| 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 | 36.7 | Very low | 43.8 | Very low | 249 Ų | 249 | 149.8 Ų | 149.8 | 100% | 1.227 | 83% | 0.829 | S | S | * | * | 0 | 111.6 | 0 | -64.2 | -178.2 | -167.8 | 0 | 0 | 106.7 | |||||
| 2 | A | 37.8 | Very low | 44.6 | Very low | 105 Ų | 105 | 147.8 Ų | 147.8 | 87% | 0.868 | 81% | 0.813 | S | S | * | * | trans | -122.5 | 117.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 3 | Q | 39.3 | Very low | 45.1 | Very low | 175 Ų | 175 | 142.3 Ų | 142.3 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -76.2 | 119 | -175.6 | -175.8 | 173 | -10.7 | 0 | 0 | 108.5 | E5 | Q3-E5 PolarHBondContact O-N 3.16Š| ||
| 4 | R | 39.1 | Very low | 45.7 | Very low | 240 Ų | 240 | 141.8 Ų | 141.8 | 91% | 0.906 | 79% | 0.788 | S | S | * | * | trans | -78.6 | 105 | 171.9 | -179 | 174.9 | 177.4 | 174.7 | -1.1 | 107.5 | S6 | R4-S6 PolarHBondContact O-N 2.89Š| ||
| 5 | E | 48 | Very low | 46.3 | Very low | 147 Ų | 147 | 142.1 Ų | 142.1 | 69% | 0.687 | 78% | 0.781 | S | S | * | * | trans | -74.7 | 120.3 | 171.8 | -67.7 | -179.2 | 169.4 | 0 | 0 | 109.1 | Q3 F7 | Q3-E5 PolarHBondContact O-N 3.16Å; E5-F7 PolarHBondContact O-N 3.45Å | ||
| 6 | S | 49.8 | Very low | 46.9 | Very low | 109 Ų | 109 | 139.2 Ų | 139.2 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | trans | -85 | 104.8 | 178.1 | 173.9 | 0 | 0 | 0 | 0 | 109.1 | R4 A8 | R4-S6 PolarHBondContact O-N 2.89Å; S6-A8 PolarHBondContact O-N 3.39Å; S6-A8 VanDerWaalsContact O-N 3.13Å | ||
| 7 | F | 44 | Very low | 47.7 | Very low | 199 Ų | 199 | 137.4 Ų | 137.4 | 87% | 0.873 | 75% | 0.753 | S | S | * | * | trans | -73 | 99.5 | 165.8 | -83.5 | -88.6 | 0 | 0 | 0 | 109.4 | E5 | E5-F7 PolarHBondContact O-N 3.45Š| ||
| 8 | A | 49.6 | Very low | 48.4 | Very low | 96 Ų | 96 | 138.8 Ų | 138.8 | 79% | 0.793 | 75% | 0.747 | S | S | * | * | trans | -87.2 | 130.8 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | S6 | S6-A8 PolarHBondContact O-N 3.39Å; S6-A8 VanDerWaalsContact O-N 3.13Å | ||
| 9 | G | 44.8 | Very low | 49.4 | Very low | 75 Ų | 75 | 139.8 Ų | 139.8 | 77% | 0.773 | 74% | 0.74 | S | S | * | * | trans | 127.3 | 40.7 | 152.2 | 0 | 0 | 0 | 0 | 0 | 118.9 | G11 | G9-G11 VanDerWaalsContact C-N 3.25Å; G9-G11 PolarHBondContact O-N 3.07Å | ||
| 10 | F | 45.3 | Very low | 50.2 | Low | 202 Ų | 202 | 136.4 Ų | 136.4 | 89% | 0.886 | 73% | 0.727 | S | S | * | * | trans | -74.4 | 89.4 | 153.9 | -85.9 | -84.2 | 0 | 0 | 0 | 108.4 | I12 | F10-I12 PolarHBondContact O-N 3.47Š| ||
| 11 | G | 47.5 | Very low | 51.4 | Low | 51 Ų | 51 | 137.1 Ų | 137.1 | 53% | 0.526 | 72% | 0.721 | S | S | . | * | trans | -60.3 | 124.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | G9 A13 Q14 | G9-G11 VanDerWaalsContact C-N 3.25Å; G9-G11 PolarHBondContact O-N 3.07Å; G11-A13 PolarHBondContact O-N 3.29Å; G11-Q14 PolarHBondContact O-N 3.32Å | ||
| 12 | I | 52.9 | Low | 52.9 | Low | 125 Ų | 125 | 132.6 Ų | 132.6 | 64% | 0.641 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | -10 | 177 | -45.2 | 162.5 | 0 | 0 | 0 | 111.9 | F10 Q14 N16 | F10-I12 PolarHBondContact O-N 3.47Å; I12-Q14 VanDerWaalsContact C-N 3.34Å; I12-Q14 PolarHBondContact O-N 3.43Å; I12-N16 PolarHBondContact O-ND2 2.95Å |
| 13 | A | 51.9 | Low | 54.4 | Low | 77 Ų | 77 | 132.2 Ų | 132.2 | 64% | 0.636 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63 | -32.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114 | G11 | G11-A13 PolarHBondContact O-N 3.29Š|
| 14 | Q | 52.9 | Low | 56 | Low | 135 Ų | 135 | 128.5 Ų | 128.5 | 63% | 0.631 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -28.4 | -174.5 | -154.6 | 176.4 | 19.8 | 0 | 0 | 113.1 | G11 I12 N16 | G11-Q14 PolarHBondContact O-N 3.32Å; I12-Q14 VanDerWaalsContact C-N 3.34Å; I12-Q14 PolarHBondContact O-N 3.43Å; Q14-N16 VanDerWaalsContact C-N 3.34Å; Q14-N16 PolarHBondContact O-N 2.81Å |
| 15 | Q | 54.9 | Low | 57.9 | Low | 146 Ų | 146 | 118.5 Ų | 118.5 | 68% | 0.682 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -27.9 | -176.9 | -69.6 | 177.6 | -0.6 | 0 | 0 | 113 | N17 | Q15-N17 VanDerWaalsContact C-N 3.31Å; Q15-N17 PolarHBondContact O-N 3.3Å |
| 16 | N | 55.4 | Low | 59.3 | Low | 96 Ų | 96 | 115.3 Ų | 115.3 | 51% | 0.513 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -72.9 | -21.6 | -177.8 | -68 | -46.6 | 0 | 0 | 0 | 113.7 | I12 Q14 Y18 Y19 C20 | I12-N16 PolarHBondContact O-ND2 2.95Å; Q14-N16 VanDerWaalsContact C-N 3.34Å; Q14-N16 PolarHBondContact O-N 2.81Å; N16-Y18 VanDerWaalsContact C-N 3.34Å; N16-Y18 PolarHBondContact O-N 2.91Å; N16-Y19 PolarHBondContact O-N 3.25Å; N16-C20 PolarHBondContact O-N 3.34Å; N16-C20 PolarHBondContact O-SG 3.37Å; N16-C20 VanDerWaalsContact O-SG 3.34Å |
| 17 | N | 60.9 | Low | 59.9 | Low | 108 Ų | 108 | 113.6 Ų | 113.6 | 58% | 0.578 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.7 | -34.6 | -176.4 | -72.8 | -41.4 | 0 | 0 | 0 | 112.6 | Q15 Y21 | Q15-N17 VanDerWaalsContact C-N 3.31Å; Q15-N17 PolarHBondContact O-N 3.3Å; N17-Y21 WeakPolarHBondContact O-CB 3.4Å; N17-Y21 PolarHBondContact O-N 2.76Å |
| 18 | Y | 61 | Low | 60.7 | Low | 164 Ų | 164 | 107.5 Ų | 107.5 | 64% | 0.643 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -68.3 | -41.7 | 179.1 | -69.9 | -77.2 | 0 | 0 | 0 | 112 | N16 Y21 W22 | N16-Y18 VanDerWaalsContact C-N 3.34Å; N16-Y18 PolarHBondContact O-N 2.91Å; Y18-Y21 PolarHBondContact O-N 3.34Å; Y18-W22 PolarHBondContact O-N 2.98Å |
| 19 | Y | 67.3 | Low | 61.3 | Low | 157 Ų | 157 | 108.1 Ų | 108.1 | 62% | 0.616 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65.9 | -42.7 | 178.5 | -176.3 | -103.7 | 0 | 0 | 0 | 111.9 | N16 Y21 W22 Q23 | N16-Y19 PolarHBondContact O-N 3.25Å; Y19-Y21 VanDerWaalsContact C-N 3.32Å; Y19-Y21 PolarHBondContact O-N 2.95Å; Y19-W22 PolarHBondContact O-N 2.89Å; Y19-Q23 HydrophobicContact CD1-CG 4.39Å; Y19-Q23 HydrophobicContact CE1-CG 4.03Å; Y19-Q23 HydrophobicContact CE2-CG 4.36Å; Y19-Q23 WeakPolarHBondContact O-CG 3.39Å; Y19-Q23 PolarHBondContact O-N 3.33Å |
| 20 | C | 65.6 | Low | 62 | Low | 72 Ų | 72 | 109.5 Ų | 109.5 | 49% | 0.486 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.3 | -37.9 | 176.4 | -68.3 | 0 | 0 | 0 | 0 | 112.5 | N16 Q23 S24 | N16-C20 PolarHBondContact O-N 3.34Å; N16-C20 PolarHBondContact O-SG 3.37Å; N16-C20 VanDerWaalsContact O-SG 3.34Å; C20-Q23 PolarHBondContact O-N 3.39Å; C20-S24 PolarHBondContact O-N 3.14Å; C20-S24 VanDerWaalsContact O-N 3.12Å; C20-S24 PolarHBondContact O-OG 3.04Å |
| 21 | Y | 74.4 | Confident | 62.6 | Low | 152 Ų | 152 | 105 Ų | 105 | 60% | 0.596 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65 | -48.2 | 175.4 | 176.2 | -100.4 | 0 | 0 | 0 | 111.9 | N17 Y18 Y19 Q23 S24 L25 | N17-Y21 WeakPolarHBondContact O-CB 3.4Å; N17-Y21 PolarHBondContact O-N 2.76Å; Y18-Y21 PolarHBondContact O-N 3.34Å; Y19-Y21 VanDerWaalsContact C-N 3.32Å; Y19-Y21 PolarHBondContact O-N 2.95Å; Y21-Q23 PolarHBondContact O-N 2.8Å; Y21-S24 WeakPolarHBondContact O-CB 3.49Å; Y21-S24 PolarHBondContact O-N 3.32Å; Y21-L25 HydrophobicContact CE1-CD1 4.31Å; Y21-L25 PolarHBondContact O-N 3.39Å |
| 22 | W | 68.9 | Low | 62.8 | Low | 153 Ų | 153 | 110.2 Ų | 110.2 | 58% | 0.58 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -56.5 | -38.7 | 174.9 | -88.3 | 107.4 | 0 | 0 | 0 | 112.5 | Y18 Y19 S24 L25 R30 | Y18-W22 PolarHBondContact O-N 2.98Å; Y19-W22 PolarHBondContact O-N 2.89Å; W22-S24 VanDerWaalsContact C-N 3.28Å; W22-S24 PolarHBondContact O-N 3.1Å; W22-L25 HydrophobicContact CD2-CD1 4.43Å; W22-L25 HydrophobicContact CE3-CD1 3.83Å; W22-L25 HydrophobicContact CZ3-CD1 4.09Å; W22-L25 PolarHBondContact O-N 2.73Å; W22-R30 WeakPolarHBondContact O-CD 3.44Å |
| 23 | Q | 68.1 | Low | 62.5 | Low | 98 Ų | 98 | 112.1 Ų | 112.1 | 46% | 0.458 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -75.5 | -16.2 | 178.2 | -68.5 | -68 | 72.2 | 0 | 0 | 114.4 | Y19 C20 Y21 R30 | Y19-Q23 HydrophobicContact CD1-CG 4.39Å; Y19-Q23 HydrophobicContact CE1-CG 4.03Å; Y19-Q23 HydrophobicContact CE2-CG 4.36Å; Y19-Q23 WeakPolarHBondContact O-CG 3.39Å; Y19-Q23 PolarHBondContact O-N 3.33Å; C20-Q23 PolarHBondContact O-N 3.39Å; Y21-Q23 PolarHBondContact O-N 2.8Å; Q23-R30 VanDerWaalsContact C-NH1 3.32Å; Q23-R30 PolarHBondContact O-NH1 3.44Å |
| 24 | S | 73.2 | Confident | 62 | Low | 97 Ų | 97 | 115.1 Ų | 115.1 | 68% | 0.678 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -88.4 | -12.3 | 177 | -57.9 | 0 | 0 | 0 | 0 | 112.8 | C20 Y21 W22 | C20-S24 PolarHBondContact O-N 3.14Å; C20-S24 VanDerWaalsContact O-N 3.12Å; C20-S24 PolarHBondContact O-OG 3.04Å; Y21-S24 WeakPolarHBondContact O-CB 3.49Å; Y21-S24 PolarHBondContact O-N 3.32Å; W22-S24 VanDerWaalsContact C-N 3.28Å; W22-S24 PolarHBondContact O-N 3.1Å |
| 25 | L | 80.3 | Confident | 61.6 | Low | 29 Ų | 29 | 117.2 Ų | 117.2 | 15% | 0.152 | 58% | 0.577 | C | S | . | * | S | Bend | trans | -68.7 | 141.1 | 177.9 | -70.6 | 172.1 | 0 | 0 | 0 | 111.6 | Y21 W22 I29 R30 | Y21-L25 HydrophobicContact CE1-CD1 4.31Å; Y21-L25 PolarHBondContact O-N 3.39Å; W22-L25 HydrophobicContact CD2-CD1 4.43Å; W22-L25 HydrophobicContact CE3-CD1 3.83Å; W22-L25 HydrophobicContact CZ3-CD1 4.09Å; W22-L25 PolarHBondContact O-N 2.73Å; L25-I29 HydrophobicContact CD1-CG2 4.41Å; L25-I29 HydrophobicContact CD2-CD1 4.43Å; L25-R30 HydrophobicContact CB-CG 4.35Å; L25-R30 PolarHBondContact O-NE 3.34Å; L25-R30 PolarHBondContact O-NH2 3.39Å; L25-R30 VanDerWaalsContact O-NH2 3.08Å |
| 26 | P | 77.2 | Confident | 60.7 | Low | 80 Ų | 80 | 117.7 Ų | 117.7 | 52% | 0.519 | 58% | 0.579 | S | S | . | * | trans | -52.5 | 141.2 | 175.5 | -26.8 | 33.2 | 0 | 0 | 0 | 112.4 | A28 I29 R30 | P26-A28 PolarHBondContact O-N 3.33Å; P26-I29 HydrophobicContact CG-CD1 4.42Å; P26-I29 WeakPolarHBondContact O-CB 3.49Å; P26-I29 PolarHBondContact O-N 3.43Å; P26-R30 PolarHBondContact O-N 3.15Å | ||
| 27 | S | 62.1 | Low | 59.8 | Low | 73 Ų | 73 | 118.3 Ų | 118.3 | 51% | 0.51 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -58.1 | -24.1 | -178.3 | -51.1 | 0 | 0 | 0 | 0 | 113.4 | I29 R30 V31 | S27-I29 VanDerWaalsContact C-N 3.3Å; S27-I29 PolarHBondContact O-N 2.99Å; S27-R30 PolarHBondContact O-N 3.42Å; S27-V31 VanDerWaalsContact O-CB 3.22Å; S27-V31 WeakPolarHBondContact O-CB 3.5Å; S27-V31 WeakPolarHBondContact O-CG2 3.22Å; S27-V31 PolarHBondContact O-N 3.25Å |
| 28 | A | 60.1 | Low | 58.6 | Low | 72 Ų | 72 | 120.8 Ų | 120.8 | 60% | 0.595 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.3 | -33.4 | 172 | 0 | 0 | 0 | 0 | 0 | 113.1 | P26 K32 | P26-A28 PolarHBondContact O-N 3.33Å; A28-K32 WeakPolarHBondContact O-CB 3.41Å; A28-K32 PolarHBondContact O-N 2.79Å |
| 29 | I | 61.8 | Low | 57.5 | Low | 109 Ų | 109 | 121.9 Ų | 121.9 | 56% | 0.559 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -79.5 | -35.2 | 175.6 | -56.6 | -177.8 | 0 | 0 | 0 | 110.2 | L25 P26 S27 | L25-I29 HydrophobicContact CD1-CG2 4.41Å; L25-I29 HydrophobicContact CD2-CD1 4.43Å; P26-I29 HydrophobicContact CG-CD1 4.42Å; P26-I29 WeakPolarHBondContact O-CB 3.49Å; P26-I29 PolarHBondContact O-N 3.43Å; S27-I29 VanDerWaalsContact C-N 3.3Å; S27-I29 PolarHBondContact O-N 2.99Å |
| 30 | R | 60.3 | Low | 55.9 | Low | 103 Ų | 103 | 117.5 Ų | 117.5 | 39% | 0.389 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -76 | -29.9 | 179.2 | -67.4 | -172.5 | -73.7 | -157.1 | -12.4 | 114.6 | W22 Q23 L25 P26 S27 | W22-R30 WeakPolarHBondContact O-CD 3.44Å; Q23-R30 VanDerWaalsContact C-NH1 3.32Å; Q23-R30 PolarHBondContact O-NH1 3.44Å; L25-R30 HydrophobicContact CB-CG 4.35Å; L25-R30 PolarHBondContact O-NE 3.34Å; L25-R30 PolarHBondContact O-NH2 3.39Å; L25-R30 VanDerWaalsContact O-NH2 3.08Å; P26-R30 PolarHBondContact O-N 3.15Å; S27-R30 PolarHBondContact O-N 3.42Å |
| 31 | V | 57.2 | Low | 54.9 | Low | 109 Ų | 109 | 124.9 Ų | 124.9 | 66% | 0.661 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -108.8 | -22.3 | -171.4 | 179.4 | 0 | 0 | 0 | 0 | 112.4 | S27 Q33 | S27-V31 VanDerWaalsContact O-CB 3.22Å; S27-V31 WeakPolarHBondContact O-CB 3.5Å; S27-V31 WeakPolarHBondContact O-CG2 3.22Å; S27-V31 PolarHBondContact O-N 3.25Å; V31-Q33 PolarHBondContact O-N 3.02Å |
| 32 | K | 52.7 | Low | 53.5 | Low | 159 Ų | 159 | 125.6 Ų | 125.6 | 69% | 0.691 | 65% | 0.648 | S | S | * | * | trans | -98.1 | 59.2 | -173.7 | -139.4 | -174.8 | -177.1 | -159.5 | 0 | 112.9 | A28 | A28-K32 WeakPolarHBondContact O-CB 3.41Å; A28-K32 PolarHBondContact O-N 2.79Å | ||
| 33 | Q | 46.8 | Very low | 51.8 | Low | 166 Ų | 166 | 128.7 Ų | 128.7 | 78% | 0.776 | 66% | 0.661 | S | S | * | * | trans | -104.5 | 58.9 | 153.4 | -167.4 | 137.9 | 17.8 | 0 | 0 | 108.7 | V31 F35 | V31-Q33 PolarHBondContact O-N 3.02Å; Q33-F35 VanDerWaalsContact C-N 3.32Å; Q33-F35 PolarHBondContact O-N 3.26Å; Q33-F35 VanDerWaalsContact O-N 3.07Å | ||
| 34 | E | 42.1 | Very low | 50.4 | Low | 139 Ų | 139 | 126.6 Ų | 126.6 | 65% | 0.65 | 67% | 0.665 | S | S | * | * | trans | -78.5 | 88 | 169.9 | -72.3 | 179.4 | -179.5 | 0 | 0 | 108.1 | Q36 | E34-Q36 PolarHBondContact O-N 2.92Å; E34-Q36 VanDerWaalsContact O-N 3.08Å | ||
| 35 | F | 43.7 | Very low | 48.7 | Very low | 180 Ų | 180 | 127.7 Ų | 127.7 | 79% | 0.789 | 66% | 0.664 | S | S | * | * | trans | -65.5 | 101.4 | 166.1 | -126 | -93.3 | 0 | 0 | 0 | 108 | Q33 | Q33-F35 VanDerWaalsContact C-N 3.32Å; Q33-F35 PolarHBondContact O-N 3.26Å; Q33-F35 VanDerWaalsContact O-N 3.07Å | ||
| 36 | Q | 36.3 | Very low | 46.4 | Very low | 155 Ų | 155 | 137.8 Ų | 137.8 | 72% | 0.724 | 70% | 0.7 | S | S | * | * | trans | -81.2 | 121.5 | 168.3 | -72.9 | -87 | -23.3 | 0 | 0 | 107.8 | E34 N38 | E34-Q36 PolarHBondContact O-N 2.92Å; E34-Q36 VanDerWaalsContact O-N 3.08Å; Q36-N38 PolarHBondContact O-N 3.4Å | ||
| 37 | P | 36.6 | Very low | 44.7 | Very low | 109 Ų | 109 | 145 Ų | 145 | 71% | 0.708 | 72% | 0.718 | S | S | * | * | trans | -70.9 | 123.1 | 177.1 | 28.6 | -30.6 | 0 | 0 | 0 | 109.2 | Q39 | P37-Q39 PolarHBondContact O-N 2.84Å; P37-Q39 VanDerWaalsContact O-N 3.16Å | ||
| 38 | N | 34.7 | Very low | 43.8 | Very low | 160 Ų | 160 | 144.6 Ų | 144.6 | 86% | 0.856 | 72% | 0.72 | S | S | * | * | trans | -44.9 | 116.1 | 175.5 | -89.2 | -68.7 | 0 | 0 | 0 | 112.2 | Q36 | Q36-N38 PolarHBondContact O-N 3.4Š| ||
| 39 | Q | 39.2 | Very low | 42.8 | Very low | 187 Ų | 187 | 152.5 Ų | 152.5 | 87% | 0.874 | 73% | 0.734 | S | S | * | * | trans | -114.6 | 119.5 | 155.7 | -78.6 | -72.1 | -24 | 0 | 0 | 107.6 | P37 | P37-Q39 PolarHBondContact O-N 2.84Å; P37-Q39 VanDerWaalsContact O-N 3.16Å | ||
| 40 | G | 32.6 | Very low | 41.6 | Very low | 65 Ų | 65 | 155.2 Ų | 155.2 | 67% | 0.67 | 74% | 0.744 | S | S | * | * | trans | 92 | 104.9 | 162 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 41 | Y | 44.8 | Very low | 40.5 | Very low | 228 Ų | 228 | 159.2 Ų | 159.2 | 89% | 0.894 | 77% | 0.767 | S | S | * | * | trans | -42.5 | 153.1 | 154.2 | -91.5 | -107.4 | 0 | 0 | 0 | 112.2 | ||||
| 42 | L | 45.7 | Very low | 39.3 | Very low | 167 Ų | 167 | 159.6 Ų | 159.6 | 87% | 0.874 | 77% | 0.774 | S | S | * | * | trans | 87.2 | 103.1 | 179.1 | -64.8 | 116.8 | 0 | 0 | 0 | 115.5 | ||||
| 43 | Y | 31.9 | Very low | 38.6 | Very low | 218 Ų | 218 | 156.4 Ų | 156.4 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | -168.7 | 129.7 | 116.2 | -149.4 | -114.1 | 0 | 0 | 0 | 111.3 | |||||
| 44 | G | 38.3 | Very low | 38.3 | Very low | 53 Ų | 53 | 159.1 Ų | 159.1 | 55% | 0.546 | 78% | 0.777 | S | S | . | * | trans | -76 | 174.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 45 | N | 38.2 | Very low | 38 | Very low | 120 Ų | 120 | 160.6 Ų | 160.6 | 64% | 0.642 | 79% | 0.789 | S | S | * | * | trans | 81 | 75.8 | 166 | -160.3 | 8 | 0 | 0 | 0 | 117.2 | Y47 A48 | N45-Y47 PolarHBondContact OD1-N 2.93Å; N45-A48 PolarHBondContact OD1-N 2.88Å | ||
| 46 | W | 33.3 | Very low | 38.1 | Very low | 241 Ų | 241 | 159.9 Ų | 159.9 | 91% | 0.913 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -92.5 | 1.2 | 162.3 | -66.4 | 94.7 | 0 | 0 | 0 | 113.6 | ||
| 47 | Y | 41 | Very low | 38.1 | Very low | 232 Ų | 232 | 158.2 Ų | 158.2 | 91% | 0.91 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -96 | 6.3 | -174.5 | -77 | -75.1 | 0 | 0 | 0 | 115.1 | N45 | N45-Y47 PolarHBondContact OD1-N 2.93Š|
| 48 | A | 43.4 | Very low | 38.5 | Very low | 65 Ų | 65 | 156.3 Ų | 156.3 | 54% | 0.537 | 80% | 0.797 | S | S | . | * | trans | -123.5 | 68.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | N45 | N45-A48 PolarHBondContact OD1-N 2.88Š| ||
| 49 | R | 37.6 | Very low | 38.4 | Very low | 237 Ų | 237 | 159 Ų | 159 | 89% | 0.894 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -142.6 | 75.8 | 158.5 | -164.8 | 162 | -78.8 | -134.3 | 0.2 | 112.8 | ||
| 50 | Q | 36.7 | Very low | 38.5 | Very low | 166 Ų | 166 | 155.2 Ų | 155.2 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | trans | 49 | 102.2 | 138.9 | -58.8 | -64.7 | -42.5 | 0 | 0 | 118 | S52 | Q50-S52 PolarHBondContact O-N 2.94Š| ||
| 51 | H | 38.7 | Very low | 38.6 | Very low | 188 Ų | 188 | 161.5 Ų | 161.5 | 87% | 0.87 | 80% | 0.797 | S | S | * | * | trans | -50.1 | 119.1 | 143.2 | -68.4 | -92.4 | 0 | 0 | 0 | 109.8 | ||||
| 52 | S | 31.4 | Very low | 38.1 | Very low | 116 Ų | 116 | 154 Ų | 154 | 81% | 0.811 | 79% | 0.788 | S | S | * | * | trans | -141.9 | 104.7 | 159.9 | -174.1 | 0 | 0 | 0 | 0 | 108.8 | Q50 | Q50-S52 PolarHBondContact O-N 2.94Š| ||
| 53 | S | 37.9 | Very low | 38 | Very low | 93 Ų | 93 | 151 Ų | 151 | 65% | 0.65 | 78% | 0.78 | S | S | * | * | trans | -65.4 | 140.2 | 178.3 | -29.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 54 | Y | 39.8 | Very low | 38.4 | Very low | 222 Ų | 222 | 145.8 Ų | 145.8 | 87% | 0.871 | 78% | 0.782 | S | S | * | * | trans | 49.8 | 120.3 | 157.8 | -60.1 | -81.1 | 0 | 0 | 0 | 120.1 | ||||
| 55 | L | 37.1 | Very low | 38.5 | Very low | 171 Ų | 171 | 149.9 Ų | 149.9 | 90% | 0.895 | 80% | 0.796 | S | S | * | * | -166.1 | 109.9 | 127.4 | -102.1 | 163.1 | 0 | 0 | 0 | 111.9 | |||||
| 56 | L | 44.4 | Very low | 38.6 | Very low | 164 Ų | 164 | 152.1 Ų | 152.1 | 86% | 0.859 | 81% | 0.808 | S | S | * | * | trans | 2.6 | 120.1 | 142.7 | -167.5 | 71.5 | 0 | 0 | 0 | 117.5 | ||||
| 57 | S | 37.3 | Very low | 38.6 | Very low | 121 Ų | 121 | 143.8 Ų | 143.8 | 85% | 0.846 | 80% | 0.797 | S | S | * | * | trans | -151.1 | 110.9 | 145.4 | -169.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 58 | G | 44.3 | Very low | 38.4 | Very low | 68 Ų | 68 | 140.7 Ų | 140.7 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | trans | -70.8 | 134.7 | -175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 59 | Y | 33.2 | Very low | 37.9 | Very low | 216 Ų | 216 | 140.6 Ų | 140.6 | 85% | 0.847 | 80% | 0.802 | S | S | * | * | trans | -115.7 | 99.3 | 161.6 | -154.3 | -100.9 | 0 | 0 | 0 | 108.5 | ||||
| 60 | S | 41.4 | Very low | 38 | Very low | 109 Ų | 109 | 141.1 Ų | 141.1 | 76% | 0.762 | 80% | 0.804 | S | S | * | * | trans | -69.9 | 119.7 | 171.3 | 174.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 61 | Y | 34.6 | Very low | 38.2 | Very low | 197 Ų | 197 | 139.9 Ų | 139.9 | 77% | 0.773 | 80% | 0.803 | S | S | * | * | trans | -113.1 | 96.8 | 162.1 | -159.5 | -99.2 | 0 | 0 | 0 | 108.1 | C63 | Y61-C63 PolarHBondContact O-N 2.89Š| ||
| 62 | G | 34.6 | Very low | 38 | Very low | 70 Ų | 70 | 137.1 Ų | 137.1 | 72% | 0.722 | 80% | 0.803 | S | S | * | * | trans | -80.3 | 109.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 63 | C | 43.1 | Very low | 38.2 | Very low | 104 Ų | 104 | 140.5 Ų | 140.5 | 70% | 0.703 | 80% | 0.803 | S | S | * | * | trans | -100.2 | 102.1 | 155.4 | -77.5 | 0 | 0 | 0 | 0 | 107.2 | Y61 V65 | Y61-C63 PolarHBondContact O-N 2.89Å; C63-V65 PolarHBondContact O-N 3.01Å | ||
| 64 | A | 39.5 | Very low | 37.8 | Very low | 109 Ų | 109 | 141.7 Ų | 141.7 | 90% | 0.901 | 81% | 0.812 | S | S | * | * | trans | -68.4 | 110 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 65 | V | 41.9 | Very low | 37.4 | Very low | 139 Ų | 139 | 135.5 Ų | 135.5 | 84% | 0.842 | 81% | 0.807 | S | S | * | * | trans | -117.2 | 117 | 152.9 | 102.4 | 0 | 0 | 0 | 0 | 106.3 | C63 | C63-V65 PolarHBondContact O-N 3.01Š| ||
| 66 | D | 38.9 | Very low | 37.5 | Very low | 166 Ų | 166 | 135.6 Ų | 135.6 | 89% | 0.888 | 80% | 0.802 | S | S | * | * | trans | -55.9 | 139.4 | 172.4 | -177.7 | 24.2 | 0 | 0 | 0 | 110.3 | ||||
| 67 | G | 33.9 | Very low | 36.8 | Very low | 66 Ų | 66 | 136.7 Ų | 136.7 | 68% | 0.68 | 80% | 0.803 | S | S | * | * | trans | 144.1 | 69 | 169.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 68 | N | 35.8 | Very low | 36.8 | Very low | 167 Ų | 167 | 136.7 Ų | 136.7 | 89% | 0.893 | 80% | 0.798 | S | S | * | * | trans | 66.1 | 95.4 | 133.8 | -140 | 11.6 | 0 | 0 | 0 | 120.8 | ||||
| 69 | G | 34.4 | Very low | 36.9 | Very low | 64 Ų | 64 | 138.6 Ų | 138.6 | 66% | 0.66 | 80% | 0.798 | S | S | * | * | 43.3 | 117.3 | 129.9 | 0 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 70 | R | 38.9 | Very low | 36.7 | Very low | 247 Ų | 247 | 137 Ų | 137 | 93% | 0.932 | 80% | 0.798 | S | S | * | * | 171.9 | 135.2 | 87.4 | -92.1 | -179.5 | -174.3 | -120.8 | 0.3 | 110.4 | |||||
| 71 | D | 40.5 | Very low | 36.5 | Very low | 140 Ų | 140 | 140.8 Ų | 140.8 | 75% | 0.749 | 80% | 0.804 | S | S | * | * | trans | -51.8 | 140.4 | 165.9 | -60.6 | -64.1 | 0 | 0 | 0 | 112.1 | ||||
| 72 | C | 35.8 | Very low | 36.4 | Very low | 130 Ų | 130 | 138.1 Ų | 138.1 | 88% | 0.878 | 81% | 0.808 | S | S | * | * | trans | -145.7 | 87.9 | 149 | -80 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 73 | F | 34.5 | Very low | 36.4 | Very low | 187 Ų | 187 | 139.6 Ų | 139.6 | 82% | 0.82 | 81% | 0.813 | S | S | * | * | trans | -68.3 | 158.4 | 149.9 | -79.3 | -85.7 | 0 | 0 | 0 | 109.4 | ||||
| 74 | S | 30.7 | Very low | 36 | Very low | 118 Ų | 118 | 138.2 Ų | 138.2 | 83% | 0.825 | 82% | 0.816 | S | S | * | * | trans | 87.6 | 143.9 | 169.2 | 97.9 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 75 | A | 31.3 | Very low | 36.2 | Very low | 93 Ų | 93 | 139 Ų | 139 | 77% | 0.769 | 81% | 0.81 | S | S | * | * | cis | -154.5 | 156.7 | 7 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 76 | H | 37.7 | Very low | 35.9 | Very low | 172 Ų | 172 | 141 Ų | 141 | 80% | 0.796 | 82% | 0.815 | S | S | * | * | trans | -57.4 | 125.5 | 167.1 | 176 | -74.9 | 0 | 0 | 0 | 112 | ||||
| 77 | E | 30.8 | Very low | 36 | Very low | 188 Ų | 188 | 137.9 Ų | 137.9 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | trans | -165.7 | 105.8 | 155.5 | -121.3 | 168.9 | 179.7 | 0 | 0 | 113.3 | ||||
| 78 | T | 36.5 | Very low | 36 | Very low | 120 Ų | 120 | 142.4 Ų | 142.4 | 74% | 0.736 | 81% | 0.807 | S | S | * | * | trans | -109.5 | 154.3 | 140.9 | 21.6 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 79 | P | 45.8 | Very low | 36.3 | Very low | 108 Ų | 108 | 139.5 Ų | 139.5 | 70% | 0.701 | 80% | 0.798 | S | S | * | * | cis | -133.5 | 179.1 | 27 | 28.2 | -2.5 | 0 | 0 | 0 | 111.5 | ||||
| 80 | E | 30.4 | Very low | 36.7 | Very low | 183 Ų | 183 | 145.9 Ų | 145.9 | 86% | 0.855 | 81% | 0.807 | S | S | * | * | 179.2 | 139 | 95.3 | -89.9 | 179.8 | 174 | 0 | 0 | 111.4 | |||||
| 81 | H | 37.3 | Very low | 36.6 | Very low | 189 Ų | 189 | 143.1 Ų | 143.1 | 88% | 0.875 | 81% | 0.805 | S | S | * | * | trans | -55.5 | 134.8 | 168.3 | -129.6 | -102.5 | 0 | 0 | 0 | 111.5 | ||||
| 82 | T | 32.1 | Very low | 37 | Very low | 141 Ų | 141 | 142.3 Ų | 142.3 | 87% | 0.865 | 81% | 0.805 | S | S | * | * | trans | -178.8 | 114.9 | 142.2 | -73.8 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 83 | A | 34.5 | Very low | 37.1 | Very low | 100 Ų | 100 | 142.6 Ų | 142.6 | 83% | 0.826 | 80% | 0.803 | S | S | * | * | trans | -177.2 | 118.8 | 142.7 | 0 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 84 | G | 35 | Very low | 37.5 | Very low | 75 Ų | 75 | 139.2 Ų | 139.2 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | cis | 116.2 | 88.3 | 49.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 85 | T | 43.1 | Very low | 38.2 | Very low | 126 Ų | 126 | 141.9 Ų | 141.9 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -21.4 | 126.8 | 171.8 | -56.9 | 0 | 0 | 0 | 0 | 117 | V87 | T85-V87 HydrophobicContact CG2-CG2 3.71Š| ||
| 86 | L | 36.8 | Very low | 38.6 | Very low | 180 Ų | 180 | 141.1 Ų | 141.1 | 94% | 0.942 | 80% | 0.797 | S | S | * | * | trans | -135.9 | 131.5 | 150.9 | -103.6 | 163.4 | 0 | 0 | 0 | 109.3 | ||||
| 87 | V | 39.7 | Very low | 39 | Very low | 102 Ų | 102 | 140.7 Ų | 140.7 | 62% | 0.618 | 80% | 0.796 | S | S | * | * | trans | -105.4 | 144.7 | -164.8 | 175 | 0 | 0 | 0 | 0 | 110.7 | T85 | T85-V87 HydrophobicContact CG2-CG2 3.71Š| ||
| 88 | M | 34.2 | Very low | 39.9 | Very low | 160 Ų | 160 | 139 Ų | 139 | 79% | 0.788 | 79% | 0.793 | S | S | * | * | trans | 127 | 156.8 | 147.4 | -69.5 | -77.1 | 58.9 | 0 | 0 | 114.6 | ||||
| 89 | P | 42.7 | Very low | 40.6 | Very low | 106 Ų | 106 | 138.5 Ų | 138.5 | 69% | 0.688 | 78% | 0.782 | S | S | * | * | cis | -123.9 | 175.4 | -40.9 | 35.7 | -19.3 | 0 | 0 | 0 | 111.8 | ||||
| 90 | K | 41.8 | Very low | 41 | Very low | 199 Ų | 199 | 141.5 Ų | 141.5 | 87% | 0.865 | 79% | 0.792 | S | S | * | * | trans | -80.3 | 113.7 | -172.9 | -161.4 | 170.9 | -173.7 | 167.9 | 0 | 110.5 | ||||
| 91 | E | 38.3 | Very low | 42.1 | Very low | 188 Ų | 188 | 138.3 Ų | 138.3 | 88% | 0.879 | 78% | 0.778 | S | S | * | * | trans | -118.1 | 122.3 | 159.2 | -71.8 | -165.5 | 167 | 0 | 0 | 109.7 | ||||
| 92 | T | 48.1 | Very low | 43.4 | Very low | 124 Ų | 124 | 135.9 Ų | 135.9 | 76% | 0.761 | 77% | 0.771 | S | S | * | * | trans | -75.3 | 121.5 | -176.5 | 34.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 93 | T | 37 | Very low | 44.8 | Very low | 135 Ų | 135 | 134.2 Ų | 134.2 | 83% | 0.828 | 76% | 0.763 | S | S | * | * | trans | -152.7 | 123.5 | 146.2 | -36.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 94 | P | 43.8 | Very low | 46.3 | Very low | 116 Ų | 116 | 136.5 Ų | 136.5 | 75% | 0.753 | 76% | 0.76 | S | S | * | * | trans | -87.1 | 146.1 | 173.8 | 34.1 | -28.7 | 0 | 0 | 0 | 110.3 | ||||
| 95 | L | 44.3 | Very low | 47.7 | Very low | 175 Ų | 175 | 141.7 Ų | 141.7 | 92% | 0.916 | 76% | 0.764 | S | S | * | * | trans | 76.5 | 93.6 | 150.1 | -160.9 | 74.7 | 0 | 0 | 0 | 117.4 | ||||
| 96 | A | 41.4 | Very low | 48.9 | Very low | 76 Ų | 76 | 140.5 Ų | 140.5 | 63% | 0.628 | 75% | 0.753 | S | S | * | * | 175.8 | 90.8 | 111.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | N98 | A96-N98 VanDerWaalsContact C-N 3.28Å; A96-N98 PolarHBondContact O-N 2.9Å | |||
| 97 | E | 44.9 | Very low | 50.3 | Low | 164 Ų | 164 | 137.5 Ų | 137.5 | 77% | 0.766 | 74% | 0.744 | S | S | * | * | trans | -61.9 | 95.6 | 157.1 | -74.8 | 176.1 | 121.5 | 0 | 0 | 107.4 | Q99 | E97-Q99 HydrophobicContact CB-CG 3.84Å; E97-Q99 HydrophobicContact CG-CG 4.44Å; E97-Q99 PolarHBondContact O-N 3.17Å; E97-Q99 PolarHBondContact OE1-NE2 3.01Å | ||
| 98 | N | 49.6 | Very low | 51.5 | Low | 151 Ų | 151 | 140.3 Ų | 140.3 | 81% | 0.807 | 75% | 0.75 | S | S | * | * | trans | -85.6 | 82.4 | 149.4 | -69.5 | -74 | 0 | 0 | 0 | 104.4 | A96 D100 | A96-N98 VanDerWaalsContact C-N 3.28Å; A96-N98 PolarHBondContact O-N 2.9Å; N98-D100 PolarHBondContact O-N 3.31Å | ||
| 99 | Q | 51.2 | Low | 53.2 | Low | 111 Ų | 111 | 138.5 Ų | 138.5 | 52% | 0.519 | 74% | 0.743 | S | S | . | * | trans | -60.3 | 109.5 | 165 | -51.8 | -162.5 | -22.8 | 0 | 0 | 105.8 | E97 E101 | E97-Q99 HydrophobicContact CB-CG 3.84Å; E97-Q99 HydrophobicContact CG-CG 4.44Å; E97-Q99 PolarHBondContact O-N 3.17Å; E97-Q99 PolarHBondContact OE1-NE2 3.01Å; Q99-E101 HydrophobicContact CB-CG 3.62Å; Q99-E101 PolarHBondContact O-N 2.97Å; Q99-E101 PolarHBondContact OE1-OE1 3.08Å; Q99-E101 VanDerWaalsContact OE1-OE1 3.13Å | ||
| 100 | D | 55.1 | Low | 54.6 | Low | 170 Ų | 170 | 141.7 Ų | 141.7 | 91% | 0.909 | 75% | 0.749 | S | S | * | * | trans | -73.3 | 63.6 | 164 | -146.9 | 2.7 | 0 | 0 | 0 | 105.6 | N98 D102 | N98-D100 PolarHBondContact O-N 3.31Å; D100-D102 PolarHBondContact O-N 3.07Å | ||
| 101 | E | 52.3 | Low | 56.2 | Low | 117 Ų | 117 | 137.4 Ų | 137.4 | 55% | 0.547 | 74% | 0.735 | S | S | . | * | trans | -72.8 | 105.3 | 170.2 | -64.9 | -64.9 | 140.8 | 0 | 0 | 104.7 | Q99 P103 | Q99-E101 HydrophobicContact CB-CG 3.62Å; Q99-E101 PolarHBondContact O-N 2.97Å; Q99-E101 PolarHBondContact OE1-OE1 3.08Å; Q99-E101 VanDerWaalsContact OE1-OE1 3.13Å; E101-P103 VanDerWaalsContact O-CD 3.27Å; E101-P103 WeakPolarHBondContact O-CD 3.39Å | ||
| 102 | D | 64.6 | Low | 58.4 | Low | 138 Ų | 138 | 131.9 Ų | 131.9 | 74% | 0.738 | 71% | 0.711 | S | S | * | * | trans | -40.8 | 109.2 | 153.7 | -171.8 | 14.3 | 0 | 0 | 0 | 106.2 | D100 L104 | D100-D102 PolarHBondContact O-N 3.07Å; D102-L104 VanDerWaalsContact C-N 3.33Å; D102-L104 PolarHBondContact O-N 3.33Å | ||
| 103 | P | 63 | Low | 60.3 | Low | 106 Ų | 106 | 131.5 Ų | 131.5 | 69% | 0.688 | 70% | 0.703 | S | S | * | * | trans | -63.7 | 104.4 | -169.4 | 23.1 | -31 | 0 | 0 | 0 | 106.3 | E101 E105 | E101-P103 VanDerWaalsContact O-CD 3.27Å; E101-P103 WeakPolarHBondContact O-CD 3.39Å; P103-E105 PolarHBondContact O-N 3.23Å | ||
| 104 | L | 65.4 | Low | 62.8 | Low | 147 Ų | 147 | 132 Ų | 132 | 77% | 0.77 | 70% | 0.696 | S | S | * | * | trans | -36.3 | 111.6 | 178.5 | -113.7 | 91.3 | 0 | 0 | 0 | 108.3 | D102 D106 | D102-L104 VanDerWaalsContact C-N 3.33Å; D102-L104 PolarHBondContact O-N 3.33Å; L104-D106 PolarHBondContact O-N 3.02Å | ||
| 105 | E | 64.7 | Low | 64.9 | Low | 184 Ų | 184 | 131.1 Ų | 131.1 | 86% | 0.86 | 68% | 0.682 | S | S | * | * | trans | -57.1 | 118 | 176.9 | -87.4 | 169.8 | 140.8 | 0 | 0 | 107.8 | P103 P107 | P103-E105 PolarHBondContact O-N 3.23Å; E105-P107 VanDerWaalsContact O-CD 3.28Å; E105-P107 WeakPolarHBondContact O-CD 3.27Å; E105-P107 VanDerWaalsContact O-N 3.12Å | ||
| 106 | D | 67.4 | Low | 67 | Low | 102 Ų | 102 | 125.5 Ų | 125.5 | 55% | 0.545 | 66% | 0.657 | S | S | . | * | trans | -57.8 | 118.7 | -170.9 | -168.2 | -15 | 0 | 0 | 0 | 108.8 | L104 H108 L109 | L104-D106 PolarHBondContact O-N 3.02Å; D106-H108 PolarHBondContact O-N 2.93Å; D106-H108 PolarHBondContact OD1-N 3.4Å; D106-H108 VanDerWaalsContact OD1-N 3.17Å; D106-L109 PolarHBondContact O-N 3.38Å | ||
| 107 | P | 66.6 | Low | 69.3 | Low | 116 Ų | 116 | 126.1 Ų | 126.1 | 75% | 0.753 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | -15 | 178.4 | -24.1 | 33.3 | 0 | 0 | 0 | 113.4 | E105 | E105-P107 VanDerWaalsContact O-CD 3.28Å; E105-P107 WeakPolarHBondContact O-CD 3.27Å; E105-P107 VanDerWaalsContact O-N 3.12Å |
| 108 | H | 65.1 | Low | 71.4 | Confident | 161 Ų | 161 | 124.8 Ų | 124.8 | 75% | 0.745 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | 24.2 | 179.6 | -65.4 | -64.4 | 0 | 0 | 0 | 114.2 | D106 H110 | D106-H108 PolarHBondContact O-N 2.93Å; D106-H108 PolarHBondContact OD1-N 3.4Å; D106-H108 VanDerWaalsContact OD1-N 3.17Å; H108-H110 VanDerWaalsContact C-N 3.34Å; H108-H110 PolarHBondContact O-N 2.9Å |
| 109 | L | 69.4 | Low | 73.4 | Confident | 122 Ų | 122 | 121.7 Ų | 121.7 | 64% | 0.639 | 62% | 0.624 | S | S | * | * | trans | -62.3 | 95.7 | 170.6 | -170.8 | 68.7 | 0 | 0 | 0 | 110.2 | D106 L111 | D106-L109 PolarHBondContact O-N 3.38Å; L109-L111 VanDerWaalsContact C-N 3.26Å; L109-L111 HydrophobicContact CD2-CD1 4.41Å; L109-L111 HydrophobicContact CD2-CD2 3.73Å; L109-L111 HydrophobicContact CD2-CG 4.03Å; L109-L111 HydrophobicContact CG-CD2 3.9Å; L109-L111 HydrophobicContact CG-CG 4.07Å; L109-L111 PolarHBondContact O-N 3.47Å | ||
| 110 | H | 72 | Confident | 75.3 | Confident | 174 Ų | 174 | 123.2 Ų | 123.2 | 81% | 0.806 | 63% | 0.629 | S | S | * | * | trans | -76.9 | 80.9 | 178.2 | -173.2 | -83.3 | 0 | 0 | 0 | 109.3 | H108 N112 | H108-H110 VanDerWaalsContact C-N 3.34Å; H108-H110 PolarHBondContact O-N 2.9Å; H110-N112 PolarHBondContact O-N 3.18Å | ||
| 111 | L | 76.7 | Confident | 77.1 | Confident | 109 Ų | 109 | 121.2 Ų | 121.2 | 57% | 0.571 | 62% | 0.616 | S | S | * | * | trans | -65.9 | 124.1 | 171.5 | -65.1 | 177.3 | 0 | 0 | 0 | 108.8 | L109 I113 | L109-L111 VanDerWaalsContact C-N 3.26Å; L109-L111 HydrophobicContact CD2-CD1 4.41Å; L109-L111 HydrophobicContact CD2-CD2 3.73Å; L109-L111 HydrophobicContact CD2-CG 4.03Å; L109-L111 HydrophobicContact CG-CD2 3.9Å; L109-L111 HydrophobicContact CG-CG 4.07Å; L109-L111 PolarHBondContact O-N 3.47Å; L111-I113 VanDerWaalsContact C-N 3.29Å; L111-I113 PolarHBondContact O-N 3.31Å | ||
| 112 | N | 83.5 | Confident | 78.9 | Confident | 72 Ų | 72 | 119.9 Ų | 119.9 | 39% | 0.385 | 62% | 0.616 | S | S | . | * | trans | -72 | 92.2 | 168.4 | -174.4 | -3.7 | 0 | 0 | 0 | 108 | H110 E114 E115 S116 | H110-N112 PolarHBondContact O-N 3.18Å; N112-E114 PolarHBondContact O-N 3.05Å; N112-E114 WeakPolarHBondContact OD1-CB 3.24Å; N112-E114 PolarHBondContact OD1-N 2.94Å; N112-E115 HydrophobicContact CB-CB 3.92Å; N112-E115 VanDerWaalsContact CG-CB 3.41Å; N112-E115 WeakPolarHBondContact ND2-CB 3.4Å; N112-E115 PolarHBondContact ND2-OE2 2.89Å; N112-E115 PolarHBondContact O-N 2.74Å; N112-E115 PolarHBondContact OD1-N 3.17Å; N112-S116 WeakPolarHBondContact O-CB 3.3Å; N112-S116 PolarHBondContact O-N 3.06Å; N112-S116 PolarHBondContact O-OG 3.42Å | ||
| 113 | I | 87.7 | Confident | 80 | Confident | 116 Ų | 116 | 119.7 Ų | 119.7 | 60% | 0.595 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -59.6 | -36.1 | -178.9 | -60.8 | 172.5 | 0 | 0 | 0 | 110 | L111 N117 | L111-I113 VanDerWaalsContact C-N 3.29Å; L111-I113 PolarHBondContact O-N 3.31Å; I113-N117 VanDerWaalsContact O-CB 3.24Å; I113-N117 WeakPolarHBondContact O-CB 3.28Å; I113-N117 PolarHBondContact O-N 3.06Å; I113-N117 PolarHBondContact O-ND2 3.2Å; I113-N117 PolarHBondContact O-OD1 2.95Å |
| 114 | E | 89.3 | Confident | 81.4 | Confident | 145 Ų | 145 | 116.7 Ų | 116.7 | 68% | 0.678 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -66 | -46.8 | -178.9 | -155.7 | 67.3 | -159.3 | 0 | 0 | 111.4 | N112 N117 Q118 | N112-E114 PolarHBondContact O-N 3.05Å; N112-E114 WeakPolarHBondContact OD1-CB 3.24Å; N112-E114 PolarHBondContact OD1-N 2.94Å; E114-N117 PolarHBondContact O-N 3.38Å; E114-Q118 WeakPolarHBondContact O-CB 3.34Å; E114-Q118 PolarHBondContact O-N 2.93Å |
| 115 | E | 88.4 | Confident | 82.6 | Confident | 98 Ų | 98 | 115.4 Ų | 115.4 | 46% | 0.458 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67.2 | -44 | 176.5 | 177.6 | 175.6 | -157.8 | 0 | 0 | 111.7 | N112 N117 Q118 E119 | N112-E115 HydrophobicContact CB-CB 3.92Å; N112-E115 VanDerWaalsContact CG-CB 3.41Å; N112-E115 WeakPolarHBondContact ND2-CB 3.4Å; N112-E115 PolarHBondContact ND2-OE2 2.89Å; N112-E115 PolarHBondContact O-N 2.74Å; N112-E115 PolarHBondContact OD1-N 3.17Å; E115-N117 VanDerWaalsContact C-N 3.3Å; E115-N117 PolarHBondContact O-N 3.13Å; E115-Q118 PolarHBondContact O-N 3.17Å; E115-Q118 VanDerWaalsContact O-N 3.15Å; E115-E119 WeakPolarHBondContact O-CB 3.35Å; E115-E119 WeakPolarHBondContact O-CG 3.28Å; E115-E119 PolarHBondContact O-N 3.26Å |
| 116 | S | 88.9 | Confident | 83.6 | Confident | 56 Ų | 56 | 113.9 Ų | 113.9 | 39% | 0.392 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -58.3 | -42.9 | 175.2 | -62.1 | 0 | 0 | 0 | 0 | 112 | N112 F120 | N112-S116 WeakPolarHBondContact O-CB 3.3Å; N112-S116 PolarHBondContact O-N 3.06Å; N112-S116 PolarHBondContact O-OG 3.42Å; S116-F120 WeakPolarHBondContact O-CB 3.27Å; S116-F120 PolarHBondContact O-N 2.9Å |
| 117 | N | 88.7 | Confident | 84.7 | Confident | 89 Ų | 89 | 115 Ų | 115 | 48% | 0.476 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -65.7 | -42.2 | 176.8 | -73 | -15.1 | 0 | 0 | 0 | 111.1 | I113 E114 E115 F120 M121 | I113-N117 VanDerWaalsContact O-CB 3.24Å; I113-N117 WeakPolarHBondContact O-CB 3.28Å; I113-N117 PolarHBondContact O-N 3.06Å; I113-N117 PolarHBondContact O-ND2 3.2Å; I113-N117 PolarHBondContact O-OD1 2.95Å; E114-N117 PolarHBondContact O-N 3.38Å; E115-N117 VanDerWaalsContact C-N 3.3Å; E115-N117 PolarHBondContact O-N 3.13Å; N117-F120 PolarHBondContact O-N 3.21Å; N117-M121 VanDerWaalsContact O-CG 3.3Å; N117-M121 WeakPolarHBondContact O-CG 3.34Å; N117-M121 PolarHBondContact O-N 3.04Å |
| 118 | Q | 90.6 | Very high | 85.7 | Confident | 136 Ų | 136 | 116.1 Ų | 116.1 | 64% | 0.636 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -65 | -44.2 | 178.3 | -171.3 | 175.9 | -7.7 | 0 | 0 | 111.6 | E114 E115 F120 M121 V122 | E114-Q118 WeakPolarHBondContact O-CB 3.34Å; E114-Q118 PolarHBondContact O-N 2.93Å; E115-Q118 PolarHBondContact O-N 3.17Å; E115-Q118 VanDerWaalsContact O-N 3.15Å; Q118-F120 VanDerWaalsContact C-N 3.32Å; Q118-F120 PolarHBondContact O-N 2.83Å; Q118-M121 WeakPolarHBondContact O-CB 3.28Å; Q118-M121 PolarHBondContact O-N 3.45Å; Q118-V122 WeakPolarHBondContact O-CG2 3.36Å; Q118-V122 PolarHBondContact O-N 2.85Å |
| 119 | E | 90 | Very high | 86.9 | Confident | 87 Ų | 87 | 112.3 Ų | 112.3 | 41% | 0.407 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.7 | -40.7 | 174.2 | -75.8 | -168.6 | -168 | 0 | 0 | 112.4 | E115 M121 V122 K123 | E115-E119 WeakPolarHBondContact O-CB 3.35Å; E115-E119 WeakPolarHBondContact O-CG 3.28Å; E115-E119 PolarHBondContact O-N 3.26Å; E119-M121 VanDerWaalsContact C-N 3.34Å; E119-V122 PolarHBondContact O-N 3.07Å; E119-K123 WeakPolarHBondContact O-CB 3.46Å; E119-K123 VanDerWaalsContact O-CG 3.28Å; E119-K123 WeakPolarHBondContact O-CG 3.22Å; E119-K123 PolarHBondContact O-N 3.34Å; E119-K123 IonicContact OE2-NZ 2.76Å; E119-K123 PolarHBondContact OE2-NZ 3.44Å |
| 120 | F | 92.7 | Very high | 87.9 | Confident | 142 Ų | 142 | 109.8 Ų | 109.8 | 62% | 0.623 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60.6 | -45.6 | 176.1 | 174.8 | -95.2 | 0 | 0 | 0 | 111.3 | S116 N117 Q118 V122 K123 S124 | S116-F120 WeakPolarHBondContact O-CB 3.27Å; S116-F120 PolarHBondContact O-N 2.9Å; N117-F120 PolarHBondContact O-N 3.21Å; Q118-F120 VanDerWaalsContact C-N 3.32Å; Q118-F120 PolarHBondContact O-N 2.83Å; F120-V122 VanDerWaalsContact C-N 3.33Å; F120-V122 PolarHBondContact O-N 3.08Å; F120-K123 PolarHBondContact O-N 3.44Å; F120-S124 VanDerWaalsContact O-CB 3.28Å; F120-S124 WeakPolarHBondContact O-CB 3.27Å; F120-S124 PolarHBondContact O-N 3.37Å; F120-S124 PolarHBondContact O-OG 3.35Å |
| 121 | M | 92.6 | Very high | 88.7 | Confident | 128 Ų | 128 | 105.9 Ų | 105.9 | 63% | 0.631 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -57.5 | -46.5 | 176.4 | -71.1 | -64 | -60.3 | 0 | 0 | 111.4 | N117 Q118 E119 S124 | N117-M121 VanDerWaalsContact O-CG 3.3Å; N117-M121 WeakPolarHBondContact O-CG 3.34Å; N117-M121 PolarHBondContact O-N 3.04Å; Q118-M121 WeakPolarHBondContact O-CB 3.28Å; Q118-M121 PolarHBondContact O-N 3.45Å; E119-M121 VanDerWaalsContact C-N 3.34Å; M121-S124 PolarHBondContact O-N 3.3Å; M121-S124 PolarHBondContact O-OG 2.87Å |
| 122 | V | 90.2 | Very high | 89.2 | Confident | 90 Ų | 90 | 105.8 Ų | 105.8 | 55% | 0.545 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.1 | -48.1 | 179.1 | 174.4 | 0 | 0 | 0 | 0 | 111.6 | Q118 E119 F120 S124 E125 | Q118-V122 WeakPolarHBondContact O-CG2 3.36Å; Q118-V122 PolarHBondContact O-N 2.85Å; E119-V122 PolarHBondContact O-N 3.07Å; F120-V122 VanDerWaalsContact C-N 3.33Å; F120-V122 PolarHBondContact O-N 3.08Å; V122-S124 PolarHBondContact O-N 3.02Å; V122-E125 VanDerWaalsContact O-CB 3.27Å; V122-E125 WeakPolarHBondContact O-CB 3.03Å; V122-E125 PolarHBondContact O-N 2.98Å; V122-E125 VanDerWaalsContact O-N 3.14Å |
| 123 | K | 87.8 | Confident | 89.4 | Confident | 134 Ų | 134 | 108 Ų | 108 | 58% | 0.583 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.5 | -28.7 | 179.5 | -72.2 | 168.5 | -179.4 | 161 | 0 | 112.4 | E119 F120 E125 | E119-K123 WeakPolarHBondContact O-CB 3.46Å; E119-K123 VanDerWaalsContact O-CG 3.28Å; E119-K123 WeakPolarHBondContact O-CG 3.22Å; E119-K123 PolarHBondContact O-N 3.34Å; E119-K123 IonicContact OE2-NZ 2.76Å; E119-K123 PolarHBondContact OE2-NZ 3.44Å; F120-K123 PolarHBondContact O-N 3.44Å; K123-E125 PolarHBondContact O-N 3.37Å |
| 124 | S | 91.4 | Very high | 89.3 | Confident | 43 Ų | 43 | 105.3 Ų | 105.3 | 30% | 0.301 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -71.6 | -17 | 178.5 | 75.7 | 0 | 0 | 0 | 0 | 113.8 | F120 M121 V122 L127 Y128 | F120-S124 VanDerWaalsContact O-CB 3.28Å; F120-S124 WeakPolarHBondContact O-CB 3.27Å; F120-S124 PolarHBondContact O-N 3.37Å; F120-S124 PolarHBondContact O-OG 3.35Å; M121-S124 PolarHBondContact O-N 3.3Å; M121-S124 PolarHBondContact O-OG 2.87Å; V122-S124 PolarHBondContact O-N 3.02Å; S124-L127 PolarHBondContact O-N 2.99Å; S124-Y128 PolarHBondContact O-N 3.27Å |
| 125 | E | 90.4 | Very high | 88.9 | Confident | 120 Ų | 120 | 106.9 Ų | 106.9 | 56% | 0.561 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -66.4 | -42.1 | -179.9 | -166.2 | 170.5 | -165.1 | 0 | 0 | 111.7 | V122 K123 L127 Y128 D129 | V122-E125 VanDerWaalsContact O-CB 3.27Å; V122-E125 WeakPolarHBondContact O-CB 3.03Å; V122-E125 PolarHBondContact O-N 2.98Å; V122-E125 VanDerWaalsContact O-N 3.14Å; K123-E125 PolarHBondContact O-N 3.37Å; E125-L127 VanDerWaalsContact C-N 3.29Å; E125-L127 PolarHBondContact O-N 3.43Å; E125-Y128 WeakPolarHBondContact O-CB 3.49Å; E125-Y128 PolarHBondContact O-N 2.87Å; E125-Y128 VanDerWaalsContact O-N 3.1Å; E125-D129 PolarHBondContact O-N 3.38Å |
| 126 | E | 86.8 | Confident | 88.2 | Confident | 151 Ų | 151 | 111.7 Ų | 111.7 | 71% | 0.706 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -62.7 | -36.7 | 177.2 | -64 | -176.5 | 175 | 0 | 0 | 112.4 | S130 | E126-S130 WeakPolarHBondContact O-CB 3.34Å; E126-S130 PolarHBondContact O-N 3.01Å; E126-S130 PolarHBondContact O-OG 3.1Å |
| 127 | L | 89.1 | Confident | 87.1 | Confident | 126 Ų | 126 | 117.2 Ų | 117.2 | 66% | 0.66 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.6 | -41.5 | 174.5 | 175.8 | 64.5 | 0 | 0 | 0 | 111.1 | S124 E125 S130 L131 | S124-L127 PolarHBondContact O-N 2.99Å; E125-L127 VanDerWaalsContact C-N 3.29Å; E125-L127 PolarHBondContact O-N 3.43Å; L127-S130 PolarHBondContact O-N 3.41Å; L127-L131 WeakPolarHBondContact O-CB 3.48Å; L127-L131 PolarHBondContact O-N 2.76Å |
| 128 | Y | 87.9 | Confident | 86.2 | Confident | 140 Ų | 140 | 118.5 Ų | 118.5 | 55% | 0.549 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -61.9 | -47.2 | 177.1 | -177.2 | -92.8 | 0 | 0 | 0 | 111.2 | S124 E125 S130 L131 M132 | S124-Y128 PolarHBondContact O-N 3.27Å; E125-Y128 WeakPolarHBondContact O-CB 3.49Å; E125-Y128 PolarHBondContact O-N 2.87Å; E125-Y128 VanDerWaalsContact O-N 3.1Å; Y128-S130 VanDerWaalsContact C-N 3.31Å; Y128-S130 PolarHBondContact O-N 3.32Å; Y128-L131 PolarHBondContact O-N 2.72Å; Y128-M132 HydrophobicContact CD1-CG 4.01Å; Y128-M132 HydrophobicContact CD2-CE 4.07Å; Y128-M132 HydrophobicContact CE1-CE 4.24Å; Y128-M132 HydrophobicContact CE1-CG 3.66Å; Y128-M132 HydrophobicContact CE2-CE 3.36Å; Y128-M132 HydrophobicContact CE2-CG 4.39Å; Y128-M132 VanDerWaalsContact CZ-CE 3.47Å; Y128-M132 WeakPolarHBondContact O-CG 3.3Å; Y128-M132 PolarHBondContact O-N 3.12Å |
| 129 | D | 90.6 | Very high | 84.7 | Confident | 80 Ų | 80 | 120.1 Ų | 120.1 | 43% | 0.428 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -60.3 | -43.1 | 176.5 | -76.2 | -15.5 | 0 | 0 | 0 | 111.7 | E125 L131 M132 N133 | E125-D129 PolarHBondContact O-N 3.38Å; D129-L131 VanDerWaalsContact C-N 3.35Å; D129-L131 PolarHBondContact O-N 3.02Å; D129-M132 PolarHBondContact O-N 2.85Å; D129-N133 VanDerWaalsContact O-CB 3.27Å; D129-N133 WeakPolarHBondContact O-CB 3.39Å; D129-N133 VanDerWaalsContact O-CG 3.23Å; D129-N133 PolarHBondContact O-N 3.33Å; D129-N133 PolarHBondContact O-ND2 3.39Å |
| 130 | S | 90.1 | Very high | 83.1 | Confident | 70 Ų | 70 | 121.5 Ų | 121.5 | 49% | 0.49 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -59.6 | -46.2 | 175.6 | -61.5 | 0 | 0 | 0 | 0 | 111.1 | E126 L127 Y128 N133 C134 | E126-S130 WeakPolarHBondContact O-CB 3.34Å; E126-S130 PolarHBondContact O-N 3.01Å; E126-S130 PolarHBondContact O-OG 3.1Å; L127-S130 PolarHBondContact O-N 3.41Å; Y128-S130 VanDerWaalsContact C-N 3.31Å; Y128-S130 PolarHBondContact O-N 3.32Å; S130-N133 CarbonylContact O-C 3.58Å; S130-N133 PolarHBondContact O-N 2.82Å; S130-C134 PolarHBondContact O-N 2.61Å; S130-C134 PolarHBondContact O-SG 3.44Å |
| 131 | L | 88.5 | Confident | 81.4 | Confident | 92 Ų | 92 | 119.5 Ų | 119.5 | 48% | 0.482 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64.3 | -41.8 | 179 | -178 | 66.4 | 0 | 0 | 0 | 112.4 | L127 Y128 D129 N133 C134 | L127-L131 WeakPolarHBondContact O-CB 3.48Å; L127-L131 PolarHBondContact O-N 2.76Å; Y128-L131 PolarHBondContact O-N 2.72Å; D129-L131 VanDerWaalsContact C-N 3.35Å; D129-L131 PolarHBondContact O-N 3.02Å; L131-N133 VanDerWaalsContact C-N 3.33Å; L131-C134 WeakPolarHBondContact O-CB 3.47Å; L131-C134 PolarHBondContact O-N 3.06Å |
| 132 | M | 88.4 | Confident | 79.8 | Confident | 106 Ų | 106 | 120.4 Ų | 120.4 | 52% | 0.522 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -70.4 | -32.4 | 179.7 | -68 | -57.2 | 157.2 | 0 | 0 | 112.3 | Y128 D129 C134 | Y128-M132 HydrophobicContact CD1-CG 4.01Å; Y128-M132 HydrophobicContact CD2-CE 4.07Å; Y128-M132 HydrophobicContact CE1-CE 4.24Å; Y128-M132 HydrophobicContact CE1-CG 3.66Å; Y128-M132 HydrophobicContact CE2-CE 3.36Å; Y128-M132 HydrophobicContact CE2-CG 4.39Å; Y128-M132 VanDerWaalsContact CZ-CE 3.47Å; Y128-M132 WeakPolarHBondContact O-CG 3.3Å; Y128-M132 PolarHBondContact O-N 3.12Å; D129-M132 PolarHBondContact O-N 2.85Å; M132-C134 VanDerWaalsContact C-N 3.3Å |
| 133 | N | 87.6 | Confident | 78.2 | Confident | 120 Ų | 120 | 124.3 Ų | 124.3 | 64% | 0.642 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.1 | -2.3 | 174.4 | -65.8 | -38.2 | 0 | 0 | 0 | 113.2 | D129 S130 L131 H135 | D129-N133 VanDerWaalsContact O-CB 3.27Å; D129-N133 WeakPolarHBondContact O-CB 3.39Å; D129-N133 VanDerWaalsContact O-CG 3.23Å; D129-N133 PolarHBondContact O-N 3.33Å; D129-N133 PolarHBondContact O-ND2 3.39Å; S130-N133 CarbonylContact O-C 3.58Å; S130-N133 PolarHBondContact O-N 2.82Å; L131-N133 VanDerWaalsContact C-N 3.33Å; N133-H135 PolarHBondContact O-N 3.21Å |
| 134 | C | 86.1 | Confident | 76.9 | Confident | 58 Ų | 58 | 120.2 Ų | 120.2 | 39% | 0.392 | 62% | 0.62 | S | S | . | * | trans | -72.8 | 117.7 | 174 | -77.8 | 0 | 0 | 0 | 0 | 110.5 | S130 L131 M132 W136 | S130-C134 PolarHBondContact O-N 2.61Å; S130-C134 PolarHBondContact O-SG 3.44Å; L131-C134 WeakPolarHBondContact O-CB 3.47Å; L131-C134 PolarHBondContact O-N 3.06Å; M132-C134 VanDerWaalsContact C-N 3.3Å; C134-W136 PolarHBondContact O-N 3.21Å | ||
| 135 | H | 79.1 | Confident | 75.5 | Confident | 179 Ų | 179 | 127 Ų | 127 | 83% | 0.829 | 65% | 0.647 | S | S | * | * | trans | -86.2 | 81.8 | 164.4 | -58.4 | -56.4 | 0 | 0 | 0 | 108.9 | N133 Q137 | N133-H135 PolarHBondContact O-N 3.21Å; H135-Q137 PolarHBondContact O-N 3.45Å | ||
| 136 | W | 74.1 | Confident | 74.4 | Confident | 198 Ų | 198 | 128.1 Ų | 128.1 | 75% | 0.75 | 66% | 0.655 | S | S | * | * | trans | -60.7 | 107.8 | 168.7 | -62.9 | 94.8 | 0 | 0 | 0 | 107.5 | C134 | C134-W136 PolarHBondContact O-N 3.21Š| ||
| 137 | Q | 66.4 | Low | 73.5 | Confident | 172 Ų | 172 | 126.3 Ų | 126.3 | 80% | 0.804 | 66% | 0.656 | S | S | * | * | trans | -57.1 | 128.7 | 167.7 | -70 | -170.9 | -78.3 | 0 | 0 | 106.2 | H135 L139 | H135-Q137 PolarHBondContact O-N 3.45Å; Q137-L139 PolarHBondContact O-N 3.34Å | ||
| 138 | P | 68.9 | Low | 72.2 | Confident | 116 Ų | 116 | 126.8 Ų | 126.8 | 75% | 0.753 | 66% | 0.66 | S | S | * | * | trans | -52.9 | 116.2 | 167.6 | -15.1 | 26.8 | 0 | 0 | 0 | 104.5 | D140 | P138-D140 PolarHBondContact O-N 3.44Š| ||
| 139 | L | 59.5 | Low | 71.2 | Confident | 170 Ų | 170 | 128.9 Ų | 128.9 | 89% | 0.89 | 67% | 0.674 | S | S | * | * | trans | -42.3 | 116.2 | 176.2 | -83.3 | 163.1 | 0 | 0 | 0 | 105.9 | Q137 T141 | Q137-L139 PolarHBondContact O-N 3.34Å; L139-T141 PolarHBondContact O-N 3.41Å | ||
| 140 | D | 56.7 | Low | 69.6 | Low | 117 Ų | 117 | 130.1 Ų | 130.1 | 63% | 0.626 | 69% | 0.685 | S | S | * | * | trans | -24.3 | 111.6 | 175.9 | -86.8 | -32.7 | 0 | 0 | 0 | 108.4 | P138 V142 S144 | P138-D140 PolarHBondContact O-N 3.44Å; D140-V142 PolarHBondContact O-N 3.32Å; D140-S144 WeakPolarHBondContact CA-OG 3.44Å; D140-S144 WeakPolarHBondContact CB-OG 3.4Å; D140-S144 VanDerWaalsContact CG-CB 3.45Å; D140-S144 VanDerWaalsContact OD1-CB 3.3Å; D140-S144 WeakPolarHBondContact OD1-CB 3.35Å; D140-S144 PolarHBondContact OD1-OG 3.39Å | ||
| 141 | T | 56.4 | Low | 68.5 | Low | 99 Ų | 99 | 132.7 Ų | 132.7 | 61% | 0.607 | 70% | 0.7 | S | S | * | * | trans | -45.7 | 145.4 | 169.6 | 54.4 | 0 | 0 | 0 | 0 | 107.1 | L139 H143 S144 | L139-T141 PolarHBondContact O-N 3.41Å; T141-H143 PolarHBondContact O-N 3.24Å; T141-S144 PolarHBondContact N-OG 3.03Å; T141-S144 PolarHBondContact O-N 2.88Å; T141-S144 PolarHBondContact O-OG 3.48Å; T141-S144 PolarHBondContact OG1-OG 3.4Å | ||
| 142 | V | 59.3 | Low | 66.8 | Low | 148 Ų | 148 | 142 Ų | 142 | 90% | 0.897 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.4 | 2.6 | -171.4 | -156.6 | 0 | 0 | 0 | 0 | 114.6 | D140 | D140-V142 PolarHBondContact O-N 3.32Š|
| 143 | H | 57.6 | Low | 65.7 | Low | 172 Ų | 172 | 143.8 Ų | 143.8 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.9 | 4.5 | 177.8 | -55.3 | -49.7 | 0 | 0 | 0 | 114.7 | T141 E145 | T141-H143 PolarHBondContact O-N 3.24Å; H143-E145 PolarHBondContact O-N 3.35Å |
| 144 | S | 59.5 | Low | 64.5 | Low | 47 Ų | 47 | 145 Ų | 145 | 33% | 0.329 | 75% | 0.753 | S | S | . | * | trans | -78.2 | 111.4 | -178.4 | -39.8 | 0 | 0 | 0 | 0 | 108.7 | D140 T141 I146 | D140-S144 WeakPolarHBondContact CA-OG 3.44Å; D140-S144 WeakPolarHBondContact CB-OG 3.4Å; D140-S144 VanDerWaalsContact CG-CB 3.45Å; D140-S144 VanDerWaalsContact OD1-CB 3.3Å; D140-S144 WeakPolarHBondContact OD1-CB 3.35Å; D140-S144 PolarHBondContact OD1-OG 3.39Å; T141-S144 PolarHBondContact N-OG 3.03Å; T141-S144 PolarHBondContact O-N 2.88Å; T141-S144 PolarHBondContact O-OG 3.48Å; T141-S144 PolarHBondContact OG1-OG 3.4Å; S144-I146 PolarHBondContact O-N 3.13Å | ||
| 145 | E | 63.3 | Low | 63.3 | Low | 187 Ų | 187 | 149.8 Ų | 149.8 | 87% | 0.874 | 77% | 0.773 | S | S | * | * | trans | -70.9 | 119.5 | 176.3 | -167.9 | 166 | -162.9 | 0 | 0 | 108.4 | H143 | H143-E145 PolarHBondContact O-N 3.35Š| ||
| 146 | I | 67.3 | Low | 62.4 | Low | 143 Ų | 143 | 148.1 Ų | 148.1 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | trans | -59 | 128.9 | 176.5 | -61.7 | 165.9 | 0 | 0 | 0 | 107.1 | S144 D148 | S144-I146 PolarHBondContact O-N 3.13Å; I146-D148 PolarHBondContact O-N 3.45Å | ||
| 147 | P | 66.7 | Low | 61.7 | Low | 112 Ų | 112 | 145 Ų | 145 | 73% | 0.727 | 77% | 0.771 | S | S | * | * | trans | -61.4 | 114.1 | 179.8 | 23.8 | -31.8 | 0 | 0 | 0 | 109.3 | E149 | P147-E149 PolarHBondContact O-N 3.44Å; P147-E149 VanDerWaalsContact O-N 3.1Å | ||
| 148 | D | 62.3 | Low | 61.4 | Low | 137 Ų | 137 | 143.2 Ų | 143.2 | 73% | 0.733 | 77% | 0.768 | S | S | * | * | trans | -72.3 | 102.1 | 179.4 | -158.3 | 8.6 | 0 | 0 | 0 | 108.4 | I146 T150 | I146-D148 PolarHBondContact O-N 3.45Å; D148-T150 PolarHBondContact O-N 3.19Å | ||
| 149 | E | 65.8 | Low | 60.8 | Low | 183 Ų | 183 | 145.1 Ų | 145.1 | 86% | 0.855 | 77% | 0.769 | S | S | * | * | trans | -70.4 | 78.2 | 170.3 | -70 | -162.4 | 170.5 | 0 | 0 | 109.5 | P147 P151 | P147-E149 PolarHBondContact O-N 3.44Å; P147-E149 VanDerWaalsContact O-N 3.1Å; E149-P151 WeakPolarHBondContact O-CD 3.34Å | ||
| 150 | T | 56.9 | Low | 60.9 | Low | 106 Ų | 106 | 143.2 Ų | 143.2 | 65% | 0.65 | 76% | 0.76 | S | S | * | * | trans | -102.4 | 101.5 | 162.4 | 42.4 | 0 | 0 | 0 | 0 | 109.7 | D148 | D148-T150 PolarHBondContact O-N 3.19Š| ||
| 151 | P | 67.2 | Low | 61.3 | Low | 125 Ų | 125 | 145.4 Ų | 145.4 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | trans | -70.8 | 133.2 | 168.8 | 28.7 | -30 | 0 | 0 | 0 | 109.3 | E149 | E149-P151 WeakPolarHBondContact O-CD 3.34Š| ||
| 152 | K | 53.2 | Low | 61.7 | Low | 286 Ų | 286 | 149.6 Ų | 149.6 | 100% | 1.243 | 79% | 0.786 | S | S | * | * | trans | -75.3 | 0 | 171.7 | -87.6 | 177.2 | 178.2 | 167.8 | 0 | 112.2 |
Retrieved 152 of 152 residues in 23.9 ms
(Link to these results)