 89.3 Ų | 89.3 | 87% | 0.866 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.4 | 36.9 | -177.5 | -89.1 | -5.7 | 0 | 0 | 0 | 113 | P141 N145 | P141-N143 PolarHBondContact O-N 2.85Å; N143-N145 PolarHBondContact O-N 3.36Å |
| 144 | H | 51.5 | Low | 69.5 | Low | 51 Ų | 51 | 86 Ų | 86 | 24% | 0.236 | 47% | 0.472 | C | S | . | . | trans | -82.7 | 107.1 | 177.1 | -159 | -52.8 | 0 | 0 | 0 | 110.9 | P141 N148 T150 | P141-H144 HydrophobicContact CG-CB 4.45Å; P141-H144 PolarHBondContact O-N 3.14Å; H144-N148 PolarHBondContact CE1-O 3.32Å; H144-N148 VanDerWaalsContact CE1-O 3.24Å; H144-T150 PolarHBondContact CE1-OG1 3.28Å; H144-T150 PolarHBondContact NE2-O 3.48Å; H144-T150 PolarHBondContact NE2-OG1 3.15Å; H144-T150 VanDerWaalsContact NE2-OG1 3.12Å | ||
| 145 | N | 55.6 | Low | 69.2 | Low | 115 Ų | 115 | 87.7 Ų | 87.7 | 62% | 0.615 | 48% | 0.482 | S | S | * | . | trans | -67.6 | 123.3 | 166.2 | -125.3 | -2.6 | 0 | 0 | 0 | 108 | N143 N147 N148 | N143-N145 PolarHBondContact O-N 3.36Å; N145-N147 PolarHBondContact O-N 2.73Å; N145-N148 PolarHBondContact O-N 3Å | ||
| 146 | P | 55.6 | Low | 69.1 | Low | 109 Ų | 109 | 84.3 Ų | 84.3 | 71% | 0.708 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -7.9 | -173.9 | 24.3 | -33.2 | 0 | 0 | 0 | 114.4 | ||
| 147 | N | 56.8 | Low | 69.2 | Low | 140 Ų | 140 | 82.8 Ų | 82.8 | 75% | 0.749 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.1 | -8.7 | -175.5 | -63.3 | -6.7 | 0 | 0 | 0 | 114.6 | N145 | N145-N147 PolarHBondContact O-N 2.73Š|
| 148 | N | 58.5 | Low | 69.5 | Low | 105 Ų | 105 | 82.1 Ų | 82.1 | 56% | 0.561 | 47% | 0.471 | S | S | * | . | S | Bend | trans | -97.4 | 117.2 | 171.8 | -78.7 | 0.8 | 0 | 0 | 0 | 107.9 | H144 N145 T150 | H144-N148 PolarHBondContact CE1-O 3.32Å; H144-N148 VanDerWaalsContact CE1-O 3.24Å; N145-N148 PolarHBondContact O-N 3Å; N148-T150 HydrophobicContact CB-CG2 4.37Å; N148-T150 PolarHBondContact O-N 2.86Å; N148-T150 PolarHBondContact O-OG1 3.32Å |
| 149 | G | 59.1 | Low | 69.9 | Low | 88 Ų | 88 | 84 Ų | 84 | 91% | 0.907 | 48% | 0.478 | S | S | * | . | trans | -66.4 | 32 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 150 | T | 63.6 | Low | 70.7 | Confident | 86 Ų | 86 | 83.2 Ų | 83.2 | 53% | 0.528 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -78.6 | 127.1 | -179.2 | 48.8 | 0 | 0 | 0 | 0 | 110.5 | H144 N148 S152 | H144-T150 PolarHBondContact CE1-OG1 3.28Å; H144-T150 PolarHBondContact NE2-O 3.48Å; H144-T150 PolarHBondContact NE2-OG1 3.15Å; H144-T150 VanDerWaalsContact NE2-OG1 3.12Å; N148-T150 HydrophobicContact CB-CG2 4.37Å; N148-T150 PolarHBondContact O-N 2.86Å; N148-T150 PolarHBondContact O-OG1 3.32Å; T150-S152 PolarHBondContact O-N 2.86Å |
| 151 | I | 68.9 | Low | 71.9 | Confident | 112 Ų | 112 | 77.2 Ų | 77.2 | 57% | 0.574 | 46% | 0.46 | S | S | * | . | P | Polyproline II helix | trans | -63.6 | 132.8 | 174.4 | -59.5 | 176.7 | 0 | 0 | 0 | 108.6 | V155 A156 I159 | I151-V155 HydrophobicContact CG2-CB 3.86Å; I151-V155 HydrophobicContact CG2-CG1 3.75Å; I151-A156 HydrophobicContact CG2-CB 4.03Å; I151-I159 HydrophobicContact CG2-CD1 4.49Å |
| 152 | S | 79.7 | Confident | 73.6 | Confident | 9 Ų | 9 | 76 Ų | 76 | 6% | 0.063 | 45% | 0.451 | C | S | . | . | P | Polyproline II helix | trans | -56.8 | 139.3 | 175.1 | -177.2 | 0 | 0 | 0 | 0 | 110.6 | I139 P141 T150 G154 V155 A156 | I139-S152 PolarHBondContact O-OG 3.39Å; P141-S152 WeakPolarHBondContact CD-OG 2.94Å; T150-S152 PolarHBondContact O-N 2.86Å; S152-G154 PolarHBondContact O-N 3.27Å; S152-G154 VanDerWaalsContact O-N 3.15Å; S152-V155 WeakPolarHBondContact O-CA 3.23Å; S152-V155 PolarHBondContact O-N 3.44Å; S152-A156 PolarHBondContact O-N 2.79Å |
| 153 | A | 81.8 | Confident | 75.4 | Confident | 67 Ų | 67 | 69.7 Ų | 69.7 | 55% | 0.554 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -52.3 | -40.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | A156 A157 | A153-A156 PolarHBondContact O-N 3.21Å; A153-A157 WeakPolarHBondContact O-CB 3.39Å; A153-A157 PolarHBondContact O-N 3.02Å |
| 154 | G | 83.6 | Confident | 77.4 | Confident | 2 Ų | 2 | 67 Ų | 67 | 2% | 0.021 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -65.2 | -38.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | F136 I139 S152 A157 A158 | F136-G154 WeakPolarHBondContact CB-O 3.32Å; F136-G154 WeakPolarHBondContact O-CA 3.47Å; I139-G154 PolarHBondContact O-N 2.87Å; S152-G154 PolarHBondContact O-N 3.27Å; S152-G154 VanDerWaalsContact O-N 3.15Å; G154-A157 PolarHBondContact O-N 2.8Å; G154-A158 PolarHBondContact O-N 3.32Å |
| 155 | V | 85.5 | Confident | 79.4 | Confident | 36 Ų | 36 | 66.6 Ų | 66.6 | 22% | 0.218 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -70 | -41.2 | 176.1 | 176.5 | 0 | 0 | 0 | 0 | 110.3 | L137 I151 S152 A157 A158 I159 | L137-V155 HydrophobicContact CD1-CG2 4.33Å; I151-V155 HydrophobicContact CG2-CB 3.86Å; I151-V155 HydrophobicContact CG2-CG1 3.75Å; S152-V155 WeakPolarHBondContact O-CA 3.23Å; S152-V155 PolarHBondContact O-N 3.44Å; V155-A157 VanDerWaalsContact C-N 3.33Å; V155-A157 PolarHBondContact O-N 2.79Å; V155-A158 PolarHBondContact O-N 3.29Å; V155-I159 HydrophobicContact CG1-CD1 3.7Å; V155-I159 HydrophobicContact CG1-CG1 4.3Å; V155-I159 WeakPolarHBondContact O-CB 3.48Å; V155-I159 VanDerWaalsContact O-CG1 3.24Å; V155-I159 WeakPolarHBondContact O-CG1 3.36Å; V155-I159 PolarHBondContact O-N 2.98Å |
| 156 | A | 88.1 | Confident | 81.2 | Confident | 35 Ų | 35 | 64.7 Ų | 64.7 | 29% | 0.289 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.5 | -40.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I151 S152 A153 I159 T160 | I151-A156 HydrophobicContact CG2-CB 4.03Å; S152-A156 PolarHBondContact O-N 2.79Å; A153-A156 PolarHBondContact O-N 3.21Å; A156-I159 PolarHBondContact O-N 3.48Å; A156-T160 WeakPolarHBondContact O-CB 3.33Å; A156-T160 PolarHBondContact O-N 2.86Å; A156-T160 PolarHBondContact O-OG1 2.96Å |
| 157 | A | 89.8 | Confident | 82.9 | Confident | 41 Ų | 41 | 62.8 Ų | 62.8 | 34% | 0.339 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F136 A153 G154 V155 T160 S161 | F136-A157 HydrophobicContact CD2-CB 4.46Å; F136-A157 HydrophobicContact CG-CB 4.41Å; A153-A157 WeakPolarHBondContact O-CB 3.39Å; A153-A157 PolarHBondContact O-N 3.02Å; G154-A157 PolarHBondContact O-N 2.8Å; V155-A157 VanDerWaalsContact C-N 3.33Å; V155-A157 PolarHBondContact O-N 2.79Å; A157-T160 PolarHBondContact O-N 3.4Å; A157-S161 WeakPolarHBondContact O-CB 3.43Å; A157-S161 PolarHBondContact O-N 3.01Å |
| 158 | A | 91.1 | Very high | 84.6 | Confident | 0 Ų | 0 | 61.5 Ų | 61.5 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64.7 | -41.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | W133 G154 V155 S161 T162 | W133-A158 HydrophobicContact CD2-CB 3.79Å; W133-A158 HydrophobicContact CE3-CB 4.03Å; W133-A158 HydrophobicContact CG-CB 4.16Å; W133-A158 HydrophobicContact CZ2-CB 4.32Å; W133-A158 HydrophobicContact CZ3-CB 4.39Å; G154-A158 PolarHBondContact O-N 3.32Å; V155-A158 PolarHBondContact O-N 3.29Å; A158-S161 PolarHBondContact O-N 3.45Å; A158-T162 WeakPolarHBondContact O-CB 3.3Å; A158-T162 PolarHBondContact O-N 2.99Å; A158-T162 PolarHBondContact O-OG1 3.12Å |
| 159 | I | 90.9 | Very high | 86.1 | Confident | 76 Ų | 76 | 57.1 Ų | 57.1 | 39% | 0.39 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 175 | -68.4 | 167.9 | 0 | 0 | 0 | 110.5 | W133 I151 V155 A156 T162 S163 | W133-I159 HydrophobicContact CH2-CG1 3.94Å; W133-I159 HydrophobicContact CZ2-CG1 4.17Å; I151-I159 HydrophobicContact CG2-CD1 4.49Å; V155-I159 HydrophobicContact CG1-CD1 3.7Å; V155-I159 HydrophobicContact CG1-CG1 4.3Å; V155-I159 WeakPolarHBondContact O-CB 3.48Å; V155-I159 VanDerWaalsContact O-CG1 3.24Å; V155-I159 WeakPolarHBondContact O-CG1 3.36Å; V155-I159 PolarHBondContact O-N 2.98Å; A156-I159 PolarHBondContact O-N 3.48Å; I159-T162 PolarHBondContact O-N 3.49Å; I159-S163 WeakPolarHBondContact O-CB 3.38Å; I159-S163 PolarHBondContact O-N 2.92Å |
| 160 | T | 92.7 | Very high | 87.7 | Confident | 80 Ų | 80 | 57.8 Ų | 57.8 | 49% | 0.491 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.7 | -46.4 | 179.4 | -56.5 | 0 | 0 | 0 | 0 | 111 | A156 A157 T162 S163 I164 | A156-T160 WeakPolarHBondContact O-CB 3.33Å; A156-T160 PolarHBondContact O-N 2.86Å; A156-T160 PolarHBondContact O-OG1 2.96Å; A157-T160 PolarHBondContact O-N 3.4Å; T160-T162 VanDerWaalsContact C-N 3.33Å; T160-T162 PolarHBondContact O-N 3.32Å; T160-S163 PolarHBondContact O-N 3.03Å; T160-I164 HydrophobicContact CG2-CD1 4.16Å; T160-I164 WeakPolarHBondContact O-CG1 3.47Å; T160-I164 PolarHBondContact O-N 2.57Å; T160-I164 VanDerWaalsContact O-N 3.08Å |
| 161 | S | 91.7 | Very high | 89.1 | Confident | 27 Ų | 27 | 58.3 Ų | 58.3 | 19% | 0.189 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -57.8 | -46.2 | 175 | -178.7 | 0 | 0 | 0 | 0 | 111.5 | C132 A157 A158 S163 I164 M165 | C132-S161 PolarHBondContact SG-OG 3.21Å; C132-S161 VanDerWaalsContact SG-OG 3.37Å; A157-S161 WeakPolarHBondContact O-CB 3.43Å; A157-S161 PolarHBondContact O-N 3.01Å; A158-S161 PolarHBondContact O-N 3.45Å; S161-S163 PolarHBondContact O-N 3.36Å; S161-I164 PolarHBondContact O-N 2.99Å; S161-M165 PolarHBondContact O-N 3.08Å; S161-M165 VanDerWaalsContact O-N 3.11Å |
| 162 | T | 93.1 | Very high | 90 | Very high | 38 Ų | 38 | 56 Ų | 56 | 23% | 0.233 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 177 | -53.8 | 0 | 0 | 0 | 0 | 111.2 | V129 W133 A158 I159 T160 I164 M165 V166 | V129-T162 HydrophobicContact CG1-CG2 4.15Å; V129-T162 WeakPolarHBondContact CG1-OG1 3.46Å; W133-T162 PolarHBondContact NE1-OG1 2.74Å; A158-T162 WeakPolarHBondContact O-CB 3.3Å; A158-T162 PolarHBondContact O-N 2.99Å; A158-T162 PolarHBondContact O-OG1 3.12Å; I159-T162 PolarHBondContact O-N 3.49Å; T160-T162 VanDerWaalsContact C-N 3.33Å; T160-T162 PolarHBondContact O-N 3.32Å; T162-I164 VanDerWaalsContact C-N 3.29Å; T162-I164 PolarHBondContact O-N 2.75Å; T162-M165 PolarHBondContact O-N 3.02Å; T162-V166 HydrophobicContact CG2-CG2 4.4Å; T162-V166 VanDerWaalsContact O-CG2 3.3Å; T162-V166 WeakPolarHBondContact O-CG2 3.43Å; T162-V166 PolarHBondContact O-N 3.45Å |
| 163 | S | 94.2 | Very high | 90.5 | Very high | 84 Ų | 84 | 59.5 Ų | 59.5 | 59% | 0.587 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -60.4 | -37.7 | -179.4 | -172.8 | 0 | 0 | 0 | 0 | 112.6 | I159 T160 S161 M165 P167 | I159-S163 WeakPolarHBondContact O-CB 3.38Å; I159-S163 PolarHBondContact O-N 2.92Å; T160-S163 PolarHBondContact O-N 3.03Å; S161-S163 PolarHBondContact O-N 3.36Å; S163-M165 VanDerWaalsContact C-N 3.32Å; S163-P167 WeakPolarHBondContact O-CD 3.38Å |
| 164 | I | 94.4 | Very high | 90.9 | Very high | 107 Ų | 107 | 61.1 Ų | 61.1 | 55% | 0.549 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -70.3 | -33.4 | 176.5 | -66.2 | 167.5 | 0 | 0 | 0 | 110.7 | T160 S161 T162 P167 F168 | T160-I164 HydrophobicContact CG2-CD1 4.16Å; T160-I164 WeakPolarHBondContact O-CG1 3.47Å; T160-I164 PolarHBondContact O-N 2.57Å; T160-I164 VanDerWaalsContact O-N 3.08Å; S161-I164 PolarHBondContact O-N 2.99Å; T162-I164 VanDerWaalsContact C-N 3.29Å; T162-I164 PolarHBondContact O-N 2.75Å; I164-P167 VanDerWaalsContact O-CD 3.3Å; I164-P167 WeakPolarHBondContact O-CD 3.45Å; I164-P167 WeakPolarHBondContact O-CG 3.34Å; I164-F168 WeakPolarHBondContact O-CD2 3.24Å |
| 165 | M | 92.5 | Very high | 91 | Very high | 41 Ų | 41 | 66.1 Ų | 66.1 | 20% | 0.202 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -81.1 | -27.9 | -175.6 | -147 | 68.1 | 84.9 | 0 | 0 | 114.2 | L125 V128 V129 S161 T162 S163 F168 G169 | L125-M165 HydrophobicContact CD1-CE 4.28Å; L125-M165 HydrophobicContact CD1-CG 3.55Å; L125-M165 HydrophobicContact CD1-SD 3.27Å; L125-M165 WeakPolarHBondContact CD1-SD 3.5Å; L125-M165 HydrophobicContact CD2-CG 3.89Å; L125-M165 HydrophobicContact CG-CG 3.46Å; L125-M165 VanDerWaalsContact CG-CG 3.46Å; L125-M165 HydrophobicContact CG-SD 3.94Å; V128-M165 HydrophobicContact CB-CE 4.45Å; V128-M165 HydrophobicContact CG1-CE 3.8Å; V129-M165 HydrophobicContact CG2-CB 3.76Å; V129-M165 HydrophobicContact CG2-CG 3.79Å; S161-M165 PolarHBondContact O-N 3.08Å; S161-M165 VanDerWaalsContact O-N 3.11Å; T162-M165 PolarHBondContact O-N 3.02Å; S163-M165 VanDerWaalsContact C-N 3.32Å; M165-F168 PolarHBondContact O-N 2.91Å; M165-G169 PolarHBondContact O-N 3.47Å |
| 166 | V | 92.8 | Very high | 90.9 | Very high | 76 Ų | 76 | 65.2 Ų | 65.2 | 46% | 0.461 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -49.5 | -50.2 | 179.3 | 165.4 | 0 | 0 | 0 | 0 | 114.6 | T162 F168 G169 L170 | T162-V166 HydrophobicContact CG2-CG2 4.4Å; T162-V166 VanDerWaalsContact O-CG2 3.3Å; T162-V166 WeakPolarHBondContact O-CG2 3.43Å; T162-V166 PolarHBondContact O-N 3.45Å; V166-F168 VanDerWaalsContact C-N 3.3Å; V166-F168 PolarHBondContact O-N 3.49Å; V166-G169 PolarHBondContact O-N 2.83Å; V166-G169 VanDerWaalsContact O-N 3.13Å; V166-L170 HydrophobicContact CG1-CD1 4.21Å; V166-L170 HydrophobicContact CG1-CG 4.42Å; V166-L170 PolarHBondContact O-N 3.45Å |
| 167 | P | 92.6 | Very high | 90.8 | Very high | 68 Ų | 68 | 66.7 Ų | 66.7 | 44% | 0.442 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.5 | -38.3 | -178.7 | 22.5 | -34.6 | 0 | 0 | 0 | 112.7 | S163 I164 L170 I171 | S163-P167 WeakPolarHBondContact O-CD 3.38Å; I164-P167 VanDerWaalsContact O-CD 3.3Å; I164-P167 WeakPolarHBondContact O-CD 3.45Å; I164-P167 WeakPolarHBondContact O-CG 3.34Å; P167-L170 PolarHBondContact O-N 3.21Å; P167-I171 WeakPolarHBondContact O-CG1 3.27Å; P167-I171 PolarHBondContact O-N 3.45Å |
| 168 | F | 92.4 | Very high | 90.6 | Very high | 114 Ų | 114 | 70.3 Ų | 70.3 | 50% | 0.5 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64.6 | -44.9 | 174.5 | -62.4 | -80.8 | 0 | 0 | 0 | 110.7 | L125 I164 M165 V166 L170 I171 F172 | L125-F168 HydrophobicContact CD2-CB 4.01Å; I164-F168 WeakPolarHBondContact O-CD2 3.24Å; M165-F168 PolarHBondContact O-N 2.91Å; V166-F168 VanDerWaalsContact C-N 3.3Å; V166-F168 PolarHBondContact O-N 3.49Å; F168-L170 VanDerWaalsContact C-N 3.34Å; F168-L170 PolarHBondContact O-N 2.68Å; F168-I171 PolarHBondContact O-N 3.28Å; F168-F172 WeakPolarHBondContact O-CD2 3.34Å; F168-F172 PolarHBondContact O-N 3.08Å; F168-F172 VanDerWaalsContact O-N 3.1Å |
| 169 | G | 90.1 | Very high | 90 | Very high | 13 Ų | 13 | 73 Ų | 73 | 13% | 0.134 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -56.5 | -44.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | M165 V166 I171 F172 I173 | M165-G169 PolarHBondContact O-N 3.47Å; V166-G169 PolarHBondContact O-N 2.83Å; V166-G169 VanDerWaalsContact O-N 3.13Å; G169-I171 PolarHBondContact O-N 2.99Å; G169-F172 PolarHBondContact O-N 2.88Å; G169-I173 VanDerWaalsContact O-CG1 3.24Å; G169-I173 WeakPolarHBondContact O-CG1 3.36Å; G169-I173 PolarHBondContact O-N 2.76Å |
| 170 | L | 92.2 | Very high | 89.5 | Confident | 102 Ų | 102 | 75.7 Ų | 75.7 | 53% | 0.534 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -60.2 | -43.9 | 178.1 | -73.8 | 175.7 | 0 | 0 | 0 | 112.6 | V166 P167 F168 F172 I173 V174 | V166-L170 HydrophobicContact CG1-CD1 4.21Å; V166-L170 HydrophobicContact CG1-CG 4.42Å; V166-L170 PolarHBondContact O-N 3.45Å; P167-L170 PolarHBondContact O-N 3.21Å; F168-L170 VanDerWaalsContact C-N 3.34Å; F168-L170 PolarHBondContact O-N 2.68Å; L170-F172 VanDerWaalsContact C-N 3.34Å; L170-F172 PolarHBondContact O-N 2.84Å; L170-I173 PolarHBondContact O-N 3.24Å; L170-V174 WeakPolarHBondContact O-CG2 3.4Å; L170-V174 PolarHBondContact O-N 3.03Å |
| 171 | I | 92.3 | Very high | 88.9 | Confident | 97 Ų | 97 | 80.4 Ų | 80.4 | 50% | 0.497 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 176.7 | -65.9 | 168.2 | 0 | 0 | 0 | 110 | P167 F168 G169 I173 V174 F175 | P167-I171 WeakPolarHBondContact O-CG1 3.27Å; P167-I171 PolarHBondContact O-N 3.45Å; F168-I171 PolarHBondContact O-N 3.28Å; G169-I171 PolarHBondContact O-N 2.99Å; I171-I173 VanDerWaalsContact C-N 3.34Å; I171-I173 PolarHBondContact O-N 3.33Å; I171-V174 PolarHBondContact O-N 3.11Å; I171-F175 HydrophobicContact CG2-CD2 3.83Å; I171-F175 HydrophobicContact CG2-CE2 3.56Å; I171-F175 WeakPolarHBondContact O-CD2 3.41Å; I171-F175 PolarHBondContact O-N 3.32Å; I171-F175 VanDerWaalsContact O-N 3.11Å |
| 172 | F | 89.1 | Confident | 88 | Confident | 62 Ų | 62 | 81.2 Ų | 81.2 | 27% | 0.272 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -63.6 | -36.7 | 177.1 | -79 | -70.7 | 0 | 0 | 0 | 113.1 | V118 T121 L122 L125 F168 G169 L170 F175 A176 | V118-F172 HydrophobicContact CG1-CD1 4.49Å; T121-F172 HydrophobicContact CG2-CD1 4.45Å; T121-F172 HydrophobicContact CG2-CE1 3.69Å; T121-F172 HydrophobicContact CG2-CE2 4.38Å; T121-F172 HydrophobicContact CG2-CZ 3.66Å; L122-F172 HydrophobicContact CB-CB 4.36Å; L122-F172 HydrophobicContact CD1-CB 4.08Å; L125-F172 HydrophobicContact CD2-CD2 4.42Å; F168-F172 WeakPolarHBondContact O-CD2 3.34Å; F168-F172 PolarHBondContact O-N 3.08Å; F168-F172 VanDerWaalsContact O-N 3.1Å; G169-F172 PolarHBondContact O-N 2.88Å; L170-F172 VanDerWaalsContact C-N 3.34Å; L170-F172 PolarHBondContact O-N 2.84Å; F172-F175 PolarHBondContact O-N 3.16Å; F172-A176 WeakPolarHBondContact O-CB 3.29Å; F172-A176 PolarHBondContact O-N 3.06Å |
| 173 | I | 90.1 | Very high | 86.8 | Confident | 83 Ų | 83 | 81.5 Ų | 81.5 | 43% | 0.426 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 175.7 | -69.6 | 164.4 | 0 | 0 | 0 | 110.5 | L122 G169 L170 I171 F175 A176 V177 | L122-I173 HydrophobicContact CD1-CG1 3.68Å; G169-I173 VanDerWaalsContact O-CG1 3.24Å; G169-I173 WeakPolarHBondContact O-CG1 3.36Å; G169-I173 PolarHBondContact O-N 2.76Å; L170-I173 PolarHBondContact O-N 3.24Å; I171-I173 VanDerWaalsContact C-N 3.34Å; I171-I173 PolarHBondContact O-N 3.33Å; I173-F175 VanDerWaalsContact C-N 3.31Å; I173-F175 PolarHBondContact O-N 2.95Å; I173-A176 PolarHBondContact O-N 2.94Å; I173-V177 HydrophobicContact CG2-CG2 4.24Å; I173-V177 WeakPolarHBondContact O-CB 3.34Å; I173-V177 WeakPolarHBondContact O-CG2 3.46Å; I173-V177 PolarHBondContact O-N 3.46Å |
| 174 | V | 90.5 | Very high | 85.7 | Confident | 101 Ų | 101 | 80.1 Ų | 80.1 | 61% | 0.612 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -58.7 | -45.9 | 176.6 | 171.2 | 0 | 0 | 0 | 0 | 110.6 | L170 I171 V177 H178 | L170-V174 WeakPolarHBondContact O-CG2 3.4Å; L170-V174 PolarHBondContact O-N 3.03Å; I171-V174 PolarHBondContact O-N 3.11Å; V174-V177 PolarHBondContact O-N 3.02Å; V174-H178 WeakPolarHBondContact O-CB 3.31Å; V174-H178 PolarHBondContact O-N 3.46Å |
| 175 | F | 85.1 | Confident | 84.3 | Confident | 108 Ų | 108 | 78.3 Ų | 78.3 | 47% | 0.474 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.9 | -47 | 174.5 | -77.2 | -65 | 0 | 0 | 0 | 111.8 | V118 I171 F172 I173 V177 H178 F179 | V118-F175 HydrophobicContact CG1-CB 4.37Å; I171-F175 HydrophobicContact CG2-CD2 3.83Å; I171-F175 HydrophobicContact CG2-CE2 3.56Å; I171-F175 WeakPolarHBondContact O-CD2 3.41Å; I171-F175 PolarHBondContact O-N 3.32Å; I171-F175 VanDerWaalsContact O-N 3.11Å; F172-F175 PolarHBondContact O-N 3.16Å; I173-F175 VanDerWaalsContact C-N 3.31Å; I173-F175 PolarHBondContact O-N 2.95Å; F175-V177 VanDerWaalsContact C-N 3.32Å; F175-V177 PolarHBondContact O-N 3.27Å; F175-H178 WeakPolarHBondContact O-CB 3.25Å; F175-H178 PolarHBondContact O-N 3.35Å; F175-H178 VanDerWaalsContact O-N 3.16Å; F175-F179 HydrophobicContact CB-CD2 4.31Å; F175-F179 HydrophobicContact CB-CE2 4.18Å; F175-F179 HydrophobicContact CD1-CE2 4.24Å; F175-F179 WeakPolarHBondContact O-CD2 3.43Å; F175-F179 PolarHBondContact O-N 3.22Å |
| 176 | A | 83.9 | Confident | 82.9 | Confident | 16 Ų | 16 | 79.2 Ų | 79.2 | 13% | 0.132 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -58.7 | -42.8 | 179 | 0 | 0 | 0 | 0 | 0 | 111.9 | V118 F172 I173 F179 Y180 | V118-A176 HydrophobicContact CG1-CB 4.17Å; F172-A176 WeakPolarHBondContact O-CB 3.29Å; F172-A176 PolarHBondContact O-N 3.06Å; I173-A176 PolarHBondContact O-N 2.94Å; A176-F179 PolarHBondContact O-N 3.37Å; A176-Y180 WeakPolarHBondContact O-CB 3.45Å; A176-Y180 PolarHBondContact O-N 3.2Å |
| 177 | V | 85.4 | Confident | 81.4 | Confident | 66 Ų | 66 | 83.1 Ų | 83.1 | 40% | 0.4 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.9 | -42.1 | 175.7 | 171.7 | 0 | 0 | 0 | 0 | 111.2 | I173 V174 F175 Y180 R181 | I173-V177 HydrophobicContact CG2-CG2 4.24Å; I173-V177 WeakPolarHBondContact O-CB 3.34Å; I173-V177 WeakPolarHBondContact O-CG2 3.46Å; I173-V177 PolarHBondContact O-N 3.46Å; V174-V177 PolarHBondContact O-N 3.02Å; F175-V177 VanDerWaalsContact C-N 3.32Å; F175-V177 PolarHBondContact O-N 3.27Å; V177-Y180 PolarHBondContact O-N 3.1Å; V177-R181 WeakPolarHBondContact O-CB 3.4Å; V177-R181 WeakPolarHBondContact O-CG 3.32Å; V177-R181 PolarHBondContact O-N 2.92Å |
| 178 | H | 84.6 | Confident | 79.9 | Confident | 117 Ų | 117 | 83.7 Ų | 83.7 | 54% | 0.542 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -58.9 | -50.1 | 175.3 | -179.4 | -82.4 | 0 | 0 | 0 | 111 | V174 F175 R181 S182 | V174-H178 WeakPolarHBondContact O-CB 3.31Å; V174-H178 PolarHBondContact O-N 3.46Å; F175-H178 WeakPolarHBondContact O-CB 3.25Å; F175-H178 PolarHBondContact O-N 3.35Å; F175-H178 VanDerWaalsContact O-N 3.16Å; H178-R181 PolarHBondContact O-N 3.37Å; H178-S182 PolarHBondContact O-N 3.12Å; H178-S182 PolarHBondContact O-OG 2.94Å; H178-S182 VanDerWaalsContact O-OG 3.12Å |
| 179 | F | 79.6 | Confident | 78.5 | Confident | 56 Ų | 56 | 82.6 Ų | 82.6 | 25% | 0.246 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -65.7 | -38.8 | 177.6 | -73.1 | -66.8 | 0 | 0 | 0 | 112.8 | L111 F115 V118 F175 A176 R181 S182 L183 | L111-F179 HydrophobicContact CD2-CD1 4.49Å; F115-F179 HydrophobicContact CD2-CB 4.04Å; V118-F179 HydrophobicContact CG2-CD2 4.08Å; V118-F179 HydrophobicContact CG2-CE2 3.98Å; F175-F179 HydrophobicContact CB-CD2 4.31Å; F175-F179 HydrophobicContact CB-CE2 4.18Å; F175-F179 HydrophobicContact CD1-CE2 4.24Å; F175-F179 WeakPolarHBondContact O-CD2 3.43Å; F175-F179 PolarHBondContact O-N 3.22Å; A176-F179 PolarHBondContact O-N 3.37Å; F179-R181 VanDerWaalsContact C-N 3.35Å; F179-S182 WeakPolarHBondContact O-CB 3.09Å; F179-S182 PolarHBondContact O-N 3.4Å; F179-L183 WeakPolarHBondContact O-CG 3.47Å; F179-L183 PolarHBondContact O-N 2.96Å |
| 180 | Y | 80.6 | Confident | 77.2 | Confident | 134 Ų | 134 | 87.8 Ų | 87.8 | 53% | 0.525 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -60.6 | -45.1 | 174.7 | 177.8 | -99.3 | 0 | 0 | 0 | 111.2 | F115 A176 V177 S182 L183 V184 | F115-Y180 HydrophobicContact CE2-CD2 4.48Å; F115-Y180 HydrophobicContact CZ-CD2 4.32Å; A176-Y180 WeakPolarHBondContact O-CB 3.45Å; A176-Y180 PolarHBondContact O-N 3.2Å; V177-Y180 PolarHBondContact O-N 3.1Å; Y180-S182 PolarHBondContact O-N 3.44Å; Y180-L183 WeakPolarHBondContact O-CB 3.16Å; Y180-L183 PolarHBondContact O-N 3.42Å; Y180-V184 HydrophobicContact CD1-CG2 4.21Å; Y180-V184 HydrophobicContact CD2-CG2 4.34Å; Y180-V184 HydrophobicContact CE1-CG2 3.75Å; Y180-V184 HydrophobicContact CE2-CG2 3.9Å; Y180-V184 HydrophobicContact CG-CG2 4.49Å; Y180-V184 WeakPolarHBondContact O-CG2 3.27Å; Y180-V184 PolarHBondContact O-N 3.33Å |
| 181 | R | 79.3 | Confident | 75.6 | Confident | 178 Ų | 178 | 88.5 Ų | 88.5 | 67% | 0.672 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -63.4 | -40.1 | 174.6 | -77.6 | -176 | 166.2 | 175.7 | -3.1 | 112 | V177 H178 F179 L183 V184 S185 | V177-R181 WeakPolarHBondContact O-CB 3.4Å; V177-R181 WeakPolarHBondContact O-CG 3.32Å; V177-R181 PolarHBondContact O-N 2.92Å; H178-R181 PolarHBondContact O-N 3.37Å; F179-R181 VanDerWaalsContact C-N 3.35Å; R181-L183 VanDerWaalsContact C-N 3.3Å; R181-L183 PolarHBondContact O-N 2.86Å; R181-V184 PolarHBondContact O-N 2.81Å; R181-S185 WeakPolarHBondContact O-CB 3.47Å; R181-S185 PolarHBondContact O-N 3.33Å |
| 182 | S | 72.6 | Confident | 74.5 | Confident | 44 Ų | 44 | 90.9 Ų | 90.9 | 31% | 0.308 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.6 | -37.7 | 173.4 | -62 | 0 | 0 | 0 | 0 | 112.6 | H178 F179 Y180 | H178-S182 PolarHBondContact O-N 3.12Å; H178-S182 PolarHBondContact O-OG 2.94Å; H178-S182 VanDerWaalsContact O-OG 3.12Å; F179-S182 WeakPolarHBondContact O-CB 3.09Å; F179-S182 PolarHBondContact O-N 3.4Å; Y180-S182 PolarHBondContact O-N 3.44Å |
| 183 | L | 69.3 | Low | 73.7 | Confident | 44 Ų | 44 | 92.2 Ų | 92.2 | 23% | 0.23 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -68.3 | -46.3 | 173.8 | -72.3 | 172.2 | 0 | 0 | 0 | 112.3 | L111 F115 F179 Y180 R181 K187 | L111-L183 HydrophobicContact CB-CD2 4.03Å; L111-L183 HydrophobicContact CD2-CB 4.43Å; L111-L183 HydrophobicContact CD2-CD1 4.28Å; L111-L183 HydrophobicContact CD2-CD2 3.32Å; L111-L183 HydrophobicContact CD2-CG 3.36Å; L111-L183 HydrophobicContact CG-CD2 4.22Å; F115-L183 HydrophobicContact CB-CD1 4.02Å; F115-L183 HydrophobicContact CD1-CD1 3.95Å; F115-L183 HydrophobicContact CD2-CD1 4.08Å; F115-L183 HydrophobicContact CE1-CD1 4.34Å; F115-L183 HydrophobicContact CE2-CD1 4.48Å; F115-L183 HydrophobicContact CG-CD1 3.76Å; F179-L183 WeakPolarHBondContact O-CG 3.47Å; F179-L183 PolarHBondContact O-N 2.96Å; Y180-L183 WeakPolarHBondContact O-CB 3.16Å; Y180-L183 PolarHBondContact O-N 3.42Å; R181-L183 VanDerWaalsContact C-N 3.3Å; R181-L183 PolarHBondContact O-N 2.86Å; L183-K187 PolarHBondContact O-N 3.48Å |
| 184 | V | 69.5 | Low | 73 | Confident | 56 Ų | 56 | 92.3 Ų | 92.3 | 34% | 0.339 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -75.6 | -43.5 | -173.1 | 170 | 0 | 0 | 0 | 0 | 112.7 | Y180 R181 H186 K187 T188 | Y180-V184 HydrophobicContact CD1-CG2 4.21Å; Y180-V184 HydrophobicContact CD2-CG2 4.34Å; Y180-V184 HydrophobicContact CE1-CG2 3.75Å; Y180-V184 HydrophobicContact CE2-CG2 3.9Å; Y180-V184 HydrophobicContact CG-CG2 4.49Å; Y180-V184 WeakPolarHBondContact O-CG2 3.27Å; Y180-V184 PolarHBondContact O-N 3.33Å; R181-V184 PolarHBondContact O-N 2.81Å; V184-H186 PolarHBondContact O-N 3.36Å; V184-K187 PolarHBondContact O-N 2.88Å; V184-K187 VanDerWaalsContact O-N 3.16Å; V184-T188 WeakPolarHBondContact O-CB 3.33Å; V184-T188 PolarHBondContact O-N 3.27Å; V184-T188 PolarHBondContact O-OG1 3.47Å |
| 185 | S | 66.4 | Low | 72.2 | Confident | 69 Ų | 69 | 93 Ų | 93 | 48% | 0.483 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -54.9 | -45.6 | 177.7 | -170.9 | 0 | 0 | 0 | 0 | 109.9 | R181 K187 T188 D189 | R181-S185 WeakPolarHBondContact O-CB 3.47Å; R181-S185 PolarHBondContact O-N 3.33Å; S185-K187 PolarHBondContact O-N 2.94Å; S185-T188 WeakPolarHBondContact O-CB 3.49Å; S185-T188 PolarHBondContact O-N 3.34Å; S185-D189 VanDerWaalsContact O-CG 3.27Å; S185-D189 PolarHBondContact O-N 3.45Å |
| 186 | H | 61.9 | Low | 72.2 | Confident | 59 Ų | 59 | 93.1 Ų | 93.1 | 27% | 0.273 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -75.2 | -28.3 | -177.4 | -159 | -55 | 0 | 0 | 0 | 113.2 | H108 V184 T188 R190 | H108-H186 AromaticContact CE1-CE1 3.52Å; H108-H186 AromaticContact CE1-CG 3.79Å; H108-H186 AromaticContact CE1-ND1 3.34Å; H108-H186 PolarHBondContact CE1-ND1 2.99Å; H108-H186 VanDerWaalsContact CE1-ND1 3.34Å; H108-H186 AromaticContact NE2-CE1 3.79Å; H108-H186 AromaticContact NE2-ND1 3.9Å; V184-H186 PolarHBondContact O-N 3.36Å; H186-T188 VanDerWaalsContact C-N 3.33Å; H186-R190 WeakPolarHBondContact O-CB 3.3Å; H186-R190 PolarHBondContact O-N 2.9Å; H186-R190 VanDerWaalsContact O-N 3.16Å |
| 187 | K | 61.7 | Low | 72.3 | Confident | 158 Ų | 158 | 98.4 Ų | 98.4 | 69% | 0.687 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -69.7 | -35.5 | 172.3 | -157.5 | 177.4 | -171.5 | 173.5 | 0 | 111.1 | L183 V184 S185 Q191 | L183-K187 PolarHBondContact O-N 3.48Å; V184-K187 PolarHBondContact O-N 2.88Å; V184-K187 VanDerWaalsContact O-N 3.16Å; S185-K187 PolarHBondContact O-N 2.94Å; K187-Q191 VanDerWaalsContact O-CG 3.26Å; K187-Q191 WeakPolarHBondContact O-CG 3.4Å; K187-Q191 PolarHBondContact O-N 3.3Å |
| 188 | T | 60.8 | Low | 72.1 | Confident | 80 Ų | 80 | 100.4 Ų | 100.4 | 49% | 0.491 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -69.5 | -47.3 | 176.5 | -51.4 | 0 | 0 | 0 | 0 | 110.8 | V184 S185 H186 R190 Q191 F192 | V184-T188 WeakPolarHBondContact O-CB 3.33Å; V184-T188 PolarHBondContact O-N 3.27Å; V184-T188 PolarHBondContact O-OG1 3.47Å; S185-T188 WeakPolarHBondContact O-CB 3.49Å; S185-T188 PolarHBondContact O-N 3.34Å; H186-T188 VanDerWaalsContact C-N 3.33Å; T188-R190 VanDerWaalsContact C-N 3.28Å; T188-R190 PolarHBondContact O-N 2.97Å; T188-Q191 PolarHBondContact O-N 3.04Å; T188-F192 PolarHBondContact O-N 3.32Å |
| 189 | D | 62.8 | Low | 72 | Confident | 91 Ų | 91 | 97.9 Ų | 97.9 | 49% | 0.487 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.5 | -39.5 | 177.2 | -69.5 | -28.5 | 0 | 0 | 0 | 111.9 | S185 F192 Q193 | S185-D189 VanDerWaalsContact O-CG 3.27Å; S185-D189 PolarHBondContact O-N 3.45Å; D189-F192 PolarHBondContact O-N 3.36Å; D189-Q193 PolarHBondContact O-N 2.99Å |
| 190 | R | 64.3 | Low | 72.4 | Confident | 123 Ų | 123 | 99.2 Ų | 99.2 | 46% | 0.464 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -70.3 | -39.7 | -179.6 | -160.1 | 168.6 | 82.1 | 173.9 | 11.4 | 112.9 | H186 T188 F192 Q193 E194 | H186-R190 WeakPolarHBondContact O-CB 3.3Å; H186-R190 PolarHBondContact O-N 2.9Å; H186-R190 VanDerWaalsContact O-N 3.16Å; T188-R190 VanDerWaalsContact C-N 3.28Å; T188-R190 PolarHBondContact O-N 2.97Å; R190-F192 VanDerWaalsContact C-N 3.28Å; R190-F192 PolarHBondContact O-N 3.18Å; R190-Q193 PolarHBondContact O-N 3.24Å; R190-E194 WeakPolarHBondContact O-CG 3.43Å; R190-E194 PolarHBondContact O-N 3.48Å |
| 191 | Q | 57.3 | Low | 72.7 | Confident | 117 Ų | 117 | 98.2 Ų | 98.2 | 55% | 0.547 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66.5 | -33.9 | 174.4 | -72.1 | -93.8 | -87.9 | 0 | 0 | 111.6 | K187 T188 E194 L195 | K187-Q191 VanDerWaalsContact O-CG 3.26Å; K187-Q191 WeakPolarHBondContact O-CG 3.4Å; K187-Q191 PolarHBondContact O-N 3.3Å; T188-Q191 PolarHBondContact O-N 3.04Å; Q191-E194 PolarHBondContact NE2-OE2 2.74Å; Q191-L195 WeakPolarHBondContact O-CB 3.49Å; Q191-L195 WeakPolarHBondContact O-CG 3.31Å; Q191-L195 PolarHBondContact O-N 3.02Å |
| 192 | F | 69.2 | Low | 72.9 | Confident | 146 Ų | 146 | 93.8 Ų | 93.8 | 64% | 0.64 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -68.7 | -41.7 | 175.6 | -141 | -88.8 | 0 | 0 | 0 | 111.8 | T188 D189 R190 L195 E196 | T188-F192 PolarHBondContact O-N 3.32Å; D189-F192 PolarHBondContact O-N 3.36Å; R190-F192 VanDerWaalsContact C-N 3.28Å; R190-F192 PolarHBondContact O-N 3.18Å; F192-L195 PolarHBondContact O-N 3.46Å; F192-E196 WeakPolarHBondContact O-CB 3.47Å; F192-E196 PolarHBondContact O-N 2.91Å |
| 193 | Q | 72.5 | Confident | 73.6 | Confident | 91 Ų | 91 | 100.6 Ų | 100.6 | 43% | 0.425 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63 | -42.6 | 172.9 | -79.2 | -169.3 | -74 | 0 | 0 | 112.5 | D189 R190 L195 E196 E197 | D189-Q193 PolarHBondContact O-N 2.99Å; R190-Q193 PolarHBondContact O-N 3.24Å; Q193-L195 VanDerWaalsContact C-N 3.31Å; Q193-L195 PolarHBondContact O-N 2.7Å; Q193-E196 PolarHBondContact O-N 3.36Å; Q193-E197 WeakPolarHBondContact O-CG 3.21Å; Q193-E197 PolarHBondContact O-N 2.93Å |
| 194 | E | 75.3 | Confident | 74.5 | Confident | 84 Ų | 84 | 103.5 Ų | 103.5 | 39% | 0.393 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.7 | -40.3 | 175.9 | -76 | 170.3 | 178.8 | 0 | 0 | 111.5 | R190 Q191 L198 | R190-E194 WeakPolarHBondContact O-CG 3.43Å; R190-E194 PolarHBondContact O-N 3.48Å; Q191-E194 PolarHBondContact NE2-OE2 2.74Å; E194-L198 WeakPolarHBondContact O-CB 3.01Å; E194-L198 WeakPolarHBondContact O-CD1 3.34Å; E194-L198 WeakPolarHBondContact O-CG 3.17Å; E194-L198 PolarHBondContact O-N 3.15Å; E194-L198 VanDerWaalsContact O-N 3.1Å |
| 195 | L | 75.1 | Confident | 75.2 | Confident | 115 Ų | 115 | 107 Ų | 107 | 60% | 0.602 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.8 | -39.5 | 174.5 | -80.9 | 166.6 | 0 | 0 | 0 | 112.5 | Q191 F192 Q193 S199 | Q191-L195 WeakPolarHBondContact O-CB 3.49Å; Q191-L195 WeakPolarHBondContact O-CG 3.31Å; Q191-L195 PolarHBondContact O-N 3.02Å; F192-L195 PolarHBondContact O-N 3.46Å; Q193-L195 VanDerWaalsContact C-N 3.31Å; Q193-L195 PolarHBondContact O-N 2.7Å; L195-S199 VanDerWaalsContact O-CB 3.31Å; L195-S199 WeakPolarHBondContact O-CB 3.31Å; L195-S199 PolarHBondContact O-N 3.43Å |
| 196 | E | 83.7 | Confident | 76.1 | Confident | 111 Ų | 111 | 109 Ų | 109 | 52% | 0.519 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -68.3 | -41.4 | 179.1 | -168.9 | 169 | -168 | 0 | 0 | 111.5 | F192 Q193 S199 N200 | F192-E196 WeakPolarHBondContact O-CB 3.47Å; F192-E196 PolarHBondContact O-N 2.91Å; Q193-E196 PolarHBondContact O-N 3.36Å; E196-S199 WeakPolarHBondContact CA-OG 3.28Å; E196-S199 PolarHBondContact O-N 2.87Å; E196-S199 PolarHBondContact O-OG 3.31Å; E196-N200 WeakPolarHBondContact O-CB 3.12Å; E196-N200 PolarHBondContact O-N 3.06Å; E196-N200 PolarHBondContact O-ND2 2.9Å |
| 197 | E | 86.8 | Confident | 77 | Confident | 127 Ų | 127 | 113.1 Ų | 113.1 | 59% | 0.593 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -62.9 | -44.7 | 174.3 | -73.9 | -178.8 | -177.8 | 0 | 0 | 112.1 | Q193 S199 N200 L201 | Q193-E197 WeakPolarHBondContact O-CG 3.21Å; Q193-E197 PolarHBondContact O-N 2.93Å; E197-S199 VanDerWaalsContact C-N 3.33Å; E197-S199 PolarHBondContact O-N 3.49Å; E197-N200 PolarHBondContact O-N 3.45Å; E197-L201 PolarHBondContact O-N 3.44Å |
| 198 | L | 81.4 | Confident | 77.9 | Confident | 108 Ų | 108 | 110.7 Ų | 110.7 | 57% | 0.565 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.3 | -38.5 | 174.2 | -76.8 | 166.1 | 0 | 0 | 0 | 112.2 | E194 T202 | E194-L198 WeakPolarHBondContact O-CB 3.01Å; E194-L198 WeakPolarHBondContact O-CD1 3.34Å; E194-L198 WeakPolarHBondContact O-CG 3.17Å; E194-L198 PolarHBondContact O-N 3.15Å; E194-L198 VanDerWaalsContact O-N 3.1Å; L198-T202 WeakPolarHBondContact O-CB 3.28Å; L198-T202 PolarHBondContact O-N 2.94Å; L198-T202 PolarHBondContact O-OG1 3.37Å |
| 199 | S | 82.4 | Confident | 78.5 | Confident | 64 Ų | 64 | 111.9 Ų | 111.9 | 45% | 0.448 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.8 | -40.2 | 177.1 | 81.1 | 0 | 0 | 0 | 0 | 111.6 | L195 E196 E197 T202 R203 | L195-S199 VanDerWaalsContact O-CB 3.31Å; L195-S199 WeakPolarHBondContact O-CB 3.31Å; L195-S199 PolarHBondContact O-N 3.43Å; E196-S199 WeakPolarHBondContact CA-OG 3.28Å; E196-S199 PolarHBondContact O-N 2.87Å; E196-S199 PolarHBondContact O-OG 3.31Å; E197-S199 VanDerWaalsContact C-N 3.33Å; E197-S199 PolarHBondContact O-N 3.49Å; S199-T202 PolarHBondContact O-N 2.91Å; S199-R203 VanDerWaalsContact O-CB 3.31Å; S199-R203 WeakPolarHBondContact O-CB 3.33Å; S199-R203 PolarHBondContact O-N 2.93Å |
| 200 | N | 87.2 | Confident | 78.9 | Confident | 84 Ų | 84 | 109.5 Ų | 109.5 | 45% | 0.449 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -69 | -40.7 | 178 | -82.9 | -35.2 | 0 | 0 | 0 | 112.1 | E196 E197 R203 L204 | E196-N200 WeakPolarHBondContact O-CB 3.12Å; E196-N200 PolarHBondContact O-N 3.06Å; E196-N200 PolarHBondContact O-ND2 2.9Å; E197-N200 PolarHBondContact O-N 3.45Å; N200-R203 PolarHBondContact O-N 3.34Å; N200-L204 WeakPolarHBondContact O-CG 3.34Å; N200-L204 PolarHBondContact O-N 2.97Å |
| 201 | L | 87 | Confident | 78.9 | Confident | 113 Ų | 113 | 111.4 Ų | 111.4 | 59% | 0.592 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.7 | -45.2 | 173.4 | -79.8 | 176.3 | 0 | 0 | 0 | 112 | E197 R203 L204 Q205 | E197-L201 PolarHBondContact O-N 3.44Å; L201-R203 VanDerWaalsContact C-N 3.25Å; L201-R203 PolarHBondContact O-N 3.32Å; L201-L204 PolarHBondContact O-N 3.46Å; L201-Q205 WeakPolarHBondContact O-CB 3.21Å; L201-Q205 PolarHBondContact O-N 2.84Å |
| 202 | T | 84.8 | Confident | 79 | Confident | 85 Ų | 85 | 107.1 Ų | 107.1 | 52% | 0.521 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59.8 | -40.1 | 176.6 | -54.2 | 0 | 0 | 0 | 0 | 111.1 | L198 S199 Q205 N206 | L198-T202 WeakPolarHBondContact O-CB 3.28Å; L198-T202 PolarHBondContact O-N 2.94Å; L198-T202 PolarHBondContact O-OG1 3.37Å; S199-T202 PolarHBondContact O-N 2.91Å; T202-Q205 PolarHBondContact O-N 3.42Å; T202-N206 PolarHBondContact O-N 3.27Å |
| 203 | R | 87.1 | Confident | 78.5 | Confident | 188 Ų | 188 | 107.1 Ų | 107.1 | 71% | 0.709 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -68.3 | -41.4 | 178.9 | -162.2 | 178.9 | 170.7 | 127.6 | 3.9 | 112.5 | S199 N200 L201 Q205 N206 E207 | S199-R203 VanDerWaalsContact O-CB 3.31Å; S199-R203 WeakPolarHBondContact O-CB 3.33Å; S199-R203 PolarHBondContact O-N 2.93Å; N200-R203 PolarHBondContact O-N 3.34Å; L201-R203 VanDerWaalsContact C-N 3.25Å; L201-R203 PolarHBondContact O-N 3.32Å; R203-Q205 VanDerWaalsContact C-N 3.34Å; R203-N206 PolarHBondContact O-N 3.14Å; R203-E207 PolarHBondContact O-N 3.17Å; R203-E207 VanDerWaalsContact O-N 3.12Å |
| 204 | L | 87.9 | Confident | 77.7 | Confident | 104 Ų | 104 | 106.1 Ų | 106.1 | 55% | 0.545 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64 | -39.1 | 173.4 | -76.5 | 168.2 | 0 | 0 | 0 | 112 | N200 L201 E207 L208 | N200-L204 WeakPolarHBondContact O-CG 3.34Å; N200-L204 PolarHBondContact O-N 2.97Å; L201-L204 PolarHBondContact O-N 3.46Å; L204-E207 PolarHBondContact O-N 3.25Å; L204-L208 PolarHBondContact O-N 3.36Å |
| 205 | Q | 83.7 | Confident | 76.8 | Confident | 129 Ų | 129 | 108.6 Ų | 108.6 | 60% | 0.603 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.4 | -41.8 | 177.5 | -167 | 139 | -20.4 | 0 | 0 | 111.8 | L201 T202 R203 E207 L208 D209 | L201-Q205 WeakPolarHBondContact O-CB 3.21Å; L201-Q205 PolarHBondContact O-N 2.84Å; T202-Q205 PolarHBondContact O-N 3.42Å; R203-Q205 VanDerWaalsContact C-N 3.34Å; Q205-E207 VanDerWaalsContact C-N 3.34Å; Q205-E207 PolarHBondContact O-N 3.11Å; Q205-L208 PolarHBondContact O-N 3.08Å; Q205-D209 PolarHBondContact O-N 3.08Å |
| 206 | N | 84.4 | Confident | 75.8 | Confident | 112 Ų | 112 | 111.1 Ų | 111.1 | 60% | 0.599 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -61.3 | -37.9 | 172.6 | -90 | -3.7 | 0 | 0 | 0 | 113.1 | T202 R203 G210 | T202-N206 PolarHBondContact O-N 3.27Å; R203-N206 PolarHBondContact O-N 3.14Å; N206-G210 PolarHBondContact O-N 2.85Å |
| 207 | E | 82.8 | Confident | 74.2 | Confident | 145 Ų | 145 | 114 Ų | 114 | 68% | 0.678 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.6 | -37.6 | 174 | -82.3 | -136.9 | 144.3 | 0 | 0 | 112.6 | R203 L204 Q205 R211 | R203-E207 PolarHBondContact O-N 3.17Å; R203-E207 VanDerWaalsContact O-N 3.12Å; L204-E207 PolarHBondContact O-N 3.25Å; Q205-E207 VanDerWaalsContact C-N 3.34Å; Q205-E207 PolarHBondContact O-N 3.11Å; E207-R211 VanDerWaalsContact O-CB 3.3Å; E207-R211 WeakPolarHBondContact O-CB 3.29Å; E207-R211 PolarHBondContact O-N 2.89Å |
| 208 | L | 78.6 | Confident | 72.2 | Confident | 107 Ų | 107 | 112.5 Ų | 112.5 | 56% | 0.56 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67.3 | -42.8 | 176.5 | -82.4 | 156.6 | 0 | 0 | 0 | 112 | L204 Q205 R211 G212 | L204-L208 PolarHBondContact O-N 3.36Å; Q205-L208 PolarHBondContact O-N 3.08Å; L208-R211 PolarHBondContact O-N 3.43Å; L208-G212 PolarHBondContact O-N 2.95Å |
| 209 | D | 74.5 | Confident | 70.6 | Confident | 105 Ų | 105 | 112.9 Ų | 112.9 | 56% | 0.561 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -65.6 | -45.1 | 175.5 | -85.8 | -18.3 | 0 | 0 | 0 | 111.3 | Q205 R211 G212 E213 | Q205-D209 PolarHBondContact O-N 3.08Å; D209-R211 VanDerWaalsContact C-N 3.27Å; D209-R211 PolarHBondContact O-N 3.32Å; D209-G212 PolarHBondContact O-N 3.19Å; D209-G212 VanDerWaalsContact O-N 3.14Å; D209-E213 PolarHBondContact O-N 3.4Å |
| 210 | G | 71.9 | Confident | 68.8 | Low | 42 Ų | 42 | 115.9 Ų | 115.9 | 43% | 0.433 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -62.2 | -33.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | N206 S214 | N206-G210 PolarHBondContact O-N 2.85Å; G210-S214 PolarHBondContact O-N 3.46Å |
| 211 | R | 63 | Low | 67.2 | Low | 162 Ų | 162 | 116.7 Ų | 116.7 | 61% | 0.611 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -75.3 | -34.2 | 175.4 | -152.4 | 166.7 | 74.9 | -173.1 | 4.8 | 112.1 | E207 L208 D209 S214 L215 | E207-R211 VanDerWaalsContact O-CB 3.3Å; E207-R211 WeakPolarHBondContact O-CB 3.29Å; E207-R211 PolarHBondContact O-N 2.89Å; L208-R211 PolarHBondContact O-N 3.43Å; D209-R211 VanDerWaalsContact C-N 3.27Å; D209-R211 PolarHBondContact O-N 3.32Å; R211-S214 WeakPolarHBondContact CA-OG 3.44Å; R211-S214 PolarHBondContact O-N 3.31Å; R211-S214 PolarHBondContact O-OG 3.33Å; R211-L215 WeakPolarHBondContact O-CG 3.45Å; R211-L215 PolarHBondContact O-N 3.31Å; R211-L215 VanDerWaalsContact O-N 3.12Å |
| 212 | G | 59.3 | Low | 65.6 | Low | 27 Ų | 27 | 119.5 Ų | 119.5 | 28% | 0.278 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -62.4 | -41.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113 | L208 D209 L215 M216 | L208-G212 PolarHBondContact O-N 2.95Å; D209-G212 PolarHBondContact O-N 3.19Å; D209-G212 VanDerWaalsContact O-N 3.14Å; G212-L215 PolarHBondContact O-N 3.15Å; G212-M216 PolarHBondContact O-N 3.03Å |
| 213 | E | 58.3 | Low | 63.2 | Low | 147 Ų | 147 | 125.3 Ų | 125.3 | 69% | 0.687 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -68.2 | -39.4 | 175.2 | -67.2 | -153.6 | 126.7 | 0 | 0 | 112.4 | D209 L215 M216 Q217 | D209-E213 PolarHBondContact O-N 3.4Å; E213-L215 VanDerWaalsContact C-N 3.32Å; E213-L215 PolarHBondContact O-N 3.12Å; E213-M216 PolarHBondContact O-N 3.3Å; E213-Q217 PolarHBondContact O-N 2.78Å |
| 214 | S | 57.2 | Low | 61.6 | Low | 70 Ų | 70 | 125.6 Ų | 125.6 | 49% | 0.49 | 68% | 0.684 | S | S | . | * | H | α-helix | trans | -65.9 | -31.3 | 177.3 | 70.2 | 0 | 0 | 0 | 0 | 113.9 | G210 R211 Q217 | G210-S214 PolarHBondContact O-N 3.46Å; R211-S214 WeakPolarHBondContact CA-OG 3.44Å; R211-S214 PolarHBondContact O-N 3.31Å; R211-S214 PolarHBondContact O-OG 3.33Å; S214-Q217 PolarHBondContact O-N 3.38Å |
| 215 | L | 56.7 | Low | 60.3 | Low | 135 Ų | 135 | 126.7 Ų | 126.7 | 71% | 0.707 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -77.6 | -22.5 | 176 | -75.8 | 166 | 0 | 0 | 0 | 112.8 | R211 G212 E213 Q217 | R211-L215 WeakPolarHBondContact O-CG 3.45Å; R211-L215 PolarHBondContact O-N 3.31Å; R211-L215 VanDerWaalsContact O-N 3.12Å; G212-L215 PolarHBondContact O-N 3.15Å; E213-L215 VanDerWaalsContact C-N 3.32Å; E213-L215 PolarHBondContact O-N 3.12Å; L215-Q217 VanDerWaalsContact C-N 3.31Å |
| 216 | M | 53.6 | Low | 59.1 | Low | 169 Ų | 169 | 126.5 Ų | 126.5 | 83% | 0.833 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -80.7 | -9.1 | 172.7 | -74.1 | -167.2 | -114.4 | 0 | 0 | 113.3 | G212 E213 | G212-M216 PolarHBondContact O-N 3.03Å; E213-M216 PolarHBondContact O-N 3.3Å |
| 217 | Q | 49.3 | Very low | 57.7 | Low | 170 Ų | 170 | 127.3 Ų | 127.3 | 79% | 0.794 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -105.2 | 14.6 | -172.1 | -155.6 | 156.4 | 22.3 | 0 | 0 | 116.1 | E213 S214 L215 | E213-Q217 PolarHBondContact O-N 2.78Å; S214-Q217 PolarHBondContact O-N 3.38Å; L215-Q217 VanDerWaalsContact C-N 3.31Å |
| 218 | S | 46.3 | Very low | 56.2 | Low | 97 Ų | 97 | 126.3 Ų | 126.3 | 68% | 0.678 | 70% | 0.703 | S | S | * | * | trans | -155.5 | 141.3 | 168.3 | -163.8 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 219 | P | 46.8 | Very low | 54.8 | Low | 116 Ų | 116 | 127.5 Ų | 127.5 | 75% | 0.753 | 71% | 0.712 | S | S | * | * | cis | -130.7 | 134.9 | 15.4 | 36 | -17.3 | 0 | 0 | 0 | 115 | ||||
| 220 | S | 45 | Very low | 53.5 | Low | 127 Ų | 127 | 129 Ų | 129 | 89% | 0.888 | 72% | 0.722 | S | S | * | * | trans | -144.2 | 49.9 | 166.8 | 57.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 221 | S | 54 | Low | 52.2 | Low | 101 Ų | 101 | 135.2 Ų | 135.2 | 71% | 0.706 | 74% | 0.742 | S | S | * | * | trans | -167.4 | 124.2 | 153.2 | 52.9 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 222 | Q | 52.2 | Low | 51.3 | Low | 172 Ų | 172 | 133.2 Ų | 133.2 | 80% | 0.804 | 75% | 0.752 | S | S | * | * | 175.3 | 134.5 | 63.6 | -160.5 | 160.1 | -11.8 | 0 | 0 | 106.1 | |||||
| 223 | F | 35.7 | Very low | 50.7 | Low | 206 Ų | 206 | 142 Ų | 142 | 90% | 0.904 | 79% | 0.792 | S | S | * | * | trans | 165.4 | 148.5 | 150.7 | -91.7 | -63.5 | 0 | 0 | 0 | 110 | ||||
| 224 | P | 53.2 | Low | 50 | Low | 194 Ų | 194 | 141.5 Ų | 141.5 | 100% | 1.26 | 80% | 0.801 | S | S | * | * | cis | -102.5 | 0 | -43.9 | 35.9 | -23 | 0 | 0 | 0 | 112.6 |
Retrieved 224 of 224 residues in 422.9 ms
(Link to these results)