| 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 | 59.5 | Low | 73.3 | Confident | 205 Ų | 205 | 143.6 Ų | 143.6 | 100% | 1.01 | 70% | 0.695 | S | S | * | * | 0 | 6.9 | 0 | -87.4 | -173.6 | 171.6 | 0 | 0 | 111.5 | L3 | M1-L3 PolarHBondContact O-N 2.83Š| |||
| 2 | D | 77.6 | Confident | 73.1 | Confident | 124 Ų | 124 | 134.4 Ų | 134.4 | 66% | 0.663 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -86.9 | -19.1 | -155.5 | -49 | -92.3 | 0 | 0 | 0 | 113.9 | W4 E5 R6 | D2-W4 PolarHBondContact O-N 3Å; D2-E5 PolarHBondContact O-N 2.75Å; D2-R6 PolarHBondContact O-N 2.9Å; D2-R6 VanDerWaalsContact O-N 3.17Å |
| 3 | L | 74.7 | Confident | 72.6 | Confident | 148 Ų | 148 | 134.6 Ų | 134.6 | 78% | 0.775 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -68.5 | -35.4 | -179.9 | -156.1 | 77.1 | 0 | 0 | 0 | 112.1 | M1 A7 | M1-L3 PolarHBondContact O-N 2.83Å; L3-A7 WeakPolarHBondContact O-CB 3.22Å; L3-A7 PolarHBondContact O-N 3.37Å; L3-A7 VanDerWaalsContact O-N 3.08Å |
| 4 | W | 76.9 | Confident | 72.4 | Confident | 223 Ų | 223 | 128.6 Ų | 128.6 | 85% | 0.845 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -71.1 | -36.4 | 178 | -89 | 85.3 | 0 | 0 | 0 | 112.4 | D2 R8 | D2-W4 PolarHBondContact O-N 3Å; W4-R8 WeakPolarHBondContact O-CB 3.39Å; W4-R8 PolarHBondContact O-N 3.37Å |
| 5 | E | 81.1 | Confident | 72.3 | Confident | 138 Ų | 138 | 123.9 Ų | 123.9 | 65% | 0.645 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -68.3 | -41.2 | 176.3 | -69.5 | -178 | 173.7 | 0 | 0 | 111.4 | D2 R8 A9 | D2-E5 PolarHBondContact O-N 2.75Å; E5-R8 PolarHBondContact O-N 3.45Å; E5-A9 WeakPolarHBondContact O-CB 3.48Å; E5-A9 PolarHBondContact O-N 2.86Å |
| 6 | R | 73.3 | Confident | 72.5 | Confident | 205 Ų | 205 | 122.9 Ų | 122.9 | 77% | 0.774 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.5 | -39.1 | 175.9 | -158.4 | 178.5 | -169.9 | 100 | 1 | 112.5 | D2 A9 F10 | D2-R6 PolarHBondContact O-N 2.9Å; D2-R6 VanDerWaalsContact O-N 3.17Å; R6-A9 PolarHBondContact O-N 2.85Å; R6-F10 PolarHBondContact O-N 2.94Å |
| 7 | A | 73.1 | Confident | 72.3 | Confident | 61 Ų | 61 | 126.4 Ų | 126.4 | 50% | 0.504 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -66.5 | -39.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L3 F10 A11 | L3-A7 WeakPolarHBondContact O-CB 3.22Å; L3-A7 PolarHBondContact O-N 3.37Å; L3-A7 VanDerWaalsContact O-N 3.08Å; A7-F10 PolarHBondContact O-N 3.05Å; A7-A11 WeakPolarHBondContact O-CB 3.49Å; A7-A11 PolarHBondContact O-N 3.43Å |
| 8 | R | 76.3 | Confident | 72 | Confident | 206 Ų | 206 | 123.8 Ų | 123.8 | 78% | 0.777 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -67.5 | -38.3 | 175.9 | -160 | -175.2 | -167.8 | 107 | 1 | 111.9 | W4 E5 A11 G12 | W4-R8 WeakPolarHBondContact O-CB 3.39Å; W4-R8 PolarHBondContact O-N 3.37Å; E5-R8 PolarHBondContact O-N 3.45Å; R8-A11 PolarHBondContact O-N 2.91Å; R8-G12 PolarHBondContact O-N 3.07Å |
| 9 | A | 76.3 | Confident | 72.1 | Confident | 59 Ų | 59 | 125 Ų | 125 | 49% | 0.488 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -61.1 | -47.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | E5 R6 A11 G12 E13 | E5-A9 WeakPolarHBondContact O-CB 3.48Å; E5-A9 PolarHBondContact O-N 2.86Å; R6-A9 PolarHBondContact O-N 2.85Å; A9-A11 PolarHBondContact O-N 3.33Å; A9-G12 PolarHBondContact O-N 3.49Å; A9-G12 VanDerWaalsContact O-N 3.17Å; A9-E13 WeakPolarHBondContact O-CB 3.43Å; A9-E13 PolarHBondContact O-N 2.79Å |
| 10 | F | 67.9 | Low | 72 | Confident | 150 Ų | 150 | 126 Ų | 126 | 66% | 0.658 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -64.7 | -37.8 | 178.2 | -168.8 | -95.9 | 0 | 0 | 0 | 112.8 | R6 A7 G12 E13 A14 | R6-F10 PolarHBondContact O-N 2.94Å; A7-F10 PolarHBondContact O-N 3.05Å; F10-G12 VanDerWaalsContact C-N 3.35Å; F10-E13 PolarHBondContact O-N 2.96Å; F10-A14 VanDerWaalsContact O-CB 3.3Å; F10-A14 WeakPolarHBondContact O-CB 3.2Å; F10-A14 PolarHBondContact O-N 3.26Å |
| 11 | A | 69.7 | Low | 71.4 | Confident | 61 Ų | 61 | 124.9 Ų | 124.9 | 50% | 0.504 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -65.1 | -38.1 | 174 | 0 | 0 | 0 | 0 | 0 | 112.2 | A7 R8 A9 A15 | A7-A11 WeakPolarHBondContact O-CB 3.49Å; A7-A11 PolarHBondContact O-N 3.43Å; R8-A11 PolarHBondContact O-N 2.91Å; A9-A11 PolarHBondContact O-N 3.33Å; A11-A15 WeakPolarHBondContact O-CB 3.36Å; A11-A15 PolarHBondContact O-N 3.49Å; A11-A15 VanDerWaalsContact O-N 3.11Å |
| 12 | G | 71 | Confident | 71.5 | Confident | 33 Ų | 33 | 118.5 Ų | 118.5 | 34% | 0.34 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -67.1 | -39.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | R8 A9 F10 A15 N16 | R8-G12 PolarHBondContact O-N 3.07Å; A9-G12 PolarHBondContact O-N 3.49Å; A9-G12 VanDerWaalsContact O-N 3.17Å; F10-G12 VanDerWaalsContact C-N 3.35Å; G12-A15 PolarHBondContact O-N 3.45Å; G12-N16 PolarHBondContact O-N 2.97Å; G12-N16 VanDerWaalsContact O-N 3.09Å; G12-N16 PolarHBondContact O-ND2 3.31Å |
| 13 | E | 67 | Low | 71.2 | Confident | 137 Ų | 137 | 115.6 Ų | 115.6 | 64% | 0.64 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -70.9 | -40 | 179.4 | -147.6 | 169.6 | -176.4 | 0 | 0 | 111.5 | A9 F10 A15 N16 W17 | A9-E13 WeakPolarHBondContact O-CB 3.43Å; A9-E13 PolarHBondContact O-N 2.79Å; F10-E13 PolarHBondContact O-N 2.96Å; E13-A15 VanDerWaalsContact C-N 3.34Å; E13-A15 PolarHBondContact O-N 3.36Å; E13-N16 PolarHBondContact O-N 3.03Å; E13-W17 PolarHBondContact O-N 2.81Å |
| 14 | A | 69.1 | Low | 70.5 | Confident | 50 Ų | 50 | 112.4 Ų | 112.4 | 41% | 0.413 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -64.5 | -36.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | F10 S18 | F10-A14 VanDerWaalsContact O-CB 3.3Å; F10-A14 WeakPolarHBondContact O-CB 3.2Å; F10-A14 PolarHBondContact O-N 3.26Å; A14-S18 WeakPolarHBondContact O-CB 3.47Å; A14-S18 PolarHBondContact O-N 3.22Å |
| 15 | A | 71.6 | Confident | 69.9 | Low | 58 Ų | 58 | 104.5 Ų | 104.5 | 48% | 0.479 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66.6 | -41.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A11 G12 E13 S18 Q19 | A11-A15 WeakPolarHBondContact O-CB 3.36Å; A11-A15 PolarHBondContact O-N 3.49Å; A11-A15 VanDerWaalsContact O-N 3.11Å; G12-A15 PolarHBondContact O-N 3.45Å; E13-A15 VanDerWaalsContact C-N 3.34Å; E13-A15 PolarHBondContact O-N 3.36Å; A15-S18 PolarHBondContact O-N 3.38Å; A15-Q19 PolarHBondContact O-N 2.91Å; A15-Q19 VanDerWaalsContact O-N 3.08Å |
| 16 | N | 74.9 | Confident | 69.1 | Low | 108 Ų | 108 | 102 Ų | 102 | 58% | 0.578 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.1 | -43.6 | 175 | -80 | -81.5 | 0 | 0 | 0 | 111.5 | G12 E13 S18 Q19 E20 | G12-N16 PolarHBondContact O-N 2.97Å; G12-N16 VanDerWaalsContact O-N 3.09Å; G12-N16 PolarHBondContact O-ND2 3.31Å; E13-N16 PolarHBondContact O-N 3.03Å; N16-S18 VanDerWaalsContact C-N 3.34Å; N16-S18 PolarHBondContact O-N 3.49Å; N16-Q19 PolarHBondContact O-N 3.4Å; N16-E20 WeakPolarHBondContact O-CB 3.49Å; N16-E20 PolarHBondContact O-N 3.35Å |
| 17 | W | 69.1 | Low | 69 | Low | 182 Ų | 182 | 99.6 Ų | 99.6 | 69% | 0.689 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.2 | -42.5 | 176.4 | -161.8 | -24.8 | 0 | 0 | 0 | 111.4 | E13 Q19 E20 L21 | E13-W17 PolarHBondContact O-N 2.81Å; W17-Q19 PolarHBondContact O-N 3.18Å; W17-E20 PolarHBondContact O-N 3.43Å; W17-L21 VanDerWaalsContact CD1-CD1 3.49Å; W17-L21 WeakPolarHBondContact O-CB 3.45Å; W17-L21 PolarHBondContact O-N 3.28Å |
| 18 | S | 67.1 | Low | 68.2 | Low | 81 Ų | 81 | 104.5 Ų | 104.5 | 57% | 0.566 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.8 | -42.4 | 177.2 | -179.9 | 0 | 0 | 0 | 0 | 112.5 | A14 A15 N16 S22 | A14-S18 WeakPolarHBondContact O-CB 3.47Å; A14-S18 PolarHBondContact O-N 3.22Å; A15-S18 PolarHBondContact O-N 3.38Å; N16-S18 VanDerWaalsContact C-N 3.34Å; N16-S18 PolarHBondContact O-N 3.49Å; S18-S22 WeakPolarHBondContact O-CB 3.42Å; S18-S22 PolarHBondContact O-N 3Å |
| 19 | Q | 73.9 | Confident | 67.4 | Low | 146 Ų | 146 | 97.9 Ų | 97.9 | 68% | 0.682 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -67.3 | -38.7 | 178.3 | -168.1 | 175.1 | -9.2 | 0 | 0 | 111.7 | A15 N16 W17 S22 A23 | A15-Q19 PolarHBondContact O-N 2.91Å; A15-Q19 VanDerWaalsContact O-N 3.08Å; N16-Q19 PolarHBondContact O-N 3.4Å; W17-Q19 PolarHBondContact O-N 3.18Å; Q19-S22 PolarHBondContact O-N 3.39Å; Q19-A23 WeakPolarHBondContact O-CB 3.42Å; Q19-A23 PolarHBondContact O-N 3.39Å |
| 20 | E | 70.1 | Confident | 66.8 | Low | 145 Ų | 145 | 98.4 Ų | 98.4 | 68% | 0.678 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -69.5 | -40.3 | 177.9 | -148.9 | 167.8 | -160.2 | 0 | 0 | 111.7 | N16 W17 S22 A23 E24 | N16-E20 WeakPolarHBondContact O-CB 3.49Å; N16-E20 PolarHBondContact O-N 3.35Å; W17-E20 PolarHBondContact O-N 3.43Å; E20-S22 VanDerWaalsContact C-N 3.33Å; E20-S22 PolarHBondContact O-N 3.34Å; E20-A23 PolarHBondContact O-N 3.49Å; E20-E24 WeakPolarHBondContact O-CB 3.48Å; E20-E24 PolarHBondContact O-N 3.45Å |
| 21 | L | 60.4 | Low | 66.5 | Low | 102 Ų | 102 | 93.7 Ų | 93.7 | 53% | 0.534 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.8 | -37.8 | 171.6 | -93.7 | 165.9 | 0 | 0 | 0 | 112.3 | W17 A25 | W17-L21 VanDerWaalsContact CD1-CD1 3.49Å; W17-L21 WeakPolarHBondContact O-CB 3.45Å; W17-L21 PolarHBondContact O-N 3.28Å; L21-A25 WeakPolarHBondContact O-CB 3.48Å; L21-A25 PolarHBondContact O-N 2.94Å |
| 22 | S | 61 | Low | 65.7 | Low | 72 Ų | 72 | 96.2 Ų | 96.2 | 50% | 0.503 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -69.6 | -40.7 | 177.3 | -170.5 | 0 | 0 | 0 | 0 | 112 | S18 Q19 E20 T26 | S18-S22 WeakPolarHBondContact O-CB 3.42Å; S18-S22 PolarHBondContact O-N 3Å; Q19-S22 PolarHBondContact O-N 3.39Å; E20-S22 VanDerWaalsContact C-N 3.33Å; E20-S22 PolarHBondContact O-N 3.34Å; S22-T26 WeakPolarHBondContact O-CB 3.32Å; S22-T26 PolarHBondContact O-N 3.17Å; S22-T26 PolarHBondContact O-OG1 2.96Å |
| 23 | A | 70.8 | Confident | 65.2 | Low | 62 Ų | 62 | 99.4 Ų | 99.4 | 51% | 0.512 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.6 | -44.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q19 E20 T26 K27 | Q19-A23 WeakPolarHBondContact O-CB 3.42Å; Q19-A23 PolarHBondContact O-N 3.39Å; E20-A23 PolarHBondContact O-N 3.49Å; A23-T26 PolarHBondContact O-N 3.47Å; A23-K27 WeakPolarHBondContact O-CB 3.44Å; A23-K27 PolarHBondContact O-N 2.93Å |
| 24 | E | 60.4 | Low | 65 | Low | 81 Ų | 81 | 95.7 Ų | 95.7 | 38% | 0.379 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65 | -40.9 | 177.2 | -173.2 | 84.1 | 179.3 | 0 | 0 | 111.4 | E20 K27 R28 | E20-E24 WeakPolarHBondContact O-CB 3.48Å; E20-E24 PolarHBondContact O-N 3.45Å; E24-K27 PolarHBondContact O-N 3.49Å; E24-R28 WeakPolarHBondContact O-CB 3.43Å; E24-R28 WeakPolarHBondContact O-CG 3.39Å; E24-R28 PolarHBondContact O-N 3.17Å; E24-R28 IonicContact OE1-CZ 2.72Å; E24-R28 IonicContact OE1-NH1 3.76Å; E24-R28 PolarHBondContact OE1-NH1 3.46Å; E24-R28 IonicContact OE1-NH2 3.14Å; E24-R28 PolarHBondContact OE1-NH2 3.33Å |
| 25 | A | 64.1 | Low | 64.2 | Low | 58 Ų | 58 | 98.5 Ų | 98.5 | 48% | 0.479 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.9 | -39.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L21 K27 R28 S29 | L21-A25 WeakPolarHBondContact O-CB 3.48Å; L21-A25 PolarHBondContact O-N 2.94Å; A25-K27 VanDerWaalsContact C-N 3.34Å; A25-R28 PolarHBondContact O-N 3.43Å; A25-S29 VanDerWaalsContact O-CB 3.32Å; A25-S29 WeakPolarHBondContact O-CB 3.28Å; A25-S29 PolarHBondContact O-N 2.87Å; A25-S29 PolarHBondContact O-OG 3.44Å |
| 26 | T | 65.1 | Low | 63.3 | Low | 85 Ų | 85 | 99.5 Ų | 99.5 | 52% | 0.521 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.3 | -38.3 | 174.7 | -55.6 | 0 | 0 | 0 | 0 | 111.2 | S22 A23 S29 S30 | S22-T26 WeakPolarHBondContact O-CB 3.32Å; S22-T26 PolarHBondContact O-N 3.17Å; S22-T26 PolarHBondContact O-OG1 2.96Å; A23-T26 PolarHBondContact O-N 3.47Å; T26-S29 WeakPolarHBondContact CA-OG 3.13Å; T26-S29 PolarHBondContact O-OG 3.45Å; T26-S30 PolarHBondContact O-N 3.09Å |
| 27 | K | 70.5 | Confident | 62.4 | Low | 154 Ų | 154 | 97.4 Ų | 97.4 | 67% | 0.67 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.5 | -44.9 | 177.1 | -157.1 | 172.3 | -174.8 | -179 | 0 | 111.2 | A23 E24 A25 S30 A31 | A23-K27 WeakPolarHBondContact O-CB 3.44Å; A23-K27 PolarHBondContact O-N 2.93Å; E24-K27 PolarHBondContact O-N 3.49Å; A25-K27 VanDerWaalsContact C-N 3.34Å; K27-S30 PolarHBondContact O-N 3.42Å; K27-S30 PolarHBondContact O-OG 3.11Å; K27-S30 VanDerWaalsContact O-OG 3.05Å; K27-A31 PolarHBondContact O-N 3.04Å |
| 28 | R | 55.1 | Low | 61.9 | Low | 165 Ų | 165 | 96 Ų | 96 | 62% | 0.623 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.2 | -40.1 | 174.9 | -77.6 | -162.8 | 173.5 | 89.2 | 18.6 | 112.5 | E24 A25 A31 L32 | E24-R28 WeakPolarHBondContact O-CB 3.43Å; E24-R28 WeakPolarHBondContact O-CG 3.39Å; E24-R28 PolarHBondContact O-N 3.17Å; E24-R28 IonicContact OE1-CZ 2.72Å; E24-R28 IonicContact OE1-NH1 3.76Å; E24-R28 PolarHBondContact OE1-NH1 3.46Å; E24-R28 IonicContact OE1-NH2 3.14Å; E24-R28 PolarHBondContact OE1-NH2 3.33Å; A25-R28 PolarHBondContact O-N 3.43Å; R28-A31 PolarHBondContact O-N 3.46Å; R28-L32 WeakPolarHBondContact O-CB 3.42Å; R28-L32 PolarHBondContact O-N 3.08Å |
| 29 | S | 59.7 | Low | 61.5 | Low | 66 Ų | 66 | 97.9 Ų | 97.9 | 46% | 0.462 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.3 | -41.5 | 177.4 | 69.8 | 0 | 0 | 0 | 0 | 111.5 | A25 T26 A31 L32 V33 | A25-S29 VanDerWaalsContact O-CB 3.32Å; A25-S29 WeakPolarHBondContact O-CB 3.28Å; A25-S29 PolarHBondContact O-N 2.87Å; A25-S29 PolarHBondContact O-OG 3.44Å; T26-S29 WeakPolarHBondContact CA-OG 3.13Å; T26-S29 PolarHBondContact O-OG 3.45Å; S29-A31 PolarHBondContact O-N 2.88Å; S29-L32 PolarHBondContact O-N 3.43Å; S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.44Å; S29-V33 PolarHBondContact O-N 3.41Å |
| 30 | S | 64.9 | Low | 60.6 | Low | 71 Ų | 71 | 94 Ų | 94 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66 | -38.8 | 177 | 82.4 | 0 | 0 | 0 | 0 | 112.8 | T26 K27 V33 S34 | T26-S30 PolarHBondContact O-N 3.09Å; K27-S30 PolarHBondContact O-N 3.42Å; K27-S30 PolarHBondContact O-OG 3.11Å; K27-S30 VanDerWaalsContact O-OG 3.05Å; S30-V33 PolarHBondContact O-N 3.29Å; S30-S34 PolarHBondContact O-N 3.43Å |
| 31 | A | 61.3 | Low | 60.1 | Low | 51 Ų | 51 | 95.2 Ų | 95.2 | 42% | 0.421 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.2 | -43.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | K27 R28 S29 S34 E35 | K27-A31 PolarHBondContact O-N 3.04Å; R28-A31 PolarHBondContact O-N 3.46Å; S29-A31 PolarHBondContact O-N 2.88Å; A31-S34 PolarHBondContact O-N 2.94Å; A31-S34 PolarHBondContact O-OG 3.36Å; A31-E35 PolarHBondContact O-N 3.25Å |
| 32 | L | 52.5 | Low | 59.9 | Low | 113 Ų | 113 | 96.8 Ų | 96.8 | 59% | 0.592 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65.8 | -41.2 | 176.6 | -157.7 | 157.6 | 0 | 0 | 0 | 111.4 | R28 S29 S34 E35 T36 | R28-L32 WeakPolarHBondContact O-CB 3.42Å; R28-L32 PolarHBondContact O-N 3.08Å; S29-L32 PolarHBondContact O-N 3.43Å; L32-S34 VanDerWaalsContact C-N 3.3Å; L32-S34 PolarHBondContact O-N 3.42Å; L32-E35 PolarHBondContact O-N 2.93Å; L32-T36 WeakPolarHBondContact CD2-OG1 3.48Å; L32-T36 VanDerWaalsContact O-CB 3.31Å; L32-T36 WeakPolarHBondContact O-CB 3.47Å; L32-T36 PolarHBondContact O-N 2.95Å; L32-T36 PolarHBondContact O-OG1 3.35Å |
| 33 | V | 61.3 | Low | 59.4 | Low | 100 Ų | 100 | 98.3 Ų | 98.3 | 61% | 0.606 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.2 | -38.4 | 174.2 | 170.1 | 0 | 0 | 0 | 0 | 111.5 | S29 S30 A37 | S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.44Å; S29-V33 PolarHBondContact O-N 3.41Å; S30-V33 PolarHBondContact O-N 3.29Å; V33-A37 WeakPolarHBondContact O-CB 3.24Å; V33-A37 PolarHBondContact O-N 3Å |
| 34 | S | 61.4 | Low | 58.4 | Low | 59 Ų | 59 | 103.2 Ų | 103.2 | 41% | 0.413 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -73 | -35.4 | 178 | 74.4 | 0 | 0 | 0 | 0 | 113.6 | S30 A31 L32 K38 | S30-S34 PolarHBondContact O-N 3.43Å; A31-S34 PolarHBondContact O-N 2.94Å; A31-S34 PolarHBondContact O-OG 3.36Å; L32-S34 VanDerWaalsContact C-N 3.3Å; L32-S34 PolarHBondContact O-N 3.42Å; S34-K38 WeakPolarHBondContact O-CG 3.31Å; S34-K38 PolarHBondContact O-N 2.99Å |
| 35 | E | 53.8 | Low | 58.1 | Low | 110 Ų | 110 | 103 Ų | 103 | 51% | 0.514 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -68.1 | -43.5 | 172.1 | -93 | -98.2 | 120.5 | 0 | 0 | 111.1 | A31 L32 K38 K39 | A31-E35 PolarHBondContact O-N 3.25Å; L32-E35 PolarHBondContact O-N 2.93Å; E35-K38 PolarHBondContact O-N 3.31Å; E35-K39 WeakPolarHBondContact O-CB 3.16Å; E35-K39 PolarHBondContact O-N 2.99Å; E35-K39 IonicContact OE2-NZ 2.78Å |
| 36 | T | 52.6 | Low | 57.4 | Low | 79 Ų | 79 | 105.3 Ų | 105.3 | 49% | 0.485 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -69.3 | -36.5 | 178.1 | -62.2 | 0 | 0 | 0 | 0 | 112 | L32 K38 S40 | L32-T36 WeakPolarHBondContact CD2-OG1 3.48Å; L32-T36 VanDerWaalsContact O-CB 3.31Å; L32-T36 WeakPolarHBondContact O-CB 3.47Å; L32-T36 PolarHBondContact O-N 2.95Å; L32-T36 PolarHBondContact O-OG1 3.35Å; T36-K38 VanDerWaalsContact C-N 3.33Å; T36-K38 PolarHBondContact O-N 2.77Å; T36-S40 WeakPolarHBondContact O-CB 3.5Å; T36-S40 PolarHBondContact O-N 3.24Å |
| 37 | A | 55.3 | Low | 56.6 | Low | 63 Ų | 63 | 105.1 Ų | 105.1 | 52% | 0.521 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.5 | -35.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V33 K41 | V33-A37 WeakPolarHBondContact O-CB 3.24Å; V33-A37 PolarHBondContact O-N 3Å; A37-K41 PolarHBondContact O-N 2.87Å |
| 38 | K | 59.9 | Low | 55.8 | Low | 154 Ų | 154 | 100.9 Ų | 100.9 | 67% | 0.67 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -71.8 | -48.1 | 174.4 | -72.9 | 175.4 | -178.5 | 176.3 | 0 | 111.8 | S34 E35 T36 S40 K41 E42 | S34-K38 WeakPolarHBondContact O-CG 3.31Å; S34-K38 PolarHBondContact O-N 2.99Å; E35-K38 PolarHBondContact O-N 3.31Å; T36-K38 VanDerWaalsContact C-N 3.33Å; T36-K38 PolarHBondContact O-N 2.77Å; K38-S40 VanDerWaalsContact C-N 3.32Å; K38-S40 PolarHBondContact O-N 2.95Å; K38-K41 PolarHBondContact O-N 2.84Å; K38-E42 PolarHBondContact O-N 3.02Å |
| 39 | K | 57.8 | Low | 55.8 | Low | 119 Ų | 119 | 97.1 Ų | 97.1 | 52% | 0.517 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.9 | -36.3 | 177 | -81.9 | -177.8 | 172.1 | 151.2 | 0 | 112.9 | E35 K41 E42 I43 | E35-K39 WeakPolarHBondContact O-CB 3.16Å; E35-K39 PolarHBondContact O-N 2.99Å; E35-K39 IonicContact OE2-NZ 2.78Å; K39-K41 VanDerWaalsContact C-N 3.28Å; K39-K41 PolarHBondContact O-N 2.88Å; K39-E42 PolarHBondContact O-N 3.03Å; K39-I43 WeakPolarHBondContact O-CD1 3.43Å; K39-I43 VanDerWaalsContact O-CG1 3.24Å; K39-I43 WeakPolarHBondContact O-CG1 3.32Å; K39-I43 PolarHBondContact O-N 3.36Å |
| 40 | S | 55.9 | Low | 55.7 | Low | 65 Ų | 65 | 99.3 Ų | 99.3 | 46% | 0.455 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.8 | -37.1 | 175.8 | 169.7 | 0 | 0 | 0 | 0 | 112.3 | T36 K38 F44 | T36-S40 WeakPolarHBondContact O-CB 3.5Å; T36-S40 PolarHBondContact O-N 3.24Å; K38-S40 VanDerWaalsContact C-N 3.32Å; K38-S40 PolarHBondContact O-N 2.95Å; S40-F44 WeakPolarHBondContact O-CB 3.44Å; S40-F44 PolarHBondContact O-N 2.83Å |
| 41 | K | 58.5 | Low | 55.3 | Low | 171 Ų | 171 | 99.7 Ų | 99.7 | 74% | 0.743 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -70.4 | -32.9 | 179.8 | -166.3 | 174.7 | -180 | -177.7 | 0 | 112.4 | A37 K38 K39 S45 | A37-K41 PolarHBondContact O-N 2.87Å; K38-K41 PolarHBondContact O-N 2.84Å; K39-K41 VanDerWaalsContact C-N 3.28Å; K39-K41 PolarHBondContact O-N 2.88Å; K41-S45 PolarHBondContact O-OG 2.86Å |
| 42 | E | 55.7 | Low | 55 | Low | 134 Ų | 134 | 103.7 Ų | 103.7 | 63% | 0.626 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -76.8 | -39.1 | 179 | -165.8 | 165.7 | -171.1 | 0 | 0 | 112.2 | K38 K39 F44 S45 E46 | K38-E42 PolarHBondContact O-N 3.02Å; K39-E42 PolarHBondContact O-N 3.03Å; E42-F44 VanDerWaalsContact C-N 3.3Å; E42-F44 PolarHBondContact O-N 2.8Å; E42-S45 PolarHBondContact O-N 2.82Å; E42-S45 PolarHBondContact O-OG 3.06Å; E42-E46 PolarHBondContact O-N 3.05Å |
| 43 | I | 51.5 | Low | 55.1 | Low | 104 Ų | 104 | 104.9 Ų | 104.9 | 53% | 0.533 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -68.6 | -29.2 | 176.6 | -59.5 | 164.8 | 0 | 0 | 0 | 111.5 | K39 T47 | K39-I43 WeakPolarHBondContact O-CD1 3.43Å; K39-I43 VanDerWaalsContact O-CG1 3.24Å; K39-I43 WeakPolarHBondContact O-CG1 3.32Å; K39-I43 PolarHBondContact O-N 3.36Å; I43-T47 WeakPolarHBondContact O-CB 3.41Å; I43-T47 PolarHBondContact O-N 2.76Å; I43-T47 PolarHBondContact O-OG1 3.22Å |
| 44 | F | 48.8 | Very low | 54.6 | Low | 165 Ų | 165 | 105.7 Ų | 105.7 | 72% | 0.724 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -74 | -29.8 | -179.1 | -138.2 | -91.6 | 0 | 0 | 0 | 113.4 | S40 E42 | S40-F44 WeakPolarHBondContact O-CB 3.44Å; S40-F44 PolarHBondContact O-N 2.83Å; E42-F44 VanDerWaalsContact C-N 3.3Å; E42-F44 PolarHBondContact O-N 2.8Å |
| 45 | S | 54.3 | Low | 54.2 | Low | 78 Ų | 78 | 105.8 Ų | 105.8 | 55% | 0.545 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -76.8 | -35.1 | 172.7 | 38.1 | 0 | 0 | 0 | 0 | 112.6 | K41 E42 | K41-S45 PolarHBondContact O-OG 2.86Å; E42-S45 PolarHBondContact O-N 2.82Å; E42-S45 PolarHBondContact O-OG 3.06Å |
| 46 | E | 50.2 | Low | 54.3 | Low | 105 Ų | 105 | 103.3 Ų | 103.3 | 49% | 0.491 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -82.9 | -29.9 | -175.3 | -154.7 | -177.5 | 144.3 | 0 | 0 | 113.1 | E42 K50 | E42-E46 PolarHBondContact O-N 3.05Å; E46-K50 HydrophobicContact CG-CD 4.48Å; E46-K50 WeakPolarHBondContact O-CG 3.45Å; E46-K50 PolarHBondContact O-N 3.5Å; E46-K50 IonicContact OE1-NZ 3.12Å; E46-K50 PolarHBondContact OE1-NZ 3.27Å |
| 47 | T | 48.8 | Very low | 54.5 | Low | 82 Ų | 82 | 105.6 Ų | 105.6 | 50% | 0.503 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -76.7 | -27.9 | 178.2 | -51.3 | 0 | 0 | 0 | 0 | 112.6 | I43 S51 | I43-T47 WeakPolarHBondContact O-CB 3.41Å; I43-T47 PolarHBondContact O-N 2.76Å; I43-T47 PolarHBondContact O-OG1 3.22Å; T47-S51 WeakPolarHBondContact O-CB 3.43Å; T47-S51 PolarHBondContact O-N 2.93Å; T47-S51 VanDerWaalsContact O-N 3.13Å |
| 48 | A | 51.8 | Low | 54.4 | Low | 65 Ų | 65 | 105.3 Ų | 105.3 | 54% | 0.537 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -69 | -37.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 49 | S | 56.6 | Low | 54.3 | Low | 86 Ų | 86 | 102.2 Ų | 102.2 | 60% | 0.601 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -75.8 | -41.1 | 175.6 | -69.7 | 0 | 0 | 0 | 0 | 112.5 | S51 L52 E53 | S49-S51 VanDerWaalsContact C-N 3.32Å; S49-S51 PolarHBondContact O-N 3.49Å; S49-L52 PolarHBondContact O-N 3.37Å; S49-E53 PolarHBondContact O-N 2.65Å |
| 50 | K | 57 | Low | 54.6 | Low | 112 Ų | 112 | 104.4 Ų | 104.4 | 49% | 0.487 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -66.1 | -31.4 | 179.6 | -72 | 176.1 | 172.7 | 172.4 | 0 | 113.1 | E46 I54 | E46-K50 HydrophobicContact CG-CD 4.48Å; E46-K50 WeakPolarHBondContact O-CG 3.45Å; E46-K50 PolarHBondContact O-N 3.5Å; E46-K50 IonicContact OE1-NZ 3.12Å; E46-K50 PolarHBondContact OE1-NZ 3.27Å; K50-I54 WeakPolarHBondContact O-CD1 3.48Å; K50-I54 WeakPolarHBondContact O-CG1 3.3Å; K50-I54 PolarHBondContact O-N 3.32Å |
| 51 | S | 56.9 | Low | 54.7 | Low | 78 Ų | 78 | 107.7 Ų | 107.7 | 55% | 0.545 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -70.7 | -29.1 | 176.8 | 179.8 | 0 | 0 | 0 | 0 | 113.7 | T47 S49 | T47-S51 WeakPolarHBondContact O-CB 3.43Å; T47-S51 PolarHBondContact O-N 2.93Å; T47-S51 VanDerWaalsContact O-N 3.13Å; S49-S51 VanDerWaalsContact C-N 3.32Å; S49-S51 PolarHBondContact O-N 3.49Å |
| 52 | L | 53.6 | Low | 54.6 | Low | 136 Ų | 136 | 102.4 Ų | 102.4 | 71% | 0.712 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -79 | -31.6 | -177.3 | -165.6 | 143.8 | 0 | 0 | 0 | 111.6 | S49 A55 A56 | S49-L52 PolarHBondContact O-N 3.37Å; L52-A55 PolarHBondContact O-N 3.49Å; L52-A56 PolarHBondContact O-N 3.4Å |
| 53 | E | 55.7 | Low | 54.7 | Low | 137 Ų | 137 | 101.7 Ų | 101.7 | 64% | 0.64 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -72.7 | -38.5 | 178.2 | -164.3 | 166.4 | -173.1 | 0 | 0 | 112.4 | S49 A55 A56 E57 | S49-E53 PolarHBondContact O-N 2.65Å; E53-A55 VanDerWaalsContact C-N 3.28Å; E53-A55 PolarHBondContact O-N 3.01Å; E53-A56 PolarHBondContact O-N 2.97Å; E53-E57 PolarHBondContact O-N 3.38Å; E53-E57 VanDerWaalsContact O-N 3.11Å |
| 54 | I | 50.8 | Low | 55.1 | Low | 117 Ų | 117 | 102.4 Ų | 102.4 | 60% | 0.6 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.6 | -29.5 | 176.1 | -62.7 | 166.2 | 0 | 0 | 0 | 111.6 | K50 A58 | K50-I54 WeakPolarHBondContact O-CD1 3.48Å; K50-I54 WeakPolarHBondContact O-CG1 3.3Å; K50-I54 PolarHBondContact O-N 3.32Å; I54-A58 VanDerWaalsContact O-CB 3.32Å; I54-A58 WeakPolarHBondContact O-CB 3.35Å; I54-A58 PolarHBondContact O-N 2.97Å; I54-A58 VanDerWaalsContact O-N 3.14Å |
| 55 | A | 53.8 | Low | 55.4 | Low | 61 Ų | 61 | 99.4 Ų | 99.4 | 50% | 0.504 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -73.3 | -32.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | L52 E53 T59 | L52-A55 PolarHBondContact O-N 3.49Å; E53-A55 VanDerWaalsContact C-N 3.28Å; E53-A55 PolarHBondContact O-N 3.01Å; A55-T59 PolarHBondContact O-OG1 3.33Å |
| 56 | A | 55.6 | Low | 55.4 | Low | 59 Ų | 59 | 98.3 Ų | 98.3 | 49% | 0.488 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -77.3 | -33.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L52 E53 | L52-A56 PolarHBondContact O-N 3.4Å; E53-A56 PolarHBondContact O-N 2.97Å |
| 57 | E | 55.2 | Low | 55.9 | Low | 126 Ų | 126 | 95.5 Ų | 95.5 | 59% | 0.589 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -78.2 | -37.7 | 179.5 | -164.5 | 173.5 | -174.1 | 0 | 0 | 113.2 | E53 T59 K60 Q61 | E53-E57 PolarHBondContact O-N 3.38Å; E53-E57 VanDerWaalsContact O-N 3.11Å; E57-T59 PolarHBondContact O-N 2.84Å; E57-K60 PolarHBondContact O-N 3.32Å; E57-K60 VanDerWaalsContact O-N 3.16Å; E57-Q61 PolarHBondContact O-N 3.08Å |
| 58 | A | 54 | Low | 56.2 | Low | 58 Ų | 58 | 97.5 Ų | 97.5 | 48% | 0.479 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.1 | -31.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | I54 A62 | I54-A58 VanDerWaalsContact O-CB 3.32Å; I54-A58 WeakPolarHBondContact O-CB 3.35Å; I54-A58 PolarHBondContact O-N 2.97Å; I54-A58 VanDerWaalsContact O-N 3.14Å; A58-A62 PolarHBondContact O-N 2.76Å |
| 59 | T | 58.3 | Low | 56.4 | Low | 89 Ų | 89 | 100 Ų | 100 | 55% | 0.546 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -69.2 | -35.1 | 178.2 | -51.1 | 0 | 0 | 0 | 0 | 111.8 | A55 E57 A62 D63 | A55-T59 PolarHBondContact O-OG1 3.33Å; E57-T59 PolarHBondContact O-N 2.84Å; T59-A62 PolarHBondContact O-N 3.24Å; T59-D63 PolarHBondContact O-N 3.28Å |
| 60 | K | 63.4 | Low | 56.5 | Low | 165 Ų | 165 | 103.8 Ų | 103.8 | 72% | 0.717 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -71.7 | -36.5 | 178 | -69.7 | -178.1 | -179.2 | 173.7 | 0 | 112.9 | E57 L64 | E57-K60 PolarHBondContact O-N 3.32Å; E57-K60 VanDerWaalsContact O-N 3.16Å; K60-L64 PolarHBondContact O-N 3.13Å |
| 61 | Q | 57.5 | Low | 56.4 | Low | 134 Ų | 134 | 106.5 Ų | 106.5 | 63% | 0.626 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -69.9 | -32 | 176 | -81.5 | -166.5 | -4.7 | 0 | 0 | 112.8 | E57 L64 L65 | E57-Q61 PolarHBondContact O-N 3.08Å; Q61-L64 PolarHBondContact O-N 3.06Å; Q61-L65 PolarHBondContact O-N 3.3Å |
| 62 | A | 56.3 | Low | 56.2 | Low | 60 Ų | 60 | 109.9 Ų | 109.9 | 50% | 0.496 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65.6 | -40.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A58 T59 L65 A66 | A58-A62 PolarHBondContact O-N 2.76Å; T59-A62 PolarHBondContact O-N 3.24Å; A62-L65 PolarHBondContact O-N 3.44Å; A62-A66 PolarHBondContact O-N 2.89Å |
| 63 | D | 59.7 | Low | 56.1 | Low | 119 Ų | 119 | 106.9 Ų | 106.9 | 64% | 0.636 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -67.8 | -35.3 | 176.5 | -88.2 | -30.1 | 0 | 0 | 0 | 112.8 | T59 A66 G67 | T59-D63 PolarHBondContact O-N 3.28Å; D63-A66 PolarHBondContact O-N 3.25Å; D63-G67 PolarHBondContact O-N 3.2Å |
| 64 | L | 59.6 | Low | 56.1 | Low | 119 Ų | 119 | 105.3 Ų | 105.3 | 62% | 0.623 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -65.4 | -42 | 176.7 | -164.4 | 79.6 | 0 | 0 | 0 | 111.6 | K60 Q61 G67 Q68 | K60-L64 PolarHBondContact O-N 3.13Å; Q61-L64 PolarHBondContact O-N 3.06Å; L64-G67 PolarHBondContact O-N 3.41Å; L64-Q68 PolarHBondContact O-N 3.37Å; L64-Q68 VanDerWaalsContact O-N 3.16Å |
| 65 | L | 54.8 | Low | 56 | Low | 101 Ų | 101 | 107 Ų | 107 | 53% | 0.529 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -67.6 | -37.9 | 175.5 | -90.2 | 164.4 | 0 | 0 | 0 | 112.1 | Q61 A62 G67 Q68 I69 | Q61-L65 PolarHBondContact O-N 3.3Å; A62-L65 PolarHBondContact O-N 3.44Å; L65-G67 VanDerWaalsContact C-N 3.32Å; L65-G67 PolarHBondContact O-N 3.06Å; L65-Q68 PolarHBondContact O-N 3.49Å; L65-I69 WeakPolarHBondContact O-CD1 3.4Å; L65-I69 VanDerWaalsContact O-CG1 3.26Å; L65-I69 WeakPolarHBondContact O-CG1 3.45Å; L65-I69 PolarHBondContact O-N 3.11Å; L65-I69 VanDerWaalsContact O-N 3.1Å |
| 66 | A | 54.9 | Low | 55.8 | Low | 56 Ų | 56 | 110.6 Ų | 110.6 | 46% | 0.463 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -63.4 | -37 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | A62 D63 K70 | A62-A66 PolarHBondContact O-N 2.89Å; D63-A66 PolarHBondContact O-N 3.25Å; A66-K70 PolarHBondContact O-N 3.22Å |
| 67 | G | 59.5 | Low | 55.1 | Low | 45 Ų | 45 | 113.1 Ų | 113.1 | 46% | 0.464 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -66.7 | -39.8 | 175 | 0 | 0 | 0 | 0 | 0 | 113.7 | D63 L64 L65 K70 H71 | D63-G67 PolarHBondContact O-N 3.2Å; L64-G67 PolarHBondContact O-N 3.41Å; L65-G67 VanDerWaalsContact C-N 3.32Å; L65-G67 PolarHBondContact O-N 3.06Å; G67-K70 PolarHBondContact O-N 3.46Å; G67-H71 PolarHBondContact O-N 2.64Å |
| 68 | Q | 55.6 | Low | 54.7 | Low | 124 Ų | 124 | 114 Ų | 114 | 58% | 0.579 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -68.6 | -39.5 | 177.6 | -75.1 | -178.3 | -20.1 | 0 | 0 | 112.6 | L64 L65 K70 H71 L72 | L64-Q68 PolarHBondContact O-N 3.37Å; L64-Q68 VanDerWaalsContact O-N 3.16Å; L65-Q68 PolarHBondContact O-N 3.49Å; Q68-K70 VanDerWaalsContact C-N 3.26Å; Q68-K70 PolarHBondContact O-N 3.25Å; Q68-H71 PolarHBondContact O-N 2.77Å; Q68-L72 PolarHBondContact O-N 2.81Å |
| 69 | I | 55.8 | Low | 54.5 | Low | 117 Ų | 117 | 116.3 Ų | 116.3 | 60% | 0.6 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -64.2 | -34.3 | 177.6 | -64.6 | 163.3 | 0 | 0 | 0 | 110.9 | L65 H71 L72 A73 | L65-I69 WeakPolarHBondContact O-CD1 3.4Å; L65-I69 VanDerWaalsContact O-CG1 3.26Å; L65-I69 WeakPolarHBondContact O-CG1 3.45Å; L65-I69 PolarHBondContact O-N 3.11Å; L65-I69 VanDerWaalsContact O-N 3.1Å; I69-H71 VanDerWaalsContact C-N 3.33Å; I69-H71 PolarHBondContact O-N 3Å; I69-L72 PolarHBondContact O-N 2.99Å; I69-A73 PolarHBondContact O-N 3.33Å |
| 70 | K | 58.9 | Low | 53.7 | Low | 166 Ų | 166 | 117.7 Ų | 117.7 | 72% | 0.722 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -66.8 | -32.1 | 178.1 | -164.2 | 173.1 | -176.6 | -178.4 | 0 | 113.1 | A66 G67 Q68 | A66-K70 PolarHBondContact O-N 3.22Å; G67-K70 PolarHBondContact O-N 3.46Å; Q68-K70 VanDerWaalsContact C-N 3.26Å; Q68-K70 PolarHBondContact O-N 3.25Å |
| 71 | H | 55.1 | Low | 53.2 | Low | 169 Ų | 169 | 117.3 Ų | 117.3 | 78% | 0.782 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -81.6 | -18.1 | -178.3 | -146.6 | -73.9 | 0 | 0 | 0 | 113.4 | G67 Q68 I69 | G67-H71 PolarHBondContact O-N 2.64Å; Q68-H71 PolarHBondContact O-N 2.77Å; I69-H71 VanDerWaalsContact C-N 3.33Å; I69-H71 PolarHBondContact O-N 3Å |
| 72 | L | 53.6 | Low | 52.8 | Low | 149 Ų | 149 | 115.8 Ų | 115.8 | 78% | 0.78 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -92.2 | -14.2 | 178.5 | -158.1 | 62.8 | 0 | 0 | 0 | 113.1 | Q68 I69 | Q68-L72 PolarHBondContact O-N 2.81Å; I69-L72 PolarHBondContact O-N 2.99Å |
| 73 | A | 50.6 | Low | 52.5 | Low | 74 Ų | 74 | 118.8 Ų | 118.8 | 61% | 0.612 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -4.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | I69 | I69-A73 PolarHBondContact O-N 3.33Š|
| 74 | S | 54.7 | Low | 52.3 | Low | 104 Ų | 104 | 120.5 Ų | 120.5 | 73% | 0.727 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.9 | 0.9 | -173.3 | -60.2 | 0 | 0 | 0 | 0 | 115.7 | ||
| 75 | D | 48.7 | Very low | 51.7 | Low | 152 Ų | 152 | 120.2 Ų | 120.2 | 81% | 0.813 | 70% | 0.7 | S | S | * | * | trans | -123.2 | 30.9 | -171.4 | -128.7 | -31.7 | 0 | 0 | 0 | 114.3 | ||||
| 76 | I | 49.7 | Very low | 51.1 | Low | 137 Ų | 137 | 120.1 Ų | 120.1 | 70% | 0.703 | 71% | 0.713 | S | S | * | * | trans | -108.9 | 106.8 | 173.5 | -53.7 | 177.4 | 0 | 0 | 0 | 109.1 | V78 | I76-V78 PolarHBondContact O-N 3.02Š| ||
| 77 | P | 42.6 | Very low | 51.3 | Low | 111 Ų | 111 | 124.2 Ų | 124.2 | 72% | 0.721 | 73% | 0.726 | S | S | * | * | trans | -67 | 129.1 | -179.4 | 25.4 | -31.2 | 0 | 0 | 0 | 110.5 | P79 | P77-P79 WeakPolarHBondContact O-CD 3.38Š| ||
| 78 | V | 45.4 | Very low | 51.1 | Low | 144 Ų | 144 | 126.9 Ų | 126.9 | 87% | 0.873 | 74% | 0.735 | S | S | * | * | trans | -91.8 | 108.6 | -179.9 | 177.7 | 0 | 0 | 0 | 0 | 110 | I76 | I76-V78 PolarHBondContact O-N 3.02Š| ||
| 79 | P | 50.8 | Low | 50.7 | Low | 108 Ų | 108 | 126.8 Ų | 126.8 | 70% | 0.701 | 75% | 0.745 | S | S | * | * | trans | -96.8 | 119.5 | 159.7 | 32.8 | -30 | 0 | 0 | 0 | 110.9 | P77 | P77-P79 WeakPolarHBondContact O-CD 3.38Š| ||
| 80 | S | 40.8 | Very low | 50.6 | Low | 118 Ų | 118 | 128.8 Ų | 128.8 | 83% | 0.825 | 76% | 0.756 | S | S | * | * | trans | -18.8 | 121.1 | 163.3 | -164.7 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 81 | I | 52.9 | Low | 49.8 | Very low | 156 Ų | 156 | 124.8 Ų | 124.8 | 80% | 0.8 | 75% | 0.753 | S | S | * | * | trans | -117.7 | 127.3 | 170.7 | -57.3 | 176.7 | 0 | 0 | 0 | 109.5 | ||||
| 82 | P | 50.2 | Low | 48.9 | Very low | 103 Ų | 103 | 121.5 Ų | 121.5 | 67% | 0.669 | 76% | 0.756 | S | S | * | * | trans | -78 | 176.7 | -178.7 | 36.6 | -39.3 | 0 | 0 | 0 | 113 | ||||
| 83 | P | 48.7 | Very low | 48.2 | Very low | 123 Ų | 123 | 121 Ų | 121 | 80% | 0.799 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 143.4 | -155.3 | 32.2 | -32.5 | 0 | 0 | 0 | 113.1 | P85 | P83-P85 WeakPolarHBondContact O-CD 3.34Š|
| 84 | I | 55.7 | Low | 47.6 | Very low | 154 Ų | 154 | 121.3 Ų | 121.3 | 79% | 0.79 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 116.6 | -170 | -57.4 | 162.4 | 0 | 0 | 0 | 111.6 | ||
| 85 | P | 47.1 | Very low | 46.9 | Very low | 114 Ų | 114 | 122.2 Ų | 122.2 | 74% | 0.74 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 156.4 | 157.4 | 33.2 | -24.1 | 0 | 0 | 0 | 110.1 | P83 | P83-P85 WeakPolarHBondContact O-CD 3.34Š|
| 86 | A | 42.6 | Very low | 46.8 | Very low | 99 Ų | 99 | 120.1 Ų | 120.1 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -38.9 | 129.3 | -171.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | P88 | A86-P88 WeakPolarHBondContact O-CD 3.37Š| ||
| 87 | I | 57.6 | Low | 47.1 | Very low | 142 Ų | 142 | 121.7 Ų | 121.7 | 73% | 0.728 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 119.3 | 176.4 | -55.5 | 163.6 | 0 | 0 | 0 | 109.3 | ||
| 88 | P | 56.1 | Low | 48 | Very low | 100 Ų | 100 | 118 Ų | 118 | 65% | 0.649 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 148.7 | 162.1 | 31.5 | -31.4 | 0 | 0 | 0 | 109.4 | A86 I90 | A86-P88 WeakPolarHBondContact O-CD 3.37Å; P88-I90 PolarHBondContact O-N 3.36Å |
| 89 | P | 46.9 | Very low | 49.3 | Very low | 123 Ų | 123 | 116.4 Ų | 116.4 | 80% | 0.799 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 134.3 | -171.4 | 29 | -33.1 | 0 | 0 | 0 | 109.9 | A91 | P89-A91 PolarHBondContact O-N 3.49Š|
| 90 | I | 54.2 | Low | 50.6 | Low | 159 Ų | 159 | 114.1 Ų | 114.1 | 82% | 0.815 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 124.6 | 171.1 | -58.8 | 166 | 0 | 0 | 0 | 107.1 | P88 A92 | P88-I90 PolarHBondContact O-N 3.36Å; I90-A92 PolarHBondContact O-N 2.91Å |
| 91 | A | 41.1 | Very low | 52.5 | Low | 81 Ų | 81 | 110.7 Ų | 110.7 | 67% | 0.669 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 125.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | P89 T93 | P89-A91 PolarHBondContact O-N 3.49Å; A91-T93 PolarHBondContact O-N 3.14Å |
| 92 | A | 38.1 | Very low | 53.9 | Low | 101 Ų | 101 | 107.3 Ų | 107.3 | 84% | 0.835 | 68% | 0.681 | S | S | * | * | trans | -49.5 | 100.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | I90 A94 | I90-A92 PolarHBondContact O-N 2.91Å; A92-A94 PolarHBondContact O-N 3.16Å; A92-A94 VanDerWaalsContact O-N 3.14Å | ||
| 93 | T | 37.4 | Very low | 55.5 | Low | 137 Ų | 137 | 102.8 Ų | 102.8 | 84% | 0.84 | 65% | 0.652 | S | S | * | * | trans | -71.3 | 102.2 | 158.4 | 30.3 | 0 | 0 | 0 | 0 | 105.8 | A91 | A91-T93 PolarHBondContact O-N 3.14Š| ||
| 94 | A | 38.4 | Very low | 57.2 | Low | 81 Ų | 81 | 102.8 Ų | 102.8 | 67% | 0.669 | 64% | 0.641 | S | S | * | * | trans | 6.7 | 112.9 | 170.5 | 0 | 0 | 0 | 0 | 0 | 116 | A92 S96 | A92-A94 PolarHBondContact O-N 3.16Å; A92-A94 VanDerWaalsContact O-N 3.14Å; A94-S96 PolarHBondContact O-N 3.27Å | ||
| 95 | S | 39.5 | Very low | 58.5 | Low | 123 Ų | 123 | 104.2 Ų | 104.2 | 86% | 0.86 | 64% | 0.636 | S | S | * | * | trans | -51.4 | 85.8 | 148.3 | 48.8 | 0 | 0 | 0 | 0 | 109.2 | E97 | S95-E97 VanDerWaalsContact C-N 3.34Å; S95-E97 PolarHBondContact O-N 3.34Å | ||
| 96 | S | 46.4 | Very low | 60.3 | Low | 108 Ų | 108 | 101.2 Ų | 101.2 | 76% | 0.755 | 61% | 0.611 | S | S | * | * | trans | -71.7 | 98.5 | 169.6 | -169.6 | 0 | 0 | 0 | 0 | 106 | A94 | A94-S96 PolarHBondContact O-N 3.27Š| ||
| 97 | E | 56.4 | Low | 62.4 | Low | 171 Ų | 171 | 96.5 Ų | 96.5 | 80% | 0.799 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 139.9 | 157.8 | -102.8 | 175.3 | 128.6 | 0 | 0 | 108.2 | S95 D99 | S95-E97 VanDerWaalsContact C-N 3.34Å; S95-E97 PolarHBondContact O-N 3.34Å; E97-D99 PolarHBondContact O-N 3.5Å |
| 98 | P | 61.5 | Low | 63.8 | Low | 32 Ų | 32 | 89.9 Ų | 89.9 | 21% | 0.208 | 54% | 0.538 | C | S | . | . | P | Polyproline II helix | trans | -54.5 | 128.7 | 171.8 | 23.6 | -32.8 | 0 | 0 | 0 | 108.5 | A100 L103 L158 | P98-A100 PolarHBondContact O-N 2.84Å; P98-L103 HydrophobicContact CB-CD1 4Å; P98-L103 HydrophobicContact CB-CD2 3.84Å; P98-L103 HydrophobicContact CB-CG 3.93Å; P98-L103 HydrophobicContact CG-CD1 3.82Å; P98-L103 HydrophobicContact CG-CD2 3.96Å; P98-L103 HydrophobicContact CG-CG 4.2Å; P98-L158 HydrophobicContact CB-CD2 4.4Å |
| 99 | D | 74 | Confident | 65.4 | Low | 111 Ų | 111 | 86.6 Ų | 86.6 | 59% | 0.594 | 52% | 0.516 | S | S | * | . | P | Polyproline II helix | trans | -57.2 | 127.3 | -179 | -169.6 | 9 | 0 | 0 | 0 | 108.7 | E97 A101 E102 L103 | E97-D99 PolarHBondContact O-N 3.5Å; D99-A101 PolarHBondContact O-N 3.02Å; D99-E102 PolarHBondContact O-N 3.34Å; D99-L103 PolarHBondContact O-N 2.98Å |
| 100 | A | 77.4 | Confident | 67.3 | Low | 60 Ų | 60 | 87 Ų | 87 | 50% | 0.496 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -55.8 | -32 | -174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | P98 L103 E104 | P98-A100 PolarHBondContact O-N 2.84Å; A100-L103 WeakPolarHBondContact O-CB 3.45Å; A100-L103 PolarHBondContact O-N 3.44Å; A100-E104 WeakPolarHBondContact O-CG 3.25Å; A100-E104 PolarHBondContact O-N 3.08Å; A100-E104 VanDerWaalsContact O-N 3.07Å |
| 101 | A | 80.1 | Confident | 68.9 | Low | 46 Ų | 46 | 84.5 Ų | 84.5 | 38% | 0.38 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.3 | -36.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | D99 R105 | D99-A101 PolarHBondContact O-N 3.02Å; A101-R105 VanDerWaalsContact O-CG 3.27Å; A101-R105 WeakPolarHBondContact O-CG 3.42Å; A101-R105 PolarHBondContact O-N 3.44Å |
| 102 | E | 82.6 | Confident | 71.2 | Confident | 85 Ų | 85 | 80.7 Ų | 80.7 | 40% | 0.397 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -71.5 | -41.1 | 176.7 | -172.1 | 174.8 | -165.7 | 0 | 0 | 110.5 | D99 E104 R105 Y106 L158 | D99-E102 PolarHBondContact O-N 3.34Å; E102-E104 PolarHBondContact O-N 3.41Å; E102-R105 WeakPolarHBondContact O-CB 3.3Å; E102-R105 PolarHBondContact O-N 2.69Å; E102-Y106 HydrophobicContact CG-CD2 3.93Å; E102-Y106 HydrophobicContact CG-CE2 3.88Å; E102-Y106 WeakPolarHBondContact O-CD2 3.42Å; E102-Y106 PolarHBondContact O-N 2.96Å; E102-Y106 VanDerWaalsContact O-N 3.15Å; E102-L158 HydrophobicContact CG-CD1 4.13Å; E102-L158 HydrophobicContact CG-CD2 4.43Å |
| 103 | L | 84.6 | Confident | 73.6 | Confident | 9 Ų | 9 | 79 Ų | 79 | 5% | 0.047 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -57.1 | -47.9 | 176.6 | -67.2 | 166.8 | 0 | 0 | 0 | 111.8 | P98 D99 A100 R105 Y106 G107 I108 L158 A162 | P98-L103 HydrophobicContact CB-CD1 4Å; P98-L103 HydrophobicContact CB-CD2 3.84Å; P98-L103 HydrophobicContact CB-CG 3.93Å; P98-L103 HydrophobicContact CG-CD1 3.82Å; P98-L103 HydrophobicContact CG-CD2 3.96Å; P98-L103 HydrophobicContact CG-CG 4.2Å; D99-L103 PolarHBondContact O-N 2.98Å; A100-L103 WeakPolarHBondContact O-CB 3.45Å; A100-L103 PolarHBondContact O-N 3.44Å; L103-R105 VanDerWaalsContact C-N 3.35Å; L103-R105 PolarHBondContact O-N 2.81Å; L103-Y106 CarbonylContact O-C 3.54Å; L103-Y106 PolarHBondContact O-N 2.94Å; L103-G107 PolarHBondContact O-N 2.66Å; L103-G107 VanDerWaalsContact O-N 3.15Å; L103-I108 HydrophobicContact CB-CB 4.08Å; L103-I108 HydrophobicContact CD2-CB 4.07Å; L103-I108 HydrophobicContact CD2-CD1 3.68Å; L103-I108 HydrophobicContact CD2-CG1 4.5Å; L103-I108 HydrophobicContact CD2-CG2 4.05Å; L103-I108 WeakPolarHBondContact O-CA 3.32Å; L103-I108 WeakPolarHBondContact O-CB 3.47Å; L103-I108 PolarHBondContact O-N 3.48Å; L103-L158 HydrophobicContact CD2-CB 4.26Å; L103-A162 HydrophobicContact CD2-CB 3.86Å |
| 104 | E | 84.3 | Confident | 76.1 | Confident | 122 Ų | 122 | 78.4 Ų | 78.4 | 57% | 0.57 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -63.8 | -37.6 | 177.8 | -73.4 | -178.8 | -170.3 | 0 | 0 | 112.8 | A100 E102 Y106 G107 F198 | A100-E104 WeakPolarHBondContact O-CG 3.25Å; A100-E104 PolarHBondContact O-N 3.08Å; A100-E104 VanDerWaalsContact O-N 3.07Å; E102-E104 PolarHBondContact O-N 3.41Å; E104-Y106 VanDerWaalsContact C-N 3.29Å; E104-Y106 PolarHBondContact O-N 2.81Å; E104-G107 PolarHBondContact O-N 3.4Å; E104-F198 WeakPolarHBondContact O-CD1 3.29Å; E104-F198 WeakPolarHBondContact O-CE1 3.09Å |
| 105 | R | 83.4 | Confident | 78.5 | Confident | 184 Ų | 184 | 77.8 Ų | 77.8 | 69% | 0.694 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -61.2 | -38.6 | 176.8 | -75.6 | 175.2 | -173 | -158.4 | 3.1 | 112.3 | A101 E102 L103 G107 | A101-R105 VanDerWaalsContact O-CG 3.27Å; A101-R105 WeakPolarHBondContact O-CG 3.42Å; A101-R105 PolarHBondContact O-N 3.44Å; E102-R105 WeakPolarHBondContact O-CB 3.3Å; E102-R105 PolarHBondContact O-N 2.69Å; L103-R105 VanDerWaalsContact C-N 3.35Å; L103-R105 PolarHBondContact O-N 2.81Å; R105-G107 VanDerWaalsContact C-N 3.29Å |
| 106 | Y | 85 | Confident | 80.8 | Confident | 52 Ų | 52 | 72 Ų | 72 | 20% | 0.204 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.5 | 10 | 175.5 | -70.2 | -82.4 | 0 | 0 | 0 | 113.2 | E102 L103 E104 W151 R154 H155 L158 | E102-Y106 HydrophobicContact CG-CD2 3.93Å; E102-Y106 HydrophobicContact CG-CE2 3.88Å; E102-Y106 WeakPolarHBondContact O-CD2 3.42Å; E102-Y106 PolarHBondContact O-N 2.96Å; E102-Y106 VanDerWaalsContact O-N 3.15Å; L103-Y106 CarbonylContact O-C 3.54Å; L103-Y106 PolarHBondContact O-N 2.94Å; E104-Y106 VanDerWaalsContact C-N 3.29Å; E104-Y106 PolarHBondContact O-N 2.81Å; Y106-W151 HydrophobicContact CD1-CZ2 4.43Å; Y106-W151 AromaticContact CD1-NE1 3.71Å; Y106-W151 WeakPolarHBondContact O-CH2 3.26Å; Y106-W151 WeakPolarHBondContact O-CZ2 3.28Å; Y106-R154 HydrophobicContact CD1-CB 4.04Å; Y106-R154 HydrophobicContact CE1-CB 3.48Å; Y106-R154 VanDerWaalsContact CE1-CB 3.48Å; Y106-R154 HydrophobicContact CE1-CG 4.17Å; Y106-H155 PolarHBondContact O-CE1 3.25Å; Y106-H155 PolarHBondContact O-ND1 3.07Å; Y106-L158 HydrophobicContact CD2-CD1 3.24Å; Y106-L158 HydrophobicContact CE2-CD1 3.87Å; Y106-L158 HydrophobicContact CG-CD1 3.62Å |
| 107 | G | 85.6 | Confident | 82.7 | Confident | 0 Ų | 0 | 73.2 Ų | 73.2 | 0% | 0 | 36% | 0.361 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 77.6 | 19.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | L103 E104 R105 T109 L112 F198 | L103-G107 PolarHBondContact O-N 2.66Å; L103-G107 VanDerWaalsContact O-N 3.15Å; E104-G107 PolarHBondContact O-N 3.4Å; R105-G107 VanDerWaalsContact C-N 3.29Å; G107-T109 PolarHBondContact O-N 3.25Å; G107-T109 VanDerWaalsContact O-N 3.14Å; G107-L112 WeakPolarHBondContact O-CD2 2.82Å; G107-F198 VanDerWaalsContact CA-CD2 3.45Å |
| 108 | I | 87.4 | Confident | 84.2 | Confident | 3 Ų | 3 | 71.2 Ų | 71.2 | 2% | 0.015 | 36% | 0.356 | C | S | . | . | trans | -88.6 | 67.1 | 173.9 | -52.8 | 163.4 | 0 | 0 | 0 | 108.7 | L103 L112 R113 L158 V159 A162 | L103-I108 HydrophobicContact CB-CB 4.08Å; L103-I108 HydrophobicContact CD2-CB 4.07Å; L103-I108 HydrophobicContact CD2-CD1 3.68Å; L103-I108 HydrophobicContact CD2-CG1 4.5Å; L103-I108 HydrophobicContact CD2-CG2 4.05Å; L103-I108 WeakPolarHBondContact O-CA 3.32Å; L103-I108 WeakPolarHBondContact O-CB 3.47Å; L103-I108 PolarHBondContact O-N 3.48Å; I108-L112 HydrophobicContact CG1-CD2 4.34Å; I108-R113 HydrophobicContact CG2-CG 4.28Å; I108-L158 HydrophobicContact CD1-CB 3.25Å; I108-L158 HydrophobicContact CD1-CD1 4.28Å; I108-L158 HydrophobicContact CD1-CG 4.39Å; I108-V159 HydrophobicContact CD1-CG2 3.75Å; I108-V159 HydrophobicContact CG1-CG2 3.82Å; I108-A162 HydrophobicContact CG2-CB 4.05Å | ||
| 109 | T | 89.2 | Confident | 85.4 | Confident | 31 Ų | 31 | 70.4 Ų | 70.4 | 19% | 0.19 | 35% | 0.35 | C | S | . | . | trans | -77.1 | 165.5 | 175.4 | 58.9 | 0 | 0 | 0 | 0 | 111.3 | G107 D111 L112 R113 F198 | G107-T109 PolarHBondContact O-N 3.25Å; G107-T109 VanDerWaalsContact O-N 3.14Å; T109-D111 PolarHBondContact O-N 3.31Å; T109-L112 WeakPolarHBondContact O-CB 3.48Å; T109-L112 PolarHBondContact O-N 3.03Å; T109-L112 VanDerWaalsContact O-N 3.1Å; T109-L112 PolarHBondContact OG1-N 3.19Å; T109-R113 WeakPolarHBondContact O-CG 3.47Å; T109-R113 PolarHBondContact O-N 2.87Å; T109-R113 VanDerWaalsContact O-N 3.11Å; T109-F198 HydrophobicContact CG2-CE2 4.3Å; T109-F198 HydrophobicContact CG2-CZ 3.75Å | ||
| 110 | D | 87.2 | Confident | 86.1 | Confident | 132 Ų | 132 | 68.4 Ų | 68.4 | 71% | 0.706 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -58.9 | -36.4 | 173.8 | -72.8 | -33.4 | 0 | 0 | 0 | 112.3 | L112 R113 E114 | D110-L112 VanDerWaalsContact C-N 3.29Å; D110-L112 PolarHBondContact O-N 3.37Å; D110-R113 WeakPolarHBondContact O-CB 3.49Å; D110-R113 PolarHBondContact O-N 3.45Å; D110-R113 VanDerWaalsContact O-N 3.08Å; D110-E114 PolarHBondContact O-N 2.55Å |
| 111 | D | 88 | Confident | 86.6 | Confident | 105 Ų | 105 | 68.7 Ų | 68.7 | 56% | 0.561 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -57.9 | -41.9 | 173.9 | -64 | -23.9 | 0 | 0 | 0 | 112 | T109 R113 F115 Y194 | T109-D111 PolarHBondContact O-N 3.31Å; D111-R113 VanDerWaalsContact C-N 3.35Å; D111-F115 WeakPolarHBondContact O-CB 3.32Å; D111-F115 PolarHBondContact O-N 3.42Å; D111-Y194 HydrophobicContact CB-CD1 4.38Å; D111-Y194 HydrophobicContact CB-CE1 4.09Å |
| 112 | L | 89 | Confident | 86.9 | Confident | 1 Ų | 1 | 69 Ų | 69 | 1% | 0.005 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64.6 | -43.7 | 176.2 | 176.4 | 58.5 | 0 | 0 | 0 | 110.7 | G107 I108 T109 D110 E114 F115 V116 V191 | G107-L112 WeakPolarHBondContact O-CD2 2.82Å; I108-L112 HydrophobicContact CG1-CD2 4.34Å; T109-L112 WeakPolarHBondContact O-CB 3.48Å; T109-L112 PolarHBondContact O-N 3.03Å; T109-L112 VanDerWaalsContact O-N 3.1Å; T109-L112 PolarHBondContact OG1-N 3.19Å; D110-L112 VanDerWaalsContact C-N 3.29Å; D110-L112 PolarHBondContact O-N 3.37Å; L112-E114 VanDerWaalsContact C-N 3.34Å; L112-E114 PolarHBondContact O-N 3.32Å; L112-F115 PolarHBondContact O-N 3.17Å; L112-V116 HydrophobicContact CD1-CG2 3.68Å; L112-V116 HydrophobicContact CG-CG2 4.19Å; L112-V116 VanDerWaalsContact O-CB 3.26Å; L112-V116 WeakPolarHBondContact O-CB 3.29Å; L112-V116 WeakPolarHBondContact O-CG2 3.46Å; L112-V116 PolarHBondContact O-N 2.86Å; L112-V191 HydrophobicContact CD1-CB 4.2Å; L112-V191 HydrophobicContact CD1-CG1 3.14Å; L112-V191 HydrophobicContact CD1-CG2 3.94Å; L112-V191 HydrophobicContact CD2-CG1 4.14Å; L112-V191 HydrophobicContact CG-CG1 4.28Å |
| 113 | R | 88.2 | Confident | 87.1 | Confident | 66 Ų | 66 | 67.4 Ų | 67.4 | 25% | 0.249 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.9 | -42.3 | -179.3 | -66 | 169.3 | 170.8 | -95.5 | 5.7 | 111.1 | I108 T109 D110 D111 K117 A162 V163 | I108-R113 HydrophobicContact CG2-CG 4.28Å; T109-R113 WeakPolarHBondContact O-CG 3.47Å; T109-R113 PolarHBondContact O-N 2.87Å; T109-R113 VanDerWaalsContact O-N 3.11Å; D110-R113 WeakPolarHBondContact O-CB 3.49Å; D110-R113 PolarHBondContact O-N 3.45Å; D110-R113 VanDerWaalsContact O-N 3.08Å; D111-R113 VanDerWaalsContact C-N 3.35Å; R113-K117 WeakPolarHBondContact O-CB 3.38Å; R113-K117 PolarHBondContact O-N 3.45Å; R113-A162 PolarHBondContact NH1-O 2.92Å; R113-A162 VanDerWaalsContact NH2-CB 3.28Å; R113-V163 HydrophobicContact CG-CG2 4.01Å |
| 114 | E | 89.6 | Confident | 87.2 | Confident | 124 Ų | 124 | 67 Ų | 67 | 58% | 0.579 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -65.5 | -48.7 | 176.1 | -172.7 | 170.8 | -156.2 | 0 | 0 | 111.4 | D110 L112 V116 K117 D118 | D110-E114 PolarHBondContact O-N 2.55Å; L112-E114 VanDerWaalsContact C-N 3.34Å; L112-E114 PolarHBondContact O-N 3.32Å; E114-V116 VanDerWaalsContact C-N 3.29Å; E114-V116 PolarHBondContact O-N 3.03Å; E114-K117 WeakPolarHBondContact O-CB 3.4Å; E114-K117 PolarHBondContact O-N 2.85Å; E114-K117 VanDerWaalsContact O-N 3.11Å; E114-D118 PolarHBondContact O-N 3.44Å |
| 115 | F | 89.1 | Confident | 87.2 | Confident | 69 Ų | 69 | 69.2 Ų | 69.2 | 30% | 0.303 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -56.1 | -44.4 | 176.5 | 175.2 | -102 | 0 | 0 | 0 | 112.4 | D111 L112 D118 M119 L190 V191 Y194 | D111-F115 WeakPolarHBondContact O-CB 3.32Å; D111-F115 PolarHBondContact O-N 3.42Å; L112-F115 PolarHBondContact O-N 3.17Å; F115-D118 PolarHBondContact O-N 2.98Å; F115-M119 PolarHBondContact O-N 2.95Å; F115-L190 HydrophobicContact CE1-CB 4.42Å; F115-V191 HydrophobicContact CD1-CG2 4.37Å; F115-V191 HydrophobicContact CE1-CG2 4.14Å; F115-Y194 HydrophobicContact CB-CE2 4.24Å; F115-Y194 HydrophobicContact CD1-CD2 4.48Å; F115-Y194 HydrophobicContact CD1-CE2 4.08Å; F115-Y194 HydrophobicContact CD2-CE2 4.07Å; F115-Y194 HydrophobicContact CE1-CE2 4.48Å; F115-Y194 HydrophobicContact CE2-CE2 4.48Å; F115-Y194 AromaticContact CG-CE2 3.85Å; F115-Y194 HydrophobicContact CG-CE2 3.85Å |
| 116 | V | 87.5 | Confident | 87.2 | Confident | 0 Ų | 0 | 65.8 Ų | 65.8 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -72.1 | -31.9 | -179.7 | 170.7 | 0 | 0 | 0 | 0 | 112.1 | L112 E114 D118 M119 V163 I166 Y187 V191 | L112-V116 HydrophobicContact CD1-CG2 3.68Å; L112-V116 HydrophobicContact CG-CG2 4.19Å; L112-V116 VanDerWaalsContact O-CB 3.26Å; L112-V116 WeakPolarHBondContact O-CB 3.29Å; L112-V116 WeakPolarHBondContact O-CG2 3.46Å; L112-V116 PolarHBondContact O-N 2.86Å; E114-V116 VanDerWaalsContact C-N 3.29Å; E114-V116 PolarHBondContact O-N 3.03Å; V116-D118 VanDerWaalsContact C-N 3.33Å; V116-M119 HydrophobicContact CB-CE 4.49Å; V116-M119 HydrophobicContact CG1-CE 4.03Å; V116-M119 HydrophobicContact CG2-CE 4.41Å; V116-M119 VanDerWaalsContact O-CB 3.25Å; V116-M119 WeakPolarHBondContact O-CB 3.34Å; V116-M119 PolarHBondContact O-N 3.38Å; V116-V163 HydrophobicContact CB-CG1 4.3Å; V116-V163 HydrophobicContact CG1-CB 4.5Å; V116-V163 HydrophobicContact CG1-CG1 3.56Å; V116-I166 HydrophobicContact CG1-CD1 3.35Å; V116-I166 HydrophobicContact CG1-CG1 3.24Å; V116-Y187 HydrophobicContact CG2-CE2 4.24Å; V116-V191 HydrophobicContact CG2-CG2 4.25Å |
| 117 | K | 86.8 | Confident | 86.9 | Confident | 135 Ų | 135 | 65.6 Ų | 65.6 | 59% | 0.587 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -68.7 | -33.5 | 175.3 | -176.2 | -180 | 178.5 | -173.2 | 0 | 112.2 | R113 E114 M119 E165 | R113-K117 WeakPolarHBondContact O-CB 3.38Å; R113-K117 PolarHBondContact O-N 3.45Å; E114-K117 WeakPolarHBondContact O-CB 3.4Å; E114-K117 PolarHBondContact O-N 2.85Å; E114-K117 VanDerWaalsContact O-N 3.11Å; K117-M119 PolarHBondContact O-N 3.31Å; K117-E165 HydrophobicContact CG-CG 4.47Å |
| 118 | D | 88.4 | Confident | 86.4 | Confident | 128 Ų | 128 | 71.1 Ų | 71.1 | 68% | 0.684 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -75.6 | -13.3 | 174.1 | -80.5 | 2.8 | 0 | 0 | 0 | 113.1 | E114 F115 V116 | E114-D118 PolarHBondContact O-N 3.44Å; F115-D118 PolarHBondContact O-N 2.98Å; V116-D118 VanDerWaalsContact C-N 3.33Å |
| 119 | M | 86.6 | Confident | 85.4 | Confident | 16 Ų | 16 | 73 Ų | 73 | 8% | 0.079 | 37% | 0.372 | C | S | . | . | trans | -71.2 | 146.5 | 175.4 | -170.3 | 164.6 | 44.8 | 0 | 0 | 111.3 | F115 V116 K117 T123 F124 I166 F169 L190 | F115-M119 PolarHBondContact O-N 2.95Å; V116-M119 HydrophobicContact CB-CE 4.49Å; V116-M119 HydrophobicContact CG1-CE 4.03Å; V116-M119 HydrophobicContact CG2-CE 4.41Å; V116-M119 VanDerWaalsContact O-CB 3.25Å; V116-M119 WeakPolarHBondContact O-CB 3.34Å; V116-M119 PolarHBondContact O-N 3.38Å; K117-M119 PolarHBondContact O-N 3.31Å; M119-T123 HydrophobicContact CG-CG2 4.26Å; M119-T123 HydrophobicContact SD-CG2 4.45Å; M119-F124 HydrophobicContact CE-CE1 4.41Å; M119-F124 HydrophobicContact CE-CE2 3.44Å; M119-F124 VanDerWaalsContact CE-CE2 3.44Å; M119-F124 HydrophobicContact CE-CZ 3.25Å; M119-F124 HydrophobicContact CG-CD2 4.43Å; M119-F124 HydrophobicContact CG-CE2 3.78Å; M119-F124 HydrophobicContact CG-CZ 4.46Å; M119-F124 HydrophobicContact SD-CD2 4.19Å; M119-F124 HydrophobicContact SD-CE1 4.34Å; M119-F124 HydrophobicContact SD-CE2 3.32Å; M119-F124 WeakPolarHBondContact SD-CE2 3.48Å; M119-F124 HydrophobicContact SD-CZ 3.43Å; M119-F124 WeakPolarHBondContact SD-CZ 3.44Å; M119-I166 HydrophobicContact CE-CD1 3.51Å; M119-F169 HydrophobicContact CB-CE2 4.4Å; M119-F169 HydrophobicContact CE-CE2 4.27Å; M119-F169 HydrophobicContact CG-CE2 4.45Å; M119-F169 VanDerWaalsContact O-CZ 3.28Å; M119-F169 WeakPolarHBondContact O-CZ 3.39Å; M119-L190 HydrophobicContact SD-CD1 3.56Å; M119-L190 VanDerWaalsContact SD-CD1 3.56Å | ||
| 120 | T | 88.6 | Confident | 84 | Confident | 69 Ų | 69 | 80 Ų | 80 | 42% | 0.423 | 40% | 0.402 | S | S | . | . | trans | -115.5 | 158 | 178.1 | 59 | 0 | 0 | 0 | 0 | 110.8 | S122 T123 | T120-S122 PolarHBondContact O-N 3.1Å; T120-S122 PolarHBondContact OG1-OG 3.16Å; T120-T123 VanDerWaalsContact O-CB 3.3Å; T120-T123 WeakPolarHBondContact O-CB 3.26Å; T120-T123 PolarHBondContact O-N 3.47Å; T120-T123 PolarHBondContact O-OG1 3.39Å; T120-T123 PolarHBondContact OG1-OG1 2.91Å | ||
| 121 | I | 87.2 | Confident | 82.5 | Confident | 65 Ų | 65 | 79.5 Ų | 79.5 | 33% | 0.333 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -59.8 | -30.3 | 177.5 | -164.7 | 164.3 | 0 | 0 | 0 | 112.6 | T123 F124 R125 F169 E172 L173 | I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 3.42Å; I121-F124 PolarHBondContact O-N 3.3Å; I121-R125 PolarHBondContact O-N 3.14Å; I121-F169 HydrophobicContact CB-CD1 3.88Å; I121-F169 HydrophobicContact CB-CE1 4.03Å; I121-F169 HydrophobicContact CD1-CD1 4.46Å; I121-F169 HydrophobicContact CG1-CD1 4.16Å; I121-E172 HydrophobicContact CD1-CB 3.38Å; I121-E172 HydrophobicContact CD1-CG 4.06Å; I121-L173 HydrophobicContact CD1-CD2 4.09Å; I121-L173 HydrophobicContact CD1-CG 4.07Å; I121-L173 HydrophobicContact CG1-CD1 4.12Å; I121-L173 HydrophobicContact CG1-CD2 3.71Å; I121-L173 HydrophobicContact CG1-CG 3.86Å |
| 122 | S | 86.3 | Confident | 80.8 | Confident | 52 Ų | 52 | 78.6 Ų | 78.6 | 36% | 0.364 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.6 | -34.7 | 174.5 | 32.3 | 0 | 0 | 0 | 0 | 112.5 | T120 F124 R125 D126 | T120-S122 PolarHBondContact O-N 3.1Å; T120-S122 PolarHBondContact OG1-OG 3.16Å; S122-F124 PolarHBondContact O-N 3.23Å; S122-R125 PolarHBondContact O-N 3.34Å; S122-R125 VanDerWaalsContact O-N 3.09Å; S122-D126 WeakPolarHBondContact O-CB 3.37Å; S122-D126 PolarHBondContact O-N 3.49Å |
| 123 | T | 87.3 | Confident | 79.1 | Confident | 52 Ų | 52 | 83 Ų | 83 | 32% | 0.319 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -58 | -36.3 | 178.9 | -51.7 | 0 | 0 | 0 | 0 | 111.9 | M119 T120 I121 F127 L190 | M119-T123 HydrophobicContact CG-CG2 4.26Å; M119-T123 HydrophobicContact SD-CG2 4.45Å; T120-T123 VanDerWaalsContact O-CB 3.3Å; T120-T123 WeakPolarHBondContact O-CB 3.26Å; T120-T123 PolarHBondContact O-N 3.47Å; T120-T123 PolarHBondContact O-OG1 3.39Å; T120-T123 PolarHBondContact OG1-OG1 2.91Å; I121-T123 VanDerWaalsContact C-N 3.29Å; I121-T123 PolarHBondContact O-N 3.42Å; T123-F127 WeakPolarHBondContact O-CB 3.24Å; T123-F127 PolarHBondContact O-N 3.39Å; T123-L190 HydrophobicContact CG2-CD1 3.86Å; T123-L190 HydrophobicContact CG2-CD2 4.39Å |
| 124 | F | 87.2 | Confident | 77.2 | Confident | 1 Ų | 1 | 88.8 Ų | 88.8 | 0% | 0.004 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -78.8 | -35.5 | 177 | -65.9 | -92 | 0 | 0 | 0 | 113 | M119 I121 S122 I166 F169 L173 M178 F183 V186 | M119-F124 HydrophobicContact CE-CE1 4.41Å; M119-F124 HydrophobicContact CE-CE2 3.44Å; M119-F124 VanDerWaalsContact CE-CE2 3.44Å; M119-F124 HydrophobicContact CE-CZ 3.25Å; M119-F124 HydrophobicContact CG-CD2 4.43Å; M119-F124 HydrophobicContact CG-CE2 3.78Å; M119-F124 HydrophobicContact CG-CZ 4.46Å; M119-F124 HydrophobicContact SD-CD2 4.19Å; M119-F124 HydrophobicContact SD-CE1 4.34Å; M119-F124 HydrophobicContact SD-CE2 3.32Å; M119-F124 WeakPolarHBondContact SD-CE2 3.48Å; M119-F124 HydrophobicContact SD-CZ 3.43Å; M119-F124 WeakPolarHBondContact SD-CZ 3.44Å; I121-F124 PolarHBondContact O-N 3.3Å; S122-F124 PolarHBondContact O-N 3.23Å; F124-I166 HydrophobicContact CZ-CD1 4.07Å; F124-F169 HydrophobicContact CD2-CD2 4.16Å; F124-F169 HydrophobicContact CD2-CG 4.39Å; F124-F169 HydrophobicContact CE2-CB 4.31Å; F124-F169 AromaticContact CE2-CD2 3.35Å; F124-F169 HydrophobicContact CE2-CD2 3.35Å; F124-F169 AromaticContact CE2-CE2 3.86Å; F124-F169 HydrophobicContact CE2-CE2 3.86Å; F124-F169 AromaticContact CE2-CG 3.98Å; F124-F169 HydrophobicContact CE2-CG 3.98Å; F124-F169 AromaticContact CZ-CD2 4Å; F124-F169 HydrophobicContact CZ-CD2 4Å; F124-L173 HydrophobicContact CB-CD1 3.43Å; F124-L173 VanDerWaalsContact CB-CD1 3.43Å; F124-L173 HydrophobicContact CD1-CD1 4.42Å; F124-L173 HydrophobicContact CD2-CD1 4.13Å; F124-L173 HydrophobicContact CG-CD1 3.78Å; F124-M178 HydrophobicContact CB-CE 3.88Å; F124-M178 HydrophobicContact CB-SD 4.49Å; F124-M178 WeakPolarHBondContact O-CE 3.47Å; F124-F183 AromaticContact CD1-CD2 3.77Å; F124-F183 HydrophobicContact CD1-CD2 3.77Å; F124-F183 AromaticContact CD1-CE2 3.75Å; F124-F183 HydrophobicContact CD1-CE2 3.75Å; F124-F183 AromaticContact CE1-CD2 3.94Å; F124-F183 HydrophobicContact CE1-CD2 3.94Å; F124-F183 AromaticContact CE1-CE2 3.56Å; F124-F183 HydrophobicContact CE1-CE2 3.56Å; F124-F183 HydrophobicContact CE1-CZ 4.16Å; F124-F183 HydrophobicContact CE2-CE2 4.5Å; F124-F183 HydrophobicContact CG-CD2 4.43Å; F124-F183 HydrophobicContact CG-CE2 4.3Å; F124-F183 AromaticContact CZ-CE2 3.94Å; F124-F183 HydrophobicContact CZ-CE2 3.94Å; F124-F183 HydrophobicContact CZ-CZ 4.38Å; F124-V186 HydrophobicContact CD1-CB 4.23Å; F124-V186 HydrophobicContact CD1-CG1 3.83Å; F124-V186 HydrophobicContact CE1-CG1 4.4Å |
| 125 | R | 84 | Confident | 75.2 | Confident | 169 Ų | 169 | 88.9 Ų | 88.9 | 64% | 0.638 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -70.5 | -45.2 | -179.2 | -179.5 | -172.1 | 173.7 | -171.5 | -2.8 | 111.9 | I121 S122 F127 | I121-R125 PolarHBondContact O-N 3.14Å; S122-R125 PolarHBondContact O-N 3.34Å; S122-R125 VanDerWaalsContact O-N 3.09Å; R125-F127 VanDerWaalsContact C-N 3.28Å |
| 126 | D | 83.7 | Confident | 73.1 | Confident | 112 Ų | 112 | 90.2 Ų | 90.2 | 60% | 0.599 | 47% | 0.47 | S | S | * | . | S | Bend | trans | -88.5 | -0.5 | -173.5 | -58 | -29.5 | 0 | 0 | 0 | 111.8 | S122 P128 | S122-D126 WeakPolarHBondContact O-CB 3.37Å; S122-D126 PolarHBondContact O-N 3.49Å; D126-P128 WeakPolarHBondContact O-CD 3.35Å |
| 127 | F | 78.9 | Confident | 71.2 | Confident | 47 Ų | 47 | 98.1 Ų | 98.1 | 21% | 0.206 | 51% | 0.513 | C | S | . | . | trans | -63.7 | 121.8 | 179.3 | -155.4 | -88.8 | 0 | 0 | 0 | 109.6 | T123 R125 L129 V186 L189 L190 | T123-F127 WeakPolarHBondContact O-CB 3.24Å; T123-F127 PolarHBondContact O-N 3.39Å; R125-F127 VanDerWaalsContact C-N 3.28Å; F127-L129 HydrophobicContact CD1-CB 3.98Å; F127-L129 HydrophobicContact CD1-CD1 4.29Å; F127-L129 HydrophobicContact CE1-CD1 4.08Å; F127-L129 PolarHBondContact O-N 3.22Å; F127-V186 HydrophobicContact CB-CG1 3.87Å; F127-V186 HydrophobicContact CB-CG2 4Å; F127-V186 HydrophobicContact CD1-CG1 4.17Å; F127-V186 HydrophobicContact CD1-CG2 3.8Å; F127-V186 HydrophobicContact CD2-CG1 3.78Å; F127-V186 HydrophobicContact CE2-CG1 4.39Å; F127-V186 HydrophobicContact CG-CB 4.44Å; F127-V186 HydrophobicContact CG-CG1 3.65Å; F127-V186 HydrophobicContact CG-CG2 3.95Å; F127-L189 HydrophobicContact CE1-CD2 3.53Å; F127-L189 HydrophobicContact CZ-CD2 3.45Å; F127-L189 VanDerWaalsContact CZ-CD2 3.45Å; F127-L189 HydrophobicContact CZ-CG 4.17Å; F127-L190 HydrophobicContact CD2-CD2 4.39Å; F127-L190 HydrophobicContact CE2-CD2 3.83Å; F127-L190 HydrophobicContact CE2-CG 4.21Å | ||
| 128 | P | 73.9 | Confident | 69.3 | Low | 117 Ų | 117 | 96.3 Ų | 96.3 | 76% | 0.76 | 51% | 0.513 | S | S | * | . | trans | -77.1 | 56.1 | 179.6 | 34.1 | -36.2 | 0 | 0 | 0 | 110.2 | D126 Q130 | D126-P128 WeakPolarHBondContact O-CD 3.35Å; P128-Q130 PolarHBondContact O-N 2.93Å | ||
| 129 | L | 66.3 | Low | 67.2 | Low | 41 Ų | 41 | 94.9 Ų | 94.9 | 22% | 0.215 | 51% | 0.51 | C | S | . | . | trans | -77.9 | 112.3 | 165.4 | -152.5 | 76.6 | 0 | 0 | 0 | 105.7 | F127 D131 K182 R185 V186 L189 | F127-L129 HydrophobicContact CD1-CB 3.98Å; F127-L129 HydrophobicContact CD1-CD1 4.29Å; F127-L129 HydrophobicContact CE1-CD1 4.08Å; F127-L129 PolarHBondContact O-N 3.22Å; L129-D131 PolarHBondContact O-N 3.06Å; L129-K182 HydrophobicContact CD2-CG 3.95Å; L129-K182 PolarHBondContact O-NZ 2.72Å; L129-R185 HydrophobicContact CD2-CB 3.86Å; L129-V186 HydrophobicContact CB-CG2 4.23Å; L129-V186 HydrophobicContact CD2-CG2 4.15Å; L129-L189 HydrophobicContact CD1-CD2 4.4Å | ||
| 130 | Q | 59.9 | Low | 65.2 | Low | 179 Ų | 179 | 99.2 Ų | 99.2 | 84% | 0.836 | 54% | 0.538 | S | S | * | . | trans | -48.6 | 120.4 | 166.2 | -69.4 | -180 | -4 | 0 | 0 | 106.5 | P128 E132 | P128-Q130 PolarHBondContact O-N 2.93Å; Q130-E132 VanDerWaalsContact C-N 3.27Å; Q130-E132 PolarHBondContact O-N 3.38Å | ||
| 131 | D | 55.7 | Low | 63.1 | Low | 121 Ų | 121 | 103.1 Ų | 103.1 | 65% | 0.647 | 56% | 0.561 | S | S | * | * | trans | -57.9 | 106.5 | 165.3 | -78.5 | -41.8 | 0 | 0 | 0 | 104.6 | L129 K182 | L129-D131 PolarHBondContact O-N 3.06Å; D131-K182 VanDerWaalsContact CG-NZ 3.29Å; D131-K182 WeakPolarHBondContact OD1-CD 3.31Å; D131-K182 WeakPolarHBondContact OD1-CE 3.28Å; D131-K182 IonicContact OD1-NZ 3.22Å; D131-K182 PolarHBondContact OD1-NZ 2.87Å; D131-K182 IonicContact OD2-NZ 2.74Å; D131-K182 PolarHBondContact OD2-NZ 2.93Å | ||
| 132 | E | 53.5 | Low | 61.2 | Low | 87 Ų | 87 | 103.7 Ų | 103.7 | 41% | 0.407 | 57% | 0.571 | S | S | . | * | trans | -51.7 | 132.3 | 177.5 | -154.3 | -177.5 | -165.8 | 0 | 0 | 105.9 | Q130 E134 M135 R185 | Q130-E132 VanDerWaalsContact C-N 3.27Å; Q130-E132 PolarHBondContact O-N 3.38Å; E132-E134 PolarHBondContact O-N 3.49Å; E132-M135 HydrophobicContact CG-CE 3.89Å; E132-M135 WeakPolarHBondContact OE1-CE 3.36Å; E132-R185 IonicContact OE2-CZ 2.79Å; E132-R185 VanDerWaalsContact OE2-CZ 3.3Å; E132-R185 IonicContact OE2-NH1 2.65Å; E132-R185 PolarHBondContact OE2-NH1 3.06Å; E132-R185 IonicContact OE2-NH2 2.94Å; E132-R185 PolarHBondContact OE2-NH2 3.26Å | ||
| 133 | P | 52 | Low | 59.2 | Low | 92 Ų | 92 | 108.8 Ų | 108.8 | 60% | 0.597 | 59% | 0.594 | S | S | * | * | trans | -46.8 | 145.3 | 175.3 | 17.6 | -29.5 | 0 | 0 | 0 | 107.8 | M135 | P133-M135 HydrophobicContact CB-CG 4.29Å; P133-M135 HydrophobicContact CG-CG 3.73Å; P133-M135 HydrophobicContact CG-SD 4.48Å; P133-M135 WeakPolarHBondContact O-CG 3.45Å; P133-M135 PolarHBondContact O-N 3.42Å | ||
| 134 | E | 48.3 | Very low | 57.1 | Low | 189 Ų | 189 | 111.5 Ų | 111.5 | 88% | 0.883 | 61% | 0.61 | S | S | * | * | trans | -51.8 | 83.9 | 163.1 | -87 | 178.8 | 151.5 | 0 | 0 | 107.4 | E132 S136 | E132-E134 PolarHBondContact O-N 3.49Å; E134-S136 PolarHBondContact O-N 3.4Å | ||
| 135 | M | 48.2 | Very low | 55.2 | Low | 126 Ų | 126 | 120.7 Ų | 120.7 | 62% | 0.621 | 65% | 0.645 | S | S | * | * | trans | -78.8 | 94.3 | -175.7 | -79.7 | -140 | -87.8 | 0 | 0 | 103.7 | E132 P133 | E132-M135 HydrophobicContact CG-CE 3.89Å; E132-M135 WeakPolarHBondContact OE1-CE 3.36Å; P133-M135 HydrophobicContact CB-CG 4.29Å; P133-M135 HydrophobicContact CG-CG 3.73Å; P133-M135 HydrophobicContact CG-SD 4.48Å; P133-M135 WeakPolarHBondContact O-CG 3.45Å; P133-M135 PolarHBondContact O-N 3.42Å | ||
| 136 | S | 44.3 | Very low | 54 | Low | 96 Ų | 96 | 119.8 Ų | 119.8 | 67% | 0.671 | 65% | 0.648 | S | S | * | * | trans | 48.2 | 104.1 | 134.9 | -106.5 | 0 | 0 | 0 | 0 | 113.3 | E134 V138 | E134-S136 PolarHBondContact O-N 3.4Å; S136-V138 PolarHBondContact O-N 2.88Å | ||
| 137 | D | 47.3 | Very low | 53 | Low | 167 Ų | 167 | 117.2 Ų | 117.2 | 89% | 0.893 | 63% | 0.634 | S | S | * | * | trans | -51.9 | 60.9 | 157 | -153.9 | 10.7 | 0 | 0 | 0 | 111.6 | P139 | D137-P139 WeakPolarHBondContact O-CD 3.43Š| ||
| 138 | V | 48.1 | Very low | 52.8 | Low | 97 Ų | 97 | 117 Ų | 117 | 59% | 0.588 | 64% | 0.635 | S | S | * | * | trans | -99.2 | 106.5 | 168.6 | 177.7 | 0 | 0 | 0 | 0 | 105.6 | S136 T140 | S136-V138 PolarHBondContact O-N 2.88Å; V138-T140 VanDerWaalsContact C-N 3.28Å; V138-T140 PolarHBondContact O-N 2.93Å | ||
| 139 | P | 44.4 | Very low | 53.2 | Low | 98 Ų | 98 | 113.3 Ų | 113.3 | 64% | 0.636 | 61% | 0.612 | S | S | * | * | trans | -71.4 | 88.3 | -177.5 | 29.7 | -32.9 | 0 | 0 | 0 | 108.4 | D137 V141 | D137-P139 WeakPolarHBondContact O-CD 3.43Å; P139-V141 PolarHBondContact O-N 2.78Å | ||
| 140 | T | 43.6 | Very low | 54.1 | Low | 107 Ų | 107 | 118.2 Ų | 118.2 | 66% | 0.656 | 63% | 0.634 | S | S | * | * | trans | -82.8 | 78.4 | 172.3 | -50.4 | 0 | 0 | 0 | 0 | 107.8 | V138 S142 | V138-T140 VanDerWaalsContact C-N 3.28Å; V138-T140 PolarHBondContact O-N 2.93Å; T140-S142 PolarHBondContact O-N 2.69Å | ||
| 141 | V | 45.9 | Very low | 55.5 | Low | 150 Ų | 150 | 111 Ų | 111 | 91% | 0.909 | 60% | 0.599 | S | S | * | * | S | Bend | trans | 46.3 | 1.6 | 153.6 | -140.6 | 0 | 0 | 0 | 0 | 120 | P139 | P139-V141 PolarHBondContact O-N 2.78Š|
| 142 | S | 45.8 | Very low | 57.2 | Low | 77 Ų | 77 | 107.1 Ų | 107.1 | 54% | 0.538 | 58% | 0.577 | S | S | . | * | trans | -149.9 | 110.9 | 165.8 | 66.7 | 0 | 0 | 0 | 0 | 108.4 | T140 V144 | T140-S142 PolarHBondContact O-N 2.69Å; S142-V144 PolarHBondContact O-N 3.25Å | ||
| 143 | N | 46 | Very low | 58.8 | Low | 159 Ų | 159 | 105 Ų | 105 | 85% | 0.85 | 57% | 0.574 | S | S | * | * | trans | -67.8 | 23.8 | 179.4 | -99 | 18.5 | 0 | 0 | 0 | 114.5 | ||||
| 144 | V | 41.6 | Very low | 60.6 | Low | 109 Ų | 109 | 107.3 Ų | 107.3 | 66% | 0.661 | 57% | 0.571 | S | S | * | * | trans | -96.9 | 107.9 | 177.1 | -175.4 | 0 | 0 | 0 | 0 | 107.8 | S142 Q146 | S142-V144 PolarHBondContact O-N 3.25Å; V144-Q146 PolarHBondContact O-N 3.33Å | ||
| 145 | R | 48.2 | Very low | 62.6 | Low | 195 Ų | 195 | 98.3 Ų | 98.3 | 74% | 0.736 | 53% | 0.529 | S | S | * | . | trans | -63.7 | 83.9 | 173.4 | -67 | 175.4 | 124.2 | -167.8 | -1.1 | 109.6 | D147 R181 | R145-D147 PolarHBondContact O-N 3.03Å; R145-R181 VanDerWaalsContact CZ-NH2 3.31Å; R145-R181 VanDerWaalsContact NE-NH2 3.19Å | ||
| 146 | Q | 58.1 | Low | 64.7 | Low | 150 Ų | 150 | 92.6 Ų | 92.6 | 70% | 0.701 | 50% | 0.502 | S | S | * | . | trans | -85.1 | 59.4 | -176.6 | -160.3 | 174.5 | 14.1 | 0 | 0 | 110.7 | V144 L148 | V144-Q146 PolarHBondContact O-N 3.33Å; Q146-L148 PolarHBondContact O-N 2.78Å | ||
| 147 | D | 63.1 | Low | 66.9 | Low | 58 Ų | 58 | 92.6 Ų | 92.6 | 31% | 0.31 | 50% | 0.498 | S | S | . | . | trans | -70.2 | -16.2 | 178.1 | -72.4 | -69.5 | 0 | 0 | 0 | 112.6 | R145 R181 R185 | R145-D147 PolarHBondContact O-N 3.03Å; D147-R181 HydrophobicContact CB-CG 4.31Å; D147-R181 IonicContact OD1-CZ 3.13Å; D147-R181 IonicContact OD1-NE 2.93Å; D147-R181 PolarHBondContact OD1-NE 3.02Å; D147-R181 IonicContact OD1-NH2 2.64Å; D147-R181 IonicContact OD2-CZ 3.46Å; D147-R181 IonicContact OD2-NE 3.3Å; D147-R181 PolarHBondContact OD2-NE 3.29Å; D147-R181 IonicContact OD2-NH2 3.91Å; D147-R181 PolarHBondContact OD2-NH2 3.15Å; D147-R185 IonicContact OD1-NH2 3.57Å; D147-R185 PolarHBondContact OD1-NH2 2.86Å | ||
| 148 | L | 74.6 | Confident | 69 | Low | 42 Ų | 42 | 85.5 Ų | 85.5 | 22% | 0.22 | 46% | 0.46 | C | S | . | . | S | Bend | trans | -125.1 | 142.8 | 177.5 | -80.5 | 69.9 | 0 | 0 | 0 | 110.1 | Q146 Q152 A156 W184 F188 | Q146-L148 PolarHBondContact O-N 2.78Å; L148-Q152 HydrophobicContact CB-CB 4Å; L148-Q152 HydrophobicContact CD2-CB 4.31Å; L148-Q152 HydrophobicContact CG-CB 4.21Å; L148-A156 HydrophobicContact CD2-CB 4.4Å; L148-W184 HydrophobicContact CD1-CB 4.02Å; L148-W184 HydrophobicContact CD1-CG 4.4Å; L148-W184 HydrophobicContact CD2-CB 4.44Å; L148-W184 HydrophobicContact CD2-CG 4.26Å; L148-F188 HydrophobicContact CD2-CE2 3.66Å; L148-F188 HydrophobicContact CD2-CZ 4.25Å; L148-F188 HydrophobicContact CG-CE2 3.95Å |
| 149 | S | 82.7 | Confident | 71 | Confident | 39 Ų | 39 | 80.9 Ų | 80.9 | 27% | 0.273 | 43% | 0.432 | S | S | . | . | trans | -64.6 | 158.5 | 167.9 | 77.9 | 0 | 0 | 0 | 0 | 110.9 | W151 Q152 A153 E199 | S149-W151 PolarHBondContact O-N 3.44Å; S149-Q152 WeakPolarHBondContact O-CB 3.49Å; S149-Q152 PolarHBondContact O-N 3.27Å; S149-Q152 WeakPolarHBondContact OG-CB 3.31Å; S149-Q152 VanDerWaalsContact OG-CG 3.24Å; S149-Q152 WeakPolarHBondContact OG-CG 3.48Å; S149-Q152 PolarHBondContact OG-N 3.07Å; S149-A153 PolarHBondContact O-N 2.88Å; S149-E199 PolarHBondContact OG-OE1 2.94Å | ||
| 150 | E | 85.2 | Confident | 73.2 | Confident | 145 Ų | 145 | 78.2 Ų | 78.2 | 68% | 0.678 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -57.4 | -39.1 | 176.4 | -175.2 | -178.9 | 175.9 | 0 | 0 | 111.2 | A153 R154 | E150-A153 PolarHBondContact O-N 3.44Å; E150-R154 WeakPolarHBondContact O-CG 3.1Å; E150-R154 PolarHBondContact O-N 3.35Å |
| 151 | W | 89.2 | Confident | 75.3 | Confident | 27 Ų | 27 | 76.5 Ų | 76.5 | 10% | 0.102 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -61.2 | -46.3 | 174.4 | -174.9 | 92.9 | 0 | 0 | 0 | 111.6 | Y106 S149 A153 R154 H155 I195 F198 E199 S202 | Y106-W151 HydrophobicContact CD1-CZ2 4.43Å; Y106-W151 AromaticContact CD1-NE1 3.71Å; Y106-W151 WeakPolarHBondContact O-CH2 3.26Å; Y106-W151 WeakPolarHBondContact O-CZ2 3.28Å; S149-W151 PolarHBondContact O-N 3.44Å; W151-A153 VanDerWaalsContact C-N 3.32Å; W151-A153 PolarHBondContact O-N 3.05Å; W151-R154 PolarHBondContact O-N 2.95Å; W151-H155 HydrophobicContact CE3-CB 4.32Å; W151-H155 HydrophobicContact CH2-CB 3.99Å; W151-H155 AromaticContact CH2-CG 3.9Å; W151-H155 AromaticContact CH2-ND1 3.61Å; W151-H155 HydrophobicContact CZ3-CB 3.85Å; W151-H155 WeakPolarHBondContact O-CB 3.48Å; W151-H155 PolarHBondContact O-N 3.24Å; W151-I195 HydrophobicContact CE3-CG2 4.46Å; W151-I195 HydrophobicContact CH2-CB 4.25Å; W151-I195 HydrophobicContact CH2-CG1 4.22Å; W151-I195 HydrophobicContact CH2-CG2 3.31Å; W151-I195 HydrophobicContact CZ2-CG2 4.44Å; W151-I195 HydrophobicContact CZ3-CG2 3.3Å; W151-F198 HydrophobicContact CZ2-CB 4.09Å; W151-E199 HydrophobicContact CD2-CB 3.98Å; W151-E199 HydrophobicContact CD2-CG 3.92Å; W151-E199 HydrophobicContact CE3-CB 3.86Å; W151-E199 HydrophobicContact CE3-CG 3.77Å; W151-E199 HydrophobicContact CG-CG 4.36Å; W151-E199 HydrophobicContact CH2-CB 4.17Å; W151-E199 HydrophobicContact CZ2-CB 4.17Å; W151-E199 HydrophobicContact CZ3-CB 3.99Å; W151-E199 HydrophobicContact CZ3-CG 4.35Å; W151-S202 VanDerWaalsContact NE1-CB 3.32Å; W151-S202 PolarHBondContact NE1-OG 3.37Å |
| 152 | Q | 90.6 | Very high | 77.3 | Confident | 39 Ų | 39 | 70.1 Ų | 70.1 | 18% | 0.182 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 176.8 | -75.6 | 172.8 | -16.9 | 0 | 0 | 112 | L148 S149 H155 A156 F188 | L148-Q152 HydrophobicContact CB-CB 4Å; L148-Q152 HydrophobicContact CD2-CB 4.31Å; L148-Q152 HydrophobicContact CG-CB 4.21Å; S149-Q152 WeakPolarHBondContact O-CB 3.49Å; S149-Q152 PolarHBondContact O-N 3.27Å; S149-Q152 WeakPolarHBondContact OG-CB 3.31Å; S149-Q152 VanDerWaalsContact OG-CG 3.24Å; S149-Q152 WeakPolarHBondContact OG-CG 3.48Å; S149-Q152 PolarHBondContact OG-N 3.07Å; Q152-H155 PolarHBondContact O-N 3.46Å; Q152-A156 VanDerWaalsContact O-CB 3.28Å; Q152-A156 WeakPolarHBondContact O-CB 3.15Å; Q152-A156 PolarHBondContact O-N 3.43Å; Q152-F188 HydrophobicContact CB-CE1 4.05Å; Q152-F188 HydrophobicContact CB-CE2 4.06Å; Q152-F188 HydrophobicContact CB-CZ 3.63Å; Q152-F188 HydrophobicContact CG-CD1 4.25Å; Q152-F188 HydrophobicContact CG-CE1 3.85Å; Q152-F188 HydrophobicContact CG-CE2 4.35Å; Q152-F188 HydrophobicContact CG-CZ 3.92Å |
| 153 | A | 88.5 | Confident | 79.3 | Confident | 43 Ų | 43 | 66.7 Ų | 66.7 | 36% | 0.355 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.5 | -40.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | S149 E150 W151 T157 | S149-A153 PolarHBondContact O-N 2.88Å; E150-A153 PolarHBondContact O-N 3.44Å; W151-A153 VanDerWaalsContact C-N 3.32Å; W151-A153 PolarHBondContact O-N 3.05Å; A153-T157 PolarHBondContact O-N 2.84Å; A153-T157 VanDerWaalsContact O-N 3.14Å; A153-T157 PolarHBondContact O-OG1 3.13Å |
| 154 | R | 89.3 | Confident | 81.4 | Confident | 141 Ų | 141 | 67.5 Ų | 67.5 | 53% | 0.532 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -64.2 | -47.6 | 173.1 | -68 | -66.9 | 178.5 | -178.6 | -1.1 | 111.5 | Y106 E150 W151 A156 T157 L158 | Y106-R154 HydrophobicContact CD1-CB 4.04Å; Y106-R154 HydrophobicContact CE1-CB 3.48Å; Y106-R154 VanDerWaalsContact CE1-CB 3.48Å; Y106-R154 HydrophobicContact CE1-CG 4.17Å; E150-R154 WeakPolarHBondContact O-CG 3.1Å; E150-R154 PolarHBondContact O-N 3.35Å; W151-R154 PolarHBondContact O-N 2.95Å; R154-A156 PolarHBondContact O-N 3.42Å; R154-T157 PolarHBondContact O-N 3.46Å; R154-L158 WeakPolarHBondContact O-CG 3.47Å; R154-L158 PolarHBondContact O-N 2.87Å |
| 155 | H | 91 | Very high | 83.7 | Confident | 0 Ų | 0 | 65.4 Ų | 65.4 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -56.9 | -49.4 | 176.1 | -178.3 | 91.1 | 0 | 0 | 0 | 111.9 | Y106 W151 Q152 T157 L158 V159 Y187 F188 I195 | Y106-H155 PolarHBondContact O-CE1 3.25Å; Y106-H155 PolarHBondContact O-ND1 3.07Å; W151-H155 HydrophobicContact CE3-CB 4.32Å; W151-H155 HydrophobicContact CH2-CB 3.99Å; W151-H155 AromaticContact CH2-CG 3.9Å; W151-H155 AromaticContact CH2-ND1 3.61Å; W151-H155 HydrophobicContact CZ3-CB 3.85Å; W151-H155 WeakPolarHBondContact O-CB 3.48Å; W151-H155 PolarHBondContact O-N 3.24Å; Q152-H155 PolarHBondContact O-N 3.46Å; H155-T157 VanDerWaalsContact C-N 3.3Å; H155-T157 PolarHBondContact O-N 3.09Å; H155-L158 PolarHBondContact O-N 3.35Å; H155-V159 WeakPolarHBondContact NE2-CG2 3.28Å; H155-V159 WeakPolarHBondContact O-CB 3.46Å; H155-V159 VanDerWaalsContact O-CG2 3.28Å; H155-V159 WeakPolarHBondContact O-CG2 3.32Å; H155-V159 PolarHBondContact O-N 3Å; H155-Y187 AromaticContact NE2-CE1 3.9Å; H155-Y187 PolarHBondContact NE2-OH 3.06Å; H155-F188 AromaticContact CD2-CE1 3.76Å; H155-I195 WeakPolarHBondContact NE2-CD1 3.46Å |
| 156 | A | 91 | Very high | 85.8 | Confident | 6 Ų | 6 | 56.1 Ų | 56.1 | 5% | 0.05 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.4 | -42.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L148 Q152 R154 V159 L160 W184 F188 | L148-A156 HydrophobicContact CD2-CB 4.4Å; Q152-A156 VanDerWaalsContact O-CB 3.28Å; Q152-A156 WeakPolarHBondContact O-CB 3.15Å; Q152-A156 PolarHBondContact O-N 3.43Å; R154-A156 PolarHBondContact O-N 3.42Å; A156-V159 PolarHBondContact O-N 3.3Å; A156-L160 VanDerWaalsContact O-CG 3.31Å; A156-L160 WeakPolarHBondContact O-CG 3.47Å; A156-L160 PolarHBondContact O-N 2.83Å; A156-W184 HydrophobicContact CB-CD2 4.3Å; A156-W184 HydrophobicContact CB-CE3 3.95Å; A156-W184 HydrophobicContact CB-CH2 3.52Å; A156-W184 HydrophobicContact CB-CZ2 3.9Å; A156-W184 HydrophobicContact CB-CZ3 3.54Å; A156-F188 HydrophobicContact CB-CZ 4.39Å |
| 157 | T | 90.8 | Very high | 87.3 | Confident | 95 Ų | 95 | 50.4 Ų | 50.4 | 58% | 0.583 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -62.8 | -45.9 | 177.7 | -56.2 | 0 | 0 | 0 | 0 | 111.2 | A153 R154 H155 L160 S161 | A153-T157 PolarHBondContact O-N 2.84Å; A153-T157 VanDerWaalsContact O-N 3.14Å; A153-T157 PolarHBondContact O-OG1 3.13Å; R154-T157 PolarHBondContact O-N 3.46Å; H155-T157 VanDerWaalsContact C-N 3.3Å; H155-T157 PolarHBondContact O-N 3.09Å; T157-L160 PolarHBondContact O-N 2.83Å; T157-S161 PolarHBondContact O-N 3.44Å |
| 158 | L | 90.9 | Very high | 88.6 | Confident | 18 Ų | 18 | 54 Ų | 54 | 9% | 0.094 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -67.8 | -38.3 | 178.6 | -70 | 170.5 | 0 | 0 | 0 | 112 | P98 E102 L103 Y106 I108 R154 H155 L160 S161 A162 | P98-L158 HydrophobicContact CB-CD2 4.4Å; E102-L158 HydrophobicContact CG-CD1 4.13Å; E102-L158 HydrophobicContact CG-CD2 4.43Å; L103-L158 HydrophobicContact CD2-CB 4.26Å; Y106-L158 HydrophobicContact CD2-CD1 3.24Å; Y106-L158 HydrophobicContact CE2-CD1 3.87Å; Y106-L158 HydrophobicContact CG-CD1 3.62Å; I108-L158 HydrophobicContact CD1-CB 3.25Å; I108-L158 HydrophobicContact CD1-CD1 4.28Å; I108-L158 HydrophobicContact CD1-CG 4.39Å; R154-L158 WeakPolarHBondContact O-CG 3.47Å; R154-L158 PolarHBondContact O-N 2.87Å; H155-L158 PolarHBondContact O-N 3.35Å; L158-L160 VanDerWaalsContact C-N 3.34Å; L158-L160 PolarHBondContact O-N 2.95Å; L158-S161 PolarHBondContact O-N 3.39Å; L158-S161 PolarHBondContact O-OG 2.9Å; L158-A162 WeakPolarHBondContact O-CB 3.44Å; L158-A162 PolarHBondContact O-N 2.86Å |
| 159 | V | 90.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.1 | -39.1 | 176.9 | 169.4 | 0 | 0 | 0 | 0 | 111.6 | I108 H155 A156 S161 A162 V163 I166 Y187 | I108-V159 HydrophobicContact CD1-CG2 3.75Å; I108-V159 HydrophobicContact CG1-CG2 3.82Å; H155-V159 WeakPolarHBondContact NE2-CG2 3.28Å; H155-V159 WeakPolarHBondContact O-CB 3.46Å; H155-V159 VanDerWaalsContact O-CG2 3.28Å; H155-V159 WeakPolarHBondContact O-CG2 3.32Å; H155-V159 PolarHBondContact O-N 3Å; A156-V159 PolarHBondContact O-N 3.3Å; V159-S161 VanDerWaalsContact C-N 3.27Å; V159-S161 PolarHBondContact O-N 3.14Å; V159-A162 PolarHBondContact O-N 3.33Å; V159-V163 HydrophobicContact CG1-CB 4.45Å; V159-V163 HydrophobicContact CG1-CG2 4.48Å; V159-V163 PolarHBondContact O-N 3.31Å; V159-I166 HydrophobicContact CG1-CB 4.01Å; V159-I166 HydrophobicContact CG1-CG1 3.81Å; V159-I166 HydrophobicContact CG1-CG2 3.93Å; V159-Y187 HydrophobicContact CG1-CE2 4.25Å; V159-Y187 WeakPolarHBondContact CG2-OH 3.42Å |
| 160 | L | 89.8 | Confident | 89.7 | Confident | 43 Ų | 43 | 54.9 Ų | 54.9 | 23% | 0.225 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.6 | -30.6 | 178.5 | -74.5 | 169.3 | 0 | 0 | 0 | 113.2 | A156 T157 L158 I166 R170 W184 | A156-L160 VanDerWaalsContact O-CG 3.31Å; A156-L160 WeakPolarHBondContact O-CG 3.47Å; A156-L160 PolarHBondContact O-N 2.83Å; T157-L160 PolarHBondContact O-N 2.83Å; L158-L160 VanDerWaalsContact C-N 3.34Å; L158-L160 PolarHBondContact O-N 2.95Å; L160-I166 HydrophobicContact CD2-CG2 3.98Å; L160-R170 HydrophobicContact CD2-CB 4.45Å; L160-W184 HydrophobicContact CD1-CH2 4.2Å; L160-W184 HydrophobicContact CD1-CZ2 3.99Å; L160-W184 HydrophobicContact CD2-CH2 4.3Å; L160-W184 HydrophobicContact CD2-CZ2 4.44Å; L160-W184 HydrophobicContact CG-CH2 4.01Å; L160-W184 HydrophobicContact CG-CZ2 4.26Å |
| 161 | S | 88.6 | Confident | 89.9 | Confident | 71 Ų | 71 | 56.2 Ų | 56.2 | 50% | 0.497 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -86 | -35.9 | 175.4 | 65 | 0 | 0 | 0 | 0 | 112.3 | T157 L158 V159 | T157-S161 PolarHBondContact O-N 3.44Å; L158-S161 PolarHBondContact O-N 3.39Å; L158-S161 PolarHBondContact O-OG 2.9Å; V159-S161 VanDerWaalsContact C-N 3.27Å; V159-S161 PolarHBondContact O-N 3.14Å |
| 162 | A | 87.7 | Confident | 89.9 | Confident | 16 Ų | 16 | 59.7 Ų | 59.7 | 13% | 0.132 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -73.6 | -41.2 | -179 | 0 | 0 | 0 | 0 | 0 | 113.7 | L103 I108 R113 L158 V159 | L103-A162 HydrophobicContact CD2-CB 3.86Å; I108-A162 HydrophobicContact CG2-CB 4.05Å; R113-A162 PolarHBondContact NH1-O 2.92Å; R113-A162 VanDerWaalsContact NH2-CB 3.28Å; L158-A162 WeakPolarHBondContact O-CB 3.44Å; L158-A162 PolarHBondContact O-N 2.86Å; V159-A162 PolarHBondContact O-N 3.33Å |
| 163 | V | 87.6 | Confident | 89.7 | Confident | 5 Ų | 5 | 58 Ų | 58 | 3% | 0.03 | 28% | 0.281 | C | S | . | . | trans | -122.5 | 105.1 | -168.5 | -169.4 | 0 | 0 | 0 | 0 | 109.9 | R113 V116 V159 E165 I166 S167 | R113-V163 HydrophobicContact CG-CG2 4.01Å; V116-V163 HydrophobicContact CB-CG1 4.3Å; V116-V163 HydrophobicContact CG1-CB 4.5Å; V116-V163 HydrophobicContact CG1-CG1 3.56Å; V159-V163 HydrophobicContact CG1-CB 4.45Å; V159-V163 HydrophobicContact CG1-CG2 4.48Å; V159-V163 PolarHBondContact O-N 3.31Å; V163-E165 HydrophobicContact CG1-CB 4.18Å; V163-E165 VanDerWaalsContact CG1-OE2 3.24Å; V163-E165 WeakPolarHBondContact CG1-OE2 3.22Å; V163-E165 PolarHBondContact O-N 3.4Å; V163-I166 HydrophobicContact CB-CG1 4.42Å; V163-I166 HydrophobicContact CG1-CG1 4.27Å; V163-I166 PolarHBondContact O-N 2.97Å; V163-S167 PolarHBondContact O-N 3.32Å | ||
| 164 | K | 90.1 | Very high | 89.5 | Confident | 175 Ų | 175 | 57 Ų | 57 | 76% | 0.761 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -65.5 | -27.1 | -175.3 | -68.2 | 176.6 | 179.6 | 167.8 | 0 | 112.1 | S167 K168 | K164-S167 WeakPolarHBondContact O-CB 3.39Å; K164-S167 PolarHBondContact O-N 3.02Å; K164-K168 WeakPolarHBondContact O-CB 3.43Å; K164-K168 PolarHBondContact O-N 2.82Å |
| 165 | E | 90.6 | Very high | 88.9 | Confident | 65 Ų | 65 | 56.4 Ų | 56.4 | 30% | 0.304 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -65.2 | -46.4 | 179.9 | -65.7 | 75.8 | -170.2 | 0 | 0 | 111.3 | K117 V163 S167 K168 F169 | K117-E165 HydrophobicContact CG-CG 4.47Å; V163-E165 HydrophobicContact CG1-CB 4.18Å; V163-E165 VanDerWaalsContact CG1-OE2 3.24Å; V163-E165 WeakPolarHBondContact CG1-OE2 3.22Å; V163-E165 PolarHBondContact O-N 3.4Å; E165-S167 VanDerWaalsContact C-N 3.34Å; E165-S167 PolarHBondContact O-N 2.75Å; E165-K168 WeakPolarHBondContact O-CB 3.34Å; E165-K168 PolarHBondContact O-N 3.47Å; E165-F169 HydrophobicContact CB-CE2 4.15Å; E165-F169 HydrophobicContact CB-CZ 4.26Å; E165-F169 VanDerWaalsContact O-CD2 3.24Å; E165-F169 WeakPolarHBondContact O-CD2 3.35Å; E165-F169 WeakPolarHBondContact O-CG 3.3Å; E165-F169 PolarHBondContact O-N 3.15Å |
| 166 | I | 91.1 | Very high | 88.5 | Confident | 0 Ų | 0 | 66.4 Ų | 66.4 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 175.2 | -66.2 | -60.6 | 0 | 0 | 0 | 110.9 | V116 M119 F124 V159 L160 V163 K168 F169 R170 F183 W184 Y187 | V116-I166 HydrophobicContact CG1-CD1 3.35Å; V116-I166 HydrophobicContact CG1-CG1 3.24Å; M119-I166 HydrophobicContact CE-CD1 3.51Å; F124-I166 HydrophobicContact CZ-CD1 4.07Å; V159-I166 HydrophobicContact CG1-CB 4.01Å; V159-I166 HydrophobicContact CG1-CG1 3.81Å; V159-I166 HydrophobicContact CG1-CG2 3.93Å; L160-I166 HydrophobicContact CD2-CG2 3.98Å; V163-I166 HydrophobicContact CB-CG1 4.42Å; V163-I166 HydrophobicContact CG1-CG1 4.27Å; V163-I166 PolarHBondContact O-N 2.97Å; I166-K168 VanDerWaalsContact C-N 3.29Å; I166-K168 PolarHBondContact O-N 2.94Å; I166-F169 HydrophobicContact CD1-CD2 4.06Å; I166-F169 HydrophobicContact CD1-CE2 4.49Å; I166-F169 PolarHBondContact O-N 3.3Å; I166-R170 WeakPolarHBondContact O-CB 3.18Å; I166-R170 PolarHBondContact O-N 3.26Å; I166-F183 HydrophobicContact CG2-CE1 4.34Å; I166-F183 HydrophobicContact CG2-CZ 4.09Å; I166-W184 HydrophobicContact CG2-CH2 4.38Å; I166-Y187 HydrophobicContact CD1-CD2 3.7Å; I166-Y187 HydrophobicContact CD1-CE2 3.66Å; I166-Y187 HydrophobicContact CG1-CD2 4.49Å; I166-Y187 HydrophobicContact CG1-CE2 4.05Å |
| 167 | S | 90.1 | Very high | 88.1 | Confident | 30 Ų | 30 | 72.2 Ų | 72.2 | 21% | 0.21 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -56.5 | -46 | 175.6 | -168 | 0 | 0 | 0 | 0 | 110.7 | V163 K164 E165 R170 Y171 | V163-S167 PolarHBondContact O-N 3.32Å; K164-S167 WeakPolarHBondContact O-CB 3.39Å; K164-S167 PolarHBondContact O-N 3.02Å; E165-S167 VanDerWaalsContact C-N 3.34Å; E165-S167 PolarHBondContact O-N 2.75Å; S167-R170 WeakPolarHBondContact O-CB 3.41Å; S167-R170 PolarHBondContact O-N 3.15Å; S167-Y171 WeakPolarHBondContact O-CD2 3.18Å; S167-Y171 PolarHBondContact O-N 3.5Å |
| 168 | K | 91.3 | Very high | 87.8 | Confident | 134 Ų | 134 | 68.4 Ų | 68.4 | 58% | 0.583 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -61.6 | -46.5 | 175.3 | -173.2 | -179.6 | 180 | -178 | 0 | 112.7 | K164 E165 I166 R170 Y171 E172 | K164-K168 WeakPolarHBondContact O-CB 3.43Å; K164-K168 PolarHBondContact O-N 2.82Å; E165-K168 WeakPolarHBondContact O-CB 3.34Å; E165-K168 PolarHBondContact O-N 3.47Å; I166-K168 VanDerWaalsContact C-N 3.29Å; I166-K168 PolarHBondContact O-N 2.94Å; K168-R170 VanDerWaalsContact C-N 3.26Å; K168-R170 PolarHBondContact O-N 2.99Å; K168-Y171 PolarHBondContact O-N 3.18Å; K168-E172 HydrophobicContact CG-CG 4.43Å; K168-E172 WeakPolarHBondContact O-CG 3.31Å; K168-E172 PolarHBondContact O-N 3.3Å |
| 169 | F | 90.8 | Very high | 87.6 | Confident | 18 Ų | 18 | 74.9 Ų | 74.9 | 8% | 0.079 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -60.2 | -39.4 | 177.9 | -59.4 | -32.5 | 0 | 0 | 0 | 111.6 | M119 I121 F124 E165 I166 E172 L173 F183 | M119-F169 HydrophobicContact CB-CE2 4.4Å; M119-F169 HydrophobicContact CE-CE2 4.27Å; M119-F169 HydrophobicContact CG-CE2 4.45Å; M119-F169 VanDerWaalsContact O-CZ 3.28Å; M119-F169 WeakPolarHBondContact O-CZ 3.39Å; I121-F169 HydrophobicContact CB-CD1 3.88Å; I121-F169 HydrophobicContact CB-CE1 4.03Å; I121-F169 HydrophobicContact CD1-CD1 4.46Å; I121-F169 HydrophobicContact CG1-CD1 4.16Å; F124-F169 HydrophobicContact CD2-CD2 4.16Å; F124-F169 HydrophobicContact CD2-CG 4.39Å; F124-F169 HydrophobicContact CE2-CB 4.31Å; F124-F169 AromaticContact CE2-CD2 3.35Å; F124-F169 HydrophobicContact CE2-CD2 3.35Å; F124-F169 AromaticContact CE2-CE2 3.86Å; F124-F169 HydrophobicContact CE2-CE2 3.86Å; F124-F169 AromaticContact CE2-CG 3.98Å; F124-F169 HydrophobicContact CE2-CG 3.98Å; F124-F169 AromaticContact CZ-CD2 4Å; F124-F169 HydrophobicContact CZ-CD2 4Å; E165-F169 HydrophobicContact CB-CE2 4.15Å; E165-F169 HydrophobicContact CB-CZ 4.26Å; E165-F169 VanDerWaalsContact O-CD2 3.24Å; E165-F169 WeakPolarHBondContact O-CD2 3.35Å; E165-F169 WeakPolarHBondContact O-CG 3.3Å; E165-F169 PolarHBondContact O-N 3.15Å; I166-F169 HydrophobicContact CD1-CD2 4.06Å; I166-F169 HydrophobicContact CD1-CE2 4.49Å; I166-F169 PolarHBondContact O-N 3.3Å; F169-E172 PolarHBondContact O-N 2.74Å; F169-L173 HydrophobicContact CB-CD1 4.11Å; F169-L173 WeakPolarHBondContact O-CB 3.34Å; F169-L173 VanDerWaalsContact O-CG 3.23Å; F169-L173 WeakPolarHBondContact O-CG 3.38Å; F169-L173 PolarHBondContact O-N 3.26Å; F169-F183 HydrophobicContact CB-CE2 3.89Å; F169-F183 HydrophobicContact CB-CZ 4.24Å |
| 170 | R | 89.1 | Confident | 87.5 | Confident | 82 Ų | 82 | 77.5 Ų | 77.5 | 31% | 0.309 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -59.5 | -48.5 | 176.1 | -174 | -178.6 | 178.8 | -114.4 | -10.5 | 111.9 | L160 I166 S167 K168 E172 C174 E180 F183 | L160-R170 HydrophobicContact CD2-CB 4.45Å; I166-R170 WeakPolarHBondContact O-CB 3.18Å; I166-R170 PolarHBondContact O-N 3.26Å; S167-R170 WeakPolarHBondContact O-CB 3.41Å; S167-R170 PolarHBondContact O-N 3.15Å; K168-R170 VanDerWaalsContact C-N 3.26Å; K168-R170 PolarHBondContact O-N 2.99Å; R170-E172 VanDerWaalsContact C-N 3.33Å; R170-E172 PolarHBondContact O-N 3.33Å; R170-C174 VanDerWaalsContact O-CB 3.29Å; R170-C174 WeakPolarHBondContact O-CB 3.45Å; R170-C174 PolarHBondContact O-N 3.45Å; R170-E180 IonicContact CZ-OE1 3.99Å; R170-E180 IonicContact CZ-OE2 3.28Å; R170-E180 VanDerWaalsContact CZ-OE2 3.28Å; R170-E180 VanDerWaalsContact NE-CD 3.28Å; R170-E180 IonicContact NE-OE1 2.99Å; R170-E180 PolarHBondContact NE-OE1 2.97Å; R170-E180 IonicContact NE-OE2 2.85Å; R170-E180 PolarHBondContact NE-OE2 3.23Å; R170-E180 IonicContact NH2-OE2 2.86Å; R170-E180 PolarHBondContact NH2-OE2 3.37Å; R170-F183 HydrophobicContact CB-CE1 4.19Å; R170-F183 HydrophobicContact CB-CZ 4.16Å |
| 171 | Y | 89.2 | Confident | 87.2 | Confident | 172 Ų | 172 | 79.1 Ų | 79.1 | 68% | 0.675 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -66 | -33.1 | 179.3 | -73.1 | -67.4 | 0 | 0 | 0 | 113.7 | S167 K168 | S167-Y171 WeakPolarHBondContact O-CD2 3.18Å; S167-Y171 PolarHBondContact O-N 3.5Å; K168-Y171 PolarHBondContact O-N 3.18Å |
| 172 | E | 89.7 | Confident | 87.1 | Confident | 101 Ų | 101 | 77.8 Ų | 77.8 | 47% | 0.472 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -81.2 | -38.5 | -179.8 | -69.3 | -79.7 | -173.7 | 0 | 0 | 112.2 | I121 K168 F169 R170 Y177 | I121-E172 HydrophobicContact CD1-CB 3.38Å; I121-E172 HydrophobicContact CD1-CG 4.06Å; K168-E172 HydrophobicContact CG-CG 4.43Å; K168-E172 WeakPolarHBondContact O-CG 3.31Å; K168-E172 PolarHBondContact O-N 3.3Å; F169-E172 PolarHBondContact O-N 2.74Å; R170-E172 VanDerWaalsContact C-N 3.33Å; R170-E172 PolarHBondContact O-N 3.33Å; E172-Y177 WeakPolarHBondContact O-CD2 3.45Å; E172-Y177 WeakPolarHBondContact O-CE2 3.49Å |
| 173 | L | 86.4 | Confident | 87.2 | Confident | 3 Ų | 3 | 77 Ų | 77 | 2% | 0.016 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -87.4 | -35.6 | -174.4 | -66 | 170.2 | 0 | 0 | 0 | 113.1 | I121 F124 F169 R176 Y177 M178 F183 | I121-L173 HydrophobicContact CD1-CD2 4.09Å; I121-L173 HydrophobicContact CD1-CG 4.07Å; I121-L173 HydrophobicContact CG1-CD1 4.12Å; I121-L173 HydrophobicContact CG1-CD2 3.71Å; I121-L173 HydrophobicContact CG1-CG 3.86Å; F124-L173 HydrophobicContact CB-CD1 3.43Å; F124-L173 VanDerWaalsContact CB-CD1 3.43Å; F124-L173 HydrophobicContact CD1-CD1 4.42Å; F124-L173 HydrophobicContact CD2-CD1 4.13Å; F124-L173 HydrophobicContact CG-CD1 3.78Å; F169-L173 HydrophobicContact CB-CD1 4.11Å; F169-L173 WeakPolarHBondContact O-CB 3.34Å; F169-L173 VanDerWaalsContact O-CG 3.23Å; F169-L173 WeakPolarHBondContact O-CG 3.38Å; F169-L173 PolarHBondContact O-N 3.26Å; L173-R176 PolarHBondContact O-N 2.92Å; L173-Y177 HydrophobicContact CD2-CD2 4.28Å; L173-Y177 HydrophobicContact CD2-CG 4.3Å; L173-Y177 WeakPolarHBondContact O-CA 3.38Å; L173-Y177 PolarHBondContact O-N 3.33Å; L173-M178 HydrophobicContact CB-CE 4.38Å; L173-M178 HydrophobicContact CB-CG 4.22Å; L173-M178 HydrophobicContact CD1-CE 4.04Å; L173-M178 HydrophobicContact CD1-SD 4.4Å; L173-M178 HydrophobicContact CD2-CE 3.93Å; L173-M178 HydrophobicContact CG-CE 4.35Å; L173-M178 PolarHBondContact O-N 2.85Å; L173-F183 HydrophobicContact CD1-CD2 3.85Å; L173-F183 HydrophobicContact CD1-CE2 3.91Å |
| 174 | C | 83.5 | Confident | 87.3 | Confident | 22 Ų | 22 | 77.7 Ų | 77.7 | 15% | 0.149 | 34% | 0.344 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.8 | 128.6 | -175.7 | -61.1 | 0 | 0 | 0 | 0 | 110.9 | R170 | R170-C174 VanDerWaalsContact O-CB 3.29Å; R170-C174 WeakPolarHBondContact O-CB 3.45Å; R170-C174 PolarHBondContact O-N 3.45Å |
| 175 | P | 77.6 | Confident | 87.2 | Confident | 128 Ų | 128 | 73.1 Ų | 73.1 | 83% | 0.831 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -92.4 | 1.8 | -0.5 | 35.7 | -34.6 | 0 | 0 | 0 | 114.2 | Y177 | P175-Y177 PolarHBondContact O-N 3.48Š|
| 176 | R | 81.5 | Confident | 87.2 | Confident | 210 Ų | 210 | 70 Ų | 70 | 79% | 0.792 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -35.4 | -164.6 | -170.5 | 174.6 | -175.1 | 179.5 | 1.8 | 114.8 | L173 | L173-R176 PolarHBondContact O-N 2.92Š|
| 177 | Y | 83.1 | Confident | 87.1 | Confident | 128 Ų | 128 | 70 Ų | 70 | 50% | 0.502 | 31% | 0.308 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.3 | -36.5 | -176.1 | -66.3 | -86.2 | 0 | 0 | 0 | 113.1 | E172 L173 P175 | E172-Y177 WeakPolarHBondContact O-CD2 3.45Å; E172-Y177 WeakPolarHBondContact O-CE2 3.49Å; L173-Y177 HydrophobicContact CD2-CD2 4.28Å; L173-Y177 HydrophobicContact CD2-CG 4.3Å; L173-Y177 WeakPolarHBondContact O-CA 3.38Å; L173-Y177 PolarHBondContact O-N 3.33Å; P175-Y177 PolarHBondContact O-N 3.48Å |
| 178 | M | 84.7 | Confident | 87.1 | Confident | 15 Ų | 15 | 69.6 Ų | 69.6 | 7% | 0.074 | 30% | 0.302 | C | S | . | . | S | Bend | trans | -148.6 | 157.5 | 176.9 | 69.1 | -171.8 | 67.5 | 0 | 0 | 111.7 | F124 L173 K182 F183 | F124-M178 HydrophobicContact CB-CE 3.88Å; F124-M178 HydrophobicContact CB-SD 4.49Å; F124-M178 WeakPolarHBondContact O-CE 3.47Å; L173-M178 HydrophobicContact CB-CE 4.38Å; L173-M178 HydrophobicContact CB-CG 4.22Å; L173-M178 HydrophobicContact CD1-CE 4.04Å; L173-M178 HydrophobicContact CD1-SD 4.4Å; L173-M178 HydrophobicContact CD2-CE 3.93Å; L173-M178 HydrophobicContact CG-CE 4.35Å; L173-M178 PolarHBondContact O-N 2.85Å; M178-K182 HydrophobicContact CB-CB 4.25Å; M178-K182 HydrophobicContact CB-CD 4.09Å; M178-K182 HydrophobicContact CB-CG 4.35Å; M178-K182 HydrophobicContact SD-CG 4.41Å; M178-F183 HydrophobicContact CG-CB 4.16Å; M178-F183 HydrophobicContact SD-CB 3.81Å; M178-F183 HydrophobicContact SD-CD2 4.2Å |
| 179 | K | 86.7 | Confident | 87 | Confident | 154 Ų | 154 | 67.8 Ų | 67.8 | 67% | 0.67 | 30% | 0.298 | S | S | * | . | trans | -71.4 | 147.2 | 170.2 | -67.2 | 177.7 | -179.4 | 169.6 | 0 | 109.5 | R181 K182 F183 | K179-R181 PolarHBondContact O-N 2.72Å; K179-K182 WeakPolarHBondContact O-CB 3.4Å; K179-K182 PolarHBondContact O-N 3.39Å; K179-F183 PolarHBondContact O-N 2.71Å; K179-F183 VanDerWaalsContact O-N 3.15Å | ||
| 180 | E | 88.3 | Confident | 87 | Confident | 55 Ų | 55 | 68.8 Ų | 68.8 | 26% | 0.257 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -49.3 | -37.3 | 177.1 | -170.4 | 79.4 | -126.7 | 0 | 0 | 112.6 | R170 K182 F183 W184 | R170-E180 IonicContact CZ-OE1 3.99Å; R170-E180 IonicContact CZ-OE2 3.28Å; R170-E180 VanDerWaalsContact CZ-OE2 3.28Å; R170-E180 VanDerWaalsContact NE-CD 3.28Å; R170-E180 IonicContact NE-OE1 2.99Å; R170-E180 PolarHBondContact NE-OE1 2.97Å; R170-E180 IonicContact NE-OE2 2.85Å; R170-E180 PolarHBondContact NE-OE2 3.23Å; R170-E180 IonicContact NH2-OE2 2.86Å; R170-E180 PolarHBondContact NH2-OE2 3.37Å; E180-K182 PolarHBondContact O-N 3.19Å; E180-F183 WeakPolarHBondContact O-CB 3.5Å; E180-F183 PolarHBondContact O-N 3.06Å; E180-W184 PolarHBondContact O-N 3.42Å; E180-W184 PolarHBondContact OE1-NE1 2.83Å |
| 181 | R | 84.4 | Confident | 87 | Confident | 78 Ų | 78 | 64.9 Ų | 64.9 | 29% | 0.294 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -56.7 | -46.8 | 174 | 179.4 | -172.5 | -66.4 | 174.5 | -16.4 | 113.2 | R145 D147 K179 R185 | R145-R181 VanDerWaalsContact CZ-NH2 3.31Å; R145-R181 VanDerWaalsContact NE-NH2 3.19Å; D147-R181 HydrophobicContact CB-CG 4.31Å; D147-R181 IonicContact OD1-CZ 3.13Å; D147-R181 IonicContact OD1-NE 2.93Å; D147-R181 PolarHBondContact OD1-NE 3.02Å; D147-R181 IonicContact OD1-NH2 2.64Å; D147-R181 IonicContact OD2-CZ 3.46Å; D147-R181 IonicContact OD2-NE 3.3Å; D147-R181 PolarHBondContact OD2-NE 3.29Å; D147-R181 IonicContact OD2-NH2 3.91Å; D147-R181 PolarHBondContact OD2-NH2 3.15Å; K179-R181 PolarHBondContact O-N 2.72Å; R181-R185 WeakPolarHBondContact O-CB 3.19Å; R181-R185 VanDerWaalsContact O-CG 3.28Å; R181-R185 WeakPolarHBondContact O-CG 3.23Å; R181-R185 PolarHBondContact O-N 3.15Å; R181-R185 VanDerWaalsContact O-N 3.09Å |
| 182 | K | 85.4 | Confident | 86.9 | Confident | 42 Ų | 42 | 60.6 Ų | 60.6 | 18% | 0.183 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.9 | -42.4 | 179.2 | -176.6 | 170.5 | -168.7 | 167.6 | 0 | 109.8 | L129 D131 M178 K179 E180 W184 R185 V186 | L129-K182 HydrophobicContact CD2-CG 3.95Å; L129-K182 PolarHBondContact O-NZ 2.72Å; D131-K182 VanDerWaalsContact CG-NZ 3.29Å; D131-K182 WeakPolarHBondContact OD1-CD 3.31Å; D131-K182 WeakPolarHBondContact OD1-CE 3.28Å; D131-K182 IonicContact OD1-NZ 3.22Å; D131-K182 PolarHBondContact OD1-NZ 2.87Å; D131-K182 IonicContact OD2-NZ 2.74Å; D131-K182 PolarHBondContact OD2-NZ 2.93Å; M178-K182 HydrophobicContact CB-CB 4.25Å; M178-K182 HydrophobicContact CB-CD 4.09Å; M178-K182 HydrophobicContact CB-CG 4.35Å; M178-K182 HydrophobicContact SD-CG 4.41Å; K179-K182 WeakPolarHBondContact O-CB 3.4Å; K179-K182 PolarHBondContact O-N 3.39Å; E180-K182 PolarHBondContact O-N 3.19Å; K182-W184 PolarHBondContact O-N 3.25Å; K182-R185 PolarHBondContact O-N 3.45Å; K182-V186 WeakPolarHBondContact O-CG2 3.33Å; K182-V186 PolarHBondContact O-N 3.43Å |
| 183 | F | 90 | Very high | 86.8 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -55.3 | -53.2 | 176.6 | 176.4 | -99.8 | 0 | 0 | 0 | 112.1 | F124 I166 F169 R170 L173 M178 K179 E180 R185 V186 Y187 | F124-F183 AromaticContact CD1-CD2 3.77Å; F124-F183 HydrophobicContact CD1-CD2 3.77Å; F124-F183 AromaticContact CD1-CE2 3.75Å; F124-F183 HydrophobicContact CD1-CE2 3.75Å; F124-F183 AromaticContact CE1-CD2 3.94Å; F124-F183 HydrophobicContact CE1-CD2 3.94Å; F124-F183 AromaticContact CE1-CE2 3.56Å; F124-F183 HydrophobicContact CE1-CE2 3.56Å; F124-F183 HydrophobicContact CE1-CZ 4.16Å; F124-F183 HydrophobicContact CE2-CE2 4.5Å; F124-F183 HydrophobicContact CG-CD2 4.43Å; F124-F183 HydrophobicContact CG-CE2 4.3Å; F124-F183 AromaticContact CZ-CE2 3.94Å; F124-F183 HydrophobicContact CZ-CE2 3.94Å; F124-F183 HydrophobicContact CZ-CZ 4.38Å; I166-F183 HydrophobicContact CG2-CE1 4.34Å; I166-F183 HydrophobicContact CG2-CZ 4.09Å; F169-F183 HydrophobicContact CB-CE2 3.89Å; F169-F183 HydrophobicContact CB-CZ 4.24Å; R170-F183 HydrophobicContact CB-CE1 4.19Å; R170-F183 HydrophobicContact CB-CZ 4.16Å; L173-F183 HydrophobicContact CD1-CD2 3.85Å; L173-F183 HydrophobicContact CD1-CE2 3.91Å; M178-F183 HydrophobicContact CG-CB 4.16Å; M178-F183 HydrophobicContact SD-CB 3.81Å; M178-F183 HydrophobicContact SD-CD2 4.2Å; K179-F183 PolarHBondContact O-N 2.71Å; K179-F183 VanDerWaalsContact O-N 3.15Å; E180-F183 WeakPolarHBondContact O-CB 3.5Å; E180-F183 PolarHBondContact O-N 3.06Å; F183-R185 PolarHBondContact O-N 3.18Å; F183-V186 PolarHBondContact O-N 2.85Å; F183-Y187 WeakPolarHBondContact O-CB 3.27Å; F183-Y187 PolarHBondContact O-N 3.45Å |
| 184 | W | 90.6 | Very high | 86.7 | Confident | 19 Ų | 19 | 63.8 Ų | 63.8 | 7% | 0.072 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -66.1 | -38.2 | 179.3 | -72.5 | 112.3 | 0 | 0 | 0 | 113.2 | L148 A156 L160 I166 E180 K182 V186 Y187 F188 | L148-W184 HydrophobicContact CD1-CB 4.02Å; L148-W184 HydrophobicContact CD1-CG 4.4Å; L148-W184 HydrophobicContact CD2-CB 4.44Å; L148-W184 HydrophobicContact CD2-CG 4.26Å; A156-W184 HydrophobicContact CB-CD2 4.3Å; A156-W184 HydrophobicContact CB-CE3 3.95Å; A156-W184 HydrophobicContact CB-CH2 3.52Å; A156-W184 HydrophobicContact CB-CZ2 3.9Å; A156-W184 HydrophobicContact CB-CZ3 3.54Å; L160-W184 HydrophobicContact CD1-CH2 4.2Å; L160-W184 HydrophobicContact CD1-CZ2 3.99Å; L160-W184 HydrophobicContact CD2-CH2 4.3Å; L160-W184 HydrophobicContact CD2-CZ2 4.44Å; L160-W184 HydrophobicContact CG-CH2 4.01Å; L160-W184 HydrophobicContact CG-CZ2 4.26Å; I166-W184 HydrophobicContact CG2-CH2 4.38Å; E180-W184 PolarHBondContact O-N 3.42Å; E180-W184 PolarHBondContact OE1-NE1 2.83Å; K182-W184 PolarHBondContact O-N 3.25Å; W184-V186 VanDerWaalsContact C-N 3.34Å; W184-V186 PolarHBondContact O-N 2.99Å; W184-Y187 AromaticContact CE3-CD1 3.71Å; W184-Y187 HydrophobicContact CE3-CD1 3.71Å; W184-Y187 HydrophobicContact CE3-CE1 4.44Å; W184-Y187 HydrophobicContact CE3-CG 4.12Å; W184-Y187 AromaticContact CZ3-CD1 3.78Å; W184-Y187 HydrophobicContact CZ3-CD1 3.78Å; W184-Y187 HydrophobicContact CZ3-CE1 4.13Å; W184-Y187 HydrophobicContact CZ3-CG 4.17Å; W184-Y187 WeakPolarHBondContact O-CB 3.49Å; W184-Y187 PolarHBondContact O-N 3.47Å; W184-F188 HydrophobicContact CB-CD2 4.22Å; W184-F188 HydrophobicContact CB-CE2 4.19Å; W184-F188 HydrophobicContact CD2-CE2 4.4Å; W184-F188 HydrophobicContact CE3-CD2 4.48Å; W184-F188 AromaticContact CE3-CE2 3.84Å; W184-F188 HydrophobicContact CE3-CE2 3.84Å; W184-F188 HydrophobicContact CE3-CZ 4.3Å; W184-F188 WeakPolarHBondContact O-CD2 3.17Å; W184-F188 PolarHBondContact O-N 3.45Å |
| 185 | R | 87.7 | Confident | 86.9 | Confident | 79 Ų | 79 | 62.8 Ų | 62.8 | 30% | 0.298 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.8 | -44.9 | 175.4 | -75 | 177.9 | -174.5 | -174.3 | 0.8 | 111.7 | L129 E132 D147 R181 K182 F183 L189 | L129-R185 HydrophobicContact CD2-CB 3.86Å; E132-R185 IonicContact OE2-CZ 2.79Å; E132-R185 VanDerWaalsContact OE2-CZ 3.3Å; E132-R185 IonicContact OE2-NH1 2.65Å; E132-R185 PolarHBondContact OE2-NH1 3.06Å; E132-R185 IonicContact OE2-NH2 2.94Å; E132-R185 PolarHBondContact OE2-NH2 3.26Å; D147-R185 IonicContact OD1-NH2 3.57Å; D147-R185 PolarHBondContact OD1-NH2 2.86Å; R181-R185 WeakPolarHBondContact O-CB 3.19Å; R181-R185 VanDerWaalsContact O-CG 3.28Å; R181-R185 WeakPolarHBondContact O-CG 3.23Å; R181-R185 PolarHBondContact O-N 3.15Å; R181-R185 VanDerWaalsContact O-N 3.09Å; K182-R185 PolarHBondContact O-N 3.45Å; F183-R185 PolarHBondContact O-N 3.18Å; R185-L189 WeakPolarHBondContact O-CB 3.33Å; R185-L189 PolarHBondContact O-N 3.33Å |
| 186 | V | 89.2 | Confident | 87.3 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.2 | -45 | 175.8 | 175.6 | 0 | 0 | 0 | 0 | 110.7 | F124 F127 L129 K182 F183 W184 L189 L190 | F124-V186 HydrophobicContact CD1-CB 4.23Å; F124-V186 HydrophobicContact CD1-CG1 3.83Å; F124-V186 HydrophobicContact CE1-CG1 4.4Å; F127-V186 HydrophobicContact CB-CG1 3.87Å; F127-V186 HydrophobicContact CB-CG2 4Å; F127-V186 HydrophobicContact CD1-CG1 4.17Å; F127-V186 HydrophobicContact CD1-CG2 3.8Å; F127-V186 HydrophobicContact CD2-CG1 3.78Å; F127-V186 HydrophobicContact CE2-CG1 4.39Å; F127-V186 HydrophobicContact CG-CB 4.44Å; F127-V186 HydrophobicContact CG-CG1 3.65Å; F127-V186 HydrophobicContact CG-CG2 3.95Å; L129-V186 HydrophobicContact CB-CG2 4.23Å; L129-V186 HydrophobicContact CD2-CG2 4.15Å; K182-V186 WeakPolarHBondContact O-CG2 3.33Å; K182-V186 PolarHBondContact O-N 3.43Å; F183-V186 PolarHBondContact O-N 2.85Å; W184-V186 VanDerWaalsContact C-N 3.34Å; W184-V186 PolarHBondContact O-N 2.99Å; V186-L189 PolarHBondContact O-N 3.42Å; V186-L190 HydrophobicContact CG1-CD1 3.82Å; V186-L190 HydrophobicContact CG1-CG 4.36Å; V186-L190 VanDerWaalsContact O-CG 3.31Å; V186-L190 WeakPolarHBondContact O-CG 3.45Å; V186-L190 PolarHBondContact O-N 2.86Å |
| 187 | Y | 90.7 | Very high | 87.6 | Confident | 1 Ų | 1 | 51.6 Ų | 51.6 | 0% | 0.004 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56.3 | -56.5 | 177.2 | 173.6 | -98.2 | 0 | 0 | 0 | 112.1 | V116 H155 V159 I166 F183 W184 L189 L190 V191 I195 | V116-Y187 HydrophobicContact CG2-CE2 4.24Å; H155-Y187 AromaticContact NE2-CE1 3.9Å; H155-Y187 PolarHBondContact NE2-OH 3.06Å; V159-Y187 HydrophobicContact CG1-CE2 4.25Å; V159-Y187 WeakPolarHBondContact CG2-OH 3.42Å; I166-Y187 HydrophobicContact CD1-CD2 3.7Å; I166-Y187 HydrophobicContact CD1-CE2 3.66Å; I166-Y187 HydrophobicContact CG1-CD2 4.49Å; I166-Y187 HydrophobicContact CG1-CE2 4.05Å; F183-Y187 WeakPolarHBondContact O-CB 3.27Å; F183-Y187 PolarHBondContact O-N 3.45Å; W184-Y187 AromaticContact CE3-CD1 3.71Å; W184-Y187 HydrophobicContact CE3-CD1 3.71Å; W184-Y187 HydrophobicContact CE3-CE1 4.44Å; W184-Y187 HydrophobicContact CE3-CG 4.12Å; W184-Y187 AromaticContact CZ3-CD1 3.78Å; W184-Y187 HydrophobicContact CZ3-CD1 3.78Å; W184-Y187 HydrophobicContact CZ3-CE1 4.13Å; W184-Y187 HydrophobicContact CZ3-CG 4.17Å; W184-Y187 WeakPolarHBondContact O-CB 3.49Å; W184-Y187 PolarHBondContact O-N 3.47Å; Y187-L189 PolarHBondContact O-N 3.33Å; Y187-L190 PolarHBondContact O-N 3.14Å; Y187-V191 HydrophobicContact CD2-CG2 4.07Å; Y187-V191 HydrophobicContact CE1-CG2 4.41Å; Y187-V191 HydrophobicContact CE2-CG2 3.66Å; Y187-V191 WeakPolarHBondContact O-CB 3.35Å; Y187-V191 WeakPolarHBondContact O-CG2 3.4Å; Y187-V191 PolarHBondContact O-N 2.79Å; Y187-I195 HydrophobicContact CE1-CD1 4.39Å |
| 188 | F | 89.8 | Confident | 87.8 | Confident | 20 Ų | 20 | 47.8 Ų | 47.8 | 9% | 0.088 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.8 | -33.1 | -178.7 | -76.5 | -64.4 | 0 | 0 | 0 | 111.7 | L148 Q152 H155 A156 W184 V191 N192 I195 | L148-F188 HydrophobicContact CD2-CE2 3.66Å; L148-F188 HydrophobicContact CD2-CZ 4.25Å; L148-F188 HydrophobicContact CG-CE2 3.95Å; Q152-F188 HydrophobicContact CB-CE1 4.05Å; Q152-F188 HydrophobicContact CB-CE2 4.06Å; Q152-F188 HydrophobicContact CB-CZ 3.63Å; Q152-F188 HydrophobicContact CG-CD1 4.25Å; Q152-F188 HydrophobicContact CG-CE1 3.85Å; Q152-F188 HydrophobicContact CG-CE2 4.35Å; Q152-F188 HydrophobicContact CG-CZ 3.92Å; H155-F188 AromaticContact CD2-CE1 3.76Å; A156-F188 HydrophobicContact CB-CZ 4.39Å; W184-F188 HydrophobicContact CB-CD2 4.22Å; W184-F188 HydrophobicContact CB-CE2 4.19Å; W184-F188 HydrophobicContact CD2-CE2 4.4Å; W184-F188 HydrophobicContact CE3-CD2 4.48Å; W184-F188 AromaticContact CE3-CE2 3.84Å; W184-F188 HydrophobicContact CE3-CE2 3.84Å; W184-F188 HydrophobicContact CE3-CZ 4.3Å; W184-F188 WeakPolarHBondContact O-CD2 3.17Å; W184-F188 PolarHBondContact O-N 3.45Å; F188-V191 PolarHBondContact O-N 3.07Å; F188-N192 VanDerWaalsContact O-CA 3.3Å; F188-N192 WeakPolarHBondContact O-CA 3.47Å; F188-N192 WeakPolarHBondContact O-CB 3.46Å; F188-N192 PolarHBondContact O-N 3.42Å; F188-I195 HydrophobicContact CD1-CD1 3.88Å; F188-I195 HydrophobicContact CE1-CD1 4.03Å |
| 189 | L | 89.3 | Confident | 88 | Confident | 96 Ų | 96 | 49.4 Ų | 49.4 | 50% | 0.503 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.6 | -42.3 | 176 | -173.4 | 60 | 0 | 0 | 0 | 112.3 | F127 L129 R185 V186 Y187 V191 | F127-L189 HydrophobicContact CE1-CD2 3.53Å; F127-L189 HydrophobicContact CZ-CD2 3.45Å; F127-L189 VanDerWaalsContact CZ-CD2 3.45Å; F127-L189 HydrophobicContact CZ-CG 4.17Å; L129-L189 HydrophobicContact CD1-CD2 4.4Å; R185-L189 WeakPolarHBondContact O-CB 3.33Å; R185-L189 PolarHBondContact O-N 3.33Å; V186-L189 PolarHBondContact O-N 3.42Å; Y187-L189 PolarHBondContact O-N 3.33Å; L189-V191 VanDerWaalsContact C-N 3.34Å |
| 190 | L | 89.3 | Confident | 88 | Confident | 40 Ų | 40 | 49.2 Ų | 49.2 | 21% | 0.209 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67.1 | -37.6 | 176.7 | -72 | 170.4 | 0 | 0 | 0 | 112 | F115 M119 T123 F127 V186 Y187 | F115-L190 HydrophobicContact CE1-CB 4.42Å; M119-L190 HydrophobicContact SD-CD1 3.56Å; M119-L190 VanDerWaalsContact SD-CD1 3.56Å; T123-L190 HydrophobicContact CG2-CD1 3.86Å; T123-L190 HydrophobicContact CG2-CD2 4.39Å; F127-L190 HydrophobicContact CD2-CD2 4.39Å; F127-L190 HydrophobicContact CE2-CD2 3.83Å; F127-L190 HydrophobicContact CE2-CG 4.21Å; V186-L190 HydrophobicContact CG1-CD1 3.82Å; V186-L190 HydrophobicContact CG1-CG 4.36Å; V186-L190 VanDerWaalsContact O-CG 3.31Å; V186-L190 WeakPolarHBondContact O-CG 3.45Å; V186-L190 PolarHBondContact O-N 2.86Å; Y187-L190 PolarHBondContact O-N 3.14Å |
| 191 | V | 89.3 | Confident | 88 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -93 | -8.2 | -173.6 | -178.9 | 0 | 0 | 0 | 0 | 112.9 | L112 F115 V116 Y187 F188 L189 S193 Y194 I195 | L112-V191 HydrophobicContact CD1-CB 4.2Å; L112-V191 HydrophobicContact CD1-CG1 3.14Å; L112-V191 HydrophobicContact CD1-CG2 3.94Å; L112-V191 HydrophobicContact CD2-CG1 4.14Å; L112-V191 HydrophobicContact CG-CG1 4.28Å; F115-V191 HydrophobicContact CD1-CG2 4.37Å; F115-V191 HydrophobicContact CE1-CG2 4.14Å; V116-V191 HydrophobicContact CG2-CG2 4.25Å; Y187-V191 HydrophobicContact CD2-CG2 4.07Å; Y187-V191 HydrophobicContact CE1-CG2 4.41Å; Y187-V191 HydrophobicContact CE2-CG2 3.66Å; Y187-V191 WeakPolarHBondContact O-CB 3.35Å; Y187-V191 WeakPolarHBondContact O-CG2 3.4Å; Y187-V191 PolarHBondContact O-N 2.79Å; F188-V191 PolarHBondContact O-N 3.07Å; L189-V191 VanDerWaalsContact C-N 3.34Å; V191-S193 PolarHBondContact O-N 3.47Å; V191-Y194 PolarHBondContact O-N 3.32Å; V191-I195 HydrophobicContact CB-CD1 3.9Å; V191-I195 HydrophobicContact CG1-CB 4.47Å; V191-I195 HydrophobicContact CG1-CD1 3.25Å; V191-I195 HydrophobicContact CG1-CG1 3.61Å; V191-I195 PolarHBondContact O-N 3.46Å; V191-I195 VanDerWaalsContact O-N 3.15Å |
| 192 | N | 88.3 | Confident | 87.9 | Confident | 82 Ų | 82 | 50 Ų | 50 | 44% | 0.439 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -50.1 | -36.3 | -172.7 | -167.9 | 40.5 | 0 | 0 | 0 | 113.7 | F188 Y194 I195 A196 | F188-N192 VanDerWaalsContact O-CA 3.3Å; F188-N192 WeakPolarHBondContact O-CA 3.47Å; F188-N192 WeakPolarHBondContact O-CB 3.46Å; F188-N192 PolarHBondContact O-N 3.42Å; N192-Y194 VanDerWaalsContact C-N 3.26Å; N192-Y194 PolarHBondContact O-N 2.93Å; N192-I195 PolarHBondContact O-N 3.03Å; N192-A196 WeakPolarHBondContact O-CB 3.49Å; N192-A196 PolarHBondContact O-N 2.83Å |
| 193 | S | 86.5 | Confident | 87.9 | Confident | 89 Ų | 89 | 53.4 Ų | 53.4 | 62% | 0.622 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -59.6 | -34.8 | 177.7 | 54.3 | 0 | 0 | 0 | 0 | 113.6 | V191 | V191-S193 PolarHBondContact O-N 3.47Å |
| 194 | Y | 85.5 | Confident | 87.7 | Confident | 81 Ų | 81 | 59 Ų | 59 | 32% | 0.318 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -86 | -40.1 | -179.8 | -63 | -84.6 | 0 | 0 | 0 | 111.6 | D111 F115 V191 N192 P197 F198 | D111-Y194 HydrophobicContact CB-CD1 4.38Å; D111-Y194 HydrophobicContact CB-CE1 4.09Å; F115-Y194 HydrophobicContact CB-CE2 4.24Å; F115-Y194 HydrophobicContact CD1-CD2 4.48Å; F115-Y194 HydrophobicContact CD1-CE2 4.08Å; F115-Y194 HydrophobicContact CD2-CE2 4.07Å; F115-Y194 HydrophobicContact CE1-CE2 4.48Å; F115-Y194 HydrophobicContact CE2-CE2 4.48Å; F115-Y194 AromaticContact CG-CE2 3.85Å; F115-Y194 HydrophobicContact CG-CE2 3.85Å; V191-Y194 PolarHBondContact O-N 3.32Å; N192-Y194 VanDerWaalsContact C-N 3.26Å; N192-Y194 PolarHBondContact O-N 2.93Å; Y194-P197 WeakPolarHBondContact O-CD 3.08Å; Y194-P197 WeakPolarHBondContact O-CG 3.16Å; Y194-F198 WeakPolarHBondContact O-CD2 3.43Å; Y194-F198 WeakPolarHBondContact O-CE2 3.43Å |
| 195 | I | 87.6 | Confident | 87.4 | Confident | 2 Ų | 2 | 64.6 Ų | 64.6 | 1% | 0.01 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -79 | -38.3 | -174 | -79.6 | 167.7 | 0 | 0 | 0 | 113.2 | W151 H155 Y187 F188 V191 N192 P197 F198 E199 | W151-I195 HydrophobicContact CE3-CG2 4.46Å; W151-I195 HydrophobicContact CH2-CB 4.25Å; W151-I195 HydrophobicContact CH2-CG1 4.22Å; W151-I195 HydrophobicContact CH2-CG2 3.31Å; W151-I195 HydrophobicContact CZ2-CG2 4.44Å; W151-I195 HydrophobicContact CZ3-CG2 3.3Å; H155-I195 WeakPolarHBondContact NE2-CD1 3.46Å; Y187-I195 HydrophobicContact CE1-CD1 4.39Å; F188-I195 HydrophobicContact CD1-CD1 3.88Å; F188-I195 HydrophobicContact CE1-CD1 4.03Å; V191-I195 HydrophobicContact CB-CD1 3.9Å; V191-I195 HydrophobicContact CG1-CB 4.47Å; V191-I195 HydrophobicContact CG1-CD1 3.25Å; V191-I195 HydrophobicContact CG1-CG1 3.61Å; V191-I195 PolarHBondContact O-N 3.46Å; V191-I195 VanDerWaalsContact O-N 3.15Å; N192-I195 PolarHBondContact O-N 3.03Å; I195-P197 VanDerWaalsContact C-CD 3.43Å; I195-P197 VanDerWaalsContact C-N 3.35Å; I195-P197 VanDerWaalsContact O-N 3.15Å; I195-F198 WeakPolarHBondContact O-CA 3.49Å; I195-F198 PolarHBondContact O-N 3.44Å; I195-E199 HydrophobicContact CG2-CB 4.23Å; I195-E199 PolarHBondContact O-N 3.37Å |
| 196 | A | 86.2 | Confident | 87.2 | Confident | 40 Ų | 40 | 66.3 Ų | 66.3 | 33% | 0.331 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -48.1 | -43.3 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | N192 F198 K200 | N192-A196 WeakPolarHBondContact O-CB 3.49Å; N192-A196 PolarHBondContact O-N 2.83Å; A196-F198 VanDerWaalsContact C-N 3.32Å; A196-F198 PolarHBondContact O-N 2.83Å; A196-K200 WeakPolarHBondContact O-CB 3.3Å; A196-K200 PolarHBondContact O-N 3.3Å; A196-K200 VanDerWaalsContact O-N 3.13Å |
| 197 | P | 86.5 | Confident | 86.9 | Confident | 63 Ų | 63 | 73.2 Ų | 73.2 | 41% | 0.409 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -67 | -31.1 | 176.7 | 25.5 | -34.9 | 0 | 0 | 0 | 113.5 | Y194 I195 K201 | Y194-P197 WeakPolarHBondContact O-CD 3.08Å; Y194-P197 WeakPolarHBondContact O-CG 3.16Å; I195-P197 VanDerWaalsContact C-CD 3.43Å; I195-P197 VanDerWaalsContact C-N 3.35Å; I195-P197 VanDerWaalsContact O-N 3.15Å; P197-K201 VanDerWaalsContact O-CG 3.26Å; P197-K201 WeakPolarHBondContact O-CG 3.5Å; P197-K201 PolarHBondContact O-N 3.25Å |
| 198 | F | 88.3 | Confident | 86.5 | Confident | 48 Ų | 48 | 77 Ų | 77 | 21% | 0.211 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -79.5 | -43.9 | 179.9 | -63.3 | -87.5 | 0 | 0 | 0 | 111.5 | E104 G107 T109 W151 Y194 I195 A196 K200 K201 S202 | E104-F198 WeakPolarHBondContact O-CD1 3.29Å; E104-F198 WeakPolarHBondContact O-CE1 3.09Å; G107-F198 VanDerWaalsContact CA-CD2 3.45Å; T109-F198 HydrophobicContact CG2-CE2 4.3Å; T109-F198 HydrophobicContact CG2-CZ 3.75Å; W151-F198 HydrophobicContact CZ2-CB 4.09Å; Y194-F198 WeakPolarHBondContact O-CD2 3.43Å; Y194-F198 WeakPolarHBondContact O-CE2 3.43Å; I195-F198 WeakPolarHBondContact O-CA 3.49Å; I195-F198 PolarHBondContact O-N 3.44Å; A196-F198 VanDerWaalsContact C-N 3.32Å; A196-F198 PolarHBondContact O-N 2.83Å; F198-K200 VanDerWaalsContact C-N 3.27Å; F198-K200 PolarHBondContact O-N 3.39Å; F198-K201 PolarHBondContact O-N 3.07Å; F198-K201 VanDerWaalsContact O-N 3.14Å; F198-S202 PolarHBondContact O-N 3.44Å; F198-S202 PolarHBondContact O-OG 3.39Å |
| 199 | E | 88.1 | Confident | 86.1 | Confident | 48 Ų | 48 | 81.7 Ų | 81.7 | 22% | 0.224 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -57.9 | -43.3 | 174.8 | -176.5 | 170.8 | -153.8 | 0 | 0 | 110.9 | S149 W151 I195 K201 S202 L203 | S149-E199 PolarHBondContact OG-OE1 2.94Å; W151-E199 HydrophobicContact CD2-CB 3.98Å; W151-E199 HydrophobicContact CD2-CG 3.92Å; W151-E199 HydrophobicContact CE3-CB 3.86Å; W151-E199 HydrophobicContact CE3-CG 3.77Å; W151-E199 HydrophobicContact CG-CG 4.36Å; W151-E199 HydrophobicContact CH2-CB 4.17Å; W151-E199 HydrophobicContact CZ2-CB 4.17Å; W151-E199 HydrophobicContact CZ3-CB 3.99Å; W151-E199 HydrophobicContact CZ3-CG 4.35Å; I195-E199 HydrophobicContact CG2-CB 4.23Å; I195-E199 PolarHBondContact O-N 3.37Å; E199-K201 PolarHBondContact O-N 3.45Å; E199-S202 PolarHBondContact O-N 2.86Å; E199-L203 WeakPolarHBondContact O-CB 3.34Å; E199-L203 PolarHBondContact O-N 3.23Å |
| 200 | K | 87.6 | Confident | 85.7 | Confident | 150 Ų | 150 | 79.2 Ų | 79.2 | 65% | 0.652 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -61.7 | -44.1 | 175.8 | -174.9 | 179.7 | 175.8 | -177.1 | 0 | 112.5 | A196 F198 L203 E204 | A196-K200 WeakPolarHBondContact O-CB 3.3Å; A196-K200 PolarHBondContact O-N 3.3Å; A196-K200 VanDerWaalsContact O-N 3.13Å; F198-K200 VanDerWaalsContact C-N 3.27Å; F198-K200 PolarHBondContact O-N 3.39Å; K200-L203 PolarHBondContact O-N 3.17Å; K200-E204 WeakPolarHBondContact O-CB 3.32Å; K200-E204 PolarHBondContact O-N 2.89Å |
| 201 | K | 87.2 | Confident | 85.1 | Confident | 131 Ų | 131 | 81.3 Ų | 81.3 | 57% | 0.57 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -62.5 | -45.5 | 178 | -78.8 | 173.4 | -179 | 177.3 | 0 | 111.6 | P197 F198 E199 L203 E204 E205 | P197-K201 VanDerWaalsContact O-CG 3.26Å; P197-K201 WeakPolarHBondContact O-CG 3.5Å; P197-K201 PolarHBondContact O-N 3.25Å; F198-K201 PolarHBondContact O-N 3.07Å; F198-K201 VanDerWaalsContact O-N 3.14Å; E199-K201 PolarHBondContact O-N 3.45Å; K201-L203 VanDerWaalsContact C-N 3.34Å; K201-L203 PolarHBondContact O-N 3.21Å; K201-E204 PolarHBondContact O-N 3.31Å; K201-E205 WeakPolarHBondContact O-CB 3.26Å; K201-E205 PolarHBondContact O-N 3.42Å |
| 202 | S | 83.6 | Confident | 84.4 | Confident | 19 Ų | 19 | 86.8 Ų | 86.8 | 13% | 0.133 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -64.9 | -38.7 | 177.7 | -63.3 | 0 | 0 | 0 | 0 | 112.1 | W151 F198 E199 E205 L206 | W151-S202 VanDerWaalsContact NE1-CB 3.32Å; W151-S202 PolarHBondContact NE1-OG 3.37Å; F198-S202 PolarHBondContact O-N 3.44Å; F198-S202 PolarHBondContact O-OG 3.39Å; E199-S202 PolarHBondContact O-N 2.86Å; S202-E205 PolarHBondContact O-N 3.01Å; S202-L206 WeakPolarHBondContact O-CB 3.43Å; S202-L206 VanDerWaalsContact O-CG 3.31Å; S202-L206 WeakPolarHBondContact O-CG 3.25Å; S202-L206 PolarHBondContact O-N 3.32Å |
| 203 | L | 83.6 | Confident | 83.7 | Confident | 114 Ų | 114 | 88.2 Ų | 88.2 | 60% | 0.597 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -66.6 | -39.4 | 175.8 | -168.4 | 152.6 | 0 | 0 | 0 | 111.7 | E199 K200 K201 K207 | E199-L203 WeakPolarHBondContact O-CB 3.34Å; E199-L203 PolarHBondContact O-N 3.23Å; K200-L203 PolarHBondContact O-N 3.17Å; K201-L203 VanDerWaalsContact C-N 3.34Å; K201-L203 PolarHBondContact O-N 3.21Å; L203-K207 WeakPolarHBondContact O-CB 3.28Å; L203-K207 PolarHBondContact O-N 3.23Å |
| 204 | E | 86.3 | Confident | 83.1 | Confident | 117 Ų | 117 | 91.3 Ų | 91.3 | 55% | 0.547 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.6 | -43.7 | 174.1 | -175.3 | 168.3 | -164.3 | 0 | 0 | 111.8 | K200 K201 K207 V208 | K200-E204 WeakPolarHBondContact O-CB 3.32Å; K200-E204 PolarHBondContact O-N 2.89Å; K201-E204 PolarHBondContact O-N 3.31Å; E204-K207 WeakPolarHBondContact O-CB 3.24Å; E204-K207 PolarHBondContact O-N 3.21Å; E204-K207 VanDerWaalsContact O-N 3.17Å; E204-V208 WeakPolarHBondContact O-CG2 3.17Å; E204-V208 PolarHBondContact O-N 3.42Å |
| 205 | E | 85.7 | Confident | 82.4 | Confident | 136 Ų | 136 | 94.7 Ų | 94.7 | 64% | 0.636 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -61.1 | -44.4 | 175.5 | -174.4 | 176.6 | -179.6 | 0 | 0 | 111.8 | K201 S202 K207 V208 K209 | K201-E205 WeakPolarHBondContact O-CB 3.26Å; K201-E205 PolarHBondContact O-N 3.42Å; S202-E205 PolarHBondContact O-N 3.01Å; E205-K207 VanDerWaalsContact C-N 3.3Å; E205-K207 PolarHBondContact O-N 3.3Å; E205-V208 PolarHBondContact O-N 3.42Å; E205-K209 VanDerWaalsContact O-CB 3.32Å; E205-K209 WeakPolarHBondContact O-CB 3.43Å; E205-K209 PolarHBondContact O-N 3.09Å |
| 206 | L | 82.2 | Confident | 81.4 | Confident | 115 Ų | 115 | 98.8 Ų | 98.8 | 60% | 0.602 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -61.9 | -38.5 | 174.2 | -74.2 | 171.6 | 0 | 0 | 0 | 112 | S202 A210 | S202-L206 WeakPolarHBondContact O-CB 3.43Å; S202-L206 VanDerWaalsContact O-CG 3.31Å; S202-L206 WeakPolarHBondContact O-CG 3.25Å; S202-L206 PolarHBondContact O-N 3.32Å; L206-A210 VanDerWaalsContact O-CB 3.29Å; L206-A210 WeakPolarHBondContact O-CB 3.45Å; L206-A210 PolarHBondContact O-N 3.49Å |
| 207 | K | 84.1 | Confident | 80.5 | Confident | 146 Ų | 146 | 100.7 Ų | 100.7 | 64% | 0.635 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.9 | -42.3 | 177 | -174.4 | 178.2 | 177.8 | -178 | 0 | 112 | L203 E204 E205 A210 E211 | L203-K207 WeakPolarHBondContact O-CB 3.28Å; L203-K207 PolarHBondContact O-N 3.23Å; E204-K207 WeakPolarHBondContact O-CB 3.24Å; E204-K207 PolarHBondContact O-N 3.21Å; E204-K207 VanDerWaalsContact O-N 3.17Å; E205-K207 VanDerWaalsContact C-N 3.3Å; E205-K207 PolarHBondContact O-N 3.3Å; K207-A210 PolarHBondContact O-N 2.91Å; K207-E211 WeakPolarHBondContact O-CB 3.19Å; K207-E211 PolarHBondContact O-N 3.3Å |
| 208 | V | 80.8 | Confident | 79.1 | Confident | 80 Ų | 80 | 104.3 Ų | 104.3 | 49% | 0.485 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.5 | -46 | 176.3 | 171 | 0 | 0 | 0 | 0 | 110.2 | E204 E205 A210 E211 E212 | E204-V208 WeakPolarHBondContact O-CG2 3.17Å; E204-V208 PolarHBondContact O-N 3.42Å; E205-V208 PolarHBondContact O-N 3.42Å; V208-A210 VanDerWaalsContact C-N 3.35Å; V208-A210 PolarHBondContact O-N 2.97Å; V208-E211 PolarHBondContact O-N 2.87Å; V208-E211 VanDerWaalsContact O-N 3.08Å; V208-E212 WeakPolarHBondContact O-CB 3.19Å; V208-E212 PolarHBondContact O-N 3.11Å |
| 209 | K | 82.6 | Confident | 77.6 | Confident | 119 Ų | 119 | 109.1 Ų | 109.1 | 52% | 0.517 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.9 | -42.7 | 177.6 | -172.2 | 176.8 | 178.6 | -175.9 | 0 | 112.1 | E205 E211 E212 E213 | E205-K209 VanDerWaalsContact O-CB 3.32Å; E205-K209 WeakPolarHBondContact O-CB 3.43Å; E205-K209 PolarHBondContact O-N 3.09Å; K209-E211 VanDerWaalsContact C-N 3.29Å; K209-E211 PolarHBondContact O-N 3.36Å; K209-E212 PolarHBondContact O-N 2.84Å; K209-E213 WeakPolarHBondContact CE-OE1 3.23Å; K209-E213 WeakPolarHBondContact O-CG 3.43Å; K209-E213 PolarHBondContact O-N 3.35Å |
| 210 | A | 80.4 | Confident | 75.9 | Confident | 44 Ų | 44 | 114.7 Ų | 114.7 | 36% | 0.364 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66.8 | -29 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | L206 K207 V208 K214 | L206-A210 VanDerWaalsContact O-CB 3.29Å; L206-A210 WeakPolarHBondContact O-CB 3.45Å; L206-A210 PolarHBondContact O-N 3.49Å; K207-A210 PolarHBondContact O-N 2.91Å; V208-A210 VanDerWaalsContact C-N 3.35Å; V208-A210 PolarHBondContact O-N 2.97Å; A210-K214 VanDerWaalsContact O-CG 3.25Å; A210-K214 WeakPolarHBondContact O-CG 3.38Å; A210-K214 PolarHBondContact O-N 3.3Å |
| 211 | E | 77.2 | Confident | 74.3 | Confident | 84 Ų | 84 | 111.1 Ų | 111.1 | 39% | 0.393 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -77.3 | -36.2 | 174.4 | -169.7 | 174.1 | 169.1 | 0 | 0 | 112.1 | K207 V208 K209 K214 R215 | K207-E211 WeakPolarHBondContact O-CB 3.19Å; K207-E211 PolarHBondContact O-N 3.3Å; V208-E211 PolarHBondContact O-N 2.87Å; V208-E211 VanDerWaalsContact O-N 3.08Å; K209-E211 VanDerWaalsContact C-N 3.29Å; K209-E211 PolarHBondContact O-N 3.36Å; E211-K214 PolarHBondContact O-N 3.1Å; E211-R215 WeakPolarHBondContact O-CG 3.43Å; E211-R215 PolarHBondContact O-N 3.35Å; E211-R215 IonicContact OE1-CZ 2.69Å; E211-R215 IonicContact OE1-NE 3.25Å; E211-R215 IonicContact OE1-NH1 3.84Å; E211-R215 PolarHBondContact OE1-NH1 3.08Å; E211-R215 IonicContact OE1-NH2 3.3Å; E211-R215 PolarHBondContact OE1-NH2 2.93Å |
| 212 | E | 75.2 | Confident | 72.6 | Confident | 114 Ų | 114 | 108.7 Ų | 108.7 | 53% | 0.533 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.3 | -48.3 | 174.1 | -170 | 169.7 | -162.2 | 0 | 0 | 111.2 | V208 K209 K214 R215 D216 | V208-E212 WeakPolarHBondContact O-CB 3.19Å; V208-E212 PolarHBondContact O-N 3.11Å; K209-E212 PolarHBondContact O-N 2.84Å; E212-K214 PolarHBondContact O-N 3.22Å; E212-R215 CarbonylContact O-C 3.58Å; E212-R215 PolarHBondContact O-N 2.88Å; E212-D216 PolarHBondContact O-N 3.25Å |
| 213 | E | 73.2 | Confident | 71 | Confident | 113 Ų | 113 | 116.1 Ų | 116.1 | 53% | 0.528 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -59.1 | -36 | 175.5 | -75.8 | 176 | -177.2 | 0 | 0 | 112.3 | K209 S217 | K209-E213 WeakPolarHBondContact CE-OE1 3.23Å; K209-E213 WeakPolarHBondContact O-CG 3.43Å; K209-E213 PolarHBondContact O-N 3.35Å; E213-S217 VanDerWaalsContact O-CB 3.3Å; E213-S217 WeakPolarHBondContact O-CB 3.2Å; E213-S217 PolarHBondContact O-N 3.37Å; E213-S217 PolarHBondContact O-OG 2.91Å |
| 214 | K | 74.3 | Confident | 69.2 | Low | 153 Ų | 153 | 115.1 Ų | 115.1 | 67% | 0.665 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67.7 | -40.7 | 173 | -77.6 | 177.8 | -176.9 | -175.5 | 0 | 112.4 | A210 E211 E212 Q218 | A210-K214 VanDerWaalsContact O-CG 3.25Å; A210-K214 WeakPolarHBondContact O-CG 3.38Å; A210-K214 PolarHBondContact O-N 3.3Å; E211-K214 PolarHBondContact O-N 3.1Å; E212-K214 PolarHBondContact O-N 3.22Å; K214-Q218 WeakPolarHBondContact O-CB 3.47Å; K214-Q218 PolarHBondContact O-N 3.06Å |
| 215 | R | 70.7 | Confident | 67.1 | Low | 153 Ų | 153 | 113.7 Ų | 113.7 | 58% | 0.577 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -70.4 | -38.2 | 177.7 | -78.2 | -174.9 | -178.6 | 135.8 | 1.5 | 112.3 | E211 E212 Q218 K219 | E211-R215 WeakPolarHBondContact O-CG 3.43Å; E211-R215 PolarHBondContact O-N 3.35Å; E211-R215 IonicContact OE1-CZ 2.69Å; E211-R215 IonicContact OE1-NE 3.25Å; E211-R215 IonicContact OE1-NH1 3.84Å; E211-R215 PolarHBondContact OE1-NH1 3.08Å; E211-R215 IonicContact OE1-NH2 3.3Å; E211-R215 PolarHBondContact OE1-NH2 2.93Å; E212-R215 CarbonylContact O-C 3.58Å; E212-R215 PolarHBondContact O-N 2.88Å; R215-Q218 PolarHBondContact O-N 3.39Å; R215-K219 WeakPolarHBondContact O-CB 3.48Å; R215-K219 PolarHBondContact O-N 3.49Å |
| 216 | D | 66.2 | Low | 64.6 | Low | 88 Ų | 88 | 113.4 Ų | 113.4 | 47% | 0.471 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -69 | -42.3 | 176.8 | -77 | -25.8 | 0 | 0 | 0 | 111 | E212 Q218 K219 Q220 | E212-D216 PolarHBondContact O-N 3.25Å; D216-Q218 VanDerWaalsContact C-N 3.27Å; D216-Q218 PolarHBondContact O-N 3.21Å; D216-K219 PolarHBondContact O-N 3.42Å; D216-Q220 WeakPolarHBondContact O-CB 3.24Å; D216-Q220 PolarHBondContact O-N 3.41Å |
| 217 | S | 66.9 | Low | 62.3 | Low | 80 Ų | 80 | 113.2 Ų | 113.2 | 56% | 0.559 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -60.4 | -36.4 | 172.3 | -59.1 | 0 | 0 | 0 | 0 | 112.3 | E213 A221 | E213-S217 VanDerWaalsContact O-CB 3.3Å; E213-S217 WeakPolarHBondContact O-CB 3.2Å; E213-S217 PolarHBondContact O-N 3.37Å; E213-S217 PolarHBondContact O-OG 2.91Å; S217-A221 WeakPolarHBondContact O-CB 3.02Å; S217-A221 PolarHBondContact O-N 3.38Å |
| 218 | Q | 57.8 | Low | 60.2 | Low | 138 Ų | 138 | 115.1 Ų | 115.1 | 65% | 0.645 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -78.2 | -31.3 | 178 | -167.5 | 173.1 | -18 | 0 | 0 | 113.2 | K214 R215 D216 S222 | K214-Q218 WeakPolarHBondContact O-CB 3.47Å; K214-Q218 PolarHBondContact O-N 3.06Å; R215-Q218 PolarHBondContact O-N 3.39Å; D216-Q218 VanDerWaalsContact C-N 3.27Å; D216-Q218 PolarHBondContact O-N 3.21Å; Q218-S222 WeakPolarHBondContact O-CB 3.45Å; Q218-S222 PolarHBondContact O-N 2.9Å; Q218-S222 PolarHBondContact O-OG 3.17Å |
| 219 | K | 56.5 | Low | 58.5 | Low | 149 Ų | 149 | 120.3 Ų | 120.3 | 65% | 0.648 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -73.8 | -38.9 | 174.3 | -100.5 | -179.1 | 173.9 | -177.4 | 0 | 112.3 | R215 D216 A221 S222 Q223 | R215-K219 WeakPolarHBondContact O-CB 3.48Å; R215-K219 PolarHBondContact O-N 3.49Å; D216-K219 PolarHBondContact O-N 3.42Å; K219-A221 VanDerWaalsContact C-N 3.28Å; K219-A221 PolarHBondContact O-N 3.27Å; K219-S222 PolarHBondContact O-N 2.87Å; K219-Q223 PolarHBondContact O-N 2.76Å |
| 220 | Q | 51.1 | Low | 56.6 | Low | 165 Ų | 165 | 119.2 Ų | 119.2 | 77% | 0.771 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -66.4 | -32.9 | 176 | -130.5 | 169.8 | 4 | 0 | 0 | 111.6 | D216 | D216-Q220 WeakPolarHBondContact O-CB 3.24Å; D216-Q220 PolarHBondContact O-N 3.41Å |
| 221 | A | 54 | Low | 54.7 | Low | 75 Ų | 75 | 126 Ų | 126 | 62% | 0.62 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -75.3 | -19.3 | 174 | 0 | 0 | 0 | 0 | 0 | 114.7 | S217 K219 | S217-A221 WeakPolarHBondContact O-CB 3.02Å; S217-A221 PolarHBondContact O-N 3.38Å; K219-A221 VanDerWaalsContact C-N 3.28Å; K219-A221 PolarHBondContact O-N 3.27Å |
| 222 | S | 51.5 | Low | 53 | Low | 80 Ų | 80 | 128.3 Ų | 128.3 | 56% | 0.559 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -103.7 | -6.4 | -174.7 | -53.5 | 0 | 0 | 0 | 0 | 114.2 | Q218 K219 | Q218-S222 WeakPolarHBondContact O-CB 3.45Å; Q218-S222 PolarHBondContact O-N 2.9Å; Q218-S222 PolarHBondContact O-OG 3.17Å; K219-S222 PolarHBondContact O-N 2.87Å |
| 223 | Q | 50.4 | Low | 51.5 | Low | 175 Ų | 175 | 128.8 Ų | 128.8 | 82% | 0.818 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -97.5 | 0.2 | -177.3 | -146.6 | 173.4 | -6.4 | 0 | 0 | 114 | K219 | K219-Q223 PolarHBondContact O-N 2.76Š|
| 224 | A | 45.7 | Very low | 50.2 | Low | 94 Ų | 94 | 132.4 Ų | 132.4 | 78% | 0.777 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -96.3 | 1.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 225 | S | 41.9 | Very low | 48.7 | Very low | 86 Ų | 86 | 129.5 Ų | 129.5 | 60% | 0.601 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -138.1 | 53.1 | -165.6 | 40.8 | 0 | 0 | 0 | 0 | 113.3 | ||
| 226 | T | 34.8 | Very low | 47.3 | Very low | 131 Ų | 131 | 127.5 Ų | 127.5 | 80% | 0.804 | 71% | 0.707 | S | S | * | * | trans | -157.4 | 79 | 160.5 | -65.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 227 | T | 33.5 | Very low | 46.4 | Very low | 111 Ų | 111 | 131.4 Ų | 131.4 | 68% | 0.681 | 73% | 0.726 | S | S | * | * | trans | -169.2 | 116.9 | 161.1 | -108.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 228 | F | 40.5 | Very low | 45.2 | Very low | 186 Ų | 186 | 136.6 Ų | 136.6 | 82% | 0.816 | 74% | 0.739 | S | S | * | * | trans | 78.9 | 96.3 | 155.9 | -50 | -54.9 | 0 | 0 | 0 | 121.1 | ||||
| 229 | E | 43.6 | Very low | 44.5 | Very low | 188 Ų | 188 | 136.3 Ų | 136.3 | 88% | 0.879 | 75% | 0.747 | S | S | * | * | trans | -78.7 | 158.3 | 143.7 | -89.5 | -126.9 | 107.4 | 0 | 0 | 111.5 | ||||
| 230 | P | 42.5 | Very low | 43.8 | Very low | 97 Ų | 97 | 134.9 Ų | 134.9 | 63% | 0.63 | 76% | 0.756 | S | S | * | * | trans | -124.6 | 178.9 | -131.5 | 41.3 | -28.9 | 0 | 0 | 0 | 116.4 | ||||
| 231 | K | 40.9 | Very low | 43.5 | Very low | 186 Ų | 186 | 132.1 Ų | 132.1 | 81% | 0.809 | 76% | 0.755 | S | S | * | * | trans | 78 | 138 | 158.7 | -77.9 | 175.6 | 165.7 | 167.8 | 0 | 117.6 | ||||
| 232 | D | 41.6 | Very low | 43.2 | Very low | 133 Ų | 133 | 135.5 Ų | 135.5 | 71% | 0.711 | 77% | 0.767 | S | S | * | * | cis | -165.4 | 164.1 | 16.9 | -123.2 | -58.4 | 0 | 0 | 0 | 107.9 | ||||
| 233 | T | 43.2 | Very low | 43.3 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 76% | 0.761 | 77% | 0.768 | S | S | * | * | trans | 115 | 99.3 | 162.4 | -39.1 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 234 | K | 46.7 | Very low | 43.7 | Very low | 189 Ų | 189 | 133.3 Ų | 133.3 | 82% | 0.822 | 76% | 0.761 | S | S | * | * | trans | 72.2 | 93.1 | 132.3 | -157.7 | 178.7 | -174.1 | -176.9 | 0 | 121.7 | ||||
| 235 | A | 42.8 | Very low | 44.4 | Very low | 91 Ų | 91 | 135.4 Ų | 135.4 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | 61.9 | 162.2 | 122.6 | 0 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 236 | P | 40.7 | Very low | 45.1 | Very low | 111 Ų | 111 | 138.6 Ų | 138.6 | 72% | 0.721 | 76% | 0.76 | S | S | * | * | -131.5 | 155.5 | -79.8 | 35.9 | -19.1 | 0 | 0 | 0 | 113.1 | |||||
| 237 | I | 48 | Very low | 46.3 | Very low | 170 Ų | 170 | 137.6 Ų | 137.6 | 87% | 0.872 | 75% | 0.749 | S | S | * | * | trans | -162.8 | 109.6 | 152.6 | -84.9 | 129 | 0 | 0 | 0 | 109.8 | ||||
| 238 | K | 40.8 | Very low | 48.1 | Very low | 190 Ų | 190 | 137.9 Ų | 137.9 | 83% | 0.826 | 75% | 0.746 | S | S | * | * | 32.8 | 110 | 123.7 | -130.7 | 173.1 | -173.7 | 177.1 | 0 | 118.3 | |||||
| 239 | T | 44.3 | Very low | 49.3 | Very low | 132 Ų | 132 | 133.9 Ų | 133.9 | 81% | 0.81 | 73% | 0.733 | S | S | * | * | 177.1 | 114.6 | 116.4 | 33.3 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 240 | S | 41.4 | Very low | 50.4 | Low | 119 Ų | 119 | 129.8 Ų | 129.8 | 83% | 0.832 | 72% | 0.721 | S | S | * | * | trans | 26.6 | 114 | 136.8 | -42.6 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 241 | S | 44.2 | Very low | 51.3 | Low | 107 Ų | 107 | 133.8 Ų | 133.8 | 75% | 0.748 | 73% | 0.729 | S | S | * | * | 168.7 | 100.6 | 121.3 | -169.4 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 242 | T | 47.5 | Very low | 52.4 | Low | 145 Ų | 145 | 131.5 Ų | 131.5 | 89% | 0.89 | 73% | 0.725 | S | S | * | * | trans | -94.4 | 109.9 | 173.7 | 43.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 243 | N | 55.1 | Low | 53.3 | Low | 105 Ų | 105 | 132.1 Ų | 132.1 | 56% | 0.561 | 73% | 0.727 | S | S | * | * | trans | -73.5 | 139.2 | 171.1 | -80.6 | -34.1 | 0 | 0 | 0 | 110.2 | E245 | N243-E245 HydrophobicContact CB-CG 4.39Å; N243-E245 PolarHBondContact O-N 3.02Å | ||
| 244 | P | 59 | Low | 53.9 | Low | 104 Ų | 104 | 128.2 Ų | 128.2 | 68% | 0.675 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -72.9 | 9.1 | -178.6 | 31.4 | -36.5 | 0 | 0 | 0 | 114.5 | ||
| 245 | E | 59.2 | Low | 54.2 | Low | 138 Ų | 138 | 126.7 Ų | 126.7 | 65% | 0.645 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -88.6 | -11.5 | -169 | -53 | -178.9 | -179.2 | 0 | 0 | 112.9 | N243 | N243-E245 HydrophobicContact CB-CG 4.39Å; N243-E245 PolarHBondContact O-N 3.02Å |
| 246 | H | 56.5 | Low | 54.8 | Low | 154 Ų | 154 | 130.3 Ų | 130.3 | 71% | 0.713 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -94.4 | -2.9 | 175.7 | -72.8 | 60.5 | 0 | 0 | 0 | 113.4 | ||
| 247 | D | 61.5 | Low | 55.6 | Low | 109 Ų | 109 | 128.3 Ų | 128.3 | 58% | 0.583 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -90 | -15.7 | -176.8 | -155.5 | 35.4 | 0 | 0 | 0 | 112.4 | F251 | D247-F251 PolarHBondContact O-N 2.86Å |
| 248 | L | 70.5 | Confident | 55.8 | Low | 117 Ų | 117 | 125.4 Ų | 125.4 | 61% | 0.613 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -72 | -36.2 | 175.8 | -75.6 | 165.9 | 0 | 0 | 0 | 112.1 | F251 L252 | L248-F251 PolarHBondContact O-N 3.47Å; L248-L252 WeakPolarHBondContact O-CB 3.47Å; L248-L252 PolarHBondContact O-N 3.24Å |
| 249 | D | 66.3 | Low | 56.5 | Low | 102 Ų | 102 | 124 Ų | 124 | 55% | 0.545 | 72% | 0.715 | S | S | . | * | H | α-helix | trans | -71.9 | -31.4 | -179.8 | -63.7 | -27.6 | 0 | 0 | 0 | 112 | L252 L253 | D249-L252 PolarHBondContact O-N 3.14Å; D249-L253 WeakPolarHBondContact O-CB 3.39Å; D249-L253 WeakPolarHBondContact O-CD1 3.33Å; D249-L253 PolarHBondContact O-N 2.89Å |
| 250 | V | 66.8 | Low | 57.3 | Low | 102 Ų | 102 | 125.2 Ų | 125.2 | 62% | 0.618 | 72% | 0.716 | S | S | * | * | H | α-helix | trans | -71.7 | -35.5 | 175.1 | 174.2 | 0 | 0 | 0 | 0 | 111.3 | ||
| 251 | F | 61.4 | Low | 58 | Low | 181 Ų | 181 | 128.4 Ų | 128.4 | 79% | 0.794 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -74 | -30.6 | 174.7 | -128.7 | -93.4 | 0 | 0 | 0 | 112.7 | D247 L248 | D247-F251 PolarHBondContact O-N 2.86Å; L248-F251 PolarHBondContact O-N 3.47Å |
| 252 | L | 62.5 | Low | 58.7 | Low | 139 Ų | 139 | 126.8 Ų | 126.8 | 73% | 0.728 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -77.6 | -31.4 | 175.3 | -92.3 | 154.5 | 0 | 0 | 0 | 113.3 | L248 D249 G254 | L248-L252 WeakPolarHBondContact O-CB 3.47Å; L248-L252 PolarHBondContact O-N 3.24Å; D249-L252 PolarHBondContact O-N 3.14Å; L252-G254 PolarHBondContact O-N 3Å |
| 253 | L | 61.8 | Low | 59.3 | Low | 145 Ų | 145 | 125.6 Ų | 125.6 | 76% | 0.759 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | 27.5 | 171.8 | -92.7 | 94.4 | 0 | 0 | 0 | 113 | D249 D255 | D249-L253 WeakPolarHBondContact O-CB 3.39Å; D249-L253 WeakPolarHBondContact O-CD1 3.33Å; D249-L253 PolarHBondContact O-N 2.89Å; L253-D255 PolarHBondContact O-N 3.11Å |
| 254 | G | 54.4 | Low | 59.4 | Low | 43 Ų | 43 | 126.9 Ų | 126.9 | 44% | 0.443 | 72% | 0.724 | S | S | . | * | trans | -13.3 | 99.4 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L252 L256 | L252-G254 PolarHBondContact O-N 3Å; G254-L256 PolarHBondContact O-N 3.23Å | ||
| 255 | D | 53.5 | Low | 59.3 | Low | 157 Ų | 157 | 128.6 Ų | 128.6 | 84% | 0.84 | 73% | 0.728 | S | S | * | * | trans | -45.4 | 87.6 | 171.2 | -178.4 | 31.6 | 0 | 0 | 0 | 108.7 | L253 G257 | L253-D255 PolarHBondContact O-N 3.11Å; D255-G257 PolarHBondContact O-N 3.35Å | ||
| 256 | L | 55.6 | Low | 59 | Low | 167 Ų | 167 | 129.7 Ų | 129.7 | 87% | 0.874 | 74% | 0.738 | S | S | * | * | trans | -75.1 | 81.1 | 172 | -73.7 | 176.6 | 0 | 0 | 0 | 106.4 | G254 S258 | G254-L256 PolarHBondContact O-N 3.23Å; L256-S258 PolarHBondContact O-N 3.22Å | ||
| 257 | G | 56.4 | Low | 59 | Low | 69 Ų | 69 | 128.6 Ų | 128.6 | 71% | 0.711 | 74% | 0.737 | S | S | * | * | trans | -48.3 | 108.9 | 160.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | D255 | D255-G257 PolarHBondContact O-N 3.35Š| ||
| 258 | S | 53 | Low | 58.8 | Low | 109 Ų | 109 | 131 Ų | 131 | 76% | 0.762 | 75% | 0.75 | S | S | * | * | trans | -73 | 130.4 | 172.5 | 57.1 | 0 | 0 | 0 | 0 | 109.8 | L256 | L256-S258 PolarHBondContact O-N 3.22Š| ||
| 259 | D | 55.5 | Low | 58.2 | Low | 161 Ų | 161 | 131.7 Ų | 131.7 | 86% | 0.861 | 75% | 0.754 | S | S | * | * | trans | 81.8 | 95.4 | 140.3 | -132.8 | 63.9 | 0 | 0 | 0 | 117.3 | ||||
| 260 | D | 61 | Low | 57.7 | Low | 156 Ų | 156 | 135 Ų | 135 | 83% | 0.834 | 77% | 0.771 | S | S | * | * | trans | -156.2 | 95.2 | 150.4 | -163.3 | 46.3 | 0 | 0 | 0 | 111.6 | ||||
| 261 | E | 57 | Low | 57.3 | Low | 187 Ų | 187 | 135.9 Ų | 135.9 | 87% | 0.874 | 77% | 0.772 | S | S | * | * | trans | 43.7 | 124.2 | 134.8 | -148.4 | 159.8 | 104.2 | 0 | 0 | 122.3 | ||||
| 262 | G | 57.9 | Low | 57.2 | Low | 73 Ų | 73 | 136 Ų | 136 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | trans | 158.5 | 108.9 | 153.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 263 | P | 59.5 | Low | 57.3 | Low | 119 Ų | 119 | 136.3 Ų | 136.3 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | trans | -103.8 | 152.6 | -174.6 | 38.1 | -30.3 | 0 | 0 | 0 | 113.7 | ||||
| 264 | V | 58.6 | Low | 57.3 | Low | 133 Ų | 133 | 139.9 Ų | 139.9 | 81% | 0.806 | 79% | 0.787 | S | S | * | * | trans | -164.2 | 114.1 | 151.1 | -78.2 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 265 | D | 56.5 | Low | 57.8 | Low | 140 Ų | 140 | 145.9 Ų | 145.9 | 75% | 0.749 | 81% | 0.81 | S | S | * | * | 57.4 | 105.7 | 97.4 | -86.4 | -66.5 | 0 | 0 | 0 | 112.5 | |||||
| 266 | D | 53.2 | Low | 58.3 | Low | 160 Ų | 160 | 146.8 Ų | 146.8 | 86% | 0.856 | 81% | 0.806 | S | S | * | * | -174.3 | 128.2 | 110.9 | -109.3 | -74.4 | 0 | 0 | 0 | 109.6 | |||||
| 267 | D | 56 | Low | 58.7 | Low | 132 Ų | 132 | 147.2 Ų | 147.2 | 71% | 0.706 | 81% | 0.807 | S | S | * | * | trans | -60.4 | 145.6 | 171.7 | -62.3 | -83.9 | 0 | 0 | 0 | 112 | ||||
| 268 | D | 56.3 | Low | 58.6 | Low | 160 Ų | 160 | 151.1 Ų | 151.1 | 86% | 0.856 | 81% | 0.812 | S | S | * | * | trans | -170.9 | 86.3 | 142.4 | -94.9 | -39.7 | 0 | 0 | 0 | 109.8 | ||||
| 269 | D | 58 | Low | 58.5 | Low | 130 Ų | 130 | 151.5 Ų | 151.5 | 70% | 0.695 | 81% | 0.81 | S | S | * | * | trans | 1.2 | 107.8 | 130.7 | -140.9 | -100.9 | 0 | 0 | 0 | 115.7 | ||||
| 270 | L | 57.1 | Low | 58.2 | Low | 172 Ų | 172 | 149.5 Ų | 149.5 | 90% | 0.901 | 80% | 0.803 | S | S | * | * | trans | -147.2 | 81.9 | 153.9 | -75 | -174.1 | 0 | 0 | 0 | 109.2 | ||||
| 271 | D | 57.7 | Low | 57.8 | Low | 121 Ų | 121 | 148.7 Ų | 148.7 | 65% | 0.647 | 80% | 0.804 | S | S | * | * | trans | -69 | 160.4 | 159.7 | -63.1 | -41 | 0 | 0 | 0 | 110.9 | ||||
| 272 | E | 59.7 | Low | 57.5 | Low | 183 Ų | 183 | 143 Ų | 143 | 86% | 0.855 | 80% | 0.795 | S | S | * | * | trans | 70.1 | 87.2 | 153.1 | -64.8 | 171.9 | -176.9 | 0 | 0 | 119.7 | ||||
| 273 | D | 65 | Low | 57.4 | Low | 146 Ų | 146 | 147.6 Ų | 147.6 | 78% | 0.781 | 80% | 0.802 | S | S | * | * | trans | -167.9 | 28.2 | 142.6 | -123.8 | -8.5 | 0 | 0 | 0 | 119.7 | ||||
| 274 | F | 62.2 | Low | 57.2 | Low | 219 Ų | 219 | 151 Ų | 151 | 96% | 0.961 | 81% | 0.808 | S | S | * | * | trans | -92.7 | 15.8 | -179.7 | -111.3 | -87.3 | 0 | 0 | 0 | 116.8 | ||||
| 275 | D | 64.7 | Low | 57.1 | Low | 170 Ų | 170 | 150.4 Ų | 150.4 | 91% | 0.909 | 81% | 0.809 | S | S | * | * | trans | -104.4 | 28.1 | -178.1 | -90.9 | -24.7 | 0 | 0 | 0 | 115 | ||||
| 276 | K | 64 | Low | 57.2 | Low | 175 Ų | 175 | 150.7 Ų | 150.7 | 76% | 0.761 | 81% | 0.81 | S | S | * | * | trans | -137.6 | 53.6 | -174.3 | -155.5 | 173.6 | -179.2 | 178 | 0 | 116.8 | ||||
| 277 | I | 64.2 | Low | 57.6 | Low | 176 Ų | 176 | 149.2 Ų | 149.2 | 90% | 0.903 | 80% | 0.803 | S | S | * | * | trans | -114.3 | 75.6 | 157 | 62.9 | 132.6 | 0 | 0 | 0 | 110.6 | ||||
| 278 | D | 53.2 | Low | 58 | Low | 152 Ų | 152 | 150 Ų | 150 | 81% | 0.813 | 81% | 0.807 | S | S | * | * | trans | -72.4 | 143.5 | 169.3 | -149.3 | -11.6 | 0 | 0 | 0 | 110.3 | ||||
| 279 | V | 50.2 | Low | 58 | Low | 117 Ų | 117 | 149.8 Ų | 149.8 | 71% | 0.709 | 81% | 0.806 | S | S | * | * | trans | -59.9 | 127.5 | 171 | 162.3 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 280 | T | 50.2 | Low | 58.3 | Low | 118 Ų | 118 | 152.2 Ų | 152.2 | 72% | 0.724 | 81% | 0.81 | S | S | * | * | trans | 171.1 | 132.2 | 135.3 | 35.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 281 | T | 53.1 | Low | 58.2 | Low | 140 Ų | 140 | 153.6 Ų | 153.6 | 86% | 0.859 | 81% | 0.809 | S | S | * | * | trans | 70.1 | 127.8 | 141.3 | 61 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 282 | G | 50.8 | Low | 58.3 | Low | 67 Ų | 67 | 154.6 Ų | 154.6 | 69% | 0.691 | 81% | 0.813 | S | S | * | * | trans | 160.7 | 125 | 147.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 283 | L | 56 | Low | 58 | Low | 169 Ų | 169 | 149.4 Ų | 149.4 | 89% | 0.885 | 80% | 0.801 | S | S | * | * | trans | 84.2 | 100.5 | 173.9 | -72.2 | 87.8 | 0 | 0 | 0 | 115.3 | ||||
| 284 | E | 55.2 | Low | 57.3 | Low | 192 Ų | 192 | 149.4 Ų | 149.4 | 90% | 0.897 | 81% | 0.807 | S | S | * | * | cis | 69.6 | 131.3 | 37.8 | -78.9 | -171.9 | 115.5 | 0 | 0 | 117.6 | ||||
| 285 | S | 55.8 | Low | 56.9 | Low | 119 Ų | 119 | 142.4 Ų | 142.4 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | trans | 97.6 | 105.5 | 161.2 | -139.4 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 286 | D | 59.1 | Low | 56.4 | Low | 146 Ų | 146 | 144.2 Ų | 144.2 | 78% | 0.781 | 80% | 0.796 | S | S | * | * | 98.8 | 155.4 | 53.3 | -136.7 | -72 | 0 | 0 | 0 | 113 | |||||
| 287 | D | 61.5 | Low | 56 | Low | 130 Ų | 130 | 139.8 Ų | 139.8 | 70% | 0.695 | 79% | 0.792 | S | S | * | * | trans | 77.1 | 133.8 | -178.8 | -73.3 | -65 | 0 | 0 | 0 | 118.4 | ||||
| 288 | D | 63.9 | Low | 55.7 | Low | 148 Ų | 148 | 140.1 Ų | 140.1 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | cis | -165.9 | 144.1 | 21.5 | -128.7 | -50.1 | 0 | 0 | 0 | 110.9 | ||||
| 289 | D | 56.7 | Low | 56.5 | Low | 155 Ų | 155 | 141 Ų | 141 | 83% | 0.829 | 79% | 0.794 | S | S | * | * | trans | -93.3 | 130.1 | 177.6 | -121.3 | -54.5 | 0 | 0 | 0 | 110.6 | ||||
| 290 | K | 64.5 | Low | 57.2 | Low | 181 Ų | 181 | 138.9 Ų | 138.9 | 79% | 0.787 | 79% | 0.789 | S | S | * | * | trans | -149.9 | 96.8 | 164.2 | -146.7 | 174.2 | -169.1 | 175 | 0 | 115.3 | I292 | K290-I292 HydrophobicContact CG-CG1 4.43Š| ||
| 291 | K | 54.6 | Low | 57.5 | Low | 201 Ų | 201 | 146.5 Ų | 146.5 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -63.8 | 129.8 | 151.5 | -90.6 | -176.1 | 175.3 | 176.9 | 0 | 110.4 | ||||
| 292 | I | 59.6 | Low | 57.7 | Low | 143 Ų | 143 | 146.8 Ų | 146.8 | 73% | 0.733 | 81% | 0.81 | S | S | * | * | trans | -133.6 | 127.3 | 149 | -64.8 | -169.3 | 0 | 0 | 0 | 109.3 | K290 | K290-I292 HydrophobicContact CG-CG1 4.43Š| ||
| 293 | A | 54.4 | Low | 58.1 | Low | 74 Ų | 74 | 151 Ų | 151 | 61% | 0.612 | 82% | 0.816 | S | S | * | * | trans | -90 | 159.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 294 | T | 49.8 | Very low | 58.2 | Low | 146 Ų | 146 | 150 Ų | 150 | 90% | 0.896 | 81% | 0.812 | S | S | * | * | trans | 68.3 | 116.5 | 143.8 | 35.5 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 295 | G | 53.8 | Low | 58.4 | Low | 71 Ų | 71 | 147.5 Ų | 147.5 | 73% | 0.732 | 81% | 0.807 | S | S | * | * | trans | -177.8 | 104.1 | 145.2 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 296 | K | 52.9 | Low | 58.5 | Low | 208 Ų | 208 | 149.3 Ų | 149.3 | 90% | 0.904 | 81% | 0.806 | S | S | * | * | 62.2 | 126.6 | 53.3 | -143 | -172.4 | -175.3 | -174.4 | 0 | 113.8 | |||||
| 297 | A | 57.3 | Low | 58.5 | Low | 83 Ų | 83 | 149.5 Ų | 149.5 | 69% | 0.686 | 81% | 0.807 | S | S | * | * | trans | 91.6 | 105.6 | 165.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 298 | E | 58 | Low | 58.3 | Low | 182 Ų | 182 | 150.9 Ų | 150.9 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | 88.6 | 104 | 69.2 | -171.2 | -178.9 | 169.8 | 0 | 0 | 109.5 | |||||
| 299 | D | 68.2 | Low | 57.9 | Low | 170 Ų | 170 | 151.2 Ų | 151.2 | 91% | 0.909 | 82% | 0.817 | S | S | * | * | trans | -138.7 | 139 | 152.3 | -136.6 | -60.7 | 0 | 0 | 0 | 108.8 | ||||
| 300 | A | 66.8 | Low | 58 | Low | 73 Ų | 73 | 150.8 Ų | 150.8 | 60% | 0.603 | 82% | 0.816 | S | S | * | * | trans | -113.1 | 144.8 | -147.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 301 | K | 55.5 | Low | 57.4 | Low | 278 Ų | 278 | 148.1 Ų | 148.1 | 100% | 1.209 | 82% | 0.819 | S | S | * | * | trans | 74.8 | 0 | 151.7 | -161.3 | 160.7 | -173.2 | 165 | 0 | 119 |
Retrieved 301 of 301 residues in 104.6 ms
(Link to these results)