| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 51.4 | Low | 55.8 | Low | 225 Ų | 225 | 130.7 Ų | 130.7 | 100% | 1.108 | 70% | 0.701 | S | S | * | * | 0 | 126.8 | 0 | -98.4 | 77.5 | 162.4 | 0 | 0 | 107.5 | |||||
| 2 | N | 56.2 | Low | 55.7 | Low | 155 Ų | 155 | 131.4 Ų | 131.4 | 83% | 0.829 | 70% | 0.704 | S | S | * | * | trans | 109.9 | 31.3 | 165.6 | -56 | -25.2 | 0 | 0 | 0 | 121 | ||||
| 3 | D | 55.6 | Low | 55.5 | Low | 151 Ų | 151 | 127 Ų | 127 | 81% | 0.807 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -119.8 | -0.6 | 169.3 | -63.1 | -70.5 | 0 | 0 | 0 | 114.6 | ||
| 4 | A | 55.7 | Low | 55.1 | Low | 93 Ų | 93 | 125.7 Ų | 125.7 | 77% | 0.769 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -98.6 | -13.2 | -171.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 5 | S | 56.3 | Low | 54.6 | Low | 95 Ų | 95 | 123.8 Ų | 123.8 | 66% | 0.664 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -101.2 | 17 | -177.1 | -74.4 | 0 | 0 | 0 | 0 | 113.8 | D8 Y9 | S5-D8 WeakPolarHBondContact CA-OD1 3.24Å; S5-D8 VanDerWaalsContact O-OD1 3.12Å; S5-Y9 WeakPolarHBondContact O-CD1 3.47Å |
| 6 | T | 56.6 | Low | 54.5 | Low | 62 Ų | 62 | 125.9 Ų | 125.9 | 38% | 0.38 | 70% | 0.698 | S | S | . | * | S | Bend | trans | -100.2 | -15.3 | -172.4 | -160.9 | 0 | 0 | 0 | 0 | 114.4 | Y9 | T6-Y9 VanDerWaalsContact C-CE1 3.43Å; T6-Y9 VanDerWaalsContact O-CD1 3.29Å; T6-Y9 WeakPolarHBondContact O-CD1 3.06Å; T6-Y9 WeakPolarHBondContact O-CE1 3.4Å; T6-Y9 PolarHBondContact O-OH 2.72Å; T6-Y9 WeakPolarHBondContact OG1-CE1 3.36Å; T6-Y9 PolarHBondContact OG1-OH 2.78Å |
| 7 | M | 59.8 | Low | 54.3 | Low | 161 Ų | 161 | 125.8 Ų | 125.8 | 79% | 0.793 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -101.8 | -13.3 | -174.7 | -57.9 | -160.5 | 104.8 | 0 | 0 | 112.9 | ||
| 8 | D | 56.5 | Low | 53.5 | Low | 84 Ų | 84 | 128.9 Ų | 128.9 | 45% | 0.449 | 71% | 0.71 | S | S | . | * | H | α-helix | trans | -82.6 | -23.8 | 174.4 | 51.7 | -63.6 | 0 | 0 | 0 | 112.9 | S5 L12 | S5-D8 WeakPolarHBondContact CA-OD1 3.24Å; S5-D8 VanDerWaalsContact O-OD1 3.12Å; D8-L12 VanDerWaalsContact O-CD1 3.25Å; D8-L12 WeakPolarHBondContact O-CD1 3.05Å; D8-L12 PolarHBondContact O-N 3.42Å |
| 9 | Y | 56.2 | Low | 53.2 | Low | 124 Ų | 124 | 131 Ų | 131 | 49% | 0.486 | 71% | 0.713 | S | S | . | * | H | α-helix | trans | -79.5 | -28.8 | 177.5 | 68.7 | -114.6 | 0 | 0 | 0 | 114.2 | S5 T6 S13 | S5-Y9 WeakPolarHBondContact O-CD1 3.47Å; T6-Y9 VanDerWaalsContact C-CE1 3.43Å; T6-Y9 VanDerWaalsContact O-CD1 3.29Å; T6-Y9 WeakPolarHBondContact O-CD1 3.06Å; T6-Y9 WeakPolarHBondContact O-CE1 3.4Å; T6-Y9 PolarHBondContact O-OH 2.72Å; T6-Y9 WeakPolarHBondContact OG1-CE1 3.36Å; T6-Y9 PolarHBondContact OG1-OH 2.78Å; Y9-S13 PolarHBondContact O-N 2.73Å; Y9-S13 PolarHBondContact O-OG 3.32Å |
| 10 | E | 54.1 | Low | 53 | Low | 139 Ų | 139 | 129.1 Ų | 129.1 | 65% | 0.65 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -75.5 | -30.5 | 174.8 | -79.3 | -73.5 | 101.4 | 0 | 0 | 111.6 | S13 | E10-S13 PolarHBondContact O-N 2.66Å |
| 11 | L | 55.3 | Low | 52.8 | Low | 149 Ų | 149 | 127.9 Ų | 127.9 | 78% | 0.78 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -83.7 | -22.1 | 179.4 | -157.8 | 134.9 | 0 | 0 | 0 | 112.9 | S13 | L11-S13 VanDerWaalsContact C-N 3.32Å |
| 12 | L | 55.2 | Low | 52.7 | Low | 139 Ų | 139 | 119.5 Ų | 119.5 | 73% | 0.728 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -87.1 | 2.3 | 167.1 | -91.7 | 99.5 | 0 | 0 | 0 | 114 | D8 P14 | D8-L12 VanDerWaalsContact O-CD1 3.25Å; D8-L12 WeakPolarHBondContact O-CD1 3.05Å; D8-L12 PolarHBondContact O-N 3.42Å; L12-P14 WeakPolarHBondContact O-CD 3.04Å |
| 13 | S | 52.9 | Low | 52.4 | Low | 74 Ų | 74 | 117.1 Ų | 117.1 | 52% | 0.517 | 69% | 0.688 | S | S | . | * | trans | -108.1 | 69.2 | 171.4 | -63.8 | 0 | 0 | 0 | 0 | 111.5 | Y9 E10 L11 S15 | Y9-S13 PolarHBondContact O-N 2.73Å; Y9-S13 PolarHBondContact O-OG 3.32Å; E10-S13 PolarHBondContact O-N 2.66Å; L11-S13 VanDerWaalsContact C-N 3.32Å; S13-S15 PolarHBondContact O-N 3.03Å | ||
| 14 | P | 50.3 | Low | 52.4 | Low | 109 Ų | 109 | 113.6 Ų | 113.6 | 71% | 0.708 | 68% | 0.68 | S | S | * | * | trans | -67.8 | 91 | 145.9 | 28.4 | -20.3 | 0 | 0 | 0 | 106 | L12 L16 | L12-P14 WeakPolarHBondContact O-CD 3.04Å; P14-L16 PolarHBondContact O-N 2.78Å; P14-L16 VanDerWaalsContact O-N 3.16Å | ||
| 15 | S | 47.2 | Very low | 52.7 | Low | 97 Ų | 97 | 112.1 Ų | 112.1 | 68% | 0.678 | 67% | 0.674 | S | S | * | * | trans | -28.4 | 119 | 144.7 | 45.7 | 0 | 0 | 0 | 0 | 110.3 | S13 V17 | S13-S15 PolarHBondContact O-N 3.03Å; S15-V17 PolarHBondContact O-N 3.46Å; S15-V17 VanDerWaalsContact O-N 3.14Å | ||
| 16 | L | 53.4 | Low | 53.1 | Low | 158 Ų | 158 | 112.7 Ų | 112.7 | 83% | 0.827 | 67% | 0.668 | S | S | * | * | S | Bend | 37.1 | 79 | 114.7 | -175.2 | 144.2 | 0 | 0 | 0 | 112.1 | P14 | P14-L16 PolarHBondContact O-N 2.78Å; P14-L16 VanDerWaalsContact O-N 3.16Å | |
| 17 | V | 49.9 | Very low | 54 | Low | 124 Ų | 124 | 115.1 Ų | 115.1 | 75% | 0.752 | 68% | 0.678 | S | S | * | * | -175.6 | 63.6 | 129.4 | -168.6 | 0 | 0 | 0 | 0 | 106.8 | S15 | S15-V17 PolarHBondContact O-N 3.46Å; S15-V17 VanDerWaalsContact O-N 3.14Å | |||
| 18 | E | 40 | Very low | 55 | Low | 181 Ų | 181 | 111.2 Ų | 111.2 | 85% | 0.846 | 67% | 0.671 | S | S | * | * | trans | -113.6 | 69.4 | 143 | -153.6 | 167.8 | 114.5 | 0 | 0 | 104.9 | P20 | E18-P20 WeakPolarHBondContact O-CD 3.06Å; E18-P20 VanDerWaalsContact O-N 3.15Å | ||
| 19 | H | 48.5 | Very low | 56.3 | Low | 169 Ų | 169 | 114.8 Ų | 114.8 | 78% | 0.782 | 69% | 0.685 | S | S | * | * | trans | -56.1 | 110.6 | 135.5 | -92.3 | 80.5 | 0 | 0 | 0 | 102.2 | A21 | H19-A21 PolarHBondContact O-N 3.15Š| ||
| 20 | P | 48.7 | Very low | 57.7 | Low | 93 Ų | 93 | 113.1 Ų | 113.1 | 60% | 0.604 | 68% | 0.682 | S | S | * | * | trans | -51.1 | 131.5 | 164.7 | 24.2 | -31.2 | 0 | 0 | 0 | 103.8 | E18 G22 | E18-P20 WeakPolarHBondContact O-CD 3.06Å; E18-P20 VanDerWaalsContact O-N 3.15Å; P20-G22 PolarHBondContact O-N 3.3Å | ||
| 21 | A | 49.7 | Very low | 59.2 | Low | 103 Ų | 103 | 112.9 Ų | 112.9 | 85% | 0.851 | 68% | 0.679 | S | S | * | * | trans | -59 | 60.7 | 156.5 | 0 | 0 | 0 | 0 | 0 | 108 | H19 A23 | H19-A21 PolarHBondContact O-N 3.15Å; A21-A23 PolarHBondContact O-N 2.79Å | ||
| 22 | G | 48.2 | Very low | 60.9 | Low | 50 Ų | 50 | 110 Ų | 110 | 52% | 0.515 | 67% | 0.668 | S | S | . | * | trans | -92.3 | 39.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | P20 A24 | P20-G22 PolarHBondContact O-N 3.3Å; G22-A24 VanDerWaalsContact CA-N 3.33Å; G22-A24 PolarHBondContact O-N 3.27Å | ||
| 23 | A | 50.8 | Low | 62.7 | Low | 105 Ų | 105 | 107.6 Ų | 107.6 | 87% | 0.868 | 66% | 0.658 | S | S | * | * | trans | -72.1 | 16.2 | 138.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | A21 G25 | A21-A23 PolarHBondContact O-N 2.79Å; A23-G25 PolarHBondContact O-N 2.78Å; A23-G25 VanDerWaalsContact O-N 3.15Å | ||
| 24 | A | 56 | Low | 64.5 | Low | 77 Ų | 77 | 109 Ų | 109 | 64% | 0.636 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -56.1 | 112.1 | 155.4 | 0 | 0 | 0 | 0 | 0 | 107.2 | G22 M26 | G22-A24 VanDerWaalsContact CA-N 3.33Å; G22-A24 PolarHBondContact O-N 3.27Å; A24-M26 PolarHBondContact O-N 3.32Å |
| 25 | G | 60.8 | Low | 66.5 | Low | 62 Ų | 62 | 106.6 Ų | 106.6 | 64% | 0.639 | 64% | 0.644 | S | S | * | * | trans | -42.3 | 126.4 | -171 | 0 | 0 | 0 | 0 | 0 | 111.6 | A23 D27 | A23-G25 PolarHBondContact O-N 2.78Å; A23-G25 VanDerWaalsContact O-N 3.15Å; G25-D27 PolarHBondContact O-N 2.79Å | ||
| 26 | M | 64.7 | Low | 68.9 | Low | 107 Ų | 107 | 108 Ų | 108 | 53% | 0.527 | 64% | 0.638 | S | S | . | * | trans | -50.1 | 110.8 | 178.1 | -152.4 | 151.2 | 63.5 | 0 | 0 | 108.6 | A24 Q30 K31 | A24-M26 PolarHBondContact O-N 3.32Å; M26-Q30 HydrophobicContact CG-CB 3.94Å; M26-Q30 HydrophobicContact CG-CG 3.65Å; M26-Q30 HydrophobicContact SD-CG 4.4Å; M26-K31 HydrophobicContact CE-CG 4.42Å | ||
| 27 | D | 76.4 | Confident | 70.9 | Confident | 113 Ų | 113 | 104.3 Ų | 104.3 | 60% | 0.604 | 62% | 0.622 | S | S | * | * | trans | -52.3 | 146.4 | -177.3 | -70 | -62.4 | 0 | 0 | 0 | 109.4 | G25 E29 Q30 K31 | G25-D27 PolarHBondContact O-N 2.79Å; D27-E29 PolarHBondContact O-N 3.25Å; D27-Q30 WeakPolarHBondContact O-CA 3.46Å; D27-Q30 WeakPolarHBondContact O-CB 2.99Å; D27-Q30 PolarHBondContact O-N 2.74Å; D27-K31 PolarHBondContact O-N 3.03Å | ||
| 28 | A | 80.6 | Confident | 73.1 | Confident | 78 Ų | 78 | 103.1 Ų | 103.1 | 65% | 0.645 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -53.4 | -34.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | K31 T32 | A28-K31 PolarHBondContact O-N 3.41Å; A28-T32 WeakPolarHBondContact O-CG2 3.47Å; A28-T32 PolarHBondContact O-N 3.32Å; A28-T32 PolarHBondContact O-OG1 3.36Å |
| 29 | E | 84.3 | Confident | 75.8 | Confident | 159 Ų | 159 | 100.7 Ų | 100.7 | 74% | 0.743 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -59.4 | -48.4 | 172.4 | -56.7 | -99.5 | 113.2 | 0 | 0 | 112.1 | D27 K31 T32 V33 | D27-E29 PolarHBondContact O-N 3.25Å; E29-K31 VanDerWaalsContact C-N 3.33Å; E29-K31 PolarHBondContact O-N 2.64Å; E29-T32 PolarHBondContact O-N 3.32Å; E29-T32 PolarHBondContact O-OG1 2.9Å; E29-V33 VanDerWaalsContact O-CG2 3.29Å; E29-V33 WeakPolarHBondContact O-CG2 2.82Å; E29-V33 PolarHBondContact O-N 2.89Å; E29-V33 VanDerWaalsContact O-N 3.08Å |
| 30 | Q | 84.6 | Confident | 78.1 | Confident | 90 Ų | 90 | 96.3 Ų | 96.3 | 42% | 0.421 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.7 | -38.6 | 178.1 | -175.7 | 168.4 | -39.9 | 0 | 0 | 110.6 | M26 D27 T32 V33 F34 | M26-Q30 HydrophobicContact CG-CB 3.94Å; M26-Q30 HydrophobicContact CG-CG 3.65Å; M26-Q30 HydrophobicContact SD-CG 4.4Å; D27-Q30 WeakPolarHBondContact O-CA 3.46Å; D27-Q30 WeakPolarHBondContact O-CB 2.99Å; D27-Q30 PolarHBondContact O-N 2.74Å; Q30-T32 PolarHBondContact O-N 3.36Å; Q30-V33 PolarHBondContact O-N 2.72Å; Q30-F34 HydrophobicContact CG-CD2 3.61Å; Q30-F34 HydrophobicContact CG-CE2 3.62Å; Q30-F34 VanDerWaalsContact O-CD2 3.31Å; Q30-F34 WeakPolarHBondContact O-CD2 3.49Å; Q30-F34 PolarHBondContact O-N 3.48Å |
| 31 | K | 86.6 | Confident | 80.3 | Confident | 134 Ų | 134 | 97.2 Ų | 97.2 | 58% | 0.583 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -63.4 | -39.1 | 178.2 | -160.8 | 172.9 | 80.3 | 173.4 | 0 | 112.4 | M26 D27 A28 E29 A35 | M26-K31 HydrophobicContact CE-CG 4.42Å; D27-K31 PolarHBondContact O-N 3.03Å; A28-K31 PolarHBondContact O-N 3.41Å; E29-K31 VanDerWaalsContact C-N 3.33Å; E29-K31 PolarHBondContact O-N 2.64Å; K31-A35 VanDerWaalsContact O-CB 3.25Å; K31-A35 WeakPolarHBondContact O-CB 3.2Å; K31-A35 PolarHBondContact O-N 3.23Å |
| 32 | T | 91 | Very high | 82.5 | Confident | 89 Ų | 89 | 96.5 Ų | 96.5 | 55% | 0.546 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -70.4 | -39.4 | 176 | 56.5 | 0 | 0 | 0 | 0 | 111.6 | A28 E29 Q30 A35 F36 | A28-T32 WeakPolarHBondContact O-CG2 3.47Å; A28-T32 PolarHBondContact O-N 3.32Å; A28-T32 PolarHBondContact O-OG1 3.36Å; E29-T32 PolarHBondContact O-N 3.32Å; E29-T32 PolarHBondContact O-OG1 2.9Å; Q30-T32 PolarHBondContact O-N 3.36Å; T32-A35 PolarHBondContact O-N 3.43Å; T32-F36 WeakPolarHBondContact O-CB 3.28Å; T32-F36 PolarHBondContact O-N 3.48Å |
| 33 | V | 92.5 | Very high | 84.7 | Confident | 88 Ų | 88 | 98.9 Ų | 98.9 | 53% | 0.533 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -60.9 | -49.9 | 174.8 | 173 | 0 | 0 | 0 | 0 | 110.5 | E29 Q30 A35 F36 V37 | E29-V33 VanDerWaalsContact O-CG2 3.29Å; E29-V33 WeakPolarHBondContact O-CG2 2.82Å; E29-V33 PolarHBondContact O-N 2.89Å; E29-V33 VanDerWaalsContact O-N 3.08Å; Q30-V33 PolarHBondContact O-N 2.72Å; V33-A35 VanDerWaalsContact C-N 3.34Å; V33-A35 PolarHBondContact O-N 3.31Å; V33-F36 PolarHBondContact O-N 3.33Å; V33-V37 HydrophobicContact CG1-CG2 4.3Å; V33-V37 WeakPolarHBondContact O-CB 3.32Å; V33-V37 VanDerWaalsContact O-CG2 3.24Å; V33-V37 WeakPolarHBondContact O-CG2 3.1Å; V33-V37 PolarHBondContact O-N 2.87Å |
| 34 | F | 90.8 | Very high | 86.8 | Confident | 104 Ų | 104 | 99.3 Ų | 99.3 | 46% | 0.456 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.4 | -42.1 | 176.2 | -88.6 | -81.7 | 0 | 0 | 0 | 112.1 | Q30 F36 V37 I38 | Q30-F34 HydrophobicContact CG-CD2 3.61Å; Q30-F34 HydrophobicContact CG-CE2 3.62Å; Q30-F34 VanDerWaalsContact O-CD2 3.31Å; Q30-F34 WeakPolarHBondContact O-CD2 3.49Å; Q30-F34 PolarHBondContact O-N 3.48Å; F34-F36 VanDerWaalsContact C-N 3.33Å; F34-F36 PolarHBondContact O-N 2.8Å; F34-V37 PolarHBondContact O-N 3.49Å; F34-I38 WeakPolarHBondContact O-CB 3.34Å; F34-I38 WeakPolarHBondContact O-CD1 3.01Å; F34-I38 WeakPolarHBondContact O-CG1 3.5Å; F34-I38 PolarHBondContact O-N 2.75Å |
| 35 | A | 92.7 | Very high | 88.6 | Confident | 57 Ų | 57 | 99.4 Ų | 99.4 | 47% | 0.471 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.8 | -42.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | K31 T32 V33 F39 | K31-A35 VanDerWaalsContact O-CB 3.25Å; K31-A35 WeakPolarHBondContact O-CB 3.2Å; K31-A35 PolarHBondContact O-N 3.23Å; T32-A35 PolarHBondContact O-N 3.43Å; V33-A35 VanDerWaalsContact C-N 3.34Å; V33-A35 PolarHBondContact O-N 3.31Å; A35-F39 WeakPolarHBondContact O-CB 3.27Å; A35-F39 PolarHBondContact O-N 3.49Å |
| 36 | F | 95.8 | Very high | 90.1 | Very high | 127 Ų | 127 | 100.1 Ų | 100.1 | 56% | 0.557 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -68.5 | -42.3 | 178 | -172 | -106.1 | 0 | 0 | 0 | 111.8 | T32 V33 F34 F39 L40 | T32-F36 WeakPolarHBondContact O-CB 3.28Å; T32-F36 PolarHBondContact O-N 3.48Å; V33-F36 PolarHBondContact O-N 3.33Å; F34-F36 VanDerWaalsContact C-N 3.33Å; F34-F36 PolarHBondContact O-N 2.8Å; F36-F39 PolarHBondContact O-N 2.96Å; F36-L40 HydrophobicContact CD1-CD1 3.76Å; F36-L40 HydrophobicContact CD1-CG 4.05Å; F36-L40 HydrophobicContact CE1-CD1 3.26Å; F36-L40 HydrophobicContact CE1-CD2 4.32Å; F36-L40 HydrophobicContact CE1-CG 3.77Å; F36-L40 HydrophobicContact CE2-CD2 4.32Å; F36-L40 HydrophobicContact CE2-CG 4.33Å; F36-L40 HydrophobicContact CG-CG 4.48Å; F36-L40 HydrophobicContact CZ-CD1 3.76Å; F36-L40 HydrophobicContact CZ-CD2 3.97Å; F36-L40 HydrophobicContact CZ-CG 3.91Å; F36-L40 WeakPolarHBondContact O-CB 3.27Å; F36-L40 VanDerWaalsContact O-CG 3.31Å; F36-L40 WeakPolarHBondContact O-CG 3.33Å; F36-L40 PolarHBondContact O-N 2.92Å |
| 37 | V | 96.3 | Very high | 91.2 | Very high | 80 Ų | 80 | 98.4 Ų | 98.4 | 49% | 0.485 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.3 | -46.9 | 175.5 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | V33 F34 L40 L41 | V33-V37 HydrophobicContact CG1-CG2 4.3Å; V33-V37 WeakPolarHBondContact O-CB 3.32Å; V33-V37 VanDerWaalsContact O-CG2 3.24Å; V33-V37 WeakPolarHBondContact O-CG2 3.1Å; V33-V37 PolarHBondContact O-N 2.87Å; F34-V37 PolarHBondContact O-N 3.49Å; V37-L40 PolarHBondContact O-N 3.16Å; V37-L41 WeakPolarHBondContact O-CB 3.14Å; V37-L41 PolarHBondContact O-N 3.49Å |
| 38 | I | 96.1 | Very high | 91.7 | Very high | 100 Ų | 100 | 96.9 Ų | 96.9 | 51% | 0.513 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.5 | -44.5 | 176.5 | -67.1 | 165.7 | 0 | 0 | 0 | 110.4 | F34 L40 L41 V42 | F34-I38 WeakPolarHBondContact O-CB 3.34Å; F34-I38 WeakPolarHBondContact O-CD1 3.01Å; F34-I38 WeakPolarHBondContact O-CG1 3.5Å; F34-I38 PolarHBondContact O-N 2.75Å; I38-L40 PolarHBondContact O-N 3.14Å; I38-L41 WeakPolarHBondContact O-CB 3.11Å; I38-L41 PolarHBondContact O-N 3.44Å; I38-V42 HydrophobicContact CG2-CG2 4.42Å; I38-V42 WeakPolarHBondContact O-CG2 3.49Å; I38-V42 PolarHBondContact O-N 2.9Å |
| 39 | F | 96.8 | Very high | 92.1 | Very high | 130 Ų | 130 | 96.7 Ų | 96.7 | 57% | 0.57 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.8 | -46.7 | 177.3 | 178 | -94.7 | 0 | 0 | 0 | 111.6 | A35 F36 L41 V42 F43 | A35-F39 WeakPolarHBondContact O-CB 3.27Å; A35-F39 PolarHBondContact O-N 3.49Å; F36-F39 PolarHBondContact O-N 2.96Å; F39-L41 VanDerWaalsContact C-N 3.33Å; F39-L41 PolarHBondContact O-N 3.42Å; F39-V42 PolarHBondContact O-N 2.84Å; F39-F43 VanDerWaalsContact O-CB 3.25Å; F39-F43 WeakPolarHBondContact O-CB 3.38Å; F39-F43 PolarHBondContact O-N 2.82Å |
| 40 | L | 96.1 | Very high | 92.1 | Very high | 76 Ų | 76 | 95.9 Ų | 95.9 | 40% | 0.398 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.4 | -38.9 | 175.9 | -75 | -170.3 | 0 | 0 | 0 | 111.8 | F36 V37 I38 F43 L44 | F36-L40 HydrophobicContact CD1-CD1 3.76Å; F36-L40 HydrophobicContact CD1-CG 4.05Å; F36-L40 HydrophobicContact CE1-CD1 3.26Å; F36-L40 HydrophobicContact CE1-CD2 4.32Å; F36-L40 HydrophobicContact CE1-CG 3.77Å; F36-L40 HydrophobicContact CE2-CD2 4.32Å; F36-L40 HydrophobicContact CE2-CG 4.33Å; F36-L40 HydrophobicContact CG-CG 4.48Å; F36-L40 HydrophobicContact CZ-CD1 3.76Å; F36-L40 HydrophobicContact CZ-CD2 3.97Å; F36-L40 HydrophobicContact CZ-CG 3.91Å; F36-L40 WeakPolarHBondContact O-CB 3.27Å; F36-L40 VanDerWaalsContact O-CG 3.31Å; F36-L40 WeakPolarHBondContact O-CG 3.33Å; F36-L40 PolarHBondContact O-N 2.92Å; V37-L40 PolarHBondContact O-N 3.16Å; I38-L40 PolarHBondContact O-N 3.14Å; L40-F43 PolarHBondContact O-N 3.43Å; L40-L44 WeakPolarHBondContact O-CB 3.26Å; L40-L44 PolarHBondContact O-N 2.99Å |
| 41 | L | 96.2 | Very high | 91.7 | Very high | 112 Ų | 112 | 94.6 Ų | 94.6 | 59% | 0.586 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.7 | -46.7 | 176.6 | -163.9 | 100.8 | 0 | 0 | 0 | 110.9 | V37 I38 F39 L44 V45 | V37-L41 WeakPolarHBondContact O-CB 3.14Å; V37-L41 PolarHBondContact O-N 3.49Å; I38-L41 WeakPolarHBondContact O-CB 3.11Å; I38-L41 PolarHBondContact O-N 3.44Å; F39-L41 VanDerWaalsContact C-N 3.33Å; F39-L41 PolarHBondContact O-N 3.42Å; L41-L44 PolarHBondContact O-N 2.63Å; L41-V45 WeakPolarHBondContact O-CG2 3.25Å; L41-V45 PolarHBondContact O-N 3.45Å |
| 42 | V | 96.3 | Very high | 91.1 | Very high | 89 Ų | 89 | 93 Ų | 93 | 54% | 0.539 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.5 | -43.9 | 176.1 | 172 | 0 | 0 | 0 | 0 | 110.8 | I38 F39 L44 V45 M46 | I38-V42 HydrophobicContact CG2-CG2 4.42Å; I38-V42 WeakPolarHBondContact O-CG2 3.49Å; I38-V42 PolarHBondContact O-N 2.9Å; F39-V42 PolarHBondContact O-N 2.84Å; V42-L44 VanDerWaalsContact C-N 3.34Å; V42-V45 PolarHBondContact O-N 3.31Å; V42-M46 VanDerWaalsContact O-CB 3.28Å; V42-M46 WeakPolarHBondContact O-CB 3.49Å; V42-M46 PolarHBondContact O-N 3.4Å |
| 43 | F | 94.5 | Very high | 90.3 | Very high | 99 Ų | 99 | 97.7 Ų | 97.7 | 43% | 0.434 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.9 | -41.9 | 176.4 | -177.3 | -106.9 | 0 | 0 | 0 | 111.2 | F39 L40 M46 L47 | F39-F43 VanDerWaalsContact O-CB 3.25Å; F39-F43 WeakPolarHBondContact O-CB 3.38Å; F39-F43 PolarHBondContact O-N 2.82Å; L40-F43 PolarHBondContact O-N 3.43Å; F43-M46 PolarHBondContact O-N 3.32Å; F43-L47 HydrophobicContact CD1-CD1 3.74Å; F43-L47 HydrophobicContact CD1-CG 4.01Å; F43-L47 HydrophobicContact CD2-CG 4.38Å; F43-L47 HydrophobicContact CE1-CD1 3.15Å; F43-L47 HydrophobicContact CE1-CD2 4.35Å; F43-L47 HydrophobicContact CE1-CG 3.68Å; F43-L47 HydrophobicContact CE2-CD1 4.35Å; F43-L47 HydrophobicContact CE2-CD2 4.11Å; F43-L47 HydrophobicContact CE2-CG 4.04Å; F43-L47 HydrophobicContact CG-CG 4.37Å; F43-L47 HydrophobicContact CZ-CD1 3.51Å; F43-L47 HydrophobicContact CZ-CD2 3.86Å; F43-L47 HydrophobicContact CZ-CG 3.68Å; F43-L47 VanDerWaalsContact O-CB 3.26Å; F43-L47 WeakPolarHBondContact O-CB 3.22Å; F43-L47 VanDerWaalsContact O-CG 3.32Å; F43-L47 WeakPolarHBondContact O-CG 3.42Å; F43-L47 PolarHBondContact O-N 2.83Å |
| 44 | L | 93.9 | Very high | 89 | Confident | 115 Ų | 115 | 99.5 Ų | 99.5 | 60% | 0.602 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.8 | -43.4 | 175.8 | -171.7 | 160.6 | 0 | 0 | 0 | 110.7 | L40 L41 V42 M48 | L40-L44 WeakPolarHBondContact O-CB 3.26Å; L40-L44 PolarHBondContact O-N 2.99Å; L41-L44 PolarHBondContact O-N 2.63Å; V42-L44 VanDerWaalsContact C-N 3.34Å; L44-M48 WeakPolarHBondContact O-CA 3.35Å; L44-M48 WeakPolarHBondContact O-CB 3.26Å; L44-M48 PolarHBondContact O-N 2.94Å |
| 45 | V | 94.2 | Very high | 87.6 | Confident | 78 Ų | 78 | 101.3 Ų | 101.3 | 47% | 0.473 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.7 | -41.3 | 174.9 | 173.1 | 0 | 0 | 0 | 0 | 111.4 | L41 V42 M48 V49 | L41-V45 WeakPolarHBondContact O-CG2 3.25Å; L41-V45 PolarHBondContact O-N 3.45Å; V42-V45 PolarHBondContact O-N 3.31Å; V45-M48 PolarHBondContact O-N 3.39Å; V45-V49 WeakPolarHBondContact O-CG2 3.23Å; V45-V49 PolarHBondContact O-N 2.78Å |
| 46 | M | 91.3 | Very high | 85.9 | Confident | 78 Ų | 78 | 104.9 Ų | 104.9 | 38% | 0.384 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.9 | -46.7 | 177.2 | -176.7 | -81.5 | -174.2 | 0 | 0 | 111 | V42 F43 M48 V49 R50 | V42-M46 VanDerWaalsContact O-CB 3.28Å; V42-M46 WeakPolarHBondContact O-CB 3.49Å; V42-M46 PolarHBondContact O-N 3.4Å; F43-M46 PolarHBondContact O-N 3.32Å; M46-M48 VanDerWaalsContact C-N 3.34Å; M46-V49 PolarHBondContact O-N 3.02Å; M46-R50 HydrophobicContact CE-CG 3.71Å; M46-R50 VanDerWaalsContact CE-CZ 3.42Å; M46-R50 WeakPolarHBondContact O-CB 3.27Å; M46-R50 VanDerWaalsContact O-CG 3.27Å; M46-R50 WeakPolarHBondContact O-CG 2.91Å; M46-R50 PolarHBondContact O-N 3.43Å; M46-R50 HydrophobicContact SD-CG 3.7Å |
| 47 | L | 87.6 | Confident | 83.9 | Confident | 70 Ų | 70 | 102.3 Ų | 102.3 | 37% | 0.366 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.3 | -42.6 | 172.4 | -76.6 | -167.5 | 0 | 0 | 0 | 110.3 | F43 R50 C51 | F43-L47 HydrophobicContact CD1-CD1 3.74Å; F43-L47 HydrophobicContact CD1-CG 4.01Å; F43-L47 HydrophobicContact CD2-CG 4.38Å; F43-L47 HydrophobicContact CE1-CD1 3.15Å; F43-L47 HydrophobicContact CE1-CD2 4.35Å; F43-L47 HydrophobicContact CE1-CG 3.68Å; F43-L47 HydrophobicContact CE2-CD1 4.35Å; F43-L47 HydrophobicContact CE2-CD2 4.11Å; F43-L47 HydrophobicContact CE2-CG 4.04Å; F43-L47 HydrophobicContact CG-CG 4.37Å; F43-L47 HydrophobicContact CZ-CD1 3.51Å; F43-L47 HydrophobicContact CZ-CD2 3.86Å; F43-L47 HydrophobicContact CZ-CG 3.68Å; F43-L47 VanDerWaalsContact O-CB 3.26Å; F43-L47 WeakPolarHBondContact O-CB 3.22Å; F43-L47 VanDerWaalsContact O-CG 3.32Å; F43-L47 WeakPolarHBondContact O-CG 3.42Å; F43-L47 PolarHBondContact O-N 2.83Å; L47-R50 CarbonylContact O-C 3.24Å; L47-R50 PolarHBondContact O-N 3.37Å; L47-C51 WeakPolarHBondContact O-CA 3.32Å; L47-C51 WeakPolarHBondContact O-CB 3.48Å; L47-C51 PolarHBondContact O-N 3.15Å; L47-C51 PolarHBondContact O-SG 3.32Å |
| 48 | M | 87.4 | Confident | 82.1 | Confident | 82 Ų | 82 | 102.9 Ų | 102.9 | 40% | 0.404 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60 | -50.8 | 175.6 | -177.7 | -95.5 | 155.6 | 0 | 0 | 109.7 | L44 V45 M46 R50 C51 F52 | L44-M48 WeakPolarHBondContact O-CA 3.35Å; L44-M48 WeakPolarHBondContact O-CB 3.26Å; L44-M48 PolarHBondContact O-N 2.94Å; V45-M48 PolarHBondContact O-N 3.39Å; M46-M48 VanDerWaalsContact C-N 3.34Å; M48-R50 VanDerWaalsContact C-N 3.34Å; M48-R50 PolarHBondContact O-N 3.26Å; M48-C51 PolarHBondContact O-N 3.4Å; M48-F52 HydrophobicContact CE-CB 4.36Å; M48-F52 HydrophobicContact CE-CD1 3.73Å; M48-F52 HydrophobicContact CE-CD2 3.31Å; M48-F52 HydrophobicContact CE-CE1 3.68Å; M48-F52 HydrophobicContact CE-CE2 3.2Å; M48-F52 HydrophobicContact CE-CG 3.53Å; M48-F52 HydrophobicContact CE-CZ 3.39Å; M48-F52 HydrophobicContact CG-CD2 3.64Å; M48-F52 HydrophobicContact CG-CE2 3.46Å; M48-F52 VanDerWaalsContact CG-CE2 3.46Å; M48-F52 HydrophobicContact CG-CZ 4.43Å; M48-F52 WeakPolarHBondContact O-CB 3.29Å; M48-F52 WeakPolarHBondContact O-CD2 3.4Å; M48-F52 WeakPolarHBondContact O-CG 3.04Å; M48-F52 PolarHBondContact O-N 2.63Å; M48-F52 HydrophobicContact SD-CD2 4.07Å; M48-F52 HydrophobicContact SD-CE2 4.12Å |
| 49 | V | 88.5 | Confident | 79.9 | Confident | 73 Ų | 73 | 108.7 Ų | 108.7 | 44% | 0.442 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -59.9 | -41 | 175.2 | 173.7 | 0 | 0 | 0 | 0 | 112.2 | V45 M46 R53 | V45-V49 WeakPolarHBondContact O-CG2 3.23Å; V45-V49 PolarHBondContact O-N 2.78Å; M46-V49 PolarHBondContact O-N 3.02Å; V49-R53 HydrophobicContact CG1-CG 4.13Å; V49-R53 WeakPolarHBondContact O-CA 3.35Å; V49-R53 WeakPolarHBondContact O-CB 3.11Å; V49-R53 WeakPolarHBondContact O-CG 3.31Å; V49-R53 PolarHBondContact O-N 3.14Å |
| 50 | R | 84.6 | Confident | 77.6 | Confident | 143 Ų | 143 | 106.4 Ų | 106.4 | 54% | 0.54 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -71.5 | -45.2 | 179 | -73.9 | -68.3 | -179 | 89.1 | 0.2 | 112.4 | M46 L47 M48 F52 R53 I54 | M46-R50 HydrophobicContact CE-CG 3.71Å; M46-R50 VanDerWaalsContact CE-CZ 3.42Å; M46-R50 WeakPolarHBondContact O-CB 3.27Å; M46-R50 VanDerWaalsContact O-CG 3.27Å; M46-R50 WeakPolarHBondContact O-CG 2.91Å; M46-R50 PolarHBondContact O-N 3.43Å; M46-R50 HydrophobicContact SD-CG 3.7Å; L47-R50 CarbonylContact O-C 3.24Å; L47-R50 PolarHBondContact O-N 3.37Å; M48-R50 VanDerWaalsContact C-N 3.34Å; M48-R50 PolarHBondContact O-N 3.26Å; R50-F52 VanDerWaalsContact C-N 3.35Å; R50-R53 CarbonylContact O-C 3.48Å; R50-R53 VanDerWaalsContact O-C 3.24Å; R50-R53 WeakPolarHBondContact O-CA 3.31Å; R50-R53 PolarHBondContact O-N 3.24Å; R50-R53 VanDerWaalsContact O-N 3.15Å; R50-I54 HydrophobicContact CB-CD1 4.5Å; R50-I54 VanDerWaalsContact O-CB 3.26Å; R50-I54 WeakPolarHBondContact O-CB 3.35Å; R50-I54 WeakPolarHBondContact O-CD1 3.29Å; R50-I54 WeakPolarHBondContact O-CG1 3.47Å; R50-I54 PolarHBondContact O-N 3.43Å |
| 51 | C | 75.6 | Confident | 75.2 | Confident | 62 Ų | 62 | 112.5 Ų | 112.5 | 42% | 0.419 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -57.3 | -51.4 | 173.6 | -72.2 | 0 | 0 | 0 | 0 | 108.6 | L47 M48 R53 I54 L55 | L47-C51 WeakPolarHBondContact O-CA 3.32Å; L47-C51 WeakPolarHBondContact O-CB 3.48Å; L47-C51 PolarHBondContact O-N 3.15Å; L47-C51 PolarHBondContact O-SG 3.32Å; M48-C51 PolarHBondContact O-N 3.4Å; C51-R53 PolarHBondContact O-N 2.9Å; C51-I54 CarbonylContact O-C 3.27Å; C51-I54 PolarHBondContact O-N 3.4Å; C51-L55 VanDerWaalsContact O-CB 3.27Å; C51-L55 WeakPolarHBondContact O-CB 3.01Å; C51-L55 PolarHBondContact O-N 3.46Å |
| 52 | F | 74.8 | Confident | 72.6 | Confident | 100 Ų | 100 | 115.8 Ų | 115.8 | 44% | 0.439 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.7 | -37 | 174.9 | -79.5 | -106.4 | 0 | 0 | 0 | 111.6 | M48 R50 I54 L55 L56 | M48-F52 HydrophobicContact CE-CB 4.36Å; M48-F52 HydrophobicContact CE-CD1 3.73Å; M48-F52 HydrophobicContact CE-CD2 3.31Å; M48-F52 HydrophobicContact CE-CE1 3.68Å; M48-F52 HydrophobicContact CE-CE2 3.2Å; M48-F52 HydrophobicContact CE-CG 3.53Å; M48-F52 HydrophobicContact CE-CZ 3.39Å; M48-F52 HydrophobicContact CG-CD2 3.64Å; M48-F52 HydrophobicContact CG-CE2 3.46Å; M48-F52 VanDerWaalsContact CG-CE2 3.46Å; M48-F52 HydrophobicContact CG-CZ 4.43Å; M48-F52 WeakPolarHBondContact O-CB 3.29Å; M48-F52 WeakPolarHBondContact O-CD2 3.4Å; M48-F52 WeakPolarHBondContact O-CG 3.04Å; M48-F52 PolarHBondContact O-N 2.63Å; M48-F52 HydrophobicContact SD-CD2 4.07Å; M48-F52 HydrophobicContact SD-CE2 4.12Å; R50-F52 VanDerWaalsContact C-N 3.35Å; F52-I54 PolarHBondContact O-N 3.06Å; F52-L55 PolarHBondContact O-N 3.37Å; F52-L56 HydrophobicContact CB-CD1 4.03Å; F52-L56 HydrophobicContact CD1-CD1 3.69Å; F52-L56 HydrophobicContact CG-CD1 4.36Å; F52-L56 VanDerWaalsContact O-CA 3.24Å; F52-L56 WeakPolarHBondContact O-CA 3.11Å; F52-L56 WeakPolarHBondContact O-CB 3.24Å; F52-L56 PolarHBondContact O-N 2.95Å |
| 53 | R | 74.3 | Confident | 70.2 | Confident | 188 Ų | 188 | 117.1 Ų | 117.1 | 71% | 0.709 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -75.2 | -0.4 | 171.1 | -75.1 | -78.7 | -166.1 | 142.1 | 3 | 114.4 | V49 R50 C51 D57 | V49-R53 HydrophobicContact CG1-CG 4.13Å; V49-R53 WeakPolarHBondContact O-CA 3.35Å; V49-R53 WeakPolarHBondContact O-CB 3.11Å; V49-R53 WeakPolarHBondContact O-CG 3.31Å; V49-R53 PolarHBondContact O-N 3.14Å; R50-R53 CarbonylContact O-C 3.48Å; R50-R53 VanDerWaalsContact O-C 3.24Å; R50-R53 WeakPolarHBondContact O-CA 3.31Å; R50-R53 PolarHBondContact O-N 3.24Å; R50-R53 VanDerWaalsContact O-N 3.15Å; C51-R53 PolarHBondContact O-N 2.9Å; R53-D57 WeakPolarHBondContact O-CB 3.16Å |
| 54 | I | 64.4 | Low | 67.9 | Low | 127 Ų | 127 | 116.9 Ų | 116.9 | 65% | 0.651 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -113.7 | -21.2 | 173.3 | -70.5 | 161.9 | 0 | 0 | 0 | 109.5 | R50 C51 F52 D57 | R50-I54 HydrophobicContact CB-CD1 4.5Å; R50-I54 VanDerWaalsContact O-CB 3.26Å; R50-I54 WeakPolarHBondContact O-CB 3.35Å; R50-I54 WeakPolarHBondContact O-CD1 3.29Å; R50-I54 WeakPolarHBondContact O-CG1 3.47Å; R50-I54 PolarHBondContact O-N 3.43Å; C51-I54 CarbonylContact O-C 3.27Å; C51-I54 PolarHBondContact O-N 3.4Å; F52-I54 PolarHBondContact O-N 3.06Å; I54-D57 CarbonylContact C-O 3.58Å; I54-D57 VanDerWaalsContact C-O 3.27Å |
| 55 | L | 62.9 | Low | 65.8 | Low | 142 Ų | 142 | 115.8 Ų | 115.8 | 74% | 0.743 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -94.4 | -46.3 | 175.5 | -118.4 | 115.4 | 0 | 0 | 0 | 112 | C51 F52 P58 | C51-L55 VanDerWaalsContact O-CB 3.27Å; C51-L55 WeakPolarHBondContact O-CB 3.01Å; C51-L55 PolarHBondContact O-N 3.46Å; F52-L55 PolarHBondContact O-N 3.37Å; L55-P58 WeakPolarHBondContact O-CB 3.25Å |
| 56 | L | 55.8 | Low | 63.7 | Low | 132 Ų | 132 | 116.8 Ų | 116.8 | 69% | 0.691 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -86.6 | -13.4 | 171.6 | -65.1 | 156.5 | 0 | 0 | 0 | 112.5 | F52 P58 | F52-L56 HydrophobicContact CB-CD1 4.03Å; F52-L56 HydrophobicContact CD1-CD1 3.69Å; F52-L56 HydrophobicContact CG-CD1 4.36Å; F52-L56 VanDerWaalsContact O-CA 3.24Å; F52-L56 WeakPolarHBondContact O-CA 3.11Å; F52-L56 WeakPolarHBondContact O-CB 3.24Å; F52-L56 PolarHBondContact O-N 2.95Å; L56-P58 VanDerWaalsContact C-CD 3.41Å; L56-P58 WeakPolarHBondContact O-CD 3.07Å; L56-P58 WeakPolarHBondContact O-CG 3.47Å |
| 57 | D | 54.8 | Low | 61.8 | Low | 72 Ų | 72 | 124.3 Ų | 124.3 | 39% | 0.385 | 63% | 0.632 | S | S | . | * | S | Bend | trans | -84.3 | 92.7 | 148.2 | -170.2 | 94 | 0 | 0 | 0 | 104.9 | R53 I54 | R53-D57 WeakPolarHBondContact O-CB 3.16Å; I54-D57 CarbonylContact C-O 3.58Å; I54-D57 VanDerWaalsContact C-O 3.27Å |
| 58 | P | 57.1 | Low | 60 | Low | 93 Ų | 93 | 125.1 Ų | 125.1 | 60% | 0.604 | 64% | 0.639 | S | S | * | * | trans | -97.5 | -3.3 | -160.9 | 5 | 16.1 | 0 | 0 | 0 | 111.9 | L55 L56 | L55-P58 WeakPolarHBondContact O-CB 3.25Å; L56-P58 VanDerWaalsContact C-CD 3.41Å; L56-P58 WeakPolarHBondContact O-CD 3.07Å; L56-P58 WeakPolarHBondContact O-CG 3.47Å | ||
| 59 | Y | 50.7 | Low | 58.3 | Low | 222 Ų | 222 | 126 Ų | 126 | 87% | 0.871 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -171.7 | -12.9 | -133.4 | -138.2 | -111.7 | 0 | 0 | 0 | 114.7 | ||
| 60 | S | 48.3 | Very low | 56.6 | Low | 81 Ų | 81 | 131 Ų | 131 | 57% | 0.566 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -87.5 | -35.2 | -171.6 | 174.2 | 0 | 0 | 0 | 0 | 111.9 | ||
| 61 | R | 45.6 | Very low | 55.1 | Low | 204 Ų | 204 | 131.8 Ų | 131.8 | 77% | 0.77 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -135.3 | -23.4 | -167.8 | -66.5 | -163.1 | -173.4 | -167.4 | 2.8 | 121.4 | ||
| 62 | M | 42.1 | Very low | 54 | Low | 181 Ų | 181 | 133.2 Ų | 133.2 | 89% | 0.892 | 67% | 0.672 | S | S | * | * | trans | -161.2 | 141.3 | 173.8 | -105.3 | 112.5 | -150.7 | 0 | 0 | 115.4 | ||||
| 63 | P | 46.1 | Very low | 53 | Low | 117 Ų | 117 | 131.1 Ų | 131.1 | 76% | 0.76 | 68% | 0.679 | S | S | * | * | trans | -67.2 | 139.2 | 176.5 | 31.3 | -33.2 | 0 | 0 | 0 | 109.5 | S65 | P63-S65 PolarHBondContact O-N 3.3Š| ||
| 64 | A | 46.8 | Very low | 52.1 | Low | 94 Ų | 94 | 127.5 Ų | 127.5 | 78% | 0.777 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -57.2 | 128.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 65 | S | 49.7 | Very low | 51.5 | Low | 92 Ų | 92 | 127 Ų | 127 | 64% | 0.643 | 67% | 0.668 | S | S | * | * | trans | 63.5 | 109.6 | 171.6 | 69.9 | 0 | 0 | 0 | 0 | 116.9 | P63 W67 | P63-S65 PolarHBondContact O-N 3.3Å; S65-W67 PolarHBondContact O-N 2.81Å | ||
| 66 | S | 49.2 | Very low | 51.2 | Low | 100 Ų | 100 | 129.6 Ų | 129.6 | 70% | 0.699 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | 42.9 | 164.4 | 80.9 | 0 | 0 | 0 | 0 | 112.3 | ||
| 67 | W | 50.8 | Low | 51.2 | Low | 235 Ų | 235 | 125.3 Ų | 125.3 | 89% | 0.89 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -2.6 | 167.2 | -165.7 | 70.1 | 0 | 0 | 0 | 111.9 | S65 | S65-W67 PolarHBondContact O-N 2.81Š|
| 68 | T | 50.5 | Low | 51.3 | Low | 87 Ų | 87 | 127.9 Ų | 127.9 | 53% | 0.534 | 67% | 0.665 | S | S | . | * | S | Bend | trans | -103.4 | -14.3 | 169.9 | 51.3 | 0 | 0 | 0 | 0 | 114 | H70 K71 | T68-H70 PolarHBondContact O-N 2.93Å; T68-H70 VanDerWaalsContact O-N 3.14Å; T68-K71 PolarHBondContact O-N 3.21Å |
| 69 | D | 50.9 | Low | 51.2 | Low | 100 Ų | 100 | 129.4 Ų | 129.4 | 54% | 0.535 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -64.2 | -24.8 | -174.5 | -166.2 | -92.6 | 0 | 0 | 0 | 113.3 | K71 E72 | D69-K71 VanDerWaalsContact C-N 3.33Å; D69-K71 PolarHBondContact O-N 3.08Å; D69-E72 WeakPolarHBondContact CA-OE1 3.25Å; D69-E72 PolarHBondContact N-OE1 2.85Å |
| 70 | H | 54 | Low | 51.6 | Low | 178 Ų | 178 | 125 Ų | 125 | 82% | 0.824 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -79.3 | -11 | 175.7 | -136 | 7.1 | 0 | 0 | 0 | 114.8 | T68 | T68-H70 PolarHBondContact O-N 2.93Å; T68-H70 VanDerWaalsContact O-N 3.14Å |
| 71 | K | 52.1 | Low | 52.1 | Low | 161 Ų | 161 | 130.6 Ų | 130.6 | 70% | 0.7 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -90.5 | -31.5 | 172.3 | -79 | -171.5 | 76.9 | 77.3 | 0 | 112.7 | T68 D69 E75 | T68-K71 PolarHBondContact O-N 3.21Å; D69-K71 VanDerWaalsContact C-N 3.33Å; D69-K71 PolarHBondContact O-N 3.08Å; K71-E75 VanDerWaalsContact O-CG 3.23Å; K71-E75 WeakPolarHBondContact O-CG 3.21Å |
| 72 | E | 54 | Low | 52.8 | Low | 91 Ų | 91 | 125 Ų | 125 | 43% | 0.425 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -85 | -14.6 | -174.3 | 56.8 | -146.9 | 149.4 | 0 | 0 | 115.3 | D69 | D69-E72 WeakPolarHBondContact CA-OE1 3.25Å; D69-E72 PolarHBondContact N-OE1 2.85Å |
| 73 | G | 53.3 | Low | 53.6 | Low | 57 Ų | 57 | 124.1 Ų | 124.1 | 59% | 0.588 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -26.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 74 | L | 54.8 | Low | 53.7 | Low | 112 Ų | 112 | 127.9 Ų | 127.9 | 59% | 0.586 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -33.1 | 178 | -160 | 90.6 | 0 | 0 | 0 | 111.5 | R76 Q78 | L74-R76 VanDerWaalsContact C-N 3.32Å; L74-R76 PolarHBondContact O-N 3.05Å; L74-Q78 WeakPolarHBondContact O-CB 3.49Å; L74-Q78 PolarHBondContact O-N 2.84Å |
| 75 | E | 53.2 | Low | 54.1 | Low | 115 Ų | 115 | 129.6 Ų | 129.6 | 54% | 0.537 | 68% | 0.675 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.9 | 0.7 | -174.2 | -48.6 | -118.8 | 117.5 | 0 | 0 | 113.2 | K71 F79 | K71-E75 VanDerWaalsContact O-CG 3.23Å; K71-E75 WeakPolarHBondContact O-CG 3.21Å; E75-F79 HydrophobicContact CB-CD2 4.49Å; E75-F79 HydrophobicContact CB-CE2 3.82Å; E75-F79 WeakPolarHBondContact O-CD2 3.47Å; E75-F79 VanDerWaalsContact O-CE2 3.27Å; E75-F79 WeakPolarHBondContact O-CE2 3.32Å |
| 76 | R | 55.8 | Low | 54.3 | Low | 197 Ų | 197 | 131.5 Ų | 131.5 | 74% | 0.743 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.3 | -7.4 | 174.7 | -79.8 | -173 | 169.8 | 89.2 | -1 | 114.3 | L74 | L74-R76 VanDerWaalsContact C-N 3.32Å; L74-R76 PolarHBondContact O-N 3.05Å |
| 77 | G | 55.7 | Low | 54.6 | Low | 42 Ų | 42 | 133.3 Ų | 133.3 | 43% | 0.433 | 68% | 0.675 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -107.4 | -17.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y81 | G77-Y81 VanDerWaalsContact O-CD2 3.29Å; G77-Y81 WeakPolarHBondContact O-CD2 3.29Å; G77-Y81 WeakPolarHBondContact O-CE2 3.43Å |
| 78 | Q | 55.8 | Low | 54.8 | Low | 127 Ų | 127 | 127.3 Ų | 127.3 | 59% | 0.593 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -91.2 | -24.8 | -176.5 | -164 | 179.2 | -67.5 | 0 | 0 | 113.6 | L74 D80 | L74-Q78 WeakPolarHBondContact O-CB 3.49Å; L74-Q78 PolarHBondContact O-N 2.84Å; Q78-D80 VanDerWaalsContact C-N 3.35Å; Q78-D80 PolarHBondContact O-N 3.46Å |
| 79 | F | 56.5 | Low | 55.1 | Low | 125 Ų | 125 | 129.8 Ų | 129.8 | 55% | 0.548 | 67% | 0.671 | S | S | . | * | G | 310 helix | trans | -78.5 | -17.4 | -175.3 | -71.8 | -95.6 | 0 | 0 | 0 | 113.6 | E75 | E75-F79 HydrophobicContact CB-CD2 4.49Å; E75-F79 HydrophobicContact CB-CE2 3.82Å; E75-F79 WeakPolarHBondContact O-CD2 3.47Å; E75-F79 VanDerWaalsContact O-CE2 3.27Å; E75-F79 WeakPolarHBondContact O-CE2 3.32Å |
| 80 | D | 58.8 | Low | 55.4 | Low | 129 Ų | 129 | 131.8 Ų | 131.8 | 69% | 0.69 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -83.7 | -7.2 | 176.6 | -75 | -65.3 | 0 | 0 | 0 | 114.1 | Q78 | Q78-D80 VanDerWaalsContact C-N 3.35Å; Q78-D80 PolarHBondContact O-N 3.46Å |
| 81 | Y | 57.6 | Low | 55.5 | Low | 198 Ų | 198 | 128.5 Ų | 128.5 | 78% | 0.776 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -104.1 | 1.6 | 177.9 | -66.5 | -78.2 | 0 | 0 | 0 | 114.3 | G77 | G77-Y81 VanDerWaalsContact O-CD2 3.29Å; G77-Y81 WeakPolarHBondContact O-CD2 3.29Å; G77-Y81 WeakPolarHBondContact O-CE2 3.43Å |
| 82 | A | 61 | Low | 55.7 | Low | 87 Ų | 87 | 126 Ų | 126 | 72% | 0.719 | 67% | 0.667 | S | S | * | * | S | Bend | trans | -103.7 | 1.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 83 | L | 58.7 | Low | 55.9 | Low | 163 Ų | 163 | 128.9 Ų | 128.9 | 85% | 0.853 | 69% | 0.688 | S | S | * | * | trans | -120.6 | 34.7 | -176.2 | -91.3 | 174.1 | 0 | 0 | 0 | 113.7 | ||||
| 84 | V | 49.1 | Very low | 56.1 | Low | 195 Ų | 195 | 135.5 Ų | 135.5 | 100% | 1.182 | 70% | 0.697 | S | S | * | * | trans | -143.4 | 0 | 163.9 | 69.5 | 0 | 0 | 0 | 0 | 111.7 |
Retrieved 84 of 84 residues in 119.1 ms
(Link to these results)