| 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 | 43.1 | Very low | 42.6 | Very low | 245 Ų | 245 | 119.5 Ų | 119.5 | 100% | 1.207 | 66% | 0.662 | S | S | * | * | 0 | 99.8 | 0 | -65 | -172.2 | 178.2 | 0 | 0 | 106.9 | |||||
| 2 | Q | 35.5 | Very low | 42.7 | Very low | 165 Ų | 165 | 117.7 Ų | 117.7 | 77% | 0.771 | 66% | 0.656 | S | S | * | * | trans | -98.6 | 122.7 | -177 | -87.9 | 167.7 | -30.3 | 0 | 0 | 108.9 | ||||
| 3 | M | 45.8 | Very low | 43.2 | Very low | 196 Ų | 196 | 113.8 Ų | 113.8 | 97% | 0.966 | 63% | 0.633 | S | S | * | * | trans | -109 | 63.6 | 163.8 | -73.1 | -170.3 | 171.7 | 0 | 0 | 107.3 | ||||
| 4 | T | 41 | Very low | 43.5 | Very low | 80 Ų | 80 | 112.4 Ų | 112.4 | 49% | 0.491 | 62% | 0.623 | S | S | . | * | trans | -117.2 | 144.4 | -178 | 44.3 | 0 | 0 | 0 | 0 | 110.3 | E6 | T4-E6 PolarHBondContact O-N 2.85Å; T4-E6 VanDerWaalsContact O-N 3.08Å | ||
| 5 | F | 40.5 | Very low | 43.5 | Very low | 132 Ų | 132 | 115.5 Ų | 115.5 | 58% | 0.579 | 63% | 0.628 | S | S | * | * | trans | -60.4 | 108.4 | 176.7 | -64.9 | -83.2 | 0 | 0 | 0 | 109.9 | Y125 V127 | F5-Y125 HydrophobicContact CD1-CD1 4.16Å; F5-Y125 WeakPolarHBondContact CD1-O 3.31Å; F5-Y125 AromaticContact CE1-CD1 3.87Å; F5-Y125 HydrophobicContact CE1-CD1 3.87Å; F5-V127 HydrophobicContact CB-CG2 3.9Å; F5-V127 HydrophobicContact CD1-CG2 4.19Å; F5-V127 HydrophobicContact CG-CG2 4.12Å | ||
| 6 | E | 46.7 | Very low | 43.5 | Very low | 121 Ų | 121 | 117.4 Ų | 117.4 | 57% | 0.565 | 64% | 0.637 | S | S | * | * | trans | -86.1 | 116.8 | 174.8 | -74.5 | -73.3 | 142.4 | 0 | 0 | 108.3 | T4 S8 | T4-E6 PolarHBondContact O-N 2.85Å; T4-E6 VanDerWaalsContact O-N 3.08Å; E6-S8 PolarHBondContact O-N 3.07Å | ||
| 7 | A | 44.8 | Very low | 43.6 | Very low | 85 Ų | 85 | 122.4 Ų | 122.4 | 70% | 0.702 | 65% | 0.652 | S | S | * | * | trans | -76 | 56.7 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 8 | S | 41.7 | Very low | 43.8 | Very low | 61 Ų | 61 | 124.3 Ų | 124.3 | 43% | 0.427 | 65% | 0.649 | S | S | . | * | trans | -85.7 | 132.2 | -179 | -168.4 | 0 | 0 | 0 | 0 | 110.7 | E6 S10 N126 | E6-S8 PolarHBondContact O-N 3.07Å; S8-S10 VanDerWaalsContact C-N 3.28Å; S8-S10 PolarHBondContact O-N 3.44Å; S8-N126 PolarHBondContact O-ND2 3.37Å | ||
| 9 | S | 41.8 | Very low | 43.8 | Very low | 102 Ų | 102 | 123.6 Ų | 123.6 | 71% | 0.713 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -83.8 | 8.2 | -171.4 | 50.2 | 0 | 0 | 0 | 0 | 114.6 | ||
| 10 | S | 40 | Very low | 44 | Very low | 89 Ų | 89 | 121.7 Ų | 121.7 | 62% | 0.622 | 64% | 0.639 | S | S | * | * | trans | -129.5 | 80.9 | -179.3 | -175.8 | 0 | 0 | 0 | 0 | 110 | S8 | S8-S10 VanDerWaalsContact C-N 3.28Å; S8-S10 PolarHBondContact O-N 3.44Å | ||
| 11 | V | 47.2 | Very low | 44.3 | Very low | 39 Ų | 39 | 124.1 Ų | 124.1 | 24% | 0.236 | 65% | 0.647 | C | S | . | * | trans | -102.4 | 96.6 | 172.5 | 172.1 | 0 | 0 | 0 | 0 | 106.9 | L13 N126 | V11-L13 HydrophobicContact CG1-CB 4.26Å; V11-L13 HydrophobicContact CG1-CD1 3.31Å; V11-L13 HydrophobicContact CG1-CG 3.41Å; V11-L13 VanDerWaalsContact CG1-CG 3.41Å; V11-L13 PolarHBondContact O-N 3.14Å; V11-N126 HydrophobicContact CG2-CB 4.4Å | ||
| 12 | T | 44.6 | Very low | 45.3 | Very low | 97 Ų | 97 | 114 Ų | 114 | 60% | 0.595 | 61% | 0.606 | S | S | * | * | trans | -74.1 | 69.5 | 179.9 | -23 | 0 | 0 | 0 | 0 | 109.8 | L14 | T12-L14 PolarHBondContact O-N 3.46Š| ||
| 13 | L | 49.1 | Very low | 47 | Very low | 67 Ų | 67 | 111.6 Ų | 111.6 | 35% | 0.351 | 60% | 0.604 | S | S | . | * | trans | -91.9 | 96.8 | 177.7 | -76.6 | 171.5 | 0 | 0 | 0 | 110 | V11 C121 | V11-L13 HydrophobicContact CG1-CB 4.26Å; V11-L13 HydrophobicContact CG1-CD1 3.31Å; V11-L13 HydrophobicContact CG1-CG 3.41Å; V11-L13 VanDerWaalsContact CG1-CG 3.41Å; V11-L13 PolarHBondContact O-N 3.14Å; L13-C121 HydrophobicContact CD1-CB 4.22Å; L13-C121 VanDerWaalsContact CD1-SG 3.5Å | ||
| 14 | L | 47.1 | Very low | 48.3 | Very low | 95 Ų | 95 | 105.4 Ų | 105.4 | 50% | 0.497 | 58% | 0.584 | S | S | . | * | S | Bend | trans | 92.7 | -27.1 | 155.2 | -129.9 | 110.2 | 0 | 0 | 0 | 121 | T12 M117 | T12-L14 PolarHBondContact O-N 3.46Å; L14-M117 HydrophobicContact CD1-CE 3.27Å; L14-M117 HydrophobicContact CD1-CG 4.38Å; L14-M117 HydrophobicContact CD1-SD 3.17Å; L14-M117 WeakPolarHBondContact CD1-SD 3.42Å; L14-M117 HydrophobicContact CD2-CE 3.5Å; L14-M117 HydrophobicContact CG-CE 3.94Å; L14-M117 HydrophobicContact CG-SD 4.41Å |
| 15 | F | 43.3 | Very low | 49.9 | Very low | 158 Ų | 158 | 102.1 Ų | 102.1 | 69% | 0.693 | 57% | 0.567 | S | S | * | * | trans | -143.4 | 122.6 | 170 | -71 | -82 | 0 | 0 | 0 | 109.4 | F17 | F15-F17 PolarHBondContact O-N 3.22Š| ||
| 16 | D | 44.1 | Very low | 51.6 | Low | 146 Ų | 146 | 97.6 Ų | 97.6 | 78% | 0.781 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | -5.9 | 175 | -101.8 | -40.7 | 0 | 0 | 0 | 114 | ||
| 17 | F | 44.2 | Very low | 53.3 | Low | 202 Ų | 202 | 96.8 Ų | 96.8 | 89% | 0.886 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -9.1 | -172.6 | -141.9 | -95.1 | 0 | 0 | 0 | 114.5 | F15 N19 | F15-F17 PolarHBondContact O-N 3.22Å; F17-N19 VanDerWaalsContact C-N 3.25Å; F17-N19 PolarHBondContact O-N 3.21Å |
| 18 | W | 48.2 | Very low | 55.1 | Low | 158 Ų | 158 | 95.6 Ų | 95.6 | 60% | 0.598 | 53% | 0.532 | S | S | * | . | trans | -92.2 | 46.8 | -177 | -145.2 | -64.2 | 0 | 0 | 0 | 112.8 | V20 L28 I32 | W18-V20 PolarHBondContact O-N 3.05Å; W18-V20 VanDerWaalsContact O-N 3.1Å; W18-L28 HydrophobicContact CZ2-CD1 4.15Å; W18-L28 HydrophobicContact CZ2-CD2 3.62Å; W18-L28 HydrophobicContact CZ2-CG 3.92Å; W18-I32 HydrophobicContact CH2-CD1 4.15Å; W18-I32 HydrophobicContact CZ2-CD1 4.2Å; W18-I32 HydrophobicContact CZ3-CD1 4.37Å | ||
| 19 | N | 43.3 | Very low | 57 | Low | 110 Ų | 110 | 94.6 Ų | 94.6 | 59% | 0.588 | 53% | 0.526 | S | S | * | . | trans | -84.5 | 84.2 | -177.9 | -167.7 | -81.5 | 0 | 0 | 0 | 110.5 | F17 H21 | F17-N19 VanDerWaalsContact C-N 3.25Å; F17-N19 PolarHBondContact O-N 3.21Å; N19-H21 VanDerWaalsContact CG-CE1 3.43Å; N19-H21 PolarHBondContact ND2-CE1 3.2Å; N19-H21 VanDerWaalsContact ND2-CE1 3.29Å; N19-H21 PolarHBondContact OD1-CE1 2.97Å; N19-H21 PolarHBondContact OD1-ND1 2.73Å | ||
| 20 | V | 48.1 | Very low | 59.1 | Low | 85 Ų | 85 | 91.1 Ų | 91.1 | 52% | 0.515 | 50% | 0.5 | S | S | . | . | trans | -111.4 | 96.2 | 164.5 | -172 | 0 | 0 | 0 | 0 | 107.1 | W18 G22 | W18-V20 PolarHBondContact O-N 3.05Å; W18-V20 VanDerWaalsContact O-N 3.1Å; V20-G22 VanDerWaalsContact C-N 3.25Å; V20-G22 PolarHBondContact O-N 3.1Å | ||
| 21 | H | 50.1 | Low | 61.4 | Low | 173 Ų | 173 | 92.8 Ų | 92.8 | 80% | 0.801 | 50% | 0.496 | S | S | * | . | trans | -64.1 | 79 | 177.7 | -74.4 | 93.5 | 0 | 0 | 0 | 111.3 | N19 | N19-H21 VanDerWaalsContact CG-CE1 3.43Å; N19-H21 PolarHBondContact ND2-CE1 3.2Å; N19-H21 VanDerWaalsContact ND2-CE1 3.29Å; N19-H21 PolarHBondContact OD1-CE1 2.97Å; N19-H21 PolarHBondContact OD1-ND1 2.73Å | ||
| 22 | G | 64.4 | Low | 63.3 | Low | 33 Ų | 33 | 94.1 Ų | 94.1 | 34% | 0.34 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -177 | 167.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | V20 A24 G25 | V20-G22 VanDerWaalsContact C-N 3.25Å; V20-G22 PolarHBondContact O-N 3.1Å; G22-A24 PolarHBondContact O-N 3.37Å; G22-G25 PolarHBondContact O-N 2.94Å |
| 23 | P | 70.8 | Confident | 65.4 | Low | 114 Ų | 114 | 90.1 Ų | 90.1 | 74% | 0.74 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -51.8 | -27.8 | 176.1 | -25.6 | 33.2 | 0 | 0 | 0 | 113.9 | G25 M26 V27 | P23-G25 VanDerWaalsContact C-N 3.31Å; P23-G25 PolarHBondContact O-N 3.07Å; P23-M26 WeakPolarHBondContact O-CB 3.45Å; P23-M26 PolarHBondContact O-N 3.31Å; P23-V27 PolarHBondContact O-N 3.06Å |
| 24 | A | 73.7 | Confident | 67.5 | Low | 66 Ų | 66 | 88.5 Ų | 88.5 | 55% | 0.545 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -59.6 | -38.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | G22 M26 V27 L28 | G22-A24 PolarHBondContact O-N 3.37Å; A24-M26 VanDerWaalsContact C-N 3.32Å; A24-M26 PolarHBondContact O-N 3.44Å; A24-V27 PolarHBondContact O-N 2.9Å; A24-L28 VanDerWaalsContact O-CB 3.23Å; A24-L28 WeakPolarHBondContact O-CB 2.96Å; A24-L28 PolarHBondContact O-N 3.46Å |
| 25 | G | 73.8 | Confident | 69.6 | Low | 12 Ų | 12 | 88.4 Ų | 88.4 | 12% | 0.124 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -63.9 | -37.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | G22 P23 L28 S29 | G22-G25 PolarHBondContact O-N 2.94Å; P23-G25 VanDerWaalsContact C-N 3.31Å; P23-G25 PolarHBondContact O-N 3.07Å; G25-L28 PolarHBondContact O-N 3.4Å; G25-S29 PolarHBondContact O-N 3.5Å; G25-S29 PolarHBondContact O-OG 3.46Å; G25-S29 VanDerWaalsContact O-OG 3.05Å |
| 26 | M | 76.4 | Confident | 71.8 | Confident | 36 Ų | 36 | 83.4 Ų | 83.4 | 18% | 0.177 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -65.1 | -47.8 | 175.9 | -78 | -75.1 | -76.5 | 0 | 0 | 112.2 | P23 A24 L28 S29 V30 W128 | P23-M26 WeakPolarHBondContact O-CB 3.45Å; P23-M26 PolarHBondContact O-N 3.31Å; A24-M26 VanDerWaalsContact C-N 3.32Å; A24-M26 PolarHBondContact O-N 3.44Å; M26-L28 VanDerWaalsContact C-N 3.27Å; M26-L28 PolarHBondContact O-N 3.43Å; M26-S29 PolarHBondContact O-N 2.8Å; M26-V30 VanDerWaalsContact O-CG2 3.31Å; M26-V30 WeakPolarHBondContact O-CG2 3.47Å; M26-V30 PolarHBondContact O-N 2.82Å; M26-W128 HydrophobicContact CE-CG 4.37Å |
| 27 | V | 81.8 | Confident | 74.2 | Confident | 104 Ų | 104 | 76.7 Ų | 76.7 | 63% | 0.63 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -61.2 | -40.4 | 177.7 | 176.3 | 0 | 0 | 0 | 0 | 110.9 | P23 A24 V30 F31 | P23-V27 PolarHBondContact O-N 3.06Å; A24-V27 PolarHBondContact O-N 2.9Å; V27-V30 PolarHBondContact O-N 2.82Å; V27-F31 WeakPolarHBondContact O-CB 3.11Å; V27-F31 PolarHBondContact O-N 3.45Å |
| 28 | L | 82.9 | Confident | 76.5 | Confident | 60 Ų | 60 | 68.1 Ų | 68.1 | 31% | 0.314 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65.5 | -42.7 | 178.7 | -174 | 51.6 | 0 | 0 | 0 | 112.1 | W18 A24 G25 M26 F31 I32 | W18-L28 HydrophobicContact CZ2-CD1 4.15Å; W18-L28 HydrophobicContact CZ2-CD2 3.62Å; W18-L28 HydrophobicContact CZ2-CG 3.92Å; A24-L28 VanDerWaalsContact O-CB 3.23Å; A24-L28 WeakPolarHBondContact O-CB 2.96Å; A24-L28 PolarHBondContact O-N 3.46Å; G25-L28 PolarHBondContact O-N 3.4Å; M26-L28 VanDerWaalsContact C-N 3.27Å; M26-L28 PolarHBondContact O-N 3.43Å; L28-F31 PolarHBondContact O-N 2.96Å; L28-I32 HydrophobicContact CD1-CD1 4.33Å; L28-I32 HydrophobicContact CG-CD1 4.22Å; L28-I32 VanDerWaalsContact O-CG1 3.27Å; L28-I32 WeakPolarHBondContact O-CG1 3.1Å; L28-I32 PolarHBondContact O-N 3.07Å |
| 29 | S | 81.4 | Confident | 78.5 | Confident | 41 Ų | 41 | 63.3 Ų | 63.3 | 29% | 0.287 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.1 | -45.7 | 172.8 | -65.6 | 0 | 0 | 0 | 0 | 111.8 | G25 M26 F31 I32 V33 | G25-S29 PolarHBondContact O-N 3.5Å; G25-S29 PolarHBondContact O-OG 3.46Å; G25-S29 VanDerWaalsContact O-OG 3.05Å; M26-S29 PolarHBondContact O-N 2.8Å; S29-F31 VanDerWaalsContact C-N 3.3Å; S29-F31 PolarHBondContact O-N 3.31Å; S29-I32 PolarHBondContact O-N 3.41Å; S29-V33 WeakPolarHBondContact O-CB 3.44Å; S29-V33 VanDerWaalsContact O-CG2 3.22Å; S29-V33 WeakPolarHBondContact O-CG2 3.44Å; S29-V33 PolarHBondContact O-N 3.37Å |
| 30 | V | 86.3 | Confident | 80.9 | Confident | 28 Ų | 28 | 59.8 Ų | 59.8 | 17% | 0.17 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60 | -43.1 | 175.7 | 175.7 | 0 | 0 | 0 | 0 | 110.9 | M26 V27 V33 L34 W128 I129 | M26-V30 VanDerWaalsContact O-CG2 3.31Å; M26-V30 WeakPolarHBondContact O-CG2 3.47Å; M26-V30 PolarHBondContact O-N 2.82Å; V27-V30 PolarHBondContact O-N 2.82Å; V30-V33 PolarHBondContact O-N 3.36Å; V30-L34 VanDerWaalsContact O-CB 3.24Å; V30-L34 WeakPolarHBondContact O-CB 3.11Å; V30-L34 PolarHBondContact O-N 2.75Å; V30-W128 HydrophobicContact CG2-CB 3.68Å; V30-I129 HydrophobicContact CG2-CD1 4.01Å |
| 31 | F | 88.2 | Confident | 83 | Confident | 125 Ų | 125 | 56.8 Ų | 56.8 | 55% | 0.548 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 178.4 | -175.8 | -96.6 | 0 | 0 | 0 | 112.4 | V27 L28 S29 L34 L35 | V27-F31 WeakPolarHBondContact O-CB 3.11Å; V27-F31 PolarHBondContact O-N 3.45Å; L28-F31 PolarHBondContact O-N 2.96Å; S29-F31 VanDerWaalsContact C-N 3.3Å; S29-F31 PolarHBondContact O-N 3.31Å; F31-L34 PolarHBondContact O-N 3.07Å; F31-L35 WeakPolarHBondContact O-CB 3.49Å; F31-L35 PolarHBondContact O-N 3.48Å |
| 32 | I | 87.7 | Confident | 84.7 | Confident | 67 Ų | 67 | 51 Ų | 51 | 34% | 0.344 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 176.3 | -69.7 | 165.4 | 0 | 0 | 0 | 110.2 | W18 L28 S29 L35 L36 | W18-I32 HydrophobicContact CH2-CD1 4.15Å; W18-I32 HydrophobicContact CZ2-CD1 4.2Å; W18-I32 HydrophobicContact CZ3-CD1 4.37Å; L28-I32 HydrophobicContact CD1-CD1 4.33Å; L28-I32 HydrophobicContact CG-CD1 4.22Å; L28-I32 VanDerWaalsContact O-CG1 3.27Å; L28-I32 WeakPolarHBondContact O-CG1 3.1Å; L28-I32 PolarHBondContact O-N 3.07Å; S29-I32 PolarHBondContact O-N 3.41Å; I32-L35 PolarHBondContact O-N 3Å; I32-L36 VanDerWaalsContact O-CB 3.3Å; I32-L36 WeakPolarHBondContact O-CB 3.33Å; I32-L36 PolarHBondContact O-N 3.2Å |
| 33 | V | 89.5 | Confident | 85.9 | Confident | 12 Ų | 12 | 50.8 Ų | 50.8 | 7% | 0.073 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.7 | -40.5 | 179.1 | 172.9 | 0 | 0 | 0 | 0 | 111.6 | S29 V30 L36 T37 C121 I129 V133 | S29-V33 WeakPolarHBondContact O-CB 3.44Å; S29-V33 VanDerWaalsContact O-CG2 3.22Å; S29-V33 WeakPolarHBondContact O-CG2 3.44Å; S29-V33 PolarHBondContact O-N 3.37Å; V30-V33 PolarHBondContact O-N 3.36Å; V33-L36 PolarHBondContact O-N 3.45Å; V33-T37 WeakPolarHBondContact O-CB 3.11Å; V33-T37 PolarHBondContact O-N 3.47Å; V33-T37 PolarHBondContact O-OG1 3.14Å; V33-C121 VanDerWaalsContact CG1-SG 3.58Å; V33-C121 WeakPolarHBondContact CG2-SG 3.24Å; V33-I129 HydrophobicContact CG1-CG2 4.22Å; V33-I129 HydrophobicContact CG2-CD1 4.21Å; V33-I129 HydrophobicContact CG2-CG2 4.43Å; V33-V133 HydrophobicContact CG1-CG2 3.38Å |
| 34 | L | 91.7 | Very high | 86.7 | Confident | 34 Ų | 34 | 49.1 Ų | 49.1 | 18% | 0.178 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -58.8 | -50.4 | 173.6 | -175.8 | 159.7 | 0 | 0 | 0 | 110.2 | V30 F31 L36 T37 V38 L135 L139 | V30-L34 VanDerWaalsContact O-CB 3.24Å; V30-L34 WeakPolarHBondContact O-CB 3.11Å; V30-L34 PolarHBondContact O-N 2.75Å; F31-L34 PolarHBondContact O-N 3.07Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.8Å; L34-T37 PolarHBondContact O-N 2.99Å; L34-V38 HydrophobicContact CD2-CG2 4.05Å; L34-V38 WeakPolarHBondContact O-CG2 3.47Å; L34-V38 PolarHBondContact O-N 3.5Å; L34-L135 HydrophobicContact CD1-CD2 4.35Å; L34-L139 HydrophobicContact CD1-CD1 4.42Å; L34-L139 HydrophobicContact CD2-CD1 4.25Å |
| 35 | L | 91.6 | Very high | 87.2 | Confident | 92 Ų | 92 | 47.3 Ų | 47.3 | 48% | 0.482 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.7 | -44.9 | 177.5 | -175.1 | 72.5 | 0 | 0 | 0 | 111.3 | F31 I32 T37 V38 V39 | F31-L35 WeakPolarHBondContact O-CB 3.49Å; F31-L35 PolarHBondContact O-N 3.48Å; I32-L35 PolarHBondContact O-N 3Å; L35-T37 VanDerWaalsContact C-N 3.28Å; L35-T37 PolarHBondContact O-N 2.93Å; L35-V38 PolarHBondContact O-N 3.31Å; L35-V39 WeakPolarHBondContact O-CB 3.19Å; L35-V39 VanDerWaalsContact O-CG2 3.3Å; L35-V39 WeakPolarHBondContact O-CG2 3.35Å; L35-V39 PolarHBondContact O-N 3.4Å |
| 36 | L | 90.6 | Very high | 87.7 | Confident | 54 Ų | 54 | 50.8 Ų | 50.8 | 28% | 0.283 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.7 | -39.5 | 178.3 | -157.9 | 72.8 | 0 | 0 | 0 | 111.4 | I32 V33 L34 F40 L114 M117 | I32-L36 VanDerWaalsContact O-CB 3.3Å; I32-L36 WeakPolarHBondContact O-CB 3.33Å; I32-L36 PolarHBondContact O-N 3.2Å; V33-L36 PolarHBondContact O-N 3.45Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.8Å; L36-F40 VanDerWaalsContact O-CB 3.29Å; L36-F40 WeakPolarHBondContact O-CB 3.23Å; L36-F40 PolarHBondContact O-N 3.46Å; L36-L114 HydrophobicContact CD1-CD2 3.39Å; L36-L114 HydrophobicContact CD2-CD2 4.27Å; L36-L114 HydrophobicContact CG-CD2 3.77Å; L36-M117 HydrophobicContact CD2-CB 3.97Å |
| 37 | T | 94.3 | Very high | 88.1 | Confident | 4 Ų | 4 | 52.9 Ų | 52.9 | 3% | 0.025 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -68 | -43.8 | 176.7 | -49.4 | 0 | 0 | 0 | 0 | 111.6 | V33 L34 L35 F40 E41 L118 V133 | V33-T37 WeakPolarHBondContact O-CB 3.11Å; V33-T37 PolarHBondContact O-N 3.47Å; V33-T37 PolarHBondContact O-OG1 3.14Å; L34-T37 PolarHBondContact O-N 2.99Å; L35-T37 VanDerWaalsContact C-N 3.28Å; L35-T37 PolarHBondContact O-N 2.93Å; T37-F40 WeakPolarHBondContact O-CB 3.25Å; T37-F40 PolarHBondContact O-N 3.01Å; T37-E41 PolarHBondContact O-N 2.87Å; T37-L118 HydrophobicContact CG2-CD2 4.35Å; T37-L118 WeakPolarHBondContact OG1-CD2 3.29Å; T37-V133 HydrophobicContact CG2-CG1 4.25Å |
| 38 | V | 92.7 | Very high | 88.1 | Confident | 22 Ų | 22 | 52.3 Ų | 52.3 | 13% | 0.133 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.5 | -47.4 | 175.8 | 170 | 0 | 0 | 0 | 0 | 110.4 | L34 L35 F40 E41 I42 G136 L139 | L34-V38 HydrophobicContact CD2-CG2 4.05Å; L34-V38 WeakPolarHBondContact O-CG2 3.47Å; L34-V38 PolarHBondContact O-N 3.5Å; L35-V38 PolarHBondContact O-N 3.31Å; V38-F40 VanDerWaalsContact C-N 3.34Å; V38-F40 PolarHBondContact O-N 3.31Å; V38-E41 PolarHBondContact O-N 2.76Å; V38-I42 HydrophobicContact CG1-CD1 3.78Å; V38-I42 VanDerWaalsContact O-CG1 3.3Å; V38-I42 WeakPolarHBondContact O-CG1 3.36Å; V38-I42 PolarHBondContact O-N 3.14Å; V38-G136 VanDerWaalsContact CG2-O 3.3Å; V38-G136 WeakPolarHBondContact CG2-O 3.45Å; V38-L139 HydrophobicContact CG2-CB 4.09Å |
| 39 | V | 90.2 | Very high | 87.7 | Confident | 57 Ų | 57 | 53.8 Ų | 53.8 | 35% | 0.345 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -61.7 | -42.2 | 176.8 | 170.6 | 0 | 0 | 0 | 0 | 111 | L35 E41 I42 L43 L114 | L35-V39 WeakPolarHBondContact O-CB 3.19Å; L35-V39 VanDerWaalsContact O-CG2 3.3Å; L35-V39 WeakPolarHBondContact O-CG2 3.35Å; L35-V39 PolarHBondContact O-N 3.4Å; V39-E41 PolarHBondContact O-N 3.39Å; V39-I42 PolarHBondContact O-N 3.22Å; V39-L43 HydrophobicContact CG1-CD1 3.67Å; V39-L43 HydrophobicContact CG1-CG 4.15Å; V39-L43 WeakPolarHBondContact O-CB 3.3Å; V39-L43 VanDerWaalsContact O-CG 3.23Å; V39-L43 WeakPolarHBondContact O-CG 3.46Å; V39-L43 PolarHBondContact O-N 3.11Å; V39-L114 HydrophobicContact CG1-CD1 4.37Å |
| 40 | F | 92.1 | Very high | 87.4 | Confident | 36 Ų | 36 | 53 Ų | 53 | 16% | 0.158 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.7 | -46.3 | 175.7 | 171.9 | -97.6 | 0 | 0 | 0 | 112.3 | L36 T37 V38 L43 K44 Q111 L114 L118 | L36-F40 VanDerWaalsContact O-CB 3.29Å; L36-F40 WeakPolarHBondContact O-CB 3.23Å; L36-F40 PolarHBondContact O-N 3.46Å; T37-F40 WeakPolarHBondContact O-CB 3.25Å; T37-F40 PolarHBondContact O-N 3.01Å; V38-F40 VanDerWaalsContact C-N 3.34Å; V38-F40 PolarHBondContact O-N 3.31Å; F40-L43 PolarHBondContact O-N 3.28Å; F40-K44 WeakPolarHBondContact O-CB 3.22Å; F40-K44 PolarHBondContact O-N 3.49Å; F40-Q111 HydrophobicContact CD2-CG 4.43Å; F40-Q111 HydrophobicContact CE2-CG 3.94Å; F40-L114 HydrophobicContact CB-CB 4.46Å; F40-L114 HydrophobicContact CD2-CB 3.82Å; F40-L118 HydrophobicContact CB-CD1 3.68Å; F40-L118 HydrophobicContact CD1-CD1 3.73Å; F40-L118 HydrophobicContact CD2-CD1 3.99Å; F40-L118 HydrophobicContact CE1-CD1 4.35Å; F40-L118 HydrophobicContact CG-CD1 3.52Å |
| 41 | E | 92.1 | Very high | 86.7 | Confident | 22 Ų | 22 | 54.1 Ų | 54.1 | 10% | 0.103 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 177.3 | -77.5 | -63.6 | 133.1 | 0 | 0 | 112 | T37 V38 V39 K44 V45 | T37-E41 PolarHBondContact O-N 2.87Å; V38-E41 PolarHBondContact O-N 2.76Å; V39-E41 PolarHBondContact O-N 3.39Å; E41-K44 WeakPolarHBondContact O-CB 3.36Å; E41-K44 PolarHBondContact O-N 2.99Å; E41-K44 IonicContact OE1-NZ 2.82Å; E41-K44 PolarHBondContact OE1-NZ 3.03Å; E41-K44 VanDerWaalsContact OE2-CE 3.24Å; E41-K44 WeakPolarHBondContact OE2-CE 3.43Å; E41-K44 IonicContact OE2-NZ 2.67Å; E41-K44 PolarHBondContact OE2-NZ 3.45Å; E41-V45 PolarHBondContact O-N 3.36Å; E41-V45 VanDerWaalsContact O-N 3.15Å |
| 42 | I | 87.6 | Confident | 85.8 | Confident | 53 Ų | 53 | 51.1 Ų | 51.1 | 27% | 0.272 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -63.3 | -46.4 | 176.5 | -66.6 | 166 | 0 | 0 | 0 | 110.8 | V38 V39 K44 V45 W46 V143 L147 | V38-I42 HydrophobicContact CG1-CD1 3.78Å; V38-I42 VanDerWaalsContact O-CG1 3.3Å; V38-I42 WeakPolarHBondContact O-CG1 3.36Å; V38-I42 PolarHBondContact O-N 3.14Å; V39-I42 PolarHBondContact O-N 3.22Å; I42-K44 VanDerWaalsContact C-N 3.31Å; I42-K44 PolarHBondContact O-N 2.98Å; I42-V45 PolarHBondContact O-N 2.98Å; I42-W46 WeakPolarHBondContact O-CB 3.48Å; I42-W46 PolarHBondContact O-N 3.36Å; I42-V143 HydrophobicContact CD1-CG1 4.24Å; I42-L147 HydrophobicContact CG1-CD1 4.39Å; I42-L147 HydrophobicContact CG2-CD1 4.25Å |
| 43 | L | 88.4 | Confident | 84.6 | Confident | 28 Ų | 28 | 49.6 Ų | 49.6 | 15% | 0.147 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.1 | -38.1 | 178.1 | -72.7 | 171.4 | 0 | 0 | 0 | 111.9 | V39 F40 V45 W46 R47 L107 L110 L114 | V39-L43 HydrophobicContact CG1-CD1 3.67Å; V39-L43 HydrophobicContact CG1-CG 4.15Å; V39-L43 WeakPolarHBondContact O-CB 3.3Å; V39-L43 VanDerWaalsContact O-CG 3.23Å; V39-L43 WeakPolarHBondContact O-CG 3.46Å; V39-L43 PolarHBondContact O-N 3.11Å; F40-L43 PolarHBondContact O-N 3.28Å; L43-V45 VanDerWaalsContact C-N 3.34Å; L43-V45 PolarHBondContact O-N 3.47Å; L43-W46 PolarHBondContact O-N 3.24Å; L43-R47 WeakPolarHBondContact O-CB 3.17Å; L43-R47 PolarHBondContact O-N 3.01Å; L43-L107 HydrophobicContact CD2-CD2 3.77Å; L43-L110 HydrophobicContact CD1-CD2 3.75Å; L43-L110 HydrophobicContact CD1-CG 4.15Å; L43-L110 HydrophobicContact CD2-CD2 4.42Å; L43-L114 HydrophobicContact CD1-CD1 3.42Å; L43-L114 VanDerWaalsContact CD1-CD1 3.42Å |
| 44 | K | 87.1 | Confident | 83.1 | Confident | 78 Ų | 78 | 52 Ų | 52 | 34% | 0.339 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58 | -47.4 | 175.4 | -172.7 | -177.1 | 72.2 | -171.1 | 0 | 110.9 | F40 E41 I42 V48 | F40-K44 WeakPolarHBondContact O-CB 3.22Å; F40-K44 PolarHBondContact O-N 3.49Å; E41-K44 WeakPolarHBondContact O-CB 3.36Å; E41-K44 PolarHBondContact O-N 2.99Å; E41-K44 IonicContact OE1-NZ 2.82Å; E41-K44 PolarHBondContact OE1-NZ 3.03Å; E41-K44 VanDerWaalsContact OE2-CE 3.24Å; E41-K44 WeakPolarHBondContact OE2-CE 3.43Å; E41-K44 IonicContact OE2-NZ 2.67Å; E41-K44 PolarHBondContact OE2-NZ 3.45Å; I42-K44 VanDerWaalsContact C-N 3.31Å; I42-K44 PolarHBondContact O-N 2.98Å; K44-V48 PolarHBondContact O-N 2.83Å |
| 45 | V | 85.8 | Confident | 81.3 | Confident | 28 Ų | 28 | 59.6 Ų | 59.6 | 17% | 0.17 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -70.5 | -42.3 | 179.5 | 174 | 0 | 0 | 0 | 0 | 111.8 | E41 I42 L43 R47 V48 W49 A144 L148 | E41-V45 PolarHBondContact O-N 3.36Å; E41-V45 VanDerWaalsContact O-N 3.15Å; I42-V45 PolarHBondContact O-N 2.98Å; L43-V45 VanDerWaalsContact C-N 3.34Å; L43-V45 PolarHBondContact O-N 3.47Å; V45-R47 VanDerWaalsContact C-N 3.32Å; V45-R47 PolarHBondContact O-N 3.44Å; V45-V48 PolarHBondContact O-N 3.35Å; V45-W49 PolarHBondContact O-N 3.39Å; V45-W49 VanDerWaalsContact O-N 3.11Å; V45-A144 HydrophobicContact CB-CB 4.34Å; V45-A144 HydrophobicContact CG2-CB 3.9Å; V45-L148 HydrophobicContact CG1-CD1 3.7Å; V45-L148 HydrophobicContact CG1-CD2 3.72Å; V45-L148 HydrophobicContact CG1-CG 3.6Å |
| 46 | W | 83 | Confident | 79.6 | Confident | 86 Ų | 86 | 62.5 Ų | 62.5 | 33% | 0.326 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.9 | -40.4 | 177.2 | -178.1 | -118.4 | 0 | 0 | 0 | 112.6 | I42 L43 V48 W49 L50 M151 | I42-W46 WeakPolarHBondContact O-CB 3.48Å; I42-W46 PolarHBondContact O-N 3.36Å; L43-W46 PolarHBondContact O-N 3.24Å; W46-V48 PolarHBondContact O-N 3.4Å; W46-W49 HydrophobicContact CE3-CD2 4.35Å; W46-W49 AromaticContact CE3-CE3 3.83Å; W46-W49 HydrophobicContact CE3-CE3 3.83Å; W46-W49 HydrophobicContact CE3-CZ3 4.43Å; W46-W49 AromaticContact CH2-CE3 3.73Å; W46-W49 HydrophobicContact CH2-CE3 3.73Å; W46-W49 HydrophobicContact CH2-CH2 4.22Å; W46-W49 AromaticContact CH2-CZ3 3.46Å; W46-W49 HydrophobicContact CH2-CZ3 3.46Å; W46-W49 VanDerWaalsContact CH2-CZ3 3.46Å; W46-W49 HydrophobicContact CZ2-CE3 4.41Å; W46-W49 HydrophobicContact CZ2-CZ3 4.19Å; W46-W49 AromaticContact CZ3-CD2 3.95Å; W46-W49 HydrophobicContact CZ3-CD2 3.95Å; W46-W49 AromaticContact CZ3-CE3 3.35Å; W46-W49 HydrophobicContact CZ3-CE3 3.35Å; W46-W49 HydrophobicContact CZ3-CH2 4.3Å; W46-W49 AromaticContact CZ3-CZ3 3.56Å; W46-W49 HydrophobicContact CZ3-CZ3 3.56Å; W46-W49 PolarHBondContact O-N 2.88Å; W46-L50 PolarHBondContact O-N 2.94Å; W46-M151 HydrophobicContact CE3-CE 3.67Å; W46-M151 HydrophobicContact CE3-SD 3.33Å; W46-M151 HydrophobicContact CH2-SD 4.24Å; W46-M151 HydrophobicContact CZ3-CE 3.96Å; W46-M151 HydrophobicContact CZ3-CG 4.31Å; W46-M151 HydrophobicContact CZ3-SD 3.11Å; W46-M151 WeakPolarHBondContact CZ3-SD 3.43Å |
| 47 | R | 85.3 | Confident | 77.5 | Confident | 80 Ų | 80 | 63.8 Ų | 63.8 | 30% | 0.302 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 176.1 | -174.6 | -176.8 | 176.3 | -166.2 | -3.5 | 112.2 | L43 V45 W49 L50 S51 H108 | L43-R47 WeakPolarHBondContact O-CB 3.17Å; L43-R47 PolarHBondContact O-N 3.01Å; V45-R47 VanDerWaalsContact C-N 3.32Å; V45-R47 PolarHBondContact O-N 3.44Å; R47-W49 VanDerWaalsContact C-N 3.31Å; R47-W49 PolarHBondContact O-N 3.43Å; R47-L50 PolarHBondContact O-N 3.24Å; R47-S51 WeakPolarHBondContact O-CB 2.94Å; R47-S51 PolarHBondContact O-N 2.91Å; R47-H108 VanDerWaalsContact CZ-ND1 3.32Å; R47-H108 PolarHBondContact NH1-ND1 2.87Å; R47-H108 VanDerWaalsContact NH1-ND1 3.12Å; R47-H108 PolarHBondContact NH2-ND1 3.32Å; R47-H108 VanDerWaalsContact NH2-ND1 3.11Å |
| 48 | V | 81.1 | Confident | 75.1 | Confident | 92 Ų | 92 | 70.3 Ų | 70.3 | 56% | 0.558 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.8 | -40.8 | 177.9 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | K44 V45 W46 S51 S52 | K44-V48 PolarHBondContact O-N 2.83Å; V45-V48 PolarHBondContact O-N 3.35Å; W46-V48 PolarHBondContact O-N 3.4Å; V48-S51 PolarHBondContact O-N 2.71Å; V48-S52 PolarHBondContact O-N 3.41Å; V48-S52 PolarHBondContact O-OG 3.41Å |
| 49 | W | 75.4 | Confident | 72.7 | Confident | 90 Ų | 90 | 73.9 Ų | 73.9 | 34% | 0.341 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -62.6 | -47.3 | 175.8 | -178.8 | 86 | 0 | 0 | 0 | 112 | V45 W46 R47 S51 S52 G53 | V45-W49 PolarHBondContact O-N 3.39Å; V45-W49 VanDerWaalsContact O-N 3.11Å; W46-W49 HydrophobicContact CE3-CD2 4.35Å; W46-W49 AromaticContact CE3-CE3 3.83Å; W46-W49 HydrophobicContact CE3-CE3 3.83Å; W46-W49 HydrophobicContact CE3-CZ3 4.43Å; W46-W49 AromaticContact CH2-CE3 3.73Å; W46-W49 HydrophobicContact CH2-CE3 3.73Å; W46-W49 HydrophobicContact CH2-CH2 4.22Å; W46-W49 AromaticContact CH2-CZ3 3.46Å; W46-W49 HydrophobicContact CH2-CZ3 3.46Å; W46-W49 VanDerWaalsContact CH2-CZ3 3.46Å; W46-W49 HydrophobicContact CZ2-CE3 4.41Å; W46-W49 HydrophobicContact CZ2-CZ3 4.19Å; W46-W49 AromaticContact CZ3-CD2 3.95Å; W46-W49 HydrophobicContact CZ3-CD2 3.95Å; W46-W49 AromaticContact CZ3-CE3 3.35Å; W46-W49 HydrophobicContact CZ3-CE3 3.35Å; W46-W49 HydrophobicContact CZ3-CH2 4.3Å; W46-W49 AromaticContact CZ3-CZ3 3.56Å; W46-W49 HydrophobicContact CZ3-CZ3 3.56Å; W46-W49 PolarHBondContact O-N 2.88Å; R47-W49 VanDerWaalsContact C-N 3.31Å; R47-W49 PolarHBondContact O-N 3.43Å; W49-S51 VanDerWaalsContact C-N 3.3Å; W49-S51 PolarHBondContact O-N 3.2Å; W49-S52 WeakPolarHBondContact O-CB 3.22Å; W49-S52 PolarHBondContact O-N 3.34Å; W49-G53 PolarHBondContact O-N 2.86Å |
| 50 | L | 74.7 | Confident | 70.7 | Confident | 24 Ų | 24 | 77.2 Ų | 77.2 | 13% | 0.126 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -61.2 | -40.3 | 179.1 | -167.1 | 69 | 0 | 0 | 0 | 111.8 | W46 R47 S52 G53 S54 L100 I103 Q104 L107 | W46-L50 PolarHBondContact O-N 2.94Å; R47-L50 PolarHBondContact O-N 3.24Å; L50-S52 VanDerWaalsContact C-N 3.26Å; L50-S52 PolarHBondContact O-N 3.45Å; L50-G53 PolarHBondContact O-N 2.9Å; L50-S54 PolarHBondContact O-N 3.01Å; L50-L100 HydrophobicContact CD1-CD2 4.05Å; L50-I103 HydrophobicContact CD2-CG2 4.21Å; L50-Q104 HydrophobicContact CD2-CB 4.17Å; L50-L107 HydrophobicContact CD2-CD1 3.92Å |
| 51 | S | 71.3 | Confident | 68.5 | Low | 53 Ų | 53 | 79.6 Ų | 79.6 | 37% | 0.371 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -67.7 | -22.6 | 174.5 | -177.1 | 0 | 0 | 0 | 0 | 113.8 | R47 V48 W49 S54 | R47-S51 WeakPolarHBondContact O-CB 2.94Å; R47-S51 PolarHBondContact O-N 2.91Å; V48-S51 PolarHBondContact O-N 2.71Å; W49-S51 VanDerWaalsContact C-N 3.3Å; W49-S51 PolarHBondContact O-N 3.2Å; S51-S54 PolarHBondContact O-OG 3.39Å |
| 52 | S | 68.9 | Low | 66.6 | Low | 61 Ų | 61 | 83.1 Ų | 83.1 | 43% | 0.427 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -83.7 | -35.8 | 176.1 | -58.3 | 0 | 0 | 0 | 0 | 111.1 | V48 W49 L50 S54 R55 L56 | V48-S52 PolarHBondContact O-N 3.41Å; V48-S52 PolarHBondContact O-OG 3.41Å; W49-S52 WeakPolarHBondContact O-CB 3.22Å; W49-S52 PolarHBondContact O-N 3.34Å; L50-S52 VanDerWaalsContact C-N 3.26Å; L50-S52 PolarHBondContact O-N 3.45Å; S52-S54 VanDerWaalsContact C-N 3.33Å; S52-S54 PolarHBondContact O-N 3.03Å; S52-R55 PolarHBondContact O-N 2.85Å; S52-L56 PolarHBondContact O-N 3.26Å |
| 53 | G | 64.4 | Low | 64.6 | Low | 36 Ų | 36 | 90.5 Ų | 90.5 | 37% | 0.371 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.3 | -35.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | W49 L50 R55 L56 A57 | W49-G53 PolarHBondContact O-N 2.86Å; L50-G53 PolarHBondContact O-N 2.9Å; G53-R55 VanDerWaalsContact C-N 3.32Å; G53-R55 PolarHBondContact O-N 3.28Å; G53-L56 PolarHBondContact O-N 3.35Å; G53-A57 PolarHBondContact O-N 3.38Å |
| 54 | S | 57.7 | Low | 62.6 | Low | 63 Ų | 63 | 94.2 Ų | 94.2 | 44% | 0.441 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70.6 | -24 | 176.6 | 53.7 | 0 | 0 | 0 | 0 | 114 | L50 S51 S52 | L50-S54 PolarHBondContact O-N 3.01Å; S51-S54 PolarHBondContact O-OG 3.39Å; S52-S54 VanDerWaalsContact C-N 3.33Å; S52-S54 PolarHBondContact O-N 3.03Å |
| 55 | R | 54.1 | Low | 60.7 | Low | 192 Ų | 192 | 94.4 Ų | 94.4 | 73% | 0.725 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -77.7 | -28.7 | 174.5 | -75.2 | -174.8 | 173.7 | -108.6 | 1.2 | 113.4 | S52 G53 A57 Q58 | S52-R55 PolarHBondContact O-N 2.85Å; G53-R55 VanDerWaalsContact C-N 3.32Å; G53-R55 PolarHBondContact O-N 3.28Å; R55-A57 VanDerWaalsContact C-N 3.34Å; R55-Q58 PolarHBondContact O-N 3.39Å |
| 56 | L | 54.3 | Low | 58.8 | Low | 154 Ų | 154 | 97.6 Ų | 97.6 | 81% | 0.806 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -75.2 | -24.9 | 175.6 | -70 | 169.6 | 0 | 0 | 0 | 112.5 | S52 G53 Q58 | S52-L56 PolarHBondContact O-N 3.26Å; G53-L56 PolarHBondContact O-N 3.35Å; L56-Q58 VanDerWaalsContact C-N 3.27Å |
| 57 | A | 48.2 | Very low | 57.1 | Low | 81 Ų | 81 | 98.9 Ų | 98.9 | 67% | 0.669 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.3 | -4.9 | 175 | 0 | 0 | 0 | 0 | 0 | 113.6 | G53 R55 P59 | G53-A57 PolarHBondContact O-N 3.38Å; R55-A57 VanDerWaalsContact C-N 3.34Å; A57-P59 WeakPolarHBondContact O-CD 3.23Å |
| 58 | Q | 42.2 | Very low | 54.7 | Low | 140 Ų | 140 | 100.8 Ų | 100.8 | 65% | 0.654 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -87.8 | 102 | 170.8 | -152.2 | 168 | 9 | 0 | 0 | 106.7 | R55 L56 | R55-Q58 PolarHBondContact O-N 3.39Å; L56-Q58 VanDerWaalsContact C-N 3.27Å |
| 59 | P | 43.9 | Very low | 52.3 | Low | 97 Ų | 97 | 100.3 Ų | 100.3 | 63% | 0.63 | 64% | 0.636 | S | S | * | * | trans | -53.4 | 142.8 | 167.9 | 24 | -32.2 | 0 | 0 | 0 | 107.2 | A57 S61 | A57-P59 WeakPolarHBondContact O-CD 3.23Å; P59-S61 VanDerWaalsContact C-N 3.33Å; P59-S61 PolarHBondContact O-N 3.48Å | ||
| 60 | P | 47.6 | Very low | 50.3 | Low | 128 Ų | 128 | 107.6 Ų | 107.6 | 83% | 0.831 | 66% | 0.663 | S | S | * | * | trans | -53 | 107.1 | 172.3 | 21.4 | -29.7 | 0 | 0 | 0 | 106.3 | A62 | P60-A62 PolarHBondContact O-N 2.88Š| ||
| 61 | S | 45.5 | Very low | 48.2 | Very low | 86 Ų | 86 | 113.1 Ų | 113.1 | 60% | 0.601 | 70% | 0.699 | S | S | * | * | trans | -57 | 116.1 | 175.4 | 51.2 | 0 | 0 | 0 | 0 | 105.1 | P59 Y63 | P59-S61 VanDerWaalsContact C-N 3.33Å; P59-S61 PolarHBondContact O-N 3.48Å; S61-Y63 PolarHBondContact O-N 2.87Å | ||
| 62 | A | 51.4 | Low | 46.4 | Very low | 95 Ų | 95 | 119.1 Ų | 119.1 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -67.2 | 53.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | P60 | P60-A62 PolarHBondContact O-N 2.88Š|
| 63 | Y | 47.4 | Very low | 44.5 | Very low | 208 Ų | 208 | 121.5 Ų | 121.5 | 82% | 0.816 | 74% | 0.738 | S | S | * | * | trans | -132.7 | 52.7 | 177.4 | -84 | -80.8 | 0 | 0 | 0 | 108.4 | S61 A65 | S61-Y63 PolarHBondContact O-N 2.87Å; Y63-A65 VanDerWaalsContact C-N 3.35Å | ||
| 64 | A | 45.6 | Very low | 42.7 | Very low | 107 Ų | 107 | 124.9 Ų | 124.9 | 88% | 0.884 | 76% | 0.755 | S | S | * | * | trans | -102.5 | 65.9 | 145.2 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 65 | A | 48 | Very low | 41.5 | Very low | 82 Ų | 82 | 127.2 Ų | 127.2 | 68% | 0.678 | 77% | 0.771 | S | S | * | * | trans | -126.7 | 103.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | Y63 | Y63-A65 VanDerWaalsContact C-N 3.35Š| ||
| 66 | A | 44.3 | Very low | 40.4 | Very low | 95 Ų | 95 | 122.3 Ų | 122.3 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | trans | 145.5 | 153.9 | 142.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 67 | P | 47.8 | Very low | 39.8 | Very low | 113 Ų | 113 | 122.4 Ų | 122.4 | 73% | 0.734 | 77% | 0.773 | S | S | * | * | cis | -137 | 171.6 | -20.6 | 30.1 | -8.3 | 0 | 0 | 0 | 115.2 | ||||
| 68 | S | 35.4 | Very low | 39 | Very low | 120 Ų | 120 | 126.4 Ų | 126.4 | 84% | 0.839 | 78% | 0.783 | S | S | * | * | trans | 67.5 | 94.7 | 148.4 | 49.4 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 69 | G | 31.3 | Very low | 38.7 | Very low | 82 Ų | 82 | 124.4 Ų | 124.4 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | trans | -139.5 | 101.7 | 153.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 70 | R | 33 | Very low | 38.4 | Very low | 242 Ų | 242 | 124.9 Ų | 124.9 | 91% | 0.913 | 80% | 0.796 | S | S | * | * | trans | -57.7 | 129.4 | -177.6 | -174.1 | 176.2 | -173.8 | 168.5 | 0.1 | 112.4 | ||||
| 71 | T | 30.6 | Very low | 38.2 | Very low | 141 Ų | 141 | 124.2 Ų | 124.2 | 87% | 0.865 | 79% | 0.792 | S | S | * | * | trans | -170.4 | 138.4 | 143.8 | -69.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 72 | E | 32.7 | Very low | 37.9 | Very low | 178 Ų | 178 | 125.1 Ų | 125.1 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | trans | -76.7 | 143.8 | -167.1 | -52.8 | 178.3 | 106.3 | 0 | 0 | 113.4 | ||||
| 73 | S | 29.2 | Very low | 37.2 | Very low | 112 Ų | 112 | 129.9 Ų | 129.9 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | 167.4 | 129.4 | 121.6 | -78.2 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 74 | S | 27.1 | Very low | 37 | Very low | 106 Ų | 106 | 125.8 Ų | 125.8 | 74% | 0.741 | 81% | 0.806 | S | S | * | * | trans | 69.2 | 109.1 | 142 | 51 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 75 | S | 32.5 | Very low | 36.5 | Very low | 112 Ų | 112 | 125.2 Ų | 125.2 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | 62.1 | 108.6 | 128.1 | 64.1 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 76 | A | 30.8 | Very low | 36.4 | Very low | 90 Ų | 90 | 128 Ų | 128 | 74% | 0.744 | 80% | 0.798 | S | S | * | * | 166.8 | 119.8 | 102.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 77 | L | 41 | Very low | 36.2 | Very low | 155 Ų | 155 | 129 Ų | 129 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | trans | 35.2 | 107.8 | 138.1 | -52.6 | 169.1 | 0 | 0 | 0 | 117.7 | ||||
| 78 | N | 32 | Very low | 35.8 | Very low | 165 Ų | 165 | 130 Ų | 130 | 88% | 0.882 | 80% | 0.801 | S | S | * | * | -175.5 | 135.9 | 105 | -91.5 | -13.7 | 0 | 0 | 0 | 111.9 | |||||
| 79 | A | 35.9 | Very low | 36.1 | Very low | 99 Ų | 99 | 129.7 Ų | 129.7 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -69.8 | 144 | -180 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 80 | S | 37.3 | Very low | 36.8 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | trans | -58.3 | 157.8 | 161.9 | -158.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 81 | P | 43.3 | Very low | 37.2 | Very low | 115 Ų | 115 | 129 Ų | 129 | 75% | 0.747 | 79% | 0.788 | S | S | * | * | -148.3 | 141.5 | 82.4 | 33.8 | -13.1 | 0 | 0 | 0 | 115.9 | |||||
| 82 | S | 40 | Very low | 38 | Very low | 105 Ų | 105 | 129.9 Ų | 129.9 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | 43.2 | 105.2 | 138.1 | -53.8 | 0 | 0 | 0 | 0 | 120 | ||||
| 83 | E | 35.4 | Very low | 38.4 | Very low | 195 Ų | 195 | 126 Ų | 126 | 91% | 0.911 | 77% | 0.773 | S | S | * | * | trans | -121.3 | 89.4 | 140.8 | -69.3 | -145.3 | 105.3 | 0 | 0 | 109.2 | S85 | E83-S85 PolarHBondContact O-N 3.33Š| ||
| 84 | S | 43 | Very low | 39.5 | Very low | 122 Ų | 122 | 124.6 Ų | 124.6 | 85% | 0.853 | 76% | 0.761 | S | S | * | * | trans | -71.5 | 103.6 | 152.2 | 162.3 | 0 | 0 | 0 | 0 | 107 | ||||
| 85 | S | 35.9 | Very low | 40.9 | Very low | 95 Ų | 95 | 130 Ų | 130 | 66% | 0.664 | 77% | 0.765 | S | S | * | * | trans | -139.2 | 97.1 | 160.7 | -173.9 | 0 | 0 | 0 | 0 | 109.7 | E83 | E83-S85 PolarHBondContact O-N 3.33Š| ||
| 86 | L | 46.3 | Very low | 42.4 | Very low | 141 Ų | 141 | 128.9 Ų | 128.9 | 74% | 0.738 | 75% | 0.75 | S | S | * | * | trans | 34.8 | 115.9 | 131.4 | -61.7 | 168.5 | 0 | 0 | 0 | 117.1 | ||||
| 87 | T | 39.6 | Very low | 44.3 | Very low | 115 Ų | 115 | 126.9 Ų | 126.9 | 71% | 0.706 | 73% | 0.731 | S | S | * | * | trans | 58.8 | 102.5 | 147.8 | 59.1 | 0 | 0 | 0 | 0 | 116.2 | T89 | T87-T89 VanDerWaalsContact C-N 3.31Å; T87-T89 PolarHBondContact O-N 3.31Å | ||
| 88 | P | 39.3 | Very low | 46 | Very low | 133 Ų | 133 | 128.1 Ų | 128.1 | 86% | 0.864 | 73% | 0.725 | S | S | * | * | trans | -63.6 | 105 | 147.1 | -1.8 | 19 | 0 | 0 | 0 | 106 | E90 | P88-E90 PolarHBondContact O-N 3.47Š| ||
| 89 | T | 42.5 | Very low | 48.3 | Very low | 114 Ų | 114 | 124 Ų | 124 | 70% | 0.699 | 70% | 0.703 | S | S | * | * | trans | -21.7 | 117.6 | 157.9 | -59.9 | 0 | 0 | 0 | 0 | 110.9 | T87 T91 | T87-T89 VanDerWaalsContact C-N 3.31Å; T87-T89 PolarHBondContact O-N 3.31Å; T89-T91 VanDerWaalsContact C-N 3.27Å; T89-T91 PolarHBondContact O-N 3.01Å; T89-T91 PolarHBondContact O-OG1 3.4Å; T89-T91 VanDerWaalsContact O-OG1 3.1Å | ||
| 90 | E | 45.3 | Very low | 50.3 | Low | 180 Ų | 180 | 123.2 Ų | 123.2 | 84% | 0.841 | 68% | 0.684 | S | S | * | * | trans | -36.5 | 91.1 | 163.5 | -176 | 170 | 112.4 | 0 | 0 | 110 | P88 Q92 | P88-E90 PolarHBondContact O-N 3.47Å; E90-Q92 PolarHBondContact O-N 2.89Å | ||
| 91 | T | 42.6 | Very low | 52.5 | Low | 130 Ų | 130 | 123.6 Ų | 123.6 | 80% | 0.798 | 67% | 0.674 | S | S | * | * | trans | -84.2 | 86.2 | 168.9 | -38.9 | 0 | 0 | 0 | 0 | 103.8 | T89 | T89-T91 VanDerWaalsContact C-N 3.27Å; T89-T91 PolarHBondContact O-N 3.01Å; T89-T91 PolarHBondContact O-OG1 3.4Å; T89-T91 VanDerWaalsContact O-OG1 3.1Å | ||
| 92 | Q | 45.8 | Very low | 54.5 | Low | 160 Ų | 160 | 121 Ų | 121 | 75% | 0.748 | 66% | 0.656 | S | S | * | * | trans | -20 | 110.1 | 168.9 | -166.8 | 173.5 | 46.5 | 0 | 0 | 110.1 | E90 | E90-Q92 PolarHBondContact O-N 2.89Š| ||
| 93 | P | 42.6 | Very low | 56.7 | Low | 97 Ų | 97 | 119.9 Ų | 119.9 | 63% | 0.63 | 64% | 0.641 | S | S | * | * | trans | -58.4 | 125.2 | 175.4 | 24.3 | -31.1 | 0 | 0 | 0 | 104.9 | R95 | P93-R95 PolarHBondContact O-N 3.15Š| ||
| 94 | P | 51.9 | Low | 59.1 | Low | 82 Ų | 82 | 114.2 Ų | 114.2 | 53% | 0.532 | 61% | 0.614 | S | S | . | * | trans | -58.1 | 136 | -173.3 | 27.9 | -36.3 | 0 | 0 | 0 | 106.7 | N96 S97 | P94-N96 WeakPolarHBondContact CA-OD1 3.36Å; P94-N96 WeakPolarHBondContact CB-OD1 3.34Å; P94-N96 WeakPolarHBondContact CG-OD1 3.41Å; P94-N96 PolarHBondContact O-N 3.35Å; P94-N96 PolarHBondContact O-OD1 3.27Å; P94-S97 PolarHBondContact O-N 3.43Å | ||
| 95 | R | 56.1 | Low | 61.1 | Low | 219 Ų | 219 | 112.5 Ų | 112.5 | 83% | 0.826 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -52.6 | -17.8 | -170.7 | -151.4 | 173.5 | 82.5 | -169.5 | 7.1 | 113.3 | P93 L99 | P93-R95 PolarHBondContact O-N 3.15Å; R95-L99 WeakPolarHBondContact O-CG 3.3Å |
| 96 | N | 64.6 | Low | 63.6 | Low | 88 Ų | 88 | 111.6 Ų | 111.6 | 47% | 0.471 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -70.6 | -27.7 | 173.4 | 53.6 | 3 | 0 | 0 | 0 | 114.3 | P94 L99 L100 | P94-N96 WeakPolarHBondContact CA-OD1 3.36Å; P94-N96 WeakPolarHBondContact CB-OD1 3.34Å; P94-N96 WeakPolarHBondContact CG-OD1 3.41Å; P94-N96 PolarHBondContact O-N 3.35Å; P94-N96 PolarHBondContact O-OD1 3.27Å; N96-L99 PolarHBondContact O-N 2.9Å; N96-L100 WeakPolarHBondContact O-CB 3.41Å; N96-L100 WeakPolarHBondContact O-CG 3.23Å; N96-L100 PolarHBondContact O-N 2.93Å |
| 97 | S | 69.2 | Low | 65.6 | Low | 48 Ų | 48 | 106 Ų | 106 | 34% | 0.336 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.2 | -44.8 | 178.8 | -173.9 | 0 | 0 | 0 | 0 | 112 | P94 L100 H101 | P94-S97 PolarHBondContact O-N 3.43Å; S97-L100 PolarHBondContact O-N 2.9Å; S97-H101 PolarHBondContact O-N 2.92Å; S97-H101 PolarHBondContact O-ND1 3.42Å |
| 98 | W | 77.9 | Confident | 67.9 | Low | 182 Ų | 182 | 104.3 Ų | 104.3 | 69% | 0.689 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.9 | -41.5 | 175.8 | -175.7 | 82.2 | 0 | 0 | 0 | 112 | L100 H101 V102 | W98-L100 VanDerWaalsContact C-N 3.33Å; W98-L100 PolarHBondContact O-N 3.48Å; W98-H101 WeakPolarHBondContact O-CB 3.39Å; W98-H101 PolarHBondContact O-N 3.41Å; W98-V102 HydrophobicContact CD2-CG2 4.02Å; W98-V102 HydrophobicContact CE3-CG2 4.13Å; W98-V102 HydrophobicContact CH2-CG2 4.02Å; W98-V102 HydrophobicContact CZ2-CG2 3.89Å; W98-V102 HydrophobicContact CZ3-CG2 4.13Å; W98-V102 WeakPolarHBondContact O-CG2 3.37Å; W98-V102 PolarHBondContact O-N 3.47Å |
| 99 | L | 80.2 | Confident | 70.3 | Confident | 78 Ų | 78 | 102.2 Ų | 102.2 | 41% | 0.408 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.6 | -38.9 | 174.5 | -70.3 | 171.1 | 0 | 0 | 0 | 112.2 | R95 N96 H101 V102 I103 | R95-L99 WeakPolarHBondContact O-CG 3.3Å; N96-L99 PolarHBondContact O-N 2.9Å; L99-H101 VanDerWaalsContact C-N 3.35Å; L99-V102 PolarHBondContact O-N 3.43Å; L99-I103 WeakPolarHBondContact O-CB 3.36Å; L99-I103 WeakPolarHBondContact O-CD1 3.43Å; L99-I103 WeakPolarHBondContact O-CG1 3.3Å; L99-I103 PolarHBondContact O-N 2.95Å |
| 100 | L | 78.2 | Confident | 72.4 | Confident | 82 Ų | 82 | 100.5 Ų | 100.5 | 43% | 0.429 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64 | -40 | 174.6 | -72.6 | 169.5 | 0 | 0 | 0 | 111.4 | L50 N96 S97 W98 I103 Q104 | L50-L100 HydrophobicContact CD1-CD2 4.05Å; N96-L100 WeakPolarHBondContact O-CB 3.41Å; N96-L100 WeakPolarHBondContact O-CG 3.23Å; N96-L100 PolarHBondContact O-N 2.93Å; S97-L100 PolarHBondContact O-N 2.9Å; W98-L100 VanDerWaalsContact C-N 3.33Å; W98-L100 PolarHBondContact O-N 3.48Å; L100-I103 PolarHBondContact O-N 2.9Å; L100-Q104 VanDerWaalsContact O-CB 3.22Å; L100-Q104 WeakPolarHBondContact O-CB 3.46Å; L100-Q104 PolarHBondContact O-N 3.49Å |
| 101 | H | 82.4 | Confident | 74.6 | Confident | 115 Ų | 115 | 93.6 Ų | 93.6 | 53% | 0.532 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.7 | -44.3 | 173.4 | -76.8 | 73 | 0 | 0 | 0 | 111.6 | S97 W98 L99 Q104 T105 | S97-H101 PolarHBondContact O-N 2.92Å; S97-H101 PolarHBondContact O-ND1 3.42Å; W98-H101 WeakPolarHBondContact O-CB 3.39Å; W98-H101 PolarHBondContact O-N 3.41Å; L99-H101 VanDerWaalsContact C-N 3.35Å; H101-Q104 PolarHBondContact O-N 3.37Å; H101-T105 WeakPolarHBondContact O-CG2 3.45Å; H101-T105 PolarHBondContact O-N 3.48Å; H101-T105 PolarHBondContact O-OG1 3.04Å |
| 102 | V | 86.3 | Confident | 76.9 | Confident | 60 Ų | 60 | 90.1 Ų | 90.1 | 36% | 0.364 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.6 | -42.4 | 177.3 | 173.2 | 0 | 0 | 0 | 0 | 111.8 | W98 L99 Q104 T105 C106 | W98-V102 HydrophobicContact CD2-CG2 4.02Å; W98-V102 HydrophobicContact CE3-CG2 4.13Å; W98-V102 HydrophobicContact CH2-CG2 4.02Å; W98-V102 HydrophobicContact CZ2-CG2 3.89Å; W98-V102 HydrophobicContact CZ3-CG2 4.13Å; W98-V102 WeakPolarHBondContact O-CG2 3.37Å; W98-V102 PolarHBondContact O-N 3.47Å; L99-V102 PolarHBondContact O-N 3.43Å; V102-Q104 VanDerWaalsContact C-N 3.34Å; V102-T105 PolarHBondContact O-N 2.77Å; V102-T105 PolarHBondContact O-OG1 2.9Å; V102-C106 WeakPolarHBondContact O-CB 3.38Å; V102-C106 PolarHBondContact O-N 3.27Å |
| 103 | I | 85.4 | Confident | 78.8 | Confident | 81 Ų | 81 | 85.4 Ų | 85.4 | 42% | 0.415 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.8 | -41.8 | 176.7 | -71 | 163.8 | 0 | 0 | 0 | 110.1 | L50 L99 L100 C106 L107 | L50-I103 HydrophobicContact CD2-CG2 4.21Å; L99-I103 WeakPolarHBondContact O-CB 3.36Å; L99-I103 WeakPolarHBondContact O-CD1 3.43Å; L99-I103 WeakPolarHBondContact O-CG1 3.3Å; L99-I103 PolarHBondContact O-N 2.95Å; L100-I103 PolarHBondContact O-N 2.9Å; I103-C106 PolarHBondContact O-N 3.2Å; I103-L107 HydrophobicContact CG2-CD1 3.74Å; I103-L107 HydrophobicContact CG2-CG 4.21Å; I103-L107 WeakPolarHBondContact O-CB 3.3Å; I103-L107 VanDerWaalsContact O-CG 3.23Å; I103-L107 WeakPolarHBondContact O-CG 3.23Å; I103-L107 PolarHBondContact O-N 2.96Å |
| 104 | Q | 85 | Confident | 81 | Confident | 77 Ų | 77 | 81.5 Ų | 81.5 | 36% | 0.36 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 177.7 | -179.9 | 179.3 | -30.5 | 0 | 0 | 112.2 | L50 L100 H101 V102 H108 | L50-Q104 HydrophobicContact CD2-CB 4.17Å; L100-Q104 VanDerWaalsContact O-CB 3.22Å; L100-Q104 WeakPolarHBondContact O-CB 3.46Å; L100-Q104 PolarHBondContact O-N 3.49Å; H101-Q104 PolarHBondContact O-N 3.37Å; V102-Q104 VanDerWaalsContact C-N 3.34Å; Q104-H108 WeakPolarHBondContact O-CB 3.38Å; Q104-H108 PolarHBondContact O-N 3.48Å |
| 105 | T | 86.7 | Confident | 82.9 | Confident | 85 Ų | 85 | 78.8 Ų | 78.8 | 52% | 0.521 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -69 | -40.6 | 176.6 | 55.6 | 0 | 0 | 0 | 0 | 111.5 | H101 V102 H108 V109 | H101-T105 WeakPolarHBondContact O-CG2 3.45Å; H101-T105 PolarHBondContact O-N 3.48Å; H101-T105 PolarHBondContact O-OG1 3.04Å; V102-T105 PolarHBondContact O-N 2.77Å; V102-T105 PolarHBondContact O-OG1 2.9Å; T105-H108 WeakPolarHBondContact O-CB 3.45Å; T105-H108 PolarHBondContact O-N 3.22Å; T105-V109 WeakPolarHBondContact O-CG2 3.27Å; T105-V109 PolarHBondContact O-N 2.88Å |
| 106 | C | 87.3 | Confident | 84.5 | Confident | 77 Ų | 77 | 75.5 Ų | 75.5 | 52% | 0.52 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 175.1 | -178.8 | 0 | 0 | 0 | 0 | 112 | V102 I103 H108 V109 L110 | V102-C106 WeakPolarHBondContact O-CB 3.38Å; V102-C106 PolarHBondContact O-N 3.27Å; I103-C106 PolarHBondContact O-N 3.2Å; C106-H108 VanDerWaalsContact C-N 3.26Å; C106-H108 PolarHBondContact O-N 3.39Å; C106-V109 PolarHBondContact O-N 3.02Å; C106-L110 WeakPolarHBondContact O-CB 3.43Å; C106-L110 PolarHBondContact O-N 3.31Å |
| 107 | L | 88.4 | Confident | 85.5 | Confident | 23 Ų | 23 | 73.8 Ų | 73.8 | 12% | 0.12 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60.7 | -36.3 | 175.5 | -73.1 | 170.9 | 0 | 0 | 0 | 111.9 | L43 L50 I103 Q111 | L43-L107 HydrophobicContact CD2-CD2 3.77Å; L50-L107 HydrophobicContact CD2-CD1 3.92Å; I103-L107 HydrophobicContact CG2-CD1 3.74Å; I103-L107 HydrophobicContact CG2-CG 4.21Å; I103-L107 WeakPolarHBondContact O-CB 3.3Å; I103-L107 VanDerWaalsContact O-CG 3.23Å; I103-L107 WeakPolarHBondContact O-CG 3.23Å; I103-L107 PolarHBondContact O-N 2.96Å; L107-Q111 VanDerWaalsContact O-CB 3.29Å; L107-Q111 WeakPolarHBondContact O-CB 3.36Å; L107-Q111 PolarHBondContact O-N 3.32Å |
| 108 | H | 89.2 | Confident | 86.4 | Confident | 80 Ų | 80 | 72.2 Ų | 72.2 | 37% | 0.37 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.1 | -50.9 | 175.2 | 172.7 | 50.7 | 0 | 0 | 0 | 112.1 | R47 Q104 T105 C106 L110 Q111 V112 | R47-H108 VanDerWaalsContact CZ-ND1 3.32Å; R47-H108 PolarHBondContact NH1-ND1 2.87Å; R47-H108 VanDerWaalsContact NH1-ND1 3.12Å; R47-H108 PolarHBondContact NH2-ND1 3.32Å; R47-H108 VanDerWaalsContact NH2-ND1 3.11Å; Q104-H108 WeakPolarHBondContact O-CB 3.38Å; Q104-H108 PolarHBondContact O-N 3.48Å; T105-H108 WeakPolarHBondContact O-CB 3.45Å; T105-H108 PolarHBondContact O-N 3.22Å; C106-H108 VanDerWaalsContact C-N 3.26Å; C106-H108 PolarHBondContact O-N 3.39Å; H108-L110 VanDerWaalsContact C-N 3.34Å; H108-L110 PolarHBondContact O-N 3.44Å; H108-Q111 PolarHBondContact O-N 3.34Å; H108-V112 WeakPolarHBondContact O-CG2 3.36Å; H108-V112 PolarHBondContact O-N 2.89Å |
| 109 | V | 88 | Confident | 87 | Confident | 89 Ų | 89 | 68.7 Ų | 68.7 | 54% | 0.539 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.7 | -47.7 | 178.2 | 174.2 | 0 | 0 | 0 | 0 | 109.9 | T105 C106 Q111 V112 T113 | T105-V109 WeakPolarHBondContact O-CG2 3.27Å; T105-V109 PolarHBondContact O-N 2.88Å; C106-V109 PolarHBondContact O-N 3.02Å; V109-Q111 PolarHBondContact O-N 3.36Å; V109-V112 PolarHBondContact O-N 3.24Å; V109-T113 PolarHBondContact O-N 3.41Å; V109-T113 PolarHBondContact O-OG1 2.82Å |
| 110 | L | 87.9 | Confident | 87.2 | Confident | 77 Ų | 77 | 69.7 Ų | 69.7 | 40% | 0.403 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -58.8 | -44.7 | 178.4 | -175.8 | 64.4 | 0 | 0 | 0 | 112.1 | L43 C106 H108 V112 T113 L114 | L43-L110 HydrophobicContact CD1-CD2 3.75Å; L43-L110 HydrophobicContact CD1-CG 4.15Å; L43-L110 HydrophobicContact CD2-CD2 4.42Å; C106-L110 WeakPolarHBondContact O-CB 3.43Å; C106-L110 PolarHBondContact O-N 3.31Å; H108-L110 VanDerWaalsContact C-N 3.34Å; H108-L110 PolarHBondContact O-N 3.44Å; L110-V112 PolarHBondContact O-N 3.34Å; L110-T113 PolarHBondContact O-N 2.95Å; L110-L114 HydrophobicContact CD1-CD1 4.43Å; L110-L114 HydrophobicContact CD1-CG 4.37Å; L110-L114 HydrophobicContact CG-CD1 4.15Å; L110-L114 HydrophobicContact CG-CG 4.48Å; L110-L114 WeakPolarHBondContact O-CB 3.28Å; L110-L114 VanDerWaalsContact O-CG 3.28Å; L110-L114 WeakPolarHBondContact O-CG 3.45Å; L110-L114 PolarHBondContact O-N 3.4Å |
| 111 | Q | 90.9 | Very high | 87.6 | Confident | 35 Ų | 35 | 66.1 Ų | 66.1 | 16% | 0.164 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -61.1 | -44.6 | 177.3 | -174.1 | -164 | -10.3 | 0 | 0 | 111.7 | F40 L107 H108 V109 L114 G115 | F40-Q111 HydrophobicContact CD2-CG 4.43Å; F40-Q111 HydrophobicContact CE2-CG 3.94Å; L107-Q111 VanDerWaalsContact O-CB 3.29Å; L107-Q111 WeakPolarHBondContact O-CB 3.36Å; L107-Q111 PolarHBondContact O-N 3.32Å; H108-Q111 PolarHBondContact O-N 3.34Å; V109-Q111 PolarHBondContact O-N 3.36Å; Q111-L114 PolarHBondContact O-N 3.12Å; Q111-G115 PolarHBondContact O-N 2.94Å |
| 112 | V | 90.4 | Very high | 87.7 | Confident | 58 Ų | 58 | 63.5 Ų | 63.5 | 35% | 0.352 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.1 | -46.2 | 178.9 | 171.5 | 0 | 0 | 0 | 0 | 110.1 | H108 V109 L110 L114 G115 Y116 | H108-V112 WeakPolarHBondContact O-CG2 3.36Å; H108-V112 PolarHBondContact O-N 2.89Å; V109-V112 PolarHBondContact O-N 3.24Å; L110-V112 PolarHBondContact O-N 3.34Å; V112-L114 PolarHBondContact O-N 2.84Å; V112-G115 PolarHBondContact O-N 3.21Å; V112-Y116 HydrophobicContact CG1-CD2 3.65Å; V112-Y116 HydrophobicContact CG1-CE2 3.34Å; V112-Y116 WeakPolarHBondContact O-CD2 3.41Å; V112-Y116 PolarHBondContact O-N 2.73Å |
| 113 | T | 86.7 | Confident | 87.7 | Confident | 61 Ų | 61 | 65.7 Ų | 65.7 | 37% | 0.374 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -57.6 | -50.9 | 175.8 | -57.6 | 0 | 0 | 0 | 0 | 111.4 | V109 L110 G115 Y116 M117 | V109-T113 PolarHBondContact O-N 3.41Å; V109-T113 PolarHBondContact O-OG1 2.82Å; L110-T113 PolarHBondContact O-N 2.95Å; T113-G115 VanDerWaalsContact C-N 3.32Å; T113-G115 PolarHBondContact O-N 2.87Å; T113-Y116 PolarHBondContact O-N 2.93Å; T113-M117 HydrophobicContact CG2-CE 4Å; T113-M117 HydrophobicContact CG2-CG 4.48Å; T113-M117 VanDerWaalsContact O-CG 3.29Å; T113-M117 WeakPolarHBondContact O-CG 3.23Å; T113-M117 PolarHBondContact O-N 3.11Å |
| 114 | L | 89.2 | Confident | 87.3 | Confident | 15 Ų | 15 | 63.8 Ų | 63.8 | 8% | 0.079 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61.6 | -38.1 | 178.6 | -70.1 | 177.5 | 0 | 0 | 0 | 112.7 | L36 V39 F40 L43 L110 Q111 V112 M117 L118 | L36-L114 HydrophobicContact CD1-CD2 3.39Å; L36-L114 HydrophobicContact CD2-CD2 4.27Å; L36-L114 HydrophobicContact CG-CD2 3.77Å; V39-L114 HydrophobicContact CG1-CD1 4.37Å; F40-L114 HydrophobicContact CB-CB 4.46Å; F40-L114 HydrophobicContact CD2-CB 3.82Å; L43-L114 HydrophobicContact CD1-CD1 3.42Å; L43-L114 VanDerWaalsContact CD1-CD1 3.42Å; L110-L114 HydrophobicContact CD1-CD1 4.43Å; L110-L114 HydrophobicContact CD1-CG 4.37Å; L110-L114 HydrophobicContact CG-CD1 4.15Å; L110-L114 HydrophobicContact CG-CG 4.48Å; L110-L114 WeakPolarHBondContact O-CB 3.28Å; L110-L114 VanDerWaalsContact O-CG 3.28Å; L110-L114 WeakPolarHBondContact O-CG 3.45Å; L110-L114 PolarHBondContact O-N 3.4Å; Q111-L114 PolarHBondContact O-N 3.12Å; V112-L114 PolarHBondContact O-N 2.84Å; L114-M117 PolarHBondContact O-N 2.89Å; L114-L118 WeakPolarHBondContact O-CB 3.43Å; L114-L118 WeakPolarHBondContact O-CG 3.3Å; L114-L118 PolarHBondContact O-N 2.97Å |
| 115 | G | 91.4 | Very high | 86.8 | Confident | 24 Ų | 24 | 66.6 Ų | 66.6 | 25% | 0.247 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -61.1 | -44.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q111 V112 T113 L118 M119 | Q111-G115 PolarHBondContact O-N 2.94Å; V112-G115 PolarHBondContact O-N 3.21Å; T113-G115 VanDerWaalsContact C-N 3.32Å; T113-G115 PolarHBondContact O-N 2.87Å; G115-L118 PolarHBondContact O-N 3.27Å; G115-M119 WeakPolarHBondContact O-CB 3.29Å; G115-M119 PolarHBondContact O-N 3.3Å |
| 116 | Y | 89 | Confident | 86.6 | Confident | 151 Ų | 151 | 62.7 Ų | 62.7 | 59% | 0.592 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -67.3 | -37.9 | 174 | -74.1 | -62.1 | 0 | 0 | 0 | 112.5 | V112 T113 L118 M119 L120 | V112-Y116 HydrophobicContact CG1-CD2 3.65Å; V112-Y116 HydrophobicContact CG1-CE2 3.34Å; V112-Y116 WeakPolarHBondContact O-CD2 3.41Å; V112-Y116 PolarHBondContact O-N 2.73Å; T113-Y116 PolarHBondContact O-N 2.93Å; Y116-L118 PolarHBondContact O-N 3.41Å; Y116-M119 PolarHBondContact O-N 3.45Å; Y116-L120 WeakPolarHBondContact O-CB 3.46Å; Y116-L120 WeakPolarHBondContact O-CG 3.27Å; Y116-L120 PolarHBondContact O-N 2.83Å |
| 117 | M | 84.8 | Confident | 86.4 | Confident | 51 Ų | 51 | 62.9 Ų | 62.9 | 25% | 0.251 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -59.1 | -47.3 | 173.5 | -63.2 | -41.4 | -161.5 | 0 | 0 | 111.4 | L14 L36 T113 L114 M119 L120 C121 | L14-M117 HydrophobicContact CD1-CE 3.27Å; L14-M117 HydrophobicContact CD1-CG 4.38Å; L14-M117 HydrophobicContact CD1-SD 3.17Å; L14-M117 WeakPolarHBondContact CD1-SD 3.42Å; L14-M117 HydrophobicContact CD2-CE 3.5Å; L14-M117 HydrophobicContact CG-CE 3.94Å; L14-M117 HydrophobicContact CG-SD 4.41Å; L36-M117 HydrophobicContact CD2-CB 3.97Å; T113-M117 HydrophobicContact CG2-CE 4Å; T113-M117 HydrophobicContact CG2-CG 4.48Å; T113-M117 VanDerWaalsContact O-CG 3.29Å; T113-M117 WeakPolarHBondContact O-CG 3.23Å; T113-M117 PolarHBondContact O-N 3.11Å; L114-M117 PolarHBondContact O-N 2.89Å; M117-M119 VanDerWaalsContact C-N 3.34Å; M117-M119 PolarHBondContact O-N 2.7Å; M117-L120 WeakPolarHBondContact O-CB 3.35Å; M117-L120 PolarHBondContact O-N 2.67Å; M117-C121 WeakPolarHBondContact O-CB 3.37Å; M117-C121 PolarHBondContact O-N 3.17Å |
| 118 | L | 89.5 | Confident | 86.2 | Confident | 16 Ų | 16 | 69.2 Ų | 69.2 | 8% | 0.084 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64 | -40.2 | 178.2 | -73.4 | 163.1 | 0 | 0 | 0 | 111.5 | T37 F40 L114 G115 Y116 C121 V122 V133 | T37-L118 HydrophobicContact CG2-CD2 4.35Å; T37-L118 WeakPolarHBondContact OG1-CD2 3.29Å; F40-L118 HydrophobicContact CB-CD1 3.68Å; F40-L118 HydrophobicContact CD1-CD1 3.73Å; F40-L118 HydrophobicContact CD2-CD1 3.99Å; F40-L118 HydrophobicContact CE1-CD1 4.35Å; F40-L118 HydrophobicContact CG-CD1 3.52Å; L114-L118 WeakPolarHBondContact O-CB 3.43Å; L114-L118 WeakPolarHBondContact O-CG 3.3Å; L114-L118 PolarHBondContact O-N 2.97Å; G115-L118 PolarHBondContact O-N 3.27Å; Y116-L118 PolarHBondContact O-N 3.41Å; L118-C121 VanDerWaalsContact O-CB 3.24Å; L118-C121 WeakPolarHBondContact O-CB 3.37Å; L118-C121 PolarHBondContact O-N 2.92Å; L118-V122 WeakPolarHBondContact O-CG2 3.29Å; L118-V122 PolarHBondContact O-N 3.43Å; L118-V133 HydrophobicContact CD2-CG2 4.27Å |
| 119 | M | 91 | Very high | 86.1 | Confident | 108 Ų | 108 | 65.6 Ų | 65.6 | 53% | 0.532 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.2 | -43.7 | 175.8 | -170.4 | 173.6 | -178.8 | 0 | 0 | 111.8 | G115 Y116 M117 C121 V122 M123 | G115-M119 WeakPolarHBondContact O-CB 3.29Å; G115-M119 PolarHBondContact O-N 3.3Å; Y116-M119 PolarHBondContact O-N 3.45Å; M117-M119 VanDerWaalsContact C-N 3.34Å; M117-M119 PolarHBondContact O-N 2.7Å; M119-C121 VanDerWaalsContact C-N 3.26Å; M119-C121 PolarHBondContact O-N 3.1Å; M119-V122 PolarHBondContact O-N 3.08Å; M119-M123 HydrophobicContact CE-CE 4.22Å; M119-M123 WeakPolarHBondContact O-CB 3.24Å; M119-M123 VanDerWaalsContact O-CG 3.29Å; M119-M123 WeakPolarHBondContact O-CG 3.46Å; M119-M123 PolarHBondContact O-N 3.27Å |
| 120 | L | 84.3 | Confident | 86.1 | Confident | 99 Ų | 99 | 66.4 Ų | 66.4 | 52% | 0.518 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.5 | -39.6 | 172.3 | -74.2 | 169.8 | 0 | 0 | 0 | 111.6 | Y116 M117 M123 S124 | Y116-L120 WeakPolarHBondContact O-CB 3.46Å; Y116-L120 WeakPolarHBondContact O-CG 3.27Å; Y116-L120 PolarHBondContact O-N 2.83Å; M117-L120 WeakPolarHBondContact O-CB 3.35Å; M117-L120 PolarHBondContact O-N 2.67Å; L120-M123 PolarHBondContact O-N 2.82Å; L120-S124 PolarHBondContact O-N 3.5Å; L120-S124 PolarHBondContact O-OG 3.2Å; L120-S124 VanDerWaalsContact O-OG 3.09Å |
| 121 | C | 85.8 | Confident | 86.2 | Confident | 7 Ų | 7 | 67.4 Ų | 67.4 | 5% | 0.047 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.8 | -46.1 | 178.9 | -150.2 | 0 | 0 | 0 | 0 | 112.1 | L13 V33 M117 L118 M119 M123 S124 I129 | L13-C121 HydrophobicContact CD1-CB 4.22Å; L13-C121 VanDerWaalsContact CD1-SG 3.5Å; V33-C121 VanDerWaalsContact CG1-SG 3.58Å; V33-C121 WeakPolarHBondContact CG2-SG 3.24Å; M117-C121 WeakPolarHBondContact O-CB 3.37Å; M117-C121 PolarHBondContact O-N 3.17Å; L118-C121 VanDerWaalsContact O-CB 3.24Å; L118-C121 WeakPolarHBondContact O-CB 3.37Å; L118-C121 PolarHBondContact O-N 2.92Å; M119-C121 VanDerWaalsContact C-N 3.26Å; M119-C121 PolarHBondContact O-N 3.1Å; C121-M123 VanDerWaalsContact C-N 3.34Å; C121-M123 PolarHBondContact O-N 3.02Å; C121-S124 VanDerWaalsContact O-CB 3.28Å; C121-S124 WeakPolarHBondContact O-CB 3.24Å; C121-S124 PolarHBondContact O-N 2.88Å; C121-S124 PolarHBondContact O-OG 2.79Å; C121-I129 HydrophobicContact CB-CG2 4.3Å; C121-I129 WeakPolarHBondContact SG-CG2 3.17Å |
| 122 | V | 85.5 | Confident | 86.2 | Confident | 60 Ų | 60 | 65.9 Ų | 65.9 | 36% | 0.364 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -65.5 | -37.5 | 176.5 | 172.6 | 0 | 0 | 0 | 0 | 111.6 | L118 M119 S124 Y125 V133 | L118-V122 WeakPolarHBondContact O-CG2 3.29Å; L118-V122 PolarHBondContact O-N 3.43Å; M119-V122 PolarHBondContact O-N 3.08Å; V122-S124 PolarHBondContact O-N 3.44Å; V122-S124 VanDerWaalsContact O-N 3.15Å; V122-Y125 PolarHBondContact O-N 3.39Å; V122-V133 HydrophobicContact CG2-CG1 4.34Å; V122-V133 HydrophobicContact CG2-CG2 4.32Å |
| 123 | M | 84.9 | Confident | 86.3 | Confident | 105 Ų | 105 | 64.1 Ų | 64.1 | 52% | 0.517 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.3 | -9.7 | 176.4 | -73.3 | -67.3 | 177.5 | 0 | 0 | 113.8 | M119 L120 C121 Y125 | M119-M123 HydrophobicContact CE-CE 4.22Å; M119-M123 WeakPolarHBondContact O-CB 3.24Å; M119-M123 VanDerWaalsContact O-CG 3.29Å; M119-M123 WeakPolarHBondContact O-CG 3.46Å; M119-M123 PolarHBondContact O-N 3.27Å; L120-M123 PolarHBondContact O-N 2.82Å; C121-M123 VanDerWaalsContact C-N 3.34Å; C121-M123 PolarHBondContact O-N 3.02Å; M123-Y125 WeakPolarHBondContact O-CD2 3.5Å; M123-Y125 PolarHBondContact O-N 3.05Å |
| 124 | S | 76.9 | Confident | 86.6 | Confident | 42 Ų | 42 | 64.5 Ų | 64.5 | 29% | 0.294 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.7 | -1.7 | 176.3 | -56.6 | 0 | 0 | 0 | 0 | 113.4 | L120 C121 V122 N126 | L120-S124 PolarHBondContact O-N 3.5Å; L120-S124 PolarHBondContact O-OG 3.2Å; L120-S124 VanDerWaalsContact O-OG 3.09Å; C121-S124 VanDerWaalsContact O-CB 3.28Å; C121-S124 WeakPolarHBondContact O-CB 3.24Å; C121-S124 PolarHBondContact O-N 2.88Å; C121-S124 PolarHBondContact O-OG 2.79Å; V122-S124 PolarHBondContact O-N 3.44Å; V122-S124 VanDerWaalsContact O-N 3.15Å; S124-N126 PolarHBondContact O-N 2.89Å |
| 125 | Y | 74.9 | Confident | 86.8 | Confident | 136 Ų | 136 | 68.3 Ų | 68.3 | 53% | 0.533 | 34% | 0.34 | S | S | . | . | trans | 47 | 30.7 | 178.4 | -68.2 | -81 | 0 | 0 | 0 | 114.7 | F5 V122 M123 | F5-Y125 HydrophobicContact CD1-CD1 4.16Å; F5-Y125 WeakPolarHBondContact CD1-O 3.31Å; F5-Y125 AromaticContact CE1-CD1 3.87Å; F5-Y125 HydrophobicContact CE1-CD1 3.87Å; V122-Y125 PolarHBondContact O-N 3.39Å; M123-Y125 WeakPolarHBondContact O-CD2 3.5Å; M123-Y125 PolarHBondContact O-N 3.05Å | ||
| 126 | N | 81.9 | Confident | 86.9 | Confident | 3 Ų | 3 | 67.2 Ų | 67.2 | 2% | 0.016 | 33% | 0.329 | C | S | . | . | trans | -97.9 | 119.6 | 177.1 | -171.1 | -52.9 | 0 | 0 | 0 | 109.6 | S8 V11 S124 W128 I129 F130 | S8-N126 PolarHBondContact O-ND2 3.37Å; V11-N126 HydrophobicContact CG2-CB 4.4Å; S124-N126 PolarHBondContact O-N 2.89Å; N126-W128 VanDerWaalsContact C-N 3.29Å; N126-W128 PolarHBondContact O-N 3.39Å; N126-W128 WeakPolarHBondContact OD1-CB 3.22Å; N126-W128 PolarHBondContact OD1-N 3.44Å; N126-W128 VanDerWaalsContact OD1-N 3.09Å; N126-I129 HydrophobicContact CB-CB 4.07Å; N126-I129 HydrophobicContact CB-CG1 3.88Å; N126-I129 PolarHBondContact O-N 3.42Å; N126-F130 PolarHBondContact O-N 3.24Å | ||
| 127 | V | 83.5 | Confident | 87.1 | Confident | 81 Ų | 81 | 62.1 Ų | 62.1 | 49% | 0.491 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -59.9 | -38.4 | -175 | 179.8 | 0 | 0 | 0 | 0 | 112.2 | F5 F130 L131 | F5-V127 HydrophobicContact CB-CG2 3.9Å; F5-V127 HydrophobicContact CD1-CG2 4.19Å; F5-V127 HydrophobicContact CG-CG2 4.12Å; V127-F130 PolarHBondContact O-N 3.46Å; V127-L131 WeakPolarHBondContact O-CB 3.48Å; V127-L131 PolarHBondContact O-N 3.26Å |
| 128 | W | 85.1 | Confident | 87.4 | Confident | 156 Ų | 156 | 62.4 Ų | 62.4 | 59% | 0.591 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -65.5 | -41.7 | 179.9 | -67.1 | 100.3 | 0 | 0 | 0 | 112 | M26 V30 N126 G132 | M26-W128 HydrophobicContact CE-CG 4.37Å; V30-W128 HydrophobicContact CG2-CB 3.68Å; N126-W128 VanDerWaalsContact C-N 3.29Å; N126-W128 PolarHBondContact O-N 3.39Å; N126-W128 WeakPolarHBondContact OD1-CB 3.22Å; N126-W128 PolarHBondContact OD1-N 3.44Å; N126-W128 VanDerWaalsContact OD1-N 3.09Å; W128-G132 PolarHBondContact O-N 3.01Å |
| 129 | I | 85.8 | Confident | 87.6 | Confident | 3 Ų | 3 | 65.2 Ų | 65.2 | 2% | 0.015 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -67.4 | -46.5 | 177.3 | -63.3 | -61.9 | 0 | 0 | 0 | 110.4 | V30 V33 C121 N126 L131 G132 V133 | V30-I129 HydrophobicContact CG2-CD1 4.01Å; V33-I129 HydrophobicContact CG1-CG2 4.22Å; V33-I129 HydrophobicContact CG2-CD1 4.21Å; V33-I129 HydrophobicContact CG2-CG2 4.43Å; C121-I129 HydrophobicContact CB-CG2 4.3Å; C121-I129 WeakPolarHBondContact SG-CG2 3.17Å; N126-I129 HydrophobicContact CB-CB 4.07Å; N126-I129 HydrophobicContact CB-CG1 3.88Å; N126-I129 PolarHBondContact O-N 3.42Å; I129-L131 VanDerWaalsContact C-N 3.33Å; I129-L131 PolarHBondContact O-N 3.02Å; I129-G132 CarbonylContact O-C 3.59Å; I129-G132 WeakPolarHBondContact O-CA 3.27Å; I129-G132 PolarHBondContact O-N 3.31Å; I129-G132 VanDerWaalsContact O-N 3.08Å; I129-V133 WeakPolarHBondContact O-CG2 3.5Å; I129-V133 PolarHBondContact O-N 3.43Å |
| 130 | F | 87.7 | Confident | 87.6 | Confident | 106 Ų | 106 | 60 Ų | 60 | 47% | 0.465 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -57.5 | -46.8 | 176 | 177.8 | -100.1 | 0 | 0 | 0 | 111.5 | N126 V127 G132 V133 V134 | N126-F130 PolarHBondContact O-N 3.24Å; V127-F130 PolarHBondContact O-N 3.46Å; F130-G132 VanDerWaalsContact C-N 3.29Å; F130-G132 PolarHBondContact O-N 2.93Å; F130-V133 PolarHBondContact O-N 2.92Å; F130-V134 HydrophobicContact CD1-CG2 4.27Å; F130-V134 HydrophobicContact CE1-CG2 3.82Å; F130-V134 HydrophobicContact CE2-CG2 4.24Å; F130-V134 HydrophobicContact CZ-CG2 3.81Å; F130-V134 WeakPolarHBondContact O-CG2 3.47Å; F130-V134 PolarHBondContact O-N 3.28Å |
| 131 | L | 90.3 | Very high | 87.8 | Confident | 98 Ų | 98 | 62.8 Ų | 62.8 | 51% | 0.513 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61 | -39.7 | 175.5 | -173.1 | 65.4 | 0 | 0 | 0 | 111.5 | V127 I129 V134 L135 | V127-L131 WeakPolarHBondContact O-CB 3.48Å; V127-L131 PolarHBondContact O-N 3.26Å; I129-L131 VanDerWaalsContact C-N 3.33Å; I129-L131 PolarHBondContact O-N 3.02Å; L131-V134 PolarHBondContact O-N 3.01Å; L131-L135 VanDerWaalsContact O-CB 3.27Å; L131-L135 WeakPolarHBondContact O-CB 3.43Å; L131-L135 PolarHBondContact O-N 2.9Å |
| 132 | G | 91.3 | Very high | 88 | Confident | 3 Ų | 3 | 70.9 Ų | 70.9 | 3% | 0.031 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.2 | -42 | 174 | 0 | 0 | 0 | 0 | 0 | 113.4 | W128 I129 F130 G136 | W128-G132 PolarHBondContact O-N 3.01Å; I129-G132 CarbonylContact O-C 3.59Å; I129-G132 WeakPolarHBondContact O-CA 3.27Å; I129-G132 PolarHBondContact O-N 3.31Å; I129-G132 VanDerWaalsContact O-N 3.08Å; F130-G132 VanDerWaalsContact C-N 3.29Å; F130-G132 PolarHBondContact O-N 2.93Å; G132-G136 WeakPolarHBondContact O-CA 3.35Å; G132-G136 PolarHBondContact O-N 3.49Å |
| 133 | V | 92.6 | Very high | 88 | Confident | 22 Ų | 22 | 70.8 Ų | 70.8 | 13% | 0.133 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -66 | -46.6 | 174.8 | 176.7 | 0 | 0 | 0 | 0 | 110.8 | V33 T37 L118 V122 I129 F130 G136 S137 | V33-V133 HydrophobicContact CG1-CG2 3.38Å; T37-V133 HydrophobicContact CG2-CG1 4.25Å; L118-V133 HydrophobicContact CD2-CG2 4.27Å; V122-V133 HydrophobicContact CG2-CG1 4.34Å; V122-V133 HydrophobicContact CG2-CG2 4.32Å; I129-V133 WeakPolarHBondContact O-CG2 3.5Å; I129-V133 PolarHBondContact O-N 3.43Å; F130-V133 PolarHBondContact O-N 2.92Å; V133-G136 PolarHBondContact O-N 3.42Å; V133-S137 WeakPolarHBondContact O-CB 3.43Å; V133-S137 PolarHBondContact O-N 3.08Å; V133-S137 PolarHBondContact O-OG 3.4Å |
| 134 | V | 92.9 | Very high | 88 | Confident | 68 Ų | 68 | 65.9 Ų | 65.9 | 41% | 0.412 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -61.3 | -49.3 | 179.2 | 173.5 | 0 | 0 | 0 | 0 | 110.5 | F130 L131 S137 A138 | F130-V134 HydrophobicContact CD1-CG2 4.27Å; F130-V134 HydrophobicContact CE1-CG2 3.82Å; F130-V134 HydrophobicContact CE2-CG2 4.24Å; F130-V134 HydrophobicContact CZ-CG2 3.81Å; F130-V134 WeakPolarHBondContact O-CG2 3.47Å; F130-V134 PolarHBondContact O-N 3.28Å; L131-V134 PolarHBondContact O-N 3.01Å; V134-S137 PolarHBondContact O-N 3.28Å; V134-S137 PolarHBondContact O-OG 2.9Å; V134-A138 PolarHBondContact O-N 2.94Å; V134-A138 VanDerWaalsContact O-N 3.08Å |
| 135 | L | 94.2 | Very high | 88.2 | Confident | 96 Ų | 96 | 70.9 Ų | 70.9 | 50% | 0.503 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 179.7 | -163 | 68.2 | 0 | 0 | 0 | 111.7 | L34 L131 S137 A138 L139 | L34-L135 HydrophobicContact CD1-CD2 4.35Å; L131-L135 VanDerWaalsContact O-CB 3.27Å; L131-L135 WeakPolarHBondContact O-CB 3.43Å; L131-L135 PolarHBondContact O-N 2.9Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.2Å; L135-A138 PolarHBondContact O-N 2.81Å; L135-L139 HydrophobicContact CG-CD1 4.31Å; L135-L139 WeakPolarHBondContact O-CB 3.33Å; L135-L139 WeakPolarHBondContact O-CG 3.41Å; L135-L139 PolarHBondContact O-N 2.86Å |
| 136 | G | 93.9 | Very high | 88.5 | Confident | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.4 | -36.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | V38 G132 V133 G140 | V38-G136 VanDerWaalsContact CG2-O 3.3Å; V38-G136 WeakPolarHBondContact CG2-O 3.45Å; G132-G136 WeakPolarHBondContact O-CA 3.35Å; G132-G136 PolarHBondContact O-N 3.49Å; V133-G136 PolarHBondContact O-N 3.42Å; G136-G140 WeakPolarHBondContact O-CA 3.34Å; G136-G140 PolarHBondContact O-N 2.94Å |
| 137 | S | 92.1 | Very high | 88.1 | Confident | 44 Ų | 44 | 70.8 Ų | 70.8 | 31% | 0.308 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -68.8 | -40.8 | 175 | 74.7 | 0 | 0 | 0 | 0 | 112.2 | V133 V134 L135 G140 Y141 | V133-S137 WeakPolarHBondContact O-CB 3.43Å; V133-S137 PolarHBondContact O-N 3.08Å; V133-S137 PolarHBondContact O-OG 3.4Å; V134-S137 PolarHBondContact O-N 3.28Å; V134-S137 PolarHBondContact O-OG 2.9Å; L135-S137 VanDerWaalsContact C-N 3.32Å; L135-S137 PolarHBondContact O-N 3.2Å; S137-G140 PolarHBondContact O-N 3.44Å; S137-Y141 WeakPolarHBondContact O-CB 3.13Å; S137-Y141 PolarHBondContact O-N 2.78Å |
| 138 | A | 92.4 | Very high | 87.5 | Confident | 57 Ų | 57 | 70.5 Ų | 70.5 | 47% | 0.471 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.5 | -46.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | V134 L135 Y141 Y142 | V134-A138 PolarHBondContact O-N 2.94Å; V134-A138 VanDerWaalsContact O-N 3.08Å; L135-A138 PolarHBondContact O-N 2.81Å; A138-Y141 PolarHBondContact O-N 3.29Å; A138-Y142 WeakPolarHBondContact O-CB 3.13Å; A138-Y142 PolarHBondContact O-N 2.87Å |
| 139 | L | 92.2 | Very high | 86.8 | Confident | 75 Ų | 75 | 65 Ų | 65 | 39% | 0.393 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64 | -42.7 | 175.5 | -73.8 | 170.1 | 0 | 0 | 0 | 111.7 | L34 V38 L135 Y141 Y142 V143 | L34-L139 HydrophobicContact CD1-CD1 4.42Å; L34-L139 HydrophobicContact CD2-CD1 4.25Å; V38-L139 HydrophobicContact CG2-CB 4.09Å; L135-L139 HydrophobicContact CG-CD1 4.31Å; L135-L139 WeakPolarHBondContact O-CB 3.33Å; L135-L139 WeakPolarHBondContact O-CG 3.41Å; L135-L139 PolarHBondContact O-N 2.86Å; L139-Y141 PolarHBondContact O-N 2.67Å; L139-Y142 PolarHBondContact O-N 3.36Å; L139-V143 WeakPolarHBondContact O-CB 3.28Å; L139-V143 VanDerWaalsContact O-CG2 3.3Å; L139-V143 WeakPolarHBondContact O-CG2 3.24Å; L139-V143 PolarHBondContact O-N 3.36Å |
| 140 | G | 91.8 | Very high | 86.1 | Confident | 0 Ų | 0 | 71.6 Ų | 71.6 | 0% | 0 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60.2 | -45.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | G136 S137 V143 A144 | G136-G140 WeakPolarHBondContact O-CA 3.34Å; G136-G140 PolarHBondContact O-N 2.94Å; S137-G140 PolarHBondContact O-N 3.44Å; G140-V143 PolarHBondContact O-N 3.42Å; G140-A144 VanDerWaalsContact O-CB 3.23Å; G140-A144 WeakPolarHBondContact O-CB 3.14Å; G140-A144 PolarHBondContact O-N 3.41Å |
| 141 | Y | 88.7 | Confident | 85.2 | Confident | 156 Ų | 156 | 68.1 Ų | 68.1 | 61% | 0.612 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -64.1 | -43.7 | 175.1 | -172.8 | -95.9 | 0 | 0 | 0 | 112.2 | S137 A138 L139 V143 A144 F145 | S137-Y141 WeakPolarHBondContact O-CB 3.13Å; S137-Y141 PolarHBondContact O-N 2.78Å; A138-Y141 PolarHBondContact O-N 3.29Å; L139-Y141 PolarHBondContact O-N 2.67Å; Y141-V143 VanDerWaalsContact C-N 3.33Å; Y141-V143 PolarHBondContact O-N 3.17Å; Y141-A144 PolarHBondContact O-N 2.92Å; Y141-F145 PolarHBondContact O-N 3.17Å |
| 142 | Y | 89.1 | Confident | 84 | Confident | 177 Ų | 177 | 66.4 Ų | 66.4 | 69% | 0.694 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -60.9 | -40.3 | 177.2 | -179 | -99 | 0 | 0 | 0 | 112.5 | A138 L139 P146 | A138-Y142 WeakPolarHBondContact O-CB 3.13Å; A138-Y142 PolarHBondContact O-N 2.87Å; L139-Y142 PolarHBondContact O-N 3.36Å; Y142-P146 WeakPolarHBondContact O-CD 3.5Å |
| 143 | V | 86.5 | Confident | 82.7 | Confident | 58 Ų | 58 | 71.2 Ų | 71.2 | 35% | 0.352 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -77.5 | -32.2 | 178.1 | 173.8 | 0 | 0 | 0 | 0 | 112.2 | I42 L139 G140 Y141 F145 P146 L147 | I42-V143 HydrophobicContact CD1-CG1 4.24Å; L139-V143 WeakPolarHBondContact O-CB 3.28Å; L139-V143 VanDerWaalsContact O-CG2 3.3Å; L139-V143 WeakPolarHBondContact O-CG2 3.24Å; L139-V143 PolarHBondContact O-N 3.36Å; G140-V143 PolarHBondContact O-N 3.42Å; Y141-V143 VanDerWaalsContact C-N 3.33Å; Y141-V143 PolarHBondContact O-N 3.17Å; V143-F145 VanDerWaalsContact C-N 3.28Å; V143-F145 PolarHBondContact O-N 3.48Å; V143-P146 WeakPolarHBondContact O-CD 3.33Å; V143-P146 VanDerWaalsContact O-CG 3.23Å; V143-P146 WeakPolarHBondContact O-CG 3.48Å; V143-L147 HydrophobicContact CG1-CD1 4.03Å |
| 144 | A | 83.8 | Confident | 81.2 | Confident | 3 Ų | 3 | 76.5 Ų | 76.5 | 3% | 0.025 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -66.6 | -31.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | V45 G140 Y141 L147 L148 | V45-A144 HydrophobicContact CB-CB 4.34Å; V45-A144 HydrophobicContact CG2-CB 3.9Å; G140-A144 VanDerWaalsContact O-CB 3.23Å; G140-A144 WeakPolarHBondContact O-CB 3.14Å; G140-A144 PolarHBondContact O-N 3.41Å; Y141-A144 PolarHBondContact O-N 2.92Å; A144-L147 WeakPolarHBondContact O-CB 3.29Å; A144-L147 PolarHBondContact O-N 2.89Å; A144-L148 PolarHBondContact O-N 3.31Å; A144-L148 VanDerWaalsContact O-N 3.07Å |
| 145 | F | 81.7 | Confident | 79.6 | Confident | 147 Ų | 147 | 74.9 Ų | 74.9 | 65% | 0.645 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -59.8 | -52 | 178.6 | -166.5 | -96.1 | 0 | 0 | 0 | 114.4 | Y141 V143 L147 L148 G149 | Y141-F145 PolarHBondContact O-N 3.17Å; V143-F145 VanDerWaalsContact C-N 3.28Å; V143-F145 PolarHBondContact O-N 3.48Å; F145-L147 VanDerWaalsContact C-N 3.34Å; F145-L147 PolarHBondContact O-N 3Å; F145-L148 PolarHBondContact O-N 2.95Å; F145-G149 PolarHBondContact O-N 3.09Å |
| 146 | P | 80.8 | Confident | 77.8 | Confident | 71 Ų | 71 | 78.2 Ų | 78.2 | 46% | 0.461 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -67.2 | -31.3 | 174.8 | 25.4 | -34.1 | 0 | 0 | 0 | 113.1 | Y142 V143 L148 G149 Q150 | Y142-P146 WeakPolarHBondContact O-CD 3.5Å; V143-P146 WeakPolarHBondContact O-CD 3.33Å; V143-P146 VanDerWaalsContact O-CG 3.23Å; V143-P146 WeakPolarHBondContact O-CG 3.48Å; P146-L148 VanDerWaalsContact C-N 3.35Å; P146-L148 PolarHBondContact O-N 3.21Å; P146-G149 PolarHBondContact O-N 3.33Å; P146-G149 VanDerWaalsContact O-N 3.14Å; P146-Q150 PolarHBondContact O-N 2.93Å |
| 147 | L | 73.4 | Confident | 76.1 | Confident | 65 Ų | 65 | 83.8 Ų | 83.8 | 34% | 0.34 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61 | -42 | 175.4 | -90.4 | 159 | 0 | 0 | 0 | 111.9 | I42 V143 A144 F145 G149 Q150 M151 | I42-L147 HydrophobicContact CG1-CD1 4.39Å; I42-L147 HydrophobicContact CG2-CD1 4.25Å; V143-L147 HydrophobicContact CG1-CD1 4.03Å; A144-L147 WeakPolarHBondContact O-CB 3.29Å; A144-L147 PolarHBondContact O-N 2.89Å; F145-L147 VanDerWaalsContact C-N 3.34Å; F145-L147 PolarHBondContact O-N 3Å; L147-G149 VanDerWaalsContact C-N 3.27Å; L147-G149 PolarHBondContact O-N 3.37Å; L147-Q150 PolarHBondContact O-N 3.43Å; L147-M151 HydrophobicContact CB-CE 4.48Å; L147-M151 WeakPolarHBondContact O-CB 3.48Å; L147-M151 VanDerWaalsContact O-CG 3.24Å; L147-M151 WeakPolarHBondContact O-CG 3.42Å; L147-M151 PolarHBondContact O-N 3.49Å |
| 148 | L | 71.1 | Confident | 74.2 | Confident | 76 Ų | 76 | 90.5 Ų | 90.5 | 40% | 0.398 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -57.5 | -40.7 | 173 | -79.8 | 152.1 | 0 | 0 | 0 | 112.1 | V45 A144 F145 P146 S152 | V45-L148 HydrophobicContact CG1-CD1 3.7Å; V45-L148 HydrophobicContact CG1-CD2 3.72Å; V45-L148 HydrophobicContact CG1-CG 3.6Å; A144-L148 PolarHBondContact O-N 3.31Å; A144-L148 VanDerWaalsContact O-N 3.07Å; F145-L148 PolarHBondContact O-N 2.95Å; P146-L148 VanDerWaalsContact C-N 3.35Å; P146-L148 PolarHBondContact O-N 3.21Å; L148-S152 VanDerWaalsContact O-CB 3.25Å; L148-S152 WeakPolarHBondContact O-CB 3.39Å; L148-S152 PolarHBondContact O-N 2.89Å |
| 149 | G | 70.1 | Confident | 71.9 | Confident | 41 Ų | 41 | 98.7 Ų | 98.7 | 42% | 0.423 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.2 | -47 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | F145 P146 L147 S152 L153 | F145-G149 PolarHBondContact O-N 3.09Å; P146-G149 PolarHBondContact O-N 3.33Å; P146-G149 VanDerWaalsContact O-N 3.14Å; L147-G149 VanDerWaalsContact C-N 3.27Å; L147-G149 PolarHBondContact O-N 3.37Å; G149-S152 PolarHBondContact O-N 3.31Å; G149-L153 PolarHBondContact O-N 3.36Å |
| 150 | Q | 71.3 | Confident | 70.9 | Confident | 141 Ų | 141 | 99.9 Ų | 99.9 | 66% | 0.659 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.9 | -42.9 | 178.5 | -70.1 | -68 | -42 | 0 | 0 | 112.2 | P146 L147 L153 Y154 | P146-Q150 PolarHBondContact O-N 2.93Å; L147-Q150 PolarHBondContact O-N 3.43Å; Q150-L153 PolarHBondContact O-N 3.24Å; Q150-Y154 WeakPolarHBondContact O-CB 3.13Å; Q150-Y154 PolarHBondContact O-N 3.15Å |
| 151 | M | 68.3 | Low | 69.8 | Low | 32 Ų | 32 | 105.1 Ų | 105.1 | 16% | 0.158 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -73.5 | -32.6 | -177.8 | -62.5 | -179 | -43.5 | 0 | 0 | 112.1 | W46 L147 G155 | W46-M151 HydrophobicContact CE3-CE 3.67Å; W46-M151 HydrophobicContact CE3-SD 3.33Å; W46-M151 HydrophobicContact CH2-SD 4.24Å; W46-M151 HydrophobicContact CZ3-CE 3.96Å; W46-M151 HydrophobicContact CZ3-CG 4.31Å; W46-M151 HydrophobicContact CZ3-SD 3.11Å; W46-M151 WeakPolarHBondContact CZ3-SD 3.43Å; L147-M151 HydrophobicContact CB-CE 4.48Å; L147-M151 WeakPolarHBondContact O-CB 3.48Å; L147-M151 VanDerWaalsContact O-CG 3.24Å; L147-M151 WeakPolarHBondContact O-CG 3.42Å; L147-M151 PolarHBondContact O-N 3.49Å; M151-G155 PolarHBondContact O-N 2.91Å |
| 152 | S | 65.6 | Low | 68.8 | Low | 63 Ų | 63 | 102.3 Ų | 102.3 | 44% | 0.441 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.9 | -38.1 | 170.3 | -179.2 | 0 | 0 | 0 | 0 | 112.5 | L148 G149 R156 | L148-S152 VanDerWaalsContact O-CB 3.25Å; L148-S152 WeakPolarHBondContact O-CB 3.39Å; L148-S152 PolarHBondContact O-N 2.89Å; G149-S152 PolarHBondContact O-N 3.31Å; S152-R156 PolarHBondContact O-N 3.08Å |
| 153 | L | 63.7 | Low | 67.6 | Low | 103 Ų | 103 | 97.9 Ų | 97.9 | 54% | 0.539 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.7 | -43.6 | 175.6 | -137 | 97.3 | 0 | 0 | 0 | 111.3 | G149 Q150 G155 R156 V157 | G149-L153 PolarHBondContact O-N 3.36Å; Q150-L153 PolarHBondContact O-N 3.24Å; L153-G155 PolarHBondContact O-N 2.86Å; L153-R156 PolarHBondContact O-N 3.09Å; L153-R156 VanDerWaalsContact O-N 3.14Å; L153-V157 WeakPolarHBondContact O-CG2 3.37Å; L153-V157 PolarHBondContact O-N 2.95Å |
| 154 | Y | 61.3 | Low | 66.4 | Low | 134 Ų | 134 | 100.4 Ų | 100.4 | 53% | 0.525 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.3 | -39.1 | 179.4 | -173.8 | -103.1 | 0 | 0 | 0 | 112.9 | Q150 R156 V157 R158 | Q150-Y154 WeakPolarHBondContact O-CB 3.13Å; Q150-Y154 PolarHBondContact O-N 3.15Å; Y154-R156 VanDerWaalsContact C-N 3.25Å; Y154-R156 PolarHBondContact O-N 3.33Å; Y154-V157 PolarHBondContact O-N 3.28Å; Y154-R158 PolarHBondContact OH-NE 3.36Å; Y154-R158 PolarHBondContact OH-NH2 3.33Å |
| 155 | G | 60.4 | Low | 65.2 | Low | 33 Ų | 33 | 106.9 Ų | 106.9 | 34% | 0.34 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.5 | -27.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | M151 L153 | M151-G155 PolarHBondContact O-N 2.91Å; L153-G155 PolarHBondContact O-N 2.86Å |
| 156 | R | 56.3 | Low | 64 | Low | 167 Ų | 167 | 104 Ų | 104 | 63% | 0.63 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -83.8 | -24.8 | 179.8 | -162.9 | -179.3 | -47.3 | 159.4 | 12.1 | 114 | S152 L153 Y154 | S152-R156 PolarHBondContact O-N 3.08Å; L153-R156 PolarHBondContact O-N 3.09Å; L153-R156 VanDerWaalsContact O-N 3.14Å; Y154-R156 VanDerWaalsContact C-N 3.25Å; Y154-R156 PolarHBondContact O-N 3.33Å |
| 157 | V | 57.3 | Low | 62.8 | Low | 117 Ų | 117 | 106.5 Ų | 106.5 | 71% | 0.709 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -83.6 | -17.9 | 179.2 | 175.5 | 0 | 0 | 0 | 0 | 111.8 | L153 Y154 | L153-V157 WeakPolarHBondContact O-CG2 3.37Å; L153-V157 PolarHBondContact O-N 2.95Å; Y154-V157 PolarHBondContact O-N 3.28Å |
| 158 | R | 51.7 | Low | 61.9 | Low | 184 Ų | 184 | 110 Ų | 110 | 69% | 0.694 | 55% | 0.548 | S | S | * | . | trans | -93.7 | -1.6 | 179.8 | -82.7 | -154.6 | 178.6 | -151.4 | 1 | 115.2 | Y154 | Y154-R158 PolarHBondContact OH-NE 3.36Å; Y154-R158 PolarHBondContact OH-NH2 3.33Å | ||
| 159 | H | 45.3 | Very low | 61 | Low | 229 Ų | 229 | 113.1 Ų | 113.1 | 100% | 1.06 | 56% | 0.562 | S | S | * | * | trans | -120.6 | 0 | 174.2 | -83 | -75.4 | 0 | 0 | 0 | 109.8 |
Retrieved 159 of 159 residues in 90.1 ms
(Link to these results)