| 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 | 39.4 | Very low | 47.8 | Very low | 235 Ų | 235 | 150.7 Ų | 150.7 | 100% | 1.158 | 83% | 0.825 | S | S | * | * | 0 | 91.7 | 0 | -69.2 | -59 | -152.1 | 0 | 0 | 106.9 | |||||
| 2 | A | 43.4 | Very low | 49.1 | Very low | 88 Ų | 88 | 156.3 Ų | 156.3 | 73% | 0.727 | 84% | 0.835 | S | S | * | * | 59.1 | 117.4 | 76.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 3 | S | 48.5 | Very low | 49.3 | Very low | 113 Ų | 113 | 148.1 Ų | 148.1 | 79% | 0.79 | 81% | 0.811 | S | S | * | * | cis | -157.4 | 130.8 | 8.1 | -70.8 | 0 | 0 | 0 | 0 | 108.4 | E5 | S3-E5 PolarHBondContact O-N 3.34Š| ||
| 4 | Q | 50.9 | Low | 49.3 | Very low | 185 Ų | 185 | 147.9 Ų | 147.9 | 86% | 0.864 | 82% | 0.816 | S | S | * | * | trans | -80.9 | 98.9 | 164.5 | -169.3 | 153 | 28.9 | 0 | 0 | 106.7 | R6 | Q4-R6 PolarHBondContact O-N 3.08Š| ||
| 5 | E | 48.9 | Very low | 49.1 | Very low | 179 Ų | 179 | 142.4 Ų | 142.4 | 84% | 0.836 | 81% | 0.807 | S | S | * | * | trans | -60 | 99.1 | 175.4 | -165.3 | 176 | 118.5 | 0 | 0 | 107.9 | S3 V7 | S3-E5 PolarHBondContact O-N 3.34Å; E5-V7 PolarHBondContact O-N 3.09Å; E5-V7 VanDerWaalsContact O-N 3.08Å | ||
| 6 | R | 53.4 | Low | 49.5 | Very low | 215 Ų | 215 | 147.1 Ų | 147.1 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | trans | -68.4 | 106.2 | 173.5 | -67.4 | -170.3 | 173.6 | 173.4 | -1 | 105.6 | Q4 D8 | Q4-R6 PolarHBondContact O-N 3.08Å; R6-D8 VanDerWaalsContact C-N 3.32Å; R6-D8 PolarHBondContact O-N 3.21Å | ||
| 7 | V | 52.3 | Low | 49.7 | Very low | 133 Ų | 133 | 152.1 Ų | 152.1 | 81% | 0.806 | 82% | 0.82 | S | S | * | * | trans | -51.9 | 104.5 | 160.4 | -80.8 | 0 | 0 | 0 | 0 | 106.8 | E5 S9 | E5-V7 PolarHBondContact O-N 3.09Å; E5-V7 VanDerWaalsContact O-N 3.08Å; V7-S9 PolarHBondContact O-N 3.06Å | ||
| 8 | D | 45 | Very low | 50.2 | Low | 152 Ų | 152 | 156.9 Ų | 156.9 | 81% | 0.813 | 83% | 0.825 | S | S | * | * | trans | -51.1 | 107.2 | -179.5 | -77.1 | -53.9 | 0 | 0 | 0 | 108.3 | R6 V10 | R6-D8 VanDerWaalsContact C-N 3.32Å; R6-D8 PolarHBondContact O-N 3.21Å; D8-V10 PolarHBondContact O-N 3.1Å | ||
| 9 | S | 47.8 | Very low | 50.4 | Low | 100 Ų | 100 | 153.1 Ų | 153.1 | 70% | 0.699 | 81% | 0.811 | S | S | * | * | trans | -49.3 | 107.2 | 168.2 | 48.4 | 0 | 0 | 0 | 0 | 106.9 | V7 T11 | V7-S9 PolarHBondContact O-N 3.06Å; S9-T11 PolarHBondContact O-N 3.12Å | ||
| 10 | V | 51 | Low | 50.6 | Low | 131 Ų | 131 | 157.2 Ų | 157.2 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -45.1 | 106.9 | 170.2 | 161.6 | 0 | 0 | 0 | 0 | 106.7 | D8 K12 | D8-V10 PolarHBondContact O-N 3.1Å; V10-K12 PolarHBondContact O-N 3.41Å | ||
| 11 | T | 44.7 | Very low | 50.9 | Low | 127 Ų | 127 | 159.4 Ų | 159.4 | 78% | 0.779 | 82% | 0.818 | S | S | * | * | trans | -63 | 105.8 | -176 | -6.4 | 0 | 0 | 0 | 0 | 105.5 | S9 G13 | S9-T11 PolarHBondContact O-N 3.12Å; T11-G13 PolarHBondContact O-N 3.38Å | ||
| 12 | K | 63.3 | Low | 51.8 | Low | 217 Ų | 217 | 152.2 Ų | 152.2 | 94% | 0.943 | 78% | 0.781 | S | S | * | * | trans | -70.4 | 72.8 | 168.8 | -71.2 | -174.5 | 177.4 | 178.6 | 0 | 107.4 | V10 | V10-K12 PolarHBondContact O-N 3.41Š| ||
| 13 | G | 52.3 | Low | 52.6 | Low | 50 Ų | 50 | 152.5 Ų | 152.5 | 52% | 0.515 | 78% | 0.784 | S | S | . | * | trans | -139.5 | 121.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | T11 | T11-G13 PolarHBondContact O-N 3.38Š| ||
| 14 | T | 49.2 | Very low | 53.7 | Low | 145 Ų | 145 | 149.4 Ų | 149.4 | 89% | 0.89 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 86 | 77.3 | 157.6 | -29.1 | 0 | 0 | 0 | 0 | 116.4 | ||
| 15 | G | 46.4 | Very low | 55 | Low | 66 Ų | 66 | 146.4 Ų | 146.4 | 68% | 0.68 | 75% | 0.752 | S | S | * | * | trans | 79.1 | 128.5 | 140.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | R17 | G15-R17 PolarHBondContact O-N 3.06Š| ||
| 16 | F | 55.4 | Low | 56.8 | Low | 218 Ų | 218 | 141.8 Ų | 141.8 | 96% | 0.956 | 74% | 0.736 | S | S | * | * | trans | -57.7 | 76.1 | 146.8 | -73.7 | -98.2 | 0 | 0 | 0 | 107.7 | R18 | F16-R18 PolarHBondContact O-N 3.4Š| ||
| 17 | R | 53.3 | Low | 58.3 | Low | 231 Ų | 231 | 136.4 Ų | 136.4 | 87% | 0.872 | 73% | 0.728 | S | S | * | * | trans | -49.7 | 116.6 | 160.6 | -99.8 | -171.3 | 177.8 | -162.3 | 0.7 | 102.9 | G15 C19 | G15-R17 PolarHBondContact O-N 3.06Å; R17-C19 PolarHBondContact O-N 3.45Å | ||
| 18 | R | 58.1 | Low | 60.1 | Low | 240 Ų | 240 | 132 Ų | 132 | 91% | 0.906 | 71% | 0.71 | S | S | * | * | trans | -46.2 | 101 | 167.9 | -68.1 | -176.4 | -175.3 | -153.4 | 1.7 | 105.4 | F16 R20 | F16-R18 PolarHBondContact O-N 3.4Å; R18-R20 PolarHBondContact O-N 3.04Å | ||
| 19 | C | 55 | Low | 62.2 | Low | 83 Ų | 83 | 127.5 Ų | 127.5 | 56% | 0.561 | 69% | 0.688 | S | S | * | * | trans | -66.6 | 100.8 | 179.2 | -151.6 | 0 | 0 | 0 | 0 | 101.8 | R17 K21 Q22 | R17-C19 PolarHBondContact O-N 3.45Å; C19-K21 PolarHBondContact O-N 3.06Å; C19-Q22 HydrophobicContact CB-CG 4.11Å; C19-Q22 WeakPolarHBondContact SG-CG 3.39Å; C19-Q22 PolarHBondContact SG-NE2 3.1Å | ||
| 20 | R | 53.1 | Low | 64 | Low | 236 Ų | 236 | 124.1 Ų | 124.1 | 89% | 0.891 | 66% | 0.664 | S | S | * | * | trans | -42.8 | 118.5 | 177 | -73.3 | -177.2 | 173.7 | -179.1 | -2 | 105 | R18 Q22 | R18-R20 PolarHBondContact O-N 3.04Å; R20-Q22 WeakPolarHBondContact O-CA 3.44Å; R20-Q22 PolarHBondContact O-N 3.44Å | ||
| 21 | K | 57.1 | Low | 65.8 | Low | 204 Ų | 204 | 123.9 Ų | 123.9 | 89% | 0.887 | 66% | 0.655 | S | S | * | * | trans | -14.4 | 100 | -173.8 | -75.4 | -179.4 | 174.6 | -178.1 | 0 | 109.4 | C19 A23 | C19-K21 PolarHBondContact O-N 3.06Å; K21-A23 VanDerWaalsContact C-N 3.35Å; K21-A23 PolarHBondContact O-N 3.01Å | ||
| 22 | Q | 57.8 | Low | 68.1 | Low | 83 Ų | 83 | 122.9 Ų | 122.9 | 39% | 0.388 | 64% | 0.644 | S | S | . | * | trans | -54.3 | 105.9 | -171.7 | -71.8 | 165.4 | 25.7 | 0 | 0 | 106.2 | C19 R20 G24 K57 | C19-Q22 HydrophobicContact CB-CG 4.11Å; C19-Q22 WeakPolarHBondContact SG-CG 3.39Å; C19-Q22 PolarHBondContact SG-NE2 3.1Å; R20-Q22 WeakPolarHBondContact O-CA 3.44Å; R20-Q22 PolarHBondContact O-N 3.44Å; Q22-G24 PolarHBondContact O-N 3.33Å; Q22-K57 HydrophobicContact CB-CD 4.41Å | ||
| 23 | A | 60.5 | Low | 69.4 | Low | 94 Ų | 94 | 114.8 Ų | 114.8 | 78% | 0.777 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 118 | -177.5 | 0 | 0 | 0 | 0 | 0 | 105.7 | K21 Y25 | K21-A23 VanDerWaalsContact C-N 3.35Å; K21-A23 PolarHBondContact O-N 3.01Å; A23-Y25 PolarHBondContact O-N 3.23Å |
| 24 | G | 72.8 | Confident | 71.2 | Confident | 48 Ų | 48 | 119 Ų | 119 | 50% | 0.495 | 61% | 0.611 | S | S | . | * | P | Polyproline II helix | trans | -53.4 | 141.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | Q22 T26 | Q22-G24 PolarHBondContact O-N 3.33Å; G24-T26 PolarHBondContact O-N 3.02Å |
| 25 | Y | 78.5 | Confident | 73.4 | Confident | 123 Ų | 123 | 115.6 Ų | 115.6 | 48% | 0.482 | 59% | 0.59 | S | S | . | * | P | Polyproline II helix | trans | -54.6 | 135.8 | 173.5 | -67.8 | -73.9 | 0 | 0 | 0 | 109.5 | A23 T29 M54 | A23-Y25 PolarHBondContact O-N 3.23Å; Y25-T29 HydrophobicContact CD1-CG2 3.53Å; Y25-T29 HydrophobicContact CE1-CG2 4.2Å; Y25-T29 HydrophobicContact CG-CG2 4.32Å; Y25-M54 HydrophobicContact CD1-CE 4.31Å; Y25-M54 HydrophobicContact CD2-CB 4.33Å; Y25-M54 HydrophobicContact CD2-CE 3.15Å; Y25-M54 HydrophobicContact CD2-CG 3.85Å; Y25-M54 HydrophobicContact CD2-SD 4.3Å; Y25-M54 HydrophobicContact CE2-CE 3.81Å; Y25-M54 HydrophobicContact CE2-CG 3.9Å; Y25-M54 HydrophobicContact CG-CE 3.42Å; Y25-M54 VanDerWaalsContact CG-CE 3.42Å |
| 26 | T | 86.2 | Confident | 75.5 | Confident | 82 Ų | 82 | 117.2 Ų | 117.2 | 50% | 0.503 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -64.1 | 158 | 173.6 | 64.3 | 0 | 0 | 0 | 0 | 109.1 | G24 G28 T29 C30 | G24-T26 PolarHBondContact O-N 3.02Å; T26-G28 PolarHBondContact O-N 2.94Å; T26-T29 PolarHBondContact O-N 2.91Å; T26-T29 PolarHBondContact OG1-N 3.05Å; T26-T29 PolarHBondContact OG1-OG1 2.87Å; T26-T29 VanDerWaalsContact OG1-OG1 3.06Å; T26-C30 PolarHBondContact O-N 3.21Å; T26-C30 PolarHBondContact O-SG 3.35Å; T26-C30 VanDerWaalsContact O-SG 3.35Å |
| 27 | P | 85.6 | Confident | 77.2 | Confident | 101 Ų | 101 | 107.4 Ų | 107.4 | 66% | 0.656 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -51.8 | -41.9 | 176.5 | -28.3 | 36 | 0 | 0 | 0 | 112.7 | T29 C30 E31 | P27-T29 PolarHBondContact O-N 3.49Å; P27-C30 WeakPolarHBondContact O-CB 3.48Å; P27-C30 PolarHBondContact O-N 3.22Å; P27-C30 VanDerWaalsContact O-N 3.1Å; P27-E31 PolarHBondContact O-N 3.33Å |
| 28 | G | 89.4 | Confident | 79 | Confident | 42 Ų | 42 | 104.7 Ų | 104.7 | 43% | 0.433 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | T26 C30 E31 L32 | T26-G28 PolarHBondContact O-N 2.94Å; G28-C30 VanDerWaalsContact C-N 3.31Å; G28-C30 PolarHBondContact O-N 3.04Å; G28-E31 PolarHBondContact O-N 3.37Å; G28-L32 PolarHBondContact O-N 2.66Å |
| 29 | T | 88.3 | Confident | 80.6 | Confident | 57 Ų | 57 | 100.6 Ų | 100.6 | 35% | 0.35 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.7 | -32.9 | 174.6 | -49.5 | 0 | 0 | 0 | 0 | 112.1 | Y25 T26 P27 L33 | Y25-T29 HydrophobicContact CD1-CG2 3.53Å; Y25-T29 HydrophobicContact CE1-CG2 4.2Å; Y25-T29 HydrophobicContact CG-CG2 4.32Å; T26-T29 PolarHBondContact O-N 2.91Å; T26-T29 PolarHBondContact OG1-N 3.05Å; T26-T29 PolarHBondContact OG1-OG1 2.87Å; T26-T29 VanDerWaalsContact OG1-OG1 3.06Å; P27-T29 PolarHBondContact O-N 3.49Å; T29-L33 WeakPolarHBondContact O-CB 3.41Å; T29-L33 PolarHBondContact O-N 3.4Å |
| 30 | C | 85.2 | Confident | 82.2 | Confident | 29 Ų | 29 | 99.4 Ų | 99.4 | 20% | 0.196 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -67.6 | -36.1 | 175.4 | -63.2 | 0 | 0 | 0 | 0 | 112.5 | T26 P27 G28 R34 M54 | T26-C30 PolarHBondContact O-N 3.21Å; T26-C30 PolarHBondContact O-SG 3.35Å; T26-C30 VanDerWaalsContact O-SG 3.35Å; P27-C30 WeakPolarHBondContact O-CB 3.48Å; P27-C30 PolarHBondContact O-N 3.22Å; P27-C30 VanDerWaalsContact O-N 3.1Å; G28-C30 VanDerWaalsContact C-N 3.31Å; G28-C30 PolarHBondContact O-N 3.04Å; C30-R34 WeakPolarHBondContact O-CG 3.39Å; C30-R34 PolarHBondContact O-N 3.34Å; C30-M54 HydrophobicContact CB-CE 4.31Å; C30-M54 VanDerWaalsContact SG-CE 3.57Å |
| 31 | E | 90.8 | Very high | 84.1 | Confident | 126 Ų | 126 | 98.5 Ų | 98.5 | 59% | 0.589 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -70.5 | -47.4 | 176.3 | -73.8 | 173.1 | -174.6 | 0 | 0 | 111.6 | P27 G28 L33 R34 V35 | P27-E31 PolarHBondContact O-N 3.33Å; G28-E31 PolarHBondContact O-N 3.37Å; E31-L33 VanDerWaalsContact C-N 3.29Å; E31-L33 PolarHBondContact O-N 2.91Å; E31-R34 WeakPolarHBondContact O-CB 3.48Å; E31-R34 PolarHBondContact O-N 3.34Å; E31-R34 VanDerWaalsContact O-N 3.08Å; E31-V35 PolarHBondContact O-N 3.4Å; E31-V35 VanDerWaalsContact O-N 3.09Å |
| 32 | L | 92.5 | Very high | 85.8 | Confident | 105 Ų | 105 | 91.4 Ų | 91.4 | 55% | 0.55 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -55.2 | -46.7 | 175.3 | 177.3 | 60.5 | 0 | 0 | 0 | 111.2 | G28 R34 V35 M36 | G28-L32 PolarHBondContact O-N 2.66Å; L32-R34 VanDerWaalsContact C-N 3.31Å; L32-R34 PolarHBondContact O-N 3.44Å; L32-V35 WeakPolarHBondContact O-CB 3.08Å; L32-V35 PolarHBondContact O-N 3.49Å; L32-V35 VanDerWaalsContact O-N 3.12Å; L32-M36 HydrophobicContact CD1-CG 4.3Å; L32-M36 HydrophobicContact CD1-SD 4.48Å; L32-M36 HydrophobicContact CG-CG 4.46Å; L32-M36 HydrophobicContact CG-SD 4.2Å; L32-M36 WeakPolarHBondContact O-CG 3.26Å; L32-M36 PolarHBondContact O-N 3.33Å |
| 33 | L | 90.2 | Very high | 87.5 | Confident | 48 Ų | 48 | 91.2 Ų | 91.2 | 25% | 0.251 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.5 | -39.4 | 178.9 | -168.6 | 72.3 | 0 | 0 | 0 | 112 | T29 E31 V35 M36 M37 I50 M54 | T29-L33 WeakPolarHBondContact O-CB 3.41Å; T29-L33 PolarHBondContact O-N 3.4Å; E31-L33 VanDerWaalsContact C-N 3.29Å; E31-L33 PolarHBondContact O-N 2.91Å; L33-V35 VanDerWaalsContact C-N 3.3Å; L33-V35 PolarHBondContact O-N 3.39Å; L33-M36 PolarHBondContact O-N 3.1Å; L33-M37 HydrophobicContact CD2-SD 4.07Å; L33-M37 HydrophobicContact CG-CG 4.25Å; L33-M37 HydrophobicContact CG-SD 3.76Å; L33-M37 WeakPolarHBondContact O-CB 3.36Å; L33-M37 WeakPolarHBondContact O-CG 3.39Å; L33-M37 PolarHBondContact O-N 3.24Å; L33-I50 HydrophobicContact CD2-CG2 3.73Å; L33-M54 HydrophobicContact CD2-CE 3.8Å; L33-M54 HydrophobicContact CD2-SD 3.25Å; L33-M54 WeakPolarHBondContact CD2-SD 3.48Å |
| 34 | R | 90.1 | Very high | 89 | Confident | 139 Ų | 139 | 93.1 Ų | 93.1 | 53% | 0.525 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.3 | -38.9 | 175.1 | -75.4 | 177.9 | -162.3 | 177.8 | 8.3 | 112.3 | C30 E31 L32 K38 M51 | C30-R34 WeakPolarHBondContact O-CG 3.39Å; C30-R34 PolarHBondContact O-N 3.34Å; E31-R34 WeakPolarHBondContact O-CB 3.48Å; E31-R34 PolarHBondContact O-N 3.34Å; E31-R34 VanDerWaalsContact O-N 3.08Å; L32-R34 VanDerWaalsContact C-N 3.31Å; L32-R34 PolarHBondContact O-N 3.44Å; R34-K38 WeakPolarHBondContact O-CG 3.41Å; R34-K38 PolarHBondContact O-N 3.12Å; R34-M51 HydrophobicContact CG-SD 4.22Å |
| 35 | V | 94.8 | Very high | 90 | Very high | 72 Ų | 72 | 98.6 Ų | 98.6 | 44% | 0.436 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.9 | -51.3 | 175.9 | 175.9 | 0 | 0 | 0 | 0 | 109.8 | E31 L32 L33 M37 K38 E39 | E31-V35 PolarHBondContact O-N 3.4Å; E31-V35 VanDerWaalsContact O-N 3.09Å; L32-V35 WeakPolarHBondContact O-CB 3.08Å; L32-V35 PolarHBondContact O-N 3.49Å; L32-V35 VanDerWaalsContact O-N 3.12Å; L33-V35 VanDerWaalsContact C-N 3.3Å; L33-V35 PolarHBondContact O-N 3.39Å; V35-M37 PolarHBondContact O-N 3.47Å; V35-K38 WeakPolarHBondContact O-CB 3.35Å; V35-K38 PolarHBondContact O-N 2.92Å; V35-E39 WeakPolarHBondContact CG1-OE1 3.46Å; V35-E39 PolarHBondContact O-N 3.35Å; V35-E39 VanDerWaalsContact O-N 3.1Å |
| 36 | M | 91.4 | Very high | 90.6 | Very high | 101 Ų | 101 | 96.8 Ų | 96.8 | 50% | 0.498 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -57.3 | -38.8 | 178.2 | -67 | -177.7 | 77.5 | 0 | 0 | 112.4 | L32 L33 K38 E39 S40 | L32-M36 HydrophobicContact CD1-CG 4.3Å; L32-M36 HydrophobicContact CD1-SD 4.48Å; L32-M36 HydrophobicContact CG-CG 4.46Å; L32-M36 HydrophobicContact CG-SD 4.2Å; L32-M36 WeakPolarHBondContact O-CG 3.26Å; L32-M36 PolarHBondContact O-N 3.33Å; L33-M36 PolarHBondContact O-N 3.1Å; M36-K38 VanDerWaalsContact C-N 3.34Å; M36-K38 PolarHBondContact O-N 3.08Å; M36-E39 PolarHBondContact O-N 3.44Å; M36-S40 VanDerWaalsContact O-CB 3.26Å; M36-S40 WeakPolarHBondContact O-CB 3.25Å; M36-S40 PolarHBondContact O-N 3.46Å; M36-S40 PolarHBondContact O-OG 3.04Å |
| 37 | M | 90.7 | Very high | 90.8 | Very high | 12 Ų | 12 | 95.3 Ų | 95.3 | 6% | 0.059 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -69.6 | -30.7 | -179.9 | -71.6 | 167.7 | 71.1 | 0 | 0 | 113.3 | L33 V35 L42 Q47 I50 M51 | L33-M37 HydrophobicContact CD2-SD 4.07Å; L33-M37 HydrophobicContact CG-CG 4.25Å; L33-M37 HydrophobicContact CG-SD 3.76Å; L33-M37 WeakPolarHBondContact O-CB 3.36Å; L33-M37 WeakPolarHBondContact O-CG 3.39Å; L33-M37 PolarHBondContact O-N 3.24Å; V35-M37 PolarHBondContact O-N 3.47Å; M37-L42 HydrophobicContact CB-CD1 4.19Å; M37-L42 HydrophobicContact CG-CD1 3.88Å; M37-Q47 HydrophobicContact CB-CG 4.44Å; M37-Q47 HydrophobicContact CE-CB 3.47Å; M37-Q47 VanDerWaalsContact CE-CB 3.47Å; M37-Q47 HydrophobicContact CE-CG 3.66Å; M37-Q47 WeakPolarHBondContact CE-O 3.41Å; M37-Q47 PolarHBondContact O-NE2 3.01Å; M37-I50 HydrophobicContact CE-CB 4.03Å; M37-I50 HydrophobicContact CE-CD1 4.25Å; M37-I50 HydrophobicContact CE-CG2 4.1Å; M37-I50 HydrophobicContact SD-CG2 3.98Å; M37-M51 HydrophobicContact CE-CG 4.27Å; M37-M51 HydrophobicContact SD-SD 4.47Å |
| 38 | K | 90.1 | Very high | 91 | Very high | 174 Ų | 174 | 98.4 Ų | 98.4 | 76% | 0.757 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -72.7 | -37.1 | 174.2 | -75.8 | -179.9 | 177 | -173 | 0 | 111.9 | R34 V35 M36 S40 | R34-K38 WeakPolarHBondContact O-CG 3.41Å; R34-K38 PolarHBondContact O-N 3.12Å; V35-K38 WeakPolarHBondContact O-CB 3.35Å; V35-K38 PolarHBondContact O-N 2.92Å; M36-K38 VanDerWaalsContact C-N 3.34Å; M36-K38 PolarHBondContact O-N 3.08Å; K38-S40 VanDerWaalsContact C-N 3.3Å |
| 39 | E | 92.4 | Very high | 91 | Very high | 154 Ų | 154 | 101.9 Ų | 101.9 | 72% | 0.72 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -78.8 | -19.1 | 178 | -66.8 | 175 | -172.6 | 0 | 0 | 112.2 | V35 M36 | V35-E39 WeakPolarHBondContact CG1-OE1 3.46Å; V35-E39 PolarHBondContact O-N 3.35Å; V35-E39 VanDerWaalsContact O-N 3.1Å; M36-E39 PolarHBondContact O-N 3.44Å |
| 40 | S | 88.1 | Confident | 91 | Very high | 58 Ų | 58 | 101.8 Ų | 101.8 | 41% | 0.406 | 49% | 0.486 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.1 | 152.2 | 174.4 | -62.4 | 0 | 0 | 0 | 0 | 111.8 | M36 K38 L42 | M36-S40 VanDerWaalsContact O-CB 3.26Å; M36-S40 WeakPolarHBondContact O-CB 3.25Å; M36-S40 PolarHBondContact O-N 3.46Å; M36-S40 PolarHBondContact O-OG 3.04Å; K38-S40 VanDerWaalsContact C-N 3.3Å; S40-L42 PolarHBondContact O-N 3.32Å |
| 41 | K | 94.7 | Very high | 91.1 | Very high | 217 Ų | 217 | 102 Ų | 102 | 94% | 0.943 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.2 | 33 | 173.3 | -60.3 | -177.1 | -179.4 | 179.5 | 0 | 113.3 | ||
| 42 | L | 92.4 | Very high | 90.9 | Very high | 55 Ų | 55 | 97.9 Ų | 97.9 | 29% | 0.288 | 47% | 0.467 | S | S | . | . | trans | -72.8 | 141.6 | -178.7 | -68.7 | 176.2 | 0 | 0 | 0 | 110.7 | M37 S40 Q46 Q47 I50 | M37-L42 HydrophobicContact CB-CD1 4.19Å; M37-L42 HydrophobicContact CG-CD1 3.88Å; S40-L42 PolarHBondContact O-N 3.32Å; L42-Q46 HydrophobicContact CB-CB 4.42Å; L42-Q46 HydrophobicContact CD2-CB 4.23Å; L42-Q47 HydrophobicContact CB-CG 3.81Å; L42-Q47 HydrophobicContact CD1-CG 4.39Å; L42-I50 HydrophobicContact CD1-CD1 4.02Å | ||
| 43 | T | 94.1 | Very high | 90.4 | Very high | 78 Ų | 78 | 95.4 Ų | 95.4 | 48% | 0.479 | 46% | 0.456 | S | S | . | . | trans | -74.6 | 154.2 | 171.9 | 72 | 0 | 0 | 0 | 0 | 110.4 | F45 Q46 Q47 | T43-F45 PolarHBondContact O-N 2.97Å; T43-Q46 WeakPolarHBondContact O-CB 3.5Å; T43-Q46 PolarHBondContact O-N 3.46Å; T43-Q46 WeakPolarHBondContact OG1-CG 3.29Å; T43-Q46 PolarHBondContact OG1-N 2.96Å; T43-Q46 PolarHBondContact OG1-OE1 3.31Å; T43-Q47 WeakPolarHBondContact O-CG 3.37Å; T43-Q47 PolarHBondContact O-N 3.44Å | ||
| 44 | N | 90.8 | Very high | 89.8 | Confident | 135 Ų | 135 | 94.2 Ų | 94.2 | 72% | 0.722 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -52.2 | -34.4 | 176.7 | -66 | -32.6 | 0 | 0 | 0 | 112.5 | Q47 R48 | N44-Q47 PolarHBondContact O-N 2.96Å; N44-R48 WeakPolarHBondContact O-CB 3.47Å; N44-R48 PolarHBondContact O-N 3.38Å |
| 45 | F | 93.6 | Very high | 89 | Confident | 162 Ų | 162 | 94.2 Ų | 94.2 | 71% | 0.711 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -67.9 | -45.9 | 177.8 | -175.6 | -96.9 | 0 | 0 | 0 | 112.4 | T43 Q47 R48 H49 | T43-F45 PolarHBondContact O-N 2.97Å; F45-Q47 VanDerWaalsContact C-N 3.28Å; F45-Q47 PolarHBondContact O-N 3.48Å; F45-R48 PolarHBondContact O-N 3.06Å; F45-H49 WeakPolarHBondContact O-CB 3.41Å; F45-H49 PolarHBondContact O-N 3.03Å |
| 46 | Q | 90.9 | Very high | 87.5 | Confident | 86 Ų | 86 | 99.9 Ų | 99.9 | 40% | 0.402 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.4 | -42.2 | 175.4 | -69.2 | 168 | -28.7 | 0 | 0 | 110.5 | L42 T43 R48 H49 I50 | L42-Q46 HydrophobicContact CB-CB 4.42Å; L42-Q46 HydrophobicContact CD2-CB 4.23Å; T43-Q46 WeakPolarHBondContact O-CB 3.5Å; T43-Q46 PolarHBondContact O-N 3.46Å; T43-Q46 WeakPolarHBondContact OG1-CG 3.29Å; T43-Q46 PolarHBondContact OG1-N 2.96Å; T43-Q46 PolarHBondContact OG1-OE1 3.31Å; Q46-R48 PolarHBondContact O-N 3.49Å; Q46-H49 PolarHBondContact O-N 2.76Å; Q46-I50 WeakPolarHBondContact O-CD1 3.49Å; Q46-I50 VanDerWaalsContact O-CG1 3.29Å; Q46-I50 WeakPolarHBondContact O-CG1 3.41Å; Q46-I50 PolarHBondContact O-N 2.96Å |
| 47 | Q | 90.3 | Very high | 85.8 | Confident | 50 Ų | 50 | 98.9 Ų | 98.9 | 23% | 0.234 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -61.6 | -44.9 | 178.1 | -66.9 | -177.5 | -4.9 | 0 | 0 | 112.2 | M37 L42 T43 N44 F45 I50 M51 | M37-Q47 HydrophobicContact CB-CG 4.44Å; M37-Q47 HydrophobicContact CE-CB 3.47Å; M37-Q47 VanDerWaalsContact CE-CB 3.47Å; M37-Q47 HydrophobicContact CE-CG 3.66Å; M37-Q47 WeakPolarHBondContact CE-O 3.41Å; M37-Q47 PolarHBondContact O-NE2 3.01Å; L42-Q47 HydrophobicContact CB-CG 3.81Å; L42-Q47 HydrophobicContact CD1-CG 4.39Å; T43-Q47 WeakPolarHBondContact O-CG 3.37Å; T43-Q47 PolarHBondContact O-N 3.44Å; N44-Q47 PolarHBondContact O-N 2.96Å; F45-Q47 VanDerWaalsContact C-N 3.28Å; F45-Q47 PolarHBondContact O-N 3.48Å; Q47-I50 PolarHBondContact O-N 3.29Å; Q47-M51 WeakPolarHBondContact O-CG 3.49Å; Q47-M51 PolarHBondContact O-N 2.98Å; Q47-M51 VanDerWaalsContact O-N 3.1Å |
| 48 | R | 90.8 | Very high | 83.9 | Confident | 166 Ų | 166 | 109.3 Ų | 109.3 | 63% | 0.626 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.9 | -47.6 | 176.3 | -176.5 | 66.4 | -175.7 | -143.3 | -4.5 | 111.8 | N44 F45 Q46 I50 M51 D52 | N44-R48 WeakPolarHBondContact O-CB 3.47Å; N44-R48 PolarHBondContact O-N 3.38Å; F45-R48 PolarHBondContact O-N 3.06Å; Q46-R48 PolarHBondContact O-N 3.49Å; R48-I50 PolarHBondContact O-N 3.03Å; R48-M51 PolarHBondContact O-N 2.9Å; R48-D52 IonicContact NE-OD1 3.6Å; R48-D52 IonicContact NE-OD2 3.03Å; R48-D52 PolarHBondContact NE-OD2 3.25Å; R48-D52 WeakPolarHBondContact O-CB 3.4Å; R48-D52 VanDerWaalsContact O-CG 3.29Å; R48-D52 PolarHBondContact O-N 2.79Å |
| 49 | H | 89.7 | Confident | 81.8 | Confident | 115 Ų | 115 | 115.2 Ų | 115.2 | 53% | 0.532 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.2 | -42.6 | -178.7 | -177.5 | 70.6 | 0 | 0 | 0 | 112.7 | F45 Q46 D52 T53 | F45-H49 WeakPolarHBondContact O-CB 3.41Å; F45-H49 PolarHBondContact O-N 3.03Å; Q46-H49 PolarHBondContact O-N 2.76Å; H49-D52 PolarHBondContact O-N 3.26Å; H49-T53 WeakPolarHBondContact O-CB 3.36Å; H49-T53 PolarHBondContact O-N 2.88Å; H49-T53 PolarHBondContact O-OG1 3.08Å |
| 50 | I | 88.1 | Confident | 81.3 | Confident | 56 Ų | 56 | 113.3 Ų | 113.3 | 29% | 0.287 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.2 | -50.5 | 177.1 | -69.6 | 165.7 | 0 | 0 | 0 | 110.2 | L33 M37 L42 Q46 Q47 R48 D52 T53 M54 | L33-I50 HydrophobicContact CD2-CG2 3.73Å; M37-I50 HydrophobicContact CE-CB 4.03Å; M37-I50 HydrophobicContact CE-CD1 4.25Å; M37-I50 HydrophobicContact CE-CG2 4.1Å; M37-I50 HydrophobicContact SD-CG2 3.98Å; L42-I50 HydrophobicContact CD1-CD1 4.02Å; Q46-I50 WeakPolarHBondContact O-CD1 3.49Å; Q46-I50 VanDerWaalsContact O-CG1 3.29Å; Q46-I50 WeakPolarHBondContact O-CG1 3.41Å; Q46-I50 PolarHBondContact O-N 2.96Å; Q47-I50 PolarHBondContact O-N 3.29Å; R48-I50 PolarHBondContact O-N 3.03Å; I50-D52 VanDerWaalsContact C-N 3.33Å; I50-D52 PolarHBondContact O-N 2.67Å; I50-T53 PolarHBondContact O-N 3.47Å; I50-M54 WeakPolarHBondContact O-CG 3.36Å; I50-M54 PolarHBondContact O-N 2.8Å; I50-M54 VanDerWaalsContact O-N 3.08Å |
| 51 | M | 85.9 | Confident | 81 | Confident | 34 Ų | 34 | 116.2 Ų | 116.2 | 17% | 0.167 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -61.4 | -40.3 | 179.7 | -73.2 | -58.2 | -53.5 | 0 | 0 | 112.7 | R34 M37 Q47 R48 M54 K55 | R34-M51 HydrophobicContact CG-SD 4.22Å; M37-M51 HydrophobicContact CE-CG 4.27Å; M37-M51 HydrophobicContact SD-SD 4.47Å; Q47-M51 WeakPolarHBondContact O-CG 3.49Å; Q47-M51 PolarHBondContact O-N 2.98Å; Q47-M51 VanDerWaalsContact O-N 3.1Å; R48-M51 PolarHBondContact O-N 2.9Å; M51-M54 PolarHBondContact O-N 2.96Å; M51-M54 HydrophobicContact SD-SD 4.31Å; M51-K55 WeakPolarHBondContact O-CG 3.47Å; M51-K55 PolarHBondContact O-N 2.81Å; M51-K55 VanDerWaalsContact O-N 3.12Å |
| 52 | D | 86.9 | Confident | 80.2 | Confident | 39 Ų | 39 | 110.6 Ų | 110.6 | 21% | 0.209 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -69.4 | -36.3 | 179.2 | -72.7 | -19.7 | 0 | 0 | 0 | 111.6 | R48 H49 I50 M54 K55 R56 | R48-D52 IonicContact NE-OD1 3.6Å; R48-D52 IonicContact NE-OD2 3.03Å; R48-D52 PolarHBondContact NE-OD2 3.25Å; R48-D52 WeakPolarHBondContact O-CB 3.4Å; R48-D52 VanDerWaalsContact O-CG 3.29Å; R48-D52 PolarHBondContact O-N 2.79Å; H49-D52 PolarHBondContact O-N 3.26Å; I50-D52 VanDerWaalsContact C-N 3.33Å; I50-D52 PolarHBondContact O-N 2.67Å; D52-M54 VanDerWaalsContact C-N 3.32Å; D52-M54 PolarHBondContact O-N 2.89Å; D52-K55 PolarHBondContact O-N 2.92Å; D52-R56 WeakPolarHBondContact O-CB 3.39Å; D52-R56 WeakPolarHBondContact O-CG 3.34Å; D52-R56 PolarHBondContact O-N 2.97Å |
| 53 | T | 83.4 | Confident | 79.5 | Confident | 52 Ų | 52 | 113.9 Ų | 113.9 | 32% | 0.319 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.8 | -37.2 | 174.3 | -61.3 | 0 | 0 | 0 | 0 | 111.8 | H49 I50 K57 | H49-T53 WeakPolarHBondContact O-CB 3.36Å; H49-T53 PolarHBondContact O-N 2.88Å; H49-T53 PolarHBondContact O-OG1 3.08Å; I50-T53 PolarHBondContact O-N 3.47Å; T53-K57 WeakPolarHBondContact O-CG 3.46Å |
| 54 | M | 76.5 | Confident | 78.6 | Confident | 24 Ų | 24 | 116.1 Ų | 116.1 | 12% | 0.118 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -68.4 | -42.3 | 175 | -64.4 | 177.2 | 85.1 | 0 | 0 | 112.5 | Y25 C30 L33 I50 M51 D52 K57 | Y25-M54 HydrophobicContact CD1-CE 4.31Å; Y25-M54 HydrophobicContact CD2-CB 4.33Å; Y25-M54 HydrophobicContact CD2-CE 3.15Å; Y25-M54 HydrophobicContact CD2-CG 3.85Å; Y25-M54 HydrophobicContact CD2-SD 4.3Å; Y25-M54 HydrophobicContact CE2-CE 3.81Å; Y25-M54 HydrophobicContact CE2-CG 3.9Å; Y25-M54 HydrophobicContact CG-CE 3.42Å; Y25-M54 VanDerWaalsContact CG-CE 3.42Å; C30-M54 HydrophobicContact CB-CE 4.31Å; C30-M54 VanDerWaalsContact SG-CE 3.57Å; L33-M54 HydrophobicContact CD2-CE 3.8Å; L33-M54 HydrophobicContact CD2-SD 3.25Å; L33-M54 WeakPolarHBondContact CD2-SD 3.48Å; I50-M54 WeakPolarHBondContact O-CG 3.36Å; I50-M54 PolarHBondContact O-N 2.8Å; I50-M54 VanDerWaalsContact O-N 3.08Å; M51-M54 PolarHBondContact O-N 2.96Å; M51-M54 HydrophobicContact SD-SD 4.31Å; D52-M54 VanDerWaalsContact C-N 3.32Å; D52-M54 PolarHBondContact O-N 2.89Å; M54-K57 PolarHBondContact O-N 2.79Å |
| 55 | K | 72.6 | Confident | 77.8 | Confident | 139 Ų | 139 | 114.9 Ų | 114.9 | 60% | 0.604 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -67 | -37.1 | -179.5 | -73.4 | 179.2 | -179.5 | 179.7 | 0 | 112.6 | M51 D52 K57 R58 | M51-K55 WeakPolarHBondContact O-CG 3.47Å; M51-K55 PolarHBondContact O-N 2.81Å; M51-K55 VanDerWaalsContact O-N 3.12Å; D52-K55 PolarHBondContact O-N 2.92Å; K55-K57 VanDerWaalsContact C-N 3.3Å; K55-K57 PolarHBondContact O-N 2.89Å; K55-R58 PolarHBondContact O-N 2.85Å |
| 56 | R | 63.3 | Low | 76.6 | Confident | 191 Ų | 191 | 111.5 Ų | 111.5 | 72% | 0.721 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -72.9 | -18.6 | -178.6 | -73.9 | -175.4 | -178.9 | 150.2 | 1.3 | 114.2 | D52 R58 | D52-R56 WeakPolarHBondContact O-CB 3.39Å; D52-R56 WeakPolarHBondContact O-CG 3.34Å; D52-R56 PolarHBondContact O-N 2.97Å; R56-R58 PolarHBondContact O-N 2.65Å |
| 57 | K | 56.6 | Low | 75.5 | Confident | 80 Ų | 80 | 113.5 Ų | 113.5 | 35% | 0.348 | 47% | 0.474 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -0 | 174.9 | -70.4 | 174.8 | -177 | -156.4 | 0 | 114.1 | Q22 T53 M54 K55 | Q22-K57 HydrophobicContact CB-CD 4.41Å; T53-K57 WeakPolarHBondContact O-CG 3.46Å; M54-K57 PolarHBondContact O-N 2.79Å; K55-K57 VanDerWaalsContact C-N 3.3Å; K55-K57 PolarHBondContact O-N 2.89Å |
| 58 | R | 51.2 | Low | 74.3 | Confident | 230 Ų | 230 | 118.8 Ų | 118.8 | 87% | 0.868 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.8 | 7.6 | -179.8 | -154 | -172.4 | 141.2 | 146 | -2.4 | 113.6 | K55 R56 | K55-R58 PolarHBondContact O-N 2.85Å; R56-R58 PolarHBondContact O-N 2.65Å |
| 59 | R | 46.6 | Very low | 72.8 | Confident | 299 Ų | 299 | 114.5 Ų | 114.5 | 100% | 1.128 | 48% | 0.482 | S | S | * | . | trans | -110.4 | 0 | 171.8 | -75.6 | -171.3 | 171.5 | -167.9 | -2.9 | 109.4 |
Retrieved 59 of 59 residues in 431.1 ms
(Link to these results)