| 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 | I | 86.6 | Confident | 92.5 | Very high | 149 Ų | 149 | 88 Ų | 88 | 76% | 0.764 | 46% | 0.458 | S | S | * | . | 0 | -57.2 | 0 | -61.7 | 163.4 | 0 | 0 | 0 | 110.4 | M3 N4 I5 L43 | I1-M3 PolarHBondContact O-N 3.26Å; I1-N4 PolarHBondContact O-N 2.64Å; I1-I5 HydrophobicContact CG2-CD1 3.68Å; I1-I5 HydrophobicContact CG2-CG1 4.48Å; I1-I5 PolarHBondContact O-N 3.08Å; I1-I5 VanDerWaalsContact O-N 3.13Å; I1-L43 HydrophobicContact CG2-CD1 3.65Å | |||
| 2 | Y | 89.5 | Confident | 92.5 | Very high | 69 Ų | 69 | 82.1 Ų | 82.1 | 27% | 0.271 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -51.1 | -46.9 | 176.9 | -63.8 | -61.4 | 0 | 0 | 0 | 114.5 | N4 I5 M6 M40 L43 M44 N47 | Y2-N4 VanDerWaalsContact C-N 3.32Å; Y2-N4 PolarHBondContact O-N 3.14Å; Y2-I5 PolarHBondContact O-N 3.39Å; Y2-M6 WeakPolarHBondContact O-CG 3.49Å; Y2-M6 PolarHBondContact O-N 3.41Å; Y2-M40 HydrophobicContact CD1-CE 4.06Å; Y2-M40 HydrophobicContact CD1-SD 3.4Å; Y2-M40 WeakPolarHBondContact CD1-SD 3.41Å; Y2-M40 HydrophobicContact CE1-SD 3.9Å; Y2-M40 HydrophobicContact CG-SD 4.47Å; Y2-L43 HydrophobicContact CE1-CB 3.72Å; Y2-L43 HydrophobicContact CE1-CD1 4.21Å; Y2-L43 PolarHBondContact OH-O 3.42Å; Y2-M44 HydrophobicContact CD1-CE 3.86Å; Y2-M44 HydrophobicContact CE1-CE 3.55Å; Y2-M44 HydrophobicContact CE1-CG 4.31Å; Y2-M44 HydrophobicContact CE1-SD 3.95Å; Y2-M44 HydrophobicContact CG-CE 4.46Å; Y2-N47 PolarHBondContact OH-ND2 2.98Å |
| 3 | M | 92.1 | Very high | 92.4 | Very high | 144 Ų | 144 | 80.5 Ų | 80.5 | 71% | 0.709 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -58.4 | -39.4 | 176.4 | -64.2 | -59.3 | -73.4 | 0 | 0 | 113.2 | I1 M6 L7 | I1-M3 PolarHBondContact O-N 3.26Å; M3-M6 PolarHBondContact O-N 3.04Å; M3-L7 WeakPolarHBondContact O-CB 3.49Å; M3-L7 VanDerWaalsContact O-CG 3.31Å; M3-L7 WeakPolarHBondContact O-CG 3.32Å; M3-L7 PolarHBondContact O-N 3.47Å |
| 4 | N | 94 | Very high | 92.3 | Very high | 116 Ų | 116 | 82.1 Ų | 82.1 | 62% | 0.62 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -69.6 | -36.5 | 179.3 | -67.9 | 7.9 | 0 | 0 | 0 | 111.7 | I1 Y2 L7 A8 | I1-N4 PolarHBondContact O-N 2.64Å; Y2-N4 VanDerWaalsContact C-N 3.32Å; Y2-N4 PolarHBondContact O-N 3.14Å; N4-L7 PolarHBondContact O-N 3.21Å; N4-A8 PolarHBondContact O-N 2.97Å |
| 5 | I | 94 | Very high | 92 | Very high | 18 Ų | 18 | 78.7 Ų | 78.7 | 9% | 0.092 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -70.3 | -40.5 | 177.2 | -62.2 | 160.6 | 0 | 0 | 0 | 110.3 | I1 Y2 L7 A8 F9 S36 I39 M40 L43 | I1-I5 HydrophobicContact CG2-CD1 3.68Å; I1-I5 HydrophobicContact CG2-CG1 4.48Å; I1-I5 PolarHBondContact O-N 3.08Å; I1-I5 VanDerWaalsContact O-N 3.13Å; Y2-I5 PolarHBondContact O-N 3.39Å; I5-L7 VanDerWaalsContact C-N 3.32Å; I5-L7 PolarHBondContact O-N 3.06Å; I5-A8 WeakPolarHBondContact O-CB 3.5Å; I5-A8 PolarHBondContact O-N 3.12Å; I5-F9 PolarHBondContact O-N 3.26Å; I5-S36 VanDerWaalsContact CG2-O 3.26Å; I5-S36 WeakPolarHBondContact CG2-O 3.47Å; I5-I39 HydrophobicContact CD1-CG2 3.64Å; I5-I39 HydrophobicContact CG1-CG2 4.24Å; I5-M40 HydrophobicContact CB-CE 3.79Å; I5-M40 HydrophobicContact CG2-CB 4.13Å; I5-M40 HydrophobicContact CG2-CE 3.67Å; I5-L43 HydrophobicContact CD1-CD1 3.3Å |
| 6 | M | 92.9 | Very high | 91.7 | Very high | 98 Ų | 98 | 76.6 Ų | 76.6 | 48% | 0.483 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -62.1 | -40.6 | 172.4 | -68.1 | -55.1 | -66.6 | 0 | 0 | 111.5 | Y2 M3 F9 T10 M40 | Y2-M6 WeakPolarHBondContact O-CG 3.49Å; Y2-M6 PolarHBondContact O-N 3.41Å; M3-M6 PolarHBondContact O-N 3.04Å; M6-F9 WeakPolarHBondContact O-CB 3.41Å; M6-F9 PolarHBondContact O-N 3Å; M6-T10 WeakPolarHBondContact O-CG2 3.4Å; M6-T10 PolarHBondContact O-N 2.93Å; M6-T10 PolarHBondContact O-OG1 3.21Å; M6-M40 HydrophobicContact CG-CE 3.75Å; M6-M40 HydrophobicContact SD-CE 3.55Å; M6-M40 VanDerWaalsContact SD-CE 3.55Å |
| 7 | L | 94.5 | Very high | 91.3 | Very high | 97 Ų | 97 | 77.9 Ų | 77.9 | 51% | 0.508 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.6 | -46.1 | 172.9 | -76.3 | 163.9 | 0 | 0 | 0 | 111.4 | M3 N4 I5 F9 T10 I11 | M3-L7 WeakPolarHBondContact O-CB 3.49Å; M3-L7 VanDerWaalsContact O-CG 3.31Å; M3-L7 WeakPolarHBondContact O-CG 3.32Å; M3-L7 PolarHBondContact O-N 3.47Å; N4-L7 PolarHBondContact O-N 3.21Å; I5-L7 VanDerWaalsContact C-N 3.32Å; I5-L7 PolarHBondContact O-N 3.06Å; L7-F9 VanDerWaalsContact C-N 3.31Å; L7-F9 PolarHBondContact O-N 2.86Å; L7-T10 WeakPolarHBondContact CA-OG1 3.5Å; L7-T10 PolarHBondContact O-N 3.1Å; L7-T10 VanDerWaalsContact O-N 3.13Å; L7-T10 PolarHBondContact O-OG1 3.25Å; L7-I11 WeakPolarHBondContact O-CD1 3.13Å; L7-I11 VanDerWaalsContact O-CG1 3.27Å; L7-I11 WeakPolarHBondContact O-CG1 3.41Å; L7-I11 PolarHBondContact O-N 3.25Å |
| 8 | A | 93.9 | Very high | 90.9 | Very high | 48 Ų | 48 | 78.7 Ų | 78.7 | 40% | 0.397 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -59.1 | -40.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | N4 I5 I11 S12 | N4-A8 PolarHBondContact O-N 2.97Å; I5-A8 WeakPolarHBondContact O-CB 3.5Å; I5-A8 PolarHBondContact O-N 3.12Å; A8-I11 PolarHBondContact O-N 3.28Å; A8-S12 PolarHBondContact O-N 3.46Å; A8-S12 PolarHBondContact O-OG 3.25Å |
| 9 | F | 93.9 | Very high | 89.5 | Confident | 55 Ų | 55 | 83.3 Ų | 83.3 | 24% | 0.241 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -62 | -46.3 | 172.9 | -177.9 | -97.7 | 0 | 0 | 0 | 111.6 | I5 M6 L7 I11 S12 L13 M33 S36 L37 | I5-F9 PolarHBondContact O-N 3.26Å; M6-F9 WeakPolarHBondContact O-CB 3.41Å; M6-F9 PolarHBondContact O-N 3Å; L7-F9 VanDerWaalsContact C-N 3.31Å; L7-F9 PolarHBondContact O-N 2.86Å; F9-I11 PolarHBondContact O-N 3.01Å; F9-S12 WeakPolarHBondContact CA-OG 3.37Å; F9-S12 PolarHBondContact O-N 2.97Å; F9-S12 PolarHBondContact O-OG 3.22Å; F9-L13 HydrophobicContact CE1-CD1 4.4Å; F9-L13 HydrophobicContact CZ-CD1 4.41Å; F9-L13 VanDerWaalsContact O-CB 3.31Å; F9-L13 WeakPolarHBondContact O-CB 3.48Å; F9-L13 PolarHBondContact O-N 3.4Å; F9-M33 HydrophobicContact CD2-CB 4.26Å; F9-M33 HydrophobicContact CD2-CG 4.35Å; F9-M33 HydrophobicContact CE2-CB 4.07Å; F9-M33 HydrophobicContact CE2-CG 4.23Å; F9-M33 HydrophobicContact CE2-SD 4.48Å; F9-S36 WeakPolarHBondContact CB-OG 3.28Å; F9-S36 WeakPolarHBondContact CD2-OG 3.42Å; F9-L37 HydrophobicContact CD2-CD2 4.37Å; F9-L37 HydrophobicContact CD2-CG 4.07Å; F9-L37 HydrophobicContact CE2-CD1 3.92Å; F9-L37 HydrophobicContact CE2-CD2 4.19Å; F9-L37 HydrophobicContact CE2-CG 3.9Å |
| 10 | T | 93.1 | Very high | 88.2 | Confident | 60 Ų | 60 | 88.2 Ų | 88.2 | 37% | 0.368 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.5 | -35.8 | 178.6 | 57.8 | 0 | 0 | 0 | 0 | 113.2 | M6 L7 L14 | M6-T10 WeakPolarHBondContact O-CG2 3.4Å; M6-T10 PolarHBondContact O-N 2.93Å; M6-T10 PolarHBondContact O-OG1 3.21Å; L7-T10 WeakPolarHBondContact CA-OG1 3.5Å; L7-T10 PolarHBondContact O-N 3.1Å; L7-T10 VanDerWaalsContact O-N 3.13Å; L7-T10 PolarHBondContact O-OG1 3.25Å; T10-L14 WeakPolarHBondContact O-CB 3.46Å; T10-L14 VanDerWaalsContact O-CG 3.24Å; T10-L14 WeakPolarHBondContact O-CG 3.38Å; T10-L14 PolarHBondContact O-N 3.2Å |
| 11 | I | 93.1 | Very high | 87 | Confident | 114 Ų | 114 | 86.9 Ų | 86.9 | 59% | 0.585 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -68.8 | -42.8 | 178 | -66.7 | 161.4 | 0 | 0 | 0 | 110.6 | L7 A8 F9 L14 G15 | L7-I11 WeakPolarHBondContact O-CD1 3.13Å; L7-I11 VanDerWaalsContact O-CG1 3.27Å; L7-I11 WeakPolarHBondContact O-CG1 3.41Å; L7-I11 PolarHBondContact O-N 3.25Å; A8-I11 PolarHBondContact O-N 3.28Å; F9-I11 PolarHBondContact O-N 3.01Å; I11-L14 PolarHBondContact O-N 3.17Å; I11-G15 PolarHBondContact O-N 3.49Å |
| 12 | S | 91.8 | Very high | 86.6 | Confident | 17 Ų | 17 | 83.6 Ų | 83.6 | 12% | 0.119 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -67.6 | -37.9 | 176.2 | 50.1 | 0 | 0 | 0 | 0 | 112.3 | A8 F9 G15 M16 M33 | A8-S12 PolarHBondContact O-N 3.46Å; A8-S12 PolarHBondContact O-OG 3.25Å; F9-S12 WeakPolarHBondContact CA-OG 3.37Å; F9-S12 PolarHBondContact O-N 2.97Å; F9-S12 PolarHBondContact O-OG 3.22Å; S12-G15 PolarHBondContact O-N 3.01Å; S12-M16 PolarHBondContact O-N 2.96Å; S12-M33 WeakPolarHBondContact OG-CG 3.37Å |
| 13 | L | 91.4 | Very high | 85.9 | Confident | 62 Ų | 62 | 81.9 Ų | 81.9 | 33% | 0.325 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -60.4 | -48 | 171.2 | -172.6 | 98.7 | 0 | 0 | 0 | 111.8 | F9 G15 M16 L17 M33 | F9-L13 HydrophobicContact CE1-CD1 4.4Å; F9-L13 HydrophobicContact CZ-CD1 4.41Å; F9-L13 VanDerWaalsContact O-CB 3.31Å; F9-L13 WeakPolarHBondContact O-CB 3.48Å; F9-L13 PolarHBondContact O-N 3.4Å; L13-G15 VanDerWaalsContact C-N 3.29Å; L13-G15 PolarHBondContact O-N 3.44Å; L13-M16 PolarHBondContact O-N 3.41Å; L13-L17 HydrophobicContact CD2-CD1 4.17Å; L13-L17 HydrophobicContact CG-CD1 4.27Å; L13-L17 WeakPolarHBondContact O-CG 3.34Å; L13-L17 PolarHBondContact O-N 3.41Å; L13-M33 HydrophobicContact CB-SD 4.05Å; L13-M33 HydrophobicContact CD1-SD 3.92Å |
| 14 | L | 90.7 | Very high | 85.4 | Confident | 103 Ų | 103 | 78.9 Ų | 78.9 | 54% | 0.539 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.1 | -39.6 | 175.7 | -74.9 | 169.4 | 0 | 0 | 0 | 111.5 | T10 I11 M16 L17 V18 | T10-L14 WeakPolarHBondContact O-CB 3.46Å; T10-L14 VanDerWaalsContact O-CG 3.24Å; T10-L14 WeakPolarHBondContact O-CG 3.38Å; T10-L14 PolarHBondContact O-N 3.2Å; I11-L14 PolarHBondContact O-N 3.17Å; L14-M16 VanDerWaalsContact C-N 3.3Å; L14-M16 PolarHBondContact O-N 3.16Å; L14-L17 PolarHBondContact O-N 3.44Å; L14-V18 WeakPolarHBondContact O-CB 3.46Å; L14-V18 VanDerWaalsContact O-CG2 3.31Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 2.9Å |
| 15 | G | 88.8 | Confident | 85 | Confident | 30 Ų | 30 | 75.4 Ų | 75.4 | 31% | 0.309 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -61.2 | -36.1 | 175 | 0 | 0 | 0 | 0 | 0 | 113.5 | I11 S12 L13 | I11-G15 PolarHBondContact O-N 3.49Å; S12-G15 PolarHBondContact O-N 3.01Å; L13-G15 VanDerWaalsContact C-N 3.29Å; L13-G15 PolarHBondContact O-N 3.44Å |
| 16 | M | 87 | Confident | 84.6 | Confident | 46 Ų | 46 | 75.8 Ų | 75.8 | 23% | 0.227 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -73.8 | -42.6 | 175.8 | -173.9 | -87.3 | -75.5 | 0 | 0 | 112.2 | S12 L13 L14 V18 C29 M33 | S12-M16 PolarHBondContact O-N 2.96Å; L13-M16 PolarHBondContact O-N 3.41Å; L14-M16 VanDerWaalsContact C-N 3.3Å; L14-M16 PolarHBondContact O-N 3.16Å; M16-V18 VanDerWaalsContact C-N 3.3Å; M16-V18 PolarHBondContact O-N 3.02Å; M16-C29 HydrophobicContact CB-CB 4.21Å; M16-M33 HydrophobicContact CB-CE 4.1Å; M16-M33 HydrophobicContact CE-CE 4.09Å; M16-M33 HydrophobicContact CG-CE 4.18Å |
| 17 | L | 85.5 | Confident | 84.3 | Confident | 98 Ų | 98 | 72.2 Ų | 72.2 | 51% | 0.513 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -65.1 | -33.8 | 177.9 | -71.5 | 171.4 | 0 | 0 | 0 | 112.6 | L13 L14 Y19 | L13-L17 HydrophobicContact CD2-CD1 4.17Å; L13-L17 HydrophobicContact CG-CD1 4.27Å; L13-L17 WeakPolarHBondContact O-CG 3.34Å; L13-L17 PolarHBondContact O-N 3.41Å; L14-L17 PolarHBondContact O-N 3.44Å; L17-Y19 WeakPolarHBondContact O-CD2 3.36Å; L17-Y19 PolarHBondContact O-N 2.91Å |
| 18 | V | 83.8 | Confident | 84 | Confident | 93 Ų | 93 | 72.8 Ų | 72.8 | 56% | 0.564 | 38% | 0.384 | S | S | * | . | S | Bend | trans | -80 | 79.5 | 171.4 | -178 | 0 | 0 | 0 | 0 | 107.9 | L14 M16 R20 | L14-V18 WeakPolarHBondContact O-CB 3.46Å; L14-V18 VanDerWaalsContact O-CG2 3.31Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 2.9Å; M16-V18 VanDerWaalsContact C-N 3.3Å; M16-V18 PolarHBondContact O-N 3.02Å; V18-R20 PolarHBondContact O-N 3.4Å |
| 19 | Y | 63.8 | Low | 83.8 | Confident | 165 Ų | 165 | 72.1 Ų | 72.1 | 65% | 0.647 | 38% | 0.375 | S | S | * | . | trans | -55.2 | 97.6 | 176.4 | -71.2 | -79.5 | 0 | 0 | 0 | 110.7 | L17 | L17-Y19 WeakPolarHBondContact O-CD2 3.36Å; L17-Y19 PolarHBondContact O-N 2.91Å | ||
| 20 | R | 64.3 | Low | 83.6 | Confident | 182 Ų | 182 | 72.6 Ų | 72.6 | 69% | 0.687 | 38% | 0.38 | S | S | * | . | trans | -73.5 | 153.6 | 165.7 | -73.7 | -79.1 | -150.1 | 131.2 | 7.4 | 108.3 | V18 H22 | V18-R20 PolarHBondContact O-N 3.4Å; R20-H22 PolarHBondContact O-N 2.99Å | ||
| 21 | S | 63.1 | Low | 83.5 | Confident | 60 Ų | 60 | 74.4 Ų | 74.4 | 42% | 0.42 | 39% | 0.385 | S | S | . | . | S | Bend | trans | -51.7 | -25.4 | -178.4 | 54.8 | 0 | 0 | 0 | 0 | 114.7 | Y86 V87 | S21-Y86 WeakPolarHBondContact O-CA 3.31Å; S21-V87 PolarHBondContact O-N 3.23Å |
| 22 | H | 76.4 | Confident | 83.4 | Confident | 81 Ų | 81 | 70.5 Ų | 70.5 | 38% | 0.375 | 37% | 0.373 | S | S | . | . | B | Isolated β-bridge | trans | -101.1 | 118.6 | -176.5 | -64.4 | -75.1 | 0 | 0 | 0 | 112.7 | R20 M24 S25 Y86 | R20-H22 PolarHBondContact O-N 2.99Å; H22-M24 VanDerWaalsContact C-N 3.25Å; H22-M24 PolarHBondContact O-N 3.29Å; H22-S25 PolarHBondContact O-N 3.18Å; H22-S25 VanDerWaalsContact O-N 3.08Å; H22-S25 PolarHBondContact O-OG 3.48Å; H22-Y86 AromaticContact CE1-CE1 3.45Å; H22-Y86 VanDerWaalsContact CE1-CE1 3.45Å; H22-Y86 WeakPolarHBondContact CE1-CE1 3.4Å; H22-Y86 AromaticContact CE1-CZ 3.9Å; H22-Y86 AromaticContact NE2-CE1 3.77Å |
| 23 | L | 76.1 | Confident | 83.4 | Confident | 32 Ų | 32 | 70.6 Ų | 70.6 | 17% | 0.168 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -60.9 | -33.4 | 178.4 | -150.5 | 146.5 | 0 | 0 | 0 | 112.2 | S25 S26 L27 L75 I78 D85 V87 | L23-S25 VanDerWaalsContact C-N 3.28Å; L23-S25 PolarHBondContact O-N 3.1Å; L23-S26 PolarHBondContact O-N 2.86Å; L23-S26 VanDerWaalsContact O-N 3.1Å; L23-S26 PolarHBondContact O-OG 3.49Å; L23-L27 HydrophobicContact CD2-CD1 4.17Å; L23-L27 HydrophobicContact CD2-CG 4.24Å; L23-L27 PolarHBondContact O-N 2.97Å; L23-L27 VanDerWaalsContact O-N 3.12Å; L23-L75 HydrophobicContact CB-CD1 4.03Å; L23-L75 HydrophobicContact CB-CG 4.46Å; L23-L75 HydrophobicContact CD2-CB 4.28Å; L23-L75 HydrophobicContact CD2-CD1 3.73Å; L23-L75 HydrophobicContact CD2-CG 4.16Å; L23-L75 HydrophobicContact CG-CD1 4.49Å; L23-I78 HydrophobicContact CD1-CD1 3.87Å; L23-D85 PolarHBondContact N-O 3.34Å; L23-V87 HydrophobicContact CB-CG2 4.27Å; L23-V87 HydrophobicContact CD1-CG2 4.23Å; L23-V87 HydrophobicContact CG-CG2 4.44Å |
| 24 | M | 82.4 | Confident | 83.6 | Confident | 82 Ų | 82 | 69.7 Ų | 69.7 | 40% | 0.404 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -54.1 | -41.1 | 173.1 | -72.8 | -60.5 | -65.3 | 0 | 0 | 113.3 | H22 S26 L27 L28 L72 L75 | H22-M24 VanDerWaalsContact C-N 3.25Å; H22-M24 PolarHBondContact O-N 3.29Å; M24-S26 VanDerWaalsContact C-N 3.32Å; M24-S26 PolarHBondContact O-N 3.26Å; M24-L27 PolarHBondContact O-N 3.49Å; M24-L28 PolarHBondContact O-N 2.94Å; M24-L28 VanDerWaalsContact O-N 3.12Å; M24-L72 HydrophobicContact SD-CD2 4.34Å; M24-L75 HydrophobicContact CB-CD1 4.46Å; M24-L75 HydrophobicContact CG-CD1 3.71Å; M24-L75 HydrophobicContact CG-CD2 4.48Å; M24-L75 HydrophobicContact SD-CD1 3.25Å; M24-L75 WeakPolarHBondContact SD-CD1 3.28Å; M24-L75 HydrophobicContact SD-CD2 4.07Å; M24-L75 HydrophobicContact SD-CG 4.31Å |
| 25 | S | 84.3 | Confident | 83.7 | Confident | 43 Ų | 43 | 70 Ų | 70 | 30% | 0.301 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -67.9 | -34.1 | -179.5 | 66.9 | 0 | 0 | 0 | 0 | 112.1 | H22 L23 L28 C29 | H22-S25 PolarHBondContact O-N 3.18Å; H22-S25 VanDerWaalsContact O-N 3.08Å; H22-S25 PolarHBondContact O-OG 3.48Å; L23-S25 VanDerWaalsContact C-N 3.28Å; L23-S25 PolarHBondContact O-N 3.1Å; S25-L28 PolarHBondContact O-N 2.89Å; S25-C29 PolarHBondContact O-N 3.28Å; S25-C29 VanDerWaalsContact O-N 3.12Å; S25-C29 PolarHBondContact O-SG 3.48Å; S25-C29 VanDerWaalsContact O-SG 3.35Å |
| 26 | S | 85.9 | Confident | 83.9 | Confident | 25 Ų | 25 | 68.9 Ų | 68.9 | 18% | 0.175 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -68.7 | -37.9 | 174.8 | 71.8 | 0 | 0 | 0 | 0 | 112.4 | L23 M24 C29 L30 | L23-S26 PolarHBondContact O-N 2.86Å; L23-S26 VanDerWaalsContact O-N 3.1Å; L23-S26 PolarHBondContact O-OG 3.49Å; M24-S26 VanDerWaalsContact C-N 3.32Å; M24-S26 PolarHBondContact O-N 3.26Å; S26-C29 PolarHBondContact O-N 3.34Å; S26-L30 PolarHBondContact O-N 3.07Å |
| 27 | L | 87.1 | Confident | 84.2 | Confident | 23 Ų | 23 | 70 Ų | 70 | 12% | 0.12 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -63.2 | -43.2 | 175.1 | -71.7 | 172.8 | 0 | 0 | 0 | 111.5 | L23 M24 C29 L30 E31 L72 L75 | L23-L27 HydrophobicContact CD2-CD1 4.17Å; L23-L27 HydrophobicContact CD2-CG 4.24Å; L23-L27 PolarHBondContact O-N 2.97Å; L23-L27 VanDerWaalsContact O-N 3.12Å; M24-L27 PolarHBondContact O-N 3.49Å; L27-C29 VanDerWaalsContact C-N 3.33Å; L27-C29 PolarHBondContact O-N 3.49Å; L27-L30 WeakPolarHBondContact O-CA 3.25Å; L27-L30 WeakPolarHBondContact O-CB 3.42Å; L27-L30 PolarHBondContact O-N 3.36Å; L27-L30 VanDerWaalsContact O-N 3.07Å; L27-E31 PolarHBondContact O-N 3.16Å; L27-L72 HydrophobicContact CD1-CD2 3.93Å; L27-L72 HydrophobicContact CD1-CG 4.37Å; L27-L75 HydrophobicContact CD1-CD1 3.58Å |
| 28 | L | 87.8 | Confident | 84.6 | Confident | 110 Ų | 110 | 68.4 Ų | 68.4 | 58% | 0.576 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -62.9 | -38 | 175.2 | -71.1 | 172.2 | 0 | 0 | 0 | 112.4 | M24 S25 L30 E31 G32 | M24-L28 PolarHBondContact O-N 2.94Å; M24-L28 VanDerWaalsContact O-N 3.12Å; S25-L28 PolarHBondContact O-N 2.89Å; L28-L30 VanDerWaalsContact C-N 3.28Å; L28-L30 PolarHBondContact O-N 3.31Å; L28-E31 PolarHBondContact O-N 3.08Å; L28-G32 PolarHBondContact O-N 3.37Å |
| 29 | C | 90.1 | Very high | 85 | Confident | 33 Ų | 33 | 67.1 Ų | 67.1 | 22% | 0.223 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -63.8 | -36.1 | 172.8 | -69.3 | 0 | 0 | 0 | 0 | 111.8 | M16 S25 S26 L27 G32 M33 | M16-C29 HydrophobicContact CB-CB 4.21Å; S25-C29 PolarHBondContact O-N 3.28Å; S25-C29 VanDerWaalsContact O-N 3.12Å; S25-C29 PolarHBondContact O-SG 3.48Å; S25-C29 VanDerWaalsContact O-SG 3.35Å; S26-C29 PolarHBondContact O-N 3.34Å; L27-C29 VanDerWaalsContact C-N 3.33Å; L27-C29 PolarHBondContact O-N 3.49Å; C29-G32 PolarHBondContact O-N 3.12Å; C29-M33 WeakPolarHBondContact O-CG 3.46Å; C29-M33 PolarHBondContact O-N 3.44Å |
| 30 | L | 89.2 | Confident | 86.4 | Confident | 65 Ų | 65 | 60.7 Ų | 60.7 | 34% | 0.34 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -67.1 | -44.5 | 176.8 | -145.5 | 160.8 | 0 | 0 | 0 | 111.5 | S26 L27 L28 G32 M33 M34 | S26-L30 PolarHBondContact O-N 3.07Å; L27-L30 WeakPolarHBondContact O-CA 3.25Å; L27-L30 WeakPolarHBondContact O-CB 3.42Å; L27-L30 PolarHBondContact O-N 3.36Å; L27-L30 VanDerWaalsContact O-N 3.07Å; L28-L30 VanDerWaalsContact C-N 3.28Å; L28-L30 PolarHBondContact O-N 3.31Å; L30-G32 VanDerWaalsContact C-N 3.3Å; L30-G32 PolarHBondContact O-N 3.24Å; L30-M33 HydrophobicContact CB-CE 4.21Å; L30-M33 HydrophobicContact CG-CE 3.92Å; L30-M33 WeakPolarHBondContact O-CB 3.45Å; L30-M33 PolarHBondContact O-N 2.97Å; L30-M34 HydrophobicContact CD2-CG 4.22Å; L30-M34 WeakPolarHBondContact O-CG 3.4Å; L30-M34 PolarHBondContact O-N 3.26Å |
| 31 | E | 90.6 | Very high | 87.6 | Confident | 99 Ų | 99 | 53.5 Ų | 53.5 | 46% | 0.463 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.1 | -41 | 171.3 | -71.1 | -175.6 | 167.9 | 0 | 0 | 111.9 | L27 L28 M33 M34 L35 | L27-E31 PolarHBondContact O-N 3.16Å; L28-E31 PolarHBondContact O-N 3.08Å; E31-M33 PolarHBondContact O-N 3.38Å; E31-M34 PolarHBondContact O-N 2.63Å; E31-L35 WeakPolarHBondContact O-CB 3.2Å; E31-L35 PolarHBondContact O-N 3.12Å |
| 32 | G | 91.1 | Very high | 88.9 | Confident | 32 Ų | 32 | 52.2 Ų | 52.2 | 33% | 0.33 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -60.9 | -40.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | L28 C29 L30 L35 S36 | L28-G32 PolarHBondContact O-N 3.37Å; C29-G32 PolarHBondContact O-N 3.12Å; L30-G32 VanDerWaalsContact C-N 3.3Å; L30-G32 PolarHBondContact O-N 3.24Å; G32-L35 PolarHBondContact O-N 3.07Å; G32-S36 PolarHBondContact O-N 3.44Å; G32-S36 VanDerWaalsContact O-N 3.08Å |
| 33 | M | 92.9 | Very high | 89.6 | Confident | 18 Ų | 18 | 50.4 Ų | 50.4 | 9% | 0.089 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.6 | -48.6 | 173.7 | -73.7 | -172.7 | -68.5 | 0 | 0 | 111 | F9 S12 L13 M16 C29 L30 E31 L35 S36 L37 | F9-M33 HydrophobicContact CD2-CB 4.26Å; F9-M33 HydrophobicContact CD2-CG 4.35Å; F9-M33 HydrophobicContact CE2-CB 4.07Å; F9-M33 HydrophobicContact CE2-CG 4.23Å; F9-M33 HydrophobicContact CE2-SD 4.48Å; S12-M33 WeakPolarHBondContact OG-CG 3.37Å; L13-M33 HydrophobicContact CB-SD 4.05Å; L13-M33 HydrophobicContact CD1-SD 3.92Å; M16-M33 HydrophobicContact CB-CE 4.1Å; M16-M33 HydrophobicContact CE-CE 4.09Å; M16-M33 HydrophobicContact CG-CE 4.18Å; C29-M33 WeakPolarHBondContact O-CG 3.46Å; C29-M33 PolarHBondContact O-N 3.44Å; L30-M33 HydrophobicContact CB-CE 4.21Å; L30-M33 HydrophobicContact CG-CE 3.92Å; L30-M33 WeakPolarHBondContact O-CB 3.45Å; L30-M33 PolarHBondContact O-N 2.97Å; E31-M33 PolarHBondContact O-N 3.38Å; M33-L35 VanDerWaalsContact C-N 3.32Å; M33-L35 PolarHBondContact O-N 3.41Å; M33-S36 PolarHBondContact O-N 3.45Å; M33-S36 PolarHBondContact O-OG 3.12Å; M33-L37 PolarHBondContact O-N 3.01Å |
| 34 | M | 94.1 | Very high | 90.2 | Very high | 44 Ų | 44 | 53.3 Ų | 53.3 | 22% | 0.217 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.6 | -38.6 | -179.6 | -64.2 | -55.4 | -78 | 0 | 0 | 112.2 | L30 E31 L37 F38 A64 | L30-M34 HydrophobicContact CD2-CG 4.22Å; L30-M34 WeakPolarHBondContact O-CG 3.4Å; L30-M34 PolarHBondContact O-N 3.26Å; E31-M34 PolarHBondContact O-N 2.63Å; M34-L37 PolarHBondContact O-N 3.03Å; M34-L37 HydrophobicContact SD-CD1 4.37Å; M34-F38 WeakPolarHBondContact O-CB 3.43Å; M34-F38 PolarHBondContact O-N 3.48Å; M34-A64 HydrophobicContact CB-CB 3.97Å; M34-A64 HydrophobicContact CE-CB 3.32Å; M34-A64 HydrophobicContact CG-CB 3.91Å; M34-A64 HydrophobicContact SD-CB 4.46Å |
| 35 | L | 92.6 | Very high | 90.5 | Very high | 108 Ų | 108 | 50 Ų | 50 | 57% | 0.565 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -66.3 | -41.1 | 176.8 | -170.3 | 141 | 0 | 0 | 0 | 112 | E31 G32 M33 L37 F38 I39 | E31-L35 WeakPolarHBondContact O-CB 3.2Å; E31-L35 PolarHBondContact O-N 3.12Å; G32-L35 PolarHBondContact O-N 3.07Å; M33-L35 VanDerWaalsContact C-N 3.32Å; M33-L35 PolarHBondContact O-N 3.41Å; L35-L37 PolarHBondContact O-N 3.27Å; L35-F38 PolarHBondContact O-N 2.69Å; L35-I39 HydrophobicContact CD2-CD1 3.58Å; L35-I39 HydrophobicContact CD2-CG1 4.4Å; L35-I39 HydrophobicContact CG-CD1 4.49Å; L35-I39 WeakPolarHBondContact O-CG1 3.5Å; L35-I39 PolarHBondContact O-N 3Å |
| 36 | S | 94.1 | Very high | 90.6 | Very high | 8 Ų | 8 | 53.1 Ų | 53.1 | 6% | 0.056 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -65.5 | -37.8 | 176.3 | 70.7 | 0 | 0 | 0 | 0 | 112.6 | I5 F9 G32 M33 I39 M40 | I5-S36 VanDerWaalsContact CG2-O 3.26Å; I5-S36 WeakPolarHBondContact CG2-O 3.47Å; F9-S36 WeakPolarHBondContact CB-OG 3.28Å; F9-S36 WeakPolarHBondContact CD2-OG 3.42Å; G32-S36 PolarHBondContact O-N 3.44Å; G32-S36 VanDerWaalsContact O-N 3.08Å; M33-S36 PolarHBondContact O-N 3.45Å; M33-S36 PolarHBondContact O-OG 3.12Å; S36-I39 PolarHBondContact O-N 2.92Å; S36-M40 WeakPolarHBondContact O-CB 3.33Å; S36-M40 PolarHBondContact O-N 3.32Å |
| 37 | L | 92.2 | Very high | 90.6 | Very high | 70 Ų | 70 | 57 Ų | 57 | 37% | 0.366 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.9 | -40.6 | 172.9 | -75.5 | 171.3 | 0 | 0 | 0 | 111.9 | F9 M33 M34 L35 M40 A41 | F9-L37 HydrophobicContact CD2-CD2 4.37Å; F9-L37 HydrophobicContact CD2-CG 4.07Å; F9-L37 HydrophobicContact CE2-CD1 3.92Å; F9-L37 HydrophobicContact CE2-CD2 4.19Å; F9-L37 HydrophobicContact CE2-CG 3.9Å; M33-L37 PolarHBondContact O-N 3.01Å; M34-L37 PolarHBondContact O-N 3.03Å; M34-L37 HydrophobicContact SD-CD1 4.37Å; L35-L37 PolarHBondContact O-N 3.27Å; L37-M40 PolarHBondContact O-N 3.46Å; L37-A41 WeakPolarHBondContact O-CB 3.48Å; L37-A41 PolarHBondContact O-N 3.1Å |
| 38 | F | 94.1 | Very high | 90.5 | Very high | 64 Ų | 64 | 60.4 Ų | 60.4 | 28% | 0.281 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.3 | -46.2 | 175.5 | 175.3 | -101.6 | 0 | 0 | 0 | 112 | M34 L35 M40 A41 T42 P57 L61 | M34-F38 WeakPolarHBondContact O-CB 3.43Å; M34-F38 PolarHBondContact O-N 3.48Å; L35-F38 PolarHBondContact O-N 2.69Å; F38-M40 VanDerWaalsContact C-N 3.34Å; F38-M40 PolarHBondContact O-N 3.27Å; F38-A41 PolarHBondContact O-N 3.08Å; F38-T42 HydrophobicContact CD1-CG2 4.4Å; F38-T42 HydrophobicContact CD2-CG2 4.19Å; F38-T42 HydrophobicContact CE1-CG2 3.97Å; F38-T42 HydrophobicContact CE2-CG2 3.73Å; F38-T42 HydrophobicContact CZ-CG2 3.61Å; F38-T42 WeakPolarHBondContact O-CG2 3.42Å; F38-T42 PolarHBondContact O-N 2.95Å; F38-T42 PolarHBondContact O-OG1 3.46Å; F38-P57 HydrophobicContact CD2-CB 3.71Å; F38-P57 WeakPolarHBondContact CD2-O 3.26Å; F38-P57 HydrophobicContact CE2-CB 3.55Å; F38-L61 HydrophobicContact CD1-CD1 4.44Å; F38-L61 HydrophobicContact CD2-CB 4.46Å; F38-L61 HydrophobicContact CD2-CD1 3.79Å; F38-L61 HydrophobicContact CD2-CG 4.39Å; F38-L61 HydrophobicContact CE1-CD1 4.35Å; F38-L61 HydrophobicContact CE2-CD1 3.69Å; F38-L61 HydrophobicContact CG-CD1 4.17Å; F38-L61 HydrophobicContact CZ-CD1 3.98Å |
| 39 | I | 93.5 | Very high | 90.2 | Very high | 66 Ų | 66 | 63.3 Ų | 63.3 | 34% | 0.338 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -64.5 | -41 | 178 | -62.6 | 170.1 | 0 | 0 | 0 | 110.7 | I5 L35 S36 T42 L43 | I5-I39 HydrophobicContact CD1-CG2 3.64Å; I5-I39 HydrophobicContact CG1-CG2 4.24Å; L35-I39 HydrophobicContact CD2-CD1 3.58Å; L35-I39 HydrophobicContact CD2-CG1 4.4Å; L35-I39 HydrophobicContact CG-CD1 4.49Å; L35-I39 WeakPolarHBondContact O-CG1 3.5Å; L35-I39 PolarHBondContact O-N 3Å; S36-I39 PolarHBondContact O-N 2.92Å; I39-T42 WeakPolarHBondContact CA-OG1 3.48Å; I39-T42 PolarHBondContact O-OG1 2.91Å; I39-L43 HydrophobicContact CG2-CD1 3.95Å; I39-L43 HydrophobicContact CG2-CG 4.42Å; I39-L43 WeakPolarHBondContact O-CB 3.47Å; I39-L43 VanDerWaalsContact O-CG 3.28Å; I39-L43 WeakPolarHBondContact O-CG 3.46Å; I39-L43 PolarHBondContact O-N 3.33Å |
| 40 | M | 92.3 | Very high | 89.6 | Confident | 30 Ų | 30 | 63.7 Ų | 63.7 | 15% | 0.148 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -60 | -48.9 | 175.5 | -177.1 | 65.1 | 63.3 | 0 | 0 | 111.5 | Y2 I5 M6 S36 L37 F38 L43 M44 | Y2-M40 HydrophobicContact CD1-CE 4.06Å; Y2-M40 HydrophobicContact CD1-SD 3.4Å; Y2-M40 WeakPolarHBondContact CD1-SD 3.41Å; Y2-M40 HydrophobicContact CE1-SD 3.9Å; Y2-M40 HydrophobicContact CG-SD 4.47Å; I5-M40 HydrophobicContact CB-CE 3.79Å; I5-M40 HydrophobicContact CG2-CB 4.13Å; I5-M40 HydrophobicContact CG2-CE 3.67Å; M6-M40 HydrophobicContact CG-CE 3.75Å; M6-M40 HydrophobicContact SD-CE 3.55Å; M6-M40 VanDerWaalsContact SD-CE 3.55Å; S36-M40 WeakPolarHBondContact O-CB 3.33Å; S36-M40 PolarHBondContact O-N 3.32Å; L37-M40 PolarHBondContact O-N 3.46Å; F38-M40 VanDerWaalsContact C-N 3.34Å; F38-M40 PolarHBondContact O-N 3.27Å; M40-L43 PolarHBondContact O-N 3.13Å; M40-M44 WeakPolarHBondContact O-CG 3.5Å; M40-M44 PolarHBondContact O-N 2.94Å; M40-M44 VanDerWaalsContact O-N 3.1Å; M40-M44 HydrophobicContact SD-CE 4.02Å |
| 41 | A | 89.9 | Confident | 89 | Confident | 30 Ų | 30 | 67.5 Ų | 67.5 | 25% | 0.248 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -63.3 | -46.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | L37 F38 L43 M44 T45 P57 | L37-A41 WeakPolarHBondContact O-CB 3.48Å; L37-A41 PolarHBondContact O-N 3.1Å; F38-A41 PolarHBondContact O-N 3.08Å; A41-L43 PolarHBondContact O-N 3.1Å; A41-M44 PolarHBondContact O-N 3.32Å; A41-T45 WeakPolarHBondContact O-CG2 3.42Å; A41-T45 PolarHBondContact O-N 3.04Å; A41-P57 HydrophobicContact CB-CB 4.37Å; A41-P57 HydrophobicContact CB-CG 3.97Å |
| 42 | T | 90.6 | Very high | 88.6 | Confident | 33 Ų | 33 | 70 Ų | 70 | 20% | 0.202 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.7 | -39.9 | 178.1 | 50.7 | 0 | 0 | 0 | 0 | 112.9 | F38 I39 M44 T45 L46 P57 | F38-T42 HydrophobicContact CD1-CG2 4.4Å; F38-T42 HydrophobicContact CD2-CG2 4.19Å; F38-T42 HydrophobicContact CE1-CG2 3.97Å; F38-T42 HydrophobicContact CE2-CG2 3.73Å; F38-T42 HydrophobicContact CZ-CG2 3.61Å; F38-T42 WeakPolarHBondContact O-CG2 3.42Å; F38-T42 PolarHBondContact O-N 2.95Å; F38-T42 PolarHBondContact O-OG1 3.46Å; I39-T42 WeakPolarHBondContact CA-OG1 3.48Å; I39-T42 PolarHBondContact O-OG1 2.91Å; T42-M44 VanDerWaalsContact C-N 3.32Å; T42-M44 PolarHBondContact O-N 3.29Å; T42-T45 PolarHBondContact O-N 3.29Å; T42-T45 PolarHBondContact O-OG1 2.97Å; T42-L46 WeakPolarHBondContact O-CB 3.43Å; T42-L46 WeakPolarHBondContact O-CD1 3.19Å; T42-L46 WeakPolarHBondContact O-CG 3.47Å; T42-L46 PolarHBondContact O-N 3.4Å; T42-P57 HydrophobicContact CG2-CB 3.65Å; T42-P57 HydrophobicContact CG2-CG 3.9Å |
| 43 | L | 90.9 | Very high | 88.3 | Confident | 44 Ų | 44 | 69.9 Ų | 69.9 | 23% | 0.23 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 174.9 | -74.6 | 170.7 | 0 | 0 | 0 | 112.1 | I1 Y2 I5 I39 M40 A41 N47 | I1-L43 HydrophobicContact CG2-CD1 3.65Å; Y2-L43 HydrophobicContact CE1-CB 3.72Å; Y2-L43 HydrophobicContact CE1-CD1 4.21Å; Y2-L43 PolarHBondContact OH-O 3.42Å; I5-L43 HydrophobicContact CD1-CD1 3.3Å; I39-L43 HydrophobicContact CG2-CD1 3.95Å; I39-L43 HydrophobicContact CG2-CG 4.42Å; I39-L43 WeakPolarHBondContact O-CB 3.47Å; I39-L43 VanDerWaalsContact O-CG 3.28Å; I39-L43 WeakPolarHBondContact O-CG 3.46Å; I39-L43 PolarHBondContact O-N 3.33Å; M40-L43 PolarHBondContact O-N 3.13Å; A41-L43 PolarHBondContact O-N 3.1Å; L43-N47 WeakPolarHBondContact O-CB 3.24Å; L43-N47 PolarHBondContact O-N 3.37Å |
| 44 | M | 87.9 | Confident | 87.8 | Confident | 92 Ų | 92 | 71.7 Ų | 71.7 | 45% | 0.453 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -68.4 | -40.1 | 177.2 | -69.5 | -63 | -176.5 | 0 | 0 | 112.5 | Y2 M40 A41 T42 N47 T48 | Y2-M44 HydrophobicContact CD1-CE 3.86Å; Y2-M44 HydrophobicContact CE1-CE 3.55Å; Y2-M44 HydrophobicContact CE1-CG 4.31Å; Y2-M44 HydrophobicContact CE1-SD 3.95Å; Y2-M44 HydrophobicContact CG-CE 4.46Å; M40-M44 WeakPolarHBondContact O-CG 3.5Å; M40-M44 PolarHBondContact O-N 2.94Å; M40-M44 VanDerWaalsContact O-N 3.1Å; M40-M44 HydrophobicContact SD-CE 4.02Å; A41-M44 PolarHBondContact O-N 3.32Å; T42-M44 VanDerWaalsContact C-N 3.32Å; T42-M44 PolarHBondContact O-N 3.29Å; M44-N47 PolarHBondContact O-N 2.94Å; M44-T48 WeakPolarHBondContact O-CG2 3.45Å; M44-T48 PolarHBondContact O-N 3.4Å; M44-T48 VanDerWaalsContact O-N 3.13Å; M44-T48 PolarHBondContact O-OG1 3.18Å |
| 45 | T | 88.8 | Confident | 87.5 | Confident | 13 Ų | 13 | 75 Ų | 75 | 8% | 0.08 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -68.1 | -39.6 | 177.3 | 62.1 | 0 | 0 | 0 | 0 | 111.6 | A41 T42 T48 H49 S50 A53 N54 P57 | A41-T45 WeakPolarHBondContact O-CG2 3.42Å; A41-T45 PolarHBondContact O-N 3.04Å; T42-T45 PolarHBondContact O-N 3.29Å; T42-T45 PolarHBondContact O-OG1 2.97Å; T45-T48 PolarHBondContact O-N 3.19Å; T45-T48 PolarHBondContact O-OG1 3.01Å; T45-H49 PolarHBondContact O-N 3.47Å; T45-S50 PolarHBondContact O-N 2.8Å; T45-A53 HydrophobicContact CG2-CB 3.64Å; T45-N54 VanDerWaalsContact CB-OD1 3.26Å; T45-N54 WeakPolarHBondContact CB-OD1 3.36Å; T45-N54 PolarHBondContact OG1-OD1 3.35Å; T45-P57 HydrophobicContact CG2-CG 4.21Å |
| 46 | L | 87.4 | Confident | 87.3 | Confident | 108 Ų | 108 | 74 Ų | 74 | 57% | 0.565 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -63.5 | -44.7 | 174.7 | -72.3 | 170.2 | 0 | 0 | 0 | 111.9 | T42 T48 H49 | T42-L46 WeakPolarHBondContact O-CB 3.43Å; T42-L46 WeakPolarHBondContact O-CD1 3.19Å; T42-L46 WeakPolarHBondContact O-CG 3.47Å; T42-L46 PolarHBondContact O-N 3.4Å; L46-T48 VanDerWaalsContact C-N 3.3Å; L46-T48 PolarHBondContact O-N 3.43Å; L46-H49 PolarHBondContact O-N 3Å |
| 47 | N | 86.2 | Confident | 87.1 | Confident | 107 Ų | 107 | 73.8 Ų | 73.8 | 57% | 0.572 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -64 | -32.8 | 178.6 | -89.3 | 4.1 | 0 | 0 | 0 | 113.4 | Y2 L43 M44 H49 | Y2-N47 PolarHBondContact OH-ND2 2.98Å; L43-N47 WeakPolarHBondContact O-CB 3.24Å; L43-N47 PolarHBondContact O-N 3.37Å; M44-N47 PolarHBondContact O-N 2.94Å; N47-H49 VanDerWaalsContact C-N 3.32Å |
| 48 | T | 84.6 | Confident | 87.1 | Confident | 94 Ų | 94 | 75.6 Ų | 75.6 | 58% | 0.577 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | 1.4 | -179.8 | 54.5 | 0 | 0 | 0 | 0 | 113.2 | M44 T45 L46 S50 | M44-T48 WeakPolarHBondContact O-CG2 3.45Å; M44-T48 PolarHBondContact O-N 3.4Å; M44-T48 VanDerWaalsContact O-N 3.13Å; M44-T48 PolarHBondContact O-OG1 3.18Å; T45-T48 PolarHBondContact O-N 3.19Å; T45-T48 PolarHBondContact O-OG1 3.01Å; L46-T48 VanDerWaalsContact C-N 3.3Å; L46-T48 PolarHBondContact O-N 3.43Å; T48-S50 PolarHBondContact O-N 3.43Å; T48-S50 PolarHBondContact OG1-OG 2.96Å |
| 49 | H | 81.1 | Confident | 87.1 | Confident | 171 Ų | 171 | 74.5 Ų | 74.5 | 79% | 0.792 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.4 | 29.3 | -175.7 | -65.8 | -68.7 | 0 | 0 | 0 | 113.9 | T45 L46 N47 L51 | T45-H49 PolarHBondContact O-N 3.47Å; L46-H49 PolarHBondContact O-N 3Å; N47-H49 VanDerWaalsContact C-N 3.32Å; H49-L51 PolarHBondContact O-N 2.93Å |
| 50 | S | 77.9 | Confident | 87 | Confident | 41 Ų | 41 | 75.3 Ų | 75.3 | 29% | 0.287 | 41% | 0.413 | S | S | . | . | trans | -94.8 | 89.5 | -175.1 | 56.9 | 0 | 0 | 0 | 0 | 110.4 | T45 T48 L52 A53 | T45-S50 PolarHBondContact O-N 2.8Å; T48-S50 PolarHBondContact O-N 3.43Å; T48-S50 PolarHBondContact OG1-OG 2.96Å; S50-L52 PolarHBondContact O-N 3.32Å; S50-A53 WeakPolarHBondContact O-CB 3.47Å; S50-A53 PolarHBondContact O-N 3.47Å; S50-A53 VanDerWaalsContact OG-CB 3.24Å; S50-A53 WeakPolarHBondContact OG-CB 3.26Å | ||
| 51 | L | 77.4 | Confident | 87 | Confident | 146 Ų | 146 | 78.1 Ų | 78.1 | 76% | 0.764 | 43% | 0.428 | S | S | * | . | G | 310 helix | trans | -58.2 | -33 | -178.4 | -68.3 | 172.1 | 0 | 0 | 0 | 113.2 | H49 A53 N54 | H49-L51 PolarHBondContact O-N 2.93Å; L51-A53 VanDerWaalsContact C-N 3.3Å; L51-A53 PolarHBondContact O-N 3.12Å; L51-N54 WeakPolarHBondContact O-CB 3.38Å; L51-N54 PolarHBondContact O-N 3.49Å |
| 52 | L | 82 | Confident | 87.3 | Confident | 152 Ų | 152 | 80.9 Ų | 80.9 | 80% | 0.796 | 44% | 0.442 | S | S | * | . | G | 310 helix | trans | -66.5 | -31.5 | 175.9 | -74.4 | 162.8 | 0 | 0 | 0 | 112.6 | S50 N54 I55 | S50-L52 PolarHBondContact O-N 3.32Å; L52-N54 PolarHBondContact O-N 2.96Å; L52-I55 PolarHBondContact O-N 3.45Å |
| 53 | A | 83.4 | Confident | 87.3 | Confident | 28 Ų | 28 | 86 Ų | 86 | 23% | 0.231 | 46% | 0.462 | C | S | . | . | G | 310 helix | trans | -74.3 | -15.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | T45 S50 L51 I55 V56 P57 | T45-A53 HydrophobicContact CG2-CB 3.64Å; S50-A53 WeakPolarHBondContact O-CB 3.47Å; S50-A53 PolarHBondContact O-N 3.47Å; S50-A53 VanDerWaalsContact OG-CB 3.24Å; S50-A53 WeakPolarHBondContact OG-CB 3.26Å; L51-A53 VanDerWaalsContact C-N 3.3Å; L51-A53 PolarHBondContact O-N 3.12Å; A53-I55 PolarHBondContact O-N 3.45Å; A53-I55 VanDerWaalsContact O-N 3.16Å; A53-V56 WeakPolarHBondContact O-CB 3.45Å; A53-V56 PolarHBondContact O-N 3.47Å; A53-P57 WeakPolarHBondContact O-CD 3.43Å |
| 54 | N | 82.6 | Confident | 87.4 | Confident | 56 Ų | 56 | 84.7 Ų | 84.7 | 30% | 0.299 | 46% | 0.457 | S | S | . | . | G | 310 helix | trans | -63.8 | -16.9 | 175.1 | -77.1 | -10.5 | 0 | 0 | 0 | 113.7 | T45 L51 L52 V56 P57 I58 | T45-N54 VanDerWaalsContact CB-OD1 3.26Å; T45-N54 WeakPolarHBondContact CB-OD1 3.36Å; T45-N54 PolarHBondContact OG1-OD1 3.35Å; L51-N54 WeakPolarHBondContact O-CB 3.38Å; L51-N54 PolarHBondContact O-N 3.49Å; L52-N54 PolarHBondContact O-N 2.96Å; N54-V56 PolarHBondContact O-N 3.2Å; N54-P57 WeakPolarHBondContact O-CD 3.44Å; N54-I58 WeakPolarHBondContact O-CD1 3.11Å; N54-I58 WeakPolarHBondContact O-CG1 3.43Å |
| 55 | I | 88.6 | Confident | 87.5 | Confident | 115 Ų | 115 | 83 Ų | 83 | 59% | 0.59 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -66.3 | -31.8 | 172.4 | -60.4 | 173.6 | 0 | 0 | 0 | 110.6 | L52 A53 I58 A59 | L52-I55 PolarHBondContact O-N 3.45Å; A53-I55 PolarHBondContact O-N 3.45Å; A53-I55 VanDerWaalsContact O-N 3.16Å; I55-I58 PolarHBondContact O-N 3.36Å; I55-A59 WeakPolarHBondContact O-CB 3.35Å; I55-A59 PolarHBondContact O-N 2.98Å |
| 56 | V | 88.8 | Confident | 87.7 | Confident | 87 Ų | 87 | 85.7 Ų | 85.7 | 53% | 0.527 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.4 | -51.2 | -175.4 | 178.4 | 0 | 0 | 0 | 0 | 112.3 | A53 N54 I58 A59 M60 | A53-V56 WeakPolarHBondContact O-CB 3.45Å; A53-V56 PolarHBondContact O-N 3.47Å; N54-V56 PolarHBondContact O-N 3.2Å; V56-I58 VanDerWaalsContact C-N 3.26Å; V56-I58 PolarHBondContact O-N 3.38Å; V56-A59 PolarHBondContact O-N 3.16Å; V56-M60 HydrophobicContact CG1-CG 4.43Å; V56-M60 WeakPolarHBondContact O-CB 3.49Å; V56-M60 VanDerWaalsContact O-CG 3.28Å; V56-M60 WeakPolarHBondContact O-CG 3.31Å; V56-M60 PolarHBondContact O-N 3.47Å |
| 57 | P | 90.1 | Very high | 87.8 | Confident | 2 Ų | 2 | 86.2 Ų | 86.2 | 1% | 0.013 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -57.1 | -36.8 | 174.5 | -23.8 | 30.2 | 0 | 0 | 0 | 113.7 | F38 A41 T42 T45 A53 N54 L61 | F38-P57 HydrophobicContact CD2-CB 3.71Å; F38-P57 WeakPolarHBondContact CD2-O 3.26Å; F38-P57 HydrophobicContact CE2-CB 3.55Å; A41-P57 HydrophobicContact CB-CB 4.37Å; A41-P57 HydrophobicContact CB-CG 3.97Å; T42-P57 HydrophobicContact CG2-CB 3.65Å; T42-P57 HydrophobicContact CG2-CG 3.9Å; T45-P57 HydrophobicContact CG2-CG 4.21Å; A53-P57 WeakPolarHBondContact O-CD 3.43Å; N54-P57 WeakPolarHBondContact O-CD 3.44Å; P57-L61 PolarHBondContact O-N 2.92Å; P57-L61 VanDerWaalsContact O-N 3.1Å |
| 58 | I | 91.4 | Very high | 88 | Confident | 108 Ų | 108 | 82.1 Ų | 82.1 | 55% | 0.554 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -69.6 | -47.6 | 179.9 | -60.1 | 167.5 | 0 | 0 | 0 | 110.1 | N54 I55 V56 M60 L61 V62 | N54-I58 WeakPolarHBondContact O-CD1 3.11Å; N54-I58 WeakPolarHBondContact O-CG1 3.43Å; I55-I58 PolarHBondContact O-N 3.36Å; V56-I58 VanDerWaalsContact C-N 3.26Å; V56-I58 PolarHBondContact O-N 3.38Å; I58-M60 VanDerWaalsContact C-N 3.31Å; I58-M60 PolarHBondContact O-N 2.92Å; I58-L61 WeakPolarHBondContact O-CB 3.4Å; I58-L61 PolarHBondContact O-N 3.29Å; I58-L61 VanDerWaalsContact O-N 3.13Å; I58-V62 WeakPolarHBondContact O-CG2 3.45Å; I58-V62 PolarHBondContact O-N 2.9Å; I58-V62 VanDerWaalsContact O-N 3.08Å |
| 59 | A | 93.1 | Very high | 88.3 | Confident | 42 Ų | 42 | 80.5 Ų | 80.5 | 35% | 0.347 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.1 | -43.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | I55 V56 L61 V62 F63 | I55-A59 WeakPolarHBondContact O-CB 3.35Å; I55-A59 PolarHBondContact O-N 2.98Å; V56-A59 PolarHBondContact O-N 3.16Å; A59-L61 VanDerWaalsContact C-N 3.3Å; A59-L61 PolarHBondContact O-N 2.78Å; A59-V62 PolarHBondContact O-N 3.36Å; A59-F63 WeakPolarHBondContact O-CD2 3.24Å; A59-F63 PolarHBondContact O-N 3.34Å; A59-F63 VanDerWaalsContact O-N 3.12Å |
| 60 | M | 92.3 | Very high | 88.8 | Confident | 82 Ų | 82 | 76.7 Ų | 76.7 | 40% | 0.404 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -56.4 | -42.5 | 174.3 | -75.4 | -72.6 | -68.6 | 0 | 0 | 112.3 | V56 I58 F63 A64 | V56-M60 HydrophobicContact CG1-CG 4.43Å; V56-M60 WeakPolarHBondContact O-CB 3.49Å; V56-M60 VanDerWaalsContact O-CG 3.28Å; V56-M60 WeakPolarHBondContact O-CG 3.31Å; V56-M60 PolarHBondContact O-N 3.47Å; I58-M60 VanDerWaalsContact C-N 3.31Å; I58-M60 PolarHBondContact O-N 2.92Å; M60-F63 PolarHBondContact O-N 3.45Å; M60-A64 WeakPolarHBondContact O-CB 3.31Å; M60-A64 PolarHBondContact O-N 3.5Å |
| 61 | L | 92.6 | Very high | 89.4 | Confident | 89 Ų | 89 | 75.4 Ų | 75.4 | 47% | 0.466 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -67.8 | -37.3 | -179.8 | -142.6 | 166.7 | 0 | 0 | 0 | 111.8 | F38 P57 I58 A59 A64 A65 | F38-L61 HydrophobicContact CD1-CD1 4.44Å; F38-L61 HydrophobicContact CD2-CB 4.46Å; F38-L61 HydrophobicContact CD2-CD1 3.79Å; F38-L61 HydrophobicContact CD2-CG 4.39Å; F38-L61 HydrophobicContact CE1-CD1 4.35Å; F38-L61 HydrophobicContact CE2-CD1 3.69Å; F38-L61 HydrophobicContact CG-CD1 4.17Å; F38-L61 HydrophobicContact CZ-CD1 3.98Å; P57-L61 PolarHBondContact O-N 2.92Å; P57-L61 VanDerWaalsContact O-N 3.1Å; I58-L61 WeakPolarHBondContact O-CB 3.4Å; I58-L61 PolarHBondContact O-N 3.29Å; I58-L61 VanDerWaalsContact O-N 3.13Å; A59-L61 VanDerWaalsContact C-N 3.3Å; A59-L61 PolarHBondContact O-N 2.78Å; L61-A64 WeakPolarHBondContact O-CB 3.4Å; L61-A64 PolarHBondContact O-N 2.76Å; L61-A65 PolarHBondContact O-N 3.39Å |
| 62 | V | 95.1 | Very high | 89.9 | Confident | 88 Ų | 88 | 72.1 Ų | 72.1 | 53% | 0.533 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63.5 | -47.9 | 175.5 | 176.3 | 0 | 0 | 0 | 0 | 110.8 | I58 A59 A64 A65 C66 | I58-V62 WeakPolarHBondContact O-CG2 3.45Å; I58-V62 PolarHBondContact O-N 2.9Å; I58-V62 VanDerWaalsContact O-N 3.08Å; A59-V62 PolarHBondContact O-N 3.36Å; V62-A64 VanDerWaalsContact C-N 3.32Å; V62-A64 PolarHBondContact O-N 3.23Å; V62-A65 PolarHBondContact O-N 3.01Å; V62-C66 PolarHBondContact O-N 2.92Å; V62-C66 VanDerWaalsContact O-N 3.1Å; V62-C66 PolarHBondContact O-SG 3.42Å |
| 63 | F | 92.2 | Very high | 90.2 | Very high | 142 Ų | 142 | 67.8 Ų | 67.8 | 62% | 0.623 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -62.9 | -39 | 176.6 | -75.4 | -67.7 | 0 | 0 | 0 | 112.2 | A59 M60 A65 C66 E67 | A59-F63 WeakPolarHBondContact O-CD2 3.24Å; A59-F63 PolarHBondContact O-N 3.34Å; A59-F63 VanDerWaalsContact O-N 3.12Å; M60-F63 PolarHBondContact O-N 3.45Å; F63-A65 VanDerWaalsContact C-N 3.33Å; F63-A65 PolarHBondContact O-N 3.06Å; F63-C66 WeakPolarHBondContact O-CB 3.41Å; F63-C66 PolarHBondContact O-N 2.85Å; F63-E67 PolarHBondContact O-N 3.45Å |
| 64 | A | 91.6 | Very high | 90.4 | Very high | 15 Ų | 15 | 71.3 Ų | 71.3 | 12% | 0.124 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -56.6 | -46 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | M34 M60 L61 V62 C66 E67 A68 | M34-A64 HydrophobicContact CB-CB 3.97Å; M34-A64 HydrophobicContact CE-CB 3.32Å; M34-A64 HydrophobicContact CG-CB 3.91Å; M34-A64 HydrophobicContact SD-CB 4.46Å; M60-A64 WeakPolarHBondContact O-CB 3.31Å; M60-A64 PolarHBondContact O-N 3.5Å; L61-A64 WeakPolarHBondContact O-CB 3.4Å; L61-A64 PolarHBondContact O-N 2.76Å; V62-A64 VanDerWaalsContact C-N 3.32Å; V62-A64 PolarHBondContact O-N 3.23Å; A64-C66 VanDerWaalsContact C-N 3.32Å; A64-C66 PolarHBondContact O-N 3.39Å; A64-E67 PolarHBondContact O-N 3.42Å; A64-A68 WeakPolarHBondContact O-CB 3.38Å; A64-A68 PolarHBondContact O-N 2.9Å |
| 65 | A | 91.4 | Very high | 90.5 | Very high | 56 Ų | 56 | 69.2 Ų | 69.2 | 46% | 0.463 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -65.9 | -36.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L61 V62 F63 A68 A69 | L61-A65 PolarHBondContact O-N 3.39Å; V62-A65 PolarHBondContact O-N 3.01Å; F63-A65 VanDerWaalsContact C-N 3.33Å; F63-A65 PolarHBondContact O-N 3.06Å; A65-A68 PolarHBondContact O-N 3.41Å; A65-A69 WeakPolarHBondContact O-CB 3.32Å; A65-A69 PolarHBondContact O-N 2.9Å |
| 66 | C | 92.3 | Very high | 90.4 | Very high | 70 Ų | 70 | 67.5 Ų | 67.5 | 47% | 0.473 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64.2 | -44.9 | 174.3 | -64.8 | 0 | 0 | 0 | 0 | 111.9 | V62 F63 A64 A69 V70 | V62-C66 PolarHBondContact O-N 2.92Å; V62-C66 VanDerWaalsContact O-N 3.1Å; V62-C66 PolarHBondContact O-SG 3.42Å; F63-C66 WeakPolarHBondContact O-CB 3.41Å; F63-C66 PolarHBondContact O-N 2.85Å; A64-C66 VanDerWaalsContact C-N 3.32Å; A64-C66 PolarHBondContact O-N 3.39Å; C66-A69 PolarHBondContact O-N 3.05Å; C66-V70 WeakPolarHBondContact O-CG2 3.43Å; C66-V70 PolarHBondContact O-N 2.83Å; C66-V70 VanDerWaalsContact O-N 3.07Å |
| 67 | E | 89.8 | Confident | 90.2 | Very high | 119 Ų | 119 | 65.9 Ų | 65.9 | 56% | 0.556 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -62.8 | -43.2 | 176.3 | -71 | -178.1 | 172.3 | 0 | 0 | 111.8 | F63 A64 A69 V70 G71 | F63-E67 PolarHBondContact O-N 3.45Å; A64-E67 PolarHBondContact O-N 3.42Å; E67-A69 PolarHBondContact O-N 3.27Å; E67-V70 PolarHBondContact O-N 3.2Å; E67-G71 PolarHBondContact O-N 3.02Å |
| 68 | A | 90.3 | Very high | 89.7 | Confident | 22 Ų | 22 | 67 Ų | 67 | 18% | 0.182 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -62.6 | -41.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A64 A65 V70 G71 L72 | A64-A68 WeakPolarHBondContact O-CB 3.38Å; A64-A68 PolarHBondContact O-N 2.9Å; A65-A68 PolarHBondContact O-N 3.41Å; A68-V70 PolarHBondContact O-N 2.89Å; A68-G71 PolarHBondContact O-N 3.25Å; A68-L72 WeakPolarHBondContact O-CG 3.37Å; A68-L72 PolarHBondContact O-N 2.91Å |
| 69 | A | 91.4 | Very high | 89.3 | Confident | 59 Ų | 59 | 63.4 Ų | 63.4 | 49% | 0.488 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A65 C66 E67 L72 A73 | A65-A69 WeakPolarHBondContact O-CB 3.32Å; A65-A69 PolarHBondContact O-N 2.9Å; C66-A69 PolarHBondContact O-N 3.05Å; E67-A69 PolarHBondContact O-N 3.27Å; A69-L72 PolarHBondContact O-N 3.02Å; A69-A73 WeakPolarHBondContact O-CB 3.19Å; A69-A73 PolarHBondContact O-N 3.08Å |
| 70 | V | 91.3 | Very high | 88.8 | Confident | 91 Ų | 91 | 67.6 Ų | 67.6 | 55% | 0.552 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -66.4 | -41.3 | 175 | 176.2 | 0 | 0 | 0 | 0 | 110.9 | C66 E67 A68 L72 A73 L74 | C66-V70 WeakPolarHBondContact O-CG2 3.43Å; C66-V70 PolarHBondContact O-N 2.83Å; C66-V70 VanDerWaalsContact O-N 3.07Å; E67-V70 PolarHBondContact O-N 3.2Å; A68-V70 PolarHBondContact O-N 2.89Å; V70-L72 PolarHBondContact O-N 3.35Å; V70-A73 PolarHBondContact O-N 3.36Å; V70-L74 HydrophobicContact CG1-CD1 4.41Å; V70-L74 WeakPolarHBondContact O-CG 3.35Å; V70-L74 PolarHBondContact O-N 2.99Å |
| 71 | G | 89.2 | Confident | 88.1 | Confident | 15 Ų | 15 | 68.5 Ų | 68.5 | 16% | 0.155 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59.7 | -42.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | E67 A68 L74 L75 | E67-G71 PolarHBondContact O-N 3.02Å; A68-G71 PolarHBondContact O-N 3.25Å; G71-L74 PolarHBondContact O-N 3.42Å; G71-L75 PolarHBondContact O-N 2.95Å |
| 72 | L | 87.9 | Confident | 87.1 | Confident | 76 Ų | 76 | 68 Ų | 68 | 40% | 0.398 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -67.3 | -41.1 | 174.6 | -72.9 | 167.5 | 0 | 0 | 0 | 112.2 | M24 L27 A68 A69 V70 L74 L75 V76 | M24-L72 HydrophobicContact SD-CD2 4.34Å; L27-L72 HydrophobicContact CD1-CD2 3.93Å; L27-L72 HydrophobicContact CD1-CG 4.37Å; A68-L72 WeakPolarHBondContact O-CG 3.37Å; A68-L72 PolarHBondContact O-N 2.91Å; A69-L72 PolarHBondContact O-N 3.02Å; V70-L72 PolarHBondContact O-N 3.35Å; L72-L74 VanDerWaalsContact C-N 3.29Å; L72-L74 PolarHBondContact O-N 3.42Å; L72-L75 WeakPolarHBondContact O-CB 3.4Å; L72-L75 PolarHBondContact O-N 3.13Å; L72-L75 VanDerWaalsContact O-N 3.16Å; L72-V76 WeakPolarHBondContact O-CG2 3.48Å; L72-V76 PolarHBondContact O-N 3.46Å |
| 73 | A | 89.8 | Confident | 85.8 | Confident | 62 Ų | 62 | 66.7 Ų | 66.7 | 51% | 0.512 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.3 | -40.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A69 V70 V76 S77 | A69-A73 WeakPolarHBondContact O-CB 3.19Å; A69-A73 PolarHBondContact O-N 3.08Å; V70-A73 PolarHBondContact O-N 3.36Å; A73-V76 PolarHBondContact O-N 3.19Å; A73-S77 PolarHBondContact O-N 3.42Å; A73-S77 VanDerWaalsContact O-N 3.08Å |
| 74 | L | 85.9 | Confident | 84.6 | Confident | 101 Ų | 101 | 64.5 Ų | 64.5 | 53% | 0.529 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 173.2 | -74.4 | 171.4 | 0 | 0 | 0 | 111.8 | V70 G71 L72 V76 S77 I78 | V70-L74 HydrophobicContact CG1-CD1 4.41Å; V70-L74 WeakPolarHBondContact O-CG 3.35Å; V70-L74 PolarHBondContact O-N 2.99Å; G71-L74 PolarHBondContact O-N 3.42Å; L72-L74 VanDerWaalsContact C-N 3.29Å; L72-L74 PolarHBondContact O-N 3.42Å; L74-V76 VanDerWaalsContact C-N 3.32Å; L74-V76 PolarHBondContact O-N 3.1Å; L74-S77 WeakPolarHBondContact O-CB 3.49Å; L74-S77 PolarHBondContact O-N 3.03Å; L74-S77 PolarHBondContact O-OG 2.93Å; L74-I78 WeakPolarHBondContact O-CG1 3.4Å; L74-I78 PolarHBondContact O-N 2.91Å |
| 75 | L | 85.9 | Confident | 83.2 | Confident | 12 Ų | 12 | 66.3 Ų | 66.3 | 6% | 0.063 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.7 | -43.6 | 177.4 | -164.3 | 156.7 | 0 | 0 | 0 | 111.7 | L23 M24 L27 G71 L72 S77 I78 S79 | L23-L75 HydrophobicContact CB-CD1 4.03Å; L23-L75 HydrophobicContact CB-CG 4.46Å; L23-L75 HydrophobicContact CD2-CB 4.28Å; L23-L75 HydrophobicContact CD2-CD1 3.73Å; L23-L75 HydrophobicContact CD2-CG 4.16Å; L23-L75 HydrophobicContact CG-CD1 4.49Å; M24-L75 HydrophobicContact CB-CD1 4.46Å; M24-L75 HydrophobicContact CG-CD1 3.71Å; M24-L75 HydrophobicContact CG-CD2 4.48Å; M24-L75 HydrophobicContact SD-CD1 3.25Å; M24-L75 WeakPolarHBondContact SD-CD1 3.28Å; M24-L75 HydrophobicContact SD-CD2 4.07Å; M24-L75 HydrophobicContact SD-CG 4.31Å; L27-L75 HydrophobicContact CD1-CD1 3.58Å; G71-L75 PolarHBondContact O-N 2.95Å; L72-L75 WeakPolarHBondContact O-CB 3.4Å; L72-L75 PolarHBondContact O-N 3.13Å; L72-L75 VanDerWaalsContact O-N 3.16Å; L75-S77 VanDerWaalsContact C-N 3.29Å; L75-S77 PolarHBondContact O-N 2.98Å; L75-I78 PolarHBondContact O-N 3.23Å; L75-S79 PolarHBondContact O-N 3.47Å; L75-S79 PolarHBondContact O-OG 3.48Å |
| 76 | V | 86.7 | Confident | 81.8 | Confident | 79 Ų | 79 | 68.1 Ų | 68.1 | 48% | 0.479 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -61 | -38 | 174.1 | 174.7 | 0 | 0 | 0 | 0 | 111.5 | L72 A73 L74 S79 N80 | L72-V76 WeakPolarHBondContact O-CG2 3.48Å; L72-V76 PolarHBondContact O-N 3.46Å; A73-V76 PolarHBondContact O-N 3.19Å; L74-V76 VanDerWaalsContact C-N 3.32Å; L74-V76 PolarHBondContact O-N 3.1Å; V76-S79 WeakPolarHBondContact CA-OG 3.49Å; V76-S79 PolarHBondContact O-OG 3.45Å; V76-N80 WeakPolarHBondContact O-CB 3.5Å; V76-N80 PolarHBondContact O-N 2.9Å; V76-N80 PolarHBondContact O-ND2 3.13Å; V76-N80 VanDerWaalsContact O-ND2 3.14Å |
| 77 | S | 84 | Confident | 80.3 | Confident | 54 Ų | 54 | 67.2 Ų | 67.2 | 38% | 0.378 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -66.2 | -39.9 | 176.3 | 75.7 | 0 | 0 | 0 | 0 | 112.5 | A73 L74 L75 N80 T81 | A73-S77 PolarHBondContact O-N 3.42Å; A73-S77 VanDerWaalsContact O-N 3.08Å; L74-S77 WeakPolarHBondContact O-CB 3.49Å; L74-S77 PolarHBondContact O-N 3.03Å; L74-S77 PolarHBondContact O-OG 2.93Å; L75-S77 VanDerWaalsContact C-N 3.29Å; L75-S77 PolarHBondContact O-N 2.98Å; S77-N80 PolarHBondContact O-N 2.76Å; S77-T81 WeakPolarHBondContact O-CG2 3.27Å; S77-T81 PolarHBondContact O-N 2.91Å; S77-T81 VanDerWaalsContact O-N 3.12Å; S77-T81 PolarHBondContact O-OG1 3.44Å |
| 78 | I | 80.6 | Confident | 78.8 | Confident | 25 Ų | 25 | 68.5 Ų | 68.5 | 13% | 0.128 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -67.9 | -42.3 | 178 | -65.7 | 164.1 | 0 | 0 | 0 | 110.7 | L23 L74 L75 N80 T81 Y82 L90 | L23-I78 HydrophobicContact CD1-CD1 3.87Å; L74-I78 WeakPolarHBondContact O-CG1 3.4Å; L74-I78 PolarHBondContact O-N 2.91Å; L75-I78 PolarHBondContact O-N 3.23Å; I78-N80 VanDerWaalsContact C-N 3.31Å; I78-N80 PolarHBondContact O-N 3.38Å; I78-T81 PolarHBondContact O-N 3.38Å; I78-T81 PolarHBondContact O-OG1 3.29Å; I78-T81 VanDerWaalsContact O-OG1 3.1Å; I78-Y82 HydrophobicContact CG2-CD2 4.08Å; I78-Y82 PolarHBondContact O-N 2.91Å; I78-L90 HydrophobicContact CD1-CD1 4.35Å |
| 79 | S | 81.7 | Confident | 77.4 | Confident | 33 Ų | 33 | 70.4 Ų | 70.4 | 23% | 0.231 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -66 | -35.3 | 177.7 | 70.4 | 0 | 0 | 0 | 0 | 111.7 | L75 V76 G83 D85 | L75-S79 PolarHBondContact O-N 3.47Å; L75-S79 PolarHBondContact O-OG 3.48Å; V76-S79 WeakPolarHBondContact CA-OG 3.49Å; V76-S79 PolarHBondContact O-OG 3.45Å; S79-G83 WeakPolarHBondContact O-CA 3.34Å; S79-G83 PolarHBondContact O-N 3.39Å; S79-D85 WeakPolarHBondContact CB-OD1 3.41Å |
| 80 | N | 82.5 | Confident | 76 | Confident | 130 Ų | 130 | 70.5 Ų | 70.5 | 70% | 0.695 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -68.1 | -33.6 | 173.5 | -74.3 | -28.6 | 0 | 0 | 0 | 113.5 | V76 S77 I78 | V76-N80 WeakPolarHBondContact O-CB 3.5Å; V76-N80 PolarHBondContact O-N 2.9Å; V76-N80 PolarHBondContact O-ND2 3.13Å; V76-N80 VanDerWaalsContact O-ND2 3.14Å; S77-N80 PolarHBondContact O-N 2.76Å; I78-N80 VanDerWaalsContact C-N 3.31Å; I78-N80 PolarHBondContact O-N 3.38Å |
| 81 | T | 78.1 | Confident | 74.8 | Confident | 100 Ų | 100 | 70.3 Ų | 70.3 | 61% | 0.613 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -84.9 | -35.9 | -179.3 | 53.8 | 0 | 0 | 0 | 0 | 113.7 | S77 I78 | S77-T81 WeakPolarHBondContact O-CG2 3.27Å; S77-T81 PolarHBondContact O-N 2.91Å; S77-T81 VanDerWaalsContact O-N 3.12Å; S77-T81 PolarHBondContact O-OG1 3.44Å; I78-T81 PolarHBondContact O-N 3.38Å; I78-T81 PolarHBondContact O-OG1 3.29Å; I78-T81 VanDerWaalsContact O-OG1 3.1Å |
| 82 | Y | 72.6 | Confident | 73.7 | Confident | 80 Ų | 80 | 75.5 Ų | 75.5 | 31% | 0.314 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -112.8 | -4.2 | -174.1 | -63.3 | -77.9 | 0 | 0 | 0 | 114.2 | I78 L84 N89 L90 L92 | I78-Y82 HydrophobicContact CG2-CD2 4.08Å; I78-Y82 PolarHBondContact O-N 2.91Å; Y82-L84 PolarHBondContact O-N 2.91Å; Y82-N89 HydrophobicContact CD1-CB 3.78Å; Y82-N89 HydrophobicContact CE1-CB 4.3Å; Y82-N89 WeakPolarHBondContact CE1-O 3.38Å; Y82-N89 HydrophobicContact CG-CB 3.91Å; Y82-L90 HydrophobicContact CE2-CD2 3.85Å; Y82-L92 HydrophobicContact CE1-CD1 4.15Å; Y82-L92 VanDerWaalsContact OH-CD1 3.32Å; Y82-L92 WeakPolarHBondContact OH-CD1 3.42Å |
| 83 | G | 67.6 | Low | 72.9 | Confident | 60 Ų | 60 | 79.6 Ų | 79.6 | 62% | 0.619 | 44% | 0.443 | S | S | * | . | S | Bend | trans | 69.4 | -8.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | S79 | S79-G83 WeakPolarHBondContact O-CA 3.34Å; S79-G83 PolarHBondContact O-N 3.39Å |
| 84 | L | 65.3 | Low | 71.8 | Confident | 96 Ų | 96 | 84.5 Ų | 84.5 | 50% | 0.503 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -144.7 | 140 | -174.6 | -64.4 | 169.2 | 0 | 0 | 0 | 110.6 | Y82 Y86 | Y82-L84 PolarHBondContact O-N 2.91Å; L84-Y86 HydrophobicContact CB-CD2 3.62Å; L84-Y86 HydrophobicContact CB-CE2 4.12Å; L84-Y86 HydrophobicContact CD1-CD2 3.97Å; L84-Y86 HydrophobicContact CD1-CE2 4.04Å; L84-Y86 HydrophobicContact CD2-CE2 4.35Å; L84-Y86 HydrophobicContact CG-CD2 4.29Å; L84-Y86 HydrophobicContact CG-CE2 4.41Å; L84-Y86 PolarHBondContact O-N 3.03Å |
| 85 | D | 62.4 | Low | 70.5 | Confident | 52 Ų | 52 | 88.3 Ų | 88.3 | 28% | 0.278 | 49% | 0.489 | S | S | . | . | trans | -74.4 | 24.6 | -177.3 | -58.9 | -24.6 | 0 | 0 | 0 | 114.5 | L23 S79 | L23-D85 PolarHBondContact N-O 3.34Å; S79-D85 WeakPolarHBondContact CB-OD1 3.41Å | ||
| 86 | Y | 62.5 | Low | 69.7 | Low | 94 Ų | 94 | 92.1 Ų | 92.1 | 37% | 0.369 | 51% | 0.51 | S | S | . | . | B | Isolated β-bridge | trans | -86 | 120.6 | -174.6 | -69.4 | -57.2 | 0 | 0 | 0 | 111.9 | S21 H22 L84 H88 N89 | S21-Y86 WeakPolarHBondContact O-CA 3.31Å; H22-Y86 AromaticContact CE1-CE1 3.45Å; H22-Y86 VanDerWaalsContact CE1-CE1 3.45Å; H22-Y86 WeakPolarHBondContact CE1-CE1 3.4Å; H22-Y86 AromaticContact CE1-CZ 3.9Å; H22-Y86 AromaticContact NE2-CE1 3.77Å; L84-Y86 HydrophobicContact CB-CD2 3.62Å; L84-Y86 HydrophobicContact CB-CE2 4.12Å; L84-Y86 HydrophobicContact CD1-CD2 3.97Å; L84-Y86 HydrophobicContact CD1-CE2 4.04Å; L84-Y86 HydrophobicContact CD2-CE2 4.35Å; L84-Y86 HydrophobicContact CG-CD2 4.29Å; L84-Y86 HydrophobicContact CG-CE2 4.41Å; L84-Y86 PolarHBondContact O-N 3.03Å; Y86-H88 PolarHBondContact O-N 3.38Å; Y86-H88 VanDerWaalsContact O-N 3.16Å; Y86-N89 PolarHBondContact O-N 2.96Å; Y86-N89 VanDerWaalsContact O-N 3.17Å |
| 87 | V | 60.8 | Low | 68.8 | Low | 51 Ų | 51 | 92.8 Ų | 92.8 | 31% | 0.309 | 51% | 0.511 | S | S | . | . | G | 310 helix | trans | -58 | -29.3 | 176.2 | -178.2 | 0 | 0 | 0 | 0 | 112 | S21 L23 N89 L90 | S21-V87 PolarHBondContact O-N 3.23Å; L23-V87 HydrophobicContact CB-CG2 4.27Å; L23-V87 HydrophobicContact CD1-CG2 4.23Å; L23-V87 HydrophobicContact CG-CG2 4.44Å; V87-N89 PolarHBondContact O-N 2.74Å; V87-L90 PolarHBondContact O-N 3.42Å |
| 88 | H | 59.3 | Low | 68 | Low | 146 Ų | 146 | 94.9 Ų | 94.9 | 68% | 0.676 | 52% | 0.519 | S | S | * | . | G | 310 helix | trans | -66.3 | -17.3 | -178.9 | -162.7 | -59.3 | 0 | 0 | 0 | 113.8 | Y86 L90 | Y86-H88 PolarHBondContact O-N 3.38Å; Y86-H88 VanDerWaalsContact O-N 3.16Å; H88-L90 PolarHBondContact O-N 3.19Å |
| 89 | N | 59.6 | Low | 67.2 | Low | 62 Ų | 62 | 99.1 Ų | 99.1 | 33% | 0.332 | 54% | 0.542 | S | S | . | . | G | 310 helix | trans | -76.8 | -10.1 | 177.6 | -76.5 | -0.9 | 0 | 0 | 0 | 113.1 | Y82 Y86 V87 N91 | Y82-N89 HydrophobicContact CD1-CB 3.78Å; Y82-N89 HydrophobicContact CE1-CB 4.3Å; Y82-N89 WeakPolarHBondContact CE1-O 3.38Å; Y82-N89 HydrophobicContact CG-CB 3.91Å; Y86-N89 PolarHBondContact O-N 2.96Å; Y86-N89 VanDerWaalsContact O-N 3.17Å; V87-N89 PolarHBondContact O-N 2.74Å; N89-N91 VanDerWaalsContact C-N 3.25Å; N89-N91 PolarHBondContact O-N 3.33Å |
| 90 | L | 62.1 | Low | 66.3 | Low | 62 Ų | 62 | 103.2 Ų | 103.2 | 33% | 0.325 | 56% | 0.561 | S | S | . | * | G | 310 helix | trans | -84.4 | 21.5 | -178.9 | -63.1 | 169.4 | 0 | 0 | 0 | 114.2 | I78 Y82 V87 H88 L92 | I78-L90 HydrophobicContact CD1-CD1 4.35Å; Y82-L90 HydrophobicContact CE2-CD2 3.85Å; V87-L90 PolarHBondContact O-N 3.42Å; H88-L90 PolarHBondContact O-N 3.19Å; L90-L92 PolarHBondContact O-N 3.13Å |
| 91 | N | 66.8 | Low | 65.2 | Low | 86 Ų | 86 | 101.4 Ų | 101.4 | 46% | 0.46 | 55% | 0.552 | S | S | . | * | G | 310 helix | trans | -77.4 | 1.3 | -178.4 | -76 | -2 | 0 | 0 | 0 | 114.8 | N89 L93 Q94 | N89-N91 VanDerWaalsContact C-N 3.25Å; N89-N91 PolarHBondContact O-N 3.33Å; N91-L93 PolarHBondContact O-N 3.02Å; N91-Q94 WeakPolarHBondContact O-CB 3.48Å; N91-Q94 PolarHBondContact O-N 3.29Å |
| 92 | L | 65.9 | Low | 64.3 | Low | 124 Ų | 124 | 101.5 Ų | 101.5 | 65% | 0.649 | 55% | 0.548 | S | S | * | . | G | 310 helix | trans | -66.2 | -20.2 | 179.1 | -80.1 | 161.5 | 0 | 0 | 0 | 113.8 | Y82 L90 Q94 | Y82-L92 HydrophobicContact CE1-CD1 4.15Å; Y82-L92 VanDerWaalsContact OH-CD1 3.32Å; Y82-L92 WeakPolarHBondContact OH-CD1 3.42Å; L90-L92 PolarHBondContact O-N 3.13Å; L92-Q94 VanDerWaalsContact C-N 3.29Å |
| 93 | L | 70.6 | Confident | 63.7 | Low | 163 Ų | 163 | 103.2 Ų | 103.2 | 85% | 0.853 | 57% | 0.566 | S | S | * | * | G | 310 helix | trans | -84.1 | 0.7 | 177.2 | -76.3 | 156.7 | 0 | 0 | 0 | 113.7 | N91 | N91-L93 PolarHBondContact O-N 3.02Š|
| 94 | Q | 66.9 | Low | 63.4 | Low | 165 Ų | 165 | 106.8 Ų | 106.8 | 77% | 0.771 | 56% | 0.562 | S | S | * | * | G | 310 helix | trans | -81.9 | -2.3 | 175.4 | -161.7 | 176.3 | -8.2 | 0 | 0 | 112.7 | N91 L92 | N91-Q94 WeakPolarHBondContact O-CB 3.48Å; N91-Q94 PolarHBondContact O-N 3.29Å; L92-Q94 VanDerWaalsContact C-N 3.29Å |
| 95 | C | 58.3 | Low | 63.2 | Low | 180 Ų | 180 | 107.7 Ų | 107.7 | 100% | 1.216 | 57% | 0.567 | S | S | * | * | trans | -82.7 | 0 | 175.4 | -68.3 | 0 | 0 | 0 | 0 | 112.7 |
Retrieved 95 of 95 residues in 194.5 ms
(Link to these results)