| 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 | I | 37.5 | Very low | 38.5 | Very low | 216 Ų | 216 | 148.9 Ų | 148.9 | 100% | 1.108 | 80% | 0.801 | S | S | * | * | 0 | 152.8 | 0 | -67.8 | 172.3 | 0 | 0 | 0 | 107.6 | |||||
| 2 | Y | 36.3 | Very low | 38.3 | Very low | 217 Ų | 217 | 152.4 Ų | 152.4 | 85% | 0.851 | 81% | 0.809 | S | S | * | * | trans | -43.5 | 165.2 | 173.1 | -58.9 | -86.3 | 0 | 0 | 0 | 114.2 | ||||
| 3 | K | 42.5 | Very low | 38.5 | Very low | 189 Ų | 189 | 145.7 Ų | 145.7 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | cis | -164.6 | 167.6 | 14.9 | -136.9 | -178.4 | -176 | -177.6 | 0 | 105.9 | ||||
| 4 | I | 39.8 | Very low | 38.6 | Very low | 134 Ų | 134 | 144.5 Ų | 144.5 | 69% | 0.687 | 79% | 0.79 | S | S | * | * | cis | -139.2 | 162.7 | 7.6 | -79.8 | 170.7 | 0 | 0 | 0 | 107.5 | ||||
| 5 | R | 43.5 | Very low | 39.4 | Very low | 215 Ų | 215 | 144.2 Ų | 144.2 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | trans | -110.9 | 118.4 | 156.5 | 178.1 | -178.1 | -179.5 | 175.2 | 0.4 | 109.5 | ||||
| 6 | S | 35.5 | Very low | 39.8 | Very low | 101 Ų | 101 | 142.3 Ų | 142.3 | 71% | 0.706 | 78% | 0.782 | S | S | * | * | trans | -123.6 | 91 | 178.6 | 55.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 7 | Q | 36.2 | Very low | 40.9 | Very low | 152 Ų | 152 | 138.8 Ų | 138.8 | 71% | 0.71 | 79% | 0.787 | S | S | * | * | trans | -105.4 | 94.6 | 164.8 | -76.4 | -179.8 | -71.6 | 0 | 0 | 108.1 | ||||
| 8 | S | 38.8 | Very low | 42.1 | Very low | 114 Ų | 114 | 137.9 Ų | 137.9 | 80% | 0.797 | 79% | 0.785 | S | S | * | * | trans | -117.7 | 50 | 175.5 | -59.5 | 0 | 0 | 0 | 0 | 109.7 | V10 | S8-V10 PolarHBondContact O-N 3.32Š| ||
| 9 | A | 38.9 | Very low | 43.4 | Very low | 99 Ų | 99 | 135.2 Ų | 135.2 | 82% | 0.818 | 77% | 0.771 | S | S | * | * | trans | -85.9 | 87.8 | 167 | 0 | 0 | 0 | 0 | 0 | 107.8 | G11 | A9-G11 PolarHBondContact O-N 3.19Š| ||
| 10 | V | 37.9 | Very low | 45.2 | Very low | 134 Ų | 134 | 131.4 Ų | 131.4 | 81% | 0.812 | 75% | 0.753 | S | S | * | * | trans | -66 | 111 | 163 | 175.9 | 0 | 0 | 0 | 0 | 105.9 | S8 E12 | S8-V10 PolarHBondContact O-N 3.32Å; V10-E12 PolarHBondContact O-N 3.28Å | ||
| 11 | G | 36.7 | Very low | 46.8 | Very low | 67 Ų | 67 | 130.5 Ų | 130.5 | 69% | 0.691 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 121.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | A9 | A9-G11 PolarHBondContact O-N 3.19Š|
| 12 | E | 36.1 | Very low | 49.1 | Very low | 191 Ų | 191 | 122.1 Ų | 122.1 | 89% | 0.893 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 137 | 172.3 | -68.8 | 173.2 | 109 | 0 | 0 | 109.2 | V10 D14 | V10-E12 PolarHBondContact O-N 3.28Å; E12-D14 PolarHBondContact O-N 2.96Å |
| 13 | G | 40.6 | Very low | 51.7 | Low | 65 Ų | 65 | 114.3 Ų | 114.3 | 67% | 0.67 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -69 | 123 | -175.7 | 0 | 0 | 0 | 0 | 0 | 111 | V15 | G13-V15 VanDerWaalsContact C-N 3.35Å; G13-V15 WeakPolarHBondContact O-CG2 3.44Å; G13-V15 PolarHBondContact O-N 3.32Å |
| 14 | D | 39.4 | Very low | 54 | Low | 129 Ų | 129 | 107.6 Ų | 107.6 | 69% | 0.69 | 68% | 0.676 | S | S | * | * | trans | -70.6 | 91.3 | 169.3 | -173.5 | 10.6 | 0 | 0 | 0 | 109.4 | E12 N16 | E12-D14 PolarHBondContact O-N 2.96Å; D14-N16 PolarHBondContact O-N 2.74Å; D14-N16 WeakPolarHBondContact OD1-CB 3.49Å; D14-N16 PolarHBondContact OD1-ND2 2.95Å | ||
| 15 | V | 50.9 | Low | 56.6 | Low | 140 Ų | 140 | 106.8 Ų | 106.8 | 85% | 0.848 | 67% | 0.673 | S | S | * | * | trans | -80.6 | 49.4 | 178 | -165.3 | 0 | 0 | 0 | 0 | 110.5 | G13 | G13-V15 VanDerWaalsContact C-N 3.35Å; G13-V15 WeakPolarHBondContact O-CG2 3.44Å; G13-V15 PolarHBondContact O-N 3.32Å | ||
| 16 | N | 46.2 | Very low | 59 | Low | 113 Ų | 113 | 102.6 Ų | 102.6 | 60% | 0.604 | 67% | 0.666 | S | S | * | * | trans | -111.6 | 105.8 | 167 | -73.9 | -71.3 | 0 | 0 | 0 | 108.5 | D14 V18 | D14-N16 PolarHBondContact O-N 2.74Å; D14-N16 WeakPolarHBondContact OD1-CB 3.49Å; D14-N16 PolarHBondContact OD1-ND2 2.95Å; N16-V18 PolarHBondContact O-N 3.2Å | ||
| 17 | G | 57.7 | Low | 61.9 | Low | 84 Ų | 84 | 102.1 Ų | 102.1 | 87% | 0.866 | 65% | 0.654 | S | S | * | * | trans | -69.5 | 29.9 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | V19 | G17-V19 PolarHBondContact O-N 3.09Å; G17-V19 VanDerWaalsContact O-N 3.09Å | ||
| 18 | V | 62.7 | Low | 64.7 | Low | 123 Ų | 123 | 100.2 Ų | 100.2 | 75% | 0.745 | 65% | 0.648 | S | S | * | * | trans | -77.4 | 94.2 | 177.6 | -175.8 | 0 | 0 | 0 | 0 | 108.4 | N16 S20 | N16-V18 PolarHBondContact O-N 3.2Å; V18-S20 PolarHBondContact O-N 2.78Å | ||
| 19 | V | 66.8 | Low | 67.5 | Low | 86 Ų | 86 | 97.4 Ų | 97.4 | 52% | 0.521 | 63% | 0.632 | S | S | . | * | trans | -49.5 | 124 | 170.3 | 177.2 | 0 | 0 | 0 | 0 | 108.8 | G17 A24 I27 | G17-V19 PolarHBondContact O-N 3.09Å; G17-V19 VanDerWaalsContact O-N 3.09Å; V19-A24 HydrophobicContact CG1-CB 4.14Å; V19-I27 HydrophobicContact CG1-CD1 4.42Å | ||
| 20 | S | 79.8 | Confident | 70.2 | Confident | 59 Ų | 59 | 98 Ų | 98 | 41% | 0.413 | 62% | 0.618 | S | S | . | * | trans | -57.2 | 146.4 | -175 | 88.6 | 0 | 0 | 0 | 0 | 110.9 | V18 G22 S23 A24 | V18-S20 PolarHBondContact O-N 2.78Å; S20-G22 PolarHBondContact O-N 2.9Å; S20-G22 VanDerWaalsContact O-N 3.11Å; S20-S23 WeakPolarHBondContact O-CA 3.43Å; S20-S23 WeakPolarHBondContact O-CB 3.41Å; S20-S23 PolarHBondContact O-N 2.9Å; S20-S23 WeakPolarHBondContact OG-CB 3.47Å; S20-S23 PolarHBondContact OG-N 3.11Å; S20-S23 VanDerWaalsContact OG-N 3.13Å; S20-S23 PolarHBondContact OG-OG 3.06Å; S20-A24 PolarHBondContact O-N 3.06Å | ||
| 21 | P | 79.9 | Confident | 73 | Confident | 112 Ų | 112 | 97.6 Ų | 97.6 | 73% | 0.727 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -55.3 | -34.7 | -177.8 | -28.9 | 36 | 0 | 0 | 0 | 113.7 | L25 | P21-L25 WeakPolarHBondContact O-CB 3.37Å; P21-L25 PolarHBondContact O-N 2.77Å |
| 22 | G | 85.4 | Confident | 75.9 | Confident | 41 Ų | 41 | 97.4 Ų | 97.4 | 42% | 0.423 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -68.2 | -41.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | S20 L25 L26 | S20-G22 PolarHBondContact O-N 2.9Å; S20-G22 VanDerWaalsContact O-N 3.11Å; G22-L25 PolarHBondContact O-N 3.13Å; G22-L26 VanDerWaalsContact O-CG 3.3Å; G22-L26 WeakPolarHBondContact O-CG 3.43Å; G22-L26 PolarHBondContact O-N 3.37Å |
| 23 | S | 89.4 | Confident | 78.8 | Confident | 53 Ų | 53 | 96.7 Ų | 96.7 | 37% | 0.371 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -62.2 | -42.4 | 174.7 | -55.4 | 0 | 0 | 0 | 0 | 111.9 | S20 L26 I27 | S20-S23 WeakPolarHBondContact O-CA 3.43Å; S20-S23 WeakPolarHBondContact O-CB 3.41Å; S20-S23 PolarHBondContact O-N 2.9Å; S20-S23 WeakPolarHBondContact OG-CB 3.47Å; S20-S23 PolarHBondContact OG-N 3.11Å; S20-S23 VanDerWaalsContact OG-N 3.13Å; S20-S23 PolarHBondContact OG-OG 3.06Å; S23-L26 PolarHBondContact O-N 3.03Å; S23-I27 WeakPolarHBondContact O-CD1 3.36Å; S23-I27 VanDerWaalsContact O-CG1 3.28Å; S23-I27 WeakPolarHBondContact O-CG1 3.3Å; S23-I27 PolarHBondContact O-N 2.98Å |
| 24 | A | 91.3 | Very high | 81.5 | Confident | 48 Ų | 48 | 97.9 Ų | 97.9 | 40% | 0.397 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -64.5 | -41.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | V19 S20 I27 L28 | V19-A24 HydrophobicContact CG1-CB 4.14Å; S20-A24 PolarHBondContact O-N 3.06Å; A24-I27 PolarHBondContact O-N 3.29Å; A24-L28 PolarHBondContact O-N 3.41Å |
| 25 | L | 94.4 | Very high | 84.3 | Confident | 117 Ų | 117 | 97.2 Ų | 97.2 | 61% | 0.613 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -63.7 | -42.2 | 175.6 | -179.3 | 61.7 | 0 | 0 | 0 | 112.3 | P21 G22 L28 A29 | P21-L25 WeakPolarHBondContact O-CB 3.37Å; P21-L25 PolarHBondContact O-N 2.77Å; G22-L25 PolarHBondContact O-N 3.13Å; L25-L28 PolarHBondContact O-N 3.41Å; L25-A29 WeakPolarHBondContact O-CB 3.28Å; L25-A29 PolarHBondContact O-N 2.96Å |
| 26 | L | 94.6 | Very high | 86.6 | Confident | 127 Ų | 127 | 95 Ų | 95 | 67% | 0.665 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -63.1 | -41.6 | 176.5 | -73.8 | 169.4 | 0 | 0 | 0 | 112.1 | G22 S23 A29 H30 | G22-L26 VanDerWaalsContact O-CG 3.3Å; G22-L26 WeakPolarHBondContact O-CG 3.43Å; G22-L26 PolarHBondContact O-N 3.37Å; S23-L26 PolarHBondContact O-N 3.03Å; L26-A29 PolarHBondContact O-N 2.9Å; L26-H30 WeakPolarHBondContact O-CB 3.39Å; L26-H30 PolarHBondContact O-N 3.36Å |
| 27 | I | 95.4 | Very high | 89 | Confident | 91 Ų | 91 | 90.7 Ų | 90.7 | 47% | 0.467 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.1 | -49 | 175 | -69.8 | 164.2 | 0 | 0 | 0 | 110.4 | V19 S23 A24 A29 H30 F31 | V19-I27 HydrophobicContact CG1-CD1 4.42Å; S23-I27 WeakPolarHBondContact O-CD1 3.36Å; S23-I27 VanDerWaalsContact O-CG1 3.28Å; S23-I27 WeakPolarHBondContact O-CG1 3.3Å; S23-I27 PolarHBondContact O-N 2.98Å; A24-I27 PolarHBondContact O-N 3.29Å; I27-A29 PolarHBondContact O-N 3.46Å; I27-H30 PolarHBondContact O-N 2.96Å; I27-F31 HydrophobicContact CG2-CD2 3.72Å; I27-F31 HydrophobicContact CG2-CE2 3.78Å; I27-F31 WeakPolarHBondContact O-CD2 3.35Å; I27-F31 PolarHBondContact O-N 3.46Å |
| 28 | L | 96.1 | Very high | 90.9 | Very high | 111 Ų | 111 | 89.5 Ų | 89.5 | 58% | 0.581 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.9 | -43.4 | 178.6 | -179.7 | 62.4 | 0 | 0 | 0 | 112.3 | A24 L25 T32 | A24-L28 PolarHBondContact O-N 3.41Å; L25-L28 PolarHBondContact O-N 3.41Å; L28-T32 WeakPolarHBondContact O-CB 3.37Å; L28-T32 PolarHBondContact O-N 2.7Å; L28-T32 PolarHBondContact O-OG1 3.39Å |
| 29 | A | 96.5 | Very high | 92.6 | Very high | 55 Ų | 55 | 87.4 Ų | 87.4 | 46% | 0.455 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.2 | -42.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | L25 L26 I27 T32 Y33 | L25-A29 WeakPolarHBondContact O-CB 3.28Å; L25-A29 PolarHBondContact O-N 2.96Å; L26-A29 PolarHBondContact O-N 2.9Å; I27-A29 PolarHBondContact O-N 3.46Å; A29-T32 PolarHBondContact O-N 3.4Å; A29-Y33 WeakPolarHBondContact O-CB 3.42Å; A29-Y33 PolarHBondContact O-N 3.04Å |
| 30 | H | 95.7 | Very high | 94.1 | Very high | 113 Ų | 113 | 87.5 Ų | 87.5 | 52% | 0.523 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.8 | -45.6 | 178.4 | -173.9 | 72 | 0 | 0 | 0 | 112.3 | L26 I27 T32 Y33 L34 | L26-H30 WeakPolarHBondContact O-CB 3.39Å; L26-H30 PolarHBondContact O-N 3.36Å; I27-H30 PolarHBondContact O-N 2.96Å; H30-T32 VanDerWaalsContact C-N 3.31Å; H30-T32 PolarHBondContact O-N 2.96Å; H30-Y33 PolarHBondContact O-N 3.28Å; H30-L34 WeakPolarHBondContact O-CG 3.3Å; H30-L34 PolarHBondContact O-N 2.98Å |
| 31 | F | 97.1 | Very high | 94.9 | Very high | 125 Ų | 125 | 91.2 Ų | 91.2 | 55% | 0.548 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.6 | -39.8 | 173.2 | -86.6 | -68.9 | 0 | 0 | 0 | 112.3 | I27 L34 L35 | I27-F31 HydrophobicContact CG2-CD2 3.72Å; I27-F31 HydrophobicContact CG2-CE2 3.78Å; I27-F31 WeakPolarHBondContact O-CD2 3.35Å; I27-F31 PolarHBondContact O-N 3.46Å; F31-L34 PolarHBondContact O-N 3.47Å; F31-L35 VanDerWaalsContact O-CG 3.3Å; F31-L35 WeakPolarHBondContact O-CG 3.42Å; F31-L35 PolarHBondContact O-N 2.92Å |
| 32 | T | 97.6 | Very high | 95.8 | Very high | 63 Ų | 63 | 91.4 Ų | 91.4 | 39% | 0.387 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.7 | -41.9 | 176.7 | -56.7 | 0 | 0 | 0 | 0 | 111.5 | L28 A29 H30 L35 I36 | L28-T32 WeakPolarHBondContact O-CB 3.37Å; L28-T32 PolarHBondContact O-N 2.7Å; L28-T32 PolarHBondContact O-OG1 3.39Å; A29-T32 PolarHBondContact O-N 3.4Å; H30-T32 VanDerWaalsContact C-N 3.31Å; H30-T32 PolarHBondContact O-N 2.96Å; T32-L35 PolarHBondContact O-N 2.72Å; T32-I36 HydrophobicContact CG2-CD1 4.02Å; T32-I36 VanDerWaalsContact O-CG1 3.31Å; T32-I36 WeakPolarHBondContact O-CG1 3.41Å; T32-I36 PolarHBondContact O-N 3.05Å |
| 33 | Y | 97.1 | Very high | 96.4 | Very high | 175 Ų | 175 | 95.3 Ų | 95.3 | 69% | 0.686 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.2 | -44.6 | 175.9 | -176.5 | -98.3 | 0 | 0 | 0 | 112.3 | A29 H30 L35 I36 G37 | A29-Y33 WeakPolarHBondContact O-CB 3.42Å; A29-Y33 PolarHBondContact O-N 3.04Å; H30-Y33 PolarHBondContact O-N 3.28Å; Y33-L35 PolarHBondContact O-N 3.31Å; Y33-I36 PolarHBondContact O-N 3.25Å; Y33-G37 PolarHBondContact O-N 3.48Å |
| 34 | L | 97.9 | Very high | 96.7 | Very high | 91 Ų | 91 | 98 Ų | 98 | 48% | 0.476 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.9 | -40 | 175.1 | -68.5 | 176.5 | 0 | 0 | 0 | 112.5 | H30 F31 G37 A38 | H30-L34 WeakPolarHBondContact O-CG 3.3Å; H30-L34 PolarHBondContact O-N 2.98Å; F31-L34 PolarHBondContact O-N 3.47Å; L34-G37 PolarHBondContact O-N 2.95Å; L34-A38 WeakPolarHBondContact O-CB 3.45Å; L34-A38 PolarHBondContact O-N 3.25Å |
| 35 | L | 98.1 | Very high | 96.9 | Very high | 114 Ų | 114 | 101 Ų | 101 | 60% | 0.597 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.2 | -42 | 176.4 | -73.5 | 169 | 0 | 0 | 0 | 112.2 | F31 T32 Y33 A38 V39 | F31-L35 VanDerWaalsContact O-CG 3.3Å; F31-L35 WeakPolarHBondContact O-CG 3.42Å; F31-L35 PolarHBondContact O-N 2.92Å; T32-L35 PolarHBondContact O-N 2.72Å; Y33-L35 PolarHBondContact O-N 3.31Å; L35-A38 PolarHBondContact O-N 2.93Å; L35-V39 WeakPolarHBondContact O-CG2 3.31Å; L35-V39 PolarHBondContact O-N 3.21Å |
| 36 | I | 98.1 | Very high | 97 | Very high | 94 Ų | 94 | 103.2 Ų | 103.2 | 48% | 0.482 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.1 | -47.1 | 174.5 | -69.8 | 165.5 | 0 | 0 | 0 | 110.2 | T32 Y33 A38 V39 I40 | T32-I36 HydrophobicContact CG2-CD1 4.02Å; T32-I36 VanDerWaalsContact O-CG1 3.31Å; T32-I36 WeakPolarHBondContact O-CG1 3.41Å; T32-I36 PolarHBondContact O-N 3.05Å; Y33-I36 PolarHBondContact O-N 3.25Å; I36-A38 PolarHBondContact O-N 3.41Å; I36-V39 PolarHBondContact O-N 3.01Å; I36-I40 HydrophobicContact CG2-CD1 3.7Å; I36-I40 WeakPolarHBondContact O-CG1 3.47Å; I36-I40 PolarHBondContact O-N 3.3Å |
| 37 | G | 97.6 | Very high | 97.1 | Very high | 22 Ų | 22 | 103.9 Ų | 103.9 | 23% | 0.227 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -58.1 | -48.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y33 L34 V39 I40 F41 | Y33-G37 PolarHBondContact O-N 3.48Å; L34-G37 PolarHBondContact O-N 2.95Å; G37-V39 PolarHBondContact O-N 3.24Å; G37-I40 PolarHBondContact O-N 3.01Å; G37-F41 WeakPolarHBondContact O-CD2 3.24Å; G37-F41 PolarHBondContact O-N 2.92Å |
| 38 | A | 98.1 | Very high | 97.1 | Very high | 60 Ų | 60 | 101.4 Ų | 101.4 | 50% | 0.496 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.2 | -41 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113 | L34 L35 I36 Q42 | L34-A38 WeakPolarHBondContact O-CB 3.45Å; L34-A38 PolarHBondContact O-N 3.25Å; L35-A38 PolarHBondContact O-N 2.93Å; I36-A38 PolarHBondContact O-N 3.41Å; A38-Q42 VanDerWaalsContact O-CB 3.24Å; A38-Q42 WeakPolarHBondContact O-CB 3.39Å; A38-Q42 PolarHBondContact O-N 3.33Å |
| 39 | V | 98.2 | Very high | 97.1 | Very high | 78 Ų | 78 | 101.2 Ų | 101.2 | 47% | 0.473 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68 | -42.3 | 175.9 | 172.5 | 0 | 0 | 0 | 0 | 111.4 | L35 I36 G37 Q42 I43 | L35-V39 WeakPolarHBondContact O-CG2 3.31Å; L35-V39 PolarHBondContact O-N 3.21Å; I36-V39 PolarHBondContact O-N 3.01Å; G37-V39 PolarHBondContact O-N 3.24Å; V39-Q42 PolarHBondContact O-N 2.97Å; V39-I43 HydrophobicContact CG1-CD1 3.78Å; V39-I43 VanDerWaalsContact O-CG1 3.3Å; V39-I43 WeakPolarHBondContact O-CG1 3.43Å; V39-I43 PolarHBondContact O-N 3.39Å |
| 40 | I | 97.9 | Very high | 97 | Very high | 89 Ų | 89 | 100.9 Ų | 100.9 | 46% | 0.456 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.5 | -49.8 | 179 | -69.7 | 170.8 | 0 | 0 | 0 | 110.9 | I36 G37 Q42 I43 L44 | I36-I40 HydrophobicContact CG2-CD1 3.7Å; I36-I40 WeakPolarHBondContact O-CG1 3.47Å; I36-I40 PolarHBondContact O-N 3.3Å; G37-I40 PolarHBondContact O-N 3.01Å; I40-Q42 VanDerWaalsContact C-N 3.31Å; I40-Q42 PolarHBondContact O-N 3.3Å; I40-I43 PolarHBondContact O-N 3.03Å; I40-I43 VanDerWaalsContact O-N 3.13Å; I40-L44 HydrophobicContact CG2-CD1 3.77Å; I40-L44 HydrophobicContact CG2-CG 4.39Å; I40-L44 WeakPolarHBondContact O-CG 3.31Å; I40-L44 PolarHBondContact O-N 2.95Å |
| 41 | F | 97.6 | Very high | 97.1 | Very high | 136 Ų | 136 | 99.6 Ų | 99.6 | 60% | 0.596 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.2 | -38.8 | 176.1 | -71.7 | -58.9 | 0 | 0 | 0 | 112.1 | G37 I43 L44 E45 | G37-F41 WeakPolarHBondContact O-CD2 3.24Å; G37-F41 PolarHBondContact O-N 2.92Å; F41-I43 VanDerWaalsContact C-N 3.31Å; F41-I43 PolarHBondContact O-N 2.99Å; F41-L44 PolarHBondContact O-N 3.34Å; F41-E45 WeakPolarHBondContact O-CB 3.44Å; F41-E45 WeakPolarHBondContact O-CG 3.31Å; F41-E45 PolarHBondContact O-N 3.26Å |
| 42 | Q | 97.8 | Very high | 96.9 | Very high | 117 Ų | 117 | 98.8 Ų | 98.8 | 55% | 0.547 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.4 | -33.3 | 175.3 | -177.6 | 175.5 | 64.8 | 0 | 0 | 113 | A38 V39 I40 R46 | A38-Q42 VanDerWaalsContact O-CB 3.24Å; A38-Q42 WeakPolarHBondContact O-CB 3.39Å; A38-Q42 PolarHBondContact O-N 3.33Å; V39-Q42 PolarHBondContact O-N 2.97Å; I40-Q42 VanDerWaalsContact C-N 3.31Å; I40-Q42 PolarHBondContact O-N 3.3Å; Q42-R46 WeakPolarHBondContact O-CB 3.48Å |
| 43 | I | 97.1 | Very high | 96.8 | Very high | 123 Ų | 123 | 102.4 Ų | 102.4 | 63% | 0.631 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -75.1 | -40.7 | 177.8 | -71.2 | 167.7 | 0 | 0 | 0 | 111.1 | V39 I40 F41 | V39-I43 HydrophobicContact CG1-CD1 3.78Å; V39-I43 VanDerWaalsContact O-CG1 3.3Å; V39-I43 WeakPolarHBondContact O-CG1 3.43Å; V39-I43 PolarHBondContact O-N 3.39Å; I40-I43 PolarHBondContact O-N 3.03Å; I40-I43 VanDerWaalsContact O-N 3.13Å; F41-I43 VanDerWaalsContact C-N 3.31Å; F41-I43 PolarHBondContact O-N 2.99Å |
| 44 | L | 96.3 | Very high | 96.7 | Very high | 109 Ų | 109 | 97.8 Ų | 97.8 | 57% | 0.571 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -77.1 | -49.9 | -176.8 | -63.9 | 174.9 | 0 | 0 | 0 | 112.7 | I40 F41 | I40-L44 HydrophobicContact CG2-CD1 3.77Å; I40-L44 HydrophobicContact CG2-CG 4.39Å; I40-L44 WeakPolarHBondContact O-CG 3.31Å; I40-L44 PolarHBondContact O-N 2.95Å; F41-L44 PolarHBondContact O-N 3.34Å |
| 45 | E | 96.8 | Very high | 96.6 | Very high | 111 Ų | 111 | 98.7 Ų | 98.7 | 52% | 0.519 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -85.8 | -24.2 | -167.7 | -58 | -52.2 | 137.5 | 0 | 0 | 113.9 | F41 E47 A48 E49 | F41-E45 WeakPolarHBondContact O-CB 3.44Å; F41-E45 WeakPolarHBondContact O-CG 3.31Å; F41-E45 PolarHBondContact O-N 3.26Å; E45-E47 PolarHBondContact O-N 3.36Å; E45-A48 PolarHBondContact O-N 3.33Å; E45-E49 WeakPolarHBondContact O-CB 3.45Å; E45-E49 PolarHBondContact O-N 2.79Å |
| 46 | R | 96.6 | Very high | 96.4 | Very high | 164 Ų | 164 | 98.3 Ų | 98.3 | 62% | 0.619 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -67.7 | -33 | -171.2 | -173.9 | -179.7 | -173 | -170.8 | 2.1 | 113.7 | Q42 S50 | Q42-R46 WeakPolarHBondContact O-CB 3.48Å; R46-S50 WeakPolarHBondContact O-CB 3.35Å; R46-S50 PolarHBondContact O-N 2.84Å; R46-S50 VanDerWaalsContact O-N 3.14Å |
| 47 | E | 96.4 | Very high | 96.2 | Very high | 140 Ų | 140 | 97.8 Ų | 97.8 | 65% | 0.654 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -72.2 | -40.8 | 174.5 | -172.5 | 170.6 | 166.7 | 0 | 0 | 110.9 | E45 S50 N51 | E45-E47 PolarHBondContact O-N 3.36Å; E47-S50 PolarHBondContact O-N 3.28Å; E47-N51 VanDerWaalsContact O-CB 3.31Å; E47-N51 WeakPolarHBondContact O-CB 3.31Å; E47-N51 PolarHBondContact O-N 3.32Å; E47-N51 PolarHBondContact O-ND2 3.37Å |
| 48 | A | 94 | Very high | 96.1 | Very high | 39 Ų | 39 | 100.8 Ų | 100.8 | 32% | 0.322 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | E45 N51 N52 | E45-A48 PolarHBondContact O-N 3.33Å; A48-N51 PolarHBondContact O-N 2.99Å; A48-N52 VanDerWaalsContact O-CB 3.28Å; A48-N52 WeakPolarHBondContact O-CB 3.46Å; A48-N52 PolarHBondContact O-N 3.14Å; A48-N52 PolarHBondContact O-ND2 3.09Å |
| 49 | E | 96 | Very high | 95.9 | Very high | 108 Ų | 108 | 102.2 Ų | 102.2 | 51% | 0.505 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58 | -51.8 | 174.7 | -178.7 | -89.9 | 135.3 | 0 | 0 | 111.4 | E45 N51 N52 R53 | E45-E49 WeakPolarHBondContact O-CB 3.45Å; E45-E49 PolarHBondContact O-N 2.79Å; E49-N51 PolarHBondContact O-N 2.98Å; E49-N52 PolarHBondContact O-N 3.37Å; E49-R53 WeakPolarHBondContact O-CB 3.21Å; E49-R53 PolarHBondContact O-N 2.83Å |
| 50 | S | 96.2 | Very high | 95.6 | Very high | 48 Ų | 48 | 100.4 Ų | 100.4 | 34% | 0.336 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56.4 | -47.3 | 176.1 | 175.3 | 0 | 0 | 0 | 0 | 112 | R46 E47 R53 N54 | R46-S50 WeakPolarHBondContact O-CB 3.35Å; R46-S50 PolarHBondContact O-N 2.84Å; R46-S50 VanDerWaalsContact O-N 3.14Å; E47-S50 PolarHBondContact O-N 3.28Å; S50-R53 PolarHBondContact O-N 3.37Å; S50-N54 WeakPolarHBondContact O-CB 3.3Å; S50-N54 PolarHBondContact O-N 3.08Å; S50-N54 PolarHBondContact O-ND2 2.87Å; S50-N54 PolarHBondContact OG-ND2 3.28Å |
| 51 | N | 96.3 | Very high | 95.3 | Very high | 85 Ų | 85 | 101.4 Ų | 101.4 | 46% | 0.455 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.7 | -45.9 | -178.5 | -71.7 | -19 | 0 | 0 | 0 | 112 | E47 A48 E49 R53 N54 H55 | E47-N51 VanDerWaalsContact O-CB 3.31Å; E47-N51 WeakPolarHBondContact O-CB 3.31Å; E47-N51 PolarHBondContact O-N 3.32Å; E47-N51 PolarHBondContact O-ND2 3.37Å; A48-N51 PolarHBondContact O-N 2.99Å; E49-N51 PolarHBondContact O-N 2.98Å; N51-R53 PolarHBondContact O-N 2.98Å; N51-N54 PolarHBondContact O-N 3.34Å; N51-H55 WeakPolarHBondContact O-CB 3.32Å; N51-H55 PolarHBondContact O-N 2.84Å |
| 52 | N | 94.5 | Very high | 95.2 | Very high | 109 Ų | 109 | 99.5 Ų | 99.5 | 58% | 0.583 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62.2 | -42.9 | 176.3 | -71.2 | -19.8 | 0 | 0 | 0 | 111.6 | A48 E49 H55 F56 | A48-N52 VanDerWaalsContact O-CB 3.28Å; A48-N52 WeakPolarHBondContact O-CB 3.46Å; A48-N52 PolarHBondContact O-N 3.14Å; A48-N52 PolarHBondContact O-ND2 3.09Å; E49-N52 PolarHBondContact O-N 3.37Å; N52-H55 PolarHBondContact O-N 3.04Å; N52-F56 WeakPolarHBondContact O-CB 3.35Å; N52-F56 PolarHBondContact O-N 3.3Å |
| 53 | R | 94 | Very high | 95 | Very high | 138 Ų | 138 | 98 Ų | 98 | 52% | 0.521 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 175.6 | -177.8 | -173.3 | 173.6 | -73.5 | -3.3 | 111.6 | E49 S50 N51 Q57 | E49-R53 WeakPolarHBondContact O-CB 3.21Å; E49-R53 PolarHBondContact O-N 2.83Å; S50-R53 PolarHBondContact O-N 3.37Å; N51-R53 PolarHBondContact O-N 2.98Å; R53-Q57 WeakPolarHBondContact O-CG 3.41Å; R53-Q57 PolarHBondContact O-N 2.99Å |
| 54 | N | 96.1 | Very high | 94.8 | Very high | 79 Ų | 79 | 94.1 Ų | 94.1 | 42% | 0.422 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -70.6 | -39.1 | -179.8 | -66.5 | -28.1 | 0 | 0 | 0 | 111.8 | S50 N51 Q57 L58 | S50-N54 WeakPolarHBondContact O-CB 3.3Å; S50-N54 PolarHBondContact O-N 3.08Å; S50-N54 PolarHBondContact O-ND2 2.87Å; S50-N54 PolarHBondContact OG-ND2 3.28Å; N51-N54 PolarHBondContact O-N 3.34Å; N54-Q57 PolarHBondContact O-N 3.4Å; N54-L58 WeakPolarHBondContact O-CB 3.39Å; N54-L58 PolarHBondContact O-N 2.87Å |
| 55 | H | 96.1 | Very high | 94.6 | Very high | 109 Ų | 109 | 92.6 Ų | 92.6 | 51% | 0.505 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 173.6 | 178.3 | 42.3 | 0 | 0 | 0 | 111.8 | N51 N52 Q57 L58 E59 | N51-H55 WeakPolarHBondContact O-CB 3.32Å; N51-H55 PolarHBondContact O-N 2.84Å; N52-H55 PolarHBondContact O-N 3.04Å; H55-Q57 VanDerWaalsContact C-N 3.34Å; H55-Q57 PolarHBondContact O-N 3.44Å; H55-L58 PolarHBondContact O-N 2.9Å; H55-L58 VanDerWaalsContact O-N 3.12Å; H55-E59 WeakPolarHBondContact CE1-CG 3.39Å; H55-E59 IonicContact CE1-OE1 3.65Å; H55-E59 IonicContact ND1-OE1 3.89Å; H55-E59 PolarHBondContact O-N 3.16Å |
| 56 | F | 93.5 | Very high | 94.5 | Very high | 107 Ų | 107 | 92.6 Ų | 92.6 | 47% | 0.469 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -58.1 | -42.6 | 176.3 | 173.2 | -104.6 | 0 | 0 | 0 | 112.9 | N52 K60 | N52-F56 WeakPolarHBondContact O-CB 3.35Å; N52-F56 PolarHBondContact O-N 3.3Å; F56-K60 WeakPolarHBondContact O-CB 3.47Å; F56-K60 PolarHBondContact O-N 3.06Å |
| 57 | Q | 93.1 | Very high | 94.3 | Very high | 82 Ų | 82 | 90.2 Ų | 90.2 | 38% | 0.383 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -68.2 | -36.1 | 176.5 | -62.8 | -62.4 | -27.5 | 0 | 0 | 112.1 | R53 N54 H55 L61 | R53-Q57 WeakPolarHBondContact O-CG 3.41Å; R53-Q57 PolarHBondContact O-N 2.99Å; N54-Q57 PolarHBondContact O-N 3.4Å; H55-Q57 VanDerWaalsContact C-N 3.34Å; H55-Q57 PolarHBondContact O-N 3.44Å; Q57-L61 WeakPolarHBondContact O-CG 3.38Å; Q57-L61 PolarHBondContact O-N 3.12Å; Q57-L61 VanDerWaalsContact O-N 3.1Å |
| 58 | L | 95.2 | Very high | 93.8 | Very high | 85 Ų | 85 | 89.9 Ų | 89.9 | 45% | 0.445 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -65.9 | -47.7 | 176.3 | -176.5 | 64.3 | 0 | 0 | 0 | 111.7 | N54 H55 K60 L61 H62 | N54-L58 WeakPolarHBondContact O-CB 3.39Å; N54-L58 PolarHBondContact O-N 2.87Å; H55-L58 PolarHBondContact O-N 2.9Å; H55-L58 VanDerWaalsContact O-N 3.12Å; L58-K60 VanDerWaalsContact C-N 3.31Å; L58-K60 PolarHBondContact O-N 3.46Å; L58-L61 WeakPolarHBondContact O-CB 3.34Å; L58-L61 PolarHBondContact O-N 2.96Å; L58-L61 VanDerWaalsContact O-N 3.1Å; L58-H62 PolarHBondContact O-N 3.17Å |
| 59 | E | 94.4 | Very high | 93.6 | Very high | 90 Ų | 90 | 94 Ų | 94 | 42% | 0.421 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.6 | -38.3 | 176.7 | -68.9 | -51.5 | 124.7 | 0 | 0 | 112 | H55 L61 H62 F63 | H55-E59 WeakPolarHBondContact CE1-CG 3.39Å; H55-E59 IonicContact CE1-OE1 3.65Å; H55-E59 IonicContact ND1-OE1 3.89Å; H55-E59 PolarHBondContact O-N 3.16Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 3.45Å; E59-H62 PolarHBondContact O-N 2.92Å; E59-H62 IonicContact OE1-ND1 3.47Å; E59-H62 PolarHBondContact OE1-ND1 3.13Å; E59-F63 WeakPolarHBondContact O-CB 3.46Å; E59-F63 PolarHBondContact O-N 3.4Å |
| 60 | K | 92.3 | Very high | 93.3 | Very high | 41 Ų | 41 | 91.3 Ų | 91.3 | 18% | 0.178 | 47% | 0.473 | C | S | . | . | H | α-helix | trans | -60.7 | -38.1 | 173.3 | -169.8 | 179 | -176.1 | 177.3 | 0 | 112.4 | F56 L58 L64 L75 E76 | F56-K60 WeakPolarHBondContact O-CB 3.47Å; F56-K60 PolarHBondContact O-N 3.06Å; L58-K60 VanDerWaalsContact C-N 3.31Å; L58-K60 PolarHBondContact O-N 3.46Å; K60-L64 WeakPolarHBondContact O-CG 3.48Å; K60-L64 PolarHBondContact O-N 2.87Å; K60-L75 HydrophobicContact CG-CD2 3.76Å; K60-E76 IonicContact NZ-OE2 2.61Å; K60-E76 PolarHBondContact NZ-OE2 3.21Å |
| 61 | L | 91.9 | Very high | 93 | Very high | 109 Ų | 109 | 93.4 Ų | 93.4 | 57% | 0.571 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -72.9 | -41.4 | 175.4 | -70.8 | 170 | 0 | 0 | 0 | 112.2 | Q57 L58 E59 F63 L64 A65 | Q57-L61 WeakPolarHBondContact O-CG 3.38Å; Q57-L61 PolarHBondContact O-N 3.12Å; Q57-L61 VanDerWaalsContact O-N 3.1Å; L58-L61 WeakPolarHBondContact O-CB 3.34Å; L58-L61 PolarHBondContact O-N 2.96Å; L58-L61 VanDerWaalsContact O-N 3.1Å; E59-L61 VanDerWaalsContact C-N 3.3Å; E59-L61 PolarHBondContact O-N 3.45Å; L61-F63 VanDerWaalsContact C-N 3.31Å; L61-F63 PolarHBondContact O-N 3.06Å; L61-L64 PolarHBondContact O-N 2.94Å; L61-A65 WeakPolarHBondContact O-CB 3.48Å; L61-A65 PolarHBondContact O-N 3.3Å |
| 62 | H | 94.7 | Very high | 92.6 | Very high | 96 Ų | 96 | 91 Ų | 91 | 44% | 0.444 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -59.1 | -41.9 | 172.5 | -70.9 | 163.1 | 0 | 0 | 0 | 111.7 | L58 E59 A65 N66 | L58-H62 PolarHBondContact O-N 3.17Å; E59-H62 PolarHBondContact O-N 2.92Å; E59-H62 IonicContact OE1-ND1 3.47Å; E59-H62 PolarHBondContact OE1-ND1 3.13Å; H62-A65 PolarHBondContact O-N 3.31Å; H62-N66 WeakPolarHBondContact O-CB 3.49Å; H62-N66 PolarHBondContact O-N 3.02Å |
| 63 | F | 93.6 | Very high | 92.5 | Very high | 87 Ų | 87 | 90.2 Ų | 90.2 | 38% | 0.382 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.3 | -47 | 177.9 | -165.8 | -93.9 | 0 | 0 | 0 | 111.9 | E59 L61 A65 N66 Y67 L70 L75 | E59-F63 WeakPolarHBondContact O-CB 3.46Å; E59-F63 PolarHBondContact O-N 3.4Å; L61-F63 VanDerWaalsContact C-N 3.31Å; L61-F63 PolarHBondContact O-N 3.06Å; F63-A65 PolarHBondContact O-N 3.22Å; F63-N66 PolarHBondContact O-N 2.92Å; F63-Y67 HydrophobicContact CD1-CD2 4.05Å; F63-Y67 AromaticContact CD2-CD2 3.88Å; F63-Y67 HydrophobicContact CD2-CD2 3.88Å; F63-Y67 AromaticContact CD2-CE2 3.84Å; F63-Y67 HydrophobicContact CD2-CE2 3.84Å; F63-Y67 AromaticContact CE1-CD2 3.89Å; F63-Y67 HydrophobicContact CE1-CD2 3.89Å; F63-Y67 HydrophobicContact CE1-CE2 4.47Å; F63-Y67 AromaticContact CE2-CD2 3.71Å; F63-Y67 HydrophobicContact CE2-CD2 3.71Å; F63-Y67 AromaticContact CE2-CE2 3.49Å; F63-Y67 HydrophobicContact CE2-CE2 3.49Å; F63-Y67 VanDerWaalsContact CE2-CE2 3.49Å; F63-Y67 HydrophobicContact CG-CD2 4.05Å; F63-Y67 HydrophobicContact CG-CE2 4.47Å; F63-Y67 AromaticContact CZ-CD2 3.71Å; F63-Y67 HydrophobicContact CZ-CD2 3.71Å; F63-Y67 AromaticContact CZ-CE2 3.85Å; F63-Y67 HydrophobicContact CZ-CE2 3.85Å; F63-Y67 WeakPolarHBondContact O-CD2 3.31Å; F63-Y67 PolarHBondContact O-N 2.98Å; F63-L70 HydrophobicContact CD1-CD2 4.15Å; F63-L70 HydrophobicContact CE1-CD2 3.67Å; F63-L75 HydrophobicContact CD1-CD1 4.02Å; F63-L75 HydrophobicContact CD1-CD2 4.06Å; F63-L75 HydrophobicContact CE1-CD1 4.04Å |
| 64 | L | 92.3 | Very high | 92.4 | Very high | 41 Ų | 41 | 85.6 Ų | 85.6 | 22% | 0.215 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -64.1 | -36.9 | 175.1 | -71.5 | 170.6 | 0 | 0 | 0 | 112.7 | K60 L61 Y67 L70 L75 | K60-L64 WeakPolarHBondContact O-CG 3.48Å; K60-L64 PolarHBondContact O-N 2.87Å; L61-L64 PolarHBondContact O-N 2.94Å; L64-Y67 CarbonylContact O-C 3.57Å; L64-L70 WeakPolarHBondContact CD2-O 3.28Å; L64-L75 HydrophobicContact CD1-CD2 4.08Å; L64-L75 HydrophobicContact CD2-CB 4.04Å; L64-L75 HydrophobicContact CD2-CD2 3.66Å; L64-L75 HydrophobicContact CG-CD2 3.6Å |
| 65 | A | 92.2 | Very high | 92.2 | Very high | 77 Ų | 77 | 82.3 Ų | 82.3 | 64% | 0.636 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -67.7 | -34.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L61 H62 F63 | L61-A65 WeakPolarHBondContact O-CB 3.48Å; L61-A65 PolarHBondContact O-N 3.3Å; H62-A65 PolarHBondContact O-N 3.31Å; F63-A65 PolarHBondContact O-N 3.22Å |
| 66 | N | 95.1 | Very high | 92 | Very high | 111 Ų | 111 | 80.5 Ų | 80.5 | 59% | 0.594 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -78.6 | -33.3 | 178.1 | -169.8 | 64.2 | 0 | 0 | 0 | 112.8 | H62 F63 | H62-N66 WeakPolarHBondContact O-CB 3.49Å; H62-N66 PolarHBondContact O-N 3.02Å; F63-N66 PolarHBondContact O-N 2.92Å |
| 67 | Y | 92.1 | Very high | 92 | Very high | 114 Ų | 114 | 82.4 Ų | 82.4 | 45% | 0.447 | 45% | 0.45 | S | S | . | . | trans | -111.8 | 71.2 | -177.5 | -64.4 | -70.2 | 0 | 0 | 0 | 111.9 | F63 L64 C69 L70 | F63-Y67 HydrophobicContact CD1-CD2 4.05Å; F63-Y67 AromaticContact CD2-CD2 3.88Å; F63-Y67 HydrophobicContact CD2-CD2 3.88Å; F63-Y67 AromaticContact CD2-CE2 3.84Å; F63-Y67 HydrophobicContact CD2-CE2 3.84Å; F63-Y67 AromaticContact CE1-CD2 3.89Å; F63-Y67 HydrophobicContact CE1-CD2 3.89Å; F63-Y67 HydrophobicContact CE1-CE2 4.47Å; F63-Y67 AromaticContact CE2-CD2 3.71Å; F63-Y67 HydrophobicContact CE2-CD2 3.71Å; F63-Y67 AromaticContact CE2-CE2 3.49Å; F63-Y67 HydrophobicContact CE2-CE2 3.49Å; F63-Y67 VanDerWaalsContact CE2-CE2 3.49Å; F63-Y67 HydrophobicContact CG-CD2 4.05Å; F63-Y67 HydrophobicContact CG-CE2 4.47Å; F63-Y67 AromaticContact CZ-CD2 3.71Å; F63-Y67 HydrophobicContact CZ-CD2 3.71Å; F63-Y67 AromaticContact CZ-CE2 3.85Å; F63-Y67 HydrophobicContact CZ-CE2 3.85Å; F63-Y67 WeakPolarHBondContact O-CD2 3.31Å; F63-Y67 PolarHBondContact O-N 2.98Å; L64-Y67 CarbonylContact O-C 3.57Å; Y67-C69 PolarHBondContact O-N 3.15Å; Y67-L70 WeakPolarHBondContact O-CB 3.49Å; Y67-L70 PolarHBondContact O-N 3.14Å | ||
| 68 | T | 87.4 | Confident | 92 | Very high | 133 Ų | 133 | 84.3 Ų | 84.3 | 82% | 0.816 | 46% | 0.457 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -9.7 | -176.6 | 57.8 | 0 | 0 | 0 | 0 | 115.8 | ||
| 69 | C | 89.3 | Confident | 91.8 | Very high | 124 Ų | 124 | 81.7 Ų | 81.7 | 84% | 0.838 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | -7 | 171.6 | 58.8 | 0 | 0 | 0 | 0 | 114.1 | Y67 | Y67-C69 PolarHBondContact O-N 3.15Š|
| 70 | L | 90.1 | Very high | 91.8 | Very high | 53 Ų | 53 | 82.5 Ų | 82.5 | 28% | 0.277 | 45% | 0.448 | S | S | . | . | S | Bend | trans | -109.7 | 123.5 | 179.7 | -171.8 | 71.2 | 0 | 0 | 0 | 109.8 | F63 L64 Y67 A74 L75 | F63-L70 HydrophobicContact CD1-CD2 4.15Å; F63-L70 HydrophobicContact CE1-CD2 3.67Å; L64-L70 WeakPolarHBondContact CD2-O 3.28Å; Y67-L70 WeakPolarHBondContact O-CB 3.49Å; Y67-L70 PolarHBondContact O-N 3.14Å; L70-A74 HydrophobicContact CD1-CB 3.58Å; L70-A74 HydrophobicContact CG-CB 4.45Å; L70-L75 HydrophobicContact CD2-CB 3.83Å; L70-L75 HydrophobicContact CD2-CD1 4Å; L70-L75 HydrophobicContact CD2-CG 4.36Å; L70-L75 HydrophobicContact CG-CB 4.22Å |
| 71 | D | 88.6 | Confident | 91.8 | Very high | 92 Ų | 92 | 84.8 Ų | 84.8 | 49% | 0.492 | 47% | 0.465 | S | S | . | . | trans | -88.7 | 163.3 | 174.1 | 75.3 | -7.4 | 0 | 0 | 0 | 112.1 | A74 L75 | D71-A74 PolarHBondContact O-N 2.94Å; D71-A74 WeakPolarHBondContact OD1-CB 3.45Å; D71-A74 PolarHBondContact OD1-N 2.95Å; D71-L75 PolarHBondContact O-N 3.01Å | ||
| 72 | G | 88.6 | Confident | 91.8 | Very high | 33 Ų | 33 | 82.4 Ų | 82.4 | 34% | 0.34 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -53.4 | -46.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | L75 E76 | G72-L75 PolarHBondContact O-N 3.27Å; G72-E76 WeakPolarHBondContact O-CB 3.42Å; G72-E76 PolarHBondContact O-N 3.38Å |
| 73 | P | 92.4 | Very high | 91.6 | Very high | 94 Ų | 94 | 82.3 Ų | 82.3 | 61% | 0.61 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -57.9 | -42.6 | 174.2 | -29 | 36.4 | 0 | 0 | 0 | 115.2 | E76 K77 | P73-E76 PolarHBondContact O-N 2.9Å; P73-K77 WeakPolarHBondContact O-CB 3.49Å; P73-K77 PolarHBondContact O-N 3.19Å |
| 74 | A | 91.3 | Very high | 91.4 | Very high | 40 Ų | 40 | 85 Ų | 85 | 33% | 0.331 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -68.4 | -40.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | L70 D71 K77 F78 | L70-A74 HydrophobicContact CD1-CB 3.58Å; L70-A74 HydrophobicContact CG-CB 4.45Å; D71-A74 PolarHBondContact O-N 2.94Å; D71-A74 WeakPolarHBondContact OD1-CB 3.45Å; D71-A74 PolarHBondContact OD1-N 2.95Å; A74-K77 PolarHBondContact O-N 2.94Å; A74-F78 PolarHBondContact O-N 2.71Å |
| 75 | L | 92.9 | Very high | 91.2 | Very high | 11 Ų | 11 | 84.3 Ų | 84.3 | 6% | 0.058 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 173.7 | -179.6 | 57 | 0 | 0 | 0 | 111.7 | K60 F63 L64 L70 D71 G72 K77 F78 V79 | K60-L75 HydrophobicContact CG-CD2 3.76Å; F63-L75 HydrophobicContact CD1-CD1 4.02Å; F63-L75 HydrophobicContact CD1-CD2 4.06Å; F63-L75 HydrophobicContact CE1-CD1 4.04Å; L64-L75 HydrophobicContact CD1-CD2 4.08Å; L64-L75 HydrophobicContact CD2-CB 4.04Å; L64-L75 HydrophobicContact CD2-CD2 3.66Å; L64-L75 HydrophobicContact CG-CD2 3.6Å; L70-L75 HydrophobicContact CD2-CB 3.83Å; L70-L75 HydrophobicContact CD2-CD1 4Å; L70-L75 HydrophobicContact CD2-CG 4.36Å; L70-L75 HydrophobicContact CG-CB 4.22Å; D71-L75 PolarHBondContact O-N 3.01Å; G72-L75 PolarHBondContact O-N 3.27Å; L75-K77 VanDerWaalsContact C-N 3.35Å; L75-K77 PolarHBondContact O-N 3.36Å; L75-F78 PolarHBondContact O-N 3.46Å; L75-F78 VanDerWaalsContact O-N 3.16Å; L75-V79 HydrophobicContact CD1-CG2 4.34Å; L75-V79 WeakPolarHBondContact O-CG2 3.25Å; L75-V79 PolarHBondContact O-N 3.47Å |
| 76 | E | 91.8 | Very high | 90.9 | Very high | 70 Ų | 70 | 88.4 Ų | 88.4 | 33% | 0.327 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -60.3 | -44.7 | 177.3 | -173.7 | 59.6 | -147.8 | 0 | 0 | 111.4 | K60 G72 P73 F78 V79 Q80 | K60-E76 IonicContact NZ-OE2 2.61Å; K60-E76 PolarHBondContact NZ-OE2 3.21Å; G72-E76 WeakPolarHBondContact O-CB 3.42Å; G72-E76 PolarHBondContact O-N 3.38Å; P73-E76 PolarHBondContact O-N 2.9Å; E76-F78 VanDerWaalsContact C-N 3.3Å; E76-F78 PolarHBondContact O-N 3Å; E76-V79 PolarHBondContact O-N 2.94Å; E76-Q80 VanDerWaalsContact O-CG 3.32Å; E76-Q80 WeakPolarHBondContact O-CG 3.24Å; E76-Q80 PolarHBondContact O-N 2.96Å; E76-Q80 PolarHBondContact OE1-NE2 2.89Å |
| 77 | K | 93.5 | Very high | 90.4 | Very high | 147 Ų | 147 | 89.3 Ų | 89.3 | 64% | 0.639 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -61.5 | -37.1 | 174.6 | -176.6 | 178.1 | 177.1 | -178.5 | 0 | 112.5 | P73 A74 L75 Q80 V81 | P73-K77 WeakPolarHBondContact O-CB 3.49Å; P73-K77 PolarHBondContact O-N 3.19Å; A74-K77 PolarHBondContact O-N 2.94Å; L75-K77 VanDerWaalsContact C-N 3.35Å; L75-K77 PolarHBondContact O-N 3.36Å; K77-Q80 PolarHBondContact O-N 3.01Å; K77-V81 WeakPolarHBondContact O-CG2 3.34Å; K77-V81 PolarHBondContact O-N 3.5Å; K77-V81 VanDerWaalsContact O-N 3.12Å |
| 78 | F | 91.8 | Very high | 90 | Very high | 122 Ų | 122 | 87.9 Ų | 87.9 | 54% | 0.535 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.5 | -43.2 | 176.2 | -178 | -118.8 | 0 | 0 | 0 | 112 | A74 L75 E76 Q80 V81 I82 | A74-F78 PolarHBondContact O-N 2.71Å; L75-F78 PolarHBondContact O-N 3.46Å; L75-F78 VanDerWaalsContact O-N 3.16Å; E76-F78 VanDerWaalsContact C-N 3.3Å; E76-F78 PolarHBondContact O-N 3Å; F78-Q80 VanDerWaalsContact C-N 3.32Å; F78-Q80 PolarHBondContact O-N 3.06Å; F78-V81 PolarHBondContact O-N 3.4Å; F78-I82 HydrophobicContact CD1-CD1 3.97Å; F78-I82 HydrophobicContact CE1-CD1 3.55Å; F78-I82 HydrophobicContact CE2-CD1 4.28Å; F78-I82 HydrophobicContact CZ-CD1 3.72Å; F78-I82 HydrophobicContact CZ-CG1 4.43Å; F78-I82 PolarHBondContact O-N 3.38Å |
| 79 | V | 92.6 | Very high | 89.6 | Confident | 30 Ų | 30 | 82.4 Ų | 82.4 | 18% | 0.182 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -59.4 | -42.1 | 172.8 | 172 | 0 | 0 | 0 | 0 | 111 | L75 E76 V81 I82 L83 | L75-V79 HydrophobicContact CD1-CG2 4.34Å; L75-V79 WeakPolarHBondContact O-CG2 3.25Å; L75-V79 PolarHBondContact O-N 3.47Å; E76-V79 PolarHBondContact O-N 2.94Å; V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 2.99Å; V79-I82 PolarHBondContact O-N 3.5Å; V79-L83 HydrophobicContact CG1-CD1 3.85Å; V79-L83 HydrophobicContact CG1-CG 4.23Å; V79-L83 WeakPolarHBondContact O-CG 3.38Å; V79-L83 PolarHBondContact O-N 3.01Å |
| 80 | Q | 93.6 | Very high | 89.3 | Confident | 108 Ų | 108 | 80.5 Ų | 80.5 | 51% | 0.505 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.4 | -37.1 | 175.7 | -72.6 | 171.2 | 9.6 | 0 | 0 | 113.1 | E76 K77 F78 Y84 | E76-Q80 VanDerWaalsContact O-CG 3.32Å; E76-Q80 WeakPolarHBondContact O-CG 3.24Å; E76-Q80 PolarHBondContact O-N 2.96Å; E76-Q80 PolarHBondContact OE1-NE2 2.89Å; K77-Q80 PolarHBondContact O-N 3.01Å; F78-Q80 VanDerWaalsContact C-N 3.32Å; F78-Q80 PolarHBondContact O-N 3.06Å; Q80-Y84 VanDerWaalsContact O-CB 3.28Å; Q80-Y84 WeakPolarHBondContact O-CB 3.33Å; Q80-Y84 PolarHBondContact O-N 3.4Å |
| 81 | V | 92.6 | Very high | 88.8 | Confident | 88 Ų | 88 | 80.1 Ų | 80.1 | 53% | 0.533 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -66.3 | -40.2 | 173.8 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | K77 F78 V79 A85 | K77-V81 WeakPolarHBondContact O-CG2 3.34Å; K77-V81 PolarHBondContact O-N 3.5Å; K77-V81 VanDerWaalsContact O-N 3.12Å; F78-V81 PolarHBondContact O-N 3.4Å; V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 2.99Å; V81-A85 WeakPolarHBondContact O-CB 3.48Å; V81-A85 PolarHBondContact O-N 2.83Å |
| 82 | I | 91.7 | Very high | 88.3 | Confident | 59 Ų | 59 | 78.6 Ų | 78.6 | 30% | 0.303 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.5 | -47.9 | 175.7 | -72 | 170.7 | 0 | 0 | 0 | 111.3 | F78 V79 A85 W86 P92 | F78-I82 HydrophobicContact CD1-CD1 3.97Å; F78-I82 HydrophobicContact CE1-CD1 3.55Å; F78-I82 HydrophobicContact CE2-CD1 4.28Å; F78-I82 HydrophobicContact CZ-CD1 3.72Å; F78-I82 HydrophobicContact CZ-CG1 4.43Å; F78-I82 PolarHBondContact O-N 3.38Å; V79-I82 PolarHBondContact O-N 3.5Å; I82-A85 WeakPolarHBondContact O-CB 3.47Å; I82-A85 PolarHBondContact O-N 3.39Å; I82-W86 PolarHBondContact O-N 3.46Å; I82-P92 HydrophobicContact CG1-CB 4.49Å; I82-P92 HydrophobicContact CG2-CB 3.94Å; I82-P92 HydrophobicContact CG2-CG 3.91Å |
| 83 | L | 90.8 | Very high | 87.7 | Confident | 94 Ų | 94 | 82 Ų | 82 | 49% | 0.492 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.3 | -44.2 | 178.4 | -69.8 | 172.8 | 0 | 0 | 0 | 111.3 | V79 A85 W86 E87 | V79-L83 HydrophobicContact CG1-CD1 3.85Å; V79-L83 HydrophobicContact CG1-CG 4.23Å; V79-L83 WeakPolarHBondContact O-CG 3.38Å; V79-L83 PolarHBondContact O-N 3.01Å; L83-A85 VanDerWaalsContact C-N 3.33Å; L83-A85 PolarHBondContact O-N 3.26Å; L83-W86 WeakPolarHBondContact O-CB 3.4Å; L83-W86 PolarHBondContact O-N 3.38Å; L83-E87 WeakPolarHBondContact O-CG 3.32Å; L83-E87 PolarHBondContact O-N 3.2Å |
| 84 | Y | 89.9 | Confident | 86.4 | Confident | 145 Ų | 145 | 78.9 Ų | 78.9 | 57% | 0.569 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -61.1 | -39.5 | 174.6 | 178.1 | -97.3 | 0 | 0 | 0 | 112.4 | Q80 K88 | Q80-Y84 VanDerWaalsContact O-CB 3.28Å; Q80-Y84 WeakPolarHBondContact O-CB 3.33Å; Q80-Y84 PolarHBondContact O-N 3.4Å; Y84-K88 HydrophobicContact CE1-CG 4.18Å; Y84-K88 VanDerWaalsContact CE2-CE 3.48Å; Y84-K88 HydrophobicContact CE2-CG 4.36Å; Y84-K88 WeakPolarHBondContact O-CG 3.47Å; Y84-K88 PolarHBondContact O-N 3.35Å |
| 85 | A | 87.6 | Confident | 85.2 | Confident | 25 Ų | 25 | 82 Ų | 82 | 21% | 0.207 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -63.3 | -44.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | V81 I82 L83 K88 G89 V90 | V81-A85 WeakPolarHBondContact O-CB 3.48Å; V81-A85 PolarHBondContact O-N 2.83Å; I82-A85 WeakPolarHBondContact O-CB 3.47Å; I82-A85 PolarHBondContact O-N 3.39Å; L83-A85 VanDerWaalsContact C-N 3.33Å; L83-A85 PolarHBondContact O-N 3.26Å; A85-K88 CarbonylContact O-C 3.55Å; A85-K88 PolarHBondContact O-N 3.45Å; A85-K88 VanDerWaalsContact O-N 3.11Å; A85-G89 PolarHBondContact O-N 2.87Å; A85-V90 CarbonylContact C-O 3.48Å; A85-V90 HydrophobicContact CB-CB 4.23Å; A85-V90 WeakPolarHBondContact O-CB 3.42Å; A85-V90 PolarHBondContact O-N 3.47Å |
| 86 | W | 85.1 | Confident | 83.8 | Confident | 164 Ų | 164 | 87.6 Ų | 87.6 | 62% | 0.621 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -61.4 | -45.5 | 176.5 | -173.2 | -97.5 | 0 | 0 | 0 | 112.3 | I82 L83 K88 G89 P92 | I82-W86 PolarHBondContact O-N 3.46Å; L83-W86 WeakPolarHBondContact O-CB 3.4Å; L83-W86 PolarHBondContact O-N 3.38Å; W86-K88 PolarHBondContact O-N 3.07Å; W86-K88 VanDerWaalsContact O-N 3.14Å; W86-G89 PolarHBondContact O-N 3.21Å; W86-P92 HydrophobicContact CE3-CG 4.4Å |
| 87 | E | 85.3 | Confident | 82.6 | Confident | 130 Ų | 130 | 89.7 Ų | 89.7 | 61% | 0.607 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -59.5 | -21.8 | 173.7 | -75.2 | 179.6 | -172.6 | 0 | 0 | 113.9 | L83 | L83-E87 WeakPolarHBondContact O-CG 3.32Å; L83-E87 PolarHBondContact O-N 3.2Å |
| 88 | K | 83.6 | Confident | 81.5 | Confident | 84 Ų | 84 | 85.3 Ų | 85.3 | 37% | 0.365 | 46% | 0.463 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.4 | 9 | 173.6 | -58.4 | -54.7 | 167.9 | -149.8 | 0 | 113.6 | Y84 A85 W86 S126 | Y84-K88 HydrophobicContact CE1-CG 4.18Å; Y84-K88 VanDerWaalsContact CE2-CE 3.48Å; Y84-K88 HydrophobicContact CE2-CG 4.36Å; Y84-K88 WeakPolarHBondContact O-CG 3.47Å; Y84-K88 PolarHBondContact O-N 3.35Å; A85-K88 CarbonylContact O-C 3.55Å; A85-K88 PolarHBondContact O-N 3.45Å; A85-K88 VanDerWaalsContact O-N 3.11Å; W86-K88 PolarHBondContact O-N 3.07Å; W86-K88 VanDerWaalsContact O-N 3.14Å; K88-S126 WeakPolarHBondContact CD-OG 3.23Å |
| 89 | G | 78.9 | Confident | 80.5 | Confident | 18 Ų | 18 | 84.9 Ų | 84.9 | 19% | 0.186 | 47% | 0.472 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 73.7 | 25.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A85 W86 N101 | A85-G89 PolarHBondContact O-N 2.87Å; W86-G89 PolarHBondContact O-N 3.21Å; G89-N101 PolarHBondContact O-ND2 3.14Å |
| 90 | V | 82.9 | Confident | 80 | Confident | 84 Ų | 84 | 86.9 Ų | 86.9 | 51% | 0.509 | 49% | 0.488 | S | S | . | . | trans | -103 | 119.3 | 174.6 | -176.4 | 0 | 0 | 0 | 0 | 108.9 | A85 P92 | A85-V90 CarbonylContact C-O 3.48Å; A85-V90 HydrophobicContact CB-CB 4.23Å; A85-V90 WeakPolarHBondContact O-CB 3.42Å; A85-V90 PolarHBondContact O-N 3.47Å; V90-P92 WeakPolarHBondContact O-CD 3.32Å | ||
| 91 | N | 78.8 | Confident | 79.5 | Confident | 44 Ų | 44 | 84.3 Ų | 84.3 | 24% | 0.235 | 48% | 0.477 | C | S | . | . | trans | -77.2 | 115.7 | 179 | -173.4 | -31.2 | 0 | 0 | 0 | 110.1 | S93 G94 | N91-S93 VanDerWaalsContact C-N 3.28Å; N91-S93 PolarHBondContact O-N 2.88Å; N91-S93 WeakPolarHBondContact OD1-CB 3.35Å; N91-S93 PolarHBondContact OD1-N 3.3Å; N91-G94 PolarHBondContact O-N 2.97Å; N91-G94 VanDerWaalsContact O-N 3.14Å | ||
| 92 | P | 79.6 | Confident | 79.4 | Confident | 61 Ų | 61 | 85.2 Ų | 85.2 | 40% | 0.396 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.5 | -17.9 | -175.1 | 32.7 | -38.6 | 0 | 0 | 0 | 113.5 | I82 W86 V90 G94 | I82-P92 HydrophobicContact CG1-CB 4.49Å; I82-P92 HydrophobicContact CG2-CB 3.94Å; I82-P92 HydrophobicContact CG2-CG 3.91Å; W86-P92 HydrophobicContact CE3-CG 4.4Å; V90-P92 WeakPolarHBondContact O-CD 3.32Å; P92-G94 VanDerWaalsContact C-N 3.29Å |
| 93 | S | 74.7 | Confident | 79.4 | Confident | 105 Ų | 105 | 85.1 Ų | 85.1 | 73% | 0.734 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.1 | -3.3 | 173.7 | -53.2 | 0 | 0 | 0 | 0 | 112.5 | N91 | N91-S93 VanDerWaalsContact C-N 3.28Å; N91-S93 PolarHBondContact O-N 2.88Å; N91-S93 WeakPolarHBondContact OD1-CB 3.35Å; N91-S93 PolarHBondContact OD1-N 3.3Å |
| 94 | G | 65.4 | Low | 79.5 | Confident | 28 Ų | 28 | 88.1 Ų | 88.1 | 29% | 0.289 | 48% | 0.481 | S | S | . | . | S | Bend | trans | -84.2 | 154.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | N91 P92 N98 | N91-G94 PolarHBondContact O-N 2.97Å; N91-G94 VanDerWaalsContact O-N 3.14Å; P92-G94 VanDerWaalsContact C-N 3.29Å; G94-N98 WeakPolarHBondContact CA-ND2 3.46Å |
| 95 | N | 66.9 | Low | 79.6 | Confident | 106 Ų | 106 | 81.6 Ų | 81.6 | 57% | 0.567 | 46% | 0.456 | S | S | * | . | trans | -89 | 162.6 | 169.8 | -169.3 | 17 | 0 | 0 | 0 | 110.5 | T97 N98 | N95-T97 PolarHBondContact ND2-OG1 3.12Å; N95-T97 PolarHBondContact O-N 3.27Å; N95-N98 PolarHBondContact N-OD1 2.92Å; N95-N98 WeakPolarHBondContact O-CB 3.32Å; N95-N98 VanDerWaalsContact O-CG 3.27Å; N95-N98 PolarHBondContact O-N 3.48Å; N95-N98 PolarHBondContact O-OD1 3.26Å; N95-N98 VanDerWaalsContact O-OD1 3.13Å | ||
| 96 | S | 63.4 | Low | 79.8 | Confident | 127 Ų | 127 | 80.7 Ų | 80.7 | 89% | 0.888 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -7.9 | 176.3 | -53.1 | 0 | 0 | 0 | 0 | 114.6 | ||
| 97 | T | 67.1 | Low | 80.3 | Confident | 114 Ų | 114 | 74.8 Ų | 74.8 | 70% | 0.699 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.9 | -5.4 | 177.1 | 51.3 | 0 | 0 | 0 | 0 | 113.9 | N95 | N95-T97 PolarHBondContact ND2-OG1 3.12Å; N95-T97 PolarHBondContact O-N 3.27Å |
| 98 | N | 68.4 | Low | 80.8 | Confident | 55 Ų | 55 | 72.2 Ų | 72.2 | 29% | 0.294 | 42% | 0.419 | S | S | . | . | S | Bend | trans | -64.6 | 147.5 | -175.5 | -74.8 | 24.9 | 0 | 0 | 0 | 112.3 | G94 N95 P234 | G94-N98 WeakPolarHBondContact CA-ND2 3.46Å; N95-N98 PolarHBondContact N-OD1 2.92Å; N95-N98 WeakPolarHBondContact O-CB 3.32Å; N95-N98 VanDerWaalsContact O-CG 3.27Å; N95-N98 PolarHBondContact O-N 3.48Å; N95-N98 PolarHBondContact O-OD1 3.26Å; N95-N98 VanDerWaalsContact O-OD1 3.13Å; N98-P234 WeakPolarHBondContact ND2-CB 3.48Å |
| 99 | P | 71.4 | Confident | 81.4 | Confident | 113 Ų | 113 | 68.7 Ų | 68.7 | 73% | 0.734 | 40% | 0.404 | S | S | * | . | P | Polyproline II helix | trans | -63.2 | 148 | 177.6 | 27.1 | -34.9 | 0 | 0 | 0 | 111.8 | N101 | P99-N101 PolarHBondContact O-N 3.16Š|
| 100 | S | 81.9 | Confident | 82.2 | Confident | 73 Ų | 73 | 69.5 Ų | 69.5 | 51% | 0.51 | 40% | 0.402 | S | S | . | . | P | Polyproline II helix | trans | -65.6 | 129.9 | 177.8 | -179.7 | 0 | 0 | 0 | 0 | 111.4 | W102 D103 | S100-W102 PolarHBondContact O-N 3.28Å; S100-W102 VanDerWaalsContact O-N 3.09Å; S100-W102 PolarHBondContact OG-N 3.42Å; S100-W102 VanDerWaalsContact OG-N 3.07Å; S100-D103 PolarHBondContact O-N 2.88Å |
| 101 | N | 84.1 | Confident | 82.9 | Confident | 53 Ų | 53 | 66.7 Ų | 66.7 | 28% | 0.283 | 39% | 0.388 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -7.8 | 168.5 | -80.5 | -41.5 | 0 | 0 | 0 | 113.6 | G89 P99 S106 L123 R243 | G89-N101 PolarHBondContact O-ND2 3.14Å; P99-N101 PolarHBondContact O-N 3.16Å; N101-S106 WeakPolarHBondContact O-CB 3.33Å; N101-L123 HydrophobicContact CB-CD1 3.98Å; N101-L123 VanDerWaalsContact O-CD2 3.29Å; N101-L123 WeakPolarHBondContact O-CD2 3.46Å; N101-R243 PolarHBondContact OD1-NH1 3.39Å |
| 102 | W | 91 | Very high | 83.7 | Confident | 108 Ų | 108 | 65.3 Ų | 65.3 | 41% | 0.409 | 38% | 0.384 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.9 | 34 | 170.9 | -64.8 | 103.4 | 0 | 0 | 0 | 112.2 | S100 F110 L123 | S100-W102 PolarHBondContact O-N 3.28Å; S100-W102 VanDerWaalsContact O-N 3.09Å; S100-W102 PolarHBondContact OG-N 3.42Å; S100-W102 VanDerWaalsContact OG-N 3.07Å; W102-F110 AromaticContact CH2-CD1 3.89Å; W102-F110 HydrophobicContact CH2-CD1 3.89Å; W102-F110 HydrophobicContact CH2-CD2 4.09Å; W102-F110 AromaticContact CH2-CE1 3.97Å; W102-F110 HydrophobicContact CH2-CE1 3.97Å; W102-F110 HydrophobicContact CH2-CE2 4.16Å; W102-F110 AromaticContact CH2-CG 3.97Å; W102-F110 HydrophobicContact CH2-CG 3.97Å; W102-F110 HydrophobicContact CH2-CZ 4.12Å; W102-F110 HydrophobicContact CZ3-CB 4.38Å; W102-F110 AromaticContact CZ3-CD1 3.71Å; W102-F110 HydrophobicContact CZ3-CD1 3.71Å; W102-F110 HydrophobicContact CZ3-CD2 4.48Å; W102-F110 HydrophobicContact CZ3-CE1 4.15Å; W102-F110 AromaticContact CZ3-CG 3.91Å; W102-F110 HydrophobicContact CZ3-CG 3.91Å; W102-L123 HydrophobicContact CD2-CD1 4.49Å; W102-L123 HydrophobicContact CD2-CD2 4.27Å; W102-L123 HydrophobicContact CE3-CD2 4.31Å; W102-L123 HydrophobicContact CH2-CD2 4.03Å; W102-L123 HydrophobicContact CH2-CG 3.95Å; W102-L123 HydrophobicContact CZ2-CD1 3.73Å; W102-L123 HydrophobicContact CZ2-CD2 3.98Å; W102-L123 HydrophobicContact CZ2-CG 3.57Å; W102-L123 HydrophobicContact CZ3-CD2 4.2Å |
| 103 | D | 90.7 | Very high | 84.5 | Confident | 56 Ų | 56 | 62.7 Ų | 62.7 | 30% | 0.299 | 37% | 0.367 | S | S | . | . | S | Bend | trans | -65 | 171.7 | 161.1 | 96.7 | -68.1 | 0 | 0 | 0 | 111 | S100 S105 S106 S107 | S100-D103 PolarHBondContact O-N 2.88Å; D103-S105 VanDerWaalsContact C-N 3.33Å; D103-S105 PolarHBondContact O-N 2.86Å; D103-S105 WeakPolarHBondContact OD2-CB 3.38Å; D103-S105 PolarHBondContact OD2-N 3.22Å; D103-S106 WeakPolarHBondContact OD1-CB 3.19Å; D103-S106 PolarHBondContact OD1-N 2.86Å; D103-S106 PolarHBondContact OD1-OG 2.96Å; D103-S107 WeakPolarHBondContact O-CB 3.47Å; D103-S107 PolarHBondContact O-N 2.92Å; D103-S107 PolarHBondContact O-OG 2.95Å |
| 104 | F | 92.3 | Very high | 85.6 | Confident | 157 Ų | 157 | 58.7 Ų | 58.7 | 69% | 0.689 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -62 | -38.2 | 179.8 | -178.5 | -95.5 | 0 | 0 | 0 | 113.1 | S107 F108 | F104-S107 PolarHBondContact O-N 3.23Å; F104-F108 WeakPolarHBondContact O-CB 3.25Å; F104-F108 PolarHBondContact O-N 2.69Å |
| 105 | S | 92.8 | Very high | 87.1 | Confident | 8 Ų | 8 | 58.3 Ų | 58.3 | 6% | 0.056 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -67.1 | -46 | -177.9 | -158.4 | 0 | 0 | 0 | 0 | 111.8 | D103 F109 S240 C244 | D103-S105 VanDerWaalsContact C-N 3.33Å; D103-S105 PolarHBondContact O-N 2.86Å; D103-S105 WeakPolarHBondContact OD2-CB 3.38Å; D103-S105 PolarHBondContact OD2-N 3.22Å; S105-F109 WeakPolarHBondContact O-CB 3.23Å; S105-F109 PolarHBondContact O-N 3.48Å; S105-S240 WeakPolarHBondContact CB-O 3.41Å; S105-S240 PolarHBondContact OG-O 3.07Å; S105-C244 PolarHBondContact OG-N 3.38Å |
| 106 | S | 92.1 | Very high | 88.5 | Confident | 6 Ų | 6 | 53.4 Ų | 53.4 | 4% | 0.042 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -67.3 | -39.9 | 174.4 | -52.3 | 0 | 0 | 0 | 0 | 111.9 | N101 D103 F109 F110 R243 | N101-S106 WeakPolarHBondContact O-CB 3.33Å; D103-S106 WeakPolarHBondContact OD1-CB 3.19Å; D103-S106 PolarHBondContact OD1-N 2.86Å; D103-S106 PolarHBondContact OD1-OG 2.96Å; S106-F109 PolarHBondContact O-N 2.86Å; S106-F110 WeakPolarHBondContact O-CB 3.36Å; S106-F110 PolarHBondContact O-N 3.28Å; S106-R243 WeakPolarHBondContact OG-CD 3.3Å; S106-R243 PolarHBondContact OG-NH1 3.47Å |
| 107 | S | 95 | Very high | 90 | Very high | 40 Ų | 40 | 50.9 Ų | 50.9 | 28% | 0.28 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66.6 | -39.1 | 177.9 | -59.4 | 0 | 0 | 0 | 0 | 112.4 | D103 F104 A111 | D103-S107 WeakPolarHBondContact O-CB 3.47Å; D103-S107 PolarHBondContact O-N 2.92Å; D103-S107 PolarHBondContact O-OG 2.95Å; F104-S107 PolarHBondContact O-N 3.23Å; S107-A111 VanDerWaalsContact O-CB 3.29Å; S107-A111 WeakPolarHBondContact O-CB 3.49Å; S107-A111 PolarHBondContact O-N 2.88Å |
| 108 | F | 95.6 | Very high | 91.5 | Very high | 76 Ų | 76 | 45.7 Ų | 45.7 | 33% | 0.333 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -65.7 | -43.5 | 173.5 | 176.5 | -90.4 | 0 | 0 | 0 | 111.4 | F104 A111 G112 C244 I248 | F104-F108 WeakPolarHBondContact O-CB 3.25Å; F104-F108 PolarHBondContact O-N 2.69Å; F108-A111 PolarHBondContact O-N 2.67Å; F108-G112 PolarHBondContact O-N 3Å; F108-C244 HydrophobicContact CD1-CB 4.15Å; F108-I248 HydrophobicContact CE1-CG1 4.27Å; F108-I248 HydrophobicContact CZ-CG1 4.44Å |
| 109 | F | 95.9 | Very high | 92.7 | Very high | 11 Ų | 11 | 45.3 Ų | 45.3 | 5% | 0.048 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.3 | -45.7 | 176.2 | -175.4 | -107.3 | 0 | 0 | 0 | 111.9 | S105 S106 G112 T113 Y120 V229 V230 R243 A246 I250 | S105-F109 WeakPolarHBondContact O-CB 3.23Å; S105-F109 PolarHBondContact O-N 3.48Å; S106-F109 PolarHBondContact O-N 2.86Å; F109-G112 CarbonylContact O-C 3.58Å; F109-G112 WeakPolarHBondContact O-CA 3.4Å; F109-G112 PolarHBondContact O-N 3.48Å; F109-G112 VanDerWaalsContact O-N 3.16Å; F109-T113 HydrophobicContact CD1-CG2 4.43Å; F109-T113 HydrophobicContact CE1-CG2 4.26Å; F109-T113 HydrophobicContact CZ-CG2 4.45Å; F109-T113 WeakPolarHBondContact O-CG2 3.26Å; F109-T113 PolarHBondContact O-N 2.87Å; F109-Y120 HydrophobicContact CE1-CD2 4.09Å; F109-Y120 AromaticContact CE1-CE2 3.61Å; F109-Y120 HydrophobicContact CE1-CE2 3.61Å; F109-Y120 HydrophobicContact CZ-CD2 4.47Å; F109-Y120 AromaticContact CZ-CE2 3.56Å; F109-Y120 HydrophobicContact CZ-CE2 3.56Å; F109-V229 HydrophobicContact CE1-CG1 3.8Å; F109-V229 HydrophobicContact CZ-CG1 4.4Å; F109-V230 HydrophobicContact CE1-CG2 4.44Å; F109-V230 HydrophobicContact CE2-CG2 4.1Å; F109-V230 HydrophobicContact CZ-CG2 3.77Å; F109-R243 HydrophobicContact CB-CB 3.94Å; F109-R243 WeakPolarHBondContact CD2-O 3.32Å; F109-R243 HydrophobicContact CG-CB 4.19Å; F109-A246 HydrophobicContact CD2-CB 4.42Å; F109-A246 HydrophobicContact CE2-CB 3.93Å; F109-I250 HydrophobicContact CE2-CD1 3.84Å; F109-I250 HydrophobicContact CZ-CD1 4.35Å |
| 110 | F | 96 | Very high | 93.8 | Very high | 34 Ų | 34 | 40.4 Ų | 40.4 | 15% | 0.149 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -59.8 | -45.1 | 173.2 | 172.9 | -91.9 | 0 | 0 | 0 | 112.5 | W102 S106 G112 T113 V114 L123 P125 | W102-F110 AromaticContact CH2-CD1 3.89Å; W102-F110 HydrophobicContact CH2-CD1 3.89Å; W102-F110 HydrophobicContact CH2-CD2 4.09Å; W102-F110 AromaticContact CH2-CE1 3.97Å; W102-F110 HydrophobicContact CH2-CE1 3.97Å; W102-F110 HydrophobicContact CH2-CE2 4.16Å; W102-F110 AromaticContact CH2-CG 3.97Å; W102-F110 HydrophobicContact CH2-CG 3.97Å; W102-F110 HydrophobicContact CH2-CZ 4.12Å; W102-F110 HydrophobicContact CZ3-CB 4.38Å; W102-F110 AromaticContact CZ3-CD1 3.71Å; W102-F110 HydrophobicContact CZ3-CD1 3.71Å; W102-F110 HydrophobicContact CZ3-CD2 4.48Å; W102-F110 HydrophobicContact CZ3-CE1 4.15Å; W102-F110 AromaticContact CZ3-CG 3.91Å; W102-F110 HydrophobicContact CZ3-CG 3.91Å; S106-F110 WeakPolarHBondContact O-CB 3.36Å; S106-F110 PolarHBondContact O-N 3.28Å; F110-G112 PolarHBondContact O-N 2.92Å; F110-T113 PolarHBondContact O-N 3.35Å; F110-T113 PolarHBondContact O-OG1 3.39Å; F110-V114 HydrophobicContact CD1-CG2 4.4Å; F110-V114 HydrophobicContact CE1-CG2 3.86Å; F110-V114 HydrophobicContact CE2-CG2 4.11Å; F110-V114 HydrophobicContact CZ-CG2 3.68Å; F110-V114 WeakPolarHBondContact O-CG2 3.38Å; F110-V114 PolarHBondContact O-N 3.4Å; F110-L123 HydrophobicContact CB-CD2 4.41Å; F110-L123 HydrophobicContact CD2-CD2 4.47Å; F110-L123 WeakPolarHBondContact CE2-O 3.24Å; F110-P125 HydrophobicContact CE1-CG 4.27Å; F110-P125 HydrophobicContact CZ-CG 3.79Å |
| 111 | A | 97.1 | Very high | 94 | Very high | 26 Ų | 26 | 39.7 Ų | 39.7 | 22% | 0.215 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.1 | -40 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | S107 F108 V115 Y137 | S107-A111 VanDerWaalsContact O-CB 3.29Å; S107-A111 WeakPolarHBondContact O-CB 3.49Å; S107-A111 PolarHBondContact O-N 2.88Å; F108-A111 PolarHBondContact O-N 2.67Å; A111-V115 PolarHBondContact O-N 2.92Å; A111-Y137 HydrophobicContact CB-CE1 4.15Å; A111-Y137 PolarHBondContact O-OH 2.81Å |
| 112 | G | 96.2 | Very high | 94 | Very high | 15 Ų | 15 | 40.4 Ų | 40.4 | 16% | 0.155 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.5 | -49.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | F108 F109 F110 V114 V115 T116 | F108-G112 PolarHBondContact O-N 3Å; F109-G112 CarbonylContact O-C 3.58Å; F109-G112 WeakPolarHBondContact O-CA 3.4Å; F109-G112 PolarHBondContact O-N 3.48Å; F109-G112 VanDerWaalsContact O-N 3.16Å; F110-G112 PolarHBondContact O-N 2.92Å; G112-V114 VanDerWaalsContact C-N 3.28Å; G112-V114 PolarHBondContact O-N 2.9Å; G112-V115 WeakPolarHBondContact O-CG2 3.34Å; G112-V115 PolarHBondContact O-N 2.95Å; G112-T116 WeakPolarHBondContact O-CB 3.47Å; G112-T116 WeakPolarHBondContact O-CG2 3.47Å; G112-T116 PolarHBondContact O-N 3.05Å; G112-T116 PolarHBondContact O-OG1 3.31Å |
| 113 | T | 96.6 | Very high | 93.8 | Very high | 6 Ų | 6 | 36.3 Ų | 36.3 | 4% | 0.037 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -67.9 | -26.2 | -177.1 | 60.9 | 0 | 0 | 0 | 0 | 113.1 | F109 F110 T116 T117 I118 G119 Y120 | F109-T113 HydrophobicContact CD1-CG2 4.43Å; F109-T113 HydrophobicContact CE1-CG2 4.26Å; F109-T113 HydrophobicContact CZ-CG2 4.45Å; F109-T113 WeakPolarHBondContact O-CG2 3.26Å; F109-T113 PolarHBondContact O-N 2.87Å; F110-T113 PolarHBondContact O-N 3.35Å; F110-T113 PolarHBondContact O-OG1 3.39Å; T113-T116 WeakPolarHBondContact CA-OG1 3.48Å; T113-T117 PolarHBondContact O-N 3Å; T113-I118 HydrophobicContact CG2-CB 4.5Å; T113-I118 PolarHBondContact O-N 3.38Å; T113-G119 PolarHBondContact O-N 3.39Å; T113-G119 VanDerWaalsContact O-N 3.08Å; T113-Y120 HydrophobicContact CG2-CD2 3.58Å; T113-Y120 HydrophobicContact CG2-CE2 3.38Å |
| 114 | V | 97.4 | Very high | 93.8 | Very high | 21 Ų | 21 | 36.4 Ų | 36.4 | 13% | 0.127 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -69.8 | -50 | 171.6 | 172.3 | 0 | 0 | 0 | 0 | 111.5 | F110 G112 T116 T117 Y137 A138 | F110-V114 HydrophobicContact CD1-CG2 4.4Å; F110-V114 HydrophobicContact CE1-CG2 3.86Å; F110-V114 HydrophobicContact CE2-CG2 4.11Å; F110-V114 HydrophobicContact CZ-CG2 3.68Å; F110-V114 WeakPolarHBondContact O-CG2 3.38Å; F110-V114 PolarHBondContact O-N 3.4Å; G112-V114 VanDerWaalsContact C-N 3.28Å; G112-V114 PolarHBondContact O-N 2.9Å; V114-T116 VanDerWaalsContact C-N 3.34Å; V114-T116 PolarHBondContact O-N 3.23Å; V114-T117 PolarHBondContact O-N 3Å; V114-Y137 HydrophobicContact CB-CD1 4.44Å; V114-Y137 HydrophobicContact CB-CE1 4.3Å; V114-Y137 HydrophobicContact CG1-CD1 3.92Å; V114-Y137 HydrophobicContact CG1-CE1 4.19Å; V114-A138 HydrophobicContact CG1-CB 3.77Å |
| 115 | V | 97.1 | Very high | 93.9 | Very high | 19 Ų | 19 | 30.1 Ų | 30.1 | 12% | 0.115 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -75.9 | -21.7 | -177.4 | -56 | 0 | 0 | 0 | 0 | 113.9 | A111 G112 T117 Y137 N145 | A111-V115 PolarHBondContact O-N 2.92Å; G112-V115 WeakPolarHBondContact O-CG2 3.34Å; G112-V115 PolarHBondContact O-N 2.95Å; V115-T117 VanDerWaalsContact C-N 3.33Å; V115-Y137 HydrophobicContact CG1-CD1 4.35Å; V115-Y137 HydrophobicContact CG1-CE1 3.52Å; V115-Y137 WeakPolarHBondContact CG1-OH 3.27Å; V115-N145 HydrophobicContact CB-CB 4.23Å; V115-N145 HydrophobicContact CG2-CB 4.37Å; V115-N145 WeakPolarHBondContact O-CB 3.31Å; V115-N145 PolarHBondContact O-ND2 3.16Å |
| 116 | T | 95.9 | Very high | 93.8 | Very high | 4 Ų | 4 | 32.6 Ų | 32.6 | 3% | 0.025 | 22% | 0.219 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | 2.6 | 171.5 | 55.2 | 0 | 0 | 0 | 0 | 113.5 | G112 T113 V114 I118 N145 T222 I250 L254 | G112-T116 WeakPolarHBondContact O-CB 3.47Å; G112-T116 WeakPolarHBondContact O-CG2 3.47Å; G112-T116 PolarHBondContact O-N 3.05Å; G112-T116 PolarHBondContact O-OG1 3.31Å; T113-T116 WeakPolarHBondContact CA-OG1 3.48Å; V114-T116 VanDerWaalsContact C-N 3.34Å; V114-T116 PolarHBondContact O-N 3.23Å; T116-I118 PolarHBondContact O-N 2.92Å; T116-I118 VanDerWaalsContact O-N 3.12Å; T116-I118 VanDerWaalsContact OG1-CD1 3.29Å; T116-I118 WeakPolarHBondContact OG1-CD1 3.43Å; T116-I118 WeakPolarHBondContact OG1-CG1 3.48Å; T116-N145 WeakPolarHBondContact CA-ND2 3.49Å; T116-T222 VanDerWaalsContact O-CG2 3.31Å; T116-T222 WeakPolarHBondContact O-CG2 3.47Å; T116-I250 HydrophobicContact CG2-CG2 4.35Å; T116-L254 HydrophobicContact CG2-CD1 3.64Å |
| 117 | T | 96.4 | Very high | 93.9 | Very high | 74 Ų | 74 | 36.3 Ų | 36.3 | 45% | 0.454 | 24% | 0.241 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 53.3 | 26.5 | -178.5 | 59.4 | 0 | 0 | 0 | 0 | 114.9 | T113 V114 V115 I142 | T113-T117 PolarHBondContact O-N 3Å; V114-T117 PolarHBondContact O-N 3Å; V115-T117 VanDerWaalsContact C-N 3.33Å; T117-I142 HydrophobicContact CG2-CB 4.47Å; T117-I142 HydrophobicContact CG2-CD1 3.57Å; T117-I142 HydrophobicContact CG2-CG1 3.73Å; T117-I142 HydrophobicContact CG2-CG2 3.88Å |
| 118 | I | 97 | Very high | 94 | Very high | 5 Ų | 5 | 39.7 Ų | 39.7 | 3% | 0.026 | 26% | 0.26 | C | S | . | . | trans | -81.3 | -44.6 | 176.7 | -58.4 | 172.2 | 0 | 0 | 0 | 110.3 | T113 T116 Y120 T219 T222 G224 I250 | T113-I118 HydrophobicContact CG2-CB 4.5Å; T113-I118 PolarHBondContact O-N 3.38Å; T116-I118 PolarHBondContact O-N 2.92Å; T116-I118 VanDerWaalsContact O-N 3.12Å; T116-I118 VanDerWaalsContact OG1-CD1 3.29Å; T116-I118 WeakPolarHBondContact OG1-CD1 3.43Å; T116-I118 WeakPolarHBondContact OG1-CG1 3.48Å; I118-Y120 HydrophobicContact CG2-CD1 4.01Å; I118-Y120 HydrophobicContact CG2-CD2 4.43Å; I118-Y120 HydrophobicContact CG2-CE1 3.68Å; I118-Y120 HydrophobicContact CG2-CE2 4.12Å; I118-Y120 HydrophobicContact CG2-CG 4.37Å; I118-Y120 PolarHBondContact O-N 3.39Å; I118-T219 HydrophobicContact CD1-CG2 4.03Å; I118-T219 WeakPolarHBondContact CD1-O 3.28Å; I118-T222 HydrophobicContact CG1-CG2 3.95Å; I118-G224 WeakPolarHBondContact O-CA 3.26Å; I118-I250 HydrophobicContact CD1-CD1 4.28Å; I118-I250 HydrophobicContact CD1-CG2 3.49Å; I118-I250 VanDerWaalsContact CD1-CG2 3.49Å | ||
| 119 | G | 94.5 | Very high | 94.1 | Very high | 47 Ų | 47 | 40.4 Ų | 40.4 | 49% | 0.485 | 27% | 0.274 | S | S | . | . | trans | 51.3 | 44.6 | 164.7 | 0 | 0 | 0 | 0 | 0 | 118.3 | T113 G121 | T113-G119 PolarHBondContact O-N 3.39Å; T113-G119 VanDerWaalsContact O-N 3.08Å; G119-G121 PolarHBondContact O-N 3.28Å | ||
| 120 | Y | 93.3 | Very high | 94.1 | Very high | 9 Ų | 9 | 40.7 Ų | 40.7 | 4% | 0.035 | 28% | 0.281 | C | S | . | . | trans | -42.6 | -13.2 | -173.6 | -61.4 | -67.1 | 0 | 0 | 0 | 119.6 | F109 T113 I118 N122 F215 T219 G224 G226 V229 | F109-Y120 HydrophobicContact CE1-CD2 4.09Å; F109-Y120 AromaticContact CE1-CE2 3.61Å; F109-Y120 HydrophobicContact CE1-CE2 3.61Å; F109-Y120 HydrophobicContact CZ-CD2 4.47Å; F109-Y120 AromaticContact CZ-CE2 3.56Å; F109-Y120 HydrophobicContact CZ-CE2 3.56Å; T113-Y120 HydrophobicContact CG2-CD2 3.58Å; T113-Y120 HydrophobicContact CG2-CE2 3.38Å; I118-Y120 HydrophobicContact CG2-CD1 4.01Å; I118-Y120 HydrophobicContact CG2-CD2 4.43Å; I118-Y120 HydrophobicContact CG2-CE1 3.68Å; I118-Y120 HydrophobicContact CG2-CE2 4.12Å; I118-Y120 HydrophobicContact CG2-CG 4.37Å; I118-Y120 PolarHBondContact O-N 3.39Å; Y120-N122 WeakPolarHBondContact CB-OD1 3.18Å; Y120-N122 PolarHBondContact O-N 2.88Å; Y120-F215 HydrophobicContact CE1-CE2 4.12Å; Y120-F215 WeakPolarHBondContact OH-CE2 3.39Å; Y120-T219 VanDerWaalsContact OH-CG2 3.28Å; Y120-T219 WeakPolarHBondContact OH-CG2 3.38Å; Y120-T219 PolarHBondContact OH-OG1 3.29Å; Y120-G224 WeakPolarHBondContact CA-O 3.33Å; Y120-G226 VanDerWaalsContact O-CA 3.31Å; Y120-G226 WeakPolarHBondContact O-CA 3.32Å; Y120-V229 HydrophobicContact CD1-CG2 3.85Å; Y120-V229 HydrophobicContact CD2-CG1 4.18Å; Y120-V229 HydrophobicContact CD2-CG2 4.14Å; Y120-V229 HydrophobicContact CE1-CG2 4.34Å; Y120-V229 HydrophobicContact CE2-CG1 4.31Å; Y120-V229 HydrophobicContact CG-CG2 3.74Å | ||
| 121 | G | 86.3 | Confident | 94.2 | Very high | 58 Ų | 58 | 43.8 Ų | 43.8 | 60% | 0.598 | 30% | 0.296 | S | S | * | . | S | Bend | trans | 72.9 | -28.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116 | G119 L123 | G119-G121 PolarHBondContact O-N 3.28Å; G121-L123 PolarHBondContact O-N 3.18Å |
| 122 | N | 84.4 | Confident | 94.2 | Very high | 69 Ų | 69 | 46.1 Ų | 46.1 | 37% | 0.369 | 31% | 0.307 | S | S | . | . | S | Bend | trans | -60.1 | -17.1 | 179.4 | 79.4 | -40.9 | 0 | 0 | 0 | 114.4 | Y120 V229 | Y120-N122 WeakPolarHBondContact CB-OD1 3.18Å; Y120-N122 PolarHBondContact O-N 2.88Å; N122-V229 HydrophobicContact CB-CG2 4.5Å |
| 123 | L | 87.3 | Confident | 94.3 | Very high | 21 Ų | 21 | 52 Ų | 52 | 11% | 0.11 | 33% | 0.329 | C | S | . | . | S | Bend | trans | -139.5 | 128.7 | 171.4 | -173.1 | 65.8 | 0 | 0 | 0 | 109.2 | N101 W102 F110 G121 | N101-L123 HydrophobicContact CB-CD1 3.98Å; N101-L123 VanDerWaalsContact O-CD2 3.29Å; N101-L123 WeakPolarHBondContact O-CD2 3.46Å; W102-L123 HydrophobicContact CD2-CD1 4.49Å; W102-L123 HydrophobicContact CD2-CD2 4.27Å; W102-L123 HydrophobicContact CE3-CD2 4.31Å; W102-L123 HydrophobicContact CH2-CD2 4.03Å; W102-L123 HydrophobicContact CH2-CG 3.95Å; W102-L123 HydrophobicContact CZ2-CD1 3.73Å; W102-L123 HydrophobicContact CZ2-CD2 3.98Å; W102-L123 HydrophobicContact CZ2-CG 3.57Å; W102-L123 HydrophobicContact CZ3-CD2 4.2Å; F110-L123 HydrophobicContact CB-CD2 4.41Å; F110-L123 HydrophobicContact CD2-CD2 4.47Å; F110-L123 WeakPolarHBondContact CE2-O 3.24Å; G121-L123 PolarHBondContact O-N 3.18Å |
| 124 | S | 90.9 | Very high | 94.4 | Very high | 59 Ų | 59 | 53 Ų | 53 | 41% | 0.413 | 34% | 0.336 | S | S | . | . | trans | -145.2 | 152.7 | 178.6 | 67.8 | 0 | 0 | 0 | 0 | 112.8 | S126 | S124-S126 PolarHBondContact O-N 3.46Å; S124-S126 VanDerWaalsContact O-N 3.14Å | ||
| 125 | P | 93.2 | Very high | 94.4 | Very high | 24 Ų | 24 | 56.6 Ų | 56.6 | 16% | 0.156 | 36% | 0.358 | C | S | . | . | trans | -66.1 | 113.6 | 179.6 | -20.3 | 33.8 | 0 | 0 | 0 | 111.4 | F110 Q131 C134 | F110-P125 HydrophobicContact CE1-CG 4.27Å; F110-P125 HydrophobicContact CZ-CG 3.79Å; P125-Q131 HydrophobicContact CB-CG 4.12Å; P125-Q131 WeakPolarHBondContact O-CG 3.3Å; P125-Q131 PolarHBondContact O-NE2 3.08Å; P125-C134 HydrophobicContact CG-CB 4.13Å | ||
| 126 | S | 91.5 | Very high | 94.5 | Very high | 61 Ų | 61 | 62 Ų | 62 | 43% | 0.427 | 38% | 0.379 | S | S | . | . | trans | -87.6 | -5.5 | 178.7 | -76.6 | 0 | 0 | 0 | 0 | 114.5 | K88 S124 | K88-S126 WeakPolarHBondContact CD-OG 3.23Å; S124-S126 PolarHBondContact O-N 3.46Å; S124-S126 VanDerWaalsContact O-N 3.14Å | ||
| 127 | T | 94.6 | Very high | 94.6 | Very high | 83 Ų | 83 | 65.6 Ų | 65.6 | 51% | 0.509 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -102.3 | 143.7 | 177.4 | 59.3 | 0 | 0 | 0 | 0 | 111.2 | S129 G130 Q131 | T127-S129 VanDerWaalsContact C-N 3.26Å; T127-S129 PolarHBondContact O-N 3.28Å; T127-G130 PolarHBondContact O-N 3.35Å; T127-G130 PolarHBondContact OG1-N 3Å; T127-G130 VanDerWaalsContact OG1-N 3.16Å; T127-Q131 WeakPolarHBondContact O-CG 3.45Å; T127-Q131 PolarHBondContact O-N 2.9Å |
| 128 | V | 96.6 | Very high | 94.7 | Very high | 111 Ų | 111 | 63 Ų | 63 | 67% | 0.673 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -57 | -40.9 | 178 | -177.9 | 0 | 0 | 0 | 0 | 111.4 | Q131 V132 | V128-Q131 PolarHBondContact O-N 3.45Å; V128-V132 HydrophobicContact CG1-CG2 4.46Å; V128-V132 WeakPolarHBondContact O-CB 3.28Å; V128-V132 VanDerWaalsContact O-CG2 3.3Å; V128-V132 WeakPolarHBondContact O-CG2 3.25Å; V128-V132 PolarHBondContact O-N 2.94Å |
| 129 | S | 97.2 | Very high | 94.7 | Very high | 91 Ų | 91 | 68.4 Ų | 68.4 | 64% | 0.636 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -64.1 | -40.8 | 175.3 | 49 | 0 | 0 | 0 | 0 | 112.8 | T127 F133 | T127-S129 VanDerWaalsContact C-N 3.26Å; T127-S129 PolarHBondContact O-N 3.28Å; S129-F133 VanDerWaalsContact O-CB 3.28Å; S129-F133 WeakPolarHBondContact O-CB 3.36Å; S129-F133 PolarHBondContact O-N 3.05Å |
| 130 | G | 96.9 | Very high | 94.8 | Very high | 18 Ų | 18 | 70.6 Ų | 70.6 | 19% | 0.186 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -66.9 | -37.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | T127 C134 | T127-G130 PolarHBondContact O-N 3.35Å; T127-G130 PolarHBondContact OG1-N 3Å; T127-G130 VanDerWaalsContact OG1-N 3.16Å; G130-C134 VanDerWaalsContact O-CB 3.25Å; G130-C134 WeakPolarHBondContact O-CB 3.24Å; G130-C134 PolarHBondContact O-N 2.64Å |
| 131 | Q | 97.4 | Very high | 95.1 | Very high | 98 Ų | 98 | 70.6 Ų | 70.6 | 46% | 0.458 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.3 | -48.7 | 175.7 | -69.7 | 172 | -7.1 | 0 | 0 | 111.4 | P125 T127 V128 F133 C134 V135 | P125-Q131 HydrophobicContact CB-CG 4.12Å; P125-Q131 WeakPolarHBondContact O-CG 3.3Å; P125-Q131 PolarHBondContact O-NE2 3.08Å; T127-Q131 WeakPolarHBondContact O-CG 3.45Å; T127-Q131 PolarHBondContact O-N 2.9Å; V128-Q131 PolarHBondContact O-N 3.45Å; Q131-F133 VanDerWaalsContact C-N 3.35Å; Q131-F133 PolarHBondContact O-N 3.18Å; Q131-C134 WeakPolarHBondContact O-CB 3.14Å; Q131-C134 PolarHBondContact O-N 3.16Å; Q131-V135 PolarHBondContact O-N 3.33Å |
| 132 | V | 98.2 | Very high | 95.6 | Very high | 76 Ų | 76 | 70.3 Ų | 70.3 | 46% | 0.461 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.2 | -43 | 176.1 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | V128 V135 F136 | V128-V132 HydrophobicContact CG1-CG2 4.46Å; V128-V132 WeakPolarHBondContact O-CB 3.28Å; V128-V132 VanDerWaalsContact O-CG2 3.3Å; V128-V132 WeakPolarHBondContact O-CG2 3.25Å; V128-V132 PolarHBondContact O-N 2.94Å; V132-V135 PolarHBondContact O-N 3.3Å; V132-F136 HydrophobicContact CG1-CD2 4.1Å; V132-F136 HydrophobicContact CG1-CE2 3.82Å; V132-F136 VanDerWaalsContact O-CD2 3.25Å; V132-F136 WeakPolarHBondContact O-CD2 3.29Å; V132-F136 PolarHBondContact O-N 2.71Å |
| 133 | F | 98.1 | Very high | 96.2 | Very high | 138 Ų | 138 | 70.7 Ų | 70.7 | 61% | 0.605 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -60 | -45.5 | 173.3 | 176.1 | -98 | 0 | 0 | 0 | 111.9 | S129 Q131 V135 F136 Y137 | S129-F133 VanDerWaalsContact O-CB 3.28Å; S129-F133 WeakPolarHBondContact O-CB 3.36Å; S129-F133 PolarHBondContact O-N 3.05Å; Q131-F133 VanDerWaalsContact C-N 3.35Å; Q131-F133 PolarHBondContact O-N 3.18Å; F133-V135 VanDerWaalsContact C-N 3.31Å; F133-V135 PolarHBondContact O-N 3.35Å; F133-F136 PolarHBondContact O-N 3.23Å; F133-Y137 HydrophobicContact CE1-CD2 4.36Å; F133-Y137 HydrophobicContact CE1-CG 4.17Å; F133-Y137 HydrophobicContact CZ-CD2 4.15Å; F133-Y137 HydrophobicContact CZ-CG 4.35Å; F133-Y137 VanDerWaalsContact O-CB 3.23Å; F133-Y137 WeakPolarHBondContact O-CB 3.14Å; F133-Y137 PolarHBondContact O-N 2.89Å |
| 134 | C | 97.8 | Very high | 96.6 | Very high | 28 Ų | 28 | 75.6 Ų | 75.6 | 19% | 0.189 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59.1 | -39.1 | 179.7 | -170.2 | 0 | 0 | 0 | 0 | 112.5 | P125 G130 Q131 Y137 A138 | P125-C134 HydrophobicContact CG-CB 4.13Å; G130-C134 VanDerWaalsContact O-CB 3.25Å; G130-C134 WeakPolarHBondContact O-CB 3.24Å; G130-C134 PolarHBondContact O-N 2.64Å; Q131-C134 WeakPolarHBondContact O-CB 3.14Å; Q131-C134 PolarHBondContact O-N 3.16Å; C134-Y137 PolarHBondContact O-N 3.43Å; C134-A138 VanDerWaalsContact O-CB 3.26Å; C134-A138 WeakPolarHBondContact O-CB 3.44Å; C134-A138 PolarHBondContact O-N 3.2Å |
| 135 | V | 98.1 | Very high | 96.8 | Very high | 96 Ų | 96 | 73.6 Ų | 73.6 | 58% | 0.582 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -61 | -50.2 | 175.9 | 171.8 | 0 | 0 | 0 | 0 | 111.5 | Q131 V132 F133 L139 | Q131-V135 PolarHBondContact O-N 3.33Å; V132-V135 PolarHBondContact O-N 3.3Å; F133-V135 VanDerWaalsContact C-N 3.31Å; F133-V135 PolarHBondContact O-N 3.35Å; V135-L139 WeakPolarHBondContact O-CB 3.42Å; V135-L139 PolarHBondContact O-N 3Å |
| 136 | F | 98.2 | Very high | 96.7 | Very high | 131 Ų | 131 | 77.7 Ų | 77.7 | 58% | 0.575 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -69.6 | -36.1 | 178.8 | -69.1 | -65.4 | 0 | 0 | 0 | 112.6 | V132 F133 L139 C140 | V132-F136 HydrophobicContact CG1-CD2 4.1Å; V132-F136 HydrophobicContact CG1-CE2 3.82Å; V132-F136 VanDerWaalsContact O-CD2 3.25Å; V132-F136 WeakPolarHBondContact O-CD2 3.29Å; V132-F136 PolarHBondContact O-N 2.71Å; F133-F136 PolarHBondContact O-N 3.23Å; F136-L139 PolarHBondContact O-N 3.32Å; F136-C140 PolarHBondContact O-N 3.35Å |
| 137 | Y | 98.4 | Very high | 96.8 | Very high | 80 Ų | 80 | 77.6 Ų | 77.6 | 31% | 0.314 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 176 | 179.7 | -105.4 | 0 | 0 | 0 | 111.8 | A111 V114 V115 F133 C134 G141 | A111-Y137 HydrophobicContact CB-CE1 4.15Å; A111-Y137 PolarHBondContact O-OH 2.81Å; V114-Y137 HydrophobicContact CB-CD1 4.44Å; V114-Y137 HydrophobicContact CB-CE1 4.3Å; V114-Y137 HydrophobicContact CG1-CD1 3.92Å; V114-Y137 HydrophobicContact CG1-CE1 4.19Å; V115-Y137 HydrophobicContact CG1-CD1 4.35Å; V115-Y137 HydrophobicContact CG1-CE1 3.52Å; V115-Y137 WeakPolarHBondContact CG1-OH 3.27Å; F133-Y137 HydrophobicContact CE1-CD2 4.36Å; F133-Y137 HydrophobicContact CE1-CG 4.17Å; F133-Y137 HydrophobicContact CZ-CD2 4.15Å; F133-Y137 HydrophobicContact CZ-CG 4.35Å; F133-Y137 VanDerWaalsContact O-CB 3.23Å; F133-Y137 WeakPolarHBondContact O-CB 3.14Å; F133-Y137 PolarHBondContact O-N 2.89Å; C134-Y137 PolarHBondContact O-N 3.43Å; Y137-G141 WeakPolarHBondContact O-CA 3.42Å; Y137-G141 PolarHBondContact O-N 2.94Å |
| 138 | A | 97.9 | Very high | 96.7 | Very high | 20 Ų | 20 | 77.6 Ų | 77.6 | 17% | 0.165 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -64.4 | -44.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | V114 C134 C140 G141 I142 | V114-A138 HydrophobicContact CG1-CB 3.77Å; C134-A138 VanDerWaalsContact O-CB 3.26Å; C134-A138 WeakPolarHBondContact O-CB 3.44Å; C134-A138 PolarHBondContact O-N 3.2Å; A138-C140 VanDerWaalsContact C-N 3.3Å; A138-C140 PolarHBondContact O-N 3.22Å; A138-G141 PolarHBondContact O-N 3.17Å; A138-I142 HydrophobicContact CB-CD1 4.01Å; A138-I142 WeakPolarHBondContact O-CB 3.36Å; A138-I142 WeakPolarHBondContact O-CG1 3.4Å; A138-I142 PolarHBondContact O-N 3.28Å |
| 139 | L | 97.8 | Very high | 96.4 | Very high | 118 Ų | 118 | 73.2 Ų | 73.2 | 62% | 0.618 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -56.5 | -40.4 | -179.4 | 179.2 | 63.3 | 0 | 0 | 0 | 112.9 | V135 F136 P143 | V135-L139 WeakPolarHBondContact O-CB 3.42Å; V135-L139 PolarHBondContact O-N 3Å; F136-L139 PolarHBondContact O-N 3.32Å; L139-P143 WeakPolarHBondContact O-CD 3.29Å; L139-P143 WeakPolarHBondContact O-CG 3.37Å |
| 140 | C | 97.6 | Very high | 96 | Very high | 93 Ų | 93 | 76.2 Ų | 76.2 | 63% | 0.628 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -87.7 | -35.2 | 175.9 | -65.5 | 0 | 0 | 0 | 0 | 113 | F136 A138 L144 | F136-C140 PolarHBondContact O-N 3.35Å; A138-C140 VanDerWaalsContact C-N 3.3Å; A138-C140 PolarHBondContact O-N 3.22Å; C140-L144 WeakPolarHBondContact O-CB 3.48Å; C140-L144 PolarHBondContact O-N 3.4Å |
| 141 | G | 97.7 | Very high | 95.7 | Very high | 10 Ų | 10 | 80.4 Ų | 80.4 | 10% | 0.103 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -75.3 | -38.3 | -172.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y137 A138 L144 N145 | Y137-G141 WeakPolarHBondContact O-CA 3.42Å; Y137-G141 PolarHBondContact O-N 2.94Å; A138-G141 PolarHBondContact O-N 3.17Å; G141-L144 PolarHBondContact O-N 2.99Å; G141-N145 WeakPolarHBondContact O-CB 3.29Å; G141-N145 PolarHBondContact O-N 2.87Å |
| 142 | I | 97.2 | Very high | 95.3 | Very high | 51 Ų | 51 | 78.2 Ų | 78.2 | 26% | 0.262 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.5 | -48.7 | 179.9 | -62.5 | 163.2 | 0 | 0 | 0 | 111.2 | T117 A138 L144 N145 L146 | T117-I142 HydrophobicContact CG2-CB 4.47Å; T117-I142 HydrophobicContact CG2-CD1 3.57Å; T117-I142 HydrophobicContact CG2-CG1 3.73Å; T117-I142 HydrophobicContact CG2-CG2 3.88Å; A138-I142 HydrophobicContact CB-CD1 4.01Å; A138-I142 WeakPolarHBondContact O-CB 3.36Å; A138-I142 WeakPolarHBondContact O-CG1 3.4Å; A138-I142 PolarHBondContact O-N 3.28Å; I142-L144 VanDerWaalsContact C-N 3.31Å; I142-L144 PolarHBondContact O-N 2.89Å; I142-N145 PolarHBondContact O-N 2.87Å; I142-L146 HydrophobicContact CG2-CD1 4.24Å; I142-L146 WeakPolarHBondContact O-CG 3.31Å; I142-L146 PolarHBondContact O-N 2.89Å |
| 143 | P | 97.3 | Very high | 94.7 | Very high | 77 Ų | 77 | 75 Ų | 75 | 50% | 0.5 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -60.8 | -36.8 | 173.4 | -24.4 | 35.4 | 0 | 0 | 0 | 113.6 | L139 A147 | L139-P143 WeakPolarHBondContact O-CD 3.29Å; L139-P143 WeakPolarHBondContact O-CG 3.37Å; P143-A147 WeakPolarHBondContact O-CB 3.28Å; P143-A147 PolarHBondContact O-N 3.28Å |
| 144 | L | 95.9 | Very high | 94.2 | Very high | 125 Ų | 125 | 73.8 Ų | 73.8 | 65% | 0.654 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -65.6 | -43.3 | 176.7 | 178.8 | 61.7 | 0 | 0 | 0 | 111.7 | C140 G141 I142 A147 F148 | C140-L144 WeakPolarHBondContact O-CB 3.48Å; C140-L144 PolarHBondContact O-N 3.4Å; G141-L144 PolarHBondContact O-N 2.99Å; I142-L144 VanDerWaalsContact C-N 3.31Å; I142-L144 PolarHBondContact O-N 2.89Å; L144-A147 PolarHBondContact O-N 3.25Å; L144-F148 WeakPolarHBondContact O-CB 3.49Å; L144-F148 PolarHBondContact O-N 3.47Å |
| 145 | N | 94.3 | Very high | 93.7 | Very high | 17 Ų | 17 | 74.9 Ų | 74.9 | 9% | 0.091 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64.3 | -44.5 | 176.1 | -179.3 | 44.3 | 0 | 0 | 0 | 111.6 | V115 T116 G141 I142 A147 F148 L149 | V115-N145 HydrophobicContact CB-CB 4.23Å; V115-N145 HydrophobicContact CG2-CB 4.37Å; V115-N145 WeakPolarHBondContact O-CB 3.31Å; V115-N145 PolarHBondContact O-ND2 3.16Å; T116-N145 WeakPolarHBondContact CA-ND2 3.49Å; G141-N145 WeakPolarHBondContact O-CB 3.29Å; G141-N145 PolarHBondContact O-N 2.87Å; I142-N145 PolarHBondContact O-N 2.87Å; N145-A147 VanDerWaalsContact C-N 3.31Å; N145-A147 PolarHBondContact O-N 2.88Å; N145-F148 WeakPolarHBondContact O-CB 3.15Å; N145-F148 PolarHBondContact O-N 3.43Å; N145-F148 VanDerWaalsContact O-N 3.14Å; N145-L149 WeakPolarHBondContact O-CG 3.4Å; N145-L149 PolarHBondContact O-N 3.43Å |
| 146 | L | 92.5 | Very high | 93 | Very high | 110 Ų | 110 | 72.5 Ų | 72.5 | 58% | 0.576 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -60.2 | -39.2 | 174.3 | -69.1 | 172.7 | 0 | 0 | 0 | 112.3 | I142 K150 | I142-L146 HydrophobicContact CG2-CD1 4.24Å; I142-L146 WeakPolarHBondContact O-CG 3.31Å; I142-L146 PolarHBondContact O-N 2.89Å; L146-K150 VanDerWaalsContact O-CB 3.3Å; L146-K150 WeakPolarHBondContact O-CB 3.3Å; L146-K150 PolarHBondContact O-N 3.15Å; L146-K150 VanDerWaalsContact O-N 3.09Å |
| 147 | A | 93.3 | Very high | 92.4 | Very high | 58 Ų | 58 | 68.9 Ų | 68.9 | 48% | 0.479 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -67 | -39.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | P143 L144 N145 Q151 | P143-A147 WeakPolarHBondContact O-CB 3.28Å; P143-A147 PolarHBondContact O-N 3.28Å; L144-A147 PolarHBondContact O-N 3.25Å; N145-A147 VanDerWaalsContact C-N 3.31Å; N145-A147 PolarHBondContact O-N 2.88Å; A147-Q151 PolarHBondContact O-N 3.42Å; A147-Q151 VanDerWaalsContact O-N 3.08Å |
| 148 | F | 92.6 | Very high | 91.7 | Very high | 84 Ų | 84 | 69.8 Ų | 69.8 | 37% | 0.368 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64.2 | -51.4 | 175.2 | 172.8 | -94.2 | 0 | 0 | 0 | 111.9 | L144 N145 K150 Q151 M152 I251 | L144-F148 WeakPolarHBondContact O-CB 3.49Å; L144-F148 PolarHBondContact O-N 3.47Å; N145-F148 WeakPolarHBondContact O-CB 3.15Å; N145-F148 PolarHBondContact O-N 3.43Å; N145-F148 VanDerWaalsContact O-N 3.14Å; F148-K150 VanDerWaalsContact C-N 3.29Å; F148-K150 PolarHBondContact O-N 2.92Å; F148-Q151 CarbonylContact O-C 3.58Å; F148-Q151 WeakPolarHBondContact O-CA 3.22Å; F148-Q151 PolarHBondContact O-N 3.13Å; F148-M152 HydrophobicContact CD1-CG 4.09Å; F148-M152 HydrophobicContact CD2-CG 4.41Å; F148-M152 HydrophobicContact CE1-CG 3.54Å; F148-M152 HydrophobicContact CE1-SD 4.44Å; F148-M152 HydrophobicContact CE2-CE 4.08Å; F148-M152 HydrophobicContact CE2-CG 3.92Å; F148-M152 HydrophobicContact CE2-SD 4.08Å; F148-M152 HydrophobicContact CG-CG 4.49Å; F148-M152 HydrophobicContact CZ-CE 4.38Å; F148-M152 HydrophobicContact CZ-CG 3.45Å; F148-M152 VanDerWaalsContact CZ-CG 3.45Å; F148-M152 HydrophobicContact CZ-SD 3.77Å; F148-M152 PolarHBondContact O-N 2.92Å; F148-I251 HydrophobicContact CD1-CG2 4.34Å; F148-I251 HydrophobicContact CE1-CG2 3.52Å; F148-I251 HydrophobicContact CZ-CG2 4.23Å |
| 149 | L | 90.5 | Very high | 91.1 | Very high | 19 Ų | 19 | 73.6 Ų | 73.6 | 10% | 0.099 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -56.9 | -43.2 | 177.3 | -68.8 | 173.6 | 0 | 0 | 0 | 111.2 | N145 Q151 M152 G153 L254 A255 | N145-L149 WeakPolarHBondContact O-CG 3.4Å; N145-L149 PolarHBondContact O-N 3.43Å; L149-Q151 VanDerWaalsContact C-N 3.3Å; L149-Q151 PolarHBondContact O-N 3Å; L149-M152 PolarHBondContact O-N 3.45Å; L149-G153 PolarHBondContact O-N 2.98Å; L149-L254 HydrophobicContact CD1-CB 4.44Å; L149-L254 HydrophobicContact CD2-CB 3.89Å; L149-A255 HydrophobicContact CD2-CB 3.93Å |
| 150 | K | 89.3 | Confident | 90.3 | Very high | 153 Ų | 153 | 68 Ų | 68 | 67% | 0.665 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.1 | -33.8 | 174.6 | -174.3 | 169.6 | -173.2 | 166 | 0 | 113.3 | L146 F148 K154 | L146-K150 VanDerWaalsContact O-CB 3.3Å; L146-K150 WeakPolarHBondContact O-CB 3.3Å; L146-K150 PolarHBondContact O-N 3.15Å; L146-K150 VanDerWaalsContact O-N 3.09Å; F148-K150 VanDerWaalsContact C-N 3.29Å; F148-K150 PolarHBondContact O-N 2.92Å; K150-K154 WeakPolarHBondContact O-CG 3.2Å; K150-K154 PolarHBondContact O-N 3.41Å |
| 151 | Q | 90.3 | Very high | 89.5 | Confident | 107 Ų | 107 | 64.7 Ų | 64.7 | 50% | 0.5 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -79.2 | -33.7 | 176.6 | -174.1 | 60.3 | 18.7 | 0 | 0 | 112.4 | A147 F148 L149 C155 | A147-Q151 PolarHBondContact O-N 3.42Å; A147-Q151 VanDerWaalsContact O-N 3.08Å; F148-Q151 CarbonylContact O-C 3.58Å; F148-Q151 WeakPolarHBondContact O-CA 3.22Å; F148-Q151 PolarHBondContact O-N 3.13Å; L149-Q151 VanDerWaalsContact C-N 3.3Å; L149-Q151 PolarHBondContact O-N 3Å; Q151-C155 WeakPolarHBondContact O-CB 3.37Å; Q151-C155 PolarHBondContact O-N 2.85Å |
| 152 | M | 88.8 | Confident | 88.7 | Confident | 52 Ų | 52 | 72.1 Ų | 72.1 | 26% | 0.256 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -66.2 | -44.7 | 171.2 | -69.3 | -63.9 | 98.1 | 0 | 0 | 111.7 | F148 L149 K154 C155 L156 A255 | F148-M152 HydrophobicContact CD1-CG 4.09Å; F148-M152 HydrophobicContact CD2-CG 4.41Å; F148-M152 HydrophobicContact CE1-CG 3.54Å; F148-M152 HydrophobicContact CE1-SD 4.44Å; F148-M152 HydrophobicContact CE2-CE 4.08Å; F148-M152 HydrophobicContact CE2-CG 3.92Å; F148-M152 HydrophobicContact CE2-SD 4.08Å; F148-M152 HydrophobicContact CG-CG 4.49Å; F148-M152 HydrophobicContact CZ-CE 4.38Å; F148-M152 HydrophobicContact CZ-CG 3.45Å; F148-M152 VanDerWaalsContact CZ-CG 3.45Å; F148-M152 HydrophobicContact CZ-SD 3.77Å; F148-M152 PolarHBondContact O-N 2.92Å; L149-M152 PolarHBondContact O-N 3.45Å; M152-K154 PolarHBondContact O-N 2.9Å; M152-C155 WeakPolarHBondContact O-CA 3.46Å; M152-C155 VanDerWaalsContact O-CB 3.31Å; M152-C155 WeakPolarHBondContact O-CB 3.48Å; M152-C155 PolarHBondContact O-N 3.06Å; M152-L156 WeakPolarHBondContact O-CG 3.4Å; M152-L156 PolarHBondContact O-N 2.88Å; M152-A255 HydrophobicContact CB-CB 3.73Å; M152-A255 HydrophobicContact CG-CB 4.32Å |
| 153 | G | 86.3 | Confident | 87.8 | Confident | 8 Ų | 8 | 73 Ų | 73 | 8% | 0.082 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -53.9 | -51.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L149 C155 L156 T157 | L149-G153 PolarHBondContact O-N 2.98Å; G153-C155 VanDerWaalsContact C-N 3.3Å; G153-C155 PolarHBondContact O-N 3.34Å; G153-L156 PolarHBondContact O-N 3.14Å; G153-L156 VanDerWaalsContact O-N 3.16Å; G153-T157 PolarHBondContact O-N 3.35Å; G153-T157 PolarHBondContact O-OG1 2.96Å |
| 154 | K | 86.4 | Confident | 86.8 | Confident | 113 Ų | 113 | 71.8 Ų | 71.8 | 49% | 0.491 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -55.1 | -41.6 | 173 | -76 | 177 | 177.8 | -178.3 | 0 | 113.5 | K150 M152 T157 I158 | K150-K154 WeakPolarHBondContact O-CG 3.2Å; K150-K154 PolarHBondContact O-N 3.41Å; M152-K154 PolarHBondContact O-N 2.9Å; K154-T157 PolarHBondContact O-N 2.92Å; K154-I158 VanDerWaalsContact O-CG1 3.31Å; K154-I158 WeakPolarHBondContact O-CG1 3.49Å; K154-I158 PolarHBondContact O-N 2.86Å |
| 155 | C | 87.1 | Confident | 85.8 | Confident | 51 Ų | 51 | 70.8 Ų | 70.8 | 35% | 0.345 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -61.6 | -48 | 178.4 | -165 | 0 | 0 | 0 | 0 | 110.4 | Q151 M152 G153 T157 I158 H159 | Q151-C155 WeakPolarHBondContact O-CB 3.37Å; Q151-C155 PolarHBondContact O-N 2.85Å; M152-C155 WeakPolarHBondContact O-CA 3.46Å; M152-C155 VanDerWaalsContact O-CB 3.31Å; M152-C155 WeakPolarHBondContact O-CB 3.48Å; M152-C155 PolarHBondContact O-N 3.06Å; G153-C155 VanDerWaalsContact C-N 3.3Å; G153-C155 PolarHBondContact O-N 3.34Å; C155-T157 PolarHBondContact O-N 3.47Å; C155-I158 WeakPolarHBondContact O-CB 3.38Å; C155-I158 PolarHBondContact O-N 3.46Å; C155-I158 VanDerWaalsContact O-N 3.13Å; C155-H159 PolarHBondContact O-CD2 2.93Å; C155-H159 VanDerWaalsContact O-CD2 3.27Å; C155-H159 PolarHBondContact O-N 2.92Å |
| 156 | L | 83.5 | Confident | 84.8 | Confident | 46 Ų | 46 | 71.9 Ų | 71.9 | 24% | 0.241 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -60.9 | -42 | 176.1 | -67.7 | 163.9 | 0 | 0 | 0 | 112.1 | M152 G153 I158 H159 L160 L259 | M152-L156 WeakPolarHBondContact O-CG 3.4Å; M152-L156 PolarHBondContact O-N 2.88Å; G153-L156 PolarHBondContact O-N 3.14Å; G153-L156 VanDerWaalsContact O-N 3.16Å; L156-I158 VanDerWaalsContact C-N 3.31Å; L156-I158 PolarHBondContact O-N 3.05Å; L156-H159 PolarHBondContact O-N 3.4Å; L156-H159 VanDerWaalsContact O-N 3.12Å; L156-L160 PolarHBondContact O-N 3.37Å; L156-L259 HydrophobicContact CB-CD1 4.05Å; L156-L259 HydrophobicContact CB-CD2 3.83Å; L156-L259 HydrophobicContact CB-CG 4.4Å; L156-L259 HydrophobicContact CD1-CB 4.3Å; L156-L259 HydrophobicContact CD1-CD2 4.27Å |
| 157 | T | 85 | Confident | 83.5 | Confident | 55 Ų | 55 | 68.9 Ų | 68.9 | 34% | 0.337 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -61.3 | -36.8 | 173.5 | -43.7 | 0 | 0 | 0 | 0 | 112.4 | G153 K154 C155 L160 G161 L259 | G153-T157 PolarHBondContact O-N 3.35Å; G153-T157 PolarHBondContact O-OG1 2.96Å; K154-T157 PolarHBondContact O-N 2.92Å; C155-T157 PolarHBondContact O-N 3.47Å; T157-L160 WeakPolarHBondContact O-CB 3.21Å; T157-L160 PolarHBondContact O-N 3.22Å; T157-G161 PolarHBondContact O-N 3.21Å; T157-L259 WeakPolarHBondContact OG1-CD1 3.4Å |
| 158 | I | 85.6 | Confident | 82.3 | Confident | 98 Ų | 98 | 69.2 Ų | 69.2 | 50% | 0.503 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -68.8 | -35.6 | 174.4 | -69.3 | 163.2 | 0 | 0 | 0 | 111.2 | K154 C155 L156 R162 | K154-I158 VanDerWaalsContact O-CG1 3.31Å; K154-I158 WeakPolarHBondContact O-CG1 3.49Å; K154-I158 PolarHBondContact O-N 2.86Å; C155-I158 WeakPolarHBondContact O-CB 3.38Å; C155-I158 PolarHBondContact O-N 3.46Å; C155-I158 VanDerWaalsContact O-N 3.13Å; L156-I158 VanDerWaalsContact C-N 3.31Å; L156-I158 PolarHBondContact O-N 3.05Å; I158-R162 WeakPolarHBondContact O-CB 3.37Å; I158-R162 VanDerWaalsContact O-CG 3.25Å; I158-R162 WeakPolarHBondContact O-CG 3.36Å; I158-R162 PolarHBondContact O-N 3.37Å |
| 159 | H | 83.8 | Confident | 81.1 | Confident | 100 Ų | 100 | 69.4 Ų | 69.4 | 46% | 0.463 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -68.2 | -38.1 | 173.2 | -83.2 | -85.2 | 0 | 0 | 0 | 112.3 | C155 L156 R162 L163 | C155-H159 PolarHBondContact O-CD2 2.93Å; C155-H159 VanDerWaalsContact O-CD2 3.27Å; C155-H159 PolarHBondContact O-N 2.92Å; L156-H159 PolarHBondContact O-N 3.4Å; L156-H159 VanDerWaalsContact O-N 3.12Å; H159-R162 PolarHBondContact O-N 3.03Å; H159-L163 PolarHBondContact O-N 2.8Å |
| 160 | L | 81.4 | Confident | 80.1 | Confident | 2 Ų | 2 | 74 Ų | 74 | 1% | 0.01 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -59.5 | -54.7 | 169.6 | -90.6 | 164.4 | 0 | 0 | 0 | 111.9 | L156 T157 R162 L163 E164 V182 F185 F186 L259 M263 | L156-L160 PolarHBondContact O-N 3.37Å; T157-L160 WeakPolarHBondContact O-CB 3.21Å; T157-L160 PolarHBondContact O-N 3.22Å; L160-R162 PolarHBondContact O-N 2.66Å; L160-R162 VanDerWaalsContact O-N 3.17Å; L160-L163 WeakPolarHBondContact O-CA 3.04Å; L160-L163 VanDerWaalsContact O-CB 3.24Å; L160-L163 WeakPolarHBondContact O-CB 3.32Å; L160-L163 PolarHBondContact O-N 2.82Å; L160-E164 WeakPolarHBondContact O-CG 3.21Å; L160-E164 PolarHBondContact O-N 3.22Å; L160-V182 HydrophobicContact CD2-CG1 4.29Å; L160-V182 HydrophobicContact CD2-CG2 4.34Å; L160-F185 HydrophobicContact CD1-CD1 4.11Å; L160-F185 HydrophobicContact CD1-CE1 3.76Å; L160-F185 HydrophobicContact CD2-CB 4.24Å; L160-F185 HydrophobicContact CD2-CD1 3.49Å; L160-F185 VanDerWaalsContact CD2-CD1 3.49Å; L160-F185 HydrophobicContact CD2-CD2 4.42Å; L160-F185 HydrophobicContact CD2-CE1 3.84Å; L160-F185 HydrophobicContact CD2-CG 3.8Å; L160-F185 HydrophobicContact CD2-CZ 4.44Å; L160-F185 HydrophobicContact CG-CD1 3.85Å; L160-F185 HydrophobicContact CG-CE1 3.62Å; L160-F185 HydrophobicContact CG-CG 4.43Å; L160-F185 HydrophobicContact CG-CZ 4.04Å; L160-F186 HydrophobicContact CD1-CE2 4.38Å; L160-F186 HydrophobicContact CD1-CZ 4.15Å; L160-L259 HydrophobicContact CD1-CD1 4.35Å; L160-L259 HydrophobicContact CD1-CD2 4.13Å; L160-M263 HydrophobicContact CD1-SD 3.81Å |
| 161 | G | 80.8 | Confident | 78.9 | Confident | 23 Ų | 23 | 69.4 Ų | 69.4 | 24% | 0.237 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.7 | -28.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | T157 E164 T165 | T157-G161 PolarHBondContact O-N 3.21Å; G161-E164 WeakPolarHBondContact CA-OE2 3.4Å; G161-T165 VanDerWaalsContact O-CB 3.31Å; G161-T165 WeakPolarHBondContact O-CB 3.42Å; G161-T165 PolarHBondContact O-N 2.94Å; G161-T165 PolarHBondContact O-OG1 2.91Å |
| 162 | R | 81.7 | Confident | 77.3 | Confident | 166 Ų | 166 | 70 Ų | 70 | 63% | 0.626 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -71.3 | -40.1 | 170.4 | -77.8 | 171.4 | 172.1 | -177.7 | -3.1 | 112.6 | I158 H159 L160 G166 | I158-R162 WeakPolarHBondContact O-CB 3.37Å; I158-R162 VanDerWaalsContact O-CG 3.25Å; I158-R162 WeakPolarHBondContact O-CG 3.36Å; I158-R162 PolarHBondContact O-N 3.37Å; H159-R162 PolarHBondContact O-N 3.03Å; L160-R162 PolarHBondContact O-N 2.66Å; L160-R162 VanDerWaalsContact O-N 3.17Å; R162-G166 PolarHBondContact O-N 2.63Å |
| 163 | L | 77.9 | Confident | 75.8 | Confident | 69 Ų | 69 | 74.7 Ų | 74.7 | 36% | 0.361 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60.4 | -54.2 | 173.7 | -167.6 | 83 | 0 | 0 | 0 | 109.8 | H159 L160 T165 G166 M167 | H159-L163 PolarHBondContact O-N 2.8Å; L160-L163 WeakPolarHBondContact O-CA 3.04Å; L160-L163 VanDerWaalsContact O-CB 3.24Å; L160-L163 WeakPolarHBondContact O-CB 3.32Å; L160-L163 PolarHBondContact O-N 2.82Å; L163-T165 PolarHBondContact O-N 3.23Å; L163-G166 PolarHBondContact O-N 2.86Å; L163-M167 HydrophobicContact CB-CE 4.45Å; L163-M167 HydrophobicContact CD2-CE 3.9Å; L163-M167 HydrophobicContact CD2-SD 4.3Å; L163-M167 HydrophobicContact CG-CE 3.72Å; L163-M167 HydrophobicContact CG-SD 3.97Å; L163-M167 WeakPolarHBondContact O-CE 3.33Å; L163-M167 WeakPolarHBondContact O-CG 3.49Å; L163-M167 PolarHBondContact O-N 3.37Å |
| 164 | E | 76.2 | Confident | 75 | Confident | 52 Ų | 52 | 82 Ų | 82 | 24% | 0.243 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -51.1 | -57.1 | 177.2 | -68.9 | 164.6 | 179.5 | 0 | 0 | 111.3 | L160 G161 G166 M167 V168 V182 | L160-E164 WeakPolarHBondContact O-CG 3.21Å; L160-E164 PolarHBondContact O-N 3.22Å; G161-E164 WeakPolarHBondContact CA-OE2 3.4Å; E164-G166 VanDerWaalsContact C-N 3.31Å; E164-G166 PolarHBondContact O-N 3.26Å; E164-M167 PolarHBondContact O-N 3.17Å; E164-V168 WeakPolarHBondContact O-CB 3.41Å; E164-V168 VanDerWaalsContact O-CG2 3.31Å; E164-V168 WeakPolarHBondContact O-CG2 3.35Å; E164-V168 PolarHBondContact O-N 3.28Å; E164-V182 HydrophobicContact CG-CG2 3.9Å; E164-V182 WeakPolarHBondContact OE1-CG2 3.41Å |
| 165 | T | 75 | Confident | 74.4 | Confident | 103 Ų | 103 | 84.6 Ų | 84.6 | 63% | 0.632 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -58.5 | -41.2 | 179.7 | -55.4 | 0 | 0 | 0 | 0 | 112.1 | G161 L163 A169 | G161-T165 VanDerWaalsContact O-CB 3.31Å; G161-T165 WeakPolarHBondContact O-CB 3.42Å; G161-T165 PolarHBondContact O-N 2.94Å; G161-T165 PolarHBondContact O-OG1 2.91Å; L163-T165 PolarHBondContact O-N 3.23Å; T165-A169 PolarHBondContact O-N 3.46Å |
| 166 | G | 72.6 | Confident | 74 | Confident | 41 Ų | 41 | 85.9 Ų | 85.9 | 42% | 0.423 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.2 | -39.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | R162 L163 E164 V170 | R162-G166 PolarHBondContact O-N 2.63Å; L163-G166 PolarHBondContact O-N 2.86Å; E164-G166 VanDerWaalsContact C-N 3.31Å; E164-G166 PolarHBondContact O-N 3.26Å; G166-V170 WeakPolarHBondContact O-CG2 3.27Å |
| 167 | M | 66.5 | Low | 73.8 | Confident | 46 Ų | 46 | 86.1 Ų | 86.1 | 23% | 0.227 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -76.5 | -37.6 | 179 | -65 | 178 | -53.1 | 0 | 0 | 112.5 | L163 E164 A169 V170 V171 A181 | L163-M167 HydrophobicContact CB-CE 4.45Å; L163-M167 HydrophobicContact CD2-CE 3.9Å; L163-M167 HydrophobicContact CD2-SD 4.3Å; L163-M167 HydrophobicContact CG-CE 3.72Å; L163-M167 HydrophobicContact CG-SD 3.97Å; L163-M167 WeakPolarHBondContact O-CE 3.33Å; L163-M167 WeakPolarHBondContact O-CG 3.49Å; L163-M167 PolarHBondContact O-N 3.37Å; E164-M167 PolarHBondContact O-N 3.17Å; M167-A169 PolarHBondContact O-N 3.14Å; M167-V170 PolarHBondContact O-N 2.83Å; M167-V171 PolarHBondContact O-N 3.36Å; M167-A181 HydrophobicContact CE-CB 3.28Å; M167-A181 HydrophobicContact SD-CB 3.35Å; M167-A181 WeakPolarHBondContact SD-CB 3.36Å |
| 168 | V | 67.4 | Low | 73.4 | Confident | 65 Ų | 65 | 86.5 Ų | 86.5 | 39% | 0.394 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.5 | -26.8 | 175.6 | 169.6 | 0 | 0 | 0 | 0 | 111.8 | E164 V170 | E164-V168 WeakPolarHBondContact O-CB 3.41Å; E164-V168 VanDerWaalsContact O-CG2 3.31Å; E164-V168 WeakPolarHBondContact O-CG2 3.35Å; E164-V168 PolarHBondContact O-N 3.28Å; V168-V170 VanDerWaalsContact C-N 3.28Å; V168-V170 PolarHBondContact O-N 2.89Å |
| 169 | A | 67.2 | Low | 73.2 | Confident | 88 Ų | 88 | 84.4 Ų | 84.4 | 73% | 0.727 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.9 | -15.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | T165 M167 | T165-A169 PolarHBondContact O-N 3.46Å; M167-A169 PolarHBondContact O-N 3.14Å |
| 170 | V | 69.3 | Low | 73.3 | Confident | 115 Ų | 115 | 84.7 Ų | 84.7 | 70% | 0.697 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.8 | -33.4 | -173.1 | 176.5 | 0 | 0 | 0 | 0 | 113 | G166 M167 V168 | G166-V170 WeakPolarHBondContact O-CG2 3.27Å; M167-V170 PolarHBondContact O-N 2.83Å; V168-V170 VanDerWaalsContact C-N 3.28Å; V168-V170 PolarHBondContact O-N 2.89Å |
| 171 | V | 64.3 | Low | 73.3 | Confident | 57 Ų | 57 | 85.2 Ų | 85.2 | 35% | 0.345 | 49% | 0.485 | S | S | . | . | trans | -117.8 | 117.5 | -167.7 | -169.9 | 0 | 0 | 0 | 0 | 113.6 | M167 H173 V177 | M167-V171 PolarHBondContact O-N 3.36Å; V171-H173 PolarHBondContact O-N 3.22Å; V171-V177 HydrophobicContact CB-CG1 4.3Å; V171-V177 HydrophobicContact CG1-CB 4.46Å; V171-V177 HydrophobicContact CG1-CG1 4.17Å; V171-V177 HydrophobicContact CG1-CG2 3.95Å; V171-V177 HydrophobicContact CG2-CG1 4.38Å | ||
| 172 | P | 56.4 | Low | 73.5 | Confident | 119 Ų | 119 | 85.3 Ų | 85.3 | 77% | 0.773 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -81 | 42.6 | -175.9 | 34 | -37.1 | 0 | 0 | 0 | 115.2 | ||
| 173 | H | 57.3 | Low | 73.7 | Confident | 151 Ų | 151 | 80.4 Ų | 80.4 | 70% | 0.699 | 47% | 0.472 | S | S | * | . | trans | -140.3 | 87.7 | 168.1 | -94.2 | -66.2 | 0 | 0 | 0 | 111.3 | V171 K175 V177 | V171-H173 PolarHBondContact O-N 3.22Å; H173-K175 PolarHBondContact O-N 3.38Å; H173-V177 HydrophobicContact CB-CG2 4.38Å | ||
| 174 | K | 69.9 | Low | 74.3 | Confident | 161 Ų | 161 | 81.6 Ų | 81.6 | 70% | 0.7 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | -32.1 | -147.8 | -65.8 | -171.1 | 174.1 | -173.4 | 0 | 118.5 | E178 | K174-E178 WeakPolarHBondContact O-CB 3.34Š|
| 175 | K | 73.9 | Confident | 74.8 | Confident | 169 Ų | 169 | 81.7 Ų | 81.7 | 74% | 0.735 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.2 | -36.5 | -171.7 | -70.4 | -159.6 | 171.7 | -162 | 0 | 115.9 | H173 A179 | H173-K175 PolarHBondContact O-N 3.38Å; K175-A179 WeakPolarHBondContact O-CB 3.35Å; K175-A179 PolarHBondContact O-N 2.68Å |
| 176 | A | 79.3 | Confident | 75.6 | Confident | 78 Ų | 78 | 79 Ų | 79 | 65% | 0.645 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -69.7 | -38.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L180 | A176-L180 WeakPolarHBondContact O-CB 3.31Å; A176-L180 PolarHBondContact O-N 3.43Å |
| 177 | V | 78.2 | Confident | 76.5 | Confident | 50 Ų | 50 | 82.3 Ų | 82.3 | 30% | 0.303 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -71.5 | -41.3 | 178.9 | -177.9 | 0 | 0 | 0 | 0 | 111.2 | V171 H173 L180 A181 | V171-V177 HydrophobicContact CB-CG1 4.3Å; V171-V177 HydrophobicContact CG1-CB 4.46Å; V171-V177 HydrophobicContact CG1-CG1 4.17Å; V171-V177 HydrophobicContact CG1-CG2 3.95Å; V171-V177 HydrophobicContact CG2-CG1 4.38Å; H173-V177 HydrophobicContact CB-CG2 4.38Å; V177-L180 PolarHBondContact O-N 3.4Å; V177-A181 VanDerWaalsContact O-CB 3.32Å; V177-A181 WeakPolarHBondContact O-CB 3.17Å; V177-A181 PolarHBondContact O-N 3.09Å |
| 178 | E | 77.7 | Confident | 77.7 | Confident | 64 Ų | 64 | 84.4 Ų | 84.4 | 30% | 0.299 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.5 | -56.5 | 173.2 | 179.7 | 179.1 | -124.7 | 0 | 0 | 111 | K174 L180 A181 V182 | K174-E178 WeakPolarHBondContact O-CB 3.34Å; E178-L180 VanDerWaalsContact C-N 3.34Å; E178-L180 PolarHBondContact O-N 2.88Å; E178-A181 PolarHBondContact O-N 3.07Å; E178-V182 WeakPolarHBondContact O-CG2 3.46Å; E178-V182 PolarHBondContact O-N 2.81Å |
| 179 | A | 81.5 | Confident | 78.9 | Confident | 54 Ų | 54 | 81.7 Ų | 81.7 | 45% | 0.446 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -60.6 | -39.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | K175 S183 | K175-A179 WeakPolarHBondContact O-CB 3.35Å; K175-A179 PolarHBondContact O-N 2.68Å; A179-S183 WeakPolarHBondContact O-CB 3.28Å; A179-S183 PolarHBondContact O-N 3.11Å; A179-S183 PolarHBondContact O-OG 2.79Å |
| 180 | L | 84.6 | Confident | 80 | Confident | 105 Ų | 105 | 78.9 Ų | 78.9 | 55% | 0.55 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -65.7 | -41.4 | 177 | 177.9 | 143.2 | 0 | 0 | 0 | 111.6 | A176 V177 E178 S183 L184 | A176-L180 WeakPolarHBondContact O-CB 3.31Å; A176-L180 PolarHBondContact O-N 3.43Å; V177-L180 PolarHBondContact O-N 3.4Å; E178-L180 VanDerWaalsContact C-N 3.34Å; E178-L180 PolarHBondContact O-N 2.88Å; L180-S183 WeakPolarHBondContact O-CB 3.41Å; L180-S183 PolarHBondContact O-N 3.14Å; L180-L184 HydrophobicContact CD2-CD1 3.66Å; L180-L184 HydrophobicContact CD2-CG 4.35Å; L180-L184 HydrophobicContact CG-CD1 4.49Å; L180-L184 WeakPolarHBondContact O-CG 3.37Å; L180-L184 PolarHBondContact O-N 3.43Å |
| 181 | A | 82.5 | Confident | 81.2 | Confident | 14 Ų | 14 | 77.8 Ų | 77.8 | 12% | 0.116 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -73.7 | -37.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113 | M167 V177 E178 S183 L184 F185 | M167-A181 HydrophobicContact CE-CB 3.28Å; M167-A181 HydrophobicContact SD-CB 3.35Å; M167-A181 WeakPolarHBondContact SD-CB 3.36Å; V177-A181 VanDerWaalsContact O-CB 3.32Å; V177-A181 WeakPolarHBondContact O-CB 3.17Å; V177-A181 PolarHBondContact O-N 3.09Å; E178-A181 PolarHBondContact O-N 3.07Å; A181-S183 VanDerWaalsContact C-N 3.33Å; A181-L184 PolarHBondContact O-N 2.84Å; A181-F185 PolarHBondContact O-N 3.2Å |
| 182 | V | 83.4 | Confident | 82.6 | Confident | 24 Ų | 24 | 79.4 Ų | 79.4 | 15% | 0.145 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -62 | -42.4 | 169 | 173.8 | 0 | 0 | 0 | 0 | 110.4 | L160 E164 E178 L184 F185 F186 | L160-V182 HydrophobicContact CD2-CG1 4.29Å; L160-V182 HydrophobicContact CD2-CG2 4.34Å; E164-V182 HydrophobicContact CG-CG2 3.9Å; E164-V182 WeakPolarHBondContact OE1-CG2 3.41Å; E178-V182 WeakPolarHBondContact O-CG2 3.46Å; E178-V182 PolarHBondContact O-N 2.81Å; V182-L184 PolarHBondContact O-N 3.25Å; V182-F185 WeakPolarHBondContact O-CB 3.29Å; V182-F185 PolarHBondContact O-N 3.37Å; V182-F186 HydrophobicContact CG1-CD2 3.8Å; V182-F186 HydrophobicContact CG1-CE2 3.73Å; V182-F186 WeakPolarHBondContact O-CD2 3.43Å; V182-F186 PolarHBondContact O-N 2.89Å |
| 183 | S | 87.4 | Confident | 84.4 | Confident | 64 Ų | 64 | 75.8 Ų | 75.8 | 45% | 0.448 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.6 | -44.1 | 173.8 | -58.1 | 0 | 0 | 0 | 0 | 111.9 | A179 L180 A181 F185 F186 I187 | A179-S183 WeakPolarHBondContact O-CB 3.28Å; A179-S183 PolarHBondContact O-N 3.11Å; A179-S183 PolarHBondContact O-OG 2.79Å; L180-S183 WeakPolarHBondContact O-CB 3.41Å; L180-S183 PolarHBondContact O-N 3.14Å; A181-S183 VanDerWaalsContact C-N 3.33Å; S183-F185 PolarHBondContact O-N 3.35Å; S183-F186 PolarHBondContact O-N 3.48Å; S183-I187 WeakPolarHBondContact O-CB 3.37Å; S183-I187 WeakPolarHBondContact O-CD1 3.44Å; S183-I187 VanDerWaalsContact O-CG1 3.23Å; S183-I187 WeakPolarHBondContact O-CG1 3.2Å; S183-I187 PolarHBondContact O-N 2.89Å |
| 184 | L | 89.1 | Confident | 86.1 | Confident | 93 Ų | 93 | 70.8 Ų | 70.8 | 49% | 0.487 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.3 | -38.7 | 176.2 | -75.5 | 174.2 | 0 | 0 | 0 | 112.4 | L180 A181 V182 I187 T188 | L180-L184 HydrophobicContact CD2-CD1 3.66Å; L180-L184 HydrophobicContact CD2-CG 4.35Å; L180-L184 HydrophobicContact CG-CD1 4.49Å; L180-L184 WeakPolarHBondContact O-CG 3.37Å; L180-L184 PolarHBondContact O-N 3.43Å; A181-L184 PolarHBondContact O-N 2.84Å; V182-L184 PolarHBondContact O-N 3.25Å; L184-I187 PolarHBondContact O-N 3.22Å; L184-T188 VanDerWaalsContact O-CB 3.24Å; L184-T188 WeakPolarHBondContact O-CB 3.22Å; L184-T188 PolarHBondContact O-N 2.87Å; L184-T188 PolarHBondContact O-OG1 3.18Å |
| 185 | F | 88.4 | Confident | 87.3 | Confident | 55 Ų | 55 | 65.4 Ų | 65.4 | 24% | 0.241 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -60 | -48.5 | 172.8 | 177.9 | -89.7 | 0 | 0 | 0 | 111.2 | L160 A181 V182 S183 T188 G189 W256 L259 | L160-F185 HydrophobicContact CD1-CD1 4.11Å; L160-F185 HydrophobicContact CD1-CE1 3.76Å; L160-F185 HydrophobicContact CD2-CB 4.24Å; L160-F185 HydrophobicContact CD2-CD1 3.49Å; L160-F185 VanDerWaalsContact CD2-CD1 3.49Å; L160-F185 HydrophobicContact CD2-CD2 4.42Å; L160-F185 HydrophobicContact CD2-CE1 3.84Å; L160-F185 HydrophobicContact CD2-CG 3.8Å; L160-F185 HydrophobicContact CD2-CZ 4.44Å; L160-F185 HydrophobicContact CG-CD1 3.85Å; L160-F185 HydrophobicContact CG-CE1 3.62Å; L160-F185 HydrophobicContact CG-CG 4.43Å; L160-F185 HydrophobicContact CG-CZ 4.04Å; A181-F185 PolarHBondContact O-N 3.2Å; V182-F185 WeakPolarHBondContact O-CB 3.29Å; V182-F185 PolarHBondContact O-N 3.37Å; S183-F185 PolarHBondContact O-N 3.35Å; F185-T188 PolarHBondContact O-N 3.46Å; F185-G189 PolarHBondContact O-N 3.44Å; F185-W256 AromaticContact CD1-CH2 3.76Å; F185-W256 HydrophobicContact CD1-CH2 3.76Å; F185-W256 HydrophobicContact CD1-CZ3 4.2Å; F185-W256 AromaticContact CE1-CH2 3.48Å; F185-W256 HydrophobicContact CE1-CH2 3.48Å; F185-W256 VanDerWaalsContact CE1-CH2 3.48Å; F185-W256 AromaticContact CE1-CZ3 3.45Å; F185-W256 HydrophobicContact CE1-CZ3 3.45Å; F185-W256 VanDerWaalsContact CE1-CZ3 3.45Å; F185-W256 HydrophobicContact CZ-CH2 4.21Å; F185-W256 AromaticContact CZ-CZ3 3.82Å; F185-W256 HydrophobicContact CZ-CZ3 3.82Å; F185-L259 HydrophobicContact CE1-CD2 4.11Å |
| 186 | F | 90.4 | Very high | 88.3 | Confident | 46 Ų | 46 | 61.4 Ų | 61.4 | 20% | 0.202 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -64.8 | -39.9 | 177.7 | -82.4 | -65.4 | 0 | 0 | 0 | 113.5 | L160 V182 S183 S190 W256 L259 I260 M263 | L160-F186 HydrophobicContact CD1-CE2 4.38Å; L160-F186 HydrophobicContact CD1-CZ 4.15Å; V182-F186 HydrophobicContact CG1-CD2 3.8Å; V182-F186 HydrophobicContact CG1-CE2 3.73Å; V182-F186 WeakPolarHBondContact O-CD2 3.43Å; V182-F186 PolarHBondContact O-N 2.89Å; S183-F186 PolarHBondContact O-N 3.48Å; F186-S190 WeakPolarHBondContact O-CB 3.41Å; F186-S190 PolarHBondContact O-N 2.66Å; F186-S190 PolarHBondContact O-OG 2.98Å; F186-W256 HydrophobicContact CD1-CH2 4.03Å; F186-W256 AromaticContact CD1-CZ2 3.85Å; F186-W256 HydrophobicContact CD1-CZ2 3.85Å; F186-L259 HydrophobicContact CE1-CD2 4Å; F186-L259 HydrophobicContact CE1-CG 4.26Å; F186-L259 HydrophobicContact CZ-CD2 4.39Å; F186-I260 HydrophobicContact CD1-CD1 4.49Å; F186-I260 HydrophobicContact CD1-CG1 3.87Å; F186-I260 HydrophobicContact CE1-CG1 3.74Å; F186-M263 HydrophobicContact CE2-SD 4.2Å; F186-M263 HydrophobicContact CZ-CG 4.37Å; F186-M263 HydrophobicContact CZ-SD 3.71Å |
| 187 | I | 91.8 | Very high | 89.1 | Confident | 111 Ų | 111 | 58.2 Ų | 58.2 | 57% | 0.569 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -63.2 | -46.2 | 174.8 | -70.1 | 162.8 | 0 | 0 | 0 | 110.4 | S183 L184 S190 L191 | S183-I187 WeakPolarHBondContact O-CB 3.37Å; S183-I187 WeakPolarHBondContact O-CD1 3.44Å; S183-I187 VanDerWaalsContact O-CG1 3.23Å; S183-I187 WeakPolarHBondContact O-CG1 3.2Å; S183-I187 PolarHBondContact O-N 2.89Å; L184-I187 PolarHBondContact O-N 3.22Å; I187-S190 PolarHBondContact O-N 3.46Å; I187-L191 WeakPolarHBondContact O-CB 3.3Å; I187-L191 PolarHBondContact O-N 2.73Å |
| 188 | T | 91.6 | Very high | 90 | Very high | 89 Ų | 89 | 55.9 Ų | 55.9 | 55% | 0.546 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -67.8 | -45.8 | -176.5 | -55.3 | 0 | 0 | 0 | 0 | 111.9 | L184 F185 L191 L192 | L184-T188 VanDerWaalsContact O-CB 3.24Å; L184-T188 WeakPolarHBondContact O-CB 3.22Å; L184-T188 PolarHBondContact O-N 2.87Å; L184-T188 PolarHBondContact O-OG1 3.18Å; F185-T188 PolarHBondContact O-N 3.46Å; T188-L191 PolarHBondContact O-N 3.44Å; T188-L192 WeakPolarHBondContact O-CB 3.34Å; T188-L192 PolarHBondContact O-N 3.42Å |
| 189 | G | 91.8 | Very high | 90.9 | Very high | 8 Ų | 8 | 57.4 Ų | 57.4 | 8% | 0.082 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -67.5 | -36.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | F185 L192 F193 W256 | F185-G189 PolarHBondContact O-N 3.44Å; G189-L192 PolarHBondContact O-N 2.94Å; G189-F193 WeakPolarHBondContact O-CD2 3.18Å; G189-F193 PolarHBondContact O-N 2.85Å; G189-W256 VanDerWaalsContact C-CE2 3.45Å; G189-W256 VanDerWaalsContact CA-CZ2 3.44Å |
| 190 | S | 92.3 | Very high | 91.6 | Very high | 30 Ų | 30 | 59.5 Ų | 59.5 | 21% | 0.21 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -68.7 | -37.7 | 175.8 | -56.8 | 0 | 0 | 0 | 0 | 111.9 | F186 I187 L192 L194 W256 | F186-S190 WeakPolarHBondContact O-CB 3.41Å; F186-S190 PolarHBondContact O-N 2.66Å; F186-S190 PolarHBondContact O-OG 2.98Å; I187-S190 PolarHBondContact O-N 3.46Å; S190-L192 VanDerWaalsContact C-N 3.34Å; S190-L194 WeakPolarHBondContact O-CA 3.17Å; S190-L194 WeakPolarHBondContact O-CB 3.07Å; S190-L194 PolarHBondContact O-N 3.3Å; S190-W256 PolarHBondContact OG-NE1 2.94Å |
| 191 | L | 93.9 | Very high | 92.2 | Very high | 91 Ų | 91 | 54.8 Ų | 54.8 | 48% | 0.476 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60.4 | -45.4 | 170.4 | -169.1 | 77.3 | 0 | 0 | 0 | 111 | I187 T188 V195 I196 | I187-L191 WeakPolarHBondContact O-CB 3.3Å; I187-L191 PolarHBondContact O-N 2.73Å; T188-L191 PolarHBondContact O-N 3.44Å; L191-V195 HydrophobicContact CD1-CB 3.94Å; L191-V195 HydrophobicContact CD1-CG1 4.03Å; L191-V195 HydrophobicContact CD1-CG2 4.24Å; L191-V195 PolarHBondContact O-N 2.99Å; L191-I196 HydrophobicContact CG-CD1 4.44Å; L191-I196 HydrophobicContact CG-CG1 4.47Å; L191-I196 PolarHBondContact O-N 3.47Å |
| 192 | L | 94.1 | Very high | 92.9 | Very high | 91 Ų | 91 | 55.5 Ų | 55.5 | 48% | 0.476 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -65 | -41.3 | -178.9 | -179.1 | 63 | 0 | 0 | 0 | 113.7 | T188 G189 S190 P197 | T188-L192 WeakPolarHBondContact O-CB 3.34Å; T188-L192 PolarHBondContact O-N 3.42Å; G189-L192 PolarHBondContact O-N 2.94Å; S190-L192 VanDerWaalsContact C-N 3.34Å; L192-P197 VanDerWaalsContact O-CD 3.28Å; L192-P197 WeakPolarHBondContact O-CD 3.29Å; L192-P197 WeakPolarHBondContact O-CG 3.35Å |
| 193 | F | 93.4 | Very high | 93.5 | Very high | 44 Ų | 44 | 63.8 Ų | 63.8 | 19% | 0.193 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -98.7 | -23.9 | -174.1 | -67.6 | -62.6 | 0 | 0 | 0 | 114.6 | G189 W249 F252 A253 W256 | G189-F193 WeakPolarHBondContact O-CD2 3.18Å; G189-F193 PolarHBondContact O-N 2.85Å; F193-W249 PolarHBondContact O-NE1 3.04Å; F193-F252 HydrophobicContact CD1-CB 4.38Å; F193-F252 HydrophobicContact CE1-CB 3.72Å; F193-F252 HydrophobicContact CZ-CB 4.34Å; F193-A253 HydrophobicContact CB-CB 4.03Å; F193-A253 HydrophobicContact CD1-CB 4.27Å; F193-A253 HydrophobicContact CG-CB 4.45Å; F193-W256 HydrophobicContact CB-CB 4.41Å; F193-W256 HydrophobicContact CB-CG 4.27Å; F193-W256 HydrophobicContact CD2-CB 3.68Å; F193-W256 AromaticContact CD2-CD1 4Å; F193-W256 AromaticContact CD2-CD2 3.73Å; F193-W256 HydrophobicContact CD2-CD2 3.73Å; F193-W256 HydrophobicContact CD2-CE3 4.12Å; F193-W256 AromaticContact CD2-CG 3.5Å; F193-W256 HydrophobicContact CD2-CG 3.5Å; F193-W256 VanDerWaalsContact CD2-CG 3.5Å; F193-W256 HydrophobicContact CE2-CB 4.2Å; F193-W256 HydrophobicContact CE2-CD2 4.18Å; F193-W256 HydrophobicContact CE2-CE3 4.08Å; F193-W256 HydrophobicContact CE2-CG 4.22Å; F193-W256 HydrophobicContact CG-CB 4.12Å; F193-W256 HydrophobicContact CG-CG 4.18Å |
| 194 | L | 93.8 | Very high | 93.9 | Very high | 45 Ų | 45 | 63 Ų | 63 | 24% | 0.236 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -118.3 | -12.4 | -171.7 | -46.5 | 177.6 | 0 | 0 | 0 | 114.7 | S190 P198 L220 L257 | S190-L194 WeakPolarHBondContact O-CA 3.17Å; S190-L194 WeakPolarHBondContact O-CB 3.07Å; S190-L194 PolarHBondContact O-N 3.3Å; L194-P198 WeakPolarHBondContact O-CG 3.1Å; L194-L220 HydrophobicContact CD2-CD1 3.57Å; L194-L257 HydrophobicContact CD1-CD2 4.21Å; L194-L257 HydrophobicContact CD2-CD2 4.22Å; L194-L257 HydrophobicContact CD2-CG 4.42Å |
| 195 | V | 93.9 | Very high | 94.1 | Very high | 49 Ų | 49 | 58.8 Ų | 58.8 | 30% | 0.297 | 30% | 0.303 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -122.4 | -47.6 | -176.6 | -174.9 | 0 | 0 | 0 | 0 | 112.8 | L191 P198 L199 | L191-V195 HydrophobicContact CD1-CB 3.94Å; L191-V195 HydrophobicContact CD1-CG1 4.03Å; L191-V195 HydrophobicContact CD1-CG2 4.24Å; L191-V195 PolarHBondContact O-N 2.99Å; V195-P198 WeakPolarHBondContact O-CD 3.34Å; V195-L199 PolarHBondContact O-N 3.38Å |
| 196 | I | 95.4 | Very high | 94.5 | Very high | 84 Ų | 84 | 59 Ų | 59 | 43% | 0.431 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60.9 | -40.6 | 175.7 | -70.3 | 175.1 | 0 | 0 | 0 | 112.3 | L191 L199 L200 | L191-I196 HydrophobicContact CG-CD1 4.44Å; L191-I196 HydrophobicContact CG-CG1 4.47Å; L191-I196 PolarHBondContact O-N 3.47Å; I196-L199 WeakPolarHBondContact O-CB 3.37Å; I196-L199 PolarHBondContact O-N 3.3Å; I196-L200 PolarHBondContact O-N 3.27Å; I196-L200 VanDerWaalsContact O-N 3.08Å |
| 197 | P | 96.4 | Very high | 94.8 | Very high | 12 Ų | 12 | 58.7 Ų | 58.7 | 8% | 0.078 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -67.2 | -44.9 | 179.9 | -22.4 | 37.2 | 0 | 0 | 0 | 113.2 | L192 L199 L200 F201 W249 | L192-P197 VanDerWaalsContact O-CD 3.28Å; L192-P197 WeakPolarHBondContact O-CD 3.29Å; L192-P197 WeakPolarHBondContact O-CG 3.35Å; P197-L199 VanDerWaalsContact C-N 3.3Å; P197-L199 PolarHBondContact O-N 2.88Å; P197-L200 WeakPolarHBondContact O-CA 3.43Å; P197-L200 WeakPolarHBondContact O-CB 3.5Å; P197-L200 PolarHBondContact O-N 3.08Å; P197-F201 VanDerWaalsContact C-CD2 3.45Å; P197-F201 HydrophobicContact CB-CD2 4.38Å; P197-F201 HydrophobicContact CB-CE2 3.77Å; P197-F201 HydrophobicContact CB-CZ 4.41Å; P197-F201 WeakPolarHBondContact O-CD2 3.07Å; P197-F201 WeakPolarHBondContact O-CG 3.22Å; P197-F201 PolarHBondContact O-N 2.64Å; P197-W249 HydrophobicContact CB-CD2 4.17Å; P197-W249 HydrophobicContact CB-CG 4.36Å; P197-W249 HydrophobicContact CB-CZ2 4.02Å; P197-W249 HydrophobicContact CG-CG 4.46Å; P197-W249 VanDerWaalsContact CG-NE1 3.32Å |
| 198 | P | 96.7 | Very high | 95.1 | Very high | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -52.6 | -38.7 | 167.1 | -33.4 | 39.1 | 0 | 0 | 0 | 115.4 | L194 V195 L200 F201 S202 F209 A212 F213 A216 | L194-P198 WeakPolarHBondContact O-CG 3.1Å; V195-P198 WeakPolarHBondContact O-CD 3.34Å; P198-L200 VanDerWaalsContact C-N 3.34Å; P198-F201 PolarHBondContact O-N 3.23Å; P198-S202 VanDerWaalsContact O-CB 3.29Å; P198-S202 WeakPolarHBondContact O-CB 3.44Å; P198-S202 PolarHBondContact O-N 3.25Å; P198-F209 HydrophobicContact CB-CD2 4.27Å; P198-F209 HydrophobicContact CB-CE2 3.78Å; P198-A212 HydrophobicContact CB-CB 4.38Å; P198-A212 WeakPolarHBondContact O-CB 3.16Å; P198-F213 HydrophobicContact CB-CB 4.28Å; P198-F213 HydrophobicContact CG-CD2 4.22Å; P198-A216 HydrophobicContact CG-CB 3.68Å |
| 199 | L | 96.8 | Very high | 95.3 | Very high | 97 Ų | 97 | 57.4 Ų | 57.4 | 51% | 0.508 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.1 | -39.8 | 174.4 | -69.5 | 167.5 | 0 | 0 | 0 | 111.8 | V195 I196 P197 Y203 F209 | V195-L199 PolarHBondContact O-N 3.38Å; I196-L199 WeakPolarHBondContact O-CB 3.37Å; I196-L199 PolarHBondContact O-N 3.3Å; P197-L199 VanDerWaalsContact C-N 3.3Å; P197-L199 PolarHBondContact O-N 2.88Å; L199-Y203 PolarHBondContact O-N 3.41Å; L199-Y203 VanDerWaalsContact O-N 3.14Å; L199-F209 HydrophobicContact CD2-CD2 3.59Å; L199-F209 HydrophobicContact CD2-CE2 3.74Å; L199-F209 HydrophobicContact CG-CD2 4.09Å; L199-F209 HydrophobicContact CG-CE2 3.83Å |
| 200 | L | 96.3 | Very high | 95.6 | Very high | 97 Ų | 97 | 59.3 Ų | 59.3 | 51% | 0.508 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -67.9 | -42.8 | 175.6 | -176.2 | 66.4 | 0 | 0 | 0 | 112.2 | I196 P197 P198 Y203 V204 | I196-L200 PolarHBondContact O-N 3.27Å; I196-L200 VanDerWaalsContact O-N 3.08Å; P197-L200 WeakPolarHBondContact O-CA 3.43Å; P197-L200 WeakPolarHBondContact O-CB 3.5Å; P197-L200 PolarHBondContact O-N 3.08Å; P198-L200 VanDerWaalsContact C-N 3.34Å; L200-Y203 PolarHBondContact O-N 3.28Å; L200-V204 HydrophobicContact CD1-CG2 4.16Å; L200-V204 HydrophobicContact CG-CG2 4.47Å; L200-V204 WeakPolarHBondContact O-CG2 3.43Å; L200-V204 PolarHBondContact O-N 2.94Å |
| 201 | F | 96.8 | Very high | 95.8 | Very high | 7 Ų | 7 | 61.1 Ų | 61.1 | 3% | 0.031 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 176.4 | -61.5 | -50.2 | 0 | 0 | 0 | 111.3 | P197 P198 Y203 V204 E205 W207 A212 F215 V230 Y242 A246 W249 | P197-F201 VanDerWaalsContact C-CD2 3.45Å; P197-F201 HydrophobicContact CB-CD2 4.38Å; P197-F201 HydrophobicContact CB-CE2 3.77Å; P197-F201 HydrophobicContact CB-CZ 4.41Å; P197-F201 WeakPolarHBondContact O-CD2 3.07Å; P197-F201 WeakPolarHBondContact O-CG 3.22Å; P197-F201 PolarHBondContact O-N 2.64Å; P198-F201 PolarHBondContact O-N 3.23Å; F201-Y203 VanDerWaalsContact C-N 3.29Å; F201-Y203 PolarHBondContact O-N 3.29Å; F201-V204 PolarHBondContact O-N 3.47Å; F201-E205 WeakPolarHBondContact O-CA 3.49Å; F201-E205 WeakPolarHBondContact O-CB 3.22Å; F201-E205 WeakPolarHBondContact O-CG 3.46Å; F201-E205 PolarHBondContact O-N 2.87Å; F201-W207 HydrophobicContact CB-CE3 4.35Å; F201-W207 HydrophobicContact CB-CZ3 4.31Å; F201-A212 HydrophobicContact CB-CB 4.09Å; F201-F215 HydrophobicContact CD1-CE1 4.49Å; F201-F215 AromaticContact CD2-CD1 3.97Å; F201-F215 HydrophobicContact CD2-CD1 3.97Å; F201-F215 AromaticContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CE2-CD1 4.38Å; F201-F215 AromaticContact CE2-CE1 3.92Å; F201-F215 HydrophobicContact CE2-CE1 3.92Å; F201-F215 HydrophobicContact CG-CD1 4.33Å; F201-F215 HydrophobicContact CG-CE1 4.23Å; F201-F215 HydrophobicContact CZ-CE1 4.24Å; F201-V230 HydrophobicContact CD1-CG1 3.62Å; F201-V230 HydrophobicContact CE1-CG1 3.83Å; F201-V230 HydrophobicContact CG-CG1 4.34Å; F201-Y242 WeakPolarHBondContact CD1-OH 3.28Å; F201-A246 HydrophobicContact CE1-CB 4.36Å; F201-W249 HydrophobicContact CE2-CD2 4.18Å; F201-W249 AromaticContact CE2-CE3 3.74Å; F201-W249 HydrophobicContact CE2-CE3 3.74Å; F201-W249 AromaticContact CE2-CH2 3.65Å; F201-W249 HydrophobicContact CE2-CH2 3.65Å; F201-W249 HydrophobicContact CE2-CZ2 4.06Å; F201-W249 AromaticContact CE2-CZ3 3.47Å; F201-W249 HydrophobicContact CE2-CZ3 3.47Å; F201-W249 VanDerWaalsContact CE2-CZ3 3.47Å; F201-W249 HydrophobicContact CZ-CD2 4.09Å; F201-W249 AromaticContact CZ-CE3 3.49Å; F201-W249 HydrophobicContact CZ-CE3 3.49Å; F201-W249 VanDerWaalsContact CZ-CE3 3.49Å; F201-W249 HydrophobicContact CZ-CH2 4.24Å; F201-W249 AromaticContact CZ-CZ3 3.59Å; F201-W249 HydrophobicContact CZ-CZ3 3.59Å |
| 202 | S | 97.2 | Very high | 96 | Very high | 28 Ų | 28 | 56.8 Ų | 56.8 | 20% | 0.196 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -55.7 | -42.8 | 173.8 | 177.4 | 0 | 0 | 0 | 0 | 112.3 | P198 G206 W207 F209 | P198-S202 VanDerWaalsContact O-CB 3.29Å; P198-S202 WeakPolarHBondContact O-CB 3.44Å; P198-S202 PolarHBondContact O-N 3.25Å; S202-G206 CarbonylContact O-C 3.54Å; S202-G206 VanDerWaalsContact O-CA 3.27Å; S202-G206 WeakPolarHBondContact O-CA 3.38Å; S202-G206 PolarHBondContact O-N 2.86Å; S202-G206 VanDerWaalsContact O-N 3.08Å; S202-W207 VanDerWaalsContact CA-O 3.29Å; S202-W207 WeakPolarHBondContact CA-O 3.03Å; S202-W207 WeakPolarHBondContact CB-O 3.48Å; S202-W207 PolarHBondContact O-N 3.41Å; S202-W207 PolarHBondContact OG-O 3.35Å; S202-F209 PolarHBondContact OG-N 3.29Å |
| 203 | Y | 95.4 | Very high | 96.2 | Very high | 199 Ų | 199 | 57 Ų | 57 | 78% | 0.78 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -69.2 | -47.6 | 177.6 | 179.8 | -104.8 | 0 | 0 | 0 | 113.7 | L199 L200 F201 | L199-Y203 PolarHBondContact O-N 3.41Å; L199-Y203 VanDerWaalsContact O-N 3.14Å; L200-Y203 PolarHBondContact O-N 3.28Å; F201-Y203 VanDerWaalsContact C-N 3.29Å; F201-Y203 PolarHBondContact O-N 3.29Å |
| 204 | V | 95.7 | Very high | 96.4 | Very high | 46 Ų | 46 | 58.9 Ų | 58.9 | 28% | 0.279 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -76 | -43.8 | -175 | 176.6 | 0 | 0 | 0 | 0 | 111.8 | L200 F201 G206 Y238 Y242 | L200-V204 HydrophobicContact CD1-CG2 4.16Å; L200-V204 HydrophobicContact CG-CG2 4.47Å; L200-V204 WeakPolarHBondContact O-CG2 3.43Å; L200-V204 PolarHBondContact O-N 2.94Å; F201-V204 PolarHBondContact O-N 3.47Å; V204-G206 VanDerWaalsContact C-N 3.32Å; V204-Y238 HydrophobicContact CG1-CD1 4Å; V204-Y238 HydrophobicContact CG1-CE1 4.07Å; V204-Y242 HydrophobicContact CB-CE2 4.37Å; V204-Y242 HydrophobicContact CG1-CE1 4.09Å; V204-Y242 HydrophobicContact CG1-CE2 3.88Å; V204-Y242 WeakPolarHBondContact CG1-OH 3.25Å; V204-Y242 HydrophobicContact CG2-CE2 4.43Å |
| 205 | E | 95.2 | Very high | 96.5 | Very high | 5 Ų | 5 | 56.9 Ų | 56.9 | 2% | 0.023 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -84 | -7.9 | -178.7 | -57.4 | -67.5 | 179.8 | 0 | 0 | 113 | F201 W207 V230 G231 K236 Y238 Y242 | F201-E205 WeakPolarHBondContact O-CA 3.49Å; F201-E205 WeakPolarHBondContact O-CB 3.22Å; F201-E205 WeakPolarHBondContact O-CG 3.46Å; F201-E205 PolarHBondContact O-N 2.87Å; E205-W207 HydrophobicContact CB-CB 4.48Å; E205-W207 HydrophobicContact CB-CD2 3.36Å; E205-W207 HydrophobicContact CB-CE3 3.82Å; E205-W207 HydrophobicContact CB-CG 3.67Å; E205-W207 HydrophobicContact CB-CH2 4.29Å; E205-W207 HydrophobicContact CB-CZ2 3.87Å; E205-W207 HydrophobicContact CB-CZ3 4.26Å; E205-W207 HydrophobicContact CG-CD2 3.95Å; E205-W207 HydrophobicContact CG-CE3 3.96Å; E205-W207 HydrophobicContact CG-CH2 3.8Å; E205-W207 HydrophobicContact CG-CZ2 3.76Å; E205-W207 HydrophobicContact CG-CZ3 3.9Å; E205-W207 PolarHBondContact O-N 2.91Å; E205-W207 VanDerWaalsContact O-N 3.14Å; E205-V230 HydrophobicContact CG-CG1 4.34Å; E205-V230 WeakPolarHBondContact OE1-CA 3.27Å; E205-V230 VanDerWaalsContact OE1-CB 3.28Å; E205-V230 WeakPolarHBondContact OE1-CB 3.34Å; E205-G231 PolarHBondContact OE1-N 3.14Å; E205-K236 PolarHBondContact O-NZ 3.48Å; E205-Y238 VanDerWaalsContact OE2-CE1 3.29Å; E205-Y238 WeakPolarHBondContact OE2-CE1 3.37Å; E205-Y238 VanDerWaalsContact OE2-CZ 3.31Å; E205-Y238 PolarHBondContact OE2-OH 2.74Å; E205-Y242 VanDerWaalsContact OE1-CE1 3.26Å; E205-Y242 WeakPolarHBondContact OE1-CE1 3.19Å; E205-Y242 PolarHBondContact OE1-OH 3.42Å |
| 206 | G | 95.2 | Very high | 96.7 | Very high | 59 Ų | 59 | 54.8 Ų | 54.8 | 61% | 0.608 | 29% | 0.291 | S | S | * | . | trans | 64.8 | 9.1 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | S202 V204 | S202-G206 CarbonylContact O-C 3.54Å; S202-G206 VanDerWaalsContact O-CA 3.27Å; S202-G206 WeakPolarHBondContact O-CA 3.38Å; S202-G206 PolarHBondContact O-N 2.86Å; S202-G206 VanDerWaalsContact O-N 3.08Å; V204-G206 VanDerWaalsContact C-N 3.32Å | ||
| 207 | W | 96.9 | Very high | 96.8 | Very high | 40 Ų | 40 | 56.7 Ų | 56.7 | 15% | 0.152 | 30% | 0.296 | C | S | . | . | trans | -66.2 | 153.2 | 172.2 | -57.2 | -24.4 | 0 | 0 | 0 | 110.3 | F201 S202 E205 E211 A212 F215 Y228 V230 | F201-W207 HydrophobicContact CB-CE3 4.35Å; F201-W207 HydrophobicContact CB-CZ3 4.31Å; S202-W207 VanDerWaalsContact CA-O 3.29Å; S202-W207 WeakPolarHBondContact CA-O 3.03Å; S202-W207 WeakPolarHBondContact CB-O 3.48Å; S202-W207 PolarHBondContact O-N 3.41Å; S202-W207 PolarHBondContact OG-O 3.35Å; E205-W207 HydrophobicContact CB-CB 4.48Å; E205-W207 HydrophobicContact CB-CD2 3.36Å; E205-W207 HydrophobicContact CB-CE3 3.82Å; E205-W207 HydrophobicContact CB-CG 3.67Å; E205-W207 HydrophobicContact CB-CH2 4.29Å; E205-W207 HydrophobicContact CB-CZ2 3.87Å; E205-W207 HydrophobicContact CB-CZ3 4.26Å; E205-W207 HydrophobicContact CG-CD2 3.95Å; E205-W207 HydrophobicContact CG-CE3 3.96Å; E205-W207 HydrophobicContact CG-CH2 3.8Å; E205-W207 HydrophobicContact CG-CZ2 3.76Å; E205-W207 HydrophobicContact CG-CZ3 3.9Å; E205-W207 PolarHBondContact O-N 2.91Å; E205-W207 VanDerWaalsContact O-N 3.14Å; W207-E211 HydrophobicContact CB-CB 4.08Å; W207-A212 HydrophobicContact CE3-CB 4.21Å; W207-F215 HydrophobicContact CH2-CD1 4.47Å; W207-F215 HydrophobicContact CH2-CD2 4.41Å; W207-F215 HydrophobicContact CH2-CG 4.26Å; W207-F215 HydrophobicContact CZ3-CB 3.99Å; W207-F215 AromaticContact CZ3-CD1 3.78Å; W207-F215 HydrophobicContact CZ3-CD1 3.78Å; W207-F215 HydrophobicContact CZ3-CD2 4.34Å; W207-F215 HydrophobicContact CZ3-CE1 4.4Å; W207-F215 AromaticContact CZ3-CG 3.74Å; W207-F215 HydrophobicContact CZ3-CG 3.74Å; W207-Y228 AromaticContact CD2-CD1 3.74Å; W207-Y228 HydrophobicContact CD2-CD1 3.74Å; W207-Y228 HydrophobicContact CD2-CE1 4.2Å; W207-Y228 AromaticContact CE2-CD1 3.58Å; W207-Y228 HydrophobicContact CE3-CD1 4.11Å; W207-Y228 HydrophobicContact CG-CD1 4.22Å; W207-Y228 HydrophobicContact CG-CE1 4.19Å; W207-Y228 HydrophobicContact CH2-CD1 4.21Å; W207-Y228 AromaticContact CZ2-CD1 3.85Å; W207-Y228 HydrophobicContact CZ2-CD1 3.85Å; W207-Y228 HydrophobicContact CZ3-CD1 4.33Å; W207-Y228 AromaticContact NE1-CD1 3.91Å; W207-V230 HydrophobicContact CH2-CG1 3.96Å; W207-V230 HydrophobicContact CZ3-CG1 4.23Å | ||
| 208 | T | 97.8 | Very high | 96.8 | Very high | 82 Ų | 82 | 56.8 Ų | 56.8 | 50% | 0.503 | 30% | 0.296 | S | S | . | . | trans | -62 | 157.7 | 164.5 | 67.6 | 0 | 0 | 0 | 0 | 110.4 | G210 E211 A212 | T208-G210 PolarHBondContact O-N 3.5Å; T208-E211 WeakPolarHBondContact CA-OE2 3.48Å; T208-E211 VanDerWaalsContact CB-OE2 3.25Å; T208-E211 WeakPolarHBondContact CB-OE2 3.45Å; T208-E211 WeakPolarHBondContact CG2-OE2 3.35Å; T208-E211 PolarHBondContact N-OE2 3.44Å; T208-E211 PolarHBondContact O-N 3.04Å; T208-E211 WeakPolarHBondContact OG1-CG 3.29Å; T208-E211 PolarHBondContact OG1-N 2.57Å; T208-E211 PolarHBondContact OG1-OE2 3.01Å; T208-A212 WeakPolarHBondContact O-CB 3.37Å; T208-A212 PolarHBondContact O-N 2.89Å | ||
| 209 | F | 96.7 | Very high | 96.8 | Very high | 92 Ų | 92 | 56.8 Ų | 56.8 | 40% | 0.404 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -59.5 | -30.4 | 174.3 | 177.4 | -104 | 0 | 0 | 0 | 112.6 | P198 L199 S202 F213 | P198-F209 HydrophobicContact CB-CD2 4.27Å; P198-F209 HydrophobicContact CB-CE2 3.78Å; L199-F209 HydrophobicContact CD2-CD2 3.59Å; L199-F209 HydrophobicContact CD2-CE2 3.74Å; L199-F209 HydrophobicContact CG-CD2 4.09Å; L199-F209 HydrophobicContact CG-CE2 3.83Å; S202-F209 PolarHBondContact OG-N 3.29Å; F209-F213 HydrophobicContact CZ-CD2 4.4Å; F209-F213 WeakPolarHBondContact O-CB 3.28Å; F209-F213 PolarHBondContact O-N 3.01Å |
| 210 | G | 97.3 | Very high | 96.8 | Very high | 48 Ų | 48 | 52.8 Ų | 52.8 | 50% | 0.495 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.7 | -48.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | T208 F213 Y214 | T208-G210 PolarHBondContact O-N 3.5Å; G210-F213 PolarHBondContact O-N 3.28Å; G210-Y214 VanDerWaalsContact O-CB 3.3Å; G210-Y214 WeakPolarHBondContact O-CB 3.31Å; G210-Y214 PolarHBondContact O-N 3.04Å |
| 211 | E | 97.6 | Very high | 96.8 | Very high | 68 Ų | 68 | 50.3 Ų | 50.3 | 32% | 0.318 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.5 | -41.8 | 176.5 | -67.8 | 155.1 | 151.7 | 0 | 0 | 111.6 | W207 T208 F213 Y214 F215 Y228 | W207-E211 HydrophobicContact CB-CB 4.08Å; T208-E211 WeakPolarHBondContact CA-OE2 3.48Å; T208-E211 VanDerWaalsContact CB-OE2 3.25Å; T208-E211 WeakPolarHBondContact CB-OE2 3.45Å; T208-E211 WeakPolarHBondContact CG2-OE2 3.35Å; T208-E211 PolarHBondContact N-OE2 3.44Å; T208-E211 PolarHBondContact O-N 3.04Å; T208-E211 WeakPolarHBondContact OG1-CG 3.29Å; T208-E211 PolarHBondContact OG1-N 2.57Å; T208-E211 PolarHBondContact OG1-OE2 3.01Å; E211-F213 PolarHBondContact O-N 2.96Å; E211-Y214 PolarHBondContact O-N 2.86Å; E211-F215 WeakPolarHBondContact O-CB 3.13Å; E211-F215 PolarHBondContact O-N 3.18Å; E211-Y228 HydrophobicContact CB-CD1 4.41Å; E211-Y228 HydrophobicContact CB-CE1 3.76Å; E211-Y228 HydrophobicContact CG-CE1 4.09Å; E211-Y228 WeakPolarHBondContact CG-OH 3.4Å; E211-Y228 PolarHBondContact OE1-OH 3.08Å |
| 212 | A | 97.9 | Very high | 96.7 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67.7 | -32.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | P198 F201 W207 T208 A216 | P198-A212 HydrophobicContact CB-CB 4.38Å; P198-A212 WeakPolarHBondContact O-CB 3.16Å; F201-A212 HydrophobicContact CB-CB 4.09Å; W207-A212 HydrophobicContact CE3-CB 4.21Å; T208-A212 WeakPolarHBondContact O-CB 3.37Å; T208-A212 PolarHBondContact O-N 2.89Å; A212-A216 PolarHBondContact O-N 3.42Å |
| 213 | F | 97.3 | Very high | 96.7 | Very high | 95 Ų | 95 | 55.1 Ų | 55.1 | 42% | 0.417 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -74.3 | -41.7 | 173.1 | -177.9 | -93.1 | 0 | 0 | 0 | 111.6 | P198 F209 G210 E211 A216 F217 | P198-F213 HydrophobicContact CB-CB 4.28Å; P198-F213 HydrophobicContact CG-CD2 4.22Å; F209-F213 HydrophobicContact CZ-CD2 4.4Å; F209-F213 WeakPolarHBondContact O-CB 3.28Å; F209-F213 PolarHBondContact O-N 3.01Å; G210-F213 PolarHBondContact O-N 3.28Å; E211-F213 PolarHBondContact O-N 2.96Å; F213-A216 PolarHBondContact O-N 3.12Å; F213-F217 WeakPolarHBondContact O-CB 3.12Å; F213-F217 PolarHBondContact O-N 2.94Å |
| 214 | Y | 97.5 | Very high | 96.7 | Very high | 84 Ų | 84 | 46 Ų | 46 | 33% | 0.329 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -57.5 | -49.5 | 171.9 | 165.3 | -94.3 | 0 | 0 | 0 | 111.3 | G210 E211 A216 F217 I218 F225 D227 Y228 | G210-Y214 VanDerWaalsContact O-CB 3.3Å; G210-Y214 WeakPolarHBondContact O-CB 3.31Å; G210-Y214 PolarHBondContact O-N 3.04Å; E211-Y214 PolarHBondContact O-N 2.86Å; Y214-A216 VanDerWaalsContact C-N 3.33Å; Y214-A216 PolarHBondContact O-N 3.19Å; Y214-F217 PolarHBondContact O-N 2.96Å; Y214-F217 VanDerWaalsContact O-N 3.15Å; Y214-I218 HydrophobicContact CD1-CG1 4.47Å; Y214-I218 HydrophobicContact CD2-CG1 3.95Å; Y214-I218 HydrophobicContact CE1-CG1 4.17Å; Y214-I218 HydrophobicContact CE2-CD1 4.07Å; Y214-I218 HydrophobicContact CE2-CG1 3.62Å; Y214-I218 HydrophobicContact CG-CG1 4.38Å; Y214-I218 WeakPolarHBondContact O-CB 3.28Å; Y214-I218 WeakPolarHBondContact O-CG1 3.49Å; Y214-I218 PolarHBondContact O-N 2.99Å; Y214-F225 WeakPolarHBondContact OH-CD2 3.46Å; Y214-D227 WeakPolarHBondContact CE1-OD2 3.19Å; Y214-D227 PolarHBondContact OH-OD2 2.67Å; Y214-Y228 AromaticContact CD1-CD2 3.97Å; Y214-Y228 HydrophobicContact CD1-CD2 3.97Å; Y214-Y228 HydrophobicContact CD1-CE2 4.33Å; Y214-Y228 AromaticContact CE1-CD2 3.79Å; Y214-Y228 HydrophobicContact CE1-CD2 3.79Å; Y214-Y228 HydrophobicContact CE1-CE2 4.21Å |
| 215 | F | 97.8 | Very high | 96.7 | Very high | 3 Ų | 3 | 49.8 Ų | 49.8 | 1% | 0.013 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -51.1 | -52.1 | 172.7 | 164.9 | -108.8 | 0 | 0 | 0 | 111.2 | Y120 F201 W207 E211 F217 I218 T219 Y228 V230 W249 | Y120-F215 HydrophobicContact CE1-CE2 4.12Å; Y120-F215 WeakPolarHBondContact OH-CE2 3.39Å; F201-F215 HydrophobicContact CD1-CE1 4.49Å; F201-F215 AromaticContact CD2-CD1 3.97Å; F201-F215 HydrophobicContact CD2-CD1 3.97Å; F201-F215 AromaticContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CE2-CD1 4.38Å; F201-F215 AromaticContact CE2-CE1 3.92Å; F201-F215 HydrophobicContact CE2-CE1 3.92Å; F201-F215 HydrophobicContact CG-CD1 4.33Å; F201-F215 HydrophobicContact CG-CE1 4.23Å; F201-F215 HydrophobicContact CZ-CE1 4.24Å; W207-F215 HydrophobicContact CH2-CD1 4.47Å; W207-F215 HydrophobicContact CH2-CD2 4.41Å; W207-F215 HydrophobicContact CH2-CG 4.26Å; W207-F215 HydrophobicContact CZ3-CB 3.99Å; W207-F215 AromaticContact CZ3-CD1 3.78Å; W207-F215 HydrophobicContact CZ3-CD1 3.78Å; W207-F215 HydrophobicContact CZ3-CD2 4.34Å; W207-F215 HydrophobicContact CZ3-CE1 4.4Å; W207-F215 AromaticContact CZ3-CG 3.74Å; W207-F215 HydrophobicContact CZ3-CG 3.74Å; E211-F215 WeakPolarHBondContact O-CB 3.13Å; E211-F215 PolarHBondContact O-N 3.18Å; F215-F217 VanDerWaalsContact C-N 3.35Å; F215-F217 PolarHBondContact O-N 3.22Å; F215-I218 PolarHBondContact O-N 2.87Å; F215-T219 VanDerWaalsContact CE2-OG1 3.29Å; F215-T219 WeakPolarHBondContact CE2-OG1 3.4Å; F215-T219 WeakPolarHBondContact O-CB 3.42Å; F215-T219 PolarHBondContact O-N 2.75Å; F215-T219 PolarHBondContact O-OG1 2.91Å; F215-Y228 WeakPolarHBondContact CD2-O 3.48Å; F215-Y228 WeakPolarHBondContact CE2-O 3.46Å; F215-V230 HydrophobicContact CE1-CG1 3.7Å; F215-V230 HydrophobicContact CZ-CG1 3.72Å; F215-V230 HydrophobicContact CZ-CG2 4.45Å; F215-W249 HydrophobicContact CE1-CH2 4.46Å; F215-W249 HydrophobicContact CE1-CZ3 4.15Å |
| 216 | A | 97.3 | Very high | 96.6 | Very high | 4 Ų | 4 | 50.4 Ų | 50.4 | 3% | 0.033 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.8 | -37 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | P198 A212 F213 Y214 L220 W249 | P198-A216 HydrophobicContact CG-CB 3.68Å; A212-A216 PolarHBondContact O-N 3.42Å; F213-A216 PolarHBondContact O-N 3.12Å; Y214-A216 VanDerWaalsContact C-N 3.33Å; Y214-A216 PolarHBondContact O-N 3.19Å; A216-L220 VanDerWaalsContact O-CB 3.3Å; A216-L220 WeakPolarHBondContact O-CB 3.29Å; A216-L220 VanDerWaalsContact O-CG 3.22Å; A216-L220 WeakPolarHBondContact O-CG 3.26Å; A216-L220 PolarHBondContact O-N 3.29Å; A216-W249 HydrophobicContact CB-CH2 3.84Å; A216-W249 HydrophobicContact CB-CZ2 4.03Å |
| 217 | F | 96.4 | Very high | 96.5 | Very high | 125 Ų | 125 | 51.7 Ų | 51.7 | 55% | 0.548 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.3 | -53.7 | 175.5 | -176 | -94 | 0 | 0 | 0 | 111.5 | F213 Y214 F215 T219 L220 S221 | F213-F217 WeakPolarHBondContact O-CB 3.12Å; F213-F217 PolarHBondContact O-N 2.94Å; Y214-F217 PolarHBondContact O-N 2.96Å; Y214-F217 VanDerWaalsContact O-N 3.15Å; F215-F217 VanDerWaalsContact C-N 3.35Å; F215-F217 PolarHBondContact O-N 3.22Å; F217-T219 PolarHBondContact O-N 3.42Å; F217-L220 PolarHBondContact O-N 2.54Å; F217-S221 WeakPolarHBondContact O-CB 3.32Å; F217-S221 PolarHBondContact O-N 3.33Å; F217-S221 PolarHBondContact O-OG 2.81Å |
| 218 | I | 97.4 | Very high | 96.4 | Very high | 13 Ų | 13 | 52.6 Ų | 52.6 | 7% | 0.067 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59.1 | -34.4 | 177.8 | -68 | -53.9 | 0 | 0 | 0 | 112.2 | Y214 F215 S221 I223 G224 F225 | Y214-I218 HydrophobicContact CD1-CG1 4.47Å; Y214-I218 HydrophobicContact CD2-CG1 3.95Å; Y214-I218 HydrophobicContact CE1-CG1 4.17Å; Y214-I218 HydrophobicContact CE2-CD1 4.07Å; Y214-I218 HydrophobicContact CE2-CG1 3.62Å; Y214-I218 HydrophobicContact CG-CG1 4.38Å; Y214-I218 WeakPolarHBondContact O-CB 3.28Å; Y214-I218 WeakPolarHBondContact O-CG1 3.49Å; Y214-I218 PolarHBondContact O-N 2.99Å; F215-I218 PolarHBondContact O-N 2.87Å; I218-S221 PolarHBondContact O-OG 2.86Å; I218-I223 HydrophobicContact CD1-CB 4.39Å; I218-I223 HydrophobicContact CD1-CD1 4.13Å; I218-I223 HydrophobicContact CD1-CG2 4.28Å; I218-I223 HydrophobicContact CG2-CB 4.16Å; I218-I223 HydrophobicContact CG2-CG2 4.21Å; I218-I223 PolarHBondContact O-N 2.97Å; I218-G224 PolarHBondContact O-N 2.61Å; I218-F225 HydrophobicContact CD1-CD2 3.89Å; I218-F225 HydrophobicContact CD1-CE2 3.63Å; I218-F225 HydrophobicContact CG1-CD2 4.08Å; I218-F225 HydrophobicContact CG1-CE2 4.31Å; I218-F225 HydrophobicContact CG2-CB 4.31Å; I218-F225 HydrophobicContact CG2-CD2 3.8Å; I218-F225 HydrophobicContact CG2-CG 4.24Å |
| 219 | T | 97.5 | Very high | 96.3 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -67.1 | -54.2 | 174.2 | -64 | 0 | 0 | 0 | 0 | 111.7 | I118 Y120 F215 F217 T222 W249 I250 | I118-T219 HydrophobicContact CD1-CG2 4.03Å; I118-T219 WeakPolarHBondContact CD1-O 3.28Å; Y120-T219 VanDerWaalsContact OH-CG2 3.28Å; Y120-T219 WeakPolarHBondContact OH-CG2 3.38Å; Y120-T219 PolarHBondContact OH-OG1 3.29Å; F215-T219 VanDerWaalsContact CE2-OG1 3.29Å; F215-T219 WeakPolarHBondContact CE2-OG1 3.4Å; F215-T219 WeakPolarHBondContact O-CB 3.42Å; F215-T219 PolarHBondContact O-N 2.75Å; F215-T219 PolarHBondContact O-OG1 2.91Å; F217-T219 PolarHBondContact O-N 3.42Å; T219-T222 WeakPolarHBondContact O-CA 3.34Å; T219-T222 PolarHBondContact O-N 3.35Å; T219-T222 VanDerWaalsContact O-N 3.07Å; T219-W249 HydrophobicContact CG2-CH2 4.31Å; T219-W249 HydrophobicContact CG2-CZ3 4.22Å; T219-I250 HydrophobicContact CG2-CD1 3.57Å; T219-I250 HydrophobicContact CG2-CG1 3.65Å |
| 220 | L | 96.3 | Very high | 96.2 | Very high | 14 Ų | 14 | 44.5 Ų | 44.5 | 7% | 0.073 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -81.4 | -17.2 | -171.7 | -63.2 | 178.9 | 0 | 0 | 0 | 113.7 | L194 A216 F217 W249 A253 L254 L257 | L194-L220 HydrophobicContact CD2-CD1 3.57Å; A216-L220 VanDerWaalsContact O-CB 3.3Å; A216-L220 WeakPolarHBondContact O-CB 3.29Å; A216-L220 VanDerWaalsContact O-CG 3.22Å; A216-L220 WeakPolarHBondContact O-CG 3.26Å; A216-L220 PolarHBondContact O-N 3.29Å; F217-L220 PolarHBondContact O-N 2.54Å; L220-W249 HydrophobicContact CD1-CH2 4.39Å; L220-W249 HydrophobicContact CD1-CZ2 3.76Å; L220-W249 HydrophobicContact CD2-CH2 4.42Å; L220-W249 HydrophobicContact CD2-CZ2 4.25Å; L220-W249 HydrophobicContact CG-CH2 4.27Å; L220-W249 HydrophobicContact CG-CZ2 4.1Å; L220-A253 HydrophobicContact CD1-CB 3.76Å; L220-A253 HydrophobicContact CD2-CB 3.57Å; L220-A253 HydrophobicContact CG-CB 4.34Å; L220-L254 HydrophobicContact CD2-CD2 4.33Å; L220-L254 HydrophobicContact CD2-CG 4.18Å; L220-L254 VanDerWaalsContact O-CD2 3.26Å; L220-L254 WeakPolarHBondContact O-CD2 3.38Å; L220-L257 HydrophobicContact CB-CD1 3.71Å; L220-L257 HydrophobicContact CD1-CD1 4.44Å |
| 221 | S | 95.2 | Very high | 95.9 | Very high | 44 Ų | 44 | 43 Ų | 43 | 31% | 0.308 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | 3.6 | 164.3 | 69.4 | 0 | 0 | 0 | 0 | 113.2 | F217 I218 I223 | F217-S221 WeakPolarHBondContact O-CB 3.32Å; F217-S221 PolarHBondContact O-N 3.33Å; F217-S221 PolarHBondContact O-OG 2.81Å; I218-S221 PolarHBondContact O-OG 2.86Å; S221-I223 PolarHBondContact O-N 3.35Å; S221-I223 VanDerWaalsContact OG-CD1 3.28Å; S221-I223 WeakPolarHBondContact OG-CD1 3.26Å; S221-I223 WeakPolarHBondContact OG-CG1 3.35Å |
| 222 | T | 95.5 | Very high | 95.4 | Very high | 54 Ų | 54 | 42.6 Ų | 42.6 | 33% | 0.331 | 22% | 0.219 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 50.9 | 37.7 | -176.3 | 71.9 | 0 | 0 | 0 | 0 | 114 | T116 I118 T219 L254 | T116-T222 VanDerWaalsContact O-CG2 3.31Å; T116-T222 WeakPolarHBondContact O-CG2 3.47Å; I118-T222 HydrophobicContact CG1-CG2 3.95Å; T219-T222 WeakPolarHBondContact O-CA 3.34Å; T219-T222 PolarHBondContact O-N 3.35Å; T219-T222 VanDerWaalsContact O-N 3.07Å; T222-L254 HydrophobicContact CG2-CD2 4.02Å |
| 223 | I | 97.2 | Very high | 94.8 | Very high | 83 Ų | 83 | 45.5 Ų | 45.5 | 43% | 0.426 | 23% | 0.234 | S | C | . | . | trans | -88.1 | -44.2 | 173.8 | -68 | 172.2 | 0 | 0 | 0 | 110.1 | I218 S221 F225 | I218-I223 HydrophobicContact CD1-CB 4.39Å; I218-I223 HydrophobicContact CD1-CD1 4.13Å; I218-I223 HydrophobicContact CD1-CG2 4.28Å; I218-I223 HydrophobicContact CG2-CB 4.16Å; I218-I223 HydrophobicContact CG2-CG2 4.21Å; I218-I223 PolarHBondContact O-N 2.97Å; S221-I223 PolarHBondContact O-N 3.35Å; S221-I223 VanDerWaalsContact OG-CD1 3.28Å; S221-I223 WeakPolarHBondContact OG-CD1 3.26Å; S221-I223 WeakPolarHBondContact OG-CG1 3.35Å; I223-F225 HydrophobicContact CG2-CD1 3.88Å; I223-F225 HydrophobicContact CG2-CD2 4.01Å; I223-F225 HydrophobicContact CG2-CE1 3.57Å; I223-F225 HydrophobicContact CG2-CE2 3.72Å; I223-F225 HydrophobicContact CG2-CG 4.1Å; I223-F225 HydrophobicContact CG2-CZ 3.49Å; I223-F225 VanDerWaalsContact CG2-CZ 3.49Å | ||
| 224 | G | 96.1 | Very high | 94 | Very high | 6 Ų | 6 | 43.7 Ų | 43.7 | 6% | 0.062 | 23% | 0.232 | C | C | . | . | trans | 52 | 59.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | I118 Y120 I218 G226 | I118-G224 WeakPolarHBondContact O-CA 3.26Å; Y120-G224 WeakPolarHBondContact CA-O 3.33Å; I218-G224 PolarHBondContact O-N 2.61Å; G224-G226 VanDerWaalsContact C-N 3.26Å; G224-G226 PolarHBondContact O-N 3.14Å | ||
| 225 | F | 94.8 | Very high | 93.3 | Very high | 127 Ų | 127 | 43 Ų | 43 | 56% | 0.557 | 25% | 0.251 | S | S | * | . | trans | -62.2 | -28.7 | 179.4 | -68.5 | -51.7 | 0 | 0 | 0 | 114.7 | Y214 I218 I223 D227 | Y214-F225 WeakPolarHBondContact OH-CD2 3.46Å; I218-F225 HydrophobicContact CD1-CD2 3.89Å; I218-F225 HydrophobicContact CD1-CE2 3.63Å; I218-F225 HydrophobicContact CG1-CD2 4.08Å; I218-F225 HydrophobicContact CG1-CE2 4.31Å; I218-F225 HydrophobicContact CG2-CB 4.31Å; I218-F225 HydrophobicContact CG2-CD2 3.8Å; I218-F225 HydrophobicContact CG2-CG 4.24Å; I223-F225 HydrophobicContact CG2-CD1 3.88Å; I223-F225 HydrophobicContact CG2-CD2 4.01Å; I223-F225 HydrophobicContact CG2-CE1 3.57Å; I223-F225 HydrophobicContact CG2-CE2 3.72Å; I223-F225 HydrophobicContact CG2-CG 4.1Å; I223-F225 HydrophobicContact CG2-CZ 3.49Å; I223-F225 VanDerWaalsContact CG2-CZ 3.49Å; F225-D227 PolarHBondContact O-N 3.44Å | ||
| 226 | G | 93.2 | Very high | 92.7 | Very high | 18 Ų | 18 | 46.5 Ų | 46.5 | 19% | 0.186 | 27% | 0.266 | C | S | . | . | S | Bend | trans | 79.5 | 2.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y120 G224 Y228 | Y120-G226 VanDerWaalsContact O-CA 3.31Å; Y120-G226 WeakPolarHBondContact O-CA 3.32Å; G224-G226 VanDerWaalsContact C-N 3.26Å; G224-G226 PolarHBondContact O-N 3.14Å; G226-Y228 VanDerWaalsContact C-N 3.32Å |
| 227 | D | 92.9 | Very high | 92.1 | Very high | 85 Ų | 85 | 56.1 Ų | 56.1 | 46% | 0.455 | 31% | 0.31 | S | S | . | . | S | Bend | trans | -58.5 | -42.1 | 164.6 | 51.6 | -4.7 | 0 | 0 | 0 | 111.9 | Y214 F225 | Y214-D227 WeakPolarHBondContact CE1-OD2 3.19Å; Y214-D227 PolarHBondContact OH-OD2 2.67Å; F225-D227 PolarHBondContact O-N 3.44Å |
| 228 | Y | 95.7 | Very high | 91.8 | Very high | 59 Ų | 59 | 52.5 Ų | 52.5 | 23% | 0.231 | 29% | 0.293 | C | S | . | . | S | Bend | trans | -115.3 | 120 | 170.5 | -70.6 | -93.2 | 0 | 0 | 0 | 110 | W207 E211 Y214 F215 G226 | W207-Y228 AromaticContact CD2-CD1 3.74Å; W207-Y228 HydrophobicContact CD2-CD1 3.74Å; W207-Y228 HydrophobicContact CD2-CE1 4.2Å; W207-Y228 AromaticContact CE2-CD1 3.58Å; W207-Y228 HydrophobicContact CE3-CD1 4.11Å; W207-Y228 HydrophobicContact CG-CD1 4.22Å; W207-Y228 HydrophobicContact CG-CE1 4.19Å; W207-Y228 HydrophobicContact CH2-CD1 4.21Å; W207-Y228 AromaticContact CZ2-CD1 3.85Å; W207-Y228 HydrophobicContact CZ2-CD1 3.85Å; W207-Y228 HydrophobicContact CZ3-CD1 4.33Å; W207-Y228 AromaticContact NE1-CD1 3.91Å; E211-Y228 HydrophobicContact CB-CD1 4.41Å; E211-Y228 HydrophobicContact CB-CE1 3.76Å; E211-Y228 HydrophobicContact CG-CE1 4.09Å; E211-Y228 WeakPolarHBondContact CG-OH 3.4Å; E211-Y228 PolarHBondContact OE1-OH 3.08Å; Y214-Y228 AromaticContact CD1-CD2 3.97Å; Y214-Y228 HydrophobicContact CD1-CD2 3.97Å; Y214-Y228 HydrophobicContact CD1-CE2 4.33Å; Y214-Y228 AromaticContact CE1-CD2 3.79Å; Y214-Y228 HydrophobicContact CE1-CD2 3.79Å; Y214-Y228 HydrophobicContact CE1-CE2 4.21Å; F215-Y228 WeakPolarHBondContact CD2-O 3.48Å; F215-Y228 WeakPolarHBondContact CE2-O 3.46Å; G226-Y228 VanDerWaalsContact C-N 3.32Å |
| 229 | V | 94.4 | Very high | 91.5 | Very high | 5 Ų | 5 | 57.6 Ų | 57.6 | 3% | 0.03 | 32% | 0.319 | C | S | . | . | trans | -143.9 | 133.9 | 173.4 | -175.6 | 0 | 0 | 0 | 0 | 110 | F109 Y120 N122 T232 | F109-V229 HydrophobicContact CE1-CG1 3.8Å; F109-V229 HydrophobicContact CZ-CG1 4.4Å; Y120-V229 HydrophobicContact CD1-CG2 3.85Å; Y120-V229 HydrophobicContact CD2-CG1 4.18Å; Y120-V229 HydrophobicContact CD2-CG2 4.14Å; Y120-V229 HydrophobicContact CE1-CG2 4.34Å; Y120-V229 HydrophobicContact CE2-CG1 4.31Å; Y120-V229 HydrophobicContact CG-CG2 3.74Å; N122-V229 HydrophobicContact CB-CG2 4.5Å; V229-T232 HydrophobicContact CB-CG2 3.94Å; V229-T232 HydrophobicContact CG1-CG2 4.17Å; V229-T232 VanDerWaalsContact O-CG2 3.22Å; V229-T232 WeakPolarHBondContact O-CG2 3.37Å; V229-T232 PolarHBondContact O-OG1 3.33Å | ||
| 230 | V | 94.9 | Very high | 91 | Very high | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | 146.5 | -173.7 | -67.6 | 0 | 0 | 0 | 0 | 114.5 | F109 F201 E205 W207 F215 T232 Y242 R243 A246 | F109-V230 HydrophobicContact CE1-CG2 4.44Å; F109-V230 HydrophobicContact CE2-CG2 4.1Å; F109-V230 HydrophobicContact CZ-CG2 3.77Å; F201-V230 HydrophobicContact CD1-CG1 3.62Å; F201-V230 HydrophobicContact CE1-CG1 3.83Å; F201-V230 HydrophobicContact CG-CG1 4.34Å; E205-V230 HydrophobicContact CG-CG1 4.34Å; E205-V230 WeakPolarHBondContact OE1-CA 3.27Å; E205-V230 VanDerWaalsContact OE1-CB 3.28Å; E205-V230 WeakPolarHBondContact OE1-CB 3.34Å; W207-V230 HydrophobicContact CH2-CG1 3.96Å; W207-V230 HydrophobicContact CZ3-CG1 4.23Å; F215-V230 HydrophobicContact CE1-CG1 3.7Å; F215-V230 HydrophobicContact CZ-CG1 3.72Å; F215-V230 HydrophobicContact CZ-CG2 4.45Å; V230-T232 VanDerWaalsContact C-N 3.35Å; V230-Y242 HydrophobicContact CB-CE1 3.88Å; V230-R243 PolarHBondContact O-NE 3.16Å; V230-A246 HydrophobicContact CG2-CB 3.73Å |
| 231 | G | 90.5 | Very high | 90.8 | Very high | 16 Ų | 16 | 67.1 Ų | 67.1 | 17% | 0.165 | 38% | 0.378 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 71.1 | 24.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | E205 Y238 R243 | E205-G231 PolarHBondContact OE1-N 3.14Å; G231-Y238 VanDerWaalsContact CA-CZ 3.46Å; G231-R243 VanDerWaalsContact O-CZ 3.26Å; G231-R243 PolarHBondContact O-NE 2.99Å; G231-R243 PolarHBondContact O-NH2 3.43Å |
| 232 | T | 87 | Confident | 90.7 | Very high | 59 Ų | 59 | 65.8 Ų | 65.8 | 36% | 0.362 | 37% | 0.366 | S | S | . | . | trans | -98.2 | -18.5 | -173.3 | 49.9 | 0 | 0 | 0 | 0 | 115.1 | V229 V230 P234 | V229-T232 HydrophobicContact CB-CG2 3.94Å; V229-T232 HydrophobicContact CG1-CG2 4.17Å; V229-T232 VanDerWaalsContact O-CG2 3.22Å; V229-T232 WeakPolarHBondContact O-CG2 3.37Å; V229-T232 PolarHBondContact O-OG1 3.33Å; V230-T232 VanDerWaalsContact C-N 3.35Å; T232-P234 WeakPolarHBondContact O-CD 3.29Å | ||
| 233 | D | 86.6 | Confident | 90.6 | Very high | 62 Ų | 62 | 64.3 Ų | 64.3 | 33% | 0.332 | 35% | 0.354 | S | S | . | . | trans | -71.6 | 116.8 | -175.1 | -171.8 | -15.2 | 0 | 0 | 0 | 111.1 | G235 K236 Y238 | D233-G235 PolarHBondContact O-N 3.21Å; D233-G235 WeakPolarHBondContact OD1-CA 3.33Å; D233-G235 PolarHBondContact OD1-N 3.04Å; D233-K236 HydrophobicContact CB-CB 4.23Å; D233-K236 HydrophobicContact CB-CD 3.97Å; D233-K236 HydrophobicContact CB-CG 4.11Å; D233-K236 PolarHBondContact O-N 3.37Å; D233-K236 VanDerWaalsContact OD2-CD 3.3Å; D233-K236 WeakPolarHBondContact OD2-CD 3.32Å; D233-K236 WeakPolarHBondContact OD2-CE 3.25Å; D233-K236 WeakPolarHBondContact OD2-CG 3.46Å; D233-K236 IonicContact OD2-NZ 3.6Å; D233-Y238 HydrophobicContact CB-CE2 4.3Å; D233-Y238 VanDerWaalsContact CB-OH 3.26Å; D233-Y238 WeakPolarHBondContact CB-OH 3.38Å; D233-Y238 PolarHBondContact N-OH 3.38Å | ||
| 234 | P | 80.9 | Confident | 90.5 | Very high | 56 Ų | 56 | 60.9 Ų | 60.9 | 36% | 0.364 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68 | -14.8 | 178.1 | 31.7 | -37.8 | 0 | 0 | 0 | 113.3 | N98 T232 | N98-P234 WeakPolarHBondContact ND2-CB 3.48Å; T232-P234 WeakPolarHBondContact O-CD 3.29Å |
| 235 | G | 81.7 | Confident | 90.5 | Very high | 70 Ų | 70 | 65.1 Ų | 65.1 | 72% | 0.722 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | 2.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | D233 | D233-G235 PolarHBondContact O-N 3.21Å; D233-G235 WeakPolarHBondContact OD1-CA 3.33Å; D233-G235 PolarHBondContact OD1-N 3.04Å |
| 236 | K | 85.5 | Confident | 90.6 | Very high | 76 Ų | 76 | 59.3 Ų | 59.3 | 33% | 0.33 | 33% | 0.334 | S | S | . | . | trans | -124.5 | 135.6 | -173.6 | -68.6 | -178.3 | -177.5 | 175.4 | 0 | 113.6 | E205 D233 Y238 | E205-K236 PolarHBondContact O-NZ 3.48Å; D233-K236 HydrophobicContact CB-CB 4.23Å; D233-K236 HydrophobicContact CB-CD 3.97Å; D233-K236 HydrophobicContact CB-CG 4.11Å; D233-K236 PolarHBondContact O-N 3.37Å; D233-K236 VanDerWaalsContact OD2-CD 3.3Å; D233-K236 WeakPolarHBondContact OD2-CD 3.32Å; D233-K236 WeakPolarHBondContact OD2-CE 3.25Å; D233-K236 WeakPolarHBondContact OD2-CG 3.46Å; D233-K236 IonicContact OD2-NZ 3.6Å; K236-Y238 HydrophobicContact CB-CD2 4.2Å; K236-Y238 HydrophobicContact CB-CE2 3.65Å; K236-Y238 WeakPolarHBondContact O-CD2 3.47Å; K236-Y238 PolarHBondContact O-N 2.95Å | ||
| 237 | E | 85.4 | Confident | 90.7 | Very high | 206 Ų | 206 | 58.7 Ų | 58.7 | 96% | 0.963 | 33% | 0.327 | S | S | * | . | trans | -86.7 | 98.4 | 172.1 | -65.1 | -167.1 | 156.9 | 0 | 0 | 110.5 | ||||
| 238 | Y | 88.6 | Confident | 90.8 | Very high | 49 Ų | 49 | 58 Ų | 58 | 19% | 0.192 | 32% | 0.323 | C | S | . | . | trans | -87.3 | 147 | 173.2 | -57.3 | -90.6 | 0 | 0 | 0 | 111.4 | V204 E205 G231 D233 K236 Y242 | V204-Y238 HydrophobicContact CG1-CD1 4Å; V204-Y238 HydrophobicContact CG1-CE1 4.07Å; E205-Y238 VanDerWaalsContact OE2-CE1 3.29Å; E205-Y238 WeakPolarHBondContact OE2-CE1 3.37Å; E205-Y238 VanDerWaalsContact OE2-CZ 3.31Å; E205-Y238 PolarHBondContact OE2-OH 2.74Å; G231-Y238 VanDerWaalsContact CA-CZ 3.46Å; D233-Y238 HydrophobicContact CB-CE2 4.3Å; D233-Y238 VanDerWaalsContact CB-OH 3.26Å; D233-Y238 WeakPolarHBondContact CB-OH 3.38Å; D233-Y238 PolarHBondContact N-OH 3.38Å; K236-Y238 HydrophobicContact CB-CD2 4.2Å; K236-Y238 HydrophobicContact CB-CE2 3.65Å; K236-Y238 WeakPolarHBondContact O-CD2 3.47Å; K236-Y238 PolarHBondContact O-N 2.95Å; Y238-Y242 AromaticContact CD1-CD1 3.53Å; Y238-Y242 HydrophobicContact CD1-CD1 3.53Å; Y238-Y242 AromaticContact CD1-CE1 3.6Å; Y238-Y242 HydrophobicContact CD1-CE1 3.6Å; Y238-Y242 HydrophobicContact CD1-CG 4.36Å; Y238-Y242 HydrophobicContact CE1-CD1 4.19Å; Y238-Y242 AromaticContact CE1-CE1 3.83Å; Y238-Y242 HydrophobicContact CE1-CE1 3.83Å; Y238-Y242 HydrophobicContact CG-CD1 4.18Å | ||
| 239 | I | 90.9 | Very high | 90.8 | Very high | 120 Ų | 120 | 56.5 Ų | 56.5 | 62% | 0.615 | 32% | 0.317 | S | S | * | . | trans | -62.5 | 138.7 | 169.1 | 64.3 | 175.3 | 0 | 0 | 0 | 110.1 | L241 Y242 L245 | I239-L241 PolarHBondContact O-N 2.64Å; I239-Y242 WeakPolarHBondContact O-CB 3.42Å; I239-Y242 PolarHBondContact O-N 2.98Å; I239-L245 HydrophobicContact CD1-CD1 4.24Å | ||
| 240 | S | 87.1 | Confident | 90.9 | Very high | 103 Ų | 103 | 56.5 Ų | 56.5 | 72% | 0.72 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | -26.4 | -170.8 | -42.9 | 0 | 0 | 0 | 0 | 114.1 | S105 Y242 | S105-S240 WeakPolarHBondContact CB-O 3.41Å; S105-S240 PolarHBondContact OG-O 3.07Å; S240-Y242 VanDerWaalsContact C-N 3.35Å |
| 241 | L | 91.8 | Very high | 90.8 | Very high | 111 Ų | 111 | 58.4 Ų | 58.4 | 58% | 0.581 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | 2.5 | 177.4 | -64.5 | 177.9 | 0 | 0 | 0 | 114.2 | I239 R243 C244 L245 | I239-L241 PolarHBondContact O-N 2.64Å; L241-R243 PolarHBondContact O-N 3.44Å; L241-C244 WeakPolarHBondContact O-CB 3.48Å; L241-C244 PolarHBondContact O-N 3.01Å; L241-L245 HydrophobicContact CB-CD1 4.49Å; L241-L245 WeakPolarHBondContact O-CG 3.38Å; L241-L245 PolarHBondContact O-N 3.3Å |
| 242 | Y | 93.9 | Very high | 90.9 | Very high | 17 Ų | 17 | 62.6 Ų | 62.6 | 7% | 0.067 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -61.4 | -48.9 | -170 | -177.8 | -120.2 | 0 | 0 | 0 | 113.7 | F201 V204 E205 V230 Y238 I239 S240 C244 L245 A246 | F201-Y242 WeakPolarHBondContact CD1-OH 3.28Å; V204-Y242 HydrophobicContact CB-CE2 4.37Å; V204-Y242 HydrophobicContact CG1-CE1 4.09Å; V204-Y242 HydrophobicContact CG1-CE2 3.88Å; V204-Y242 WeakPolarHBondContact CG1-OH 3.25Å; V204-Y242 HydrophobicContact CG2-CE2 4.43Å; E205-Y242 VanDerWaalsContact OE1-CE1 3.26Å; E205-Y242 WeakPolarHBondContact OE1-CE1 3.19Å; E205-Y242 PolarHBondContact OE1-OH 3.42Å; V230-Y242 HydrophobicContact CB-CE1 3.88Å; Y238-Y242 AromaticContact CD1-CD1 3.53Å; Y238-Y242 HydrophobicContact CD1-CD1 3.53Å; Y238-Y242 AromaticContact CD1-CE1 3.6Å; Y238-Y242 HydrophobicContact CD1-CE1 3.6Å; Y238-Y242 HydrophobicContact CD1-CG 4.36Å; Y238-Y242 HydrophobicContact CE1-CD1 4.19Å; Y238-Y242 AromaticContact CE1-CE1 3.83Å; Y238-Y242 HydrophobicContact CE1-CE1 3.83Å; Y238-Y242 HydrophobicContact CG-CD1 4.18Å; I239-Y242 WeakPolarHBondContact O-CB 3.42Å; I239-Y242 PolarHBondContact O-N 2.98Å; S240-Y242 VanDerWaalsContact C-N 3.35Å; Y242-C244 VanDerWaalsContact C-N 3.35Å; Y242-C244 PolarHBondContact O-N 3.14Å; Y242-L245 PolarHBondContact O-N 3.38Å; Y242-A246 PolarHBondContact O-N 2.82Å |
| 243 | R | 94.3 | Very high | 91.3 | Very high | 22 Ų | 22 | 59.8 Ų | 59.8 | 8% | 0.083 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.3 | -38 | 174.9 | -76.9 | -177.4 | 170.8 | 169.9 | -1.6 | 111.9 | N101 S106 F109 V230 G231 L241 A246 G247 | N101-R243 PolarHBondContact OD1-NH1 3.39Å; S106-R243 WeakPolarHBondContact OG-CD 3.3Å; S106-R243 PolarHBondContact OG-NH1 3.47Å; F109-R243 HydrophobicContact CB-CB 3.94Å; F109-R243 WeakPolarHBondContact CD2-O 3.32Å; F109-R243 HydrophobicContact CG-CB 4.19Å; V230-R243 PolarHBondContact O-NE 3.16Å; G231-R243 VanDerWaalsContact O-CZ 3.26Å; G231-R243 PolarHBondContact O-NE 2.99Å; G231-R243 PolarHBondContact O-NH2 3.43Å; L241-R243 PolarHBondContact O-N 3.44Å; R243-A246 PolarHBondContact O-N 2.88Å; R243-G247 PolarHBondContact O-N 2.98Å |
| 244 | C | 94.5 | Very high | 91.6 | Very high | 12 Ų | 12 | 57.6 Ų | 57.6 | 8% | 0.081 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -57.8 | -48.2 | 169.4 | -75 | 0 | 0 | 0 | 0 | 113 | S105 F108 L241 Y242 A246 G247 I248 | S105-C244 PolarHBondContact OG-N 3.38Å; F108-C244 HydrophobicContact CD1-CB 4.15Å; L241-C244 WeakPolarHBondContact O-CB 3.48Å; L241-C244 PolarHBondContact O-N 3.01Å; Y242-C244 VanDerWaalsContact C-N 3.35Å; Y242-C244 PolarHBondContact O-N 3.14Å; C244-A246 VanDerWaalsContact C-N 3.34Å; C244-A246 PolarHBondContact O-N 3.23Å; C244-G247 PolarHBondContact O-N 3.48Å; C244-I248 VanDerWaalsContact O-CG1 3.27Å; C244-I248 WeakPolarHBondContact O-CG1 3.35Å; C244-I248 PolarHBondContact O-N 2.9Å |
| 245 | L | 95.8 | Very high | 92.1 | Very high | 95 Ų | 95 | 55 Ų | 55 | 50% | 0.497 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.4 | -39.7 | -179.6 | -69.8 | 170 | 0 | 0 | 0 | 111.8 | I239 L241 Y242 I248 W249 | I239-L245 HydrophobicContact CD1-CD1 4.24Å; L241-L245 HydrophobicContact CB-CD1 4.49Å; L241-L245 WeakPolarHBondContact O-CG 3.38Å; L241-L245 PolarHBondContact O-N 3.3Å; Y242-L245 PolarHBondContact O-N 3.38Å; L245-I248 PolarHBondContact O-N 2.91Å; L245-W249 PolarHBondContact O-N 3.1Å |
| 246 | A | 96.4 | Very high | 92.6 | Very high | 4 Ų | 4 | 51.9 Ų | 51.9 | 3% | 0.033 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | F109 F201 V230 Y242 R243 C244 I248 W249 I250 | F109-A246 HydrophobicContact CD2-CB 4.42Å; F109-A246 HydrophobicContact CE2-CB 3.93Å; F201-A246 HydrophobicContact CE1-CB 4.36Å; V230-A246 HydrophobicContact CG2-CB 3.73Å; Y242-A246 PolarHBondContact O-N 2.82Å; R243-A246 PolarHBondContact O-N 2.88Å; C244-A246 VanDerWaalsContact C-N 3.34Å; C244-A246 PolarHBondContact O-N 3.23Å; A246-I248 VanDerWaalsContact C-N 3.31Å; A246-I248 PolarHBondContact O-N 3.4Å; A246-W249 PolarHBondContact O-N 3.24Å; A246-I250 WeakPolarHBondContact O-CG1 3.05Å; A246-I250 PolarHBondContact O-N 3.39Å |
| 247 | G | 95.6 | Very high | 92.9 | Very high | 5 Ų | 5 | 50.3 Ų | 50.3 | 5% | 0.052 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.7 | -38.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | R243 C244 I250 I251 | R243-G247 PolarHBondContact O-N 2.98Å; C244-G247 PolarHBondContact O-N 3.48Å; G247-I250 PolarHBondContact O-N 3.46Å; G247-I251 WeakPolarHBondContact O-CG1 3.3Å; G247-I251 PolarHBondContact O-N 3.45Å |
| 248 | I | 94.7 | Very high | 93 | Very high | 72 Ų | 72 | 42.1 Ų | 42.1 | 37% | 0.369 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -66.5 | -43.7 | 174.5 | -67.2 | 167.5 | 0 | 0 | 0 | 110.9 | F108 C244 L245 A246 I251 F252 | F108-I248 HydrophobicContact CE1-CG1 4.27Å; F108-I248 HydrophobicContact CZ-CG1 4.44Å; C244-I248 VanDerWaalsContact O-CG1 3.27Å; C244-I248 WeakPolarHBondContact O-CG1 3.35Å; C244-I248 PolarHBondContact O-N 2.9Å; L245-I248 PolarHBondContact O-N 2.91Å; A246-I248 VanDerWaalsContact C-N 3.31Å; A246-I248 PolarHBondContact O-N 3.4Å; I248-I251 PolarHBondContact O-N 3.04Å; I248-F252 HydrophobicContact CG2-CD2 3.83Å; I248-F252 HydrophobicContact CG2-CE2 3.7Å; I248-F252 VanDerWaalsContact O-CD2 3.29Å; I248-F252 WeakPolarHBondContact O-CD2 3.49Å; I248-F252 PolarHBondContact O-N 2.83Å |
| 249 | W | 96.3 | Very high | 92.9 | Very high | 27 Ų | 27 | 39.8 Ų | 39.8 | 10% | 0.102 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -58.1 | -47.2 | 173.7 | 157 | 68.5 | 0 | 0 | 0 | 111.8 | F193 P197 F201 F215 A216 T219 L220 L245 A246 I251 F252 A253 | F193-W249 PolarHBondContact O-NE1 3.04Å; P197-W249 HydrophobicContact CB-CD2 4.17Å; P197-W249 HydrophobicContact CB-CG 4.36Å; P197-W249 HydrophobicContact CB-CZ2 4.02Å; P197-W249 HydrophobicContact CG-CG 4.46Å; P197-W249 VanDerWaalsContact CG-NE1 3.32Å; F201-W249 HydrophobicContact CE2-CD2 4.18Å; F201-W249 AromaticContact CE2-CE3 3.74Å; F201-W249 HydrophobicContact CE2-CE3 3.74Å; F201-W249 AromaticContact CE2-CH2 3.65Å; F201-W249 HydrophobicContact CE2-CH2 3.65Å; F201-W249 HydrophobicContact CE2-CZ2 4.06Å; F201-W249 AromaticContact CE2-CZ3 3.47Å; F201-W249 HydrophobicContact CE2-CZ3 3.47Å; F201-W249 VanDerWaalsContact CE2-CZ3 3.47Å; F201-W249 HydrophobicContact CZ-CD2 4.09Å; F201-W249 AromaticContact CZ-CE3 3.49Å; F201-W249 HydrophobicContact CZ-CE3 3.49Å; F201-W249 VanDerWaalsContact CZ-CE3 3.49Å; F201-W249 HydrophobicContact CZ-CH2 4.24Å; F201-W249 AromaticContact CZ-CZ3 3.59Å; F201-W249 HydrophobicContact CZ-CZ3 3.59Å; F215-W249 HydrophobicContact CE1-CH2 4.46Å; F215-W249 HydrophobicContact CE1-CZ3 4.15Å; A216-W249 HydrophobicContact CB-CH2 3.84Å; A216-W249 HydrophobicContact CB-CZ2 4.03Å; T219-W249 HydrophobicContact CG2-CH2 4.31Å; T219-W249 HydrophobicContact CG2-CZ3 4.22Å; L220-W249 HydrophobicContact CD1-CH2 4.39Å; L220-W249 HydrophobicContact CD1-CZ2 3.76Å; L220-W249 HydrophobicContact CD2-CH2 4.42Å; L220-W249 HydrophobicContact CD2-CZ2 4.25Å; L220-W249 HydrophobicContact CG-CH2 4.27Å; L220-W249 HydrophobicContact CG-CZ2 4.1Å; L245-W249 PolarHBondContact O-N 3.1Å; A246-W249 PolarHBondContact O-N 3.24Å; W249-I251 VanDerWaalsContact C-N 3.3Å; W249-I251 PolarHBondContact O-N 3.41Å; W249-F252 PolarHBondContact O-N 2.85Å; W249-F252 VanDerWaalsContact O-N 3.17Å; W249-A253 VanDerWaalsContact O-CB 3.31Å; W249-A253 WeakPolarHBondContact O-CB 3.41Å; W249-A253 PolarHBondContact O-N 3.31Å |
| 250 | I | 96.6 | Very high | 92.7 | Very high | 5 Ų | 5 | 37.2 Ų | 37.2 | 3% | 0.026 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -53.1 | -48.3 | 177.7 | -71.7 | 171.3 | 0 | 0 | 0 | 110.7 | F109 T116 I118 T219 A246 G247 F252 A253 L254 | F109-I250 HydrophobicContact CE2-CD1 3.84Å; F109-I250 HydrophobicContact CZ-CD1 4.35Å; T116-I250 HydrophobicContact CG2-CG2 4.35Å; I118-I250 HydrophobicContact CD1-CD1 4.28Å; I118-I250 HydrophobicContact CD1-CG2 3.49Å; I118-I250 VanDerWaalsContact CD1-CG2 3.49Å; T219-I250 HydrophobicContact CG2-CD1 3.57Å; T219-I250 HydrophobicContact CG2-CG1 3.65Å; A246-I250 WeakPolarHBondContact O-CG1 3.05Å; A246-I250 PolarHBondContact O-N 3.39Å; G247-I250 PolarHBondContact O-N 3.46Å; I250-F252 PolarHBondContact O-N 3.1Å; I250-A253 PolarHBondContact O-N 3.21Å; I250-L254 HydrophobicContact CG2-CD1 3.75Å; I250-L254 HydrophobicContact CG2-CG 4.28Å; I250-L254 WeakPolarHBondContact O-CB 3.34Å; I250-L254 VanDerWaalsContact O-CG 3.27Å; I250-L254 WeakPolarHBondContact O-CG 3.33Å; I250-L254 PolarHBondContact O-N 2.9Å |
| 251 | I | 92.9 | Very high | 92.5 | Very high | 40 Ų | 40 | 39.5 Ų | 39.5 | 21% | 0.205 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.4 | -43.3 | -178.9 | -67.9 | 165.5 | 0 | 0 | 0 | 111.5 | F148 G247 I248 W249 A255 | F148-I251 HydrophobicContact CD1-CG2 4.34Å; F148-I251 HydrophobicContact CE1-CG2 3.52Å; F148-I251 HydrophobicContact CZ-CG2 4.23Å; G247-I251 WeakPolarHBondContact O-CG1 3.3Å; G247-I251 PolarHBondContact O-N 3.45Å; I248-I251 PolarHBondContact O-N 3.04Å; W249-I251 VanDerWaalsContact C-N 3.3Å; W249-I251 PolarHBondContact O-N 3.41Å; I251-A255 WeakPolarHBondContact O-CB 3.49Å; I251-A255 PolarHBondContact O-N 3.13Å; I251-A255 VanDerWaalsContact O-N 3.14Å |
| 252 | F | 92.5 | Very high | 91.7 | Very high | 103 Ų | 103 | 40.4 Ų | 40.4 | 45% | 0.452 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -73 | -36.8 | 177.9 | -76 | -65.1 | 0 | 0 | 0 | 113.4 | F193 I248 W249 I250 A255 W256 | F193-F252 HydrophobicContact CD1-CB 4.38Å; F193-F252 HydrophobicContact CE1-CB 3.72Å; F193-F252 HydrophobicContact CZ-CB 4.34Å; I248-F252 HydrophobicContact CG2-CD2 3.83Å; I248-F252 HydrophobicContact CG2-CE2 3.7Å; I248-F252 VanDerWaalsContact O-CD2 3.29Å; I248-F252 WeakPolarHBondContact O-CD2 3.49Å; I248-F252 PolarHBondContact O-N 2.83Å; W249-F252 PolarHBondContact O-N 2.85Å; W249-F252 VanDerWaalsContact O-N 3.17Å; I250-F252 PolarHBondContact O-N 3.1Å; F252-A255 WeakPolarHBondContact O-CB 3.05Å; F252-A255 PolarHBondContact O-N 3.22Å; F252-W256 PolarHBondContact O-N 3.3Å |
| 253 | A | 95.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -71.9 | -35.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | F193 L220 W249 I250 A255 W256 L257 | F193-A253 HydrophobicContact CB-CB 4.03Å; F193-A253 HydrophobicContact CD1-CB 4.27Å; F193-A253 HydrophobicContact CG-CB 4.45Å; L220-A253 HydrophobicContact CD1-CB 3.76Å; L220-A253 HydrophobicContact CD2-CB 3.57Å; L220-A253 HydrophobicContact CG-CB 4.34Å; W249-A253 VanDerWaalsContact O-CB 3.31Å; W249-A253 WeakPolarHBondContact O-CB 3.41Å; W249-A253 PolarHBondContact O-N 3.31Å; I250-A253 PolarHBondContact O-N 3.21Å; A253-A255 VanDerWaalsContact C-N 3.34Å; A253-W256 WeakPolarHBondContact O-CB 3.48Å; A253-W256 PolarHBondContact O-N 2.93Å; A253-L257 WeakPolarHBondContact O-CG 3.47Å; A253-L257 PolarHBondContact O-N 3.3Å |
| 254 | L | 93.8 | Very high | 90.2 | Very high | 16 Ų | 16 | 47.8 Ų | 47.8 | 8% | 0.084 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.9 | -38.7 | 168.3 | -72.5 | 174.1 | 0 | 0 | 0 | 111.6 | T116 L149 L220 T222 I250 W256 L257 A258 | T116-L254 HydrophobicContact CG2-CD1 3.64Å; L149-L254 HydrophobicContact CD1-CB 4.44Å; L149-L254 HydrophobicContact CD2-CB 3.89Å; L220-L254 HydrophobicContact CD2-CD2 4.33Å; L220-L254 HydrophobicContact CD2-CG 4.18Å; L220-L254 VanDerWaalsContact O-CD2 3.26Å; L220-L254 WeakPolarHBondContact O-CD2 3.38Å; T222-L254 HydrophobicContact CG2-CD2 4.02Å; I250-L254 HydrophobicContact CG2-CD1 3.75Å; I250-L254 HydrophobicContact CG2-CG 4.28Å; I250-L254 WeakPolarHBondContact O-CB 3.34Å; I250-L254 VanDerWaalsContact O-CG 3.27Å; I250-L254 WeakPolarHBondContact O-CG 3.33Å; I250-L254 PolarHBondContact O-N 2.9Å; L254-W256 VanDerWaalsContact C-N 3.31Å; L254-W256 PolarHBondContact O-N 3.48Å; L254-L257 PolarHBondContact O-N 3.12Å; L254-A258 VanDerWaalsContact O-CB 3.28Å; L254-A258 WeakPolarHBondContact O-CB 3.45Å; L254-A258 PolarHBondContact O-N 3.47Å |
| 255 | A | 91.4 | Very high | 90 | Very high | 2 Ų | 2 | 49.7 Ų | 49.7 | 2% | 0.017 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.9 | -33.7 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | L149 M152 I251 F252 A253 L259 | L149-A255 HydrophobicContact CD2-CB 3.93Å; M152-A255 HydrophobicContact CB-CB 3.73Å; M152-A255 HydrophobicContact CG-CB 4.32Å; I251-A255 WeakPolarHBondContact O-CB 3.49Å; I251-A255 PolarHBondContact O-N 3.13Å; I251-A255 VanDerWaalsContact O-N 3.14Å; F252-A255 WeakPolarHBondContact O-CB 3.05Å; F252-A255 PolarHBondContact O-N 3.22Å; A253-A255 VanDerWaalsContact C-N 3.34Å; A255-L259 PolarHBondContact O-N 3.03Å; A255-L259 VanDerWaalsContact O-N 3.16Å |
| 256 | W | 91.9 | Very high | 89.7 | Confident | 5 Ų | 5 | 47.2 Ų | 47.2 | 2% | 0.019 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -68.2 | -44.3 | 173.4 | -179.4 | -104.9 | 0 | 0 | 0 | 112.5 | F185 F186 G189 S190 F193 F252 A253 L254 L259 I260 | F185-W256 AromaticContact CD1-CH2 3.76Å; F185-W256 HydrophobicContact CD1-CH2 3.76Å; F185-W256 HydrophobicContact CD1-CZ3 4.2Å; F185-W256 AromaticContact CE1-CH2 3.48Å; F185-W256 HydrophobicContact CE1-CH2 3.48Å; F185-W256 VanDerWaalsContact CE1-CH2 3.48Å; F185-W256 AromaticContact CE1-CZ3 3.45Å; F185-W256 HydrophobicContact CE1-CZ3 3.45Å; F185-W256 VanDerWaalsContact CE1-CZ3 3.45Å; F185-W256 HydrophobicContact CZ-CH2 4.21Å; F185-W256 AromaticContact CZ-CZ3 3.82Å; F185-W256 HydrophobicContact CZ-CZ3 3.82Å; F186-W256 HydrophobicContact CD1-CH2 4.03Å; F186-W256 AromaticContact CD1-CZ2 3.85Å; F186-W256 HydrophobicContact CD1-CZ2 3.85Å; G189-W256 VanDerWaalsContact C-CE2 3.45Å; G189-W256 VanDerWaalsContact CA-CZ2 3.44Å; S190-W256 PolarHBondContact OG-NE1 2.94Å; F193-W256 HydrophobicContact CB-CB 4.41Å; F193-W256 HydrophobicContact CB-CG 4.27Å; F193-W256 HydrophobicContact CD2-CB 3.68Å; F193-W256 AromaticContact CD2-CD1 4Å; F193-W256 AromaticContact CD2-CD2 3.73Å; F193-W256 HydrophobicContact CD2-CD2 3.73Å; F193-W256 HydrophobicContact CD2-CE3 4.12Å; F193-W256 AromaticContact CD2-CG 3.5Å; F193-W256 HydrophobicContact CD2-CG 3.5Å; F193-W256 VanDerWaalsContact CD2-CG 3.5Å; F193-W256 HydrophobicContact CE2-CB 4.2Å; F193-W256 HydrophobicContact CE2-CD2 4.18Å; F193-W256 HydrophobicContact CE2-CE3 4.08Å; F193-W256 HydrophobicContact CE2-CG 4.22Å; F193-W256 HydrophobicContact CG-CB 4.12Å; F193-W256 HydrophobicContact CG-CG 4.18Å; F252-W256 PolarHBondContact O-N 3.3Å; A253-W256 WeakPolarHBondContact O-CB 3.48Å; A253-W256 PolarHBondContact O-N 2.93Å; L254-W256 VanDerWaalsContact C-N 3.31Å; L254-W256 PolarHBondContact O-N 3.48Å; W256-L259 HydrophobicContact CE3-CD2 4.17Å; W256-L259 HydrophobicContact CH2-CD2 4.47Å; W256-L259 HydrophobicContact CZ3-CD2 3.92Å; W256-L259 WeakPolarHBondContact O-CB 3.39Å; W256-L259 PolarHBondContact O-N 2.95Å; W256-I260 HydrophobicContact CZ2-CD1 4.42Å; W256-I260 VanDerWaalsContact NE1-CD1 3.35Å; W256-I260 PolarHBondContact O-N 3.45Å; W256-I260 VanDerWaalsContact O-N 3.14Å |
| 257 | L | 91.6 | Very high | 89.3 | Confident | 43 Ų | 43 | 49.7 Ų | 49.7 | 23% | 0.225 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.5 | -38.4 | 173.8 | -69.6 | 176 | 0 | 0 | 0 | 112 | L194 L220 A253 L254 L259 I260 L261 | L194-L257 HydrophobicContact CD1-CD2 4.21Å; L194-L257 HydrophobicContact CD2-CD2 4.22Å; L194-L257 HydrophobicContact CD2-CG 4.42Å; L220-L257 HydrophobicContact CB-CD1 3.71Å; L220-L257 HydrophobicContact CD1-CD1 4.44Å; A253-L257 WeakPolarHBondContact O-CG 3.47Å; A253-L257 PolarHBondContact O-N 3.3Å; L254-L257 PolarHBondContact O-N 3.12Å; L257-L259 PolarHBondContact O-N 3.32Å; L257-I260 HydrophobicContact CD2-CD1 4.49Å; L257-I260 PolarHBondContact O-N 3.38Å; L257-I260 VanDerWaalsContact O-N 3.15Å; L257-L261 WeakPolarHBondContact O-CB 3.38Å; L257-L261 WeakPolarHBondContact O-CG 3.46Å; L257-L261 PolarHBondContact O-N 2.94Å |
| 258 | A | 87.6 | Confident | 88.9 | Confident | 33 Ų | 33 | 52.5 Ų | 52.5 | 27% | 0.273 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.3 | -24.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L254 N262 | L254-A258 VanDerWaalsContact O-CB 3.28Å; L254-A258 WeakPolarHBondContact O-CB 3.45Å; L254-A258 PolarHBondContact O-N 3.47Å; A258-N262 VanDerWaalsContact O-CB 3.24Å; A258-N262 WeakPolarHBondContact O-CB 3.36Å |
| 259 | L | 86.1 | Confident | 88.5 | Confident | 1 Ų | 1 | 51.2 Ų | 51.2 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -71.9 | -51.8 | 167.6 | 175.5 | 72.8 | 0 | 0 | 0 | 110.9 | L156 T157 L160 F185 F186 A255 W256 L257 L261 N262 M263 | L156-L259 HydrophobicContact CB-CD1 4.05Å; L156-L259 HydrophobicContact CB-CD2 3.83Å; L156-L259 HydrophobicContact CB-CG 4.4Å; L156-L259 HydrophobicContact CD1-CB 4.3Å; L156-L259 HydrophobicContact CD1-CD2 4.27Å; T157-L259 WeakPolarHBondContact OG1-CD1 3.4Å; L160-L259 HydrophobicContact CD1-CD1 4.35Å; L160-L259 HydrophobicContact CD1-CD2 4.13Å; F185-L259 HydrophobicContact CE1-CD2 4.11Å; F186-L259 HydrophobicContact CE1-CD2 4Å; F186-L259 HydrophobicContact CE1-CG 4.26Å; F186-L259 HydrophobicContact CZ-CD2 4.39Å; A255-L259 PolarHBondContact O-N 3.03Å; A255-L259 VanDerWaalsContact O-N 3.16Å; W256-L259 HydrophobicContact CE3-CD2 4.17Å; W256-L259 HydrophobicContact CH2-CD2 4.47Å; W256-L259 HydrophobicContact CZ3-CD2 3.92Å; W256-L259 WeakPolarHBondContact O-CB 3.39Å; W256-L259 PolarHBondContact O-N 2.95Å; L257-L259 PolarHBondContact O-N 3.32Å; L259-L261 VanDerWaalsContact C-N 3.26Å; L259-L261 PolarHBondContact O-N 2.86Å; L259-N262 CarbonylContact O-C 3.57Å; L259-N262 PolarHBondContact O-N 2.89Å; L259-M263 HydrophobicContact CD1-CG 4.27Å; L259-M263 HydrophobicContact CD1-SD 4.27Å |
| 260 | I | 86.9 | Confident | 87.9 | Confident | 65 Ų | 65 | 52.9 Ų | 52.9 | 33% | 0.333 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -57.4 | -39.2 | -178.3 | -70.9 | 168.5 | 0 | 0 | 0 | 111.8 | F186 W256 L257 N262 | F186-I260 HydrophobicContact CD1-CD1 4.49Å; F186-I260 HydrophobicContact CD1-CG1 3.87Å; F186-I260 HydrophobicContact CE1-CG1 3.74Å; W256-I260 HydrophobicContact CZ2-CD1 4.42Å; W256-I260 VanDerWaalsContact NE1-CD1 3.35Å; W256-I260 PolarHBondContact O-N 3.45Å; W256-I260 VanDerWaalsContact O-N 3.14Å; L257-I260 HydrophobicContact CD2-CD1 4.49Å; L257-I260 PolarHBondContact O-N 3.38Å; L257-I260 VanDerWaalsContact O-N 3.15Å; I260-N262 VanDerWaalsContact C-N 3.26Å; I260-N262 PolarHBondContact O-N 2.96Å |
| 261 | L | 82.8 | Confident | 87.3 | Confident | 152 Ų | 152 | 56.6 Ų | 56.6 | 80% | 0.796 | 29% | 0.294 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.5 | -3.1 | 179.7 | -65.6 | 171.3 | 0 | 0 | 0 | 114.4 | L257 L259 | L257-L261 WeakPolarHBondContact O-CB 3.38Å; L257-L261 WeakPolarHBondContact O-CG 3.46Å; L257-L261 PolarHBondContact O-N 2.94Å; L259-L261 VanDerWaalsContact C-N 3.26Å; L259-L261 PolarHBondContact O-N 2.86Å |
| 262 | N | 74.4 | Confident | 86.8 | Confident | 130 Ų | 130 | 58 Ų | 58 | 70% | 0.695 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -126.8 | 24.7 | -174.3 | -169 | 97.9 | 0 | 0 | 0 | 111.7 | A258 L259 I260 | A258-N262 VanDerWaalsContact O-CB 3.24Å; A258-N262 WeakPolarHBondContact O-CB 3.36Å; L259-N262 CarbonylContact O-C 3.57Å; L259-N262 PolarHBondContact O-N 2.89Å; I260-N262 VanDerWaalsContact C-N 3.26Å; I260-N262 PolarHBondContact O-N 2.96Å |
| 263 | M | 67.4 | Low | 86.3 | Confident | 146 Ų | 146 | 53.9 Ų | 53.9 | 72% | 0.719 | 29% | 0.288 | S | S | * | . | trans | -121 | 0 | 173.8 | -73.8 | -140.5 | 61.3 | 0 | 0 | 112.1 | L160 F186 L259 | L160-M263 HydrophobicContact CD1-SD 3.81Å; F186-M263 HydrophobicContact CE2-SD 4.2Å; F186-M263 HydrophobicContact CZ-CG 4.37Å; F186-M263 HydrophobicContact CZ-SD 3.71Å; L259-M263 HydrophobicContact CD1-CG 4.27Å; L259-M263 HydrophobicContact CD1-SD 4.27Å |
Retrieved 263 of 263 residues in 369.4 ms
(Link to these results)