| 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 | A | 76.6 | Confident | 84.1 | Confident | 90 Ų | 90 | 77.5 Ų | 77.5 | 74% | 0.744 | 45% | 0.454 | S | S | * | . | 0 | -52.6 | 0 | 0 | 0 | 0 | 0 | 0 | 111.7 | T3 I4 S5 | A1-T3 PolarHBondContact O-N 3.09Å; A1-I4 PolarHBondContact O-N 3.35Å; A1-S5 PolarHBondContact O-N 3.38Å; A1-S5 PolarHBondContact O-OG 3.15Å | |||
| 2 | F | 86.3 | Confident | 82.3 | Confident | 82 Ų | 82 | 85.6 Ų | 85.6 | 36% | 0.36 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -55 | -49.8 | 178.6 | -172.9 | -99.9 | 0 | 0 | 0 | 113.9 | I4 S5 L6 M26 S29 L30 | F2-I4 VanDerWaalsContact C-N 3.33Å; F2-I4 PolarHBondContact O-N 3.27Å; F2-S5 WeakPolarHBondContact CA-OG 3.34Å; F2-S5 PolarHBondContact O-N 3.28Å; F2-S5 PolarHBondContact O-OG 3.02Å; F2-L6 HydrophobicContact CE1-CD1 4.15Å; F2-L6 HydrophobicContact CZ-CD1 4.27Å; F2-L6 VanDerWaalsContact O-CB 3.31Å; F2-L6 WeakPolarHBondContact O-CB 3.48Å; F2-L6 PolarHBondContact O-N 3.11Å; F2-M26 HydrophobicContact CD2-CB 4.18Å; F2-M26 HydrophobicContact CD2-CG 4.29Å; F2-M26 HydrophobicContact CE2-CB 4.07Å; F2-M26 HydrophobicContact CE2-CG 4.25Å; F2-M26 HydrophobicContact CE2-SD 4.42Å; F2-S29 WeakPolarHBondContact CB-OG 3.4Å; F2-L30 HydrophobicContact CD2-CD1 4.45Å; F2-L30 HydrophobicContact CD2-CD2 4.38Å; F2-L30 HydrophobicContact CD2-CG 4.04Å; F2-L30 HydrophobicContact CE2-CD1 3.86Å; F2-L30 HydrophobicContact CE2-CD2 4.24Å; F2-L30 HydrophobicContact CE2-CG 3.92Å |
| 3 | T | 86.5 | Confident | 80.8 | Confident | 93 Ų | 93 | 93.4 Ų | 93.4 | 57% | 0.571 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.8 | -34.9 | 179.7 | 51.6 | 0 | 0 | 0 | 0 | 113.6 | A1 L7 | A1-T3 PolarHBondContact O-N 3.09Å; T3-L7 WeakPolarHBondContact O-CB 3.36Å; T3-L7 VanDerWaalsContact O-CG 3.24Å; T3-L7 WeakPolarHBondContact O-CG 3.38Å; T3-L7 PolarHBondContact O-N 3.29Å |
| 4 | I | 86.6 | Confident | 79.5 | Confident | 122 Ų | 122 | 91.1 Ų | 91.1 | 63% | 0.626 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -71.3 | -41.9 | 179.1 | -60 | 167.9 | 0 | 0 | 0 | 110.5 | A1 F2 L7 G8 | A1-I4 PolarHBondContact O-N 3.35Å; F2-I4 VanDerWaalsContact C-N 3.33Å; F2-I4 PolarHBondContact O-N 3.27Å; I4-L7 PolarHBondContact O-N 2.65Å; I4-G8 PolarHBondContact O-N 3.42Å |
| 5 | S | 86.1 | Confident | 79.2 | Confident | 16 Ų | 16 | 90.3 Ų | 90.3 | 11% | 0.112 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -70.6 | -35.7 | 176.5 | 45.6 | 0 | 0 | 0 | 0 | 112.1 | A1 F2 G8 M9 M26 | A1-S5 PolarHBondContact O-N 3.38Å; A1-S5 PolarHBondContact O-OG 3.15Å; F2-S5 WeakPolarHBondContact CA-OG 3.34Å; F2-S5 PolarHBondContact O-N 3.28Å; F2-S5 PolarHBondContact O-OG 3.02Å; S5-G8 PolarHBondContact O-N 3.07Å; S5-M9 PolarHBondContact O-N 3.1Å; S5-M26 WeakPolarHBondContact OG-CG 3.45Å |
| 6 | L | 86.1 | Confident | 78.9 | Confident | 65 Ų | 65 | 86.8 Ų | 86.8 | 34% | 0.34 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.8 | -47.4 | 171.2 | -171.9 | 112.3 | 0 | 0 | 0 | 111.7 | F2 G8 M9 L10 M26 | F2-L6 HydrophobicContact CE1-CD1 4.15Å; F2-L6 HydrophobicContact CZ-CD1 4.27Å; F2-L6 VanDerWaalsContact O-CB 3.31Å; F2-L6 WeakPolarHBondContact O-CB 3.48Å; F2-L6 PolarHBondContact O-N 3.11Å; L6-G8 VanDerWaalsContact C-N 3.3Å; L6-G8 PolarHBondContact O-N 3.26Å; L6-M9 PolarHBondContact O-N 3.38Å; L6-L10 HydrophobicContact CD2-CD1 3.97Å; L6-L10 HydrophobicContact CG-CD1 4.33Å; L6-L10 WeakPolarHBondContact O-CG 3.44Å; L6-L10 PolarHBondContact O-N 2.88Å; L6-M26 HydrophobicContact CB-SD 4.07Å; L6-M26 HydrophobicContact CD1-SD 4.16Å |
| 7 | L | 86.1 | Confident | 79 | Confident | 107 Ų | 107 | 86.5 Ų | 86.5 | 56% | 0.56 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -61.6 | -39.4 | 174.2 | -73.7 | 168.8 | 0 | 0 | 0 | 111.6 | T3 I4 M9 L10 V11 | T3-L7 WeakPolarHBondContact O-CB 3.36Å; T3-L7 VanDerWaalsContact O-CG 3.24Å; T3-L7 WeakPolarHBondContact O-CG 3.38Å; T3-L7 PolarHBondContact O-N 3.29Å; I4-L7 PolarHBondContact O-N 2.65Å; L7-M9 VanDerWaalsContact C-N 3.31Å; L7-M9 PolarHBondContact O-N 3.03Å; L7-L10 PolarHBondContact O-N 2.96Å; L7-V11 WeakPolarHBondContact O-CG2 3.5Å; L7-V11 PolarHBondContact O-N 3.07Å |
| 8 | G | 85.6 | Confident | 79.3 | Confident | 32 Ų | 32 | 84.1 Ų | 84.1 | 33% | 0.33 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.8 | -34.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | I4 S5 L6 | I4-G8 PolarHBondContact O-N 3.42Å; S5-G8 PolarHBondContact O-N 3.07Å; L6-G8 VanDerWaalsContact C-N 3.3Å; L6-G8 PolarHBondContact O-N 3.26Å |
| 9 | M | 83.4 | Confident | 79.5 | Confident | 51 Ų | 51 | 81.3 Ų | 81.3 | 25% | 0.251 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -74.2 | -42.8 | 175.1 | -178.9 | -87.1 | -73.3 | 0 | 0 | 112.1 | S5 L6 L7 V11 C22 M26 | S5-M9 PolarHBondContact O-N 3.1Å; L6-M9 PolarHBondContact O-N 3.38Å; L7-M9 VanDerWaalsContact C-N 3.31Å; L7-M9 PolarHBondContact O-N 3.03Å; M9-V11 VanDerWaalsContact C-N 3.29Å; M9-V11 PolarHBondContact O-N 3.48Å; M9-C22 HydrophobicContact CB-CB 4.34Å; M9-M26 HydrophobicContact CB-CE 4.24Å; M9-M26 HydrophobicContact CE-CE 4.27Å; M9-M26 HydrophobicContact CG-CE 4.36Å |
| 10 | L | 81.6 | Confident | 79.8 | Confident | 97 Ų | 97 | 78.5 Ų | 78.5 | 51% | 0.508 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.3 | -33.1 | 178.5 | -71.6 | 170.6 | 0 | 0 | 0 | 112.5 | L6 L7 Y12 | L6-L10 HydrophobicContact CD2-CD1 3.97Å; L6-L10 HydrophobicContact CG-CD1 4.33Å; L6-L10 WeakPolarHBondContact O-CG 3.44Å; L6-L10 PolarHBondContact O-N 2.88Å; L7-L10 PolarHBondContact O-N 2.96Å; L10-Y12 VanDerWaalsContact C-N 3.26Å; L10-Y12 WeakPolarHBondContact O-CD2 3.13Å; L10-Y12 PolarHBondContact O-N 3.21Å |
| 11 | V | 80.1 | Confident | 80.1 | Confident | 97 Ų | 97 | 80 Ų | 80 | 59% | 0.588 | 43% | 0.428 | S | S | * | . | S | Bend | trans | -79.4 | 82.2 | 170.1 | -178.6 | 0 | 0 | 0 | 0 | 107.8 | L7 M9 R13 | L7-V11 WeakPolarHBondContact O-CG2 3.5Å; L7-V11 PolarHBondContact O-N 3.07Å; M9-V11 VanDerWaalsContact C-N 3.29Å; M9-V11 PolarHBondContact O-N 3.48Å; V11-R13 PolarHBondContact O-N 3.4Å |
| 12 | Y | 63.2 | Low | 80.6 | Confident | 175 Ų | 175 | 77.4 Ų | 77.4 | 69% | 0.686 | 40% | 0.404 | S | S | * | . | trans | -54 | 95.9 | 176 | -73.3 | -80.1 | 0 | 0 | 0 | 110.8 | L10 | L10-Y12 VanDerWaalsContact C-N 3.26Å; L10-Y12 WeakPolarHBondContact O-CD2 3.13Å; L10-Y12 PolarHBondContact O-N 3.21Å | ||
| 13 | R | 62.6 | Low | 80.6 | Confident | 187 Ų | 187 | 76.9 Ų | 76.9 | 71% | 0.706 | 40% | 0.404 | S | S | * | . | trans | -72.5 | 150.1 | 165.4 | -77.2 | -84.8 | -163.2 | 121 | 2.8 | 108 | V11 H15 | V11-R13 PolarHBondContact O-N 3.4Å; R13-H15 PolarHBondContact O-N 3.02Å | ||
| 14 | S | 62.3 | Low | 80.6 | Confident | 62 Ų | 62 | 77.3 Ų | 77.3 | 43% | 0.434 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -51.3 | -24.5 | -177.8 | 53.8 | 0 | 0 | 0 | 0 | 115 | Y79 V80 | S14-Y79 WeakPolarHBondContact O-CA 3.45Å; S14-V80 PolarHBondContact O-N 2.99Å |
| 15 | H | 75.3 | Confident | 80.7 | Confident | 79 Ų | 79 | 73.1 Ų | 73.1 | 37% | 0.366 | 39% | 0.386 | S | S | . | . | B | Isolated β-bridge | trans | -103.6 | 120.6 | -176.7 | -62.4 | -74.8 | 0 | 0 | 0 | 112.8 | R13 M17 S18 Y79 | R13-H15 PolarHBondContact O-N 3.02Å; H15-M17 PolarHBondContact O-N 3.05Å; H15-S18 PolarHBondContact O-N 3.4Å; H15-S18 VanDerWaalsContact O-N 3.09Å; H15-S18 PolarHBondContact O-OG 3Å; H15-Y79 AromaticContact CE1-CE1 3.47Å; H15-Y79 VanDerWaalsContact CE1-CE1 3.47Å; H15-Y79 WeakPolarHBondContact CE1-CE1 3.42Å; H15-Y79 AromaticContact CE1-CZ 3.83Å; H15-Y79 AromaticContact NE2-CE1 3.83Å |
| 16 | L | 74.4 | Confident | 80.9 | Confident | 34 Ų | 34 | 73 Ų | 73 | 18% | 0.178 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -61 | -32.5 | 177.5 | -153.3 | 139.8 | 0 | 0 | 0 | 112.3 | S18 S19 L20 L68 I71 V80 | L16-S18 VanDerWaalsContact C-N 3.3Å; L16-S18 PolarHBondContact O-N 2.85Å; L16-S19 PolarHBondContact O-N 2.94Å; L16-S19 VanDerWaalsContact O-N 3.12Å; L16-S19 PolarHBondContact O-OG 3.15Å; L16-L20 HydrophobicContact CD2-CD1 4.12Å; L16-L20 HydrophobicContact CD2-CG 4.28Å; L16-L20 PolarHBondContact O-N 3.26Å; L16-L20 VanDerWaalsContact O-N 3.12Å; L16-L68 HydrophobicContact CB-CD1 4.13Å; L16-L68 HydrophobicContact CD2-CB 4.14Å; L16-L68 HydrophobicContact CD2-CD1 3.69Å; L16-L68 HydrophobicContact CD2-CG 4.06Å; L16-I71 HydrophobicContact CD1-CD1 4.04Å; L16-V80 HydrophobicContact CB-CG2 4.26Å; L16-V80 HydrophobicContact CD1-CG2 4.22Å |
| 17 | M | 81.1 | Confident | 81.2 | Confident | 82 Ų | 82 | 72.1 Ų | 72.1 | 40% | 0.404 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -54.3 | -41.8 | 172.7 | -73 | -61.2 | -69 | 0 | 0 | 113.4 | H15 S19 L20 L21 L65 L68 | H15-M17 PolarHBondContact O-N 3.05Å; M17-S19 VanDerWaalsContact C-N 3.31Å; M17-S19 PolarHBondContact O-N 3.34Å; M17-L20 PolarHBondContact O-N 3.04Å; M17-L21 PolarHBondContact O-N 3Å; M17-L21 VanDerWaalsContact O-N 3.13Å; M17-L65 HydrophobicContact SD-CD2 4.49Å; M17-L68 HydrophobicContact CB-CD1 4.48Å; M17-L68 HydrophobicContact CG-CD1 3.71Å; M17-L68 HydrophobicContact SD-CD1 3.24Å; M17-L68 WeakPolarHBondContact SD-CD1 3.41Å; M17-L68 HydrophobicContact SD-CD2 4.1Å; M17-L68 HydrophobicContact SD-CG 4.33Å |
| 18 | S | 83.1 | Confident | 81.4 | Confident | 43 Ų | 43 | 72.2 Ų | 72.2 | 30% | 0.301 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -68 | -33.6 | -179.5 | 66.1 | 0 | 0 | 0 | 0 | 112.1 | H15 L16 L21 C22 | H15-S18 PolarHBondContact O-N 3.4Å; H15-S18 VanDerWaalsContact O-N 3.09Å; H15-S18 PolarHBondContact O-OG 3Å; L16-S18 VanDerWaalsContact C-N 3.3Å; L16-S18 PolarHBondContact O-N 2.85Å; S18-L21 PolarHBondContact O-N 3.25Å; S18-C22 PolarHBondContact O-N 2.86Å; S18-C22 VanDerWaalsContact O-N 3.11Å; S18-C22 PolarHBondContact O-SG 3.29Å; S18-C22 VanDerWaalsContact O-SG 3.34Å |
| 19 | S | 83.8 | Confident | 81.7 | Confident | 31 Ų | 31 | 71.7 Ų | 71.7 | 22% | 0.217 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -68.9 | -38.1 | 174.9 | 73 | 0 | 0 | 0 | 0 | 112.5 | L16 M17 C22 L23 | L16-S19 PolarHBondContact O-N 2.94Å; L16-S19 VanDerWaalsContact O-N 3.12Å; L16-S19 PolarHBondContact O-OG 3.15Å; M17-S19 VanDerWaalsContact C-N 3.31Å; M17-S19 PolarHBondContact O-N 3.34Å; S19-C22 PolarHBondContact O-N 3.19Å; S19-L23 PolarHBondContact O-N 3.16Å |
| 20 | L | 85.6 | Confident | 82 | Confident | 24 Ų | 24 | 72 Ų | 72 | 13% | 0.126 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 174.8 | -70.5 | 170.8 | 0 | 0 | 0 | 111.5 | L16 M17 C22 L23 E24 L65 L68 | L16-L20 HydrophobicContact CD2-CD1 4.12Å; L16-L20 HydrophobicContact CD2-CG 4.28Å; L16-L20 PolarHBondContact O-N 3.26Å; L16-L20 VanDerWaalsContact O-N 3.12Å; M17-L20 PolarHBondContact O-N 3.04Å; L20-C22 VanDerWaalsContact C-N 3.33Å; L20-C22 PolarHBondContact O-N 3.5Å; L20-L23 WeakPolarHBondContact O-CA 3.45Å; L20-L23 VanDerWaalsContact O-CB 3.27Å; L20-L23 WeakPolarHBondContact O-CB 3.46Å; L20-L23 PolarHBondContact O-N 3.01Å; L20-L23 VanDerWaalsContact O-N 3.08Å; L20-E24 PolarHBondContact O-N 3.45Å; L20-L65 HydrophobicContact CD1-CD2 4.03Å; L20-L65 HydrophobicContact CD1-CG 4.4Å; L20-L68 HydrophobicContact CD1-CB 4.5Å; L20-L68 HydrophobicContact CD1-CD1 3.57Å |
| 21 | L | 85.8 | Confident | 82.5 | Confident | 112 Ų | 112 | 70.7 Ų | 70.7 | 59% | 0.586 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -62.5 | -37.8 | 175.1 | -72.1 | 172 | 0 | 0 | 0 | 112.5 | M17 S18 L23 E24 G25 | M17-L21 PolarHBondContact O-N 3Å; M17-L21 VanDerWaalsContact O-N 3.13Å; S18-L21 PolarHBondContact O-N 3.25Å; L21-L23 VanDerWaalsContact C-N 3.29Å; L21-L23 PolarHBondContact O-N 3.42Å; L21-E24 PolarHBondContact O-N 2.96Å; L21-G25 PolarHBondContact O-N 2.96Å |
| 22 | C | 86.6 | Confident | 83.1 | Confident | 34 Ų | 34 | 70.1 Ų | 70.1 | 23% | 0.23 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -64 | -36.9 | 172.9 | -69.7 | 0 | 0 | 0 | 0 | 111.9 | M9 S18 S19 L20 G25 M26 | M9-C22 HydrophobicContact CB-CB 4.34Å; S18-C22 PolarHBondContact O-N 2.86Å; S18-C22 VanDerWaalsContact O-N 3.11Å; S18-C22 PolarHBondContact O-SG 3.29Å; S18-C22 VanDerWaalsContact O-SG 3.34Å; S19-C22 PolarHBondContact O-N 3.19Å; L20-C22 VanDerWaalsContact C-N 3.33Å; L20-C22 PolarHBondContact O-N 3.5Å; C22-G25 PolarHBondContact O-N 3.45Å; C22-M26 WeakPolarHBondContact O-CG 3.35Å; C22-M26 PolarHBondContact O-N 2.93Å |
| 23 | L | 86.1 | Confident | 84.4 | Confident | 71 Ų | 71 | 66.9 Ų | 66.9 | 37% | 0.372 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -64.3 | -46.3 | 175.6 | -125 | 163.7 | 0 | 0 | 0 | 111.8 | S19 L20 L21 G25 M26 M27 | S19-L23 PolarHBondContact O-N 3.16Å; L20-L23 WeakPolarHBondContact O-CA 3.45Å; L20-L23 VanDerWaalsContact O-CB 3.27Å; L20-L23 WeakPolarHBondContact O-CB 3.46Å; L20-L23 PolarHBondContact O-N 3.01Å; L20-L23 VanDerWaalsContact O-N 3.08Å; L21-L23 VanDerWaalsContact C-N 3.29Å; L21-L23 PolarHBondContact O-N 3.42Å; L23-G25 VanDerWaalsContact C-N 3.29Å; L23-G25 PolarHBondContact O-N 3.39Å; L23-M26 HydrophobicContact CB-CE 4.32Å; L23-M26 HydrophobicContact CD2-CE 4.1Å; L23-M26 HydrophobicContact CG-CE 3.79Å; L23-M26 WeakPolarHBondContact O-CB 3.45Å; L23-M26 PolarHBondContact O-N 3.42Å; L23-M26 VanDerWaalsContact O-N 3.13Å; L23-M27 WeakPolarHBondContact O-CG 3.46Å; L23-M27 PolarHBondContact O-N 3Å |
| 24 | E | 88.1 | Confident | 85.7 | Confident | 103 Ų | 103 | 59.3 Ų | 59.3 | 48% | 0.481 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -58.9 | -41.4 | 173.1 | -71.2 | -174.7 | 165.7 | 0 | 0 | 111.8 | L20 L21 M26 M27 L28 | L20-E24 PolarHBondContact O-N 3.45Å; L21-E24 PolarHBondContact O-N 2.96Å; E24-M26 VanDerWaalsContact C-N 3.34Å; E24-M26 PolarHBondContact O-N 3.25Å; E24-M27 PolarHBondContact O-N 3.47Å; E24-L28 WeakPolarHBondContact O-CB 3.41Å; E24-L28 PolarHBondContact O-N 3.37Å |
| 25 | G | 88.4 | Confident | 87 | Confident | 33 Ų | 33 | 57.8 Ų | 57.8 | 34% | 0.34 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.5 | -38.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L21 C22 L23 S29 | L21-G25 PolarHBondContact O-N 2.96Å; C22-G25 PolarHBondContact O-N 3.45Å; L23-G25 VanDerWaalsContact C-N 3.29Å; L23-G25 PolarHBondContact O-N 3.39Å; G25-S29 PolarHBondContact O-N 3.12Å; G25-S29 VanDerWaalsContact O-N 3.13Å |
| 26 | M | 90.3 | Very high | 87.7 | Confident | 15 Ų | 15 | 58.5 Ų | 58.5 | 7% | 0.074 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.6 | -49.1 | 173.8 | -73.6 | -172.4 | -68.6 | 0 | 0 | 110.9 | F2 S5 L6 M9 C22 L23 E24 L28 S29 L30 | F2-M26 HydrophobicContact CD2-CB 4.18Å; F2-M26 HydrophobicContact CD2-CG 4.29Å; F2-M26 HydrophobicContact CE2-CB 4.07Å; F2-M26 HydrophobicContact CE2-CG 4.25Å; F2-M26 HydrophobicContact CE2-SD 4.42Å; S5-M26 WeakPolarHBondContact OG-CG 3.45Å; L6-M26 HydrophobicContact CB-SD 4.07Å; L6-M26 HydrophobicContact CD1-SD 4.16Å; M9-M26 HydrophobicContact CB-CE 4.24Å; M9-M26 HydrophobicContact CE-CE 4.27Å; M9-M26 HydrophobicContact CG-CE 4.36Å; C22-M26 WeakPolarHBondContact O-CG 3.35Å; C22-M26 PolarHBondContact O-N 2.93Å; L23-M26 HydrophobicContact CB-CE 4.32Å; L23-M26 HydrophobicContact CD2-CE 4.1Å; L23-M26 HydrophobicContact CG-CE 3.79Å; L23-M26 WeakPolarHBondContact O-CB 3.45Å; L23-M26 PolarHBondContact O-N 3.42Å; L23-M26 VanDerWaalsContact O-N 3.13Å; E24-M26 VanDerWaalsContact C-N 3.34Å; E24-M26 PolarHBondContact O-N 3.25Å; M26-L28 VanDerWaalsContact C-N 3.34Å; M26-L28 PolarHBondContact O-N 2.64Å; M26-S29 PolarHBondContact O-N 3.21Å; M26-S29 PolarHBondContact O-OG 3.3Å; M26-L30 PolarHBondContact O-N 2.99Å |
| 27 | M | 91.9 | Very high | 88.3 | Confident | 45 Ų | 45 | 62.4 Ų | 62.4 | 22% | 0.222 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62 | -40.9 | -178.9 | -63.4 | -54.9 | -79.5 | 0 | 0 | 112.1 | L23 E24 S29 L30 F31 A57 | L23-M27 WeakPolarHBondContact O-CG 3.46Å; L23-M27 PolarHBondContact O-N 3Å; E24-M27 PolarHBondContact O-N 3.47Å; M27-S29 PolarHBondContact O-N 3.49Å; M27-L30 PolarHBondContact O-N 3.48Å; M27-L30 HydrophobicContact SD-CD1 4.45Å; M27-F31 PolarHBondContact O-N 3.34Å; M27-A57 HydrophobicContact CB-CB 4.02Å; M27-A57 HydrophobicContact CE-CB 3.29Å; M27-A57 HydrophobicContact CG-CB 3.96Å; M27-A57 HydrophobicContact SD-CB 4.47Å |
| 28 | L | 90.4 | Very high | 88.6 | Confident | 110 Ų | 110 | 59.2 Ų | 59.2 | 58% | 0.576 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -65.1 | -39.5 | 176.7 | -165.5 | 146.9 | 0 | 0 | 0 | 111.7 | E24 M26 F31 I32 | E24-L28 WeakPolarHBondContact O-CB 3.41Å; E24-L28 PolarHBondContact O-N 3.37Å; M26-L28 VanDerWaalsContact C-N 3.34Å; M26-L28 PolarHBondContact O-N 2.64Å; L28-F31 PolarHBondContact O-N 3.09Å; L28-I32 HydrophobicContact CD2-CD1 3.57Å; L28-I32 HydrophobicContact CD2-CG1 4.3Å; L28-I32 WeakPolarHBondContact O-CG1 3.4Å; L28-I32 PolarHBondContact O-N 3.08Å |
| 29 | S | 92.4 | Very high | 88.7 | Confident | 21 Ų | 21 | 62.5 Ų | 62.5 | 15% | 0.147 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -67.3 | -36.1 | 176.7 | 74.2 | 0 | 0 | 0 | 0 | 113.2 | F2 G25 M26 M27 M33 | F2-S29 WeakPolarHBondContact CB-OG 3.4Å; G25-S29 PolarHBondContact O-N 3.12Å; G25-S29 VanDerWaalsContact O-N 3.13Å; M26-S29 PolarHBondContact O-N 3.21Å; M26-S29 PolarHBondContact O-OG 3.3Å; M27-S29 PolarHBondContact O-N 3.49Å; S29-M33 PolarHBondContact O-N 3.12Å; S29-M33 VanDerWaalsContact O-N 3.11Å |
| 30 | L | 90.1 | Very high | 88.9 | Confident | 58 Ų | 58 | 66.9 Ų | 66.9 | 30% | 0.304 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.3 | -40.6 | 172.9 | -76.9 | 170.1 | 0 | 0 | 0 | 111.5 | F2 M26 M27 M33 A34 | F2-L30 HydrophobicContact CD2-CD1 4.45Å; F2-L30 HydrophobicContact CD2-CD2 4.38Å; F2-L30 HydrophobicContact CD2-CG 4.04Å; F2-L30 HydrophobicContact CE2-CD1 3.86Å; F2-L30 HydrophobicContact CE2-CD2 4.24Å; F2-L30 HydrophobicContact CE2-CG 3.92Å; M26-L30 PolarHBondContact O-N 2.99Å; M27-L30 PolarHBondContact O-N 3.48Å; M27-L30 HydrophobicContact SD-CD1 4.45Å; L30-M33 HydrophobicContact CD2-CE 4.29Å; L30-M33 PolarHBondContact O-N 2.7Å; L30-A34 WeakPolarHBondContact O-CB 3.47Å; L30-A34 PolarHBondContact O-N 2.96Å |
| 31 | F | 92.2 | Very high | 88.7 | Confident | 68 Ų | 68 | 70.1 Ų | 70.1 | 30% | 0.298 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61 | -46.3 | 175.7 | 176.8 | -99.4 | 0 | 0 | 0 | 112.1 | M27 L28 M33 A34 T35 P50 L54 | M27-F31 PolarHBondContact O-N 3.34Å; L28-F31 PolarHBondContact O-N 3.09Å; F31-M33 VanDerWaalsContact C-N 3.34Å; F31-M33 PolarHBondContact O-N 3.28Å; F31-A34 PolarHBondContact O-N 2.91Å; F31-T35 HydrophobicContact CD1-CG2 4.3Å; F31-T35 HydrophobicContact CD2-CG2 4.21Å; F31-T35 HydrophobicContact CE1-CG2 3.88Å; F31-T35 HydrophobicContact CE2-CG2 3.79Å; F31-T35 HydrophobicContact CG-CG2 4.45Å; F31-T35 HydrophobicContact CZ-CG2 3.61Å; F31-T35 WeakPolarHBondContact O-CB 3.24Å; F31-T35 VanDerWaalsContact O-CG2 3.32Å; F31-T35 WeakPolarHBondContact O-CG2 3.21Å; F31-T35 PolarHBondContact O-N 2.94Å; F31-T35 PolarHBondContact O-OG1 3.31Å; F31-P50 HydrophobicContact CD2-CB 3.77Å; F31-P50 WeakPolarHBondContact CD2-O 3.19Å; F31-P50 HydrophobicContact CE2-CB 3.61Å; F31-L54 HydrophobicContact CD2-CB 4.44Å; F31-L54 HydrophobicContact CD2-CD1 3.89Å; F31-L54 HydrophobicContact CE2-CD1 3.79Å; F31-L54 HydrophobicContact CG-CD1 4.31Å; F31-L54 HydrophobicContact CZ-CD1 4.13Å |
| 32 | I | 92.3 | Very high | 88.4 | Confident | 85 Ų | 85 | 73.1 Ų | 73.1 | 44% | 0.436 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -61.5 | -43.7 | 177.1 | -66.9 | 171.6 | 0 | 0 | 0 | 110.8 | L28 T35 L36 | L28-I32 HydrophobicContact CD2-CD1 3.57Å; L28-I32 HydrophobicContact CD2-CG1 4.3Å; L28-I32 WeakPolarHBondContact O-CG1 3.4Å; L28-I32 PolarHBondContact O-N 3.08Å; I32-T35 WeakPolarHBondContact CA-OG1 3.45Å; I32-T35 PolarHBondContact O-OG1 3.01Å; I32-L36 HydrophobicContact CG2-CD1 3.88Å; I32-L36 HydrophobicContact CG2-CG 4.46Å; I32-L36 WeakPolarHBondContact O-CB 3.44Å; I32-L36 VanDerWaalsContact O-CG 3.3Å; I32-L36 WeakPolarHBondContact O-CG 3.37Å; I32-L36 PolarHBondContact O-N 3.01Å |
| 33 | M | 90.8 | Very high | 87.9 | Confident | 107 Ų | 107 | 73.6 Ų | 73.6 | 53% | 0.527 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.8 | -44.9 | 178.3 | -170.5 | -174.1 | 74 | 0 | 0 | 111.8 | S29 L30 F31 L36 M37 | S29-M33 PolarHBondContact O-N 3.12Å; S29-M33 VanDerWaalsContact O-N 3.11Å; L30-M33 HydrophobicContact CD2-CE 4.29Å; L30-M33 PolarHBondContact O-N 2.7Å; F31-M33 VanDerWaalsContact C-N 3.34Å; F31-M33 PolarHBondContact O-N 3.28Å; M33-L36 PolarHBondContact O-N 3.27Å; M33-M37 WeakPolarHBondContact O-CG 3.48Å; M33-M37 PolarHBondContact O-N 3.39Å |
| 34 | A | 88.6 | Confident | 87.4 | Confident | 29 Ų | 29 | 77.8 Ų | 77.8 | 24% | 0.24 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -63.6 | -44.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L30 F31 M37 T38 P50 | L30-A34 WeakPolarHBondContact O-CB 3.47Å; L30-A34 PolarHBondContact O-N 2.96Å; F31-A34 PolarHBondContact O-N 2.91Å; A34-M37 PolarHBondContact O-N 3.42Å; A34-T38 WeakPolarHBondContact O-CG2 3.27Å; A34-T38 PolarHBondContact O-N 3.37Å; A34-P50 HydrophobicContact CB-CB 4.44Å; A34-P50 HydrophobicContact CB-CG 4.04Å |
| 35 | T | 89.1 | Confident | 87 | Confident | 29 Ų | 29 | 80 Ų | 80 | 18% | 0.178 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -64.9 | -38.9 | 177.5 | 51.5 | 0 | 0 | 0 | 0 | 112.7 | F31 I32 M37 T38 L39 P50 | F31-T35 HydrophobicContact CD1-CG2 4.3Å; F31-T35 HydrophobicContact CD2-CG2 4.21Å; F31-T35 HydrophobicContact CE1-CG2 3.88Å; F31-T35 HydrophobicContact CE2-CG2 3.79Å; F31-T35 HydrophobicContact CG-CG2 4.45Å; F31-T35 HydrophobicContact CZ-CG2 3.61Å; F31-T35 WeakPolarHBondContact O-CB 3.24Å; F31-T35 VanDerWaalsContact O-CG2 3.32Å; F31-T35 WeakPolarHBondContact O-CG2 3.21Å; F31-T35 PolarHBondContact O-N 2.94Å; F31-T35 PolarHBondContact O-OG1 3.31Å; I32-T35 WeakPolarHBondContact CA-OG1 3.45Å; I32-T35 PolarHBondContact O-OG1 3.01Å; T35-M37 VanDerWaalsContact C-N 3.31Å; T35-M37 PolarHBondContact O-N 2.78Å; T35-T38 WeakPolarHBondContact CA-OG1 3.48Å; T35-T38 PolarHBondContact O-N 3.13Å; T35-T38 PolarHBondContact O-OG1 2.99Å; T35-L39 WeakPolarHBondContact O-CB 3.39Å; T35-L39 WeakPolarHBondContact O-CD1 3.44Å; T35-L39 WeakPolarHBondContact O-CG 3.26Å; T35-L39 PolarHBondContact O-N 3.42Å; T35-P50 HydrophobicContact CG2-CB 3.74Å; T35-P50 HydrophobicContact CG2-CG 3.98Å |
| 36 | L | 90.2 | Very high | 86.6 | Confident | 95 Ų | 95 | 80 Ų | 80 | 50% | 0.497 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -63.1 | -38.5 | 173.8 | -74.6 | 169.1 | 0 | 0 | 0 | 112 | I32 M33 N40 | I32-L36 HydrophobicContact CG2-CD1 3.88Å; I32-L36 HydrophobicContact CG2-CG 4.46Å; I32-L36 WeakPolarHBondContact O-CB 3.44Å; I32-L36 VanDerWaalsContact O-CG 3.3Å; I32-L36 WeakPolarHBondContact O-CG 3.37Å; I32-L36 PolarHBondContact O-N 3.01Å; M33-L36 PolarHBondContact O-N 3.27Å; L36-N40 WeakPolarHBondContact O-CB 3.41Å; L36-N40 PolarHBondContact O-N 3.33Å; L36-N40 PolarHBondContact O-ND2 3.47Å |
| 37 | M | 87.4 | Confident | 86.2 | Confident | 116 Ų | 116 | 82.5 Ų | 82.5 | 57% | 0.571 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -68.7 | -39.6 | 177 | -70.1 | -62.5 | -168 | 0 | 0 | 112.7 | M33 A34 T35 N40 T41 | M33-M37 WeakPolarHBondContact O-CG 3.48Å; M33-M37 PolarHBondContact O-N 3.39Å; A34-M37 PolarHBondContact O-N 3.42Å; T35-M37 VanDerWaalsContact C-N 3.31Å; T35-M37 PolarHBondContact O-N 2.78Å; M37-N40 PolarHBondContact O-N 3Å; M37-T41 WeakPolarHBondContact O-CG2 3.15Å; M37-T41 PolarHBondContact O-N 3.24Å; M37-T41 VanDerWaalsContact O-N 3.12Å; M37-T41 PolarHBondContact O-OG1 3.46Å |
| 38 | T | 87.2 | Confident | 86 | Confident | 15 Ų | 15 | 85.7 Ų | 85.7 | 9% | 0.092 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -66.7 | -39.7 | 176.1 | 59.5 | 0 | 0 | 0 | 0 | 111.4 | A34 T35 T41 H42 S43 A46 N47 P50 | A34-T38 WeakPolarHBondContact O-CG2 3.27Å; A34-T38 PolarHBondContact O-N 3.37Å; T35-T38 WeakPolarHBondContact CA-OG1 3.48Å; T35-T38 PolarHBondContact O-N 3.13Å; T35-T38 PolarHBondContact O-OG1 2.99Å; T38-T41 PolarHBondContact O-N 3.48Å; T38-T41 PolarHBondContact O-OG1 3.08Å; T38-H42 PolarHBondContact O-N 3.49Å; T38-S43 PolarHBondContact O-N 3.42Å; T38-A46 HydrophobicContact CG2-CB 3.74Å; T38-A46 WeakPolarHBondContact CG2-O 3.46Å; T38-N47 PolarHBondContact OG1-OD1 3.13Å; T38-P50 HydrophobicContact CG2-CG 4.12Å |
| 39 | L | 86.3 | Confident | 85.8 | Confident | 112 Ų | 112 | 84.8 Ų | 84.8 | 59% | 0.586 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -63.2 | -45.9 | 175.1 | -71.8 | 168.9 | 0 | 0 | 0 | 111.9 | T35 T41 H42 | T35-L39 WeakPolarHBondContact O-CB 3.39Å; T35-L39 WeakPolarHBondContact O-CD1 3.44Å; T35-L39 WeakPolarHBondContact O-CG 3.26Å; T35-L39 PolarHBondContact O-N 3.42Å; L39-T41 VanDerWaalsContact C-N 3.3Å; L39-T41 PolarHBondContact O-N 2.94Å; L39-H42 PolarHBondContact O-N 3.01Å |
| 40 | N | 86.4 | Confident | 85.7 | Confident | 123 Ų | 123 | 83.9 Ų | 83.9 | 66% | 0.658 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -63.9 | -33.3 | 179 | -81.5 | -26.3 | 0 | 0 | 0 | 113.3 | L36 M37 H42 | L36-N40 WeakPolarHBondContact O-CB 3.41Å; L36-N40 PolarHBondContact O-N 3.33Å; L36-N40 PolarHBondContact O-ND2 3.47Å; M37-N40 PolarHBondContact O-N 3Å; N40-H42 VanDerWaalsContact C-N 3.31Å |
| 41 | T | 82.9 | Confident | 85.7 | Confident | 92 Ų | 92 | 86.1 Ų | 86.1 | 56% | 0.564 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.8 | 1 | -179.7 | 55 | 0 | 0 | 0 | 0 | 113.2 | M37 T38 L39 S43 | M37-T41 WeakPolarHBondContact O-CG2 3.15Å; M37-T41 PolarHBondContact O-N 3.24Å; M37-T41 VanDerWaalsContact O-N 3.12Å; M37-T41 PolarHBondContact O-OG1 3.46Å; T38-T41 PolarHBondContact O-N 3.48Å; T38-T41 PolarHBondContact O-OG1 3.08Å; L39-T41 VanDerWaalsContact C-N 3.3Å; L39-T41 PolarHBondContact O-N 2.94Å; T41-S43 PolarHBondContact O-N 3.33Å; T41-S43 PolarHBondContact OG1-OG 3.27Å |
| 42 | H | 78.8 | Confident | 85.7 | Confident | 175 Ų | 175 | 84.8 Ų | 84.8 | 81% | 0.81 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.2 | 29.1 | -175.6 | -67.6 | -69.5 | 0 | 0 | 0 | 113.9 | T38 L39 N40 L44 | T38-H42 PolarHBondContact O-N 3.49Å; L39-H42 PolarHBondContact O-N 3.01Å; N40-H42 VanDerWaalsContact C-N 3.31Å; H42-L44 PolarHBondContact O-N 3.45Å |
| 43 | S | 76 | Confident | 85.6 | Confident | 43 Ų | 43 | 85 Ų | 85 | 30% | 0.301 | 46% | 0.463 | S | S | . | . | trans | -96.3 | 91.1 | -174.2 | 58.2 | 0 | 0 | 0 | 0 | 110.2 | T38 T41 L45 A46 | T38-S43 PolarHBondContact O-N 3.42Å; T41-S43 PolarHBondContact O-N 3.33Å; T41-S43 PolarHBondContact OG1-OG 3.27Å; S43-L45 PolarHBondContact O-N 3.5Å; S43-A46 WeakPolarHBondContact O-CB 3.45Å; S43-A46 PolarHBondContact O-N 3.02Å; S43-A46 WeakPolarHBondContact OG-CB 3.31Å | ||
| 44 | L | 74.8 | Confident | 85.7 | Confident | 159 Ų | 159 | 84.2 Ų | 84.2 | 83% | 0.832 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | -58.7 | -32.9 | -178.8 | -67.5 | 172.6 | 0 | 0 | 0 | 113.1 | H42 A46 N47 | H42-L44 PolarHBondContact O-N 3.45Å; L44-A46 VanDerWaalsContact C-N 3.33Å; L44-A46 PolarHBondContact O-N 3.34Å; L44-N47 WeakPolarHBondContact O-CB 3.49Å; L44-N47 PolarHBondContact O-N 3.11Å |
| 45 | L | 79.7 | Confident | 85.9 | Confident | 151 Ų | 151 | 86.9 Ų | 86.9 | 79% | 0.791 | 47% | 0.473 | S | S | * | . | G | 310 helix | trans | -66.6 | -32.7 | 175.5 | -83.1 | 158.9 | 0 | 0 | 0 | 112.9 | S43 N47 I48 | S43-L45 PolarHBondContact O-N 3.5Å; L45-N47 PolarHBondContact O-N 3.1Å; L45-I48 PolarHBondContact O-N 3.24Å |
| 46 | A | 81 | Confident | 86 | Confident | 31 Ų | 31 | 92.2 Ų | 92.2 | 26% | 0.256 | 49% | 0.494 | S | S | . | . | G | 310 helix | trans | -72.5 | -13.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | T38 S43 L44 I48 V49 P50 | T38-A46 HydrophobicContact CG2-CB 3.74Å; T38-A46 WeakPolarHBondContact CG2-O 3.46Å; S43-A46 WeakPolarHBondContact O-CB 3.45Å; S43-A46 PolarHBondContact O-N 3.02Å; S43-A46 WeakPolarHBondContact OG-CB 3.31Å; L44-A46 VanDerWaalsContact C-N 3.33Å; L44-A46 PolarHBondContact O-N 3.34Å; A46-I48 PolarHBondContact O-N 3.23Å; A46-V49 WeakPolarHBondContact O-CB 3.42Å; A46-V49 PolarHBondContact O-N 3.44Å; A46-P50 WeakPolarHBondContact O-CD 3.34Å |
| 47 | N | 80.9 | Confident | 86.1 | Confident | 69 Ų | 69 | 88.5 Ų | 88.5 | 37% | 0.369 | 48% | 0.478 | S | S | . | . | G | 310 helix | trans | -67.8 | -14.4 | 178.2 | -134.8 | 29.9 | 0 | 0 | 0 | 113.5 | T38 L44 L45 V49 P50 I51 | T38-N47 PolarHBondContact OG1-OD1 3.13Å; L44-N47 WeakPolarHBondContact O-CB 3.49Å; L44-N47 PolarHBondContact O-N 3.11Å; L45-N47 PolarHBondContact O-N 3.1Å; N47-V49 VanDerWaalsContact C-N 3.27Å; N47-P50 WeakPolarHBondContact O-CD 3.49Å; N47-I51 WeakPolarHBondContact O-CD1 3.42Å; N47-I51 WeakPolarHBondContact O-CG1 3.45Å |
| 48 | I | 87.6 | Confident | 86.2 | Confident | 111 Ų | 111 | 85.7 Ų | 85.7 | 57% | 0.569 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -66.7 | -31.9 | 171 | -61.5 | 172.7 | 0 | 0 | 0 | 110.7 | L45 A46 I51 A52 | L45-I48 PolarHBondContact O-N 3.24Å; A46-I48 PolarHBondContact O-N 3.23Å; I48-I51 PolarHBondContact O-N 2.96Å; I48-A52 WeakPolarHBondContact O-CB 3.47Å; I48-A52 PolarHBondContact O-N 3.44Å |
| 49 | V | 87.6 | Confident | 86.4 | Confident | 91 Ų | 91 | 88.4 Ų | 88.4 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65.9 | -50.6 | -175.2 | 178.4 | 0 | 0 | 0 | 0 | 112.3 | A46 N47 I51 A52 M53 | A46-V49 WeakPolarHBondContact O-CB 3.42Å; A46-V49 PolarHBondContact O-N 3.44Å; N47-V49 VanDerWaalsContact C-N 3.27Å; V49-I51 VanDerWaalsContact C-N 3.26Å; V49-I51 PolarHBondContact O-N 2.92Å; V49-A52 PolarHBondContact O-N 3.47Å; V49-M53 HydrophobicContact CG1-CG 4.44Å; V49-M53 WeakPolarHBondContact O-CB 3.24Å; V49-M53 VanDerWaalsContact O-CG 3.26Å; V49-M53 WeakPolarHBondContact O-CG 3.39Å; V49-M53 PolarHBondContact O-N 2.92Å |
| 50 | P | 89.3 | Confident | 86.6 | Confident | 2 Ų | 2 | 88.8 Ų | 88.8 | 1% | 0.013 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -58.2 | -35.9 | 174.5 | -23.9 | 31.3 | 0 | 0 | 0 | 113.8 | F31 A34 T35 T38 A46 N47 L54 | F31-P50 HydrophobicContact CD2-CB 3.77Å; F31-P50 WeakPolarHBondContact CD2-O 3.19Å; F31-P50 HydrophobicContact CE2-CB 3.61Å; A34-P50 HydrophobicContact CB-CB 4.44Å; A34-P50 HydrophobicContact CB-CG 4.04Å; T35-P50 HydrophobicContact CG2-CB 3.74Å; T35-P50 HydrophobicContact CG2-CG 3.98Å; T38-P50 HydrophobicContact CG2-CG 4.12Å; A46-P50 WeakPolarHBondContact O-CD 3.34Å; N47-P50 WeakPolarHBondContact O-CD 3.49Å; P50-L54 PolarHBondContact O-N 3.27Å; P50-L54 VanDerWaalsContact O-N 3.09Å |
| 51 | I | 90.3 | Very high | 86.7 | Confident | 105 Ų | 105 | 84.1 Ų | 84.1 | 54% | 0.538 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -69.6 | -47.9 | 179.7 | -60.9 | 168.9 | 0 | 0 | 0 | 110.3 | N47 I48 V49 M53 L54 V55 | N47-I51 WeakPolarHBondContact O-CD1 3.42Å; N47-I51 WeakPolarHBondContact O-CG1 3.45Å; I48-I51 PolarHBondContact O-N 2.96Å; V49-I51 VanDerWaalsContact C-N 3.26Å; V49-I51 PolarHBondContact O-N 2.92Å; I51-M53 VanDerWaalsContact C-N 3.31Å; I51-M53 PolarHBondContact O-N 3.34Å; I51-L54 PolarHBondContact O-N 2.96Å; I51-L54 VanDerWaalsContact O-N 3.14Å; I51-V55 WeakPolarHBondContact O-CG2 3.5Å; I51-V55 PolarHBondContact O-N 3.42Å; I51-V55 VanDerWaalsContact O-N 3.1Å |
| 52 | A | 92.2 | Very high | 87.1 | Confident | 41 Ų | 41 | 82.5 Ų | 82.5 | 34% | 0.339 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59.3 | -43.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | I48 V49 L54 V55 F56 | I48-A52 WeakPolarHBondContact O-CB 3.47Å; I48-A52 PolarHBondContact O-N 3.44Å; V49-A52 PolarHBondContact O-N 3.47Å; A52-L54 VanDerWaalsContact C-N 3.3Å; A52-L54 PolarHBondContact O-N 2.97Å; A52-V55 PolarHBondContact O-N 2.87Å; A52-F56 WeakPolarHBondContact O-CD2 3.34Å; A52-F56 PolarHBondContact O-N 3.04Å; A52-F56 VanDerWaalsContact O-N 3.13Å |
| 53 | M | 91.4 | Very high | 87.7 | Confident | 88 Ų | 88 | 78.5 Ų | 78.5 | 43% | 0.433 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -56.9 | -41.7 | 174.5 | -75.2 | -70.8 | -67.4 | 0 | 0 | 112.4 | V49 I51 F56 A57 | V49-M53 HydrophobicContact CG1-CG 4.44Å; V49-M53 WeakPolarHBondContact O-CB 3.24Å; V49-M53 VanDerWaalsContact O-CG 3.26Å; V49-M53 WeakPolarHBondContact O-CG 3.39Å; V49-M53 PolarHBondContact O-N 2.92Å; I51-M53 VanDerWaalsContact C-N 3.31Å; I51-M53 PolarHBondContact O-N 3.34Å; M53-F56 PolarHBondContact O-N 3.35Å; M53-A57 WeakPolarHBondContact O-CB 3.48Å; M53-A57 PolarHBondContact O-N 3.42Å |
| 54 | L | 91.3 | Very high | 88.2 | Confident | 91 Ų | 91 | 77.1 Ų | 77.1 | 48% | 0.476 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -67.8 | -38 | 179.9 | -157.5 | 158.1 | 0 | 0 | 0 | 111.8 | F31 P50 I51 A52 A57 A58 | F31-L54 HydrophobicContact CD2-CB 4.44Å; F31-L54 HydrophobicContact CD2-CD1 3.89Å; F31-L54 HydrophobicContact CE2-CD1 3.79Å; F31-L54 HydrophobicContact CG-CD1 4.31Å; F31-L54 HydrophobicContact CZ-CD1 4.13Å; P50-L54 PolarHBondContact O-N 3.27Å; P50-L54 VanDerWaalsContact O-N 3.09Å; I51-L54 PolarHBondContact O-N 2.96Å; I51-L54 VanDerWaalsContact O-N 3.14Å; A52-L54 VanDerWaalsContact C-N 3.3Å; A52-L54 PolarHBondContact O-N 2.97Å; L54-A57 WeakPolarHBondContact O-CB 3.45Å; L54-A57 PolarHBondContact O-N 2.94Å; L54-A58 PolarHBondContact O-N 2.95Å |
| 55 | V | 94.3 | Very high | 88.9 | Confident | 85 Ų | 85 | 73.3 Ų | 73.3 | 52% | 0.515 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.5 | -48.1 | 175.6 | 176.4 | 0 | 0 | 0 | 0 | 110.9 | I51 A52 A57 A58 C59 | I51-V55 WeakPolarHBondContact O-CG2 3.5Å; I51-V55 PolarHBondContact O-N 3.42Å; I51-V55 VanDerWaalsContact O-N 3.1Å; A52-V55 PolarHBondContact O-N 2.87Å; V55-A57 VanDerWaalsContact C-N 3.31Å; V55-A57 PolarHBondContact O-N 3.33Å; V55-A58 PolarHBondContact O-N 3.29Å; V55-C59 PolarHBondContact O-N 3.05Å; V55-C59 VanDerWaalsContact O-N 3.08Å; V55-C59 PolarHBondContact O-SG 3.04Å |
| 56 | F | 91.3 | Very high | 89.3 | Confident | 141 Ų | 141 | 69.1 Ų | 69.1 | 62% | 0.618 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -62.4 | -38.6 | 176.5 | -75.6 | -68.1 | 0 | 0 | 0 | 112.2 | A52 M53 A58 C59 E60 | A52-F56 WeakPolarHBondContact O-CD2 3.34Å; A52-F56 PolarHBondContact O-N 3.04Å; A52-F56 VanDerWaalsContact O-N 3.13Å; M53-F56 PolarHBondContact O-N 3.35Å; F56-A58 VanDerWaalsContact C-N 3.34Å; F56-A58 PolarHBondContact O-N 3.3Å; F56-C59 WeakPolarHBondContact O-CB 3.36Å; F56-C59 PolarHBondContact O-N 3.09Å; F56-E60 PolarHBondContact O-N 3.14Å |
| 57 | A | 90.8 | Very high | 89.5 | Confident | 18 Ų | 18 | 72.4 Ų | 72.4 | 15% | 0.149 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -57.4 | -45.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | M27 M53 L54 V55 C59 E60 A61 | M27-A57 HydrophobicContact CB-CB 4.02Å; M27-A57 HydrophobicContact CE-CB 3.29Å; M27-A57 HydrophobicContact CG-CB 3.96Å; M27-A57 HydrophobicContact SD-CB 4.47Å; M53-A57 WeakPolarHBondContact O-CB 3.48Å; M53-A57 PolarHBondContact O-N 3.42Å; L54-A57 WeakPolarHBondContact O-CB 3.45Å; L54-A57 PolarHBondContact O-N 2.94Å; V55-A57 VanDerWaalsContact C-N 3.31Å; V55-A57 PolarHBondContact O-N 3.33Å; A57-C59 VanDerWaalsContact C-N 3.32Å; A57-C59 PolarHBondContact O-N 3.48Å; A57-E60 PolarHBondContact O-N 3.18Å; A57-A61 WeakPolarHBondContact O-CB 3.43Å; A57-A61 PolarHBondContact O-N 3Å |
| 58 | A | 90.9 | Very high | 89.7 | Confident | 57 Ų | 57 | 69.8 Ų | 69.8 | 47% | 0.471 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -65.7 | -36.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L54 V55 F56 A61 A62 | L54-A58 PolarHBondContact O-N 2.95Å; V55-A58 PolarHBondContact O-N 3.29Å; F56-A58 VanDerWaalsContact C-N 3.34Å; F56-A58 PolarHBondContact O-N 3.3Å; A58-A61 PolarHBondContact O-N 3.38Å; A58-A62 WeakPolarHBondContact O-CB 3.44Å; A58-A62 PolarHBondContact O-N 2.88Å |
| 59 | C | 91.6 | Very high | 89.7 | Confident | 71 Ų | 71 | 68.2 Ų | 68.2 | 48% | 0.48 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.5 | -47 | 174.3 | -65.3 | 0 | 0 | 0 | 0 | 111.8 | V55 F56 A57 A61 A62 V63 | V55-C59 PolarHBondContact O-N 3.05Å; V55-C59 VanDerWaalsContact O-N 3.08Å; V55-C59 PolarHBondContact O-SG 3.04Å; F56-C59 WeakPolarHBondContact O-CB 3.36Å; F56-C59 PolarHBondContact O-N 3.09Å; A57-C59 VanDerWaalsContact C-N 3.32Å; A57-C59 PolarHBondContact O-N 3.48Å; C59-A61 VanDerWaalsContact C-N 3.34Å; C59-A61 PolarHBondContact O-N 3.34Å; C59-A62 PolarHBondContact O-N 3.34Å; C59-V63 WeakPolarHBondContact O-CG2 3.45Å; C59-V63 PolarHBondContact O-N 2.92Å |
| 60 | E | 89.1 | Confident | 89.5 | Confident | 120 Ų | 120 | 66.5 Ų | 66.5 | 56% | 0.561 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -61.1 | -42.8 | 176.8 | -71.4 | -176.1 | 169.4 | 0 | 0 | 111.9 | F56 A57 A62 V63 G64 | F56-E60 PolarHBondContact O-N 3.14Å; A57-E60 PolarHBondContact O-N 3.18Å; E60-A62 PolarHBondContact O-N 3.44Å; E60-V63 PolarHBondContact O-N 3.13Å; E60-G64 PolarHBondContact O-N 3.43Å |
| 61 | A | 89.7 | Confident | 89 | Confident | 25 Ų | 25 | 67.7 Ų | 67.7 | 21% | 0.207 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -62.2 | -41.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | A57 A58 C59 G64 L65 | A57-A61 WeakPolarHBondContact O-CB 3.43Å; A57-A61 PolarHBondContact O-N 3Å; A58-A61 PolarHBondContact O-N 3.38Å; C59-A61 VanDerWaalsContact C-N 3.34Å; C59-A61 PolarHBondContact O-N 3.34Å; A61-G64 PolarHBondContact O-N 3.32Å; A61-L65 WeakPolarHBondContact O-CG 3.43Å; A61-L65 PolarHBondContact O-N 3.01Å |
| 62 | A | 90.6 | Very high | 88.6 | Confident | 59 Ų | 59 | 64.2 Ų | 64.2 | 49% | 0.488 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.6 | -43 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A58 C59 E60 L65 A66 | A58-A62 WeakPolarHBondContact O-CB 3.44Å; A58-A62 PolarHBondContact O-N 2.88Å; C59-A62 PolarHBondContact O-N 3.34Å; E60-A62 PolarHBondContact O-N 3.44Å; A62-L65 PolarHBondContact O-N 3.34Å; A62-A66 WeakPolarHBondContact O-CB 3.48Å; A62-A66 PolarHBondContact O-N 2.76Å |
| 63 | V | 90.4 | Very high | 88.1 | Confident | 90 Ų | 90 | 68.5 Ų | 68.5 | 55% | 0.545 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -66.4 | -41.2 | 174.9 | 179.7 | 0 | 0 | 0 | 0 | 111 | C59 E60 L65 A66 L67 | C59-V63 WeakPolarHBondContact O-CG2 3.45Å; C59-V63 PolarHBondContact O-N 2.92Å; E60-V63 PolarHBondContact O-N 3.13Å; V63-L65 PolarHBondContact O-N 2.86Å; V63-A66 PolarHBondContact O-N 3.03Å; V63-L67 HydrophobicContact CG1-CD1 4.38Å; V63-L67 WeakPolarHBondContact O-CG 3.42Å; V63-L67 PolarHBondContact O-N 3.27Å |
| 64 | G | 88.6 | Confident | 87.5 | Confident | 14 Ų | 14 | 69 Ų | 69 | 14% | 0.144 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -59.8 | -42.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | E60 A61 L67 L68 | E60-G64 PolarHBondContact O-N 3.43Å; A61-G64 PolarHBondContact O-N 3.32Å; G64-L67 PolarHBondContact O-N 3.22Å; G64-L68 PolarHBondContact O-N 3.2Å |
| 65 | L | 87.4 | Confident | 86.6 | Confident | 80 Ų | 80 | 68.4 Ų | 68.4 | 42% | 0.419 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -67.4 | -41.3 | 174.7 | -74.1 | 165.6 | 0 | 0 | 0 | 112.2 | M17 L20 A61 A62 V63 L67 L68 V69 | M17-L65 HydrophobicContact SD-CD2 4.49Å; L20-L65 HydrophobicContact CD1-CD2 4.03Å; L20-L65 HydrophobicContact CD1-CG 4.4Å; A61-L65 WeakPolarHBondContact O-CG 3.43Å; A61-L65 PolarHBondContact O-N 3.01Å; A62-L65 PolarHBondContact O-N 3.34Å; V63-L65 PolarHBondContact O-N 2.86Å; L65-L67 VanDerWaalsContact C-N 3.3Å; L65-L67 PolarHBondContact O-N 3.35Å; L65-L68 WeakPolarHBondContact O-CB 3.14Å; L65-L68 PolarHBondContact O-N 3.25Å; L65-L68 VanDerWaalsContact O-N 3.16Å; L65-V69 WeakPolarHBondContact O-CG2 3.32Å; L65-V69 PolarHBondContact O-N 3.34Å |
| 66 | A | 89.3 | Confident | 85.3 | Confident | 63 Ų | 63 | 67.3 Ų | 67.3 | 52% | 0.521 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60.3 | -41 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | A62 V63 V69 S70 | A62-A66 WeakPolarHBondContact O-CB 3.48Å; A62-A66 PolarHBondContact O-N 2.76Å; V63-A66 PolarHBondContact O-N 3.03Å; A66-V69 PolarHBondContact O-N 3.26Å; A66-S70 PolarHBondContact O-N 3.45Å |
| 67 | L | 85.4 | Confident | 84.1 | Confident | 100 Ų | 100 | 65.1 Ų | 65.1 | 52% | 0.524 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.7 | -42.9 | 173.2 | -75.1 | 171.6 | 0 | 0 | 0 | 111.8 | V63 G64 L65 V69 S70 I71 | V63-L67 HydrophobicContact CG1-CD1 4.38Å; V63-L67 WeakPolarHBondContact O-CG 3.42Å; V63-L67 PolarHBondContact O-N 3.27Å; G64-L67 PolarHBondContact O-N 3.22Å; L65-L67 VanDerWaalsContact C-N 3.3Å; L65-L67 PolarHBondContact O-N 3.35Å; L67-V69 VanDerWaalsContact C-N 3.31Å; L67-V69 PolarHBondContact O-N 3.5Å; L67-S70 PolarHBondContact O-N 3.45Å; L67-S70 VanDerWaalsContact O-N 3.07Å; L67-S70 PolarHBondContact O-OG 3.32Å; L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 3.11Å |
| 68 | L | 85.1 | Confident | 82.7 | Confident | 13 Ų | 13 | 66.9 Ų | 66.9 | 7% | 0.068 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -59.3 | -44 | 177.2 | -165 | 156.8 | 0 | 0 | 0 | 111.6 | L16 M17 L20 G64 L65 S70 I71 S72 | L16-L68 HydrophobicContact CB-CD1 4.13Å; L16-L68 HydrophobicContact CD2-CB 4.14Å; L16-L68 HydrophobicContact CD2-CD1 3.69Å; L16-L68 HydrophobicContact CD2-CG 4.06Å; M17-L68 HydrophobicContact CB-CD1 4.48Å; M17-L68 HydrophobicContact CG-CD1 3.71Å; M17-L68 HydrophobicContact SD-CD1 3.24Å; M17-L68 WeakPolarHBondContact SD-CD1 3.41Å; M17-L68 HydrophobicContact SD-CD2 4.1Å; M17-L68 HydrophobicContact SD-CG 4.33Å; L20-L68 HydrophobicContact CD1-CB 4.5Å; L20-L68 HydrophobicContact CD1-CD1 3.57Å; G64-L68 PolarHBondContact O-N 3.2Å; L65-L68 WeakPolarHBondContact O-CB 3.14Å; L65-L68 PolarHBondContact O-N 3.25Å; L65-L68 VanDerWaalsContact O-N 3.16Å; L68-S70 VanDerWaalsContact C-N 3.29Å; L68-S70 PolarHBondContact O-N 2.9Å; L68-I71 PolarHBondContact O-N 3.13Å; L68-S72 PolarHBondContact O-N 2.84Å; L68-S72 PolarHBondContact O-OG 3.01Å |
| 69 | V | 86.2 | Confident | 81.4 | Confident | 79 Ų | 79 | 68.7 Ų | 68.7 | 48% | 0.479 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.7 | -37.4 | 174.8 | 174.5 | 0 | 0 | 0 | 0 | 111.7 | L65 A66 L67 S72 N73 | L65-V69 WeakPolarHBondContact O-CG2 3.32Å; L65-V69 PolarHBondContact O-N 3.34Å; A66-V69 PolarHBondContact O-N 3.26Å; L67-V69 VanDerWaalsContact C-N 3.31Å; L67-V69 PolarHBondContact O-N 3.5Å; V69-S72 WeakPolarHBondContact CA-OG 3.32Å; V69-S72 PolarHBondContact O-OG 3.03Å; V69-N73 WeakPolarHBondContact O-CB 3.19Å; V69-N73 VanDerWaalsContact O-CG 3.25Å; V69-N73 PolarHBondContact O-N 2.99Å; V69-N73 PolarHBondContact O-ND2 2.91Å |
| 70 | S | 83.9 | Confident | 79.9 | Confident | 54 Ų | 54 | 67.8 Ų | 67.8 | 38% | 0.378 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.1 | -40.8 | 175.6 | 74.7 | 0 | 0 | 0 | 0 | 112.5 | A66 L67 L68 N73 T74 | A66-S70 PolarHBondContact O-N 3.45Å; L67-S70 PolarHBondContact O-N 3.45Å; L67-S70 VanDerWaalsContact O-N 3.07Å; L67-S70 PolarHBondContact O-OG 3.32Å; L68-S70 VanDerWaalsContact C-N 3.29Å; L68-S70 PolarHBondContact O-N 2.9Å; S70-N73 PolarHBondContact O-N 3.4Å; S70-T74 WeakPolarHBondContact O-CG2 3.48Å; S70-T74 PolarHBondContact O-N 2.87Å; S70-T74 VanDerWaalsContact O-N 3.09Å; S70-T74 PolarHBondContact O-OG1 3.39Å |
| 71 | I | 80 | Confident | 78.5 | Confident | 27 Ų | 27 | 69.6 Ų | 69.6 | 14% | 0.138 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -67.8 | -42 | 178.6 | -65.8 | 164.8 | 0 | 0 | 0 | 110.6 | L16 L67 L68 N73 T74 Y75 L83 | L16-I71 HydrophobicContact CD1-CD1 4.04Å; L67-I71 WeakPolarHBondContact O-CG1 3.48Å; L67-I71 PolarHBondContact O-N 3.11Å; L68-I71 PolarHBondContact O-N 3.13Å; I71-N73 VanDerWaalsContact C-N 3.32Å; I71-N73 PolarHBondContact O-N 3.22Å; I71-T74 PolarHBondContact O-N 2.96Å; I71-T74 PolarHBondContact O-OG1 3.47Å; I71-T74 VanDerWaalsContact O-OG1 3.1Å; I71-Y75 HydrophobicContact CG2-CD2 4.09Å; I71-Y75 PolarHBondContact O-N 3.12Å; I71-L83 HydrophobicContact CD1-CD1 4.37Å |
| 72 | S | 81.4 | Confident | 77 | Confident | 33 Ų | 33 | 71.8 Ų | 71.8 | 23% | 0.231 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -66.3 | -35.2 | 177.5 | 71 | 0 | 0 | 0 | 0 | 111.7 | L68 V69 G76 D78 | L68-S72 PolarHBondContact O-N 2.84Å; L68-S72 PolarHBondContact O-OG 3.01Å; V69-S72 WeakPolarHBondContact CA-OG 3.32Å; V69-S72 PolarHBondContact O-OG 3.03Å; S72-G76 WeakPolarHBondContact O-CA 3.39Å; S72-G76 PolarHBondContact O-N 3.22Å; S72-D78 WeakPolarHBondContact CB-OD1 3.3Å |
| 73 | N | 81.9 | Confident | 75.6 | Confident | 130 Ų | 130 | 72.1 Ų | 72.1 | 70% | 0.695 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -68.7 | -33.6 | 173.5 | -76.7 | -35 | 0 | 0 | 0 | 113.5 | V69 S70 I71 | V69-N73 WeakPolarHBondContact O-CB 3.19Å; V69-N73 VanDerWaalsContact O-CG 3.25Å; V69-N73 PolarHBondContact O-N 2.99Å; V69-N73 PolarHBondContact O-ND2 2.91Å; S70-N73 PolarHBondContact O-N 3.4Å; I71-N73 VanDerWaalsContact C-N 3.32Å; I71-N73 PolarHBondContact O-N 3.22Å |
| 74 | T | 78.4 | Confident | 74.4 | Confident | 100 Ų | 100 | 72.3 Ų | 72.3 | 61% | 0.613 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -84.1 | -35 | -179.7 | 53.7 | 0 | 0 | 0 | 0 | 113.7 | S70 I71 | S70-T74 WeakPolarHBondContact O-CG2 3.48Å; S70-T74 PolarHBondContact O-N 2.87Å; S70-T74 VanDerWaalsContact O-N 3.09Å; S70-T74 PolarHBondContact O-OG1 3.39Å; I71-T74 PolarHBondContact O-N 2.96Å; I71-T74 PolarHBondContact O-OG1 3.47Å; I71-T74 VanDerWaalsContact O-OG1 3.1Å |
| 75 | Y | 72.6 | Confident | 73.2 | Confident | 78 Ų | 78 | 77.5 Ų | 77.5 | 31% | 0.306 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -113.5 | -5.5 | -173.8 | -64.2 | -77.5 | 0 | 0 | 0 | 114.3 | I71 L77 N82 L83 L85 | I71-Y75 HydrophobicContact CG2-CD2 4.09Å; I71-Y75 PolarHBondContact O-N 3.12Å; Y75-L77 PolarHBondContact O-N 3.44Å; Y75-N82 HydrophobicContact CD1-CB 3.82Å; Y75-N82 HydrophobicContact CE1-CB 4.34Å; Y75-N82 HydrophobicContact CG-CB 4.01Å; Y75-L83 HydrophobicContact CE2-CD2 3.84Å; Y75-L85 HydrophobicContact CE1-CD1 4.14Å; Y75-L85 WeakPolarHBondContact OH-CD1 3.41Å |
| 76 | G | 67.7 | Low | 72.2 | Confident | 61 Ų | 61 | 81.3 Ų | 81.3 | 63% | 0.629 | 45% | 0.453 | S | S | * | . | S | Bend | trans | 69.4 | -9.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | S72 | S72-G76 WeakPolarHBondContact O-CA 3.39Å; S72-G76 PolarHBondContact O-N 3.22Å |
| 77 | L | 65 | Low | 71 | Confident | 96 Ų | 96 | 85.5 Ų | 85.5 | 50% | 0.503 | 46% | 0.461 | S | S | . | . | S | Bend | trans | -143.5 | 139.9 | -175.1 | -64.5 | 170.7 | 0 | 0 | 0 | 110.7 | Y75 Y79 | Y75-L77 PolarHBondContact O-N 3.44Å; L77-Y79 HydrophobicContact CB-CD2 3.69Å; L77-Y79 HydrophobicContact CB-CE2 4.23Å; L77-Y79 HydrophobicContact CD1-CD2 4.04Å; L77-Y79 HydrophobicContact CD1-CE2 4.15Å; L77-Y79 HydrophobicContact CD2-CE2 4.47Å; L77-Y79 HydrophobicContact CG-CD2 4.37Å; L77-Y79 PolarHBondContact O-N 3.07Å |
| 78 | D | 62.4 | Low | 69.6 | Low | 55 Ų | 55 | 89.1 Ų | 89.1 | 29% | 0.294 | 49% | 0.493 | S | S | . | . | trans | -75.3 | 23.6 | -176.9 | -58.4 | -28.5 | 0 | 0 | 0 | 114.6 | S72 | S72-D78 WeakPolarHBondContact CB-OD1 3.3Š| ||
| 79 | Y | 62.6 | Low | 68.9 | Low | 94 Ų | 94 | 92.9 Ų | 92.9 | 37% | 0.369 | 51% | 0.514 | S | S | . | . | B | Isolated β-bridge | trans | -84.8 | 120.7 | -175.3 | -71 | -60.6 | 0 | 0 | 0 | 111.8 | S14 H15 L77 H81 N82 | S14-Y79 WeakPolarHBondContact O-CA 3.45Å; H15-Y79 AromaticContact CE1-CE1 3.47Å; H15-Y79 VanDerWaalsContact CE1-CE1 3.47Å; H15-Y79 WeakPolarHBondContact CE1-CE1 3.42Å; H15-Y79 AromaticContact CE1-CZ 3.83Å; H15-Y79 AromaticContact NE2-CE1 3.83Å; L77-Y79 HydrophobicContact CB-CD2 3.69Å; L77-Y79 HydrophobicContact CB-CE2 4.23Å; L77-Y79 HydrophobicContact CD1-CD2 4.04Å; L77-Y79 HydrophobicContact CD1-CE2 4.15Å; L77-Y79 HydrophobicContact CD2-CE2 4.47Å; L77-Y79 HydrophobicContact CG-CD2 4.37Å; L77-Y79 PolarHBondContact O-N 3.07Å; Y79-H81 PolarHBondContact O-N 3.42Å; Y79-H81 VanDerWaalsContact O-N 3.15Å; Y79-N82 PolarHBondContact O-N 3.38Å |
| 80 | V | 60.8 | Low | 68 | Low | 53 Ų | 53 | 93.6 Ų | 93.6 | 32% | 0.321 | 52% | 0.516 | S | S | . | . | G | 310 helix | trans | -59.5 | -27.3 | 176.5 | -173.5 | 0 | 0 | 0 | 0 | 112 | S14 L16 N82 L83 | S14-V80 PolarHBondContact O-N 2.99Å; L16-V80 HydrophobicContact CB-CG2 4.26Å; L16-V80 HydrophobicContact CD1-CG2 4.22Å; V80-N82 PolarHBondContact O-N 2.92Å; V80-L83 PolarHBondContact O-N 3Å |
| 81 | H | 59.3 | Low | 67.1 | Low | 157 Ų | 157 | 95.8 Ų | 95.8 | 73% | 0.727 | 52% | 0.524 | S | S | * | . | G | 310 helix | trans | -64.6 | -23.8 | -179.7 | -163.2 | -17.9 | 0 | 0 | 0 | 113.6 | Y79 L83 | Y79-H81 PolarHBondContact O-N 3.42Å; Y79-H81 VanDerWaalsContact O-N 3.15Å; H81-L83 PolarHBondContact O-N 2.95Å |
| 82 | N | 58.9 | Low | 66.3 | Low | 71 Ų | 71 | 99.9 Ų | 99.9 | 38% | 0.38 | 55% | 0.547 | S | S | . | . | G | 310 helix | trans | -73.1 | -11.6 | 179.3 | -87.6 | 7.3 | 0 | 0 | 0 | 113.7 | Y75 Y79 V80 N84 | Y75-N82 HydrophobicContact CD1-CB 3.82Å; Y75-N82 HydrophobicContact CE1-CB 4.34Å; Y75-N82 HydrophobicContact CG-CB 4.01Å; Y79-N82 PolarHBondContact O-N 3.38Å; V80-N82 PolarHBondContact O-N 2.92Å; N82-N84 PolarHBondContact O-N 3.22Å; N82-N84 VanDerWaalsContact O-N 3.11Å |
| 83 | L | 61 | Low | 65.4 | Low | 66 Ų | 66 | 104.1 Ų | 104.1 | 35% | 0.346 | 57% | 0.566 | S | S | . | * | G | 310 helix | trans | -80.8 | 23.1 | -179.6 | -64 | 169.4 | 0 | 0 | 0 | 113.9 | I71 Y75 V80 H81 L85 | I71-L83 HydrophobicContact CD1-CD1 4.37Å; Y75-L83 HydrophobicContact CE2-CD2 3.84Å; V80-L83 PolarHBondContact O-N 3Å; H81-L83 PolarHBondContact O-N 2.95Å; L83-L85 PolarHBondContact O-N 3.26Å |
| 84 | N | 65.1 | Low | 64.3 | Low | 95 Ų | 95 | 102.3 Ų | 102.3 | 51% | 0.508 | 56% | 0.558 | S | S | . | * | G | 310 helix | trans | -82.1 | 5.2 | -174.8 | -138.7 | 32.6 | 0 | 0 | 0 | 114.7 | N82 L86 Q87 | N82-N84 PolarHBondContact O-N 3.22Å; N82-N84 VanDerWaalsContact O-N 3.11Å; N84-L86 VanDerWaalsContact C-N 3.26Å; N84-L86 PolarHBondContact O-N 3.38Å; N84-Q87 PolarHBondContact ND2-OE1 3.33Å; N84-Q87 PolarHBondContact O-N 3.44Å; N84-Q87 PolarHBondContact OD1-OE1 2.98Å |
| 85 | L | 62.8 | Low | 63.2 | Low | 122 Ų | 122 | 102.5 Ų | 102.5 | 64% | 0.639 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -69.3 | -19.9 | 178.8 | -81.8 | 160.7 | 0 | 0 | 0 | 113.8 | Y75 L83 Q87 | Y75-L85 HydrophobicContact CE1-CD1 4.14Å; Y75-L85 WeakPolarHBondContact OH-CD1 3.41Å; L83-L85 PolarHBondContact O-N 3.26Å; L85-Q87 VanDerWaalsContact C-N 3.3Å |
| 86 | L | 65.8 | Low | 62.5 | Low | 160 Ų | 160 | 104.4 Ų | 104.4 | 84% | 0.838 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -84.4 | 0.8 | 177.4 | -78.8 | 154.1 | 0 | 0 | 0 | 113.6 | N84 C88 | N84-L86 VanDerWaalsContact C-N 3.26Å; N84-L86 PolarHBondContact O-N 3.38Å; L86-C88 VanDerWaalsContact C-N 3.26Å |
| 87 | Q | 64 | Low | 62.1 | Low | 151 Ų | 151 | 108 Ų | 108 | 71% | 0.706 | 57% | 0.568 | S | S | * | * | G | 310 helix | trans | -83.1 | -2.3 | 175 | -156.2 | -174.9 | -26.3 | 0 | 0 | 112.7 | N84 L85 | N84-Q87 PolarHBondContact ND2-OE1 3.33Å; N84-Q87 PolarHBondContact O-N 3.44Å; N84-Q87 PolarHBondContact OD1-OE1 2.98Å; L85-Q87 VanDerWaalsContact C-N 3.3Å |
| 88 | C | 57.6 | Low | 61.8 | Low | 176 Ų | 176 | 109.1 Ų | 109.1 | 100% | 1.189 | 57% | 0.574 | S | S | * | * | trans | -86.4 | 0 | 171.4 | -67.3 | 0 | 0 | 0 | 0 | 110.9 | L86 | L86-C88 VanDerWaalsContact C-N 3.26Š|
Retrieved 88 of 88 residues in 82.3 ms
(Link to these results)