| 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 | 52.2 | Low | 56.5 | Low | 213 Ų | 213 | 117 Ų | 117 | 100% | 1.049 | 58% | 0.579 | S | S | * | * | 0 | 129.1 | 0 | -58.4 | -53.2 | 176.9 | 0 | 0 | 107.8 | C3 | M1-C3 VanDerWaalsContact C-N 3.26Å; M1-C3 PolarHBondContact O-N 3.47Å | |||
| 2 | Y | 59 | Low | 56.4 | Low | 191 Ų | 191 | 119 Ų | 119 | 75% | 0.749 | 59% | 0.592 | S | S | * | * | trans | -66.8 | 65.6 | -162.5 | -53.8 | -90.1 | 0 | 0 | 0 | 115.2 | L4 Q5 | Y2-L4 PolarHBondContact O-N 3.18Å; Y2-L4 VanDerWaalsContact O-N 3.16Å; Y2-Q5 WeakPolarHBondContact O-CB 3.47Å; Y2-Q5 PolarHBondContact O-N 2.73Å | ||
| 3 | C | 58.8 | Low | 56.6 | Low | 42 Ų | 42 | 115.8 Ų | 115.8 | 28% | 0.284 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -51.9 | -36.7 | 173.5 | -82.4 | 0 | 0 | 0 | 0 | 111.8 | M1 Q5 W6 C46 | M1-C3 VanDerWaalsContact C-N 3.26Å; M1-C3 PolarHBondContact O-N 3.47Å; C3-Q5 PolarHBondContact O-N 2.05Å; C3-W6 PolarHBondContact O-N 3.03Å; C3-C46 HydrophobicContact CB-CB 3.83Å; C3-C46 WeakPolarHBondContact CB-SG 3.29Å; C3-C46 WeakPolarHBondContact SG-CB 3.44Å; C3-C46 CovalentContact SG-SG 2.05Å; C3-C46 PolarHBondContact SG-SG 3.47Å |
| 4 | L | 55.8 | Low | 55.7 | Low | 144 Ų | 144 | 115.4 Ų | 115.4 | 75% | 0.754 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.5 | -30.2 | 178.7 | -88.9 | 130 | 0 | 0 | 0 | 113.9 | Y2 W6 L7 L8 | Y2-L4 PolarHBondContact O-N 3.18Å; Y2-L4 VanDerWaalsContact O-N 3.16Å; L4-W6 PolarHBondContact O-N 3.31Å; L4-L7 PolarHBondContact O-N 3.26Å; L4-L8 PolarHBondContact O-N 3.16Å |
| 5 | Q | 57.9 | Low | 55.1 | Low | 125 Ų | 125 | 119.4 Ų | 119.4 | 58% | 0.584 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -67.3 | -27.5 | -178.2 | -157.9 | 92.1 | 23.3 | 0 | 0 | 112.1 | Y2 C3 P9 | Y2-Q5 WeakPolarHBondContact O-CB 3.47Å; Y2-Q5 PolarHBondContact O-N 2.73Å; C3-Q5 PolarHBondContact O-N 2.05Å; Q5-P9 WeakPolarHBondContact O-CD 3.42Å |
| 6 | W | 57.3 | Low | 54.3 | Low | 123 Ų | 123 | 116.4 Ų | 116.4 | 47% | 0.466 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -86.5 | -15.6 | 177.9 | -81.8 | 92.2 | 0 | 0 | 0 | 113.4 | C3 L4 P9 F36 R40 | C3-W6 PolarHBondContact O-N 3.03Å; L4-W6 PolarHBondContact O-N 3.31Å; W6-P9 WeakPolarHBondContact O-CD 2.98Å; W6-F36 HydrophobicContact CB-CE1 4.41Å; W6-F36 HydrophobicContact CB-CZ 4Å; W6-F36 HydrophobicContact CE3-CE2 4.15Å; W6-F36 AromaticContact CE3-CZ 3.86Å; W6-F36 HydrophobicContact CE3-CZ 3.86Å; W6-F36 WeakPolarHBondContact O-CZ 3.32Å; W6-R40 VanDerWaalsContact CZ2-CZ 3.41Å |
| 7 | L | 54 | Low | 54.2 | Low | 84 Ų | 84 | 120.1 Ų | 120.1 | 44% | 0.44 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -86.2 | -24.4 | 174.7 | -143.1 | 90.8 | 0 | 0 | 0 | 112 | L4 V10 L11 | L4-L7 PolarHBondContact O-N 3.26Å; L7-V10 PolarHBondContact O-N 3.48Å; L7-L11 PolarHBondContact O-N 3.09Å; L7-L11 VanDerWaalsContact O-N 3.13Å |
| 8 | L | 61.7 | Low | 53.8 | Low | 100 Ų | 100 | 120.4 Ų | 120.4 | 52% | 0.524 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -57.6 | -42.3 | 179.7 | -145.5 | 76.1 | 0 | 0 | 0 | 113.9 | L4 V10 L11 L12 | L4-L8 PolarHBondContact O-N 3.16Å; L8-V10 VanDerWaalsContact C-N 3.29Å; L8-V10 PolarHBondContact O-N 3.49Å; L8-L11 PolarHBondContact O-N 3.3Å; L8-L12 PolarHBondContact O-N 3.13Å; L8-L12 VanDerWaalsContact O-N 3.09Å |
| 9 | P | 55.2 | Low | 53.8 | Low | 77 Ų | 77 | 118.6 Ų | 118.6 | 50% | 0.5 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -68.5 | -26.5 | 178 | -19.3 | 33.2 | 0 | 0 | 0 | 113.4 | Q5 W6 | Q5-P9 WeakPolarHBondContact O-CD 3.42Å; W6-P9 WeakPolarHBondContact O-CD 2.98Å |
| 10 | V | 56.7 | Low | 53.7 | Low | 42 Ų | 42 | 116.8 Ų | 116.8 | 26% | 0.255 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -77.9 | -33.4 | 176.6 | -177.1 | 0 | 0 | 0 | 0 | 110.6 | L7 L8 L12 Y32 L33 | L7-V10 PolarHBondContact O-N 3.48Å; L8-V10 VanDerWaalsContact C-N 3.29Å; L8-V10 PolarHBondContact O-N 3.49Å; V10-L12 VanDerWaalsContact C-N 3.32Å; V10-Y32 HydrophobicContact CG2-CE1 4.31Å; V10-L33 HydrophobicContact CG1-CD2 4.26Å |
| 11 | L | 53.3 | Low | 53.7 | Low | 146 Ų | 146 | 116.8 Ų | 116.8 | 76% | 0.764 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -73.6 | -23.1 | 174.1 | -159.3 | 70.6 | 0 | 0 | 0 | 113 | L7 L8 | L7-L11 PolarHBondContact O-N 3.09Å; L7-L11 VanDerWaalsContact O-N 3.13Å; L8-L11 PolarHBondContact O-N 3.3Å |
| 12 | L | 55 | Low | 53.8 | Low | 141 Ų | 141 | 111.7 Ų | 111.7 | 74% | 0.738 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -1.8 | 179.6 | -130.1 | 81.1 | 0 | 0 | 0 | 114.2 | L8 V10 P14 | L8-L12 PolarHBondContact O-N 3.13Å; L8-L12 VanDerWaalsContact O-N 3.09Å; V10-L12 VanDerWaalsContact C-N 3.32Å; L12-P14 WeakPolarHBondContact O-CD 3.18Å |
| 13 | I | 59.6 | Low | 53.8 | Low | 77 Ų | 77 | 109.3 Ų | 109.3 | 40% | 0.395 | 58% | 0.577 | S | S | . | * | S | Bend | trans | -67.7 | 115.6 | 174.9 | -72.2 | 165.4 | 0 | 0 | 0 | 107.9 | K15 Y32 | I13-K15 PolarHBondContact O-N 3.4Å; I13-Y32 HydrophobicContact CD1-CE1 4.47Å |
| 14 | P | 43.3 | Very low | 53.8 | Low | 111 Ų | 111 | 110.3 Ų | 110.3 | 72% | 0.721 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 136.8 | -173 | 26.4 | -32.2 | 0 | 0 | 0 | 110.3 | L12 P16 | L12-P14 WeakPolarHBondContact O-CD 3.18Å; P14-P16 WeakPolarHBondContact O-CD 3.43Å |
| 15 | K | 46.1 | Very low | 54.3 | Low | 175 Ų | 175 | 106.4 Ų | 106.4 | 76% | 0.761 | 56% | 0.563 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 119.1 | 179.6 | -176 | 96 | 172.5 | 174 | 0 | 110.5 | I13 L17 | I13-K15 PolarHBondContact O-N 3.4Å; K15-L17 PolarHBondContact O-N 3.21Å |
| 16 | P | 42.8 | Very low | 54.8 | Low | 71 Ų | 71 | 100.5 Ų | 100.5 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | P | Polyproline II helix | trans | -67.9 | 125.8 | 172.7 | 23.2 | -27.6 | 0 | 0 | 0 | 109.9 | P14 N18 H25 | P14-P16 WeakPolarHBondContact O-CD 3.43Å; P16-N18 PolarHBondContact O-N 2.9Å; P16-H25 WeakPolarHBondContact CG-NE2 3.42Å |
| 17 | L | 53 | Low | 55 | Low | 179 Ų | 179 | 98.2 Ų | 98.2 | 94% | 0.937 | 53% | 0.531 | S | S | * | . | S | Bend | trans | -66.1 | 8.1 | -177.8 | -92.1 | 148.2 | 0 | 0 | 0 | 115.2 | K15 | K15-L17 PolarHBondContact O-N 3.21Š|
| 18 | N | 47 | Very low | 55.7 | Low | 127 Ų | 127 | 100.8 Ų | 100.8 | 68% | 0.679 | 54% | 0.539 | S | S | * | . | trans | -128.6 | 107.4 | -170.7 | -157.1 | -7.6 | 0 | 0 | 0 | 114.3 | P16 A20 | P16-N18 PolarHBondContact O-N 2.9Å; N18-A20 VanDerWaalsContact C-N 3.35Å; N18-A20 PolarHBondContact O-N 3.42Å | ||
| 19 | P | 53.7 | Low | 56.2 | Low | 86 Ų | 86 | 98.5 Ų | 98.5 | 56% | 0.558 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.4 | 26.1 | -175.7 | 36.2 | -36.6 | 0 | 0 | 0 | 114.8 | W22 | P19-W22 VanDerWaalsContact C-CD1 3.41Å; P19-W22 HydrophobicContact CB-CZ2 3.77Å; P19-W22 PolarHBondContact O-NE1 3.04Å |
| 20 | A | 51.7 | Low | 57 | Low | 82 Ų | 82 | 96.4 Ų | 96.4 | 68% | 0.678 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.9 | -13.2 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | N18 | N18-A20 VanDerWaalsContact C-N 3.35Å; N18-A20 PolarHBondContact O-N 3.42Å |
| 21 | L | 53.7 | Low | 57.6 | Low | 116 Ų | 116 | 100.4 Ų | 100.4 | 61% | 0.607 | 53% | 0.532 | S | S | * | . | trans | -133.9 | 41.2 | -170.2 | -154.9 | 79.7 | 0 | 0 | 0 | 112.8 | F23 S24 H25 | L21-F23 VanDerWaalsContact C-N 3.31Å; L21-F23 PolarHBondContact O-N 3.5Å; L21-S24 PolarHBondContact O-N 3.41Å; L21-H25 VanDerWaalsContact O-CB 3.3Å; L21-H25 WeakPolarHBondContact O-CB 3.35Å; L21-H25 PolarHBondContact O-N 3.18Å | ||
| 22 | W | 55.3 | Low | 58.4 | Low | 107 Ų | 107 | 98.5 Ų | 98.5 | 41% | 0.405 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.1 | -32.7 | -172.6 | -69.7 | 83.9 | 0 | 0 | 0 | 114.6 | P19 S26 N64 | P19-W22 VanDerWaalsContact C-CD1 3.41Å; P19-W22 HydrophobicContact CB-CZ2 3.77Å; P19-W22 PolarHBondContact O-NE1 3.04Å; W22-S26 VanDerWaalsContact O-CA 3.27Å; W22-S26 WeakPolarHBondContact O-CA 3.28Å; W22-S26 WeakPolarHBondContact O-CB 3.47Å; W22-S26 PolarHBondContact O-N 3.23Å; W22-N64 HydrophobicContact CZ3-CB 4.25Å; W22-N64 WeakPolarHBondContact CZ3-ND2 3.49Å |
| 23 | F | 59.2 | Low | 59.1 | Low | 140 Ų | 140 | 93.6 Ų | 93.6 | 61% | 0.614 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -77.9 | -31.3 | -178.8 | -174.9 | -98.2 | 0 | 0 | 0 | 113.4 | L21 S26 M27 | L21-F23 VanDerWaalsContact C-N 3.31Å; L21-F23 PolarHBondContact O-N 3.5Å; F23-S26 VanDerWaalsContact O-CA 3.26Å; F23-S26 WeakPolarHBondContact O-CA 3.48Å; F23-M27 HydrophobicContact CE1-CE 4.28Å; F23-M27 HydrophobicContact CE2-CE 3.97Å; F23-M27 HydrophobicContact CZ-CE 3.57Å; F23-M27 PolarHBondContact O-N 3.37Å |
| 24 | S | 58.8 | Low | 59.6 | Low | 63 Ų | 63 | 94.1 Ų | 94.1 | 44% | 0.441 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -79.8 | -38.3 | 174.1 | -45.1 | 0 | 0 | 0 | 0 | 110.4 | L21 S26 M27 F28 | L21-S24 PolarHBondContact O-N 3.41Å; S24-S26 VanDerWaalsContact C-N 3.3Å; S24-M27 PolarHBondContact O-N 3.46Å; S24-F28 WeakPolarHBondContact O-CB 3.3Å; S24-F28 PolarHBondContact O-N 3Å |
| 25 | H | 66.1 | Low | 60.9 | Low | 62 Ų | 62 | 91.8 Ų | 91.8 | 29% | 0.287 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 171 | -156.7 | 62.4 | 0 | 0 | 0 | 110 | P16 L21 F28 M29 F66 | P16-H25 WeakPolarHBondContact CG-NE2 3.42Å; L21-H25 VanDerWaalsContact O-CB 3.3Å; L21-H25 WeakPolarHBondContact O-CB 3.35Å; L21-H25 PolarHBondContact O-N 3.18Å; H25-F28 CarbonylContact O-C 3.58Å; H25-F28 WeakPolarHBondContact O-CA 3.32Å; H25-F28 WeakPolarHBondContact O-CB 3.27Å; H25-F28 PolarHBondContact O-N 2.93Å; H25-F28 VanDerWaalsContact O-N 3.13Å; H25-M29 WeakPolarHBondContact NE2-CE 3.46Å; H25-M29 PolarHBondContact O-N 3.35Å; H25-F66 HydrophobicContact CB-CZ 4.12Å; H25-F66 AromaticContact CD2-CZ 3.76Å; H25-F66 WeakPolarHBondContact O-CE1 3.17Å; H25-F66 WeakPolarHBondContact O-CZ 3.15Å |
| 26 | S | 66.9 | Low | 61.8 | Low | 1 Ų | 1 | 85.8 Ų | 85.8 | 1% | 0.007 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -0.2 | -94.2 | 142.1 | -151.4 | 0 | 0 | 0 | 0 | 119.3 | W22 F23 S24 F28 G30 F66 | W22-S26 VanDerWaalsContact O-CA 3.27Å; W22-S26 WeakPolarHBondContact O-CA 3.28Å; W22-S26 WeakPolarHBondContact O-CB 3.47Å; W22-S26 PolarHBondContact O-N 3.23Å; F23-S26 VanDerWaalsContact O-CA 3.26Å; F23-S26 WeakPolarHBondContact O-CA 3.48Å; S24-S26 VanDerWaalsContact C-N 3.3Å; S26-F28 PolarHBondContact O-N 3.39Å; S26-G30 PolarHBondContact O-N 3.31Å; S26-G30 VanDerWaalsContact O-N 3.16Å; S26-F66 VanDerWaalsContact CA-CZ 3.4Å; S26-F66 VanDerWaalsContact CB-CD2 3.48Å; S26-F66 WeakPolarHBondContact CB-O 3.32Å; S26-F66 WeakPolarHBondContact O-CD1 3.37Å; S26-F66 WeakPolarHBondContact O-CE1 3.48Å; S26-F66 VanDerWaalsContact OG-CB 3.25Å; S26-F66 WeakPolarHBondContact OG-CB 3.39Å; S26-F66 WeakPolarHBondContact OG-CD1 2.89Å; S26-F66 WeakPolarHBondContact OG-CE1 3.49Å; S26-F66 WeakPolarHBondContact OG-CG 3.42Å; S26-F66 PolarHBondContact OG-O 2.91Å |
| 27 | M | 62.3 | Low | 62.9 | Low | 76 Ų | 76 | 85.1 Ų | 85.1 | 37% | 0.374 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.1 | -37.7 | -179.8 | -65.4 | -65.1 | 173.3 | 0 | 0 | 109.7 | F23 S24 G30 F31 | F23-M27 HydrophobicContact CE1-CE 4.28Å; F23-M27 HydrophobicContact CE2-CE 3.97Å; F23-M27 HydrophobicContact CZ-CE 3.57Å; F23-M27 PolarHBondContact O-N 3.37Å; S24-M27 PolarHBondContact O-N 3.46Å; M27-G30 PolarHBondContact O-N 3.48Å; M27-F31 HydrophobicContact CB-CD2 4.1Å; M27-F31 HydrophobicContact CB-CE2 4.01Å; M27-F31 WeakPolarHBondContact O-CB 3.19Å; M27-F31 WeakPolarHBondContact O-CD2 3.38Å; M27-F31 WeakPolarHBondContact O-CG 3.36Å; M27-F31 PolarHBondContact O-N 2.82Å; M27-F31 HydrophobicContact SD-CE2 4.49Å |
| 28 | F | 69.8 | Low | 63.6 | Low | 138 Ų | 138 | 82.6 Ų | 82.6 | 61% | 0.605 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -62.3 | -48.5 | -178.7 | -167.6 | -98 | 0 | 0 | 0 | 113.7 | S24 H25 S26 Y32 | S24-F28 WeakPolarHBondContact O-CB 3.3Å; S24-F28 PolarHBondContact O-N 3Å; H25-F28 CarbonylContact O-C 3.58Å; H25-F28 WeakPolarHBondContact O-CA 3.32Å; H25-F28 WeakPolarHBondContact O-CB 3.27Å; H25-F28 PolarHBondContact O-N 2.93Å; H25-F28 VanDerWaalsContact O-N 3.13Å; S26-F28 PolarHBondContact O-N 3.39Å; F28-Y32 VanDerWaalsContact O-CB 3.29Å; F28-Y32 WeakPolarHBondContact O-CB 3.25Å; F28-Y32 PolarHBondContact O-N 3.49Å |
| 29 | M | 70.9 | Confident | 64.3 | Low | 51 Ų | 51 | 84.7 Ų | 84.7 | 25% | 0.251 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -70.2 | -34.1 | 176.2 | -58.3 | -75.6 | -172.6 | 0 | 0 | 111.7 | H25 Y32 L33 F66 | H25-M29 WeakPolarHBondContact NE2-CE 3.46Å; H25-M29 PolarHBondContact O-N 3.35Å; M29-Y32 PolarHBondContact O-N 3.03Å; M29-L33 WeakPolarHBondContact O-CB 3.45Å; M29-L33 WeakPolarHBondContact O-CD1 3.49Å; M29-L33 WeakPolarHBondContact O-CG 3.21Å; M29-L33 PolarHBondContact O-N 3.25Å; M29-F66 HydrophobicContact CB-CD1 4.27Å; M29-F66 HydrophobicContact CB-CE1 3.44Å; M29-F66 VanDerWaalsContact CB-CE1 3.44Å; M29-F66 HydrophobicContact CB-CZ 4.01Å; M29-F66 HydrophobicContact CG-CE1 3.78Å; M29-F66 HydrophobicContact CG-CZ 3.8Å |
| 30 | G | 72.5 | Confident | 64.8 | Low | 33 Ų | 33 | 87 Ų | 87 | 34% | 0.34 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.8 | -48.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S26 M27 L33 L34 | S26-G30 PolarHBondContact O-N 3.31Å; S26-G30 VanDerWaalsContact O-N 3.16Å; M27-G30 PolarHBondContact O-N 3.48Å; G30-L33 PolarHBondContact O-N 2.99Å; G30-L34 WeakPolarHBondContact O-CB 3.35Å; G30-L34 PolarHBondContact O-N 2.86Å |
| 31 | F | 69.3 | Low | 65.3 | Low | 126 Ų | 126 | 91.8 Ų | 91.8 | 55% | 0.553 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.4 | -37.9 | 174.6 | -76.7 | -61.8 | 0 | 0 | 0 | 112 | M27 L33 L34 S35 | M27-F31 HydrophobicContact CB-CD2 4.1Å; M27-F31 HydrophobicContact CB-CE2 4.01Å; M27-F31 WeakPolarHBondContact O-CB 3.19Å; M27-F31 WeakPolarHBondContact O-CD2 3.38Å; M27-F31 WeakPolarHBondContact O-CG 3.36Å; M27-F31 PolarHBondContact O-N 2.82Å; M27-F31 HydrophobicContact SD-CE2 4.49Å; F31-L33 VanDerWaalsContact C-N 3.34Å; F31-L33 PolarHBondContact O-N 2.87Å; F31-L34 PolarHBondContact O-N 3.48Å; F31-S35 WeakPolarHBondContact O-CB 3.44Å; F31-S35 PolarHBondContact O-N 3.37Å; F31-S35 PolarHBondContact O-OG 2.7Å |
| 32 | Y | 70.1 | Confident | 65.8 | Low | 106 Ų | 106 | 88.3 Ų | 88.3 | 42% | 0.416 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.6 | -44.9 | 175.4 | -173.3 | -97.6 | 0 | 0 | 0 | 111.7 | V10 I13 F28 M29 F36 | V10-Y32 HydrophobicContact CG2-CE1 4.31Å; I13-Y32 HydrophobicContact CD1-CE1 4.47Å; F28-Y32 VanDerWaalsContact O-CB 3.29Å; F28-Y32 WeakPolarHBondContact O-CB 3.25Å; F28-Y32 PolarHBondContact O-N 3.49Å; M29-Y32 PolarHBondContact O-N 3.03Å; Y32-F36 WeakPolarHBondContact O-CB 3.38Å; Y32-F36 PolarHBondContact O-N 3.48Å |
| 33 | L | 69.8 | Low | 66.4 | Low | 38 Ų | 38 | 86.7 Ų | 86.7 | 20% | 0.199 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -63.2 | -45.3 | 174.5 | -70.6 | 162.8 | 0 | 0 | 0 | 111.2 | V10 M29 G30 F31 F36 L37 F50 | V10-L33 HydrophobicContact CG1-CD2 4.26Å; M29-L33 WeakPolarHBondContact O-CB 3.45Å; M29-L33 WeakPolarHBondContact O-CD1 3.49Å; M29-L33 WeakPolarHBondContact O-CG 3.21Å; M29-L33 PolarHBondContact O-N 3.25Å; G30-L33 PolarHBondContact O-N 2.99Å; F31-L33 VanDerWaalsContact C-N 3.34Å; F31-L33 PolarHBondContact O-N 2.87Å; L33-F36 WeakPolarHBondContact O-CB 3.34Å; L33-F36 PolarHBondContact O-N 3.44Å; L33-L37 WeakPolarHBondContact O-CG 3.2Å; L33-L37 PolarHBondContact O-N 3.38Å; L33-F50 HydrophobicContact CB-CE1 4.26Å; L33-F50 HydrophobicContact CB-CZ 4.41Å; L33-F50 HydrophobicContact CD1-CE1 3.97Å; L33-F50 HydrophobicContact CD1-CZ 3.52Å; L33-F50 HydrophobicContact CD2-CE1 3.96Å; L33-F50 HydrophobicContact CD2-CE2 4.07Å; L33-F50 HydrophobicContact CD2-CZ 3.38Å; L33-F50 HydrophobicContact CG-CE1 4.27Å; L33-F50 HydrophobicContact CG-CZ 3.93Å |
| 34 | L | 70.9 | Confident | 67 | Low | 89 Ų | 89 | 85.1 Ų | 85.1 | 47% | 0.466 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 179.4 | -173.6 | 62 | 0 | 0 | 0 | 112.4 | G30 F31 F36 L37 L38 | G30-L34 WeakPolarHBondContact O-CB 3.35Å; G30-L34 PolarHBondContact O-N 2.86Å; F31-L34 PolarHBondContact O-N 3.48Å; L34-F36 VanDerWaalsContact C-N 3.29Å; L34-F36 PolarHBondContact O-N 3.33Å; L34-L37 HydrophobicContact CD1-CD1 4.46Å; L34-L37 WeakPolarHBondContact O-CB 3.41Å; L34-L37 PolarHBondContact O-N 3.47Å; L34-L37 VanDerWaalsContact O-N 3.13Å; L34-L38 HydrophobicContact CG-CD1 4.02Å; L34-L38 WeakPolarHBondContact O-CD1 3.41Å; L34-L38 PolarHBondContact O-N 3.09Å |
| 35 | S | 69 | Low | 67.6 | Low | 61 Ų | 61 | 88.2 Ų | 88.2 | 43% | 0.427 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -60.3 | -40.7 | 173.5 | -65.1 | 0 | 0 | 0 | 0 | 110.9 | F31 L37 L38 E39 | F31-S35 WeakPolarHBondContact O-CB 3.44Å; F31-S35 PolarHBondContact O-N 3.37Å; F31-S35 PolarHBondContact O-OG 2.7Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 3.42Å; S35-L38 PolarHBondContact O-N 2.97Å; S35-E39 VanDerWaalsContact O-CB 3.27Å; S35-E39 WeakPolarHBondContact O-CB 3.34Å; S35-E39 PolarHBondContact O-N 2.94Å |
| 36 | F | 66.1 | Low | 67.8 | Low | 49 Ų | 49 | 87.2 Ų | 87.2 | 22% | 0.215 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -61.5 | -39.7 | 174.1 | -166 | -95.9 | 0 | 0 | 0 | 112.3 | W6 Y32 L33 L34 R40 | W6-F36 HydrophobicContact CB-CE1 4.41Å; W6-F36 HydrophobicContact CB-CZ 4Å; W6-F36 HydrophobicContact CE3-CE2 4.15Å; W6-F36 AromaticContact CE3-CZ 3.86Å; W6-F36 HydrophobicContact CE3-CZ 3.86Å; W6-F36 WeakPolarHBondContact O-CZ 3.32Å; Y32-F36 WeakPolarHBondContact O-CB 3.38Å; Y32-F36 PolarHBondContact O-N 3.48Å; L33-F36 WeakPolarHBondContact O-CB 3.34Å; L33-F36 PolarHBondContact O-N 3.44Å; L34-F36 VanDerWaalsContact C-N 3.29Å; L34-F36 PolarHBondContact O-N 3.33Å; F36-R40 HydrophobicContact CD2-CG 4.41Å; F36-R40 HydrophobicContact CE1-CG 4.38Å; F36-R40 HydrophobicContact CE2-CG 4.16Å; F36-R40 HydrophobicContact CZ-CG 4.16Å; F36-R40 VanDerWaalsContact O-CB 3.3Å; F36-R40 WeakPolarHBondContact O-CB 3.43Å; F36-R40 PolarHBondContact O-N 3.04Å |
| 37 | L | 65.7 | Low | 68.1 | Low | 57 Ų | 57 | 88.5 Ų | 88.5 | 30% | 0.298 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.7 | -42.8 | 174.9 | -62.3 | 176.6 | 0 | 0 | 0 | 112 | L33 L34 S35 K41 P42 A47 | L33-L37 WeakPolarHBondContact O-CG 3.2Å; L33-L37 PolarHBondContact O-N 3.38Å; L34-L37 HydrophobicContact CD1-CD1 4.46Å; L34-L37 WeakPolarHBondContact O-CB 3.41Å; L34-L37 PolarHBondContact O-N 3.47Å; L34-L37 VanDerWaalsContact O-N 3.13Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 3.42Å; L37-K41 PolarHBondContact O-N 3.33Å; L37-P42 HydrophobicContact CB-CG 4.47Å; L37-P42 HydrophobicContact CD2-CG 3.46Å; L37-P42 VanDerWaalsContact CD2-CG 3.46Å; L37-P42 WeakPolarHBondContact O-CD 3.27Å; L37-A47 HydrophobicContact CD2-CB 4.41Å |
| 38 | L | 66.6 | Low | 68.7 | Low | 126 Ų | 126 | 90.2 Ų | 90.2 | 66% | 0.66 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -68.1 | -38.4 | -180 | -77.2 | 154.4 | 0 | 0 | 0 | 112.4 | L34 S35 | L34-L38 HydrophobicContact CG-CD1 4.02Å; L34-L38 WeakPolarHBondContact O-CD1 3.41Å; L34-L38 PolarHBondContact O-N 3.09Å; S35-L38 PolarHBondContact O-N 2.97Å |
| 39 | E | 61.8 | Low | 69 | Low | 171 Ų | 171 | 88.3 Ų | 88.3 | 80% | 0.799 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -85.8 | -34.8 | -173.2 | -149.6 | 141.7 | 122.9 | 0 | 0 | 112.8 | S35 | S35-E39 VanDerWaalsContact O-CB 3.27Å; S35-E39 WeakPolarHBondContact O-CB 3.34Å; S35-E39 PolarHBondContact O-N 2.94Å |
| 40 | R | 63.8 | Low | 69.1 | Low | 135 Ų | 135 | 88.2 Ų | 88.2 | 51% | 0.509 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -95.5 | -12.5 | -177 | -74.1 | -81.8 | 173.9 | -167.8 | -9.3 | 115.1 | W6 F36 | W6-R40 VanDerWaalsContact CZ2-CZ 3.41Å; F36-R40 HydrophobicContact CD2-CG 4.41Å; F36-R40 HydrophobicContact CE1-CG 4.38Å; F36-R40 HydrophobicContact CE2-CG 4.16Å; F36-R40 HydrophobicContact CZ-CG 4.16Å; F36-R40 VanDerWaalsContact O-CB 3.3Å; F36-R40 WeakPolarHBondContact O-CB 3.43Å; F36-R40 PolarHBondContact O-N 3.04Å |
| 41 | K | 62.2 | Low | 69.2 | Low | 183 Ų | 183 | 92 Ų | 92 | 80% | 0.796 | 47% | 0.472 | S | S | * | . | trans | 42.6 | 60.3 | -173 | -78.8 | 153.9 | 177.1 | 166.7 | 0 | 111.3 | L37 C43 | L37-K41 PolarHBondContact O-N 3.33Å; K41-C43 PolarHBondContact O-N 2.92Å | ||
| 42 | P | 65.6 | Low | 69.7 | Low | 42 Ų | 42 | 88.2 Ų | 88.2 | 27% | 0.273 | 46% | 0.464 | S | S | . | . | trans | -58.4 | 145.6 | 175.6 | 26.6 | -30.6 | 0 | 0 | 0 | 108.6 | L37 T44 C46 | L37-P42 HydrophobicContact CB-CG 4.47Å; L37-P42 HydrophobicContact CD2-CG 3.46Å; L37-P42 VanDerWaalsContact CD2-CG 3.46Å; L37-P42 WeakPolarHBondContact O-CD 3.27Å; P42-T44 PolarHBondContact O-N 3.26Å; P42-C46 HydrophobicContact CB-CB 4.47Å | ||
| 43 | C | 66.4 | Low | 69.8 | Low | 73 Ų | 73 | 85.3 Ų | 85.3 | 49% | 0.493 | 46% | 0.462 | S | S | . | . | trans | -51.7 | 140.4 | 175 | -59.2 | 0 | 0 | 0 | 0 | 109.7 | K41 I45 C46 A47 | K41-C43 PolarHBondContact O-N 2.92Å; C43-I45 PolarHBondContact O-N 2.91Å; C43-C46 WeakPolarHBondContact O-CA 3.5Å; C43-C46 WeakPolarHBondContact O-CB 3.39Å; C43-C46 PolarHBondContact O-N 2.99Å; C43-A47 PolarHBondContact O-N 3.38Å | ||
| 44 | T | 71.8 | Confident | 70 | Confident | 108 Ų | 108 | 87.2 Ų | 87.2 | 66% | 0.663 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -48.6 | -37.4 | -177 | -48.7 | 0 | 0 | 0 | 0 | 112.7 | P42 C46 A47 L48 | P42-T44 PolarHBondContact O-N 3.26Å; T44-C46 PolarHBondContact O-N 3.22Å; T44-A47 PolarHBondContact O-N 2.97Å; T44-L48 HydrophobicContact CG2-CD1 4.18Å; T44-L48 HydrophobicContact CG2-CG 4.44Å; T44-L48 WeakPolarHBondContact O-CB 3.17Å; T44-L48 VanDerWaalsContact O-CG 3.28Å; T44-L48 WeakPolarHBondContact O-CG 3.39Å; T44-L48 PolarHBondContact O-N 3.24Å |
| 45 | I | 72.6 | Confident | 70.1 | Confident | 128 Ų | 128 | 89.5 Ų | 89.5 | 66% | 0.656 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -61.5 | -42.7 | 177.6 | -60.3 | 159.6 | 0 | 0 | 0 | 111.7 | C43 L48 V49 | C43-I45 PolarHBondContact O-N 2.91Å; I45-L48 PolarHBondContact O-N 2.95Å; I45-V49 WeakPolarHBondContact O-CG2 3.25Å; I45-V49 PolarHBondContact O-N 2.88Å |
| 46 | C | 70.3 | Confident | 70.2 | Confident | 40 Ų | 40 | 91.7 Ų | 91.7 | 27% | 0.27 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -70.1 | -36.8 | -179.2 | -53.6 | 0 | 0 | 0 | 0 | 111.1 | C3 P42 C43 T44 F50 | C3-C46 HydrophobicContact CB-CB 3.83Å; C3-C46 WeakPolarHBondContact CB-SG 3.29Å; C3-C46 WeakPolarHBondContact SG-CB 3.44Å; C3-C46 CovalentContact SG-SG 2.05Å; C3-C46 PolarHBondContact SG-SG 3.47Å; P42-C46 HydrophobicContact CB-CB 4.47Å; C43-C46 WeakPolarHBondContact O-CA 3.5Å; C43-C46 WeakPolarHBondContact O-CB 3.39Å; C43-C46 PolarHBondContact O-N 2.99Å; T44-C46 PolarHBondContact O-N 3.22Å; C46-F50 WeakPolarHBondContact O-CB 2.97Å; C46-F50 PolarHBondContact O-N 2.79Å |
| 47 | A | 72.7 | Confident | 70.3 | Confident | 29 Ų | 29 | 93.7 Ų | 93.7 | 24% | 0.24 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -66.3 | -41.8 | 173 | 0 | 0 | 0 | 0 | 0 | 112.1 | L37 C43 T44 F50 L51 | L37-A47 HydrophobicContact CD2-CB 4.41Å; C43-A47 PolarHBondContact O-N 3.38Å; T44-A47 PolarHBondContact O-N 2.97Å; A47-F50 PolarHBondContact O-N 3.03Å; A47-L51 WeakPolarHBondContact O-CB 3.17Å; A47-L51 PolarHBondContact O-N 2.84Å |
| 48 | L | 75.6 | Confident | 70.4 | Confident | 112 Ų | 112 | 92.8 Ų | 92.8 | 59% | 0.586 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.6 | -43.9 | 177.9 | -74.5 | 173.1 | 0 | 0 | 0 | 112.3 | T44 I45 F50 L51 A52 | T44-L48 HydrophobicContact CG2-CD1 4.18Å; T44-L48 HydrophobicContact CG2-CG 4.44Å; T44-L48 WeakPolarHBondContact O-CB 3.17Å; T44-L48 VanDerWaalsContact O-CG 3.28Å; T44-L48 WeakPolarHBondContact O-CG 3.39Å; T44-L48 PolarHBondContact O-N 3.24Å; I45-L48 PolarHBondContact O-N 2.95Å; L48-F50 PolarHBondContact O-N 3.41Å; L48-L51 PolarHBondContact O-N 3.13Å; L48-A52 VanDerWaalsContact O-CB 3.27Å; L48-A52 WeakPolarHBondContact O-CB 3.05Å; L48-A52 PolarHBondContact O-N 3.44Å |
| 49 | V | 75.8 | Confident | 70.4 | Confident | 97 Ų | 97 | 95.6 Ų | 95.6 | 59% | 0.588 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.6 | -42.1 | 177.8 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | I45 A52 A53 | I45-V49 WeakPolarHBondContact O-CG2 3.25Å; I45-V49 PolarHBondContact O-N 2.88Å; V49-A52 PolarHBondContact O-N 3.37Å; V49-A53 PolarHBondContact O-N 2.75Å |
| 50 | F | 71.9 | Confident | 70.4 | Confident | 49 Ų | 49 | 90.6 Ų | 90.6 | 22% | 0.215 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -63.4 | -46 | 177.3 | -177.8 | -103.5 | 0 | 0 | 0 | 112.3 | L33 C46 A47 L48 A53 L54 | L33-F50 HydrophobicContact CB-CE1 4.26Å; L33-F50 HydrophobicContact CB-CZ 4.41Å; L33-F50 HydrophobicContact CD1-CE1 3.97Å; L33-F50 HydrophobicContact CD1-CZ 3.52Å; L33-F50 HydrophobicContact CD2-CE1 3.96Å; L33-F50 HydrophobicContact CD2-CE2 4.07Å; L33-F50 HydrophobicContact CD2-CZ 3.38Å; L33-F50 HydrophobicContact CG-CE1 4.27Å; L33-F50 HydrophobicContact CG-CZ 3.93Å; C46-F50 WeakPolarHBondContact O-CB 2.97Å; C46-F50 PolarHBondContact O-N 2.79Å; A47-F50 PolarHBondContact O-N 3.03Å; L48-F50 PolarHBondContact O-N 3.41Å; F50-A53 PolarHBondContact O-N 2.89Å; F50-L54 HydrophobicContact CD1-CD1 3.99Å; F50-L54 HydrophobicContact CE1-CD1 3.36Å; F50-L54 HydrophobicContact CE1-CG 4.11Å; F50-L54 HydrophobicContact CZ-CD1 3.73Å; F50-L54 HydrophobicContact CZ-CD2 4.39Å; F50-L54 HydrophobicContact CZ-CG 4.11Å; F50-L54 PolarHBondContact O-N 3.24Å; F50-L54 VanDerWaalsContact O-N 3.09Å |
| 51 | L | 74.7 | Confident | 70.4 | Confident | 113 Ų | 113 | 85.6 Ų | 85.6 | 59% | 0.592 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -66.1 | -39.1 | 178.9 | -165.2 | 145.8 | 0 | 0 | 0 | 111.7 | A47 L48 L54 F55 | A47-L51 WeakPolarHBondContact O-CB 3.17Å; A47-L51 PolarHBondContact O-N 2.84Å; L48-L51 PolarHBondContact O-N 3.13Å; L51-L54 PolarHBondContact O-N 3.2Å; L51-F55 WeakPolarHBondContact O-CB 3.02Å; L51-F55 PolarHBondContact O-N 3.44Å |
| 52 | A | 79.7 | Confident | 69.9 | Low | 47 Ų | 47 | 88.2 Ų | 88.2 | 39% | 0.388 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.1 | -41 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L48 V49 F55 L56 | L48-A52 VanDerWaalsContact O-CB 3.27Å; L48-A52 WeakPolarHBondContact O-CB 3.05Å; L48-A52 PolarHBondContact O-N 3.44Å; V49-A52 PolarHBondContact O-N 3.37Å; A52-F55 PolarHBondContact O-N 2.78Å; A52-L56 WeakPolarHBondContact O-CB 3.25Å; A52-L56 WeakPolarHBondContact O-CG 3.12Å; A52-L56 PolarHBondContact O-N 3.37Å |
| 53 | A | 73.9 | Confident | 69.4 | Low | 44 Ų | 44 | 87.8 Ų | 87.8 | 36% | 0.364 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65 | -44 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | V49 F50 F55 L56 I57 | V49-A53 PolarHBondContact O-N 2.75Å; F50-A53 PolarHBondContact O-N 2.89Å; A53-F55 VanDerWaalsContact C-N 3.33Å; A53-F55 PolarHBondContact O-N 3.08Å; A53-L56 PolarHBondContact O-N 3.4Å; A53-I57 WeakPolarHBondContact O-CB 3.49Å; A53-I57 WeakPolarHBondContact O-CD1 2.8Å; A53-I57 VanDerWaalsContact O-CG1 3.25Å; A53-I57 WeakPolarHBondContact O-CG1 3.24Å; A53-I57 PolarHBondContact O-N 3.38Å |
| 54 | L | 72.1 | Confident | 68.9 | Low | 78 Ų | 78 | 89.8 Ų | 89.8 | 41% | 0.408 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -59.9 | -44.6 | 174 | -73.3 | 179 | 0 | 0 | 0 | 111.7 | F50 L51 I57 C58 | F50-L54 HydrophobicContact CD1-CD1 3.99Å; F50-L54 HydrophobicContact CE1-CD1 3.36Å; F50-L54 HydrophobicContact CE1-CG 4.11Å; F50-L54 HydrophobicContact CZ-CD1 3.73Å; F50-L54 HydrophobicContact CZ-CD2 4.39Å; F50-L54 HydrophobicContact CZ-CG 4.11Å; F50-L54 PolarHBondContact O-N 3.24Å; F50-L54 VanDerWaalsContact O-N 3.09Å; L51-L54 PolarHBondContact O-N 3.2Å; L54-I57 PolarHBondContact O-N 3.17Å; L54-C58 WeakPolarHBondContact O-CB 3.01Å; L54-C58 PolarHBondContact O-N 2.73Å; L54-C58 VanDerWaalsContact O-N 3.08Å |
| 55 | F | 73.3 | Confident | 68.3 | Low | 137 Ų | 137 | 85.4 Ų | 85.4 | 60% | 0.601 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -64 | -44.7 | 178.5 | -164.5 | -91.9 | 0 | 0 | 0 | 111.5 | L51 A52 A53 I57 C58 Y59 | L51-F55 WeakPolarHBondContact O-CB 3.02Å; L51-F55 PolarHBondContact O-N 3.44Å; A52-F55 PolarHBondContact O-N 2.78Å; A53-F55 VanDerWaalsContact C-N 3.33Å; A53-F55 PolarHBondContact O-N 3.08Å; F55-I57 PolarHBondContact O-N 2.73Å; F55-C58 PolarHBondContact O-N 2.84Å; F55-Y59 HydrophobicContact CE1-CD2 4.1Å; F55-Y59 HydrophobicContact CE1-CG 4.47Å; F55-Y59 HydrophobicContact CZ-CD2 4.45Å; F55-Y59 WeakPolarHBondContact O-CB 3.04Å; F55-Y59 PolarHBondContact O-N 3.13Å |
| 56 | L | 71.8 | Confident | 67.6 | Low | 108 Ų | 108 | 82.3 Ų | 82.3 | 57% | 0.565 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -61.9 | -43 | 177.6 | -86.5 | 161.4 | 0 | 0 | 0 | 112.7 | A52 A53 Y59 S60 | A52-L56 WeakPolarHBondContact O-CB 3.25Å; A52-L56 WeakPolarHBondContact O-CG 3.12Å; A52-L56 PolarHBondContact O-N 3.37Å; A53-L56 PolarHBondContact O-N 3.4Å; L56-Y59 PolarHBondContact O-N 2.75Å; L56-S60 WeakPolarHBondContact O-CB 2.84Å; L56-S60 PolarHBondContact O-N 2.03Å; L56-S60 PolarHBondContact O-OG 3.38Å |
| 57 | I | 67.5 | Low | 66.7 | Low | 91 Ų | 91 | 86 Ų | 86 | 47% | 0.467 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.3 | -42.3 | 179.1 | -70.1 | 164.4 | 0 | 0 | 0 | 110.7 | A53 L54 F55 C61 | A53-I57 WeakPolarHBondContact O-CB 3.49Å; A53-I57 WeakPolarHBondContact O-CD1 2.8Å; A53-I57 VanDerWaalsContact O-CG1 3.25Å; A53-I57 WeakPolarHBondContact O-CG1 3.24Å; A53-I57 PolarHBondContact O-N 3.38Å; L54-I57 PolarHBondContact O-N 3.17Å; F55-I57 PolarHBondContact O-N 2.73Å; I57-C61 PolarHBondContact O-N 3.03Å |
| 58 | C | 69 | Low | 65.5 | Low | 37 Ų | 37 | 93.5 Ų | 93.5 | 25% | 0.25 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -72 | -35.9 | 177.4 | -80.6 | 0 | 0 | 0 | 0 | 113.1 | L54 F55 C65 | L54-C58 WeakPolarHBondContact O-CB 3.01Å; L54-C58 PolarHBondContact O-N 2.73Å; L54-C58 VanDerWaalsContact O-N 3.08Å; F55-C58 PolarHBondContact O-N 2.84Å; C58-C65 VanDerWaalsContact CA-SG 3.59Å; C58-C65 HydrophobicContact CB-CB 4Å; C58-C65 WeakPolarHBondContact CB-SG 3.49Å; C58-C65 WeakPolarHBondContact SG-CB 3.3Å; C58-C65 CovalentContact SG-SG 2.03Å; C58-C65 PolarHBondContact SG-SG 3Å |
| 59 | Y | 65.6 | Low | 64.4 | Low | 186 Ų | 186 | 95.7 Ų | 95.7 | 73% | 0.729 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -73 | -35.4 | 177.7 | -163.7 | -95.5 | 0 | 0 | 0 | 112.2 | F55 L56 C61 | F55-Y59 HydrophobicContact CE1-CD2 4.1Å; F55-Y59 HydrophobicContact CE1-CG 4.47Å; F55-Y59 HydrophobicContact CZ-CD2 4.45Å; F55-Y59 WeakPolarHBondContact O-CB 3.04Å; F55-Y59 PolarHBondContact O-N 3.13Å; L56-Y59 PolarHBondContact O-N 2.75Å; Y59-C61 PolarHBondContact O-N 3.3Å |
| 60 | S | 62.8 | Low | 63.3 | Low | 65 Ų | 65 | 93.7 Ų | 93.7 | 46% | 0.455 | 47% | 0.473 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.1 | -7.2 | 180 | -52.7 | 0 | 0 | 0 | 0 | 113 | L56 W62 | L56-S60 WeakPolarHBondContact O-CB 2.84Å; L56-S60 PolarHBondContact O-N 2.03Å; L56-S60 PolarHBondContact O-OG 3.38Å; S60-W62 PolarHBondContact O-N 3.16Å |
| 61 | C | 62.3 | Low | 62.4 | Low | 30 Ų | 30 | 97.6 Ų | 97.6 | 20% | 0.203 | 50% | 0.501 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 52.6 | 19.2 | 179.4 | -147.4 | 0 | 0 | 0 | 0 | 113.4 | I57 Y59 C70 S73 | I57-C61 PolarHBondContact O-N 3.03Å; Y59-C61 PolarHBondContact O-N 3.3Å; C61-C70 HydrophobicContact CB-CB 4.28Å; C61-C70 WeakPolarHBondContact CB-SG 3.43Å; C61-C70 WeakPolarHBondContact SG-CB 3.26Å; C61-C70 CovalentContact SG-SG 2.03Å; C61-C70 PolarHBondContact SG-SG 3.43Å; C61-S73 PolarHBondContact SG-OG 3.27Å |
| 62 | W | 52.5 | Low | 61.4 | Low | 238 Ų | 238 | 95.5 Ų | 95.5 | 90% | 0.902 | 51% | 0.506 | S | S | * | . | trans | -96.8 | -2.5 | -170.5 | -164.2 | 0.7 | 0 | 0 | 0 | 111.5 | S60 | S60-W62 PolarHBondContact O-N 3.16Š| ||
| 63 | G | 55.8 | Low | 59.6 | Low | 33 Ų | 33 | 96.8 Ų | 96.8 | 34% | 0.34 | 51% | 0.513 | S | S | . | . | S | Bend | trans | -136.2 | 163.3 | 172 | 0 | 0 | 0 | 0 | 0 | 110.3 | C65 | G63-C65 PolarHBondContact O-N 2.81Š|
| 64 | N | 54.5 | Low | 58 | Low | 116 Ų | 116 | 103.2 Ų | 103.2 | 62% | 0.62 | 54% | 0.535 | S | S | * | . | trans | -67.5 | 84.1 | 173.3 | -145.4 | 7.1 | 0 | 0 | 0 | 107.8 | W22 F66 | W22-N64 HydrophobicContact CZ3-CB 4.25Å; W22-N64 WeakPolarHBondContact CZ3-ND2 3.49Å; N64-F66 PolarHBondContact O-N 3.34Å | ||
| 65 | C | 60.4 | Low | 56.6 | Low | 15 Ų | 15 | 105.8 Ų | 105.8 | 10% | 0.101 | 55% | 0.549 | C | S | . | . | trans | -59.5 | 120.5 | -176.9 | 174.6 | 0 | 0 | 0 | 0 | 108 | C58 G63 L67 Y68 | C58-C65 VanDerWaalsContact CA-SG 3.59Å; C58-C65 HydrophobicContact CB-CB 4Å; C58-C65 WeakPolarHBondContact CB-SG 3.49Å; C58-C65 WeakPolarHBondContact SG-CB 3.3Å; C58-C65 CovalentContact SG-SG 2.03Å; C58-C65 PolarHBondContact SG-SG 3Å; G63-C65 PolarHBondContact O-N 2.81Å; C65-L67 VanDerWaalsContact C-N 3.28Å; C65-L67 PolarHBondContact O-N 2.88Å; C65-Y68 WeakPolarHBondContact CB-O 3.01Å | ||
| 66 | F | 57.7 | Low | 55 | Low | 63 Ų | 63 | 104.6 Ų | 104.6 | 28% | 0.276 | 56% | 0.555 | S | S | . | * | S | Bend | trans | -62.9 | -38.6 | -173.7 | -134 | -134.7 | 0 | 0 | 0 | 111.1 | H25 S26 M29 N64 | H25-F66 HydrophobicContact CB-CZ 4.12Å; H25-F66 AromaticContact CD2-CZ 3.76Å; H25-F66 WeakPolarHBondContact O-CE1 3.17Å; H25-F66 WeakPolarHBondContact O-CZ 3.15Å; S26-F66 VanDerWaalsContact CA-CZ 3.4Å; S26-F66 VanDerWaalsContact CB-CD2 3.48Å; S26-F66 WeakPolarHBondContact CB-O 3.32Å; S26-F66 WeakPolarHBondContact O-CD1 3.37Å; S26-F66 WeakPolarHBondContact O-CE1 3.48Å; S26-F66 VanDerWaalsContact OG-CB 3.25Å; S26-F66 WeakPolarHBondContact OG-CB 3.39Å; S26-F66 WeakPolarHBondContact OG-CD1 2.89Å; S26-F66 WeakPolarHBondContact OG-CE1 3.49Å; S26-F66 WeakPolarHBondContact OG-CG 3.42Å; S26-F66 PolarHBondContact OG-O 2.91Å; M29-F66 HydrophobicContact CB-CD1 4.27Å; M29-F66 HydrophobicContact CB-CE1 3.44Å; M29-F66 VanDerWaalsContact CB-CE1 3.44Å; M29-F66 HydrophobicContact CB-CZ 4.01Å; M29-F66 HydrophobicContact CG-CE1 3.78Å; M29-F66 HydrophobicContact CG-CZ 3.8Å; N64-F66 PolarHBondContact O-N 3.34Å |
| 67 | L | 52 | Low | 53.6 | Low | 118 Ų | 118 | 107.2 Ų | 107.2 | 62% | 0.618 | 56% | 0.564 | S | S | * | * | S | Bend | trans | -94.5 | -18.2 | -170.5 | -74.1 | 168 | 0 | 0 | 0 | 115.6 | C65 | C65-L67 VanDerWaalsContact C-N 3.28Å; C65-L67 PolarHBondContact O-N 2.88Å |
| 68 | Y | 47.2 | Very low | 52.4 | Low | 187 Ų | 187 | 108.2 Ų | 108.2 | 73% | 0.733 | 58% | 0.579 | S | S | * | * | trans | -140.6 | 123.6 | -176.8 | -119 | -94.8 | 0 | 0 | 0 | 110.4 | C65 C70 | C65-Y68 WeakPolarHBondContact CB-O 3.01Å; Y68-C70 PolarHBondContact O-N 2.03Å; Y68-C70 VanDerWaalsContact O-N 3.09Å | ||
| 69 | H | 51.3 | Low | 51 | Low | 157 Ų | 157 | 111 Ų | 111 | 73% | 0.727 | 61% | 0.605 | S | S | * | * | trans | -69.3 | 107.6 | 167.4 | -170.9 | -88.4 | 0 | 0 | 0 | 107.5 | T71 | H69-T71 PolarHBondContact ND1-OG1 2.96Å; H69-T71 PolarHBondContact O-N 3.09Å; H69-T71 PolarHBondContact O-OG1 2.77Å | ||
| 70 | C | 54.3 | Low | 49.9 | Very low | 56 Ų | 56 | 110.6 Ų | 110.6 | 38% | 0.378 | 61% | 0.61 | S | S | . | * | trans | -79.6 | 88.6 | -177.5 | -150.2 | 0 | 0 | 0 | 0 | 107.8 | C61 Y68 G72 | C61-C70 HydrophobicContact CB-CB 4.28Å; C61-C70 WeakPolarHBondContact CB-SG 3.43Å; C61-C70 WeakPolarHBondContact SG-CB 3.26Å; C61-C70 CovalentContact SG-SG 2.03Å; C61-C70 PolarHBondContact SG-SG 3.43Å; Y68-C70 PolarHBondContact O-N 2.03Å; Y68-C70 VanDerWaalsContact O-N 3.09Å; C70-G72 PolarHBondContact O-N 3.32Å | ||
| 71 | T | 51.2 | Low | 48.7 | Very low | 130 Ų | 130 | 114.4 Ų | 114.4 | 80% | 0.798 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.7 | 54.3 | -179.1 | -33.6 | 0 | 0 | 0 | 0 | 110.4 | H69 | H69-T71 PolarHBondContact ND1-OG1 2.96Å; H69-T71 PolarHBondContact O-N 3.09Å; H69-T71 PolarHBondContact O-OG1 2.77Å |
| 72 | G | 54.4 | Low | 47.8 | Very low | 69 Ų | 69 | 117.9 Ų | 117.9 | 71% | 0.711 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -167.1 | 19.5 | -164.5 | 0 | 0 | 0 | 0 | 0 | 118.9 | C70 | C70-G72 PolarHBondContact O-N 3.32Š|
| 73 | S | 42.9 | Very low | 47.4 | Very low | 74 Ų | 74 | 111.2 Ų | 111.2 | 52% | 0.517 | 64% | 0.637 | S | S | . | * | trans | -140.7 | 117.8 | 168 | 48.4 | 0 | 0 | 0 | 0 | 111.2 | C61 L75 | C61-S73 PolarHBondContact SG-OG 3.27Å; S73-L75 PolarHBondContact O-N 3.24Å | ||
| 74 | Q | 40.4 | Very low | 47 | Very low | 180 Ų | 180 | 116.7 Ų | 116.7 | 84% | 0.841 | 66% | 0.656 | S | S | * | * | trans | -50.9 | 123.2 | 165 | -75.5 | -133.9 | -88.8 | 0 | 0 | 109.9 | ||||
| 75 | L | 42.1 | Very low | 46.6 | Very low | 131 Ų | 131 | 118.4 Ų | 118.4 | 69% | 0.686 | 67% | 0.671 | S | S | * | * | trans | -41.1 | 126.2 | 144.1 | -171.4 | 76.4 | 0 | 0 | 0 | 108.2 | S73 E77 | S73-L75 PolarHBondContact O-N 3.24Å; L75-E77 PolarHBondContact O-N 3.43Å | ||
| 76 | P | 38.6 | Very low | 46.1 | Very low | 113 Ų | 113 | 120.6 Ų | 120.6 | 73% | 0.734 | 70% | 0.696 | S | S | * | * | trans | -63.2 | 100.6 | 151.7 | 26.3 | -27 | 0 | 0 | 0 | 105.5 | S78 | P76-S78 PolarHBondContact O-N 3.35Š| ||
| 77 | E | 44 | Very low | 45.1 | Very low | 162 Ų | 162 | 127.9 Ų | 127.9 | 76% | 0.757 | 75% | 0.746 | S | S | * | * | trans | -59.3 | 68.5 | 170.1 | -171.9 | 165.6 | 82.6 | 0 | 0 | 109.6 | L75 | L75-E77 PolarHBondContact O-N 3.43Š| ||
| 78 | S | 42.4 | Very low | 44.8 | Very low | 112 Ų | 112 | 128.4 Ų | 128.4 | 78% | 0.783 | 75% | 0.753 | S | S | * | * | trans | -149.5 | 42.9 | -178.7 | -152.2 | 0 | 0 | 0 | 0 | 112.4 | P76 | P76-S78 PolarHBondContact O-N 3.35Š| ||
| 79 | A | 39.6 | Very low | 44.6 | Very low | 97 Ų | 97 | 125.3 Ų | 125.3 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -155.9 | 6 | 161.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 80 | H | 42 | Very low | 44.3 | Very low | 177 Ų | 177 | 123.6 Ų | 123.6 | 82% | 0.819 | 76% | 0.755 | S | S | * | * | trans | -131.7 | 85.2 | 171.1 | -118.2 | -69.5 | 0 | 0 | 0 | 109.2 | P82 | H80-P82 VanDerWaalsContact O-CD 3.25Å; H80-P82 WeakPolarHBondContact O-CD 3.27Å | ||
| 81 | D | 38.1 | Very low | 43.7 | Very low | 144 Ų | 144 | 127.5 Ų | 127.5 | 77% | 0.77 | 78% | 0.777 | S | S | * | * | trans | -45 | 118.4 | 167.9 | -145.1 | -61.2 | 0 | 0 | 0 | 110.7 | S83 | D81-S83 PolarHBondContact OD1-N 3.34Š| ||
| 82 | P | 42.3 | Very low | 43.2 | Very low | 104 Ų | 104 | 127.4 Ų | 127.4 | 68% | 0.675 | 78% | 0.776 | S | S | * | * | trans | -111.1 | 65.9 | 165.9 | 36.3 | -19.9 | 0 | 0 | 0 | 107.7 | H80 I84 | H80-P82 VanDerWaalsContact O-CD 3.25Å; H80-P82 WeakPolarHBondContact O-CD 3.27Å; P82-I84 PolarHBondContact O-N 3.01Å | ||
| 83 | S | 43.3 | Very low | 42.5 | Very low | 97 Ų | 97 | 131.3 Ų | 131.3 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | trans | -62.3 | 131.1 | 151.4 | -164.3 | 0 | 0 | 0 | 0 | 106.9 | D81 | D81-S83 PolarHBondContact OD1-N 3.34Š| ||
| 84 | I | 49.2 | Very low | 42.4 | Very low | 148 Ų | 148 | 135.4 Ų | 135.4 | 76% | 0.759 | 80% | 0.799 | S | S | * | * | trans | 94.4 | 64.7 | -178.9 | -43.1 | 173 | 0 | 0 | 0 | 114.9 | P82 | P82-I84 PolarHBondContact O-N 3.01Š| ||
| 85 | V | 45.6 | Very low | 42.6 | Very low | 153 Ų | 153 | 131.9 Ų | 131.9 | 93% | 0.927 | 80% | 0.796 | S | S | * | * | -118.8 | 98.3 | 128.7 | 174.4 | 0 | 0 | 0 | 0 | 106.2 | |||||
| 86 | G | 49.1 | Very low | 42.6 | Very low | 61 Ų | 61 | 132 Ų | 132 | 63% | 0.629 | 81% | 0.805 | S | S | * | * | trans | -173.5 | 64 | -175.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 87 | T | 37.6 | Very low | 43 | Very low | 216 Ų | 216 | 133.7 Ų | 133.7 | 100% | 1.325 | 81% | 0.811 | S | S | * | * | trans | 174.4 | 0 | 150.8 | 37.9 | 0 | 0 | 0 | 0 | 108.8 |
Retrieved 87 of 87 residues in 14.6 ms
(Link to these results)