| 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 | 35.6 | Very low | 50.1 | Low | 239 Ų | 239 | 157.2 Ų | 157.2 | 100% | 1.177 | 83% | 0.828 | S | S | * | * | 0 | 128.5 | 0 | -65.4 | 171.5 | 150.2 | 0 | 0 | 105.8 | |||||
| 2 | T | 39.8 | Very low | 50.5 | Low | 126 Ų | 126 | 154.5 Ų | 154.5 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | cis | -166.2 | 156 | -9.4 | 11.7 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 3 | A | 47.9 | Very low | 51.2 | Low | 97 Ų | 97 | 149.1 Ų | 149.1 | 80% | 0.802 | 78% | 0.78 | S | S | * | * | trans | -67.2 | 133.2 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 4 | E | 46.1 | Very low | 51.1 | Low | 167 Ų | 167 | 148.5 Ų | 148.5 | 78% | 0.78 | 79% | 0.79 | S | S | * | * | trans | -149.9 | 54.1 | 167.4 | 64.2 | -150.2 | 150.9 | 0 | 0 | 111.2 | ||||
| 5 | W | 47.7 | Very low | 51.5 | Low | 258 Ų | 258 | 144.1 Ų | 144.1 | 98% | 0.977 | 79% | 0.794 | S | S | * | * | trans | -123.1 | 21.7 | 162.9 | -70.8 | 100.2 | 0 | 0 | 0 | 111.7 | ||||
| 6 | L | 51.4 | Low | 51.9 | Low | 137 Ų | 137 | 139.6 Ų | 139.6 | 72% | 0.717 | 77% | 0.772 | S | S | * | * | trans | -78.2 | 143.1 | 162.3 | -64.9 | 174.2 | 0 | 0 | 0 | 107.4 | ||||
| 7 | H | 53.2 | Low | 52.3 | Low | 171 Ų | 171 | 134.1 Ų | 134.1 | 79% | 0.792 | 76% | 0.755 | S | S | * | * | trans | 95.6 | 54.9 | 166.2 | -48.6 | -86.9 | 0 | 0 | 0 | 118.8 | ||||
| 8 | L | 50.8 | Low | 52.7 | Low | 175 Ų | 175 | 132.4 Ų | 132.4 | 92% | 0.916 | 75% | 0.75 | S | S | * | * | trans | -144.2 | 49.3 | 147.1 | -82.1 | 179.9 | 0 | 0 | 0 | 112.2 | ||||
| 9 | L | 54.9 | Low | 52.8 | Low | 124 Ų | 124 | 130.7 Ų | 130.7 | 65% | 0.649 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -86.9 | 141.9 | 158.5 | -89.8 | 79.6 | 0 | 0 | 0 | 109.1 | Y12 | L9-Y12 HydrophobicContact CD2-CE2 3.85Å; L9-Y12 WeakPolarHBondContact CD2-OH 3.37Å |
| 10 | P | 61.4 | Low | 53.1 | Low | 104 Ų | 104 | 133 Ų | 133 | 68% | 0.675 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 146 | 171.9 | -19.8 | 29.8 | 0 | 0 | 0 | 110.6 | Y12 | P10-Y12 PolarHBondContact O-N 3.01Å; P10-Y12 VanDerWaalsContact O-N 3.09Å |
| 11 | P | 62.4 | Low | 53.7 | Low | 131 Ų | 131 | 128.7 Ų | 128.7 | 85% | 0.851 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -62 | 118.3 | 176.6 | 25.2 | -31.1 | 0 | 0 | 0 | 109.3 | ||
| 12 | Y | 55.2 | Low | 55.5 | Low | 125 Ų | 125 | 121.4 Ų | 121.4 | 49% | 0.49 | 70% | 0.699 | S | S | . | * | P | Polyproline II helix | trans | -61.2 | 145.1 | 174.8 | -76.3 | -90.4 | 0 | 0 | 0 | 110.5 | L9 P10 | L9-Y12 HydrophobicContact CD2-CE2 3.85Å; L9-Y12 WeakPolarHBondContact CD2-OH 3.37Å; P10-Y12 PolarHBondContact O-N 3.01Å; P10-Y12 VanDerWaalsContact O-N 3.09Å |
| 13 | P | 59.3 | Low | 57.4 | Low | 84 Ų | 84 | 120.9 Ų | 120.9 | 55% | 0.545 | 69% | 0.688 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 143.9 | 176.4 | 24.9 | -32.9 | 0 | 0 | 0 | 110.8 | G15 V16 | P13-G15 PolarHBondContact O-N 2.93Å; P13-G15 VanDerWaalsContact O-N 3.15Å; P13-V16 PolarHBondContact O-N 3.42Å |
| 14 | P | 49.2 | Very low | 59.1 | Low | 141 Ų | 141 | 119.3 Ų | 119.3 | 92% | 0.916 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | 120.5 | 179.2 | -22.7 | 32.4 | 0 | 0 | 0 | 111.3 | ||
| 15 | G | 57.6 | Low | 60.8 | Low | 83 Ų | 83 | 116.8 Ų | 116.8 | 86% | 0.856 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 115.1 | -13.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | P13 | P13-G15 PolarHBondContact O-N 2.93Å; P13-G15 VanDerWaalsContact O-N 3.15Å |
| 16 | V | 57.9 | Low | 62.7 | Low | 72 Ų | 72 | 107.4 Ų | 107.4 | 44% | 0.436 | 63% | 0.631 | S | S | . | * | trans | -112.9 | 81.3 | 171.6 | -167.3 | 0 | 0 | 0 | 0 | 107.5 | P13 L19 | P13-V16 PolarHBondContact O-N 3.42Å; V16-L19 HydrophobicContact CG1-CD1 4.06Å; V16-L19 HydrophobicContact CG1-CG 4.29Å | ||
| 17 | G | 58.7 | Low | 64.6 | Low | 46 Ų | 46 | 109 Ų | 109 | 47% | 0.474 | 63% | 0.628 | S | S | . | * | trans | -58.4 | 166.4 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110 | L19 | G17-L19 PolarHBondContact O-N 3.21Š| ||
| 18 | P | 58.8 | Low | 66.4 | Low | 104 Ų | 104 | 107 Ų | 107 | 68% | 0.675 | 61% | 0.614 | S | S | * | * | trans | -56.1 | 101.2 | 176.4 | -20.1 | 31.3 | 0 | 0 | 0 | 109.2 | Y20 | P18-Y20 PolarHBondContact O-N 3.47Š| ||
| 19 | L | 55.6 | Low | 68.3 | Low | 99 Ų | 99 | 103.7 Ų | 103.7 | 52% | 0.518 | 59% | 0.594 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -67.4 | 20.4 | 169.2 | -67.6 | 174.8 | 0 | 0 | 0 | 111.2 | V16 G17 | V16-L19 HydrophobicContact CG1-CD1 4.06Å; V16-L19 HydrophobicContact CG1-CG 4.29Å; G17-L19 PolarHBondContact O-N 3.21Å |
| 20 | Y | 58.4 | Low | 70.1 | Confident | 177 Ų | 177 | 101.9 Ų | 101.9 | 69% | 0.694 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | 2.7 | -167.1 | -112 | -90.8 | 0 | 0 | 0 | 113.4 | P18 L24 | P18-Y20 PolarHBondContact O-N 3.47Å; Y20-L24 HydrophobicContact CD1-CD2 3.93Å; Y20-L24 HydrophobicContact CE1-CD2 4.29Å; Y20-L24 WeakPolarHBondContact O-CD2 3.33Å |
| 21 | G | 65 | Low | 71.6 | Confident | 42 Ų | 42 | 100.2 Ų | 100.2 | 43% | 0.433 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -111.7 | -78 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | E25 | G21-E25 WeakPolarHBondContact O-CB 3.35Å; G21-E25 PolarHBondContact O-N 3.29Å |
| 22 | A | 73.4 | Confident | 72.8 | Confident | 86 Ų | 86 | 99.4 Ų | 99.4 | 71% | 0.711 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -70.4 | -42.8 | -168 | 0 | 0 | 0 | 0 | 0 | 114.4 | A26 | A22-A26 WeakPolarHBondContact O-CB 3.47Å; A22-A26 PolarHBondContact O-N 3.16Å |
| 23 | E | 81.3 | Confident | 74.3 | Confident | 115 Ų | 115 | 98.7 Ų | 98.7 | 54% | 0.537 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -72.2 | -36.1 | 178.2 | -68.6 | -177 | 174.3 | 0 | 0 | 111.8 | A26 W27 | E23-A26 PolarHBondContact O-N 2.88Å; E23-W27 PolarHBondContact O-N 3.47Å |
| 24 | L | 83.9 | Confident | 75.7 | Confident | 65 Ų | 65 | 99.5 Ų | 99.5 | 34% | 0.34 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.3 | -42.2 | 175.5 | -174.2 | 64.2 | 0 | 0 | 0 | 111.3 | Y20 W27 Y28 | Y20-L24 HydrophobicContact CD1-CD2 3.93Å; Y20-L24 HydrophobicContact CE1-CD2 4.29Å; Y20-L24 WeakPolarHBondContact O-CD2 3.33Å; L24-W27 WeakPolarHBondContact O-CB 3.43Å; L24-W27 PolarHBondContact O-N 3.09Å; L24-Y28 HydrophobicContact CD1-CD2 4.22Å; L24-Y28 HydrophobicContact CD1-CE2 3.68Å; L24-Y28 HydrophobicContact CD2-CE2 4.09Å; L24-Y28 HydrophobicContact CG-CD2 3.92Å; L24-Y28 HydrophobicContact CG-CE2 3.59Å; L24-Y28 WeakPolarHBondContact O-CD2 3.46Å; L24-Y28 PolarHBondContact O-N 3.39Å |
| 25 | E | 80.8 | Confident | 77.4 | Confident | 114 Ų | 114 | 98.9 Ų | 98.9 | 53% | 0.533 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.3 | -42.6 | 174.3 | -167.2 | 68.9 | -161.7 | 0 | 0 | 111.2 | G21 W27 Y28 E29 | G21-E25 WeakPolarHBondContact O-CB 3.35Å; G21-E25 PolarHBondContact O-N 3.29Å; E25-W27 VanDerWaalsContact C-N 3.28Å; E25-W27 PolarHBondContact O-N 3.34Å; E25-Y28 PolarHBondContact O-N 3.28Å; E25-Y28 VanDerWaalsContact O-N 3.13Å; E25-E29 WeakPolarHBondContact O-CG 3.3Å; E25-E29 PolarHBondContact O-N 3.06Å |
| 26 | A | 88.4 | Confident | 78.1 | Confident | 60 Ų | 60 | 97.1 Ų | 97.1 | 50% | 0.496 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.1 | -37.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A22 E23 D30 | A22-A26 WeakPolarHBondContact O-CB 3.47Å; A22-A26 PolarHBondContact O-N 3.16Å; E23-A26 PolarHBondContact O-N 2.88Å; A26-D30 WeakPolarHBondContact O-CB 3.14Å; A26-D30 PolarHBondContact O-N 2.73Å |
| 27 | W | 91.3 | Very high | 78.5 | Confident | 170 Ų | 170 | 98 Ų | 98 | 64% | 0.644 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -66.2 | -40 | 172.9 | -103.5 | 96 | 0 | 0 | 0 | 112.8 | E23 L24 E25 L31 | E23-W27 PolarHBondContact O-N 3.47Å; L24-W27 WeakPolarHBondContact O-CB 3.43Å; L24-W27 PolarHBondContact O-N 3.09Å; E25-W27 VanDerWaalsContact C-N 3.28Å; E25-W27 PolarHBondContact O-N 3.34Å; W27-L31 HydrophobicContact CE3-CD1 4.16Å; W27-L31 HydrophobicContact CE3-CG 4.19Å; W27-L31 HydrophobicContact CZ3-CD2 4.49Å; W27-L31 WeakPolarHBondContact O-CB 3.2Å; W27-L31 VanDerWaalsContact O-CG 3.24Å; W27-L31 WeakPolarHBondContact O-CG 3.43Å; W27-L31 PolarHBondContact O-N 3.19Å |
| 28 | Y | 89.4 | Confident | 78.8 | Confident | 130 Ų | 130 | 103.1 Ų | 103.1 | 51% | 0.51 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69 | -36.1 | 176.6 | -80.5 | -63.4 | 0 | 0 | 0 | 112.6 | L24 E25 Q32 | L24-Y28 HydrophobicContact CD1-CD2 4.22Å; L24-Y28 HydrophobicContact CD1-CE2 3.68Å; L24-Y28 HydrophobicContact CD2-CE2 4.09Å; L24-Y28 HydrophobicContact CG-CD2 3.92Å; L24-Y28 HydrophobicContact CG-CE2 3.59Å; L24-Y28 WeakPolarHBondContact O-CD2 3.46Å; L24-Y28 PolarHBondContact O-N 3.39Å; E25-Y28 PolarHBondContact O-N 3.28Å; E25-Y28 VanDerWaalsContact O-N 3.13Å; Y28-Q32 WeakPolarHBondContact O-CB 3.25Å; Y28-Q32 VanDerWaalsContact O-CG 3.25Å; Y28-Q32 WeakPolarHBondContact O-CG 3.28Å; Y28-Q32 PolarHBondContact O-N 3.31Å; Y28-Q32 PolarHBondContact O-NE2 3.35Å |
| 29 | E | 91.2 | Very high | 78.8 | Confident | 105 Ų | 105 | 104.2 Ų | 104.2 | 49% | 0.491 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.3 | -45.9 | 173.3 | -74.2 | -67.5 | 115.2 | 0 | 0 | 111.4 | E25 L31 Q32 D33 | E25-E29 WeakPolarHBondContact O-CG 3.3Å; E25-E29 PolarHBondContact O-N 3.06Å; E29-L31 PolarHBondContact O-N 3.13Å; E29-Q32 WeakPolarHBondContact O-CB 3.39Å; E29-Q32 PolarHBondContact O-N 2.7Å; E29-Q32 VanDerWaalsContact O-N 3.11Å; E29-D33 PolarHBondContact O-N 2.86Å |
| 30 | D | 92.4 | Very high | 79 | Confident | 86 Ų | 86 | 103 Ų | 103 | 46% | 0.46 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -62.5 | -42.4 | 178 | -167.9 | 56 | 0 | 0 | 0 | 111.7 | A26 Q32 D33 I34 | A26-D30 WeakPolarHBondContact O-CB 3.14Å; A26-D30 PolarHBondContact O-N 2.73Å; D30-Q32 VanDerWaalsContact C-N 3.3Å; D30-Q32 PolarHBondContact O-N 2.82Å; D30-D33 PolarHBondContact O-N 2.99Å; D30-I34 WeakPolarHBondContact O-CD1 3.41Å; D30-I34 VanDerWaalsContact O-CG1 3.26Å; D30-I34 WeakPolarHBondContact O-CG1 3.24Å; D30-I34 PolarHBondContact O-N 2.98Å |
| 31 | L | 92.7 | Very high | 78.6 | Confident | 70 Ų | 70 | 97.8 Ų | 97.8 | 37% | 0.366 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.4 | -35.2 | 174 | -73.4 | 172 | 0 | 0 | 0 | 112.6 | W27 E29 L35 | W27-L31 HydrophobicContact CE3-CD1 4.16Å; W27-L31 HydrophobicContact CE3-CG 4.19Å; W27-L31 HydrophobicContact CZ3-CD2 4.49Å; W27-L31 WeakPolarHBondContact O-CB 3.2Å; W27-L31 VanDerWaalsContact O-CG 3.24Å; W27-L31 WeakPolarHBondContact O-CG 3.43Å; W27-L31 PolarHBondContact O-N 3.19Å; E29-L31 PolarHBondContact O-N 3.13Å; L31-L35 VanDerWaalsContact O-CB 3.28Å; L31-L35 WeakPolarHBondContact O-CB 3.42Å; L31-L35 WeakPolarHBondContact O-CD1 3.45Å; L31-L35 WeakPolarHBondContact O-CG 3.43Å; L31-L35 PolarHBondContact O-N 2.88Å |
| 32 | Q | 88.1 | Confident | 77.9 | Confident | 114 Ų | 114 | 100.9 Ų | 100.9 | 53% | 0.533 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -70.4 | -36 | 175.3 | -78.2 | 174.9 | 70.1 | 0 | 0 | 112.4 | Y28 E29 D30 G36 | Y28-Q32 WeakPolarHBondContact O-CB 3.25Å; Y28-Q32 VanDerWaalsContact O-CG 3.25Å; Y28-Q32 WeakPolarHBondContact O-CG 3.28Å; Y28-Q32 PolarHBondContact O-N 3.31Å; Y28-Q32 PolarHBondContact O-NE2 3.35Å; E29-Q32 WeakPolarHBondContact O-CB 3.39Å; E29-Q32 PolarHBondContact O-N 2.7Å; E29-Q32 VanDerWaalsContact O-N 3.11Å; D30-Q32 VanDerWaalsContact C-N 3.3Å; D30-Q32 PolarHBondContact O-N 2.82Å; Q32-G36 VanDerWaalsContact O-CA 3.29Å; Q32-G36 WeakPolarHBondContact O-CA 3.29Å; Q32-G36 PolarHBondContact O-N 3.15Å |
| 33 | D | 86.5 | Confident | 76.6 | Confident | 110 Ų | 110 | 106 Ų | 106 | 59% | 0.588 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -65.5 | -46.7 | 175.1 | -172 | 44.7 | 0 | 0 | 0 | 111.2 | E29 D30 L35 G36 S37 | E29-D33 PolarHBondContact O-N 2.86Å; D30-D33 PolarHBondContact O-N 2.99Å; D33-L35 PolarHBondContact O-N 3.06Å; D33-G36 PolarHBondContact O-N 3.37Å; D33-S37 WeakPolarHBondContact O-CB 3.43Å; D33-S37 PolarHBondContact O-N 2.87Å; D33-S37 PolarHBondContact O-OG 3.24Å |
| 34 | I | 89.4 | Confident | 75.1 | Confident | 101 Ų | 101 | 108.7 Ų | 108.7 | 52% | 0.518 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -61.4 | -44 | 177.9 | -64.3 | 163.4 | 0 | 0 | 0 | 111.2 | D30 | D30-I34 WeakPolarHBondContact O-CD1 3.41Å; D30-I34 VanDerWaalsContact O-CG1 3.26Å; D30-I34 WeakPolarHBondContact O-CG1 3.24Å; D30-I34 PolarHBondContact O-N 2.98Å |
| 35 | L | 84.4 | Confident | 73.1 | Confident | 127 Ų | 127 | 110.2 Ų | 110.2 | 67% | 0.665 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -80.9 | -31.3 | -178.2 | -66.9 | 171.2 | 0 | 0 | 0 | 113 | L31 D33 S37 | L31-L35 VanDerWaalsContact O-CB 3.28Å; L31-L35 WeakPolarHBondContact O-CB 3.42Å; L31-L35 WeakPolarHBondContact O-CD1 3.45Å; L31-L35 WeakPolarHBondContact O-CG 3.43Å; L31-L35 PolarHBondContact O-N 2.88Å; D33-L35 PolarHBondContact O-N 3.06Å; L35-S37 VanDerWaalsContact C-N 3.29Å |
| 36 | G | 72.4 | Confident | 71.3 | Confident | 47 Ų | 47 | 114 Ų | 114 | 49% | 0.485 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -72 | -24.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q32 D33 D38 T39 | Q32-G36 VanDerWaalsContact O-CA 3.29Å; Q32-G36 WeakPolarHBondContact O-CA 3.29Å; Q32-G36 PolarHBondContact O-N 3.15Å; D33-G36 PolarHBondContact O-N 3.37Å; G36-D38 PolarHBondContact O-N 3.13Å; G36-D38 VanDerWaalsContact O-N 3.16Å; G36-T39 PolarHBondContact O-N 3.24Å |
| 37 | S | 66.4 | Low | 68.8 | Low | 91 Ų | 91 | 114.9 Ų | 114.9 | 64% | 0.636 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | -19.8 | -179.3 | -72.3 | 0 | 0 | 0 | 0 | 115.1 | D33 L35 | D33-S37 WeakPolarHBondContact O-CB 3.43Å; D33-S37 PolarHBondContact O-N 2.87Å; D33-S37 PolarHBondContact O-OG 3.24Å; L35-S37 VanDerWaalsContact C-N 3.29Å |
| 38 | D | 65.4 | Low | 66.3 | Low | 152 Ų | 152 | 112.9 Ų | 112.9 | 81% | 0.813 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.6 | -4.1 | -175.6 | -161.2 | 27.1 | 0 | 0 | 0 | 114.7 | G36 | G36-D38 PolarHBondContact O-N 3.13Å; G36-D38 VanDerWaalsContact O-N 3.16Å |
| 39 | T | 58.9 | Low | 63.8 | Low | 128 Ų | 128 | 110.3 Ų | 110.3 | 79% | 0.785 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -101 | 2.3 | -175.1 | -32.1 | 0 | 0 | 0 | 0 | 113.7 | G36 | G36-T39 PolarHBondContact O-N 3.24Š|
| 40 | G | 58.8 | Low | 61.1 | Low | 73 Ų | 73 | 111.5 Ų | 111.5 | 75% | 0.753 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -109 | 52.6 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 41 | G | 49.7 | Very low | 58.5 | Low | 68 Ų | 68 | 112.5 Ų | 112.5 | 70% | 0.701 | 69% | 0.689 | S | S | * | * | trans | 88.7 | 100.8 | 160.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | K43 | G41-K43 PolarHBondContact O-N 3.04Š| ||
| 42 | A | 50.9 | Low | 56.5 | Low | 106 Ų | 106 | 117.5 Ų | 117.5 | 88% | 0.876 | 71% | 0.711 | S | S | * | * | trans | -52.2 | 105.8 | 159.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 43 | K | 46.4 | Very low | 54.6 | Low | 194 Ų | 194 | 121.1 Ų | 121.1 | 84% | 0.843 | 73% | 0.725 | S | S | * | * | -123.2 | 120.6 | 128 | -76.6 | -177.6 | 175.6 | 172.1 | 0 | 105.3 | G41 A45 | G41-K43 PolarHBondContact O-N 3.04Å; K43-A45 VanDerWaalsContact C-N 3.25Å; K43-A45 PolarHBondContact O-N 2.99Å | |||
| 44 | L | 49.8 | Very low | 52.6 | Low | 172 Ų | 172 | 120.8 Ų | 120.8 | 90% | 0.901 | 72% | 0.72 | S | S | * | * | trans | -38 | 99.1 | 154.8 | -83 | 134 | 0 | 0 | 0 | 107.7 | R46 | L44-R46 PolarHBondContact O-N 3.45Š| ||
| 45 | A | 40.8 | Very low | 51.2 | Low | 97 Ų | 97 | 121 Ų | 121 | 80% | 0.802 | 73% | 0.728 | S | S | * | * | trans | -62 | 98.7 | 157.7 | 0 | 0 | 0 | 0 | 0 | 102.9 | K43 A47 | K43-A45 VanDerWaalsContact C-N 3.25Å; K43-A45 PolarHBondContact O-N 2.99Å; A45-A47 PolarHBondContact O-N 3.01Å; A45-A47 VanDerWaalsContact O-N 3.1Å | ||
| 46 | R | 43.7 | Very low | 50 | Low | 192 Ų | 192 | 121.6 Ų | 121.6 | 73% | 0.725 | 73% | 0.727 | S | S | * | * | trans | -29.7 | 119.1 | 169.5 | 177.8 | 170 | 178.5 | 90.2 | -4.9 | 107.4 | L44 T49 | L44-R46 PolarHBondContact O-N 3.45Å; R46-T49 HydrophobicContact CG-CG2 4.35Å; R46-T49 VanDerWaalsContact NH2-CG2 3.31Å | ||
| 47 | A | 35.8 | Very low | 49.1 | Very low | 79 Ų | 79 | 127.6 Ų | 127.6 | 65% | 0.653 | 74% | 0.74 | S | S | * | * | trans | -40 | 132 | 168.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | A45 T49 | A45-A47 PolarHBondContact O-N 3.01Å; A45-A47 VanDerWaalsContact O-N 3.1Å; A47-T49 PolarHBondContact O-N 2.97Å | ||
| 48 | P | 39.6 | Very low | 48.7 | Very low | 128 Ų | 128 | 129 Ų | 129 | 83% | 0.831 | 74% | 0.74 | S | S | * | * | trans | -46.7 | 112 | -179 | -24.6 | 30.9 | 0 | 0 | 0 | 107.6 | C50 | P48-C50 PolarHBondContact O-N 3.27Š| ||
| 49 | T | 35.4 | Very low | 48.5 | Very low | 77 Ų | 77 | 126.8 Ų | 126.8 | 47% | 0.472 | 73% | 0.728 | S | S | . | * | trans | -63.3 | 109.9 | 171.5 | 40.4 | 0 | 0 | 0 | 0 | 104.8 | R46 A47 T51 | R46-T49 HydrophobicContact CG-CG2 4.35Å; R46-T49 VanDerWaalsContact NH2-CG2 3.31Å; A47-T49 PolarHBondContact O-N 2.97Å; T49-T51 VanDerWaalsContact C-N 3.28Å; T49-T51 PolarHBondContact O-N 3.18Å | ||
| 50 | C | 34.6 | Very low | 48.9 | Very low | 130 Ų | 130 | 125 Ų | 125 | 88% | 0.878 | 72% | 0.717 | S | S | * | * | trans | -51 | 95.7 | 168.9 | -177.6 | 0 | 0 | 0 | 0 | 107.8 | P48 E52 | P48-C50 PolarHBondContact O-N 3.27Å; C50-E52 PolarHBondContact O-N 3.45Å | ||
| 51 | T | 39.5 | Very low | 49.4 | Very low | 106 Ų | 106 | 126.4 Ų | 126.4 | 65% | 0.65 | 71% | 0.707 | S | S | * | * | trans | -88 | 95.7 | 169.7 | 50.9 | 0 | 0 | 0 | 0 | 106.6 | T49 K53 | T49-T51 VanDerWaalsContact C-N 3.28Å; T49-T51 PolarHBondContact O-N 3.18Å; T51-K53 PolarHBondContact O-N 3.02Å | ||
| 52 | E | 49.9 | Very low | 49.9 | Very low | 176 Ų | 176 | 130.5 Ų | 130.5 | 82% | 0.822 | 71% | 0.707 | S | S | * | * | trans | 2.7 | 82.3 | 138 | -168.7 | -166.7 | 158.6 | 0 | 0 | 114.9 | C50 | C50-E52 PolarHBondContact O-N 3.45Š| ||
| 53 | K | 48.8 | Very low | 50.4 | Low | 190 Ų | 190 | 130.1 Ų | 130.1 | 83% | 0.826 | 70% | 0.698 | S | S | * | * | trans | -157 | 121 | 159.1 | -59 | -63.8 | 167.3 | 176.4 | 0 | 102.3 | T51 | T51-K53 PolarHBondContact O-N 3.02Š| ||
| 54 | E | 44.8 | Very low | 50.6 | Low | 103 Ų | 103 | 124.8 Ų | 124.8 | 48% | 0.481 | 68% | 0.684 | S | S | . | * | cis | -173.2 | 131.2 | 33.8 | -154.6 | -77.6 | 158.8 | 0 | 0 | 103.9 | E56 | E54-E56 VanDerWaalsContact C-N 3.27Å; E54-E56 PolarHBondContact O-N 2.93Å; E54-E56 VanDerWaalsContact OE2-CB 3.27Å; E54-E56 WeakPolarHBondContact OE2-CB 3.17Å; E54-E56 PolarHBondContact OE2-N 3.11Å | ||
| 55 | P | 58.4 | Low | 50.8 | Low | 105 Ų | 105 | 120.9 Ų | 120.9 | 68% | 0.682 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | -7.4 | -170.4 | 25.2 | -31.2 | 0 | 0 | 0 | 115.5 | ||
| 56 | E | 59.4 | Low | 51.3 | Low | 140 Ų | 140 | 120 Ų | 120 | 65% | 0.654 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -86.5 | -24.9 | -174.9 | -64.4 | 179.4 | 152.5 | 0 | 0 | 113.5 | E54 L58 V60 | E54-E56 VanDerWaalsContact C-N 3.27Å; E54-E56 PolarHBondContact O-N 2.93Å; E54-E56 VanDerWaalsContact OE2-CB 3.27Å; E54-E56 WeakPolarHBondContact OE2-CB 3.17Å; E54-E56 PolarHBondContact OE2-N 3.11Å; E56-L58 VanDerWaalsContact C-N 3.35Å; E56-V60 PolarHBondContact O-N 3.39Å |
| 57 | F | 54.3 | Low | 52 | Low | 173 Ų | 173 | 116.3 Ų | 116.3 | 76% | 0.759 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -76 | -24.8 | 178.9 | -131.8 | -91 | 0 | 0 | 0 | 113.1 | L61 | F57-L61 PolarHBondContact O-N 3.24Å |
| 58 | L | 58.2 | Low | 53.2 | Low | 121 Ų | 121 | 122.3 Ų | 122.3 | 63% | 0.634 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -73.9 | -39.1 | 174.2 | -92.5 | 163 | 0 | 0 | 0 | 111.6 | E56 V60 L61 E62 | E56-L58 VanDerWaalsContact C-N 3.35Å; L58-V60 VanDerWaalsContact C-N 3.32Å; L58-V60 PolarHBondContact O-N 3.45Å; L58-L61 CarbonylContact O-C 3.57Å; L58-L61 WeakPolarHBondContact O-CB 3.46Å; L58-L61 PolarHBondContact O-N 2.85Å; L58-L61 VanDerWaalsContact O-N 3.14Å; L58-E62 WeakPolarHBondContact O-CB 3.36Å; L58-E62 PolarHBondContact O-N 2.73Å |
| 59 | D | 59.9 | Low | 53.9 | Low | 105 Ų | 105 | 120.4 Ų | 120.4 | 56% | 0.561 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -63.2 | -37 | 178.2 | -111.9 | 16.9 | 0 | 0 | 0 | 112.3 | E62 S63 | D59-E62 PolarHBondContact O-N 3.16Å; D59-S63 WeakPolarHBondContact O-CB 3.38Å; D59-S63 PolarHBondContact O-N 3.47Å; D59-S63 PolarHBondContact O-OG 2.69Å |
| 60 | V | 68.1 | Low | 54.4 | Low | 91 Ų | 91 | 120.8 Ų | 120.8 | 55% | 0.552 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -68.8 | -38.1 | 174.3 | 174.6 | 0 | 0 | 0 | 0 | 111.3 | E56 L58 S63 C64 | E56-V60 PolarHBondContact O-N 3.39Å; L58-V60 VanDerWaalsContact C-N 3.32Å; L58-V60 PolarHBondContact O-N 3.45Å; V60-S63 PolarHBondContact O-N 3.02Å; V60-C64 PolarHBondContact O-N 3.5Å; V60-C64 VanDerWaalsContact O-N 3.16Å; V60-C64 PolarHBondContact O-SG 3.04Å |
| 61 | L | 68.6 | Low | 55 | Low | 102 Ų | 102 | 121.5 Ų | 121.5 | 53% | 0.534 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -72.2 | -31.9 | 177.7 | -155.1 | 76.2 | 0 | 0 | 0 | 111.8 | F57 L58 C64 L66 | F57-L61 PolarHBondContact O-N 3.24Å; L58-L61 CarbonylContact O-C 3.57Å; L58-L61 WeakPolarHBondContact O-CB 3.46Å; L58-L61 PolarHBondContact O-N 2.85Å; L58-L61 VanDerWaalsContact O-N 3.14Å; L61-C64 PolarHBondContact O-N 3.42Å; L61-L66 WeakPolarHBondContact O-CD1 3.26Å |
| 62 | E | 61.5 | Low | 55.5 | Low | 153 Ų | 153 | 118.3 Ų | 118.3 | 72% | 0.715 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -73.3 | -34.1 | 173.6 | -169.4 | 170.1 | -166.6 | 0 | 0 | 111.9 | L58 D59 C64 | L58-E62 WeakPolarHBondContact O-CB 3.36Å; L58-E62 PolarHBondContact O-N 2.73Å; D59-E62 PolarHBondContact O-N 3.16Å; E62-C64 VanDerWaalsContact C-N 3.28Å; E62-C64 PolarHBondContact O-N 3.04Å |
| 63 | S | 62 | Low | 55.4 | Low | 99 Ų | 99 | 116.9 Ų | 116.9 | 69% | 0.692 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -69.3 | -24.9 | 172.8 | -64.2 | 0 | 0 | 0 | 0 | 113.1 | D59 V60 S65 | D59-S63 WeakPolarHBondContact O-CB 3.38Å; D59-S63 PolarHBondContact O-N 3.47Å; D59-S63 PolarHBondContact O-OG 2.69Å; V60-S63 PolarHBondContact O-N 3.02Å; S63-S65 PolarHBondContact O-N 3.02Å |
| 64 | C | 49.8 | Very low | 55.3 | Low | 81 Ų | 81 | 114.3 Ų | 114.3 | 55% | 0.547 | 62% | 0.615 | S | S | . | * | S | Bend | trans | -81.4 | 88.9 | 170.2 | -67.7 | 0 | 0 | 0 | 0 | 108.7 | V60 L61 E62 L66 | V60-C64 PolarHBondContact O-N 3.5Å; V60-C64 VanDerWaalsContact O-N 3.16Å; V60-C64 PolarHBondContact O-SG 3.04Å; L61-C64 PolarHBondContact O-N 3.42Å; E62-C64 VanDerWaalsContact C-N 3.28Å; E62-C64 PolarHBondContact O-N 3.04Å; C64-L66 PolarHBondContact O-N 3.42Å |
| 65 | S | 53.7 | Low | 55.3 | Low | 90 Ų | 90 | 114.1 Ų | 114.1 | 63% | 0.629 | 62% | 0.621 | S | S | * | * | trans | -37 | 105.4 | -178.3 | -58.4 | 0 | 0 | 0 | 0 | 113.3 | S63 T67 | S63-S65 PolarHBondContact O-N 3.02Å; S65-T67 PolarHBondContact O-N 3.33Å; S65-T67 PolarHBondContact O-OG1 3.48Å | ||
| 66 | L | 52.2 | Low | 54.8 | Low | 78 Ų | 78 | 120.3 Ų | 120.3 | 41% | 0.408 | 63% | 0.631 | S | S | . | * | trans | -72.8 | 35.9 | -179 | -120.2 | 87.8 | 0 | 0 | 0 | 112.7 | L61 C64 W68 L69 | L61-L66 WeakPolarHBondContact O-CD1 3.26Å; C64-L66 PolarHBondContact O-N 3.42Å; L66-W68 PolarHBondContact O-N 3.05Å; L66-W68 VanDerWaalsContact O-N 3.13Å; L66-L69 HydrophobicContact CD2-CB 3.92Å; L66-L69 HydrophobicContact CD2-CD1 3.78Å; L66-L69 HydrophobicContact CD2-CG 4.49Å; L66-L69 HydrophobicContact CG-CB 4.22Å; L66-L69 HydrophobicContact CG-CD1 3.94Å; L66-L69 PolarHBondContact O-N 2.94Å | ||
| 67 | T | 58.5 | Low | 54.1 | Low | 116 Ų | 116 | 118 Ų | 118 | 71% | 0.712 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.5 | -18.7 | -173.3 | 41.8 | 0 | 0 | 0 | 0 | 113.7 | S65 | S65-T67 PolarHBondContact O-N 3.33Å; S65-T67 PolarHBondContact O-OG1 3.48Å |
| 68 | W | 59.8 | Low | 53.3 | Low | 204 Ų | 204 | 117.1 Ų | 117.1 | 77% | 0.773 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -4.9 | 179.2 | 56.2 | -87.8 | 0 | 0 | 0 | 114.5 | L66 | L66-W68 PolarHBondContact O-N 3.05Å; L66-W68 VanDerWaalsContact O-N 3.13Å |
| 69 | L | 55.7 | Low | 52.4 | Low | 88 Ų | 88 | 114.7 Ų | 114.7 | 46% | 0.461 | 64% | 0.638 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -102.2 | -16.3 | 180 | -94.5 | 157.2 | 0 | 0 | 0 | 114.1 | L66 | L66-L69 HydrophobicContact CD2-CB 3.92Å; L66-L69 HydrophobicContact CD2-CD1 3.78Å; L66-L69 HydrophobicContact CD2-CG 4.49Å; L66-L69 HydrophobicContact CG-CB 4.22Å; L66-L69 HydrophobicContact CG-CD1 3.94Å; L66-L69 PolarHBondContact O-N 2.94Å |
| 70 | T | 45.1 | Very low | 51.5 | Low | 86 Ų | 86 | 116.2 Ų | 116.2 | 53% | 0.528 | 65% | 0.651 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86 | -19.6 | -175.7 | -58.5 | 0 | 0 | 0 | 0 | 113.9 | ||
| 71 | D | 47.1 | Very low | 50 | Low | 144 Ų | 144 | 119.8 Ų | 119.8 | 77% | 0.77 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | 12.6 | -174.1 | -158.7 | 34.8 | 0 | 0 | 0 | 114.7 | ||
| 72 | G | 49.3 | Very low | 48.7 | Very low | 40 Ų | 40 | 126.3 Ų | 126.3 | 41% | 0.412 | 68% | 0.679 | S | S | . | * | S | Bend | trans | -113.8 | -22.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 73 | N | 48.8 | Very low | 47.3 | Very low | 146 Ų | 146 | 126 Ų | 126 | 78% | 0.781 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -112.1 | -3.2 | -164.6 | -97.7 | 39.3 | 0 | 0 | 0 | 115.5 | ||
| 74 | Q | 46 | Very low | 46 | Very low | 136 Ų | 136 | 127 Ų | 127 | 64% | 0.636 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -105.3 | -14 | -177.7 | -66.9 | -173.7 | 83.9 | 0 | 0 | 114.6 | ||
| 75 | T | 44.9 | Very low | 45.6 | Very low | 98 Ų | 98 | 131.3 Ų | 131.3 | 60% | 0.601 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | -15.5 | -175.7 | 52.7 | 0 | 0 | 0 | 0 | 114.2 | ||
| 76 | W | 47.9 | Very low | 44.5 | Very low | 235 Ų | 235 | 134.9 Ų | 134.9 | 89% | 0.89 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | -6.8 | 178.5 | -64.3 | 93.7 | 0 | 0 | 0 | 114.3 | ||
| 77 | A | 45.3 | Very low | 43.9 | Very low | 92 Ų | 92 | 138.8 Ų | 138.8 | 76% | 0.76 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.9 | -14.9 | -174 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 78 | E | 37.1 | Very low | 42.9 | Very low | 155 Ų | 155 | 139.4 Ų | 139.4 | 72% | 0.724 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -126.3 | 39.1 | -171 | -161.1 | 110.3 | -144.3 | 0 | 0 | 112.5 | ||
| 79 | G | 39.6 | Very low | 41.5 | Very low | 69 Ų | 69 | 135.5 Ų | 135.5 | 71% | 0.711 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -101 | 3.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 80 | V | 41.7 | Very low | 40.5 | Very low | 137 Ų | 137 | 137.7 Ų | 137.7 | 83% | 0.83 | 74% | 0.739 | S | S | * | * | trans | -136.4 | 66.4 | -177.6 | -170.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 81 | Q | 36.4 | Very low | 40 | Very low | 167 Ų | 167 | 141.5 Ų | 141.5 | 78% | 0.78 | 75% | 0.751 | S | S | * | * | trans | -129.8 | 121.6 | 153 | -71.3 | -156.9 | 73.6 | 0 | 0 | 110.2 | ||||
| 82 | R | 41.5 | Very low | 39.6 | Very low | 238 Ų | 238 | 140.3 Ų | 140.3 | 90% | 0.898 | 75% | 0.751 | S | S | * | * | trans | -54 | 136.9 | -178.7 | -53.2 | 170.9 | -65.7 | -167.5 | 2.2 | 110.8 | ||||
| 83 | T | 31.5 | Very low | 38.8 | Very low | 148 Ų | 148 | 143.7 Ų | 143.7 | 91% | 0.908 | 76% | 0.759 | S | S | * | * | trans | -115.6 | 88.3 | 149.1 | 51.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 84 | T | 35.2 | Very low | 38 | Very low | 118 Ų | 118 | 145.9 Ų | 145.9 | 72% | 0.724 | 76% | 0.764 | S | S | * | * | trans | -85.3 | 117.7 | 153.6 | -118.3 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 85 | E | 39.9 | Very low | 37.3 | Very low | 173 Ų | 173 | 146.2 Ų | 146.2 | 81% | 0.808 | 77% | 0.765 | S | S | * | * | trans | 44.2 | 114.1 | 142.6 | -47.2 | -176 | -167.4 | 0 | 0 | 119.3 | ||||
| 86 | E | 30.2 | Very low | 36.7 | Very low | 164 Ų | 164 | 148.6 Ų | 148.6 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | trans | -160.5 | 124.5 | 134.1 | -126.6 | -175.5 | 141.4 | 0 | 0 | 111.7 | H88 | E86-H88 VanDerWaalsContact CB-NE2 3.32Å; E86-H88 WeakPolarHBondContact CB-NE2 3.42Å; E86-H88 WeakPolarHBondContact CG-NE2 3.4Å; E86-H88 IonicContact OE1-CE1 3.01Å; E86-H88 PolarHBondContact OE1-CE1 3.02Å; E86-H88 IonicContact OE1-NE2 2.85Å; E86-H88 PolarHBondContact OE1-NE2 3.5Å; E86-H88 IonicContact OE2-NE2 3.84Å | ||
| 87 | I | 39.7 | Very low | 36.1 | Very low | 160 Ų | 160 | 142.8 Ų | 142.8 | 82% | 0.821 | 78% | 0.775 | S | S | * | * | trans | -88.3 | 110.9 | 179.8 | -65 | 157.6 | 0 | 0 | 0 | 107.9 | ||||
| 88 | H | 37.8 | Very low | 35.5 | Very low | 130 Ų | 130 | 144 Ų | 144 | 60% | 0.602 | 78% | 0.778 | S | S | * | * | trans | -142 | 97 | 164.3 | -45 | -93.5 | 0 | 0 | 0 | 110.9 | E86 T90 | E86-H88 VanDerWaalsContact CB-NE2 3.32Å; E86-H88 WeakPolarHBondContact CB-NE2 3.42Å; E86-H88 WeakPolarHBondContact CG-NE2 3.4Å; E86-H88 IonicContact OE1-CE1 3.01Å; E86-H88 PolarHBondContact OE1-CE1 3.02Å; E86-H88 IonicContact OE1-NE2 2.85Å; E86-H88 PolarHBondContact OE1-NE2 3.5Å; E86-H88 IonicContact OE2-NE2 3.84Å; H88-T90 PolarHBondContact O-N 3.12Å | ||
| 89 | T | 30.6 | Very low | 35.5 | Very low | 121 Ų | 121 | 141.9 Ų | 141.9 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | 6.1 | 111.6 | 125.9 | -63.7 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 90 | T | 35.9 | Very low | 35.4 | Very low | 134 Ų | 134 | 143.7 Ų | 143.7 | 82% | 0.822 | 78% | 0.782 | S | S | * | * | 176.7 | 127.1 | 118.4 | 30.8 | 0 | 0 | 0 | 0 | 110.2 | H88 | H88-T90 PolarHBondContact O-N 3.12Š| |||
| 91 | Q | 32.8 | Very low | 35.1 | Very low | 167 Ų | 167 | 142 Ų | 142 | 78% | 0.78 | 78% | 0.776 | S | S | * | * | trans | -72 | 168.4 | 164 | -70.2 | -159.1 | -12.8 | 0 | 0 | 111 | ||||
| 92 | P | 39.4 | Very low | 35.2 | Very low | 118 Ų | 118 | 139 Ų | 139 | 77% | 0.766 | 77% | 0.774 | S | S | * | * | -142.4 | 136.2 | 94.9 | 30.8 | -12.4 | 0 | 0 | 0 | 116.2 | |||||
| 93 | L | 31.9 | Very low | 34.9 | Very low | 112 Ų | 112 | 132.5 Ų | 132.5 | 59% | 0.586 | 77% | 0.765 | S | S | * | * | trans | 36.8 | 115.1 | 132.9 | -72.5 | 157.5 | 0 | 0 | 0 | 119.7 | ||||
| 94 | H | 32.2 | Very low | 35.1 | Very low | 191 Ų | 191 | 130.4 Ų | 130.4 | 88% | 0.884 | 76% | 0.756 | S | S | * | * | -151.8 | 150 | 122.8 | -83.8 | -71.7 | 0 | 0 | 0 | 110 | |||||
| 95 | H | 32 | Very low | 35.2 | Very low | 144 Ų | 144 | 129.5 Ų | 129.5 | 67% | 0.667 | 76% | 0.755 | S | S | * | * | trans | -92.1 | 147.8 | -154.3 | -47.8 | -97.7 | 0 | 0 | 0 | 113.4 | ||||
| 96 | T | 31.5 | Very low | 34.9 | Very low | 147 Ų | 147 | 126.3 Ų | 126.3 | 90% | 0.902 | 75% | 0.751 | S | S | * | * | -166.1 | 138.1 | 125.2 | 50.7 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 97 | S | 35.9 | Very low | 35.2 | Very low | 114 Ų | 114 | 123.9 Ų | 123.9 | 80% | 0.797 | 75% | 0.753 | S | S | * | * | trans | -76.9 | 152.8 | -167.1 | -42.5 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 98 | S | 33.4 | Very low | 35 | Very low | 116 Ų | 116 | 121.4 Ų | 121.4 | 81% | 0.811 | 75% | 0.75 | S | S | * | * | 173.3 | 132.7 | 108.9 | -69.7 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 99 | S | 36.9 | Very low | 34.9 | Very low | 112 Ų | 112 | 120.7 Ų | 120.7 | 78% | 0.783 | 76% | 0.759 | S | S | * | * | trans | -43.7 | 163.2 | 168.3 | 40.6 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 100 | S | 37.4 | Very low | 35.2 | Very low | 106 Ų | 106 | 120.8 Ų | 120.8 | 74% | 0.741 | 77% | 0.765 | S | S | * | * | cis | -175 | 155 | 11.2 | 36 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 101 | S | 35.6 | Very low | 35.3 | Very low | 102 Ų | 102 | 119 Ų | 119 | 71% | 0.713 | 76% | 0.758 | S | S | * | * | 172.8 | 149.3 | 64.1 | 40.8 | 0 | 0 | 0 | 0 | 111 | |||||
| 102 | S | 37.8 | Very low | 35.3 | Very low | 105 Ų | 105 | 115.7 Ų | 115.7 | 73% | 0.734 | 75% | 0.752 | S | S | * | * | trans | 62.3 | 134.9 | 148.4 | 52.3 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 103 | S | 36.3 | Very low | 35.4 | Very low | 100 Ų | 100 | 117.9 Ų | 117.9 | 70% | 0.699 | 75% | 0.754 | S | S | * | * | cis | 177.2 | 146.1 | 9.8 | 40.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 104 | S | 35.7 | Very low | 35.8 | Very low | 104 Ų | 104 | 118 Ų | 118 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | trans | 49.1 | 138.5 | 141.6 | 50 | 0 | 0 | 0 | 0 | 121 | ||||
| 105 | S | 36.1 | Very low | 36.2 | Very low | 99 Ų | 99 | 115.3 Ų | 115.3 | 69% | 0.692 | 76% | 0.764 | S | S | * | * | cis | -176.3 | 166.8 | 5.8 | -68.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 106 | S | 34.7 | Very low | 36.3 | Very low | 106 Ų | 106 | 112.6 Ų | 112.6 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | trans | 87.2 | 96.3 | 143 | -46.9 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 107 | S | 35.8 | Very low | 36.4 | Very low | 114 Ų | 114 | 112.2 Ų | 112.2 | 80% | 0.797 | 76% | 0.763 | S | S | * | * | 44 | 133 | 115.8 | -46.2 | 0 | 0 | 0 | 0 | 123.8 | |||||
| 108 | S | 35.5 | Very low | 36.7 | Very low | 108 Ų | 108 | 113.9 Ų | 113.9 | 76% | 0.755 | 77% | 0.769 | S | S | * | * | trans | 105 | 104.6 | 134.9 | -60.3 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 109 | S | 35.8 | Very low | 37.2 | Very low | 114 Ų | 114 | 117.1 Ų | 117.1 | 80% | 0.797 | 77% | 0.771 | S | S | * | * | 56.3 | 145.3 | 117.8 | -57 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 110 | S | 37.8 | Very low | 37.1 | Very low | 123 Ų | 123 | 120.5 Ų | 120.5 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | trans | 89.8 | 145.4 | 164.5 | 84.9 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 111 | S | 36.6 | Very low | 37 | Very low | 98 Ų | 98 | 125.2 Ų | 125.2 | 69% | 0.685 | 78% | 0.776 | S | S | * | * | cis | -165.7 | 153.2 | -7.1 | 170 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 112 | C | 34 | Very low | 36.8 | Very low | 97 Ų | 97 | 127.4 Ų | 127.4 | 66% | 0.655 | 78% | 0.775 | S | S | * | * | trans | -50.9 | 150.4 | 163.9 | 48.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 113 | M | 41.2 | Very low | 36.8 | Very low | 163 Ų | 163 | 129.3 Ų | 129.3 | 80% | 0.803 | 78% | 0.782 | S | S | * | * | trans | -167.3 | 126.9 | 137.5 | -86.3 | -47.9 | 94 | 0 | 0 | 110.2 | ||||
| 114 | S | 38.8 | Very low | 37 | Very low | 115 Ų | 115 | 131.7 Ų | 131.7 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | trans | -75.1 | 160.4 | 164.5 | -47.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 115 | P | 42.4 | Very low | 37.1 | Very low | 135 Ų | 135 | 131.8 Ų | 131.8 | 88% | 0.877 | 79% | 0.789 | S | S | * | * | trans | -100.4 | 139.9 | 156.6 | 33.4 | -24.3 | 0 | 0 | 0 | 111.4 | ||||
| 116 | A | 32.5 | Very low | 37.3 | Very low | 87 Ų | 87 | 135.2 Ų | 135.2 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | trans | -108.6 | 147.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 117 | V | 34.3 | Very low | 37.4 | Very low | 138 Ų | 138 | 135.5 Ų | 135.5 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | trans | 24.4 | 132.1 | 150.6 | -68.7 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 118 | V | 41.5 | Very low | 37.4 | Very low | 150 Ų | 150 | 133.6 Ų | 133.6 | 91% | 0.909 | 80% | 0.795 | S | S | * | * | trans | -136.3 | 125.5 | 141.6 | 164.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 119 | E | 44 | Very low | 37.8 | Very low | 183 Ų | 183 | 139.5 Ų | 139.5 | 86% | 0.855 | 80% | 0.8 | S | S | * | * | trans | -91.8 | 145.6 | 169.5 | -114.7 | -175.2 | 124 | 0 | 0 | 109.8 | ||||
| 120 | E | 34.7 | Very low | 37.8 | Very low | 184 Ų | 184 | 142 Ų | 142 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -169.6 | 107.3 | 133.8 | -115.2 | -154.7 | 128.6 | 0 | 0 | 113.7 | ||||
| 121 | R | 35.4 | Very low | 38 | Very low | 204 Ų | 204 | 140.8 Ų | 140.8 | 77% | 0.77 | 80% | 0.802 | S | S | * | * | 50.7 | 104.3 | 120.2 | -151.1 | 162.3 | -172.2 | -119.7 | -0.7 | 123.4 | |||||
| 122 | Q | 32.6 | Very low | 38.3 | Very low | 148 Ų | 148 | 143.9 Ų | 143.9 | 69% | 0.692 | 81% | 0.811 | S | S | * | * | 47.7 | 120.9 | 118.3 | -167.6 | 176.9 | -9.6 | 0 | 0 | 122.4 | |||||
| 123 | V | 37.1 | Very low | 38.6 | Very low | 146 Ų | 146 | 144 Ų | 144 | 89% | 0.885 | 81% | 0.813 | S | S | * | * | trans | -150.2 | 137.5 | 135.6 | -178.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 124 | E | 39.7 | Very low | 39.1 | Very low | 149 Ų | 149 | 142.2 Ų | 142.2 | 70% | 0.696 | 82% | 0.816 | S | S | * | * | trans | -68.8 | 148.6 | 176.8 | -65.1 | 169.7 | 137.9 | 0 | 0 | 114.1 | ||||
| 125 | A | 38.7 | Very low | 39.3 | Very low | 106 Ų | 106 | 142.8 Ų | 142.8 | 88% | 0.876 | 82% | 0.816 | S | S | * | * | trans | -155.2 | 120.2 | 144.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 126 | E | 41.3 | Very low | 39.5 | Very low | 172 Ų | 172 | 140.4 Ų | 140.4 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | -86.4 | 130.3 | -179.8 | -18 | 172.4 | 160.8 | 0 | 0 | 108.2 | ||||
| 127 | S | 35.9 | Very low | 40.1 | Very low | 111 Ų | 111 | 139.5 Ų | 139.5 | 78% | 0.776 | 82% | 0.815 | S | S | * | * | trans | -156.5 | 89.5 | 156.9 | -150 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 128 | G | 36 | Very low | 40.9 | Very low | 75 Ų | 75 | 137 Ų | 137 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | trans | -76.5 | 136.8 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 129 | R | 42.6 | Very low | 41.7 | Very low | 231 Ų | 231 | 133.1 Ų | 133.1 | 87% | 0.872 | 80% | 0.796 | S | S | * | * | trans | -141 | 107.3 | 150.8 | -63.4 | -169.6 | -178.4 | -176.3 | 0.7 | 108.8 | ||||
| 130 | N | 35.6 | Very low | 42.6 | Very low | 166 Ų | 166 | 132 Ų | 132 | 89% | 0.888 | 80% | 0.796 | S | S | * | * | trans | -56.6 | 130.1 | 160.7 | -75.6 | -57 | 0 | 0 | 0 | 109.5 | ||||
| 131 | A | 42.8 | Very low | 43.8 | Very low | 98 Ų | 98 | 131.2 Ų | 131.2 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | trans | -140.3 | 91.8 | 154.3 | 0 | 0 | 0 | 0 | 0 | 107 | S133 | A131-S133 PolarHBondContact O-N 2.85Š| ||
| 132 | D | 42.8 | Very low | 45.3 | Very low | 163 Ų | 163 | 125.2 Ų | 125.2 | 87% | 0.872 | 78% | 0.78 | S | S | * | * | trans | -58.5 | 110.3 | 157.4 | -87.8 | -37.5 | 0 | 0 | 0 | 108 | ||||
| 133 | S | 41.3 | Very low | 47.3 | Very low | 100 Ų | 100 | 122.2 Ų | 122.2 | 70% | 0.699 | 77% | 0.773 | S | S | * | * | trans | -140.6 | 92.9 | 150.4 | 78.6 | 0 | 0 | 0 | 0 | 109 | A131 T135 | A131-S133 PolarHBondContact O-N 2.85Å; S133-T135 PolarHBondContact O-N 3.06Å; S133-T135 VanDerWaalsContact O-N 3.13Å | ||
| 134 | S | 50.2 | Low | 48.7 | Very low | 125 Ų | 125 | 120.5 Ų | 120.5 | 87% | 0.874 | 77% | 0.765 | S | S | * | * | trans | -61.5 | 106.6 | 160.3 | -80.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 135 | T | 44.2 | Very low | 49.8 | Very low | 128 Ų | 128 | 120.8 Ų | 120.8 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | trans | -140.4 | 101.2 | 153.8 | -3.5 | 0 | 0 | 0 | 0 | 106.9 | S133 | S133-T135 PolarHBondContact O-N 3.06Å; S133-T135 VanDerWaalsContact O-N 3.13Å | ||
| 136 | G | 45.9 | Very low | 50.9 | Low | 85 Ų | 85 | 120.3 Ų | 120.3 | 88% | 0.876 | 75% | 0.745 | S | S | * | * | trans | -67.4 | 144 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 137 | G | 45 | Very low | 52 | Low | 68 Ų | 68 | 115.9 Ų | 115.9 | 70% | 0.701 | 72% | 0.723 | S | S | * | * | trans | 163.1 | 101.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | S139 | G137-S139 PolarHBondContact O-N 3.33Š| ||
| 138 | G | 51.6 | Low | 53.5 | Low | 86 Ų | 86 | 117.3 Ų | 117.3 | 89% | 0.887 | 72% | 0.717 | S | S | * | * | trans | -58.4 | 101.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 139 | S | 59.2 | Low | 54.6 | Low | 68 Ų | 68 | 119.9 Ų | 119.9 | 48% | 0.476 | 71% | 0.713 | S | S | . | * | trans | -96.8 | 4.1 | 173.8 | 66.6 | 0 | 0 | 0 | 0 | 112.6 | G137 L141 F147 | G137-S139 PolarHBondContact O-N 3.33Å; S139-L141 VanDerWaalsContact C-N 3.26Å; S139-L141 PolarHBondContact O-N 3.49Å; S139-F147 VanDerWaalsContact O-CZ 3.3Å; S139-F147 WeakPolarHBondContact O-CZ 3.48Å | ||
| 140 | D | 61.6 | Low | 55.5 | Low | 159 Ų | 159 | 113.9 Ų | 113.9 | 85% | 0.85 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | 18.8 | -169.4 | -151.4 | 24.8 | 0 | 0 | 0 | 114.7 | ||
| 141 | L | 59.3 | Low | 56.7 | Low | 167 Ų | 167 | 110.5 Ų | 110.5 | 87% | 0.874 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -124.7 | 8.1 | 179.7 | -67 | 178.7 | 0 | 0 | 0 | 113.6 | S139 | S139-L141 VanDerWaalsContact C-N 3.26Å; S139-L141 PolarHBondContact O-N 3.49Å |
| 142 | L | 68.4 | Low | 57.4 | Low | 78 Ų | 78 | 114.4 Ų | 114.4 | 41% | 0.408 | 69% | 0.688 | S | S | . | * | S | Bend | trans | -111.5 | 131.6 | -174.8 | -65.3 | 167.8 | 0 | 0 | 0 | 110.1 | F146 F147 | L142-F146 HydrophobicContact CB-CB 4.12Å; L142-F146 HydrophobicContact CB-CD1 4.21Å; L142-F146 HydrophobicContact CB-CG 4.34Å; L142-F146 HydrophobicContact CD1-CD1 3.61Å; L142-F146 HydrophobicContact CD1-CE1 3.76Å; L142-F146 HydrophobicContact CD1-CG 4.41Å; L142-F146 HydrophobicContact CD2-CD1 4.24Å; L142-F146 HydrophobicContact CD2-CE1 4.46Å; L142-F146 HydrophobicContact CD2-CG 4.3Å; L142-F146 HydrophobicContact CG-CD1 4.22Å; L142-F147 HydrophobicContact CB-CE2 4Å |
| 143 | P | 74.4 | Confident | 58.2 | Low | 85 Ų | 85 | 109.7 Ų | 109.7 | 55% | 0.552 | 68% | 0.678 | S | S | * | * | trans | -52 | 146 | 173.3 | -24.8 | 33.2 | 0 | 0 | 0 | 110.6 | E145 F146 | P143-E145 PolarHBondContact O-N 2.94Å; P143-F146 WeakPolarHBondContact O-CB 3.44Å; P143-F146 PolarHBondContact O-N 2.83Å | ||
| 144 | P | 65.2 | Low | 58.5 | Low | 110 Ų | 110 | 107.6 Ų | 107.6 | 71% | 0.714 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -50.5 | -32 | 179.3 | -26.5 | 33.4 | 0 | 0 | 0 | 113.3 | F146 F147 | P144-F146 PolarHBondContact O-N 3.09Å; P144-F147 WeakPolarHBondContact O-CB 3.33Å; P144-F147 PolarHBondContact O-N 3.38Å |
| 145 | E | 63.5 | Low | 58.3 | Low | 156 Ų | 156 | 108.2 Ų | 108.2 | 73% | 0.729 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -65.3 | -21 | 178.9 | -53.7 | -146.2 | 162.1 | 0 | 0 | 114.1 | P143 F147 | P143-E145 PolarHBondContact O-N 2.94Å; E145-F147 VanDerWaalsContact C-N 3.34Å |
| 146 | F | 62.5 | Low | 58.2 | Low | 95 Ų | 95 | 106 Ų | 106 | 42% | 0.417 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -76.4 | -24.6 | 174.8 | -164.9 | -90.8 | 0 | 0 | 0 | 112.2 | L142 P143 P144 L150 | L142-F146 HydrophobicContact CB-CB 4.12Å; L142-F146 HydrophobicContact CB-CD1 4.21Å; L142-F146 HydrophobicContact CB-CG 4.34Å; L142-F146 HydrophobicContact CD1-CD1 3.61Å; L142-F146 HydrophobicContact CD1-CE1 3.76Å; L142-F146 HydrophobicContact CD1-CG 4.41Å; L142-F146 HydrophobicContact CD2-CD1 4.24Å; L142-F146 HydrophobicContact CD2-CE1 4.46Å; L142-F146 HydrophobicContact CD2-CG 4.3Å; L142-F146 HydrophobicContact CG-CD1 4.22Å; P143-F146 WeakPolarHBondContact O-CB 3.44Å; P143-F146 PolarHBondContact O-N 2.83Å; P144-F146 PolarHBondContact O-N 3.09Å; F146-L150 HydrophobicContact CD1-CD1 4.05Å; F146-L150 HydrophobicContact CD1-CG 4.47Å; F146-L150 HydrophobicContact CE1-CD1 3.92Å; F146-L150 HydrophobicContact CE1-CG 4.31Å |
| 147 | F | 64.6 | Low | 58.6 | Low | 79 Ų | 79 | 110.6 Ų | 110.6 | 35% | 0.346 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -78.2 | -28 | 178.6 | -73 | -92.5 | 0 | 0 | 0 | 112.9 | S139 L142 P144 E145 L149 L150 S151 | S139-F147 VanDerWaalsContact O-CZ 3.3Å; S139-F147 WeakPolarHBondContact O-CZ 3.48Å; L142-F147 HydrophobicContact CB-CE2 4Å; P144-F147 WeakPolarHBondContact O-CB 3.33Å; P144-F147 PolarHBondContact O-N 3.38Å; E145-F147 VanDerWaalsContact C-N 3.34Å; F147-L149 VanDerWaalsContact C-N 3.34Å; F147-L150 PolarHBondContact O-N 3.43Å; F147-S151 WeakPolarHBondContact O-CB 3.35Å; F147-S151 PolarHBondContact O-N 3.42Å; F147-S151 PolarHBondContact O-OG 3.13Å |
| 148 | E | 66.2 | Low | 58.8 | Low | 142 Ų | 142 | 113.9 Ų | 113.9 | 66% | 0.664 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -63.7 | -40.8 | 174.4 | -75.2 | -173.7 | 162.6 | 0 | 0 | 111.2 | L150 S151 E152 | E148-L150 VanDerWaalsContact C-N 3.33Å; E148-L150 PolarHBondContact O-N 2.96Å; E148-S151 PolarHBondContact O-N 3.06Å; E148-S151 VanDerWaalsContact O-N 3.16Å; E148-E152 PolarHBondContact O-N 2.74Å |
| 149 | L | 60.4 | Low | 58.6 | Low | 129 Ų | 129 | 116 Ų | 116 | 68% | 0.675 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -63.4 | -34.7 | 175.3 | -75.5 | 162.2 | 0 | 0 | 0 | 113.4 | F147 | F147-L149 VanDerWaalsContact C-N 3.34Å |
| 150 | L | 60.6 | Low | 58.1 | Low | 104 Ų | 104 | 118.9 Ų | 118.9 | 55% | 0.545 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -78.2 | -30.9 | 174.8 | -68.4 | 176 | 0 | 0 | 0 | 112.2 | F146 F147 E148 E152 G153 | F146-L150 HydrophobicContact CD1-CD1 4.05Å; F146-L150 HydrophobicContact CD1-CG 4.47Å; F146-L150 HydrophobicContact CE1-CD1 3.92Å; F146-L150 HydrophobicContact CE1-CG 4.31Å; F147-L150 PolarHBondContact O-N 3.43Å; E148-L150 VanDerWaalsContact C-N 3.33Å; E148-L150 PolarHBondContact O-N 2.96Å; L150-E152 VanDerWaalsContact C-N 3.31Å; L150-G153 PolarHBondContact O-N 3.07Å |
| 151 | S | 60.8 | Low | 57.6 | Low | 95 Ų | 95 | 116 Ų | 116 | 66% | 0.664 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -71.1 | -28.4 | 178.8 | -59.3 | 0 | 0 | 0 | 0 | 112 | F147 E148 G153 | F147-S151 WeakPolarHBondContact O-CB 3.35Å; F147-S151 PolarHBondContact O-N 3.42Å; F147-S151 PolarHBondContact O-OG 3.13Å; E148-S151 PolarHBondContact O-N 3.06Å; E148-S151 VanDerWaalsContact O-N 3.16Å; S151-G153 PolarHBondContact O-N 2.93Å |
| 152 | E | 57.8 | Low | 57 | Low | 181 Ų | 181 | 112.4 Ų | 112.4 | 85% | 0.846 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 0.2 | 176.1 | -164.9 | 149 | -171.1 | 0 | 0 | 114 | E148 L150 | E148-E152 PolarHBondContact O-N 2.74Å; L150-E152 VanDerWaalsContact C-N 3.31Å |
| 153 | G | 58.7 | Low | 55.8 | Low | 63 Ų | 63 | 113 Ų | 113 | 65% | 0.649 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.2 | 43.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | L150 S151 V155 | L150-G153 PolarHBondContact O-N 3.07Å; S151-G153 PolarHBondContact O-N 2.93Å; G153-V155 PolarHBondContact O-N 2.64Å |
| 154 | G | 47.9 | Very low | 54.5 | Low | 57 Ų | 57 | 116 Ų | 116 | 59% | 0.588 | 72% | 0.716 | S | S | * | * | trans | -75.9 | 116.9 | 180 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 155 | V | 45.8 | Very low | 53.5 | Low | 137 Ų | 137 | 118.4 Ų | 118.4 | 83% | 0.83 | 72% | 0.722 | S | S | * | * | trans | 62.4 | 85.9 | 149.7 | -57.7 | 0 | 0 | 0 | 0 | 119.6 | G153 M157 | G153-V155 PolarHBondContact O-N 2.64Å; V155-M157 PolarHBondContact O-N 2.88Å | ||
| 156 | G | 42.7 | Very low | 52.6 | Low | 82 Ų | 82 | 116.2 Ų | 116.2 | 85% | 0.845 | 72% | 0.724 | S | S | * | * | trans | -78.1 | 97.9 | 154 | 0 | 0 | 0 | 0 | 0 | 110.6 | V158 | G156-V158 PolarHBondContact O-N 3.34Š| ||
| 157 | M | 54.2 | Low | 51.6 | Low | 181 Ų | 181 | 116.7 Ų | 116.7 | 89% | 0.892 | 74% | 0.739 | S | S | * | * | trans | -63 | 115.9 | 163.8 | -69.6 | -145.4 | 72 | 0 | 0 | 108.6 | V155 D159 | V155-M157 PolarHBondContact O-N 2.88Å; M157-D159 PolarHBondContact O-N 2.89Å | ||
| 158 | V | 50.5 | Low | 50.4 | Low | 138 Ų | 138 | 115.5 Ų | 115.5 | 84% | 0.836 | 75% | 0.749 | S | S | * | * | trans | -82.2 | 111.6 | 170 | 64 | 0 | 0 | 0 | 0 | 108.5 | G156 | G156-V158 PolarHBondContact O-N 3.34Š| ||
| 159 | D | 45.8 | Very low | 49.1 | Very low | 131 Ų | 131 | 118.7 Ų | 118.7 | 70% | 0.701 | 76% | 0.756 | S | S | * | * | trans | -73.3 | 144.5 | 170 | -133.1 | -4.9 | 0 | 0 | 0 | 108.7 | M157 S161 | M157-D159 PolarHBondContact O-N 2.89Å; D159-S161 PolarHBondContact O-N 3.16Å | ||
| 160 | P | 50.5 | Low | 48 | Very low | 128 Ų | 128 | 123.7 Ų | 123.7 | 83% | 0.831 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -77.8 | 20.9 | -172.8 | 32.9 | -32.7 | 0 | 0 | 0 | 113.6 | ||
| 161 | S | 50.1 | Low | 46.7 | Very low | 99 Ų | 99 | 129.6 Ų | 129.6 | 69% | 0.692 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -123.6 | 102.2 | 171.2 | -82.5 | 0 | 0 | 0 | 0 | 109.2 | D159 A163 | D159-S161 PolarHBondContact O-N 3.16Å; S161-A163 PolarHBondContact O-N 3.44Å |
| 162 | G | 46.7 | Very low | 45.5 | Very low | 91 Ų | 91 | 133.7 Ų | 133.7 | 94% | 0.938 | 79% | 0.793 | S | S | * | * | trans | -56.5 | 107.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 163 | A | 43.5 | Very low | 44.5 | Very low | 90 Ų | 90 | 132.3 Ų | 132.3 | 74% | 0.744 | 79% | 0.786 | S | S | * | * | trans | -147.8 | 119.6 | 162.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | S161 | S161-A163 PolarHBondContact O-N 3.44Š| ||
| 164 | V | 46.9 | Very low | 43.3 | Very low | 147 Ų | 147 | 137.8 Ų | 137.8 | 89% | 0.891 | 79% | 0.794 | S | S | * | * | trans | -83.4 | 118.4 | 176.4 | -174 | 0 | 0 | 0 | 0 | 108 | S166 | V164-S166 PolarHBondContact O-N 2.68Š| ||
| 165 | I | 44.6 | Very low | 42.9 | Very low | 162 Ų | 162 | 143.5 Ų | 143.5 | 83% | 0.831 | 81% | 0.805 | S | S | * | * | trans | -87.8 | 107 | 171.8 | -61.3 | -179.3 | 0 | 0 | 0 | 108.9 | ||||
| 166 | S | 44.7 | Very low | 43.1 | Very low | 110 Ų | 110 | 143 Ų | 143 | 77% | 0.769 | 81% | 0.805 | S | S | * | * | trans | -62.2 | 130 | 167.8 | 171 | 0 | 0 | 0 | 0 | 111.9 | V164 | V164-S166 PolarHBondContact O-N 2.68Š| ||
| 167 | S | 41.2 | Very low | 42.9 | Very low | 105 Ų | 105 | 143.4 Ų | 143.4 | 73% | 0.734 | 80% | 0.8 | S | S | * | * | trans | -139.1 | 119.6 | 158.1 | -162.4 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 168 | G | 38.3 | Very low | 41.9 | Very low | 54 Ų | 54 | 142.7 Ų | 142.7 | 56% | 0.557 | 80% | 0.8 | S | S | * | * | cis | 128 | 65.2 | 19.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 169 | Y | 39.9 | Very low | 41.2 | Very low | 208 Ų | 208 | 143.2 Ų | 143.2 | 82% | 0.816 | 80% | 0.798 | S | S | * | * | trans | -129.2 | 108.7 | 173.1 | -61.8 | -73.7 | 0 | 0 | 0 | 110.5 | ||||
| 170 | Y | 36.7 | Very low | 40.7 | Very low | 234 Ų | 234 | 144 Ų | 144 | 92% | 0.918 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 127.3 | 169.9 | -82.9 | -95.8 | 0 | 0 | 0 | 109.7 | ||
| 171 | Y | 33.7 | Very low | 39.9 | Very low | 228 Ų | 228 | 146.6 Ų | 146.6 | 89% | 0.894 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 125.1 | 163 | -94.8 | -88.1 | 0 | 0 | 0 | 109.6 | ||
| 172 | H | 35 | Very low | 39.6 | Very low | 182 Ų | 182 | 147.8 Ų | 147.8 | 84% | 0.843 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 122.9 | 167.1 | -110.9 | -42.6 | 0 | 0 | 0 | 110.4 | ||
| 173 | Q | 38.2 | Very low | 38.9 | Very low | 151 Ų | 151 | 148 Ų | 148 | 71% | 0.706 | 81% | 0.807 | S | S | * | * | trans | -6.8 | 139 | 148.1 | -144.5 | 83.2 | 30 | 0 | 0 | 117.5 | ||||
| 174 | H | 33.5 | Very low | 38.7 | Very low | 179 Ų | 179 | 149.2 Ų | 149.2 | 83% | 0.829 | 81% | 0.81 | S | S | * | * | 171.1 | 119.2 | 122.8 | -87.1 | -67.6 | 0 | 0 | 0 | 112 | |||||
| 175 | H | 39.1 | Very low | 38.8 | Very low | 176 Ų | 176 | 147.6 Ų | 147.6 | 82% | 0.815 | 80% | 0.803 | S | S | * | * | trans | -85.5 | 155.9 | 154.7 | -73.4 | -81.4 | 0 | 0 | 0 | 108.9 | ||||
| 176 | P | 48.7 | Very low | 38.2 | Very low | 128 Ų | 128 | 145.3 Ų | 145.3 | 83% | 0.831 | 80% | 0.801 | S | S | * | * | -144 | 163.8 | 97.4 | 33.5 | -15.5 | 0 | 0 | 0 | 115.3 | |||||
| 177 | A | 38.6 | Very low | 37.8 | Very low | 90 Ų | 90 | 144.6 Ų | 144.6 | 74% | 0.744 | 80% | 0.802 | S | S | * | * | trans | -69.5 | 151.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 178 | N | 33.5 | Very low | 37.7 | Very low | 166 Ų | 166 | 144.3 Ų | 144.3 | 89% | 0.888 | 80% | 0.8 | S | S | * | * | trans | -158.9 | 133.2 | 138.7 | -106.6 | -15.3 | 0 | 0 | 0 | 112.8 | ||||
| 179 | N | 37 | Very low | 38.1 | Very low | 149 Ų | 149 | 150.2 Ų | 150.2 | 80% | 0.797 | 81% | 0.813 | S | S | * | * | trans | -49.1 | 140.1 | 169.9 | -79.4 | -48.9 | 0 | 0 | 0 | 113.4 | ||||
| 180 | T | 33.7 | Very low | 38.3 | Very low | 148 Ų | 148 | 148.9 Ų | 148.9 | 91% | 0.908 | 81% | 0.814 | S | S | * | * | -175.5 | 136.9 | 125.2 | 17.5 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 181 | H | 35.2 | Very low | 38.3 | Very low | 181 Ų | 181 | 145.3 Ų | 145.3 | 84% | 0.838 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 152 | 172.2 | -96.1 | -112 | 0 | 0 | 0 | 114.4 | ||
| 182 | P | 43.4 | Very low | 38.9 | Very low | 124 Ų | 124 | 142.2 Ų | 142.2 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 122.6 | 156.3 | 32.8 | -27.1 | 0 | 0 | 0 | 110.2 | ||
| 183 | A | 32.7 | Very low | 39.8 | Very low | 97 Ų | 97 | 139.4 Ų | 139.4 | 80% | 0.802 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -91.7 | 125.8 | 162.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||
| 184 | S | 38.5 | Very low | 39.7 | Very low | 115 Ų | 115 | 138 Ų | 138 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -66 | 160.8 | 157.5 | -51.5 | 0 | 0 | 0 | 0 | 109.8 | ||
| 185 | P | 48.3 | Very low | 40.5 | Very low | 112 Ų | 112 | 136 Ų | 136 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | -151.5 | 158.3 | 94 | 36 | -17.1 | 0 | 0 | 0 | 117.4 | |||||
| 186 | S | 32.6 | Very low | 41.4 | Very low | 114 Ų | 114 | 133.1 Ų | 133.1 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | trans | 63.2 | 122.6 | 143 | -64 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 187 | A | 35.8 | Very low | 40.8 | Very low | 96 Ų | 96 | 134.5 Ų | 134.5 | 79% | 0.793 | 81% | 0.805 | S | S | * | * | cis | 97.4 | 116.1 | 49.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 188 | S | 40.3 | Very low | 41.1 | Very low | 98 Ų | 98 | 135.4 Ų | 135.4 | 69% | 0.685 | 81% | 0.806 | S | S | * | * | trans | 174.7 | 96.5 | 153.1 | 55.7 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 189 | E | 46.4 | Very low | 41.9 | Very low | 178 Ų | 178 | 133.7 Ų | 133.7 | 83% | 0.832 | 80% | 0.803 | S | S | * | * | 78.8 | 145.5 | 80.1 | 80.5 | -159.3 | 82.4 | 0 | 0 | 114.3 | |||||
| 190 | E | 42.7 | Very low | 42.2 | Very low | 180 Ų | 180 | 132 Ų | 132 | 84% | 0.841 | 80% | 0.803 | S | S | * | * | trans | 77.5 | 137.3 | -171.3 | -78.9 | -177.6 | 50.6 | 0 | 0 | 117.8 | ||||
| 191 | E | 38.2 | Very low | 42.1 | Very low | 160 Ų | 160 | 130.5 Ų | 130.5 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | cis | -171 | 123.4 | -14.4 | -176.7 | 164.4 | 138 | 0 | 0 | 104.6 | ||||
| 192 | L | 46.8 | Very low | 42.1 | Very low | 163 Ų | 163 | 127.2 Ų | 127.2 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | trans | -110 | 138.2 | 169.1 | -70.3 | 174.1 | 0 | 0 | 0 | 108 | ||||
| 193 | P | 52.1 | Low | 41.8 | Very low | 123 Ų | 123 | 126.9 Ų | 126.9 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 130.3 | 148 | 29.1 | -22.1 | 0 | 0 | 0 | 110.9 | ||
| 194 | C | 36.5 | Very low | 42.1 | Very low | 120 Ų | 120 | 127.9 Ų | 127.9 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 145.3 | -173.1 | -54.2 | 0 | 0 | 0 | 0 | 114.4 | ||
| 195 | V | 50.3 | Low | 42 | Very low | 138 Ų | 138 | 126.8 Ų | 126.8 | 84% | 0.836 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 125.2 | 161.7 | -153.3 | 0 | 0 | 0 | 0 | 107.7 | ||
| 196 | P | 58.8 | Low | 41.5 | Very low | 116 Ų | 116 | 126.6 Ų | 126.6 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 154.6 | 173.7 | 30.8 | -30.9 | 0 | 0 | 0 | 112.7 | ||
| 197 | D | 34.6 | Very low | 41.8 | Very low | 156 Ų | 156 | 130.4 Ų | 130.4 | 83% | 0.834 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64 | 162.3 | -162.7 | -63.8 | -73.9 | 0 | 0 | 0 | 118 | ||
| 198 | S | 45.1 | Very low | 42.1 | Very low | 110 Ų | 110 | 130.8 Ų | 130.8 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 159.2 | 162.7 | -43.7 | 0 | 0 | 0 | 0 | 113.4 | ||
| 199 | P | 52.2 | Low | 42.5 | Very low | 129 Ų | 129 | 132.4 Ų | 132.4 | 84% | 0.838 | 81% | 0.807 | S | S | * | * | trans | -114.8 | 109.9 | 144.3 | 32.2 | -23.7 | 0 | 0 | 0 | 111.3 | ||||
| 200 | S | 42 | Very low | 42.3 | Very low | 113 Ų | 113 | 128.9 Ų | 128.9 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -71.5 | 134.8 | 142.1 | -86.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 201 | C | 32.2 | Very low | 42.3 | Very low | 118 Ų | 118 | 129 Ų | 129 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | -175 | 118.4 | 136.9 | -95.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 202 | S | 34.1 | Very low | 42.2 | Very low | 112 Ų | 112 | 128.1 Ų | 128.1 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | 76.9 | 112.3 | 123.3 | -55.2 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 203 | S | 37 | Very low | 41.5 | Very low | 116 Ų | 116 | 126.1 Ų | 126.1 | 81% | 0.811 | 80% | 0.801 | S | S | * | * | trans | -24.5 | 144 | 149.9 | -49.3 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 204 | S | 40.2 | Very low | 41 | Very low | 119 Ų | 119 | 125.5 Ų | 125.5 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | -159.5 | 104.8 | 138.7 | -75.1 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 205 | A | 36.8 | Very low | 41.6 | Very low | 92 Ų | 92 | 125.2 Ų | 125.2 | 76% | 0.76 | 80% | 0.796 | S | S | * | * | 65.8 | 111.5 | 84.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 206 | S | 37.5 | Very low | 41.5 | Very low | 108 Ų | 108 | 125 Ų | 125 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | trans | 84 | 107.3 | 146.8 | -54 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 207 | Q | 38.1 | Very low | 40.3 | Very low | 193 Ų | 193 | 124.9 Ų | 124.9 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | -177.5 | 123.1 | 99.8 | -98.4 | 172.5 | 77.4 | 0 | 0 | 112 | |||||
| 208 | S | 42.6 | Very low | 40.6 | Very low | 105 Ų | 105 | 122.9 Ų | 122.9 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | trans | -83.8 | 163.1 | 162.8 | -50.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 209 | P | 47.7 | Very low | 40.7 | Very low | 132 Ų | 132 | 123.5 Ų | 123.5 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | -129.5 | 142.7 | 115.5 | 34.8 | -26.2 | 0 | 0 | 0 | 113 | |||||
| 210 | S | 42.2 | Very low | 40.1 | Very low | 104 Ų | 104 | 123.6 Ų | 123.6 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -71.4 | 135 | -180 | -41.9 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 211 | Q | 43.4 | Very low | 39.6 | Very low | 182 Ų | 182 | 123.9 Ų | 123.9 | 85% | 0.85 | 80% | 0.799 | S | S | * | * | trans | -152.9 | 85.2 | 149.9 | -69.5 | -70.2 | -6.7 | 0 | 0 | 105 | ||||
| 212 | N | 36.8 | Very low | 39.9 | Very low | 142 Ų | 142 | 123.7 Ų | 123.7 | 76% | 0.759 | 80% | 0.799 | S | S | * | * | 41.3 | 102.9 | 94.1 | -140.8 | 27.9 | 0 | 0 | 0 | 113.2 | |||||
| 213 | C | 31.7 | Very low | 40.6 | Very low | 120 Ų | 120 | 124.3 Ų | 124.3 | 81% | 0.811 | 80% | 0.8 | S | S | * | * | 168.9 | 136.2 | 120.1 | -85 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 214 | S | 41.6 | Very low | 40.4 | Very low | 110 Ų | 110 | 124.4 Ų | 124.4 | 77% | 0.769 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 166.2 | -174 | -50.7 | 0 | 0 | 0 | 0 | 117.5 | ||
| 215 | P | 47.9 | Very low | 40 | Very low | 114 Ų | 114 | 122.3 Ų | 122.3 | 74% | 0.74 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 142.6 | 172.8 | 31.8 | -34.3 | 0 | 0 | 0 | 111.3 | ||
| 216 | P | 48.7 | Very low | 40.1 | Very low | 133 Ų | 133 | 128.5 Ų | 128.5 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 129.7 | 171.5 | 29.7 | -30.5 | 0 | 0 | 0 | 111.2 | ||
| 217 | S | 34.8 | Very low | 39.8 | Very low | 114 Ų | 114 | 129.3 Ų | 129.3 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 155.3 | 174.9 | -48.5 | 0 | 0 | 0 | 0 | 113.6 | ||
| 218 | S | 41 | Very low | 39.6 | Very low | 114 Ų | 114 | 125.1 Ų | 125.1 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 153.5 | 166 | -35.5 | 0 | 0 | 0 | 0 | 113.5 | ||
| 219 | P | 45.4 | Very low | 39.3 | Very low | 124 Ų | 124 | 125.6 Ų | 125.6 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | trans | -103 | 115 | 147.8 | 31.3 | -23.2 | 0 | 0 | 0 | 110.3 | ||||
| 220 | V | 40.4 | Very low | 39.1 | Very low | 131 Ų | 131 | 130.2 Ų | 130.2 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | trans | -59.5 | 130.6 | 151.3 | 54.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 221 | S | 32.2 | Very low | 39 | Very low | 119 Ų | 119 | 133.8 Ų | 133.8 | 83% | 0.832 | 82% | 0.815 | S | S | * | * | trans | -168.2 | 106.1 | 152.1 | -82.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 222 | S | 37.2 | Very low | 38.5 | Very low | 114 Ų | 114 | 128.4 Ų | 128.4 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -112.3 | 148.6 | 145.5 | -73.2 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 223 | P | 49.1 | Very low | 38.9 | Very low | 124 Ų | 124 | 130.7 Ų | 130.7 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | -154 | 170.6 | 70.5 | 38.8 | -17.7 | 0 | 0 | 0 | 117.7 | |||||
| 224 | S | 33.3 | Very low | 39.4 | Very low | 119 Ų | 119 | 136 Ų | 136 | 83% | 0.832 | 81% | 0.814 | S | S | * | * | trans | 77.3 | 115.7 | 144.3 | -165.3 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 225 | G | 30.8 | Very low | 39.4 | Very low | 75 Ų | 75 | 139.9 Ų | 139.9 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | trans | -169.8 | 82.3 | 162.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | S227 | G225-S227 PolarHBondContact O-N 2.88Š| ||
| 226 | Y | 38.9 | Very low | 39.3 | Very low | 221 Ų | 221 | 146 Ų | 146 | 87% | 0.867 | 83% | 0.825 | S | S | * | * | trans | -48.9 | 128.9 | 165.4 | -107.3 | -108.8 | 0 | 0 | 0 | 110.6 | ||||
| 227 | S | 31.5 | Very low | 38.7 | Very low | 126 Ų | 126 | 145.2 Ų | 145.2 | 88% | 0.881 | 82% | 0.818 | S | S | * | * | trans | -160.5 | 102.1 | 142.2 | -87.2 | 0 | 0 | 0 | 0 | 110.4 | G225 | G225-S227 PolarHBondContact O-N 2.88Š| ||
| 228 | S | 34.3 | Very low | 38.9 | Very low | 104 Ų | 104 | 145.7 Ų | 145.7 | 73% | 0.727 | 82% | 0.822 | S | S | * | * | trans | -85.9 | 126.3 | 167.3 | -163 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 229 | S | 36.4 | Very low | 38.8 | Very low | 116 Ų | 116 | 145.7 Ų | 145.7 | 81% | 0.811 | 82% | 0.822 | S | S | * | * | trans | -151.6 | 110.3 | 151.2 | 65.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 230 | R | 42.4 | Very low | 38.6 | Very low | 228 Ų | 228 | 147.3 Ų | 147.3 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -62.8 | 141.3 | 168.3 | -60.2 | 165.5 | 175.9 | -115.1 | -1.1 | 110.9 | ||||
| 231 | L | 40.5 | Very low | 38.6 | Very low | 180 Ų | 180 | 151.4 Ų | 151.4 | 94% | 0.942 | 82% | 0.82 | S | S | * | * | trans | -171.6 | 125.9 | 147.6 | -95.5 | 131.9 | 0 | 0 | 0 | 105.3 | ||||
| 232 | G | 34.3 | Very low | 39 | Very low | 68 Ų | 68 | 149.4 Ų | 149.4 | 70% | 0.701 | 81% | 0.811 | S | S | * | * | cis | 123.2 | 88.2 | 28.6 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 233 | K | 43.5 | Very low | 38.8 | Very low | 190 Ų | 190 | 151.6 Ų | 151.6 | 83% | 0.826 | 81% | 0.813 | S | S | * | * | trans | 43.9 | 123.8 | 148.8 | -61.3 | -174.1 | 177.9 | 177.4 | 0 | 121.2 | ||||
| 234 | R | 42.3 | Very low | 38.2 | Very low | 232 Ų | 232 | 151.1 Ų | 151.1 | 88% | 0.875 | 81% | 0.813 | S | S | * | * | trans | 55.5 | 124.4 | 131.6 | -65.4 | 168.7 | 33.5 | 170.3 | -6.4 | 119.4 | ||||
| 235 | K | 41.3 | Very low | 38.8 | Very low | 192 Ų | 192 | 150.1 Ų | 150.1 | 84% | 0.835 | 81% | 0.812 | S | S | * | * | -162.7 | 125.5 | 124 | -163 | 137.8 | 173.2 | -171.9 | 0 | 113 | T237 | K235-T237 HydrophobicContact CG-CG2 4.28Š| |||
| 236 | R | 47.3 | Very low | 39.6 | Very low | 241 Ų | 241 | 154.9 Ų | 154.9 | 91% | 0.909 | 82% | 0.819 | S | S | * | * | trans | -71.5 | 136.7 | 157.9 | -79.2 | 176.7 | 164.3 | 131 | -3.6 | 108.6 | ||||
| 237 | T | 36.1 | Very low | 39.4 | Very low | 117 Ų | 117 | 150.2 Ų | 150.2 | 72% | 0.718 | 82% | 0.818 | S | S | * | * | trans | -142.1 | 107.2 | 152.1 | 50 | 0 | 0 | 0 | 0 | 109.9 | K235 | K235-T237 HydrophobicContact CG-CG2 4.28Š| ||
| 238 | S | 39.5 | Very low | 39.9 | Very low | 124 Ų | 124 | 149.7 Ų | 149.7 | 87% | 0.867 | 81% | 0.814 | S | S | * | * | trans | -60.3 | 133.1 | 147.4 | 175.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 239 | S | 38.7 | Very low | 40.2 | Very low | 114 Ų | 114 | 153.3 Ų | 153.3 | 80% | 0.797 | 82% | 0.817 | S | S | * | * | trans | -150.6 | 116.1 | 161.2 | -176.6 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 240 | E | 40.5 | Very low | 40.3 | Very low | 158 Ų | 158 | 153.5 Ų | 153.5 | 74% | 0.738 | 82% | 0.819 | S | S | * | * | trans | -77.9 | 150.5 | 173.8 | -159 | -177 | 120 | 0 | 0 | 110.1 | ||||
| 241 | R | 40 | Very low | 40.5 | Very low | 218 Ų | 218 | 148.2 Ų | 148.2 | 82% | 0.823 | 82% | 0.816 | S | S | * | * | trans | 95.8 | 117.6 | 145.2 | -141.9 | 168.4 | -166.8 | 161.8 | 3.3 | 120.5 | ||||
| 242 | A | 39.9 | Very low | 40.4 | Very low | 77 Ų | 77 | 144.6 Ų | 144.6 | 64% | 0.636 | 81% | 0.806 | S | S | * | * | trans | 67.5 | 112.6 | 146 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 243 | N | 35 | Very low | 41.1 | Very low | 160 Ų | 160 | 150.1 Ų | 150.1 | 86% | 0.856 | 82% | 0.816 | S | S | * | * | -172.9 | 152 | 106.8 | -91.1 | -49.2 | 0 | 0 | 0 | 111.6 | |||||
| 244 | S | 34.9 | Very low | 41.1 | Very low | 114 Ų | 114 | 149.6 Ų | 149.6 | 80% | 0.797 | 82% | 0.817 | S | S | * | * | trans | 87.1 | 72.8 | 167.6 | -49.8 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 245 | A | 45.5 | Very low | 41.4 | Very low | 97 Ų | 97 | 150.5 Ų | 150.5 | 80% | 0.802 | 82% | 0.82 | S | S | * | * | trans | -55.9 | 131.2 | 138.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 246 | L | 48.9 | Very low | 42 | Very low | 176 Ų | 176 | 146 Ų | 146 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | trans | 167.8 | 84.1 | 145.7 | -86.6 | -179.4 | 0 | 0 | 0 | 108.2 | ||||
| 247 | S | 35.2 | Very low | 42 | Very low | 122 Ų | 122 | 139.4 Ų | 139.4 | 85% | 0.853 | 80% | 0.804 | S | S | * | * | trans | -172.4 | 78 | 147.4 | -175 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 248 | S | 41.9 | Very low | 42.5 | Very low | 115 Ų | 115 | 143.5 Ų | 143.5 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -113.9 | 103.8 | 162.8 | -62 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 249 | F | 40.7 | Very low | 43 | Very low | 181 Ų | 181 | 143.4 Ų | 143.4 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | 158.4 | 98.9 | 134.5 | -106 | -93.8 | 0 | 0 | 0 | 110.4 | ||||
| 250 | S | 38.4 | Very low | 43.7 | Very low | 120 Ų | 120 | 142.7 Ų | 142.7 | 84% | 0.839 | 80% | 0.802 | S | S | * | * | trans | -164.4 | 79.2 | 141.1 | -80.3 | 0 | 0 | 0 | 0 | 107.3 | S252 | S250-S252 PolarHBondContact O-N 3.47Š| ||
| 251 | S | 47 | Very low | 44.3 | Very low | 116 Ų | 116 | 141 Ų | 141 | 81% | 0.811 | 80% | 0.802 | S | S | * | * | trans | -64.6 | 88.4 | 158.7 | 7.7 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 252 | S | 36.5 | Very low | 45 | Very low | 104 Ų | 104 | 140.3 Ų | 140.3 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | -106.3 | 126 | 166.4 | -170.5 | 0 | 0 | 0 | 0 | 109 | S250 Q254 | S250-S252 PolarHBondContact O-N 3.47Å; S252-Q254 PolarHBondContact O-N 3.29Å | ||
| 253 | M | 50.2 | Low | 46.3 | Very low | 185 Ų | 185 | 140.6 Ų | 140.6 | 91% | 0.911 | 79% | 0.792 | S | S | * | * | trans | -71.4 | 80.9 | -168.7 | -133.6 | 111.4 | 66.5 | 0 | 0 | 111.1 | ||||
| 254 | Q | 43.8 | Very low | 48.3 | Very low | 179 Ų | 179 | 136.4 Ų | 136.4 | 84% | 0.836 | 78% | 0.776 | S | S | * | * | trans | -115.6 | 80.1 | 161.4 | -74.5 | -162.7 | -49.8 | 0 | 0 | 109.8 | S252 S256 | S252-Q254 PolarHBondContact O-N 3.29Å; Q254-S256 PolarHBondContact O-N 3.45Å | ||
| 255 | R | 48.3 | Very low | 50.7 | Low | 250 Ų | 250 | 140.5 Ų | 140.5 | 94% | 0.943 | 77% | 0.773 | S | S | * | * | trans | -92.8 | 77.9 | 164.4 | -86.7 | -171.2 | 164.8 | -141.9 | -0.3 | 109.4 | ||||
| 256 | S | 52.8 | Low | 52.7 | Low | 97 Ų | 97 | 143.6 Ų | 143.6 | 68% | 0.678 | 77% | 0.769 | S | S | * | * | trans | -178.8 | 122.4 | 161.9 | 135.5 | 0 | 0 | 0 | 0 | 102.9 | Q254 | Q254-S256 PolarHBondContact O-N 3.45Š| ||
| 257 | S | 48.5 | Very low | 54.6 | Low | 104 Ų | 104 | 140.3 Ų | 140.3 | 73% | 0.727 | 75% | 0.749 | S | S | * | * | S | Bend | cis | -159.2 | 109.7 | 29.1 | -75.8 | 0 | 0 | 0 | 0 | 107.9 | ||
| 258 | Y | 47.2 | Very low | 57.3 | Low | 203 Ų | 203 | 142.2 Ų | 142.2 | 80% | 0.796 | 74% | 0.737 | S | S | * | * | trans | -174.6 | 60.5 | 154.5 | 62.8 | -82.5 | 0 | 0 | 0 | 110.8 | S260 | Y258-S260 PolarHBondContact O-N 2.96Š| ||
| 259 | S | 48 | Very low | 59.6 | Low | 121 Ų | 121 | 140.7 Ų | 140.7 | 85% | 0.846 | 72% | 0.718 | S | S | * | * | trans | -75.8 | 47.8 | 154.7 | 54.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 260 | S | 54.4 | Low | 62.2 | Low | 100 Ų | 100 | 137 Ų | 137 | 70% | 0.699 | 70% | 0.703 | S | S | * | * | trans | -89.5 | -4.1 | -166.8 | 129.7 | 0 | 0 | 0 | 0 | 114 | Y258 | Y258-S260 PolarHBondContact O-N 2.96Š| ||
| 261 | T | 53.9 | Low | 64.9 | Low | 121 Ų | 121 | 136.5 Ų | 136.5 | 74% | 0.742 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -120.3 | 0.1 | -168.3 | 48 | 0 | 0 | 0 | 0 | 118.1 | ||
| 262 | K | 54.4 | Low | 67.2 | Low | 204 Ų | 204 | 135.7 Ų | 135.7 | 89% | 0.887 | 67% | 0.674 | S | S | * | * | trans | -159.6 | 59.3 | 165.2 | -63.4 | -167.9 | -179.5 | 172.2 | 0 | 113.5 | ||||
| 263 | K | 66 | Low | 70.1 | Confident | 83 Ų | 83 | 137.2 Ų | 137.2 | 36% | 0.361 | 67% | 0.669 | S | S | . | * | trans | -70.1 | 131 | 160.4 | 68.3 | 172.9 | 176.3 | 177.8 | 0 | 108.8 | E267 R268 E271 | K263-E267 WeakPolarHBondContact CA-OE2 3.44Å; K263-E267 WeakPolarHBondContact CB-OE2 3.42Å; K263-R268 HydrophobicContact CD-CB 4.04Å; K263-R268 HydrophobicContact CG-CB 4.43Å; K263-E271 IonicContact NZ-OE2 3.72Å; K263-E271 PolarHBondContact NZ-OE2 3.47Å | ||
| 264 | S | 78.3 | Confident | 72.3 | Confident | 73 Ų | 73 | 136.2 Ų | 136.2 | 51% | 0.51 | 66% | 0.655 | S | S | . | * | trans | -61.1 | 141.9 | -179.4 | 179.7 | 0 | 0 | 0 | 0 | 108.6 | K266 E267 R268 | S264-K266 PolarHBondContact O-N 2.91Å; S264-E267 PolarHBondContact N-OE2 2.95Å; S264-E267 WeakPolarHBondContact O-CA 3.38Å; S264-E267 WeakPolarHBondContact O-CB 3.49Å; S264-E267 PolarHBondContact O-N 3.25Å; S264-R268 PolarHBondContact O-N 3.45Å; S264-R268 VanDerWaalsContact O-N 3.12Å | ||
| 265 | R | 85.4 | Confident | 74.9 | Confident | 199 Ų | 199 | 133.6 Ų | 133.6 | 75% | 0.751 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -47.7 | -40.5 | 176.3 | 177.5 | -179.2 | 170.4 | -170.8 | 2.3 | 111.3 | E267 R268 E269 | R265-E267 PolarHBondContact O-N 3.42Å; R265-R268 PolarHBondContact O-N 2.98Å; R265-E269 WeakPolarHBondContact CG-OE1 3.24Å; R265-E269 IonicContact CZ-OE1 3.56Å; R265-E269 IonicContact NE-OE1 2.85Å; R265-E269 PolarHBondContact NE-OE1 2.82Å; R265-E269 IonicContact NH2-OE1 3.5Å; R265-E269 PolarHBondContact NH2-OE1 3.1Å; R265-E269 WeakPolarHBondContact O-CG 3.48Å; R265-E269 PolarHBondContact O-N 3.02Å |
| 266 | K | 86.9 | Confident | 77.3 | Confident | 163 Ų | 163 | 125.5 Ų | 125.5 | 71% | 0.709 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -64.5 | -35.4 | 177.2 | -173.4 | 172.1 | -178.3 | 173.1 | 0 | 114 | S264 Q270 | S264-K266 PolarHBondContact O-N 2.91Å; K266-Q270 PolarHBondContact O-N 2.94Å |
| 267 | E | 89.6 | Confident | 79.5 | Confident | 107 Ų | 107 | 127.7 Ų | 127.7 | 50% | 0.5 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -70.7 | -39.6 | 177.1 | -177.5 | -172.4 | -176.9 | 0 | 0 | 111 | K263 S264 R265 Q270 E271 | K263-E267 WeakPolarHBondContact CA-OE2 3.44Å; K263-E267 WeakPolarHBondContact CB-OE2 3.42Å; S264-E267 PolarHBondContact N-OE2 2.95Å; S264-E267 WeakPolarHBondContact O-CA 3.38Å; S264-E267 WeakPolarHBondContact O-CB 3.49Å; S264-E267 PolarHBondContact O-N 3.25Å; R265-E267 PolarHBondContact O-N 3.42Å; E267-Q270 PolarHBondContact O-N 3.48Å; E267-E271 WeakPolarHBondContact O-CB 3.38Å; E267-E271 PolarHBondContact O-N 2.92Å |
| 268 | R | 90.9 | Very high | 81.9 | Confident | 161 Ų | 161 | 128.3 Ų | 128.3 | 61% | 0.608 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.1 | -40.6 | 174.1 | -178.3 | -177.7 | -118.2 | 161.9 | 0.3 | 111.9 | K263 S264 R265 E271 N272 | K263-R268 HydrophobicContact CD-CB 4.04Å; K263-R268 HydrophobicContact CG-CB 4.43Å; S264-R268 PolarHBondContact O-N 3.45Å; S264-R268 VanDerWaalsContact O-N 3.12Å; R265-R268 PolarHBondContact O-N 2.98Å; R268-E271 PolarHBondContact O-N 3.22Å; R268-N272 WeakPolarHBondContact O-CB 3.35Å; R268-N272 PolarHBondContact O-N 3.45Å |
| 269 | E | 91.2 | Very high | 84.3 | Confident | 84 Ų | 84 | 123 Ų | 123 | 39% | 0.393 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -63.7 | -45.6 | 177.1 | -74.8 | 164.4 | -176.4 | 0 | 0 | 110.5 | R265 E271 N272 E273 | R265-E269 WeakPolarHBondContact CG-OE1 3.24Å; R265-E269 IonicContact CZ-OE1 3.56Å; R265-E269 IonicContact NE-OE1 2.85Å; R265-E269 PolarHBondContact NE-OE1 2.82Å; R265-E269 IonicContact NH2-OE1 3.5Å; R265-E269 PolarHBondContact NH2-OE1 3.1Å; R265-E269 WeakPolarHBondContact O-CG 3.48Å; R265-E269 PolarHBondContact O-N 3.02Å; E269-E271 PolarHBondContact O-N 3.34Å; E269-N272 WeakPolarHBondContact O-CB 3.46Å; E269-N272 PolarHBondContact O-N 2.92Å; E269-N272 VanDerWaalsContact O-N 3.13Å; E269-E273 WeakPolarHBondContact O-CG 3.4Å; E269-E273 PolarHBondContact O-N 3.26Å |
| 270 | Q | 94.9 | Very high | 86.7 | Confident | 103 Ų | 103 | 121.4 Ų | 121.4 | 48% | 0.481 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.3 | -38.1 | 176.9 | -172.3 | 173.6 | 55.9 | 0 | 0 | 113.4 | K266 E267 N272 E273 R274 | K266-Q270 PolarHBondContact O-N 2.94Å; E267-Q270 PolarHBondContact O-N 3.48Å; Q270-N272 VanDerWaalsContact C-N 3.32Å; Q270-E273 PolarHBondContact O-N 2.96Å; Q270-R274 WeakPolarHBondContact O-CG 3.31Å; Q270-R274 PolarHBondContact O-N 3.33Å |
| 271 | E | 94.6 | Very high | 88.8 | Confident | 109 Ų | 109 | 120.8 Ų | 120.8 | 51% | 0.509 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.1 | -39 | 173.2 | -176.3 | -173.5 | -173 | 0 | 0 | 111.5 | K263 E267 R268 E269 R274 K275 | K263-E271 IonicContact NZ-OE2 3.72Å; K263-E271 PolarHBondContact NZ-OE2 3.47Å; E267-E271 WeakPolarHBondContact O-CB 3.38Å; E267-E271 PolarHBondContact O-N 2.92Å; R268-E271 PolarHBondContact O-N 3.22Å; E269-E271 PolarHBondContact O-N 3.34Å; E271-R274 PolarHBondContact O-N 3.47Å; E271-K275 WeakPolarHBondContact O-CB 3.48Å; E271-K275 PolarHBondContact O-N 3.46Å |
| 272 | N | 95.9 | Very high | 91 | Very high | 100 Ų | 100 | 119 Ų | 119 | 54% | 0.535 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -65.3 | -45.6 | 176.6 | -164.4 | -10.7 | 0 | 0 | 0 | 111.1 | R268 E269 Q270 R274 K275 V276 | R268-N272 WeakPolarHBondContact O-CB 3.35Å; R268-N272 PolarHBondContact O-N 3.45Å; E269-N272 WeakPolarHBondContact O-CB 3.46Å; E269-N272 PolarHBondContact O-N 2.92Å; E269-N272 VanDerWaalsContact O-N 3.13Å; Q270-N272 VanDerWaalsContact C-N 3.32Å; N272-R274 VanDerWaalsContact C-N 3.32Å; N272-R274 PolarHBondContact O-N 3.28Å; N272-K275 CarbonylContact O-C 3.59Å; N272-K275 WeakPolarHBondContact O-CB 3.47Å; N272-K275 PolarHBondContact O-N 2.98Å; N272-K275 VanDerWaalsContact O-N 3.09Å; N272-V276 WeakPolarHBondContact O-CG2 3.34Å; N272-V276 PolarHBondContact O-N 3.09Å |
| 273 | E | 96.7 | Very high | 93.1 | Very high | 135 Ų | 135 | 113.4 Ų | 113.4 | 63% | 0.631 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -57.1 | -44.4 | 174.9 | -72.5 | 173.6 | -177 | 0 | 0 | 112.1 | E269 Q270 K275 V276 Q277 | E269-E273 WeakPolarHBondContact O-CG 3.4Å; E269-E273 PolarHBondContact O-N 3.26Å; Q270-E273 PolarHBondContact O-N 2.96Å; E273-K275 VanDerWaalsContact C-N 3.33Å; E273-K275 PolarHBondContact O-N 3.34Å; E273-V276 PolarHBondContact O-N 3.5Å; E273-Q277 PolarHBondContact O-N 2.81Å |
| 274 | R | 97.2 | Very high | 94.6 | Very high | 164 Ų | 164 | 115.6 Ų | 115.6 | 62% | 0.619 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60.7 | -43.4 | 174.6 | -73.3 | 179.7 | -175.8 | -177.2 | 3 | 112 | Q270 E271 N272 V276 Q277 E278 | Q270-R274 WeakPolarHBondContact O-CG 3.31Å; Q270-R274 PolarHBondContact O-N 3.33Å; E271-R274 PolarHBondContact O-N 3.47Å; N272-R274 VanDerWaalsContact C-N 3.32Å; N272-R274 PolarHBondContact O-N 3.28Å; R274-V276 VanDerWaalsContact C-N 3.34Å; R274-Q277 PolarHBondContact O-N 2.81Å; R274-E278 WeakPolarHBondContact O-CB 3.25Å; R274-E278 PolarHBondContact O-N 3.11Å |
| 275 | K | 98.2 | Very high | 95.6 | Very high | 125 Ų | 125 | 118.4 Ų | 118.4 | 54% | 0.543 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.3 | -38.5 | 178.1 | -171.6 | 171.4 | -176 | 173.7 | 0 | 112 | E271 N272 E273 Q277 E278 L279 | E271-K275 WeakPolarHBondContact O-CB 3.48Å; E271-K275 PolarHBondContact O-N 3.46Å; N272-K275 CarbonylContact O-C 3.59Å; N272-K275 WeakPolarHBondContact O-CB 3.47Å; N272-K275 PolarHBondContact O-N 2.98Å; N272-K275 VanDerWaalsContact O-N 3.09Å; E273-K275 VanDerWaalsContact C-N 3.33Å; E273-K275 PolarHBondContact O-N 3.34Å; K275-Q277 VanDerWaalsContact C-N 3.33Å; K275-E278 PolarHBondContact O-N 2.92Å; K275-L279 HydrophobicContact CG-CD1 4.07Å; K275-L279 HydrophobicContact CG-CG 4.37Å; K275-L279 VanDerWaalsContact O-CB 3.31Å; K275-L279 WeakPolarHBondContact O-CB 3.48Å; K275-L279 VanDerWaalsContact O-CG 3.24Å; K275-L279 WeakPolarHBondContact O-CG 3.32Å; K275-L279 PolarHBondContact O-N 3.4Å |
| 276 | V | 98.6 | Very high | 96.2 | Very high | 80 Ų | 80 | 113.6 Ų | 113.6 | 49% | 0.485 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 173.9 | 169.5 | 0 | 0 | 0 | 0 | 110.2 | N272 E273 R274 L279 T280 | N272-V276 WeakPolarHBondContact O-CG2 3.34Å; N272-V276 PolarHBondContact O-N 3.09Å; E273-V276 PolarHBondContact O-N 3.5Å; R274-V276 VanDerWaalsContact C-N 3.34Å; V276-L279 PolarHBondContact O-N 2.91Å; V276-T280 WeakPolarHBondContact O-CB 3.31Å; V276-T280 PolarHBondContact O-N 3.39Å; V276-T280 PolarHBondContact O-OG1 3.31Å |
| 277 | Q | 98.5 | Very high | 96.8 | Very high | 142 Ų | 142 | 112.8 Ų | 112.8 | 66% | 0.664 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.7 | -46.9 | 178 | -168.1 | 172.1 | 20 | 0 | 0 | 111.8 | E273 R274 K275 T280 E281 | E273-Q277 PolarHBondContact O-N 2.81Å; R274-Q277 PolarHBondContact O-N 2.81Å; K275-Q277 VanDerWaalsContact C-N 3.33Å; Q277-T280 WeakPolarHBondContact O-CB 3.47Å; Q277-T280 PolarHBondContact O-N 2.98Å; Q277-T280 VanDerWaalsContact O-N 3.16Å; Q277-E281 PolarHBondContact O-N 3.41Å |
| 278 | E | 98.3 | Very high | 97.2 | Very high | 118 Ų | 118 | 110.1 Ų | 110.1 | 55% | 0.551 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.5 | -46.7 | 176.7 | -177.6 | 178.9 | -174.6 | 0 | 0 | 111.8 | R274 K275 T280 E281 Q282 | R274-E278 WeakPolarHBondContact O-CB 3.25Å; R274-E278 PolarHBondContact O-N 3.11Å; K275-E278 PolarHBondContact O-N 2.92Å; E278-T280 PolarHBondContact O-N 3.42Å; E278-E281 PolarHBondContact O-N 2.9Å; E278-Q282 VanDerWaalsContact O-CG 3.32Å; E278-Q282 WeakPolarHBondContact O-CG 3.47Å; E278-Q282 PolarHBondContact O-N 3.46Å |
| 279 | L | 98.8 | Very high | 97.6 | Very high | 90 Ų | 90 | 106.3 Ų | 106.3 | 47% | 0.471 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.2 | -30.9 | 176.4 | -74.2 | 173.9 | 0 | 0 | 0 | 112.4 | K275 V276 N283 | K275-L279 HydrophobicContact CG-CD1 4.07Å; K275-L279 HydrophobicContact CG-CG 4.37Å; K275-L279 VanDerWaalsContact O-CB 3.31Å; K275-L279 WeakPolarHBondContact O-CB 3.48Å; K275-L279 VanDerWaalsContact O-CG 3.24Å; K275-L279 WeakPolarHBondContact O-CG 3.32Å; K275-L279 PolarHBondContact O-N 3.4Å; V276-L279 PolarHBondContact O-N 2.91Å; L279-N283 VanDerWaalsContact O-CB 3.31Å; L279-N283 WeakPolarHBondContact O-CB 3.27Å; L279-N283 PolarHBondContact O-N 2.81Å; L279-N283 PolarHBondContact O-ND2 2.94Å |
| 280 | T | 98.6 | Very high | 98 | Very high | 89 Ų | 89 | 108 Ų | 108 | 55% | 0.546 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -68 | -45.7 | 176.5 | -59.3 | 0 | 0 | 0 | 0 | 110.4 | V276 Q277 E278 N283 E284 | V276-T280 WeakPolarHBondContact O-CB 3.31Å; V276-T280 PolarHBondContact O-N 3.39Å; V276-T280 PolarHBondContact O-OG1 3.31Å; Q277-T280 WeakPolarHBondContact O-CB 3.47Å; Q277-T280 PolarHBondContact O-N 2.98Å; Q277-T280 VanDerWaalsContact O-N 3.16Å; E278-T280 PolarHBondContact O-N 3.42Å; T280-N283 PolarHBondContact O-N 2.66Å; T280-E284 PolarHBondContact O-N 2.95Å |
| 281 | E | 98.6 | Very high | 98.2 | Very high | 87 Ų | 87 | 109.2 Ų | 109.2 | 41% | 0.407 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 176.4 | -169.6 | -171 | 160.5 | 0 | 0 | 111.9 | Q277 E278 N283 E284 R285 | Q277-E281 PolarHBondContact O-N 3.41Å; E278-E281 PolarHBondContact O-N 2.9Å; E281-N283 VanDerWaalsContact C-N 3.35Å; E281-N283 PolarHBondContact O-N 2.81Å; E281-E284 WeakPolarHBondContact O-CB 3.4Å; E281-E284 PolarHBondContact O-N 3.37Å; E281-R285 PolarHBondContact O-N 2.91Å; E281-R285 IonicContact OE1-CZ 2.64Å; E281-R285 IonicContact OE1-NH1 3.05Å; E281-R285 PolarHBondContact OE1-NH1 3Å; E281-R285 IonicContact OE1-NH2 3.67Å; E281-R285 PolarHBondContact OE1-NH2 3.02Å |
| 282 | Q | 98.7 | Very high | 98.4 | Very high | 84 Ų | 84 | 109.7 Ų | 109.7 | 39% | 0.393 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.9 | -42.7 | 175 | -71.1 | -66.6 | -33 | 0 | 0 | 111.6 | E278 E284 R285 L286 | E278-Q282 VanDerWaalsContact O-CG 3.32Å; E278-Q282 WeakPolarHBondContact O-CG 3.47Å; E278-Q282 PolarHBondContact O-N 3.46Å; Q282-E284 VanDerWaalsContact C-N 3.33Å; Q282-E284 PolarHBondContact O-N 3.43Å; Q282-R285 PolarHBondContact O-N 3.02Å; Q282-L286 WeakPolarHBondContact O-CB 3.49Å; Q282-L286 WeakPolarHBondContact O-CG 3.34Å; Q282-L286 PolarHBondContact O-N 3.28Å |
| 283 | N | 98.8 | Very high | 98.5 | Very high | 85 Ų | 85 | 108.9 Ų | 108.9 | 46% | 0.455 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 175.4 | -90.2 | -63.1 | 0 | 0 | 0 | 112.3 | L279 T280 E281 L286 K287 | L279-N283 VanDerWaalsContact O-CB 3.31Å; L279-N283 WeakPolarHBondContact O-CB 3.27Å; L279-N283 PolarHBondContact O-N 2.81Å; L279-N283 PolarHBondContact O-ND2 2.94Å; T280-N283 PolarHBondContact O-N 2.66Å; E281-N283 VanDerWaalsContact C-N 3.35Å; E281-N283 PolarHBondContact O-N 2.81Å; N283-L286 PolarHBondContact O-N 2.93Å; N283-K287 WeakPolarHBondContact O-CB 3.34Å; N283-K287 VanDerWaalsContact O-CG 3.25Å; N283-K287 WeakPolarHBondContact O-CG 3.31Å; N283-K287 PolarHBondContact O-N 3.38Å |
| 284 | E | 98.7 | Very high | 98.6 | Very high | 130 Ų | 130 | 104 Ų | 104 | 61% | 0.607 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.6 | -48.4 | 175.3 | -168.8 | -137.3 | 140.9 | 0 | 0 | 111.1 | T280 E281 Q282 L286 K287 A288 | T280-E284 PolarHBondContact O-N 2.95Å; E281-E284 WeakPolarHBondContact O-CB 3.4Å; E281-E284 PolarHBondContact O-N 3.37Å; Q282-E284 VanDerWaalsContact C-N 3.33Å; Q282-E284 PolarHBondContact O-N 3.43Å; E284-L286 PolarHBondContact O-N 3.46Å; E284-K287 WeakPolarHBondContact O-CB 3.39Å; E284-K287 PolarHBondContact O-N 2.86Å; E284-A288 PolarHBondContact O-N 3.28Å; E284-A288 VanDerWaalsContact O-N 3.09Å |
| 285 | R | 98.8 | Very high | 98.7 | Very high | 131 Ų | 131 | 100.8 Ų | 100.8 | 49% | 0.494 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.2 | -46.8 | 175.2 | -76.7 | -167.9 | -178.4 | 101.7 | 3.7 | 112.5 | E281 Q282 K287 A288 E289 | E281-R285 PolarHBondContact O-N 2.91Å; E281-R285 IonicContact OE1-CZ 2.64Å; E281-R285 IonicContact OE1-NH1 3.05Å; E281-R285 PolarHBondContact OE1-NH1 3Å; E281-R285 IonicContact OE1-NH2 3.67Å; E281-R285 PolarHBondContact OE1-NH2 3.02Å; Q282-R285 PolarHBondContact O-N 3.02Å; R285-K287 VanDerWaalsContact C-N 3.32Å; R285-K287 PolarHBondContact O-N 3.44Å; R285-A288 PolarHBondContact O-N 2.96Å; R285-E289 PolarHBondContact O-N 3.47Å |
| 286 | L | 98.9 | Very high | 98.7 | Very high | 99 Ų | 99 | 98.6 Ų | 98.6 | 52% | 0.518 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.8 | -37.9 | 179.6 | -73.4 | 172.8 | 0 | 0 | 0 | 112 | Q282 N283 E284 E289 I290 | Q282-L286 WeakPolarHBondContact O-CB 3.49Å; Q282-L286 WeakPolarHBondContact O-CG 3.34Å; Q282-L286 PolarHBondContact O-N 3.28Å; N283-L286 PolarHBondContact O-N 2.93Å; E284-L286 PolarHBondContact O-N 3.46Å; L286-E289 PolarHBondContact O-N 3.31Å; L286-I290 VanDerWaalsContact O-CG1 3.27Å; L286-I290 WeakPolarHBondContact O-CG1 3.38Å; L286-I290 PolarHBondContact O-N 2.89Å |
| 287 | K | 98.8 | Very high | 98.7 | Very high | 145 Ų | 145 | 99.8 Ų | 99.8 | 63% | 0.63 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.6 | -46.7 | 174.6 | -76.8 | 171.3 | -178.9 | -179.8 | 0 | 111.5 | N283 E284 R285 E289 I290 E291 | N283-K287 WeakPolarHBondContact O-CB 3.34Å; N283-K287 VanDerWaalsContact O-CG 3.25Å; N283-K287 WeakPolarHBondContact O-CG 3.31Å; N283-K287 PolarHBondContact O-N 3.38Å; E284-K287 WeakPolarHBondContact O-CB 3.39Å; E284-K287 PolarHBondContact O-N 2.86Å; R285-K287 VanDerWaalsContact C-N 3.32Å; R285-K287 PolarHBondContact O-N 3.44Å; K287-E289 VanDerWaalsContact C-N 3.3Å; K287-E289 PolarHBondContact O-N 3.17Å; K287-I290 PolarHBondContact O-N 2.92Å; K287-E291 PolarHBondContact O-N 3.2Å |
| 288 | A | 98.8 | Very high | 98.7 | Very high | 52 Ų | 52 | 98.1 Ų | 98.1 | 43% | 0.43 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.4 | -39.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E284 R285 E291 R292 | E284-A288 PolarHBondContact O-N 3.28Å; E284-A288 VanDerWaalsContact O-N 3.09Å; R285-A288 PolarHBondContact O-N 2.96Å; A288-E291 PolarHBondContact O-N 3.28Å; A288-R292 WeakPolarHBondContact O-CB 3.35Å; A288-R292 PolarHBondContact O-N 2.92Å |
| 289 | E | 98.7 | Very high | 98.7 | Very high | 80 Ų | 80 | 97.8 Ų | 97.8 | 37% | 0.374 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -68.5 | -40 | 178.3 | -176.5 | 59 | -165.7 | 0 | 0 | 112.5 | R285 L286 K287 E291 R292 L293 | R285-E289 PolarHBondContact O-N 3.47Å; L286-E289 PolarHBondContact O-N 3.31Å; K287-E289 VanDerWaalsContact C-N 3.3Å; K287-E289 PolarHBondContact O-N 3.17Å; E289-E291 VanDerWaalsContact C-N 3.34Å; E289-E291 PolarHBondContact O-N 3.47Å; E289-R292 PolarHBondContact O-N 2.68Å; E289-R292 IonicContact OE1-CZ 2.89Å; E289-R292 IonicContact OE1-NE 2.91Å; E289-R292 PolarHBondContact OE1-NE 2.8Å; E289-R292 IonicContact OE1-NH2 2.94Å; E289-R292 PolarHBondContact OE1-NH2 3.19Å; E289-R292 IonicContact OE2-CZ 2.81Å; E289-R292 IonicContact OE2-NE 3.46Å; E289-R292 PolarHBondContact OE2-NE 3.47Å; E289-R292 IonicContact OE2-NH2 2.66Å; E289-L293 HydrophobicContact CG-CD1 4.15Å; E289-L293 WeakPolarHBondContact O-CB 3.43Å; E289-L293 WeakPolarHBondContact O-CG 3.48Å; E289-L293 PolarHBondContact O-N 3.42Å |
| 290 | I | 98.8 | Very high | 98.7 | Very high | 119 Ų | 119 | 96.9 Ų | 96.9 | 61% | 0.61 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.7 | -43.9 | 174.5 | -71 | 165.5 | 0 | 0 | 0 | 110.6 | L286 K287 L293 G294 | L286-I290 VanDerWaalsContact O-CG1 3.27Å; L286-I290 WeakPolarHBondContact O-CG1 3.38Å; L286-I290 PolarHBondContact O-N 2.89Å; K287-I290 PolarHBondContact O-N 2.92Å; I290-L293 PolarHBondContact O-N 3.38Å; I290-G294 PolarHBondContact O-N 3.15Å |
| 291 | E | 98.8 | Very high | 98.7 | Very high | 129 Ų | 129 | 100.7 Ų | 100.7 | 60% | 0.603 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.1 | -49.7 | 177.4 | -176.6 | 174.1 | -166.7 | 0 | 0 | 111 | K287 A288 E289 L293 G294 E295 | K287-E291 PolarHBondContact O-N 3.2Å; A288-E291 PolarHBondContact O-N 3.28Å; E289-E291 VanDerWaalsContact C-N 3.34Å; E289-E291 PolarHBondContact O-N 3.47Å; E291-L293 PolarHBondContact O-N 3.43Å; E291-G294 WeakPolarHBondContact O-CA 3.38Å; E291-G294 PolarHBondContact O-N 3.34Å; E291-G294 VanDerWaalsContact O-N 3.11Å; E291-E295 PolarHBondContact O-N 3.22Å |
| 292 | R | 98.8 | Very high | 98.7 | Very high | 120 Ų | 120 | 103 Ų | 103 | 45% | 0.453 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57 | -46.1 | 177.5 | -169.4 | -162.1 | 69.3 | 71.9 | -2.2 | 112.4 | A288 E289 E295 E296 | A288-R292 WeakPolarHBondContact O-CB 3.35Å; A288-R292 PolarHBondContact O-N 2.92Å; E289-R292 PolarHBondContact O-N 2.68Å; E289-R292 IonicContact OE1-CZ 2.89Å; E289-R292 IonicContact OE1-NE 2.91Å; E289-R292 PolarHBondContact OE1-NE 2.8Å; E289-R292 IonicContact OE1-NH2 2.94Å; E289-R292 PolarHBondContact OE1-NH2 3.19Å; E289-R292 IonicContact OE2-CZ 2.81Å; E289-R292 IonicContact OE2-NE 3.46Å; E289-R292 PolarHBondContact OE2-NE 3.47Å; E289-R292 IonicContact OE2-NH2 2.66Å; R292-E295 PolarHBondContact O-N 3.03Å; R292-E296 PolarHBondContact O-N 3.38Å |
| 293 | L | 98.9 | Very high | 98.7 | Very high | 82 Ų | 82 | 101.1 Ų | 101.1 | 43% | 0.429 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -67.1 | -38.4 | 176.2 | -73.3 | 173.4 | 0 | 0 | 0 | 111.8 | E289 I290 E291 E295 E296 V297 | E289-L293 HydrophobicContact CG-CD1 4.15Å; E289-L293 WeakPolarHBondContact O-CB 3.43Å; E289-L293 WeakPolarHBondContact O-CG 3.48Å; E289-L293 PolarHBondContact O-N 3.42Å; I290-L293 PolarHBondContact O-N 3.38Å; E291-L293 PolarHBondContact O-N 3.43Å; L293-E295 VanDerWaalsContact C-N 3.33Å; L293-E295 PolarHBondContact O-N 3.28Å; L293-E296 WeakPolarHBondContact O-CB 3.34Å; L293-E296 PolarHBondContact O-N 3.41Å; L293-E296 VanDerWaalsContact O-N 3.17Å; L293-V297 WeakPolarHBondContact O-CG2 3.45Å; L293-V297 PolarHBondContact O-N 3.36Å |
| 294 | G | 98.8 | Very high | 98.7 | Very high | 32 Ų | 32 | 100.8 Ų | 100.8 | 33% | 0.33 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -58.6 | -44.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | I290 E291 E296 V297 Q298 | I290-G294 PolarHBondContact O-N 3.15Å; E291-G294 WeakPolarHBondContact O-CA 3.38Å; E291-G294 PolarHBondContact O-N 3.34Å; E291-G294 VanDerWaalsContact O-N 3.11Å; G294-E296 VanDerWaalsContact C-N 3.34Å; G294-E296 PolarHBondContact O-N 2.9Å; G294-V297 PolarHBondContact O-N 2.92Å; G294-Q298 WeakPolarHBondContact O-CG 3.34Å; G294-Q298 PolarHBondContact O-N 3.19Å |
| 295 | E | 98.6 | Very high | 98.7 | Very high | 97 Ų | 97 | 98.5 Ų | 98.5 | 45% | 0.453 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.8 | -40.2 | 174.1 | -70.3 | -169.5 | 171 | 0 | 0 | 112.7 | E291 R292 L293 Q298 R299 | E291-E295 PolarHBondContact O-N 3.22Å; R292-E295 PolarHBondContact O-N 3.03Å; L293-E295 VanDerWaalsContact C-N 3.33Å; L293-E295 PolarHBondContact O-N 3.28Å; E295-Q298 PolarHBondContact O-N 2.97Å; E295-R299 WeakPolarHBondContact O-CB 3.31Å; E295-R299 PolarHBondContact O-N 3.29Å |
| 296 | E | 98.6 | Very high | 98.6 | Very high | 80 Ų | 80 | 98.1 Ų | 98.1 | 37% | 0.374 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 178.8 | -166.1 | 62.5 | -101.5 | 0 | 0 | 112.2 | R292 L293 G294 Q298 R299 T300 | R292-E296 PolarHBondContact O-N 3.38Å; L293-E296 WeakPolarHBondContact O-CB 3.34Å; L293-E296 PolarHBondContact O-N 3.41Å; L293-E296 VanDerWaalsContact O-N 3.17Å; G294-E296 VanDerWaalsContact C-N 3.34Å; G294-E296 PolarHBondContact O-N 2.9Å; E296-Q298 VanDerWaalsContact C-N 3.32Å; E296-Q298 PolarHBondContact O-N 2.91Å; E296-R299 PolarHBondContact O-N 3.07Å; E296-R299 IonicContact OE1-CZ 3.97Å; E296-R299 IonicContact OE1-NH1 2.68Å; E296-R299 PolarHBondContact OE1-NH1 2.89Å; E296-R299 IonicContact OE2-NH1 3.42Å; E296-R299 PolarHBondContact OE2-NH1 2.99Å; E296-T300 WeakPolarHBondContact O-CB 3.48Å; E296-T300 PolarHBondContact O-N 3.11Å; E296-T300 PolarHBondContact O-OG1 2.91Å |
| 297 | V | 98.8 | Very high | 98.5 | Very high | 104 Ų | 104 | 100 Ų | 100 | 63% | 0.63 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61 | -44.8 | 174.4 | 171.1 | 0 | 0 | 0 | 0 | 110.2 | L293 G294 T300 R301 | L293-V297 WeakPolarHBondContact O-CG2 3.45Å; L293-V297 PolarHBondContact O-N 3.36Å; G294-V297 PolarHBondContact O-N 2.92Å; V297-T300 PolarHBondContact O-N 3.41Å; V297-R301 WeakPolarHBondContact O-CB 3.34Å; V297-R301 PolarHBondContact O-N 3.37Å |
| 298 | Q | 98.7 | Very high | 98.4 | Very high | 107 Ų | 107 | 98.1 Ų | 98.1 | 50% | 0.5 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.5 | -40.3 | 177.4 | -72.8 | -172.7 | 13.5 | 0 | 0 | 112.6 | G294 E295 E296 R301 R302 | G294-Q298 WeakPolarHBondContact O-CG 3.34Å; G294-Q298 PolarHBondContact O-N 3.19Å; E295-Q298 PolarHBondContact O-N 2.97Å; E296-Q298 VanDerWaalsContact C-N 3.32Å; E296-Q298 PolarHBondContact O-N 2.91Å; Q298-R301 PolarHBondContact O-N 2.88Å; Q298-R302 WeakPolarHBondContact O-CG 3.47Å; Q298-R302 PolarHBondContact O-N 3.27Å |
| 299 | R | 98.7 | Very high | 98.2 | Very high | 112 Ų | 112 | 99.2 Ų | 99.2 | 42% | 0.423 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60 | -48.2 | 175.7 | -175.3 | -176.5 | -64.3 | 102.4 | 4.2 | 110.5 | E295 E296 R302 A303 | E295-R299 WeakPolarHBondContact O-CB 3.31Å; E295-R299 PolarHBondContact O-N 3.29Å; E296-R299 PolarHBondContact O-N 3.07Å; E296-R299 IonicContact OE1-CZ 3.97Å; E296-R299 IonicContact OE1-NH1 2.68Å; E296-R299 PolarHBondContact OE1-NH1 2.89Å; E296-R299 IonicContact OE2-NH1 3.42Å; E296-R299 PolarHBondContact OE2-NH1 2.99Å; R299-R302 PolarHBondContact O-N 3.37Å; R299-A303 PolarHBondContact O-N 3.46Å |
| 300 | T | 98.6 | Very high | 97.7 | Very high | 71 Ų | 71 | 99.8 Ų | 99.8 | 44% | 0.436 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -47.9 | 177 | -57.8 | 0 | 0 | 0 | 0 | 110.9 | E296 V297 R302 A303 L304 | E296-T300 WeakPolarHBondContact O-CB 3.48Å; E296-T300 PolarHBondContact O-N 3.11Å; E296-T300 PolarHBondContact O-OG1 2.91Å; V297-T300 PolarHBondContact O-N 3.41Å; T300-R302 VanDerWaalsContact C-N 3.33Å; T300-R302 PolarHBondContact O-N 3.3Å; T300-A303 PolarHBondContact O-N 2.94Å; T300-L304 HydrophobicContact CG2-CD1 4.4Å; T300-L304 HydrophobicContact CG2-CG 4.41Å; T300-L304 WeakPolarHBondContact O-CG 3.47Å; T300-L304 PolarHBondContact O-N 2.81Å |
| 301 | R | 98.8 | Very high | 97.1 | Very high | 169 Ų | 169 | 99 Ų | 99 | 64% | 0.638 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -55.5 | -46.8 | 176.4 | -179 | -178.7 | 174.5 | -133.3 | -0.9 | 111.7 | V297 Q298 L304 I305 | V297-R301 WeakPolarHBondContact O-CB 3.34Å; V297-R301 PolarHBondContact O-N 3.37Å; Q298-R301 PolarHBondContact O-N 2.88Å; R301-L304 PolarHBondContact O-N 2.87Å; R301-I305 HydrophobicContact CG-CD1 3.99Å; R301-I305 VanDerWaalsContact O-CG1 3.31Å; R301-I305 WeakPolarHBondContact O-CG1 3.5Å; R301-I305 PolarHBondContact O-N 3.48Å |
| 302 | R | 98.5 | Very high | 95.9 | Very high | 136 Ų | 136 | 102.7 Ų | 102.7 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.3 | -46.8 | 177.2 | -74.9 | -173 | -66.7 | -97.1 | 0.8 | 111.6 | Q298 R299 T300 L304 I305 E306 | Q298-R302 WeakPolarHBondContact O-CG 3.47Å; Q298-R302 PolarHBondContact O-N 3.27Å; R299-R302 PolarHBondContact O-N 3.37Å; T300-R302 VanDerWaalsContact C-N 3.33Å; T300-R302 PolarHBondContact O-N 3.3Å; R302-L304 VanDerWaalsContact C-N 3.33Å; R302-L304 PolarHBondContact O-N 3.13Å; R302-I305 PolarHBondContact O-N 3.2Å; R302-E306 WeakPolarHBondContact O-CB 3.38Å; R302-E306 PolarHBondContact O-N 3.46Å |
| 303 | A | 98.3 | Very high | 93.8 | Very high | 43 Ų | 43 | 108.3 Ų | 108.3 | 36% | 0.355 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.8 | -37.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | R299 T300 R307 | R299-A303 PolarHBondContact O-N 3.46Å; T300-A303 PolarHBondContact O-N 2.94Å; A303-R307 WeakPolarHBondContact O-CB 3.27Å; A303-R307 PolarHBondContact O-N 3.14Å; A303-R307 VanDerWaalsContact O-N 3.11Å |
| 304 | L | 98.4 | Very high | 93.5 | Very high | 79 Ų | 79 | 109.6 Ų | 109.6 | 41% | 0.414 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.2 | -46.6 | 174 | -67.5 | -178.6 | 0 | 0 | 0 | 111.5 | T300 R301 R302 R307 L308 | T300-L304 HydrophobicContact CG2-CD1 4.4Å; T300-L304 HydrophobicContact CG2-CG 4.41Å; T300-L304 WeakPolarHBondContact O-CG 3.47Å; T300-L304 PolarHBondContact O-N 2.81Å; R301-L304 PolarHBondContact O-N 2.87Å; R302-L304 VanDerWaalsContact C-N 3.33Å; R302-L304 PolarHBondContact O-N 3.13Å; L304-R307 PolarHBondContact O-N 3.49Å; L304-L308 WeakPolarHBondContact O-CG 2.99Å; L304-L308 PolarHBondContact O-N 2.86Å |
| 305 | I | 97.9 | Very high | 93.3 | Very high | 82 Ų | 82 | 113.7 Ų | 113.7 | 42% | 0.421 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.3 | -49.5 | 178.1 | -68.7 | 166.7 | 0 | 0 | 0 | 110.3 | R301 R302 R307 L308 V309 | R301-I305 HydrophobicContact CG-CD1 3.99Å; R301-I305 VanDerWaalsContact O-CG1 3.31Å; R301-I305 WeakPolarHBondContact O-CG1 3.5Å; R301-I305 PolarHBondContact O-N 3.48Å; R302-I305 PolarHBondContact O-N 3.2Å; I305-R307 VanDerWaalsContact C-N 3.29Å; I305-R307 PolarHBondContact O-N 3.18Å; I305-L308 PolarHBondContact O-N 3.46Å; I305-L308 VanDerWaalsContact O-N 3.15Å; I305-V309 HydrophobicContact CG2-CG2 4.2Å; I305-V309 VanDerWaalsContact O-CG2 3.31Å; I305-V309 WeakPolarHBondContact O-CG2 3.32Å; I305-V309 PolarHBondContact O-N 2.86Å |
| 306 | E | 97 | Very high | 93 | Very high | 123 Ų | 123 | 114.6 Ų | 114.6 | 58% | 0.575 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -57.1 | -44.1 | 179.9 | -177.2 | 177 | -171.1 | 0 | 0 | 111.6 | R302 L308 V309 N310 | R302-E306 WeakPolarHBondContact O-CB 3.38Å; R302-E306 PolarHBondContact O-N 3.46Å; E306-L308 PolarHBondContact O-N 3.16Å; E306-V309 PolarHBondContact O-N 2.94Å; E306-N310 WeakPolarHBondContact O-CB 3.32Å; E306-N310 PolarHBondContact O-N 3.46Å |
| 307 | R | 96.8 | Very high | 92.6 | Very high | 138 Ų | 138 | 116.6 Ų | 116.6 | 52% | 0.521 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.9 | -44 | 177.1 | -161.4 | -175.5 | -43.5 | 105.8 | 7.3 | 112.3 | A303 L304 I305 V309 N310 T311 | A303-R307 WeakPolarHBondContact O-CB 3.27Å; A303-R307 PolarHBondContact O-N 3.14Å; A303-R307 VanDerWaalsContact O-N 3.11Å; L304-R307 PolarHBondContact O-N 3.49Å; I305-R307 VanDerWaalsContact C-N 3.29Å; I305-R307 PolarHBondContact O-N 3.18Å; R307-V309 VanDerWaalsContact C-N 3.3Å; R307-V309 PolarHBondContact O-N 3.49Å; R307-N310 PolarHBondContact O-N 3.42Å; R307-T311 VanDerWaalsContact O-CG2 3.32Å; R307-T311 WeakPolarHBondContact O-CG2 3.38Å; R307-T311 PolarHBondContact O-N 2.85Å; R307-T311 PolarHBondContact O-OG1 3.01Å |
| 308 | L | 96.9 | Very high | 92.3 | Very high | 106 Ų | 106 | 117.4 Ų | 117.4 | 56% | 0.555 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -69.6 | -26 | 179.1 | -73.3 | 170.7 | 0 | 0 | 0 | 113.7 | L304 I305 E306 T311 | L304-L308 WeakPolarHBondContact O-CG 2.99Å; L304-L308 PolarHBondContact O-N 2.86Å; I305-L308 PolarHBondContact O-N 3.46Å; I305-L308 VanDerWaalsContact O-N 3.15Å; E306-L308 PolarHBondContact O-N 3.16Å; L308-T311 PolarHBondContact O-OG1 3.45Å |
| 309 | V | 95.1 | Very high | 91.8 | Very high | 75 Ų | 75 | 118.1 Ų | 118.1 | 46% | 0.455 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -80.4 | -42.1 | 175.9 | 170.8 | 0 | 0 | 0 | 0 | 110.1 | I305 E306 R307 T311 R312 | I305-V309 HydrophobicContact CG2-CG2 4.2Å; I305-V309 VanDerWaalsContact O-CG2 3.31Å; I305-V309 WeakPolarHBondContact O-CG2 3.32Å; I305-V309 PolarHBondContact O-N 2.86Å; E306-V309 PolarHBondContact O-N 2.94Å; R307-V309 VanDerWaalsContact C-N 3.3Å; R307-V309 PolarHBondContact O-N 3.49Å; V309-T311 VanDerWaalsContact C-N 3.34Å; V309-T311 PolarHBondContact O-N 3.45Å; V309-R312 PolarHBondContact O-N 3.19Å |
| 310 | N | 89 | Confident | 91.3 | Very high | 91 Ų | 91 | 118.6 Ų | 118.6 | 49% | 0.487 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -69.9 | -26.9 | -178.4 | -70.8 | -10.3 | 0 | 0 | 0 | 113.4 | E306 R307 R312 | E306-N310 WeakPolarHBondContact O-CB 3.32Å; E306-N310 PolarHBondContact O-N 3.46Å; R307-N310 PolarHBondContact O-N 3.42Å; N310-R312 VanDerWaalsContact C-N 3.29Å; N310-R312 PolarHBondContact O-N 3.48Å |
| 311 | T | 84.3 | Confident | 90.8 | Very high | 104 Ų | 104 | 122.2 Ų | 122.2 | 64% | 0.638 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -7.1 | 176.3 | 54.2 | 0 | 0 | 0 | 0 | 114.4 | R307 L308 V309 | R307-T311 VanDerWaalsContact O-CG2 3.32Å; R307-T311 WeakPolarHBondContact O-CG2 3.38Å; R307-T311 PolarHBondContact O-N 2.85Å; R307-T311 PolarHBondContact O-OG1 3.01Å; L308-T311 PolarHBondContact O-OG1 3.45Å; V309-T311 VanDerWaalsContact C-N 3.34Å; V309-T311 PolarHBondContact O-N 3.45Å |
| 312 | R | 73.9 | Confident | 90.1 | Very high | 205 Ų | 205 | 118.3 Ų | 118.3 | 77% | 0.774 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.5 | 2.1 | 179 | -115.4 | -175.2 | -65.3 | -154.2 | 0.8 | 113.9 | V309 N310 | V309-R312 PolarHBondContact O-N 3.19Å; N310-R312 VanDerWaalsContact C-N 3.29Å; N310-R312 PolarHBondContact O-N 3.48Å |
| 313 | K | 55.4 | Low | 89.3 | Confident | 238 Ų | 238 | 116.7 Ų | 116.7 | 100% | 1.035 | 57% | 0.566 | S | S | * | * | trans | -102 | 0 | 172 | -81.1 | 177.6 | 164.4 | 175.7 | 0 | 109.7 |
Retrieved 313 of 313 residues in 104 ms
(Link to these results)