| 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 | 60 | Low | 56.6 | Low | 216 Ų | 216 | 118.5 Ų | 118.5 | 100% | 1.064 | 58% | 0.583 | S | S | * | * | 0 | 78.5 | 0 | -68.2 | -58.7 | -171.7 | 0 | 0 | 110.2 | |||||
| 2 | Y | 57.2 | Low | 56.5 | Low | 187 Ų | 187 | 120.6 Ų | 120.6 | 73% | 0.733 | 60% | 0.597 | S | S | * | * | trans | -175.5 | 33.2 | 157.1 | -76.5 | -62.8 | 0 | 0 | 0 | 108 | L4 Q5 | Y2-L4 PolarHBondContact O-N 3.08Å; Y2-Q5 PolarHBondContact O-N 3.18Å; Y2-Q5 VanDerWaalsContact O-N 3.08Å | ||
| 3 | C | 58.1 | Low | 56.7 | Low | 40 Ų | 40 | 116.3 Ų | 116.3 | 27% | 0.27 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -55.5 | -38.6 | -175.5 | -83.6 | 0 | 0 | 0 | 0 | 111.7 | C46 | C3-C46 HydrophobicContact CB-CB 3.82Å; C3-C46 WeakPolarHBondContact CB-SG 3.44Å; C3-C46 WeakPolarHBondContact SG-CB 3.37Å; C3-C46 CovalentContact SG-SG 2.06Å; C3-C46 PolarHBondContact SG-SG 2.8Å |
| 4 | L | 55.2 | Low | 55.8 | Low | 151 Ų | 151 | 115.9 Ų | 115.9 | 79% | 0.791 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -67.4 | -32.3 | 179.4 | -82.9 | 110.3 | 0 | 0 | 0 | 113.7 | Y2 W6 L7 L8 | Y2-L4 PolarHBondContact O-N 3.08Å; L4-W6 PolarHBondContact O-N 3.17Å; L4-L7 PolarHBondContact O-N 3.28Å; L4-L7 VanDerWaalsContact O-N 3.17Å; L4-L8 PolarHBondContact O-N 3.31Å |
| 5 | Q | 56.7 | Low | 55.2 | Low | 129 Ų | 129 | 119.1 Ų | 119.1 | 60% | 0.603 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -64.7 | -31.2 | -177.4 | -161.9 | 77.2 | 22.7 | 0 | 0 | 111.8 | Y2 | Y2-Q5 PolarHBondContact O-N 3.18Å; Y2-Q5 VanDerWaalsContact O-N 3.08Å |
| 6 | W | 55.6 | Low | 54.5 | Low | 141 Ų | 141 | 115.9 Ų | 115.9 | 53% | 0.534 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -88.3 | -14 | 179 | -73.8 | 112.7 | 0 | 0 | 0 | 113.5 | L4 P9 F36 R40 | L4-W6 PolarHBondContact O-N 3.17Å; W6-P9 WeakPolarHBondContact O-CD 2.97Å; W6-F36 HydrophobicContact CB-CE1 4.5Å; W6-F36 HydrophobicContact CB-CZ 4.4Å; W6-F36 WeakPolarHBondContact O-CZ 3.32Å; W6-R40 VanDerWaalsContact CB-NH1 3.34Å; W6-R40 VanDerWaalsContact CG-NH1 3.29Å; W6-R40 VanDerWaalsContact CZ3-NH1 3.32Å |
| 7 | L | 53.8 | Low | 54.4 | Low | 83 Ų | 83 | 119.8 Ų | 119.8 | 44% | 0.435 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -84.6 | -23.4 | 174.7 | -141.8 | 95.8 | 0 | 0 | 0 | 112 | L4 P9 V10 L11 | L4-L7 PolarHBondContact O-N 3.28Å; L4-L7 VanDerWaalsContact O-N 3.17Å; L7-P9 VanDerWaalsContact C-CD 3.48Å; L7-V10 PolarHBondContact O-N 2.06Å; L7-L11 PolarHBondContact O-N 2.81Å |
| 8 | L | 60.6 | Low | 53.9 | Low | 106 Ų | 106 | 119.5 Ų | 119.5 | 56% | 0.555 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -55.5 | -42.5 | 179.3 | -145.2 | 78.9 | 0 | 0 | 0 | 114.2 | L4 V10 L11 L12 | L4-L8 PolarHBondContact O-N 3.31Å; L8-V10 VanDerWaalsContact C-N 3.29Å; L8-V10 PolarHBondContact O-N 3.5Å; L8-L11 PolarHBondContact O-N 3.41Å; L8-L12 PolarHBondContact O-N 3.49Å |
| 9 | P | 55.8 | Low | 53.9 | Low | 77 Ų | 77 | 117.8 Ų | 117.8 | 50% | 0.5 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -69.3 | -25.2 | 178.9 | -19.1 | 33.4 | 0 | 0 | 0 | 113.7 | W6 L7 | W6-P9 WeakPolarHBondContact O-CD 2.97Å; L7-P9 VanDerWaalsContact C-CD 3.48Å |
| 10 | V | 56.8 | Low | 53.8 | Low | 27 Ų | 27 | 116.5 Ų | 116.5 | 16% | 0.164 | 61% | 0.613 | C | S | . | * | H | α-helix | trans | -78.7 | -33.7 | 176.8 | -175.7 | 0 | 0 | 0 | 0 | 110.5 | L7 L8 L12 I13 Y32 L33 F36 | L7-V10 PolarHBondContact O-N 2.06Å; L8-V10 VanDerWaalsContact C-N 3.29Å; L8-V10 PolarHBondContact O-N 3.5Å; V10-L12 VanDerWaalsContact C-N 3.27Å; V10-L12 PolarHBondContact O-N 3.46Å; V10-I13 HydrophobicContact CG1-CD1 4.48Å; V10-Y32 HydrophobicContact CG1-CD1 4.37Å; V10-Y32 HydrophobicContact CG1-CE1 4.13Å; V10-Y32 HydrophobicContact CG2-CE1 4.06Å; V10-L33 HydrophobicContact CG1-CD2 3.98Å; V10-F36 HydrophobicContact CG2-CE2 4.21Å; V10-F36 HydrophobicContact CG2-CZ 4.18Å |
| 11 | L | 53.1 | Low | 53.9 | Low | 147 Ų | 147 | 116 Ų | 116 | 77% | 0.77 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -72 | -20.7 | 174.5 | -160.1 | 70.3 | 0 | 0 | 0 | 112.9 | L7 L8 | L7-L11 PolarHBondContact O-N 2.81Å; L8-L11 PolarHBondContact O-N 3.41Å |
| 12 | L | 54.8 | Low | 53.7 | Low | 143 Ų | 143 | 110.8 Ų | 110.8 | 75% | 0.749 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | 3 | 179.8 | -139.2 | 78.7 | 0 | 0 | 0 | 113.9 | L8 V10 P14 | L8-L12 PolarHBondContact O-N 3.49Å; V10-L12 VanDerWaalsContact C-N 3.27Å; V10-L12 PolarHBondContact O-N 3.46Å; L12-P14 VanDerWaalsContact O-CD 3.29Å; L12-P14 WeakPolarHBondContact O-CD 3.39Å; L12-P14 VanDerWaalsContact O-N 3.17Å |
| 13 | I | 59.6 | Low | 53.8 | Low | 65 Ų | 65 | 108.5 Ų | 108.5 | 33% | 0.333 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -67.4 | 115.1 | 175.4 | -64.2 | 167.9 | 0 | 0 | 0 | 107.8 | V10 K15 M29 Y32 | V10-I13 HydrophobicContact CG1-CD1 4.48Å; I13-K15 PolarHBondContact O-N 3.21Å; I13-M29 HydrophobicContact CB-CE 4.25Å; I13-M29 HydrophobicContact CD1-CE 4.32Å; I13-M29 HydrophobicContact CD1-SD 4.31Å; I13-M29 HydrophobicContact CG2-CE 3.58Å; I13-Y32 HydrophobicContact CD1-CE1 4.02Å |
| 14 | P | 44 | Very low | 53.8 | Low | 111 Ų | 111 | 111.7 Ų | 111.7 | 72% | 0.721 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 135.8 | -172.6 | 25.6 | -32.6 | 0 | 0 | 0 | 110.1 | L12 | L12-P14 VanDerWaalsContact O-CD 3.29Å; L12-P14 WeakPolarHBondContact O-CD 3.39Å; L12-P14 VanDerWaalsContact O-N 3.17Å |
| 15 | K | 46.7 | Very low | 54.4 | Low | 164 Ų | 164 | 107 Ų | 107 | 71% | 0.713 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 123.3 | -176.9 | -173.6 | 164.6 | 175.5 | 72.8 | 0 | 110.2 | I13 L17 | I13-K15 PolarHBondContact O-N 3.21Å; K15-L17 PolarHBondContact O-N 3.32Å |
| 16 | P | 44.9 | Very low | 54.8 | Low | 67 Ų | 67 | 101.1 Ų | 101.1 | 44% | 0.435 | 54% | 0.535 | S | S | . | . | P | Polyproline II helix | trans | -67.5 | 131.2 | 176.5 | 26.2 | -32.5 | 0 | 0 | 0 | 110.1 | N18 | P16-N18 PolarHBondContact O-N 3.19Å; P16-N18 VanDerWaalsContact O-N 3.14Å |
| 17 | L | 51.6 | Low | 55.2 | Low | 183 Ų | 183 | 98.1 Ų | 98.1 | 96% | 0.958 | 53% | 0.528 | S | S | * | . | S | Bend | trans | -70.3 | 4.4 | -177.5 | -78.7 | 148.6 | 0 | 0 | 0 | 114.5 | K15 | K15-L17 PolarHBondContact O-N 3.32Š|
| 18 | N | 46 | Very low | 56 | Low | 114 Ų | 114 | 100.7 Ų | 100.7 | 61% | 0.61 | 54% | 0.535 | S | S | * | . | trans | -127.1 | 115.3 | -167.7 | -160.8 | -4.7 | 0 | 0 | 0 | 114.1 | P16 A20 | P16-N18 PolarHBondContact O-N 3.19Å; P16-N18 VanDerWaalsContact O-N 3.14Å; N18-A20 PolarHBondContact O-N 3.4Å | ||
| 19 | P | 53.7 | Low | 56.5 | Low | 87 Ų | 87 | 97.4 Ų | 97.4 | 57% | 0.565 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.7 | 16 | -173.6 | 34.4 | -36.8 | 0 | 0 | 0 | 116.6 | W22 | P19-W22 HydrophobicContact CB-CZ2 4.09Å; P19-W22 PolarHBondContact O-NE1 3.43Å |
| 20 | A | 52.7 | Low | 57.3 | Low | 91 Ų | 91 | 95 Ų | 95 | 75% | 0.752 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95 | -13.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | N18 | N18-A20 PolarHBondContact O-N 3.4Š|
| 21 | L | 54.9 | Low | 57.9 | Low | 108 Ų | 108 | 99.8 Ų | 99.8 | 57% | 0.565 | 53% | 0.526 | S | S | * | . | trans | -115.2 | 24.1 | -170.6 | -158.4 | 69.3 | 0 | 0 | 0 | 112.5 | F23 N24 H25 | L21-F23 PolarHBondContact O-N 3.32Å; L21-N24 HydrophobicContact CD1-CB 4.05Å; L21-N24 HydrophobicContact CG-CB 4.11Å; L21-N24 PolarHBondContact O-N 3.47Å; L21-H25 WeakPolarHBondContact O-CB 3.19Å; L21-H25 PolarHBondContact O-N 3.19Å | ||
| 22 | W | 55.3 | Low | 58.7 | Low | 106 Ų | 106 | 97.5 Ų | 97.5 | 40% | 0.402 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.6 | -37.4 | -172.2 | -68 | 94 | 0 | 0 | 0 | 114.2 | P19 H25 S26 | P19-W22 HydrophobicContact CB-CZ2 4.09Å; P19-W22 PolarHBondContact O-NE1 3.43Å; W22-H25 CarbonylContact O-C 3.56Å; W22-S26 WeakPolarHBondContact O-CA 3.15Å; W22-S26 WeakPolarHBondContact O-CB 3.49Å; W22-S26 PolarHBondContact O-N 3.02Å |
| 23 | F | 59.3 | Low | 59.5 | Low | 138 Ų | 138 | 92.5 Ų | 92.5 | 61% | 0.605 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -74.5 | -38.1 | -177 | -169.4 | -94.2 | 0 | 0 | 0 | 112.7 | L21 S26 M27 | L21-F23 PolarHBondContact O-N 3.32Å; F23-S26 WeakPolarHBondContact CA-OG 3.34Å; F23-S26 WeakPolarHBondContact O-CA 3.25Å; F23-S26 WeakPolarHBondContact O-CB 3.32Å; F23-S26 PolarHBondContact O-N 3.44Å; F23-S26 VanDerWaalsContact O-N 3.11Å; F23-S26 PolarHBondContact O-OG 3.17Å; F23-M27 HydrophobicContact CE1-CE 4.19Å; F23-M27 HydrophobicContact CE1-CG 4.33Å; F23-M27 HydrophobicContact CE2-CE 4.13Å; F23-M27 HydrophobicContact CZ-CE 3.66Å; F23-M27 PolarHBondContact O-N 2.94Å |
| 24 | N | 59.5 | Low | 60 | Low | 108 Ų | 108 | 93.7 Ų | 93.7 | 58% | 0.578 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -73 | -38.1 | 173.9 | -73.3 | -60.6 | 0 | 0 | 0 | 111.1 | L21 S26 F28 | L21-N24 HydrophobicContact CD1-CB 4.05Å; L21-N24 HydrophobicContact CG-CB 4.11Å; L21-N24 PolarHBondContact O-N 3.47Å; N24-S26 PolarHBondContact O-N 3.5Å; N24-F28 VanDerWaalsContact O-CB 3.24Å; N24-F28 WeakPolarHBondContact O-CB 3.2Å; N24-F28 PolarHBondContact O-N 2.95Å |
| 25 | H | 66 | Low | 61.2 | Low | 51 Ų | 51 | 91 Ų | 91 | 24% | 0.236 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -59.9 | -34.1 | 167.4 | -157.9 | 65.3 | 0 | 0 | 0 | 110.1 | L21 W22 F28 M29 F66 | L21-H25 WeakPolarHBondContact O-CB 3.19Å; L21-H25 PolarHBondContact O-N 3.19Å; W22-H25 CarbonylContact O-C 3.56Å; H25-F28 PolarHBondContact O-N 3.06Å; H25-M29 WeakPolarHBondContact NE2-CE 3.29Å; H25-M29 PolarHBondContact O-N 2.88Å; H25-F66 VanDerWaalsContact C-CE2 3.49Å; H25-F66 HydrophobicContact CB-CE2 4.4Å; H25-F66 AromaticContact CD2-CE2 3.93Å; H25-F66 WeakPolarHBondContact O-CZ 3.4Å |
| 26 | S | 67 | Low | 62.1 | Low | 7 Ų | 7 | 85.2 Ų | 85.2 | 5% | 0.049 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -57.6 | -57 | 177.1 | 93.2 | 0 | 0 | 0 | 0 | 116.3 | W22 F23 N24 F28 G30 F66 | W22-S26 WeakPolarHBondContact O-CA 3.15Å; W22-S26 WeakPolarHBondContact O-CB 3.49Å; W22-S26 PolarHBondContact O-N 3.02Å; F23-S26 WeakPolarHBondContact CA-OG 3.34Å; F23-S26 WeakPolarHBondContact O-CA 3.25Å; F23-S26 WeakPolarHBondContact O-CB 3.32Å; F23-S26 PolarHBondContact O-N 3.44Å; F23-S26 VanDerWaalsContact O-N 3.11Å; F23-S26 PolarHBondContact O-OG 3.17Å; N24-S26 PolarHBondContact O-N 3.5Å; S26-F28 VanDerWaalsContact C-N 3.27Å; S26-F28 PolarHBondContact O-N 3.05Å; S26-G30 PolarHBondContact O-N 3.41Å; S26-G30 VanDerWaalsContact O-N 3.14Å; S26-F66 VanDerWaalsContact CA-CD1 3.41Å; S26-F66 VanDerWaalsContact CA-CD2 3.44Å; S26-F66 WeakPolarHBondContact CB-O 2.97Å; S26-F66 WeakPolarHBondContact O-CD1 3.47Å; S26-F66 WeakPolarHBondContact O-CE1 3.43Å; S26-F66 PolarHBondContact OG-O 3.3Å |
| 27 | M | 63.3 | Low | 63.1 | Low | 78 Ų | 78 | 84.9 Ų | 84.9 | 38% | 0.384 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.1 | -41.1 | 173.4 | -65.1 | -62.6 | 163.7 | 0 | 0 | 110.1 | F23 G30 F31 | F23-M27 HydrophobicContact CE1-CE 4.19Å; F23-M27 HydrophobicContact CE1-CG 4.33Å; F23-M27 HydrophobicContact CE2-CE 4.13Å; F23-M27 HydrophobicContact CZ-CE 3.66Å; F23-M27 PolarHBondContact O-N 2.94Å; M27-G30 PolarHBondContact O-N 3Å; M27-F31 HydrophobicContact CB-CD2 4.16Å; M27-F31 HydrophobicContact CB-CE2 3.99Å; M27-F31 WeakPolarHBondContact O-CB 3.47Å; M27-F31 WeakPolarHBondContact O-CD2 3.33Å; M27-F31 WeakPolarHBondContact O-CG 3.47Å; M27-F31 PolarHBondContact O-N 3.22Å; M27-F31 HydrophobicContact SD-CE2 4.39Å |
| 28 | F | 69.9 | Low | 63.9 | Low | 137 Ų | 137 | 82.3 Ų | 82.3 | 60% | 0.601 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -63 | -50.4 | -177.4 | -169.7 | -98.5 | 0 | 0 | 0 | 114.2 | N24 H25 S26 G30 F31 Y32 | N24-F28 VanDerWaalsContact O-CB 3.24Å; N24-F28 WeakPolarHBondContact O-CB 3.2Å; N24-F28 PolarHBondContact O-N 2.95Å; H25-F28 PolarHBondContact O-N 3.06Å; S26-F28 VanDerWaalsContact C-N 3.27Å; S26-F28 PolarHBondContact O-N 3.05Å; F28-G30 VanDerWaalsContact C-N 3.32Å; F28-G30 PolarHBondContact O-N 3.35Å; F28-F31 PolarHBondContact O-N 3.32Å; F28-Y32 VanDerWaalsContact O-CB 3.3Å; F28-Y32 WeakPolarHBondContact O-CB 3.36Å; F28-Y32 PolarHBondContact O-N 3.45Å |
| 29 | M | 71.1 | Confident | 64.7 | Low | 36 Ų | 36 | 84.9 Ų | 84.9 | 18% | 0.177 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -72.4 | -28.5 | 178 | -56.6 | -85.2 | -158.9 | 0 | 0 | 112.1 | I13 H25 Y32 L33 F66 | I13-M29 HydrophobicContact CB-CE 4.25Å; I13-M29 HydrophobicContact CD1-CE 4.32Å; I13-M29 HydrophobicContact CD1-SD 4.31Å; I13-M29 HydrophobicContact CG2-CE 3.58Å; H25-M29 WeakPolarHBondContact NE2-CE 3.29Å; H25-M29 PolarHBondContact O-N 2.88Å; M29-Y32 PolarHBondContact O-N 3.38Å; M29-L33 WeakPolarHBondContact O-CB 3.5Å; M29-L33 WeakPolarHBondContact O-CD1 3.44Å; M29-L33 VanDerWaalsContact O-CG 3.22Å; M29-L33 WeakPolarHBondContact O-CG 3.19Å; M29-L33 PolarHBondContact O-N 3.27Å; M29-F66 HydrophobicContact CB-CE1 3.5Å; M29-F66 VanDerWaalsContact CB-CE1 3.5Å; M29-F66 HydrophobicContact CB-CZ 3.41Å; M29-F66 VanDerWaalsContact CB-CZ 3.41Å; M29-F66 HydrophobicContact CG-CE1 4.27Å; M29-F66 HydrophobicContact CG-CZ 3.65Å |
| 30 | G | 72.6 | Confident | 65.3 | Low | 27 Ų | 27 | 85.6 Ų | 85.6 | 28% | 0.278 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -63.3 | -48.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | S26 M27 F28 L33 L34 | S26-G30 PolarHBondContact O-N 3.41Å; S26-G30 VanDerWaalsContact O-N 3.14Å; M27-G30 PolarHBondContact O-N 3Å; F28-G30 VanDerWaalsContact C-N 3.32Å; F28-G30 PolarHBondContact O-N 3.35Å; G30-L33 PolarHBondContact O-N 2.81Å; G30-L34 WeakPolarHBondContact O-CB 3.35Å; G30-L34 PolarHBondContact O-N 3.41Å |
| 31 | F | 69.4 | Low | 65.7 | Low | 128 Ų | 128 | 90 Ų | 90 | 56% | 0.561 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64.8 | -38.1 | 173.8 | -74.1 | -60.1 | 0 | 0 | 0 | 112.1 | M27 F28 L33 L34 S35 | M27-F31 HydrophobicContact CB-CD2 4.16Å; M27-F31 HydrophobicContact CB-CE2 3.99Å; M27-F31 WeakPolarHBondContact O-CB 3.47Å; M27-F31 WeakPolarHBondContact O-CD2 3.33Å; M27-F31 WeakPolarHBondContact O-CG 3.47Å; M27-F31 PolarHBondContact O-N 3.22Å; M27-F31 HydrophobicContact SD-CE2 4.39Å; F28-F31 PolarHBondContact O-N 3.32Å; F31-L33 PolarHBondContact O-N 2.69Å; F31-L34 PolarHBondContact O-N 3.42Å; F31-S35 WeakPolarHBondContact O-CB 3.37Å; F31-S35 PolarHBondContact O-N 3.01Å; F31-S35 PolarHBondContact O-OG 3.39Å |
| 32 | Y | 70.5 | Confident | 66.2 | Low | 98 Ų | 98 | 86.9 Ų | 86.9 | 38% | 0.384 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.7 | -45.5 | 175.6 | -174.5 | -100.4 | 0 | 0 | 0 | 111.9 | V10 I13 F28 M29 F36 | V10-Y32 HydrophobicContact CG1-CD1 4.37Å; V10-Y32 HydrophobicContact CG1-CE1 4.13Å; V10-Y32 HydrophobicContact CG2-CE1 4.06Å; I13-Y32 HydrophobicContact CD1-CE1 4.02Å; F28-Y32 VanDerWaalsContact O-CB 3.3Å; F28-Y32 WeakPolarHBondContact O-CB 3.36Å; F28-Y32 PolarHBondContact O-N 3.45Å; M29-Y32 PolarHBondContact O-N 3.38Å; Y32-F36 WeakPolarHBondContact O-CB 3.21Å; Y32-F36 PolarHBondContact O-N 3.49Å |
| 33 | L | 70.3 | Confident | 66.7 | Low | 39 Ų | 39 | 85.3 Ų | 85.3 | 20% | 0.204 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 174.1 | -74.5 | 162.5 | 0 | 0 | 0 | 111.3 | V10 M29 G30 F31 F36 L37 F50 | V10-L33 HydrophobicContact CG1-CD2 3.98Å; M29-L33 WeakPolarHBondContact O-CB 3.5Å; M29-L33 WeakPolarHBondContact O-CD1 3.44Å; M29-L33 VanDerWaalsContact O-CG 3.22Å; M29-L33 WeakPolarHBondContact O-CG 3.19Å; M29-L33 PolarHBondContact O-N 3.27Å; G30-L33 PolarHBondContact O-N 2.81Å; F31-L33 PolarHBondContact O-N 2.69Å; L33-F36 WeakPolarHBondContact O-CB 3.44Å; L33-F36 PolarHBondContact O-N 2.96Å; L33-L37 WeakPolarHBondContact O-CG 3.34Å; L33-L37 PolarHBondContact O-N 2.9Å; L33-F50 HydrophobicContact CB-CE1 4.36Å; L33-F50 HydrophobicContact CD1-CE1 4.04Å; L33-F50 HydrophobicContact CD1-CZ 3.6Å; L33-F50 HydrophobicContact CD2-CE1 3.88Å; L33-F50 HydrophobicContact CD2-CE2 4.13Å; L33-F50 HydrophobicContact CD2-CZ 3.37Å; L33-F50 HydrophobicContact CG-CE1 4.31Å; L33-F50 HydrophobicContact CG-CZ 4.01Å |
| 34 | L | 70.9 | Confident | 67.2 | Low | 89 Ų | 89 | 84 Ų | 84 | 47% | 0.466 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64.1 | -45.3 | 179.8 | -172.9 | 62 | 0 | 0 | 0 | 112.2 | G30 F31 F36 L37 L38 | G30-L34 WeakPolarHBondContact O-CB 3.35Å; G30-L34 PolarHBondContact O-N 3.41Å; F31-L34 PolarHBondContact O-N 3.42Å; L34-F36 VanDerWaalsContact C-N 3.27Å; L34-F36 PolarHBondContact O-N 3.47Å; L34-L37 HydrophobicContact CD1-CD1 4.5Å; L34-L37 WeakPolarHBondContact O-CB 3.38Å; L34-L37 PolarHBondContact O-N 3.48Å; L34-L37 VanDerWaalsContact O-N 3.09Å; L34-L38 HydrophobicContact CD1-CD1 4.4Å; L34-L38 HydrophobicContact CG-CD1 3.93Å; L34-L38 WeakPolarHBondContact O-CD1 3.44Å; L34-L38 PolarHBondContact O-N 3.39Å |
| 35 | S | 69.4 | Low | 67.8 | Low | 55 Ų | 55 | 84.8 Ų | 84.8 | 39% | 0.385 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.3 | -40.5 | 174.1 | -64.8 | 0 | 0 | 0 | 0 | 111.1 | F31 L37 L38 E39 | F31-S35 WeakPolarHBondContact O-CB 3.37Å; F31-S35 PolarHBondContact O-N 3.01Å; F31-S35 PolarHBondContact O-OG 3.39Å; S35-L37 VanDerWaalsContact C-N 3.3Å; S35-L37 PolarHBondContact O-N 2.79Å; S35-L38 PolarHBondContact O-N 3.45Å; S35-L38 VanDerWaalsContact O-N 3.16Å; S35-E39 WeakPolarHBondContact O-CB 3.4Å; S35-E39 PolarHBondContact O-N 2.85Å |
| 36 | F | 66 | Low | 68 | Low | 42 Ų | 42 | 84.4 Ų | 84.4 | 18% | 0.184 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -62.3 | -36.3 | 175 | -157.8 | -97.5 | 0 | 0 | 0 | 113 | W6 V10 Y32 L33 L34 R40 | W6-F36 HydrophobicContact CB-CE1 4.5Å; W6-F36 HydrophobicContact CB-CZ 4.4Å; W6-F36 WeakPolarHBondContact O-CZ 3.32Å; V10-F36 HydrophobicContact CG2-CE2 4.21Å; V10-F36 HydrophobicContact CG2-CZ 4.18Å; Y32-F36 WeakPolarHBondContact O-CB 3.21Å; Y32-F36 PolarHBondContact O-N 3.49Å; L33-F36 WeakPolarHBondContact O-CB 3.44Å; L33-F36 PolarHBondContact O-N 2.96Å; L34-F36 VanDerWaalsContact C-N 3.27Å; L34-F36 PolarHBondContact O-N 3.47Å; F36-R40 WeakPolarHBondContact O-CB 3.38Å; F36-R40 PolarHBondContact O-N 3.36Å |
| 37 | L | 65.5 | Low | 68.2 | Low | 60 Ų | 60 | 85.5 Ų | 85.5 | 31% | 0.314 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -67.7 | -40.5 | 173.8 | -62.9 | 174.2 | 0 | 0 | 0 | 111.6 | L33 L34 S35 K41 P42 A47 | L33-L37 WeakPolarHBondContact O-CG 3.34Å; L33-L37 PolarHBondContact O-N 2.9Å; L34-L37 HydrophobicContact CD1-CD1 4.5Å; L34-L37 WeakPolarHBondContact O-CB 3.38Å; L34-L37 PolarHBondContact O-N 3.48Å; L34-L37 VanDerWaalsContact O-N 3.09Å; S35-L37 VanDerWaalsContact C-N 3.3Å; S35-L37 PolarHBondContact O-N 2.79Å; L37-K41 PolarHBondContact O-N 2.9Å; L37-P42 HydrophobicContact CD2-CG 3.5Å; L37-P42 WeakPolarHBondContact O-CD 3.48Å; L37-A47 HydrophobicContact CD2-CB 4.37Å |
| 38 | L | 68.6 | Low | 68.7 | Low | 130 Ų | 130 | 87 Ų | 87 | 68% | 0.681 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -71 | -41.1 | -179.9 | -79 | 147.4 | 0 | 0 | 0 | 112.8 | L34 S35 | L34-L38 HydrophobicContact CD1-CD1 4.4Å; L34-L38 HydrophobicContact CG-CD1 3.93Å; L34-L38 WeakPolarHBondContact O-CD1 3.44Å; L34-L38 PolarHBondContact O-N 3.39Å; S35-L38 PolarHBondContact O-N 3.45Å; S35-L38 VanDerWaalsContact O-N 3.16Å |
| 39 | E | 63.2 | Low | 69 | Low | 168 Ų | 168 | 85.1 Ų | 85.1 | 79% | 0.785 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -77 | -35.1 | -177.9 | -107.5 | 161 | 98.9 | 0 | 0 | 113.4 | S35 | S35-E39 WeakPolarHBondContact O-CB 3.4Å; S35-E39 PolarHBondContact O-N 2.85Å |
| 40 | R | 64.8 | Low | 69 | Low | 101 Ų | 101 | 85.8 Ų | 85.8 | 38% | 0.381 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -101.2 | -7.8 | -173.9 | -80.6 | -143.3 | -170.9 | 119.1 | 16.9 | 117.1 | W6 F36 P42 | W6-R40 VanDerWaalsContact CB-NH1 3.34Å; W6-R40 VanDerWaalsContact CG-NH1 3.29Å; W6-R40 VanDerWaalsContact CZ3-NH1 3.32Å; F36-R40 WeakPolarHBondContact O-CB 3.38Å; F36-R40 PolarHBondContact O-N 3.36Å; R40-P42 VanDerWaalsContact C-N 3.35Å |
| 41 | K | 62.6 | Low | 69.1 | Low | 183 Ų | 183 | 89.5 Ų | 89.5 | 80% | 0.796 | 46% | 0.462 | S | S | * | . | trans | 42.8 | 58.5 | -174.8 | -71.3 | 170.4 | 177.9 | 172.7 | 0 | 111.4 | L37 C43 | L37-K41 PolarHBondContact O-N 2.9Å; K41-C43 PolarHBondContact O-N 3.3Å | ||
| 42 | P | 64.9 | Low | 69.5 | Low | 44 Ų | 44 | 85.6 Ų | 85.6 | 29% | 0.286 | 45% | 0.453 | S | S | . | . | trans | -57.5 | 146.2 | 175.6 | 26.2 | -30.9 | 0 | 0 | 0 | 108.7 | L37 R40 T44 | L37-P42 HydrophobicContact CD2-CG 3.5Å; L37-P42 WeakPolarHBondContact O-CD 3.48Å; R40-P42 VanDerWaalsContact C-N 3.35Å; P42-T44 PolarHBondContact O-N 3.39Å | ||
| 43 | C | 65.9 | Low | 69.6 | Low | 72 Ų | 72 | 83 Ų | 83 | 49% | 0.486 | 45% | 0.452 | S | S | . | . | trans | -50.8 | 138.6 | 176.4 | -59.3 | 0 | 0 | 0 | 0 | 109.6 | K41 I45 C46 A47 | K41-C43 PolarHBondContact O-N 3.3Å; C43-I45 PolarHBondContact O-N 2.9Å; C43-C46 WeakPolarHBondContact O-CA 3.22Å; C43-C46 WeakPolarHBondContact O-CB 3.48Å; C43-C46 PolarHBondContact O-N 2.99Å; C43-A47 PolarHBondContact O-N 3.26Å | ||
| 44 | T | 70.5 | Confident | 69.7 | Low | 110 Ų | 110 | 84.9 Ų | 84.9 | 68% | 0.675 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -50.6 | -35.5 | -175.3 | -37.7 | 0 | 0 | 0 | 0 | 112.6 | P42 C46 A47 L48 | P42-T44 PolarHBondContact O-N 3.39Å; T44-C46 PolarHBondContact O-N 3.4Å; T44-A47 PolarHBondContact O-N 2.91Å; T44-L48 HydrophobicContact CG2-CD1 4.47Å; T44-L48 WeakPolarHBondContact O-CB 2.93Å; T44-L48 VanDerWaalsContact O-CG 3.32Å; T44-L48 WeakPolarHBondContact O-CG 3.36Å; T44-L48 PolarHBondContact O-N 3.48Å |
| 45 | I | 72.1 | Confident | 69.7 | Low | 126 Ų | 126 | 87.1 Ų | 87.1 | 65% | 0.646 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -62.1 | -42.6 | 176.7 | -61.6 | 159 | 0 | 0 | 0 | 111.7 | C43 L48 V49 | C43-I45 PolarHBondContact O-N 2.9Å; I45-L48 PolarHBondContact O-N 3.26Å; I45-V49 WeakPolarHBondContact O-CG2 2.89Å; I45-V49 PolarHBondContact O-N 2.98Å |
| 46 | C | 69.3 | Low | 69.7 | Low | 43 Ų | 43 | 89.9 Ų | 89.9 | 29% | 0.291 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -69.1 | -38.4 | -179.9 | -52.5 | 0 | 0 | 0 | 0 | 111.2 | C3 C43 T44 F50 | C3-C46 HydrophobicContact CB-CB 3.82Å; C3-C46 WeakPolarHBondContact CB-SG 3.44Å; C3-C46 WeakPolarHBondContact SG-CB 3.37Å; C3-C46 CovalentContact SG-SG 2.06Å; C3-C46 PolarHBondContact SG-SG 2.8Å; C43-C46 WeakPolarHBondContact O-CA 3.22Å; C43-C46 WeakPolarHBondContact O-CB 3.48Å; C43-C46 PolarHBondContact O-N 2.99Å; T44-C46 PolarHBondContact O-N 3.4Å; C46-F50 WeakPolarHBondContact O-CB 3.04Å; C46-F50 PolarHBondContact O-N 3.09Å; C46-F50 VanDerWaalsContact O-N 3.17Å |
| 47 | A | 71.8 | Confident | 69.7 | Low | 29 Ų | 29 | 92.1 Ų | 92.1 | 24% | 0.24 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -66.1 | -41.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | L37 C43 T44 F50 L51 | L37-A47 HydrophobicContact CD2-CB 4.37Å; C43-A47 PolarHBondContact O-N 3.26Å; T44-A47 PolarHBondContact O-N 2.91Å; A47-F50 PolarHBondContact O-N 3.14Å; A47-L51 WeakPolarHBondContact O-CB 3.13Å; A47-L51 PolarHBondContact O-N 3.04Å |
| 48 | L | 74.5 | Confident | 69.8 | Low | 110 Ų | 110 | 90.8 Ų | 90.8 | 58% | 0.576 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.9 | -43.8 | 177.7 | -76.6 | 173.6 | 0 | 0 | 0 | 112.5 | T44 I45 F50 L51 A52 | T44-L48 HydrophobicContact CG2-CD1 4.47Å; T44-L48 WeakPolarHBondContact O-CB 2.93Å; T44-L48 VanDerWaalsContact O-CG 3.32Å; T44-L48 WeakPolarHBondContact O-CG 3.36Å; T44-L48 PolarHBondContact O-N 3.48Å; I45-L48 PolarHBondContact O-N 3.26Å; L48-F50 VanDerWaalsContact C-N 3.35Å; L48-F50 PolarHBondContact O-N 3.38Å; L48-L51 PolarHBondContact O-N 2.85Å; L48-A52 VanDerWaalsContact O-CB 3.25Å; L48-A52 WeakPolarHBondContact O-CB 3.47Å; L48-A52 PolarHBondContact O-N 3.16Å |
| 49 | V | 75.8 | Confident | 69.5 | Low | 97 Ų | 97 | 93.8 Ų | 93.8 | 59% | 0.588 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.2 | -41.4 | 177.9 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | I45 A52 A53 | I45-V49 WeakPolarHBondContact O-CG2 2.89Å; I45-V49 PolarHBondContact O-N 2.98Å; V49-A52 PolarHBondContact O-N 3.37Å; V49-A53 PolarHBondContact O-N 3.49Å |
| 50 | F | 71.6 | Confident | 69.4 | Low | 50 Ų | 50 | 89 Ų | 89 | 22% | 0.219 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -64.5 | -46 | 177.1 | -178 | -103.5 | 0 | 0 | 0 | 112.3 | L33 C46 A47 L48 A53 L54 | L33-F50 HydrophobicContact CB-CE1 4.36Å; L33-F50 HydrophobicContact CD1-CE1 4.04Å; L33-F50 HydrophobicContact CD1-CZ 3.6Å; L33-F50 HydrophobicContact CD2-CE1 3.88Å; L33-F50 HydrophobicContact CD2-CE2 4.13Å; L33-F50 HydrophobicContact CD2-CZ 3.37Å; L33-F50 HydrophobicContact CG-CE1 4.31Å; L33-F50 HydrophobicContact CG-CZ 4.01Å; C46-F50 WeakPolarHBondContact O-CB 3.04Å; C46-F50 PolarHBondContact O-N 3.09Å; C46-F50 VanDerWaalsContact O-N 3.17Å; A47-F50 PolarHBondContact O-N 3.14Å; L48-F50 VanDerWaalsContact C-N 3.35Å; L48-F50 PolarHBondContact O-N 3.38Å; F50-A53 PolarHBondContact O-N 3.45Å; F50-L54 HydrophobicContact CD1-CD1 3.98Å; F50-L54 HydrophobicContact CE1-CD1 3.37Å; F50-L54 HydrophobicContact CE1-CG 4.09Å; F50-L54 HydrophobicContact CZ-CD1 3.76Å; F50-L54 HydrophobicContact CZ-CD2 4.34Å; F50-L54 HydrophobicContact CZ-CG 4.1Å; F50-L54 PolarHBondContact O-N 3.35Å |
| 51 | L | 73.8 | Confident | 69.1 | Low | 106 Ų | 106 | 86.7 Ų | 86.7 | 56% | 0.555 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -63.2 | -43.1 | 177.3 | -164.2 | 160.1 | 0 | 0 | 0 | 110.9 | A47 L48 A53 L54 F55 | A47-L51 WeakPolarHBondContact O-CB 3.13Å; A47-L51 PolarHBondContact O-N 3.04Å; L48-L51 PolarHBondContact O-N 2.85Å; L51-A53 VanDerWaalsContact C-N 3.34Å; L51-A53 PolarHBondContact O-N 2.75Å; L51-L54 PolarHBondContact O-N 2.01Å; L51-F55 WeakPolarHBondContact O-CB 2.96Å; L51-F55 PolarHBondContact O-N 3Å |
| 52 | A | 77.9 | Confident | 68.5 | Low | 45 Ų | 45 | 89.5 Ų | 89.5 | 37% | 0.372 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.4 | -40.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L48 V49 F55 L56 | L48-A52 VanDerWaalsContact O-CB 3.25Å; L48-A52 WeakPolarHBondContact O-CB 3.47Å; L48-A52 PolarHBondContact O-N 3.16Å; V49-A52 PolarHBondContact O-N 3.37Å; A52-F55 PolarHBondContact O-N 2.93Å; A52-L56 WeakPolarHBondContact O-CB 3.15Å; A52-L56 WeakPolarHBondContact O-CG 3.17Å; A52-L56 PolarHBondContact O-N 3.14Å |
| 53 | A | 72.8 | Confident | 68 | Low | 43 Ų | 43 | 88.8 Ų | 88.8 | 36% | 0.355 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65.3 | -44.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | V49 F50 L51 F55 L56 I57 | V49-A53 PolarHBondContact O-N 3.49Å; F50-A53 PolarHBondContact O-N 3.45Å; L51-A53 VanDerWaalsContact C-N 3.34Å; L51-A53 PolarHBondContact O-N 2.75Å; A53-F55 VanDerWaalsContact C-N 3.31Å; A53-F55 PolarHBondContact O-N 2.02Å; A53-L56 PolarHBondContact O-N 3.41Å; A53-I57 WeakPolarHBondContact O-CB 3.11Å; A53-I57 WeakPolarHBondContact O-CD1 3.13Å; A53-I57 WeakPolarHBondContact O-CG1 3.14Å; A53-I57 PolarHBondContact O-N 3.11Å |
| 54 | L | 71.4 | Confident | 67.4 | Low | 80 Ų | 80 | 91.2 Ų | 91.2 | 42% | 0.419 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.3 | -43.9 | 173.5 | -73 | 178.7 | 0 | 0 | 0 | 111.6 | F50 L51 I57 C58 | F50-L54 HydrophobicContact CD1-CD1 3.98Å; F50-L54 HydrophobicContact CE1-CD1 3.37Å; F50-L54 HydrophobicContact CE1-CG 4.09Å; F50-L54 HydrophobicContact CZ-CD1 3.76Å; F50-L54 HydrophobicContact CZ-CD2 4.34Å; F50-L54 HydrophobicContact CZ-CG 4.1Å; F50-L54 PolarHBondContact O-N 3.35Å; L51-L54 PolarHBondContact O-N 2.01Å; L54-I57 PolarHBondContact O-N 3.35Å; L54-C58 WeakPolarHBondContact O-CB 2.86Å; L54-C58 PolarHBondContact O-N 3.22Å |
| 55 | F | 71.4 | Confident | 66.8 | Low | 136 Ų | 136 | 86.9 Ų | 86.9 | 60% | 0.596 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -65.6 | -44.5 | 179.3 | -145.8 | -87.7 | 0 | 0 | 0 | 111.5 | L51 A52 A53 I57 C58 Y59 | L51-F55 WeakPolarHBondContact O-CB 2.96Å; L51-F55 PolarHBondContact O-N 3Å; A52-F55 PolarHBondContact O-N 2.93Å; A53-F55 VanDerWaalsContact C-N 3.31Å; A53-F55 PolarHBondContact O-N 2.02Å; F55-I57 PolarHBondContact O-N 2.86Å; F55-C58 PolarHBondContact O-N 2.88Å; F55-Y59 HydrophobicContact CE1-CD2 4.3Å; F55-Y59 WeakPolarHBondContact O-CB 3.4Å; F55-Y59 PolarHBondContact O-N 2.71Å |
| 56 | L | 70.2 | Confident | 66 | Low | 112 Ų | 112 | 84 Ų | 84 | 59% | 0.586 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -61.9 | -42.5 | 176.8 | -85 | 160.8 | 0 | 0 | 0 | 112.3 | A52 A53 Y59 S60 | A52-L56 WeakPolarHBondContact O-CB 3.15Å; A52-L56 WeakPolarHBondContact O-CG 3.17Å; A52-L56 PolarHBondContact O-N 3.14Å; A53-L56 PolarHBondContact O-N 3.41Å; L56-Y59 PolarHBondContact O-N 3.42Å; L56-S60 WeakPolarHBondContact O-CB 3.33Å; L56-S60 PolarHBondContact O-N 3.48Å; L56-S60 PolarHBondContact O-OG 2.99Å |
| 57 | I | 65.6 | Low | 65.1 | Low | 89 Ų | 89 | 88 Ų | 88 | 46% | 0.456 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -67.6 | -41.5 | 179.6 | -68.2 | 163.9 | 0 | 0 | 0 | 110.8 | A53 L54 F55 | A53-I57 WeakPolarHBondContact O-CB 3.11Å; A53-I57 WeakPolarHBondContact O-CD1 3.13Å; A53-I57 WeakPolarHBondContact O-CG1 3.14Å; A53-I57 PolarHBondContact O-N 3.11Å; L54-I57 PolarHBondContact O-N 3.35Å; F55-I57 PolarHBondContact O-N 2.86Å |
| 58 | C | 66.6 | Low | 63.8 | Low | 33 Ų | 33 | 95 Ų | 95 | 22% | 0.223 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -69.4 | -39.6 | 174.8 | -79.9 | 0 | 0 | 0 | 0 | 113.2 | L54 F55 C61 C65 | L54-C58 WeakPolarHBondContact O-CB 2.86Å; L54-C58 PolarHBondContact O-N 3.22Å; F55-C58 PolarHBondContact O-N 2.88Å; C58-C61 PolarHBondContact O-N 3.04Å; C58-C65 WeakPolarHBondContact CA-SG 3.38Å; C58-C65 HydrophobicContact CB-CB 3.91Å; C58-C65 WeakPolarHBondContact CB-SG 2.75Å; C58-C65 PolarHBondContact N-SG 3.5Å; C58-C65 VanDerWaalsContact N-SG 3.42Å; C58-C65 WeakPolarHBondContact SG-CB 3.3Å; C58-C65 CovalentContact SG-SG 2.02Å; C58-C65 PolarHBondContact SG-SG 3.18Å |
| 59 | Y | 63.1 | Low | 62.6 | Low | 193 Ų | 193 | 97 Ų | 97 | 76% | 0.757 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -74.2 | -32.1 | -177.7 | -160.5 | -94.9 | 0 | 0 | 0 | 112.2 | F55 L56 C61 | F55-Y59 HydrophobicContact CE1-CD2 4.3Å; F55-Y59 WeakPolarHBondContact O-CB 3.4Å; F55-Y59 PolarHBondContact O-N 2.71Å; L56-Y59 PolarHBondContact O-N 3.42Å; Y59-C61 PolarHBondContact O-N 2.86Å |
| 60 | S | 60 | Low | 61.4 | Low | 67 Ų | 67 | 94.3 Ų | 94.3 | 47% | 0.469 | 48% | 0.475 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | -4.2 | 179.4 | -53.4 | 0 | 0 | 0 | 0 | 113.2 | L56 W62 | L56-S60 WeakPolarHBondContact O-CB 3.33Å; L56-S60 PolarHBondContact O-N 3.48Å; L56-S60 PolarHBondContact O-OG 2.99Å; S60-W62 PolarHBondContact O-N 3.34Å |
| 61 | C | 59.3 | Low | 60.3 | Low | 53 Ų | 53 | 98.5 Ų | 98.5 | 36% | 0.358 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.4 | 10.7 | -178.8 | -141 | 0 | 0 | 0 | 0 | 114.7 | C58 Y59 C70 | C58-C61 PolarHBondContact O-N 3.04Å; Y59-C61 PolarHBondContact O-N 2.86Å; C61-C70 WeakPolarHBondContact CA-SG 3.24Å; C61-C70 HydrophobicContact CB-CB 4.12Å; C61-C70 WeakPolarHBondContact CB-SG 3.42Å; C61-C70 WeakPolarHBondContact SG-CB 3.36Å; C61-C70 CovalentContact SG-SG 2.01Å; C61-C70 PolarHBondContact SG-SG 3Å |
| 62 | W | 49.7 | Very low | 59 | Low | 242 Ų | 242 | 98.3 Ų | 98.3 | 92% | 0.917 | 50% | 0.495 | S | S | * | . | trans | -93.5 | -9 | -165.3 | -161.4 | 20.7 | 0 | 0 | 0 | 112.1 | S60 | S60-W62 PolarHBondContact O-N 3.34Š| ||
| 63 | G | 54 | Low | 57.4 | Low | 29 Ų | 29 | 101.4 Ų | 101.4 | 30% | 0.299 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -127.8 | 149.4 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | C65 | G63-C65 VanDerWaalsContact C-N 3.27Å; G63-C65 PolarHBondContact O-N 2.9Å |
| 64 | N | 53.5 | Low | 56.1 | Low | 122 Ų | 122 | 103.5 Ų | 103.5 | 65% | 0.652 | 54% | 0.538 | S | S | * | . | trans | -60.9 | 89.9 | 175.5 | -163.6 | 23.6 | 0 | 0 | 0 | 108.7 | F66 | N64-F66 PolarHBondContact O-N 3.38Š| ||
| 65 | C | 57.8 | Low | 54.6 | Low | 19 Ų | 19 | 106 Ų | 106 | 13% | 0.128 | 55% | 0.552 | C | S | . | * | trans | -73 | 133.4 | -168.8 | -132.3 | 0 | 0 | 0 | 0 | 110.3 | C58 G63 L67 Y68 | C58-C65 WeakPolarHBondContact CA-SG 3.38Å; C58-C65 HydrophobicContact CB-CB 3.91Å; C58-C65 WeakPolarHBondContact CB-SG 2.75Å; C58-C65 PolarHBondContact N-SG 3.5Å; C58-C65 VanDerWaalsContact N-SG 3.42Å; C58-C65 WeakPolarHBondContact SG-CB 3.3Å; C58-C65 CovalentContact SG-SG 2.02Å; C58-C65 PolarHBondContact SG-SG 3.18Å; G63-C65 VanDerWaalsContact C-N 3.27Å; G63-C65 PolarHBondContact O-N 2.9Å; C65-L67 VanDerWaalsContact C-N 3.31Å; C65-L67 PolarHBondContact O-N 2.77Å; C65-Y68 VanDerWaalsContact O-O 3.1Å | ||
| 66 | F | 55.7 | Low | 53 | Low | 67 Ų | 67 | 104.8 Ų | 104.8 | 29% | 0.294 | 56% | 0.557 | S | S | . | * | S | Bend | trans | -71.1 | -30.6 | -171 | -161.8 | -131.9 | 0 | 0 | 0 | 112.9 | H25 S26 M29 N64 | H25-F66 VanDerWaalsContact C-CE2 3.49Å; H25-F66 HydrophobicContact CB-CE2 4.4Å; H25-F66 AromaticContact CD2-CE2 3.93Å; H25-F66 WeakPolarHBondContact O-CZ 3.4Å; S26-F66 VanDerWaalsContact CA-CD1 3.41Å; S26-F66 VanDerWaalsContact CA-CD2 3.44Å; S26-F66 WeakPolarHBondContact CB-O 2.97Å; S26-F66 WeakPolarHBondContact O-CD1 3.47Å; S26-F66 WeakPolarHBondContact O-CE1 3.43Å; S26-F66 PolarHBondContact OG-O 3.3Å; M29-F66 HydrophobicContact CB-CE1 3.5Å; M29-F66 VanDerWaalsContact CB-CE1 3.5Å; M29-F66 HydrophobicContact CB-CZ 3.41Å; M29-F66 VanDerWaalsContact CB-CZ 3.41Å; M29-F66 HydrophobicContact CG-CE1 4.27Å; M29-F66 HydrophobicContact CG-CZ 3.65Å; N64-F66 PolarHBondContact O-N 3.38Å |
| 67 | L | 49.6 | Very low | 51.9 | Low | 125 Ų | 125 | 105 Ų | 105 | 65% | 0.654 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -103.9 | -19.9 | -169.3 | -141.9 | 145.7 | 0 | 0 | 0 | 112.5 | C65 | C65-L67 VanDerWaalsContact C-N 3.31Å; C65-L67 PolarHBondContact O-N 2.77Å |
| 68 | Y | 45.2 | Very low | 50.8 | Low | 177 Ų | 177 | 104.7 Ų | 104.7 | 69% | 0.694 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -137.7 | 124 | 177.6 | -103.2 | -94.5 | 0 | 0 | 0 | 109 | C65 C70 | C65-Y68 VanDerWaalsContact O-O 3.1Å; Y68-C70 PolarHBondContact O-N 2.96Å |
| 69 | H | 48.8 | Very low | 49.5 | Very low | 153 Ų | 153 | 107.2 Ų | 107.2 | 71% | 0.708 | 61% | 0.609 | S | S | * | * | trans | -66.4 | 106.2 | 164.3 | -159.6 | -31.8 | 0 | 0 | 0 | 106.1 | Q71 | H69-Q71 VanDerWaalsContact C-N 3.3Å; H69-Q71 PolarHBondContact O-N 3.35Å | ||
| 70 | C | 51.1 | Low | 48.6 | Very low | 40 Ų | 40 | 106.9 Ų | 106.9 | 27% | 0.27 | 61% | 0.614 | S | S | . | * | trans | -72.7 | 97.6 | 172.9 | -148.1 | 0 | 0 | 0 | 0 | 105.7 | C61 Y68 D72 | C61-C70 WeakPolarHBondContact CA-SG 3.24Å; C61-C70 HydrophobicContact CB-CB 4.12Å; C61-C70 WeakPolarHBondContact CB-SG 3.42Å; C61-C70 WeakPolarHBondContact SG-CB 3.36Å; C61-C70 CovalentContact SG-SG 2.01Å; C61-C70 PolarHBondContact SG-SG 3Å; Y68-C70 PolarHBondContact O-N 2.96Å; C70-D72 PolarHBondContact O-N 3.01Å | ||
| 71 | Q | 48.5 | Very low | 47.7 | Very low | 137 Ų | 137 | 109.8 Ų | 109.8 | 64% | 0.64 | 62% | 0.624 | S | S | * | * | trans | -73.4 | 111.3 | 172.4 | -167.5 | 84.4 | 39.2 | 0 | 0 | 105.2 | H69 A73 | H69-Q71 VanDerWaalsContact C-N 3.3Å; H69-Q71 PolarHBondContact O-N 3.35Å; Q71-A73 PolarHBondContact O-N 2.79Å | ||
| 72 | D | 46.1 | Very low | 47.1 | Very low | 102 Ų | 102 | 113.5 Ų | 113.5 | 55% | 0.545 | 65% | 0.648 | S | S | . | * | trans | -40.3 | 123 | 178.3 | -57.3 | -81.8 | 0 | 0 | 0 | 110.8 | C70 A74 | C70-D72 PolarHBondContact O-N 3.01Å; D72-A74 PolarHBondContact O-N 3.49Å | ||
| 73 | A | 45.3 | Very low | 46.8 | Very low | 110 Ų | 110 | 105.7 Ų | 105.7 | 91% | 0.909 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | 70.9 | 159.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | Q71 | Q71-A73 PolarHBondContact O-N 2.79Š|
| 74 | A | 44.2 | Very low | 46.4 | Very low | 88 Ų | 88 | 112 Ų | 112 | 73% | 0.727 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 150.5 | 69.7 | 162.2 | 0 | 0 | 0 | 0 | 0 | 111 | D72 | D72-A74 PolarHBondContact O-N 3.49Š|
| 75 | L | 39.8 | Very low | 45.9 | Very low | 133 Ų | 133 | 114.4 Ų | 114.4 | 70% | 0.696 | 67% | 0.671 | S | S | * | * | trans | -134 | 122.2 | 150.4 | -148.8 | 69.3 | 0 | 0 | 0 | 108 | A77 | L75-A77 PolarHBondContact O-N 3.35Š| ||
| 76 | P | 39.8 | Very low | 45.3 | Very low | 109 Ų | 109 | 117.1 Ų | 117.1 | 71% | 0.708 | 70% | 0.702 | S | S | * | * | trans | -65.3 | 129.5 | -168.9 | 28.7 | -34.1 | 0 | 0 | 0 | 109.3 | A78 | P76-A78 VanDerWaalsContact C-N 3.25Å; P76-A78 WeakPolarHBondContact O-CB 3.34Å; P76-A78 PolarHBondContact O-N 2.65Å | ||
| 77 | A | 45.2 | Very low | 44.5 | Very low | 116 Ų | 116 | 124.3 Ų | 124.3 | 96% | 0.959 | 75% | 0.751 | S | S | * | * | S | Bend | trans | 10.9 | 47.5 | 152.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | L75 | L75-A77 PolarHBondContact O-N 3.35Š|
| 78 | A | 42.4 | Very low | 44.2 | Very low | 84 Ų | 84 | 124.3 Ų | 124.3 | 69% | 0.694 | 76% | 0.756 | S | S | * | * | trans | -150.8 | 26.9 | -172.2 | 0 | 0 | 0 | 0 | 0 | 115 | P76 | P76-A78 VanDerWaalsContact C-N 3.25Å; P76-A78 WeakPolarHBondContact O-CB 3.34Å; P76-A78 PolarHBondContact O-N 2.65Å | ||
| 79 | A | 39.9 | Very low | 44.1 | Very low | 85 Ų | 85 | 121.5 Ų | 121.5 | 70% | 0.702 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -128.8 | 17.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 80 | H | 44.1 | Very low | 43.9 | Very low | 186 Ų | 186 | 119.7 Ų | 119.7 | 86% | 0.861 | 76% | 0.762 | S | S | * | * | trans | -103 | 43 | 172.1 | -132.2 | -52.7 | 0 | 0 | 0 | 110.9 | ||||
| 81 | D | 41.1 | Very low | 43.5 | Very low | 129 Ų | 129 | 124.4 Ų | 124.4 | 69% | 0.69 | 79% | 0.791 | S | S | * | * | trans | -104.6 | 113.7 | 168.5 | -87.9 | -50.4 | 0 | 0 | 0 | 109.9 | A83 | D81-A83 PolarHBondContact O-N 2.91Š| ||
| 82 | P | 47.2 | Very low | 43.1 | Very low | 131 Ų | 131 | 123.6 Ų | 123.6 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | trans | -79.6 | 51.8 | 177.6 | 36 | -35.2 | 0 | 0 | 0 | 110.8 | ||||
| 83 | A | 42.7 | Very low | 42.9 | Very low | 77 Ų | 77 | 125.1 Ų | 125.1 | 64% | 0.636 | 82% | 0.818 | S | S | * | * | trans | -112.7 | 1.6 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | D81 | D81-A83 PolarHBondContact O-N 2.91Š| ||
| 84 | I | 45.6 | Very low | 42.8 | Very low | 163 Ų | 163 | 126.1 Ų | 126.1 | 84% | 0.836 | 81% | 0.811 | S | S | * | * | trans | -113.8 | 53.8 | 176.4 | -45 | -72.3 | 0 | 0 | 0 | 109.9 | ||||
| 85 | I | 43.5 | Very low | 42.7 | Very low | 172 Ų | 172 | 129.1 Ų | 129.1 | 88% | 0.882 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -129.5 | 93.1 | 155.1 | -59.3 | 174.4 | 0 | 0 | 0 | 104.8 | ||
| 86 | G | 44.6 | Very low | 42.9 | Very low | 76 Ų | 76 | 128.8 Ų | 128.8 | 78% | 0.784 | 83% | 0.828 | S | S | * | * | trans | 143.9 | 54.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 87 | T | 38.7 | Very low | 43.2 | Very low | 217 Ų | 217 | 130.5 Ų | 130.5 | 100% | 1.331 | 84% | 0.839 | S | S | * | * | trans | -119.3 | 0 | 137.1 | 55.8 | 0 | 0 | 0 | 0 | 107.6 |
Retrieved 87 of 87 residues in 46.6 ms
(Link to these results)