| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 55.5 | Low | 73.1 | Confident | 206 Ų | 206 | 98.2 Ų | 98.2 | 100% | 1.015 | 53% | 0.53 | S | S | * | . | 0 | -27.4 | 0 | -74.2 | 173.4 | 101.9 | 0 | 0 | 113.3 | E3 N4 | M1-E3 PolarHBondContact O-N 3.35Å; M1-N4 PolarHBondContact O-N 3.15Å | |||
| 2 | N | 52.8 | Low | 74 | Confident | 144 Ų | 144 | 93.3 Ų | 93.3 | 77% | 0.77 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.4 | -37.7 | -177.9 | -89.2 | 18.7 | 0 | 0 | 0 | 115.8 | ||
| 3 | E | 57.7 | Low | 75 | Confident | 150 Ų | 150 | 93.8 Ų | 93.8 | 70% | 0.701 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -77.1 | -24.3 | -176.9 | -68.5 | -80.9 | 140.3 | 0 | 0 | 113.3 | M1 L5 F6 A7 | M1-E3 PolarHBondContact O-N 3.35Å; E3-L5 VanDerWaalsContact C-N 3.33Å; E3-L5 PolarHBondContact O-N 3.29Å; E3-F6 PolarHBondContact O-N 3.34Å; E3-A7 PolarHBondContact O-N 3.43Å |
| 4 | N | 73.9 | Confident | 75.8 | Confident | 117 Ų | 117 | 95.1 Ų | 95.1 | 63% | 0.626 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -71.7 | -28.5 | -170.8 | -67 | 5.9 | 0 | 0 | 0 | 112.7 | M1 | M1-N4 PolarHBondContact O-N 3.15Å |
| 5 | L | 75 | Confident | 76.4 | Confident | 45 Ų | 45 | 100.3 Ų | 100.3 | 24% | 0.236 | 55% | 0.545 | C | S | . | . | H | α-helix | trans | -71.1 | -35.5 | 179.5 | -67.3 | 177 | 0 | 0 | 0 | 112.2 | E3 H172 L173 | E3-L5 VanDerWaalsContact C-N 3.33Å; E3-L5 PolarHBondContact O-N 3.29Å; L5-H172 WeakPolarHBondContact CD2-CE1 3.37Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.38Å; L5-L173 HydrophobicContact CD1-CD2 4.11Å; L5-L173 HydrophobicContact CD2-CD2 4.45Å |
| 6 | F | 81.2 | Confident | 76.8 | Confident | 117 Ų | 117 | 98.4 Ų | 98.4 | 51% | 0.513 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -93 | -10.2 | -177.1 | -67.1 | -75.7 | 0 | 0 | 0 | 113.6 | E3 S8 F9 L169 | E3-F6 PolarHBondContact O-N 3.34Å; F6-S8 PolarHBondContact O-N 3.03Å; F6-S8 VanDerWaalsContact O-N 3.13Å; F6-F9 AromaticContact CD1-CD2 3.99Å; F6-F9 HydrophobicContact CD1-CD2 3.99Å; F6-F9 HydrophobicContact CD1-CE2 4.37Å; F6-F9 PolarHBondContact O-N 3.37Å; F6-L169 HydrophobicContact CD1-CD2 4.38Å; F6-L169 HydrophobicContact CE1-CD1 4.1Å; F6-L169 HydrophobicContact CE1-CD2 4Å; F6-L169 HydrophobicContact CZ-CD2 4.4Å |
| 7 | A | 79.3 | Confident | 77.3 | Confident | 53 Ų | 53 | 100 Ų | 100 | 44% | 0.438 | 56% | 0.562 | S | S | . | * | G | 310 helix | trans | -54 | -33.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E3 F9 I10 | E3-A7 PolarHBondContact O-N 3.43Å; A7-F9 PolarHBondContact O-N 3.42Å; A7-I10 PolarHBondContact O-N 3.03Å |
| 8 | S | 79.7 | Confident | 77.7 | Confident | 61 Ų | 61 | 98.7 Ų | 98.7 | 43% | 0.427 | 56% | 0.559 | S | S | . | * | G | 310 helix | trans | -69 | -18.7 | 177.3 | 58.8 | 0 | 0 | 0 | 0 | 114.3 | F6 F92 | F6-S8 PolarHBondContact O-N 3.03Å; F6-S8 VanDerWaalsContact O-N 3.13Å; S8-F92 WeakPolarHBondContact O-CD2 2.98Å |
| 9 | F | 82.2 | Confident | 78.1 | Confident | 26 Ų | 26 | 94.5 Ų | 94.5 | 11% | 0.114 | 54% | 0.538 | C | S | . | . | G | 310 helix | trans | -94.7 | -9.6 | 178.3 | -58.4 | -70.3 | 0 | 0 | 0 | 112.8 | F6 A7 A11 T96 Q97 T165 H168 L169 | F6-F9 AromaticContact CD1-CD2 3.99Å; F6-F9 HydrophobicContact CD1-CD2 3.99Å; F6-F9 HydrophobicContact CD1-CE2 4.37Å; F6-F9 PolarHBondContact O-N 3.37Å; A7-F9 PolarHBondContact O-N 3.42Å; F9-A11 PolarHBondContact O-N 3.44Å; F9-T96 HydrophobicContact CD1-CG2 3.82Å; F9-T96 HydrophobicContact CE1-CG2 3.71Å; F9-Q97 PolarHBondContact O-NE2 2.93Å; F9-T165 HydrophobicContact CD1-CG2 4.44Å; F9-T165 HydrophobicContact CE1-CG2 4.16Å; F9-H168 HydrophobicContact CE1-CB 4.11Å; F9-H168 HydrophobicContact CZ-CB 3.83Å; F9-L169 HydrophobicContact CE2-CD1 4.47Å; F9-L169 HydrophobicContact CE2-CD2 3.71Å; F9-L169 HydrophobicContact CE2-CG 3.78Å; F9-L169 HydrophobicContact CZ-CD2 4.34Å; F9-L169 HydrophobicContact CZ-CG 3.94Å |
| 10 | I | 84.4 | Confident | 78.5 | Confident | 109 Ų | 109 | 90.8 Ų | 90.8 | 56% | 0.559 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -69.5 | 130 | 178.2 | -58.6 | 175.3 | 0 | 0 | 0 | 108.5 | A7 P12 | A7-I10 PolarHBondContact O-N 3.03Å; I10-P12 WeakPolarHBondContact O-CD 3.4Å |
| 11 | A | 83.1 | Confident | 78.8 | Confident | 52 Ų | 52 | 90.3 Ų | 90.3 | 43% | 0.43 | 52% | 0.518 | S | S | . | . | P | Polyproline II helix | trans | -59.1 | 120.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | F9 T13 | F9-A11 PolarHBondContact O-N 3.44Å; A11-T13 PolarHBondContact O-N 2.96Å |
| 12 | P | 83.6 | Confident | 80.2 | Confident | 39 Ų | 39 | 86.4 Ų | 86.4 | 25% | 0.253 | 50% | 0.5 | S | S | . | . | P | Polyproline II helix | trans | -71.2 | 127.4 | -174.1 | 26.7 | -33 | 0 | 0 | 0 | 110.1 | I10 A19 I23 F92 | I10-P12 WeakPolarHBondContact O-CD 3.4Å; P12-A19 HydrophobicContact CB-CB 4.22Å; P12-A19 HydrophobicContact CG-CB 4.33Å; P12-A19 WeakPolarHBondContact O-CB 3.31Å; P12-A19 PolarHBondContact O-N 2.9Å; P12-I23 HydrophobicContact CG-CD1 3.63Å; P12-F92 HydrophobicContact CG-CB 4.41Å; P12-F92 HydrophobicContact CG-CD1 4.13Å; P12-F92 HydrophobicContact CG-CG 4.11Å |
| 13 | T | 86.8 | Confident | 81.9 | Confident | 101 Ų | 101 | 82.1 Ų | 82.1 | 62% | 0.62 | 48% | 0.476 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 127.6 | 170.1 | 54.1 | 0 | 0 | 0 | 0 | 108.6 | A11 L17 | A11-T13 PolarHBondContact O-N 2.96Å; T13-L17 CarbonylContact C-O 3.56Å; T13-L17 VanDerWaalsContact CA-O 3.26Å; T13-L17 WeakPolarHBondContact CA-O 3.47Å |
| 14 | I | 86.3 | Confident | 83.3 | Confident | 111 Ų | 111 | 77.4 Ų | 77.4 | 57% | 0.569 | 46% | 0.456 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 122.4 | 176.1 | -65.4 | 172.4 | 0 | 0 | 0 | 106.4 | G16 L17 A19 | I14-G16 PolarHBondContact O-N 3.29Å; I14-G16 VanDerWaalsContact O-N 3.13Å; I14-L17 PolarHBondContact N-O 3.11Å; I14-L17 PolarHBondContact O-N 3.18Å; I14-A19 HydrophobicContact CB-CB 4.45Å; I14-A19 HydrophobicContact CD1-CB 3.85Å; I14-A19 HydrophobicContact CG1-CB 3.94Å |
| 15 | L | 84.6 | Confident | 83.9 | Confident | 173 Ų | 173 | 77.4 Ų | 77.4 | 91% | 0.906 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.2 | 33.2 | -179.5 | -81.6 | 129.2 | 0 | 0 | 0 | 113.7 | L17 | L15-L17 PolarHBondContact O-N 3.06Š|
| 16 | G | 83.7 | Confident | 84.6 | Confident | 70 Ų | 70 | 79.5 Ų | 79.5 | 72% | 0.722 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.8 | -2.1 | -177.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | I14 | I14-G16 PolarHBondContact O-N 3.29Å; I14-G16 VanDerWaalsContact O-N 3.13Å |
| 17 | L | 84.4 | Confident | 84.9 | Confident | 126 Ų | 126 | 74 Ų | 74 | 66% | 0.66 | 44% | 0.439 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.8 | 140.4 | 172.6 | -66.4 | 170 | 0 | 0 | 0 | 110.9 | T13 I14 L15 A19 | T13-L17 CarbonylContact C-O 3.56Å; T13-L17 VanDerWaalsContact CA-O 3.26Å; T13-L17 WeakPolarHBondContact CA-O 3.47Å; I14-L17 PolarHBondContact N-O 3.11Å; I14-L17 PolarHBondContact O-N 3.18Å; L15-L17 PolarHBondContact O-N 3.06Å; L17-A19 PolarHBondContact O-N 2.89Å |
| 18 | P | 84.8 | Confident | 85.1 | Confident | 77 Ų | 77 | 74.9 Ų | 74.9 | 50% | 0.5 | 44% | 0.44 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.9 | 101.8 | 177.8 | 29 | -33.3 | 0 | 0 | 0 | 110.6 | A20 V21 | P18-A20 PolarHBondContact O-N 3.47Å; P18-V21 HydrophobicContact CB-CG2 4.5Å; P18-V21 HydrophobicContact CG-CG2 4.25Å; P18-V21 PolarHBondContact O-N 2.86Å |
| 19 | A | 85.3 | Confident | 85.5 | Confident | 19 Ų | 19 | 78.5 Ų | 78.5 | 16% | 0.157 | 45% | 0.453 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | -17.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | P12 I14 L17 V21 L22 I23 | P12-A19 HydrophobicContact CB-CB 4.22Å; P12-A19 HydrophobicContact CG-CB 4.33Å; P12-A19 WeakPolarHBondContact O-CB 3.31Å; P12-A19 PolarHBondContact O-N 2.9Å; I14-A19 HydrophobicContact CB-CB 4.45Å; I14-A19 HydrophobicContact CD1-CB 3.85Å; I14-A19 HydrophobicContact CG1-CB 3.94Å; L17-A19 PolarHBondContact O-N 2.89Å; A19-V21 PolarHBondContact O-N 3.24Å; A19-L22 WeakPolarHBondContact O-CB 3.22Å; A19-L22 PolarHBondContact O-N 3.31Å; A19-L22 VanDerWaalsContact O-N 3.08Å; A19-I23 PolarHBondContact O-N 3.45Å |
| 20 | A | 85.3 | Confident | 85.8 | Confident | 19 Ų | 19 | 81 Ų | 81 | 16% | 0.157 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -53.4 | -33.5 | 174 | 0 | 0 | 0 | 0 | 0 | 113.2 | P18 L22 I23 I24 F92 | P18-A20 PolarHBondContact O-N 3.47Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 3.1Å; A20-I23 PolarHBondContact O-N 2.96Å; A20-I24 VanDerWaalsContact O-CG1 3.26Å; A20-I24 WeakPolarHBondContact O-CG1 3.44Å; A20-I24 PolarHBondContact O-N 3.29Å; A20-F92 HydrophobicContact CB-CE1 4.38Å |
| 21 | V | 85 | Confident | 85.9 | Confident | 82 Ų | 82 | 78.3 Ų | 78.3 | 50% | 0.497 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -63.3 | -42.1 | 178.6 | 180 | 0 | 0 | 0 | 0 | 111.1 | P18 A19 I23 I24 L25 | P18-V21 HydrophobicContact CB-CG2 4.5Å; P18-V21 HydrophobicContact CG-CG2 4.25Å; P18-V21 PolarHBondContact O-N 2.86Å; A19-V21 PolarHBondContact O-N 3.24Å; V21-I23 VanDerWaalsContact C-N 3.31Å; V21-I23 PolarHBondContact O-N 3.43Å; V21-I24 PolarHBondContact O-N 3.42Å; V21-L25 HydrophobicContact CG1-CD1 4.14Å; V21-L25 WeakPolarHBondContact O-CG 3.46Å; V21-L25 PolarHBondContact O-N 3.02Å; V21-L25 VanDerWaalsContact O-N 3.08Å |
| 22 | L | 86 | Confident | 86.1 | Confident | 124 Ų | 124 | 78.7 Ų | 78.7 | 65% | 0.649 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -66 | -38.4 | 178.8 | -166.8 | 147.9 | 0 | 0 | 0 | 111 | A19 A20 L25 F26 | A19-L22 WeakPolarHBondContact O-CB 3.22Å; A19-L22 PolarHBondContact O-N 3.31Å; A19-L22 VanDerWaalsContact O-N 3.08Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 3.1Å; L22-L25 PolarHBondContact O-N 3.18Å; L22-F26 PolarHBondContact O-N 3.31Å |
| 23 | I | 87.3 | Confident | 86.3 | Confident | 53 Ų | 53 | 83.4 Ų | 83.4 | 27% | 0.272 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.3 | -41.6 | 177.2 | -58.9 | 171.4 | 0 | 0 | 0 | 110.9 | P12 A19 A20 V21 L25 F26 P27 F92 | P12-I23 HydrophobicContact CG-CD1 3.63Å; A19-I23 PolarHBondContact O-N 3.45Å; A20-I23 PolarHBondContact O-N 2.96Å; V21-I23 VanDerWaalsContact C-N 3.31Å; V21-I23 PolarHBondContact O-N 3.43Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.38Å; I23-F26 WeakPolarHBondContact O-CB 3.44Å; I23-F26 PolarHBondContact O-N 3.11Å; I23-P27 VanDerWaalsContact O-CD 3.29Å; I23-P27 WeakPolarHBondContact O-CD 2.92Å; I23-F92 HydrophobicContact CD1-CB 4.03Å; I23-F92 HydrophobicContact CD1-CD1 3.89Å; I23-F92 HydrophobicContact CD1-CG 4.34Å; I23-F92 HydrophobicContact CG2-CD1 4.44Å |
| 24 | I | 87.8 | Confident | 86.3 | Confident | 52 Ų | 52 | 80.3 Ų | 80.3 | 27% | 0.267 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.2 | -32.2 | 176.8 | -68.4 | 163.7 | 0 | 0 | 0 | 111.8 | A20 V21 F26 P27 F78 P94 M100 | A20-I24 VanDerWaalsContact O-CG1 3.26Å; A20-I24 WeakPolarHBondContact O-CG1 3.44Å; A20-I24 PolarHBondContact O-N 3.29Å; V21-I24 PolarHBondContact O-N 3.42Å; I24-F26 VanDerWaalsContact C-N 3.34Å; I24-P27 WeakPolarHBondContact O-CD 3.44Å; I24-F78 HydrophobicContact CG2-CZ 4.31Å; I24-P94 HydrophobicContact CD1-CB 4.3Å; I24-P94 HydrophobicContact CG1-CB 3.73Å; I24-P94 HydrophobicContact CG1-CG 4.08Å; I24-M100 HydrophobicContact CD1-SD 4.4Å; I24-M100 HydrophobicContact CG2-CE 4.36Å |
| 25 | L | 86.8 | Confident | 86.3 | Confident | 116 Ų | 116 | 85.1 Ų | 85.1 | 61% | 0.607 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -81.2 | -11 | 178 | -71.3 | 171.8 | 0 | 0 | 0 | 114 | V21 L22 I23 P28 | V21-L25 HydrophobicContact CG1-CD1 4.14Å; V21-L25 WeakPolarHBondContact O-CG 3.46Å; V21-L25 PolarHBondContact O-N 3.02Å; V21-L25 VanDerWaalsContact O-N 3.08Å; L22-L25 PolarHBondContact O-N 3.18Å; I23-L25 VanDerWaalsContact C-N 3.28Å; I23-L25 PolarHBondContact O-N 3.38Å; L25-P28 WeakPolarHBondContact O-CD 3.04Å |
| 26 | F | 88.5 | Confident | 86.4 | Confident | 90 Ų | 90 | 85.5 Ų | 85.5 | 40% | 0.395 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.9 | -44.8 | -177.6 | -168.7 | -99 | 0 | 0 | 0 | 115 | L22 I23 I24 L29 L30 L85 | L22-F26 PolarHBondContact O-N 3.31Å; I23-F26 WeakPolarHBondContact O-CB 3.44Å; I23-F26 PolarHBondContact O-N 3.11Å; I24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 VanDerWaalsContact O-CB 3.3Å; F26-L29 WeakPolarHBondContact O-CB 3.22Å; F26-L29 PolarHBondContact O-N 3.41Å; F26-L30 HydrophobicContact CE1-CD1 4.24Å; F26-L30 HydrophobicContact CE1-CD2 4.13Å; F26-L30 HydrophobicContact CE1-CG 4.27Å; F26-L30 HydrophobicContact CZ-CD2 4.42Å; F26-L85 HydrophobicContact CD1-CD1 4.25Å; F26-L85 HydrophobicContact CD1-CD2 3.71Å; F26-L85 HydrophobicContact CE1-CD2 3.61Å |
| 27 | P | 88.3 | Confident | 86.3 | Confident | 2 Ų | 2 | 90.6 Ų | 90.6 | 1% | 0.013 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -57.1 | -42 | -178.8 | -10.3 | 13.5 | 0 | 0 | 0 | 115.2 | I23 I24 L29 L30 T81 T82 L85 | I23-P27 VanDerWaalsContact O-CD 3.29Å; I23-P27 WeakPolarHBondContact O-CD 2.92Å; I24-P27 WeakPolarHBondContact O-CD 3.44Å; P27-L29 PolarHBondContact O-N 3.39Å; P27-L30 WeakPolarHBondContact O-CB 3.26Å; P27-L30 PolarHBondContact O-N 2.98Å; P27-L30 VanDerWaalsContact O-N 3.07Å; P27-T81 WeakPolarHBondContact CB-OG1 3.49Å; P27-T82 HydrophobicContact CB-CG2 4.18Å; P27-T82 HydrophobicContact CG-CG2 3.38Å; P27-L85 HydrophobicContact CB-CD1 3.86Å; P27-L85 HydrophobicContact CG-CD1 4.01Å |
| 28 | P | 84.4 | Confident | 86.4 | Confident | 71 Ų | 71 | 92 Ų | 92 | 46% | 0.461 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -55.5 | -33.5 | 173.7 | -27.3 | 33 | 0 | 0 | 0 | 114.2 | L25 L30 I31 | L25-P28 WeakPolarHBondContact O-CD 3.04Å; P28-L30 PolarHBondContact O-N 2.85Å; P28-I31 PolarHBondContact O-N 3.05Å |
| 29 | L | 87.6 | Confident | 86.7 | Confident | 136 Ų | 136 | 89.5 Ų | 89.5 | 71% | 0.712 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -67 | -25.3 | 179.4 | -172.2 | 65.4 | 0 | 0 | 0 | 112.5 | F26 P27 I31 | F26-L29 VanDerWaalsContact O-CB 3.3Å; F26-L29 WeakPolarHBondContact O-CB 3.22Å; F26-L29 PolarHBondContact O-N 3.41Å; P27-L29 PolarHBondContact O-N 3.39Å; L29-I31 PolarHBondContact O-N 3.36Å |
| 30 | L | 87.3 | Confident | 86.9 | Confident | 78 Ų | 78 | 94 Ų | 94 | 41% | 0.408 | 49% | 0.491 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.5 | -6 | 178.4 | -63.1 | 178.3 | 0 | 0 | 0 | 113.7 | F26 P27 P28 P32 Q46 L85 | F26-L30 HydrophobicContact CE1-CD1 4.24Å; F26-L30 HydrophobicContact CE1-CD2 4.13Å; F26-L30 HydrophobicContact CE1-CG 4.27Å; F26-L30 HydrophobicContact CZ-CD2 4.42Å; P27-L30 WeakPolarHBondContact O-CB 3.26Å; P27-L30 PolarHBondContact O-N 2.98Å; P27-L30 VanDerWaalsContact O-N 3.07Å; P28-L30 PolarHBondContact O-N 2.85Å; L30-P32 VanDerWaalsContact C-CD 3.41Å; L30-P32 WeakPolarHBondContact O-CD 3.45Å; L30-Q46 PolarHBondContact O-NE2 3.41Å; L30-L85 HydrophobicContact CD1-CD1 3.47Å; L30-L85 VanDerWaalsContact CD1-CD1 3.47Å; L30-L85 HydrophobicContact CD1-CD2 4Å; L30-L85 HydrophobicContact CD1-CG 3.98Å |
| 31 | I | 88 | Confident | 87.2 | Confident | 53 Ų | 53 | 103.1 Ų | 103.1 | 27% | 0.272 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -110.3 | 80.5 | -177.4 | -54 | 158.8 | 0 | 0 | 0 | 108.5 | P28 L29 I77 | P28-I31 PolarHBondContact O-N 3.05Å; L29-I31 PolarHBondContact O-N 3.36Å; I31-I77 HydrophobicContact CD1-CG2 3.33Å; I31-I77 HydrophobicContact CG1-CG2 4.39Å |
| 32 | P | 86.9 | Confident | 87.4 | Confident | 60 Ų | 60 | 103.3 Ų | 103.3 | 39% | 0.39 | 52% | 0.519 | S | S | . | . | trans | -69 | 135.2 | 179.6 | 27.6 | -33.7 | 0 | 0 | 0 | 111 | L30 L42 I43 | L30-P32 VanDerWaalsContact C-CD 3.41Å; L30-P32 WeakPolarHBondContact O-CD 3.45Å; P32-L42 HydrophobicContact CG-CD2 3.62Å; P32-I43 HydrophobicContact CB-CD1 4.42Å; P32-I43 HydrophobicContact CG-CD1 4.38Å; P32-I43 HydrophobicContact CG-CG1 4Å | ||
| 33 | T | 87.1 | Confident | 87.7 | Confident | 138 Ų | 138 | 98.4 Ų | 98.4 | 85% | 0.847 | 49% | 0.493 | S | S | * | . | trans | -99.2 | 132 | 171.6 | 59.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 34 | S | 87.5 | Confident | 87.9 | Confident | 37 Ų | 37 | 98.9 Ų | 98.9 | 26% | 0.259 | 50% | 0.498 | S | S | . | . | trans | -110.4 | 145.9 | 171.3 | 170.4 | 0 | 0 | 0 | 0 | 111 | Y36 N39 | S34-Y36 PolarHBondContact OG-N 2.95Å; S34-N39 WeakPolarHBondContact CB-OD1 3.27Å; S34-N39 PolarHBondContact OG-OD1 3.37Å | ||
| 35 | K | 86.2 | Confident | 88.1 | Confident | 211 Ų | 211 | 100.5 Ų | 100.5 | 92% | 0.917 | 51% | 0.511 | S | S | * | . | trans | -86.9 | -13.5 | 173.6 | -63.1 | -178.8 | -178.9 | 178.3 | 0 | 113.1 | ||||
| 36 | Y | 87.4 | Confident | 88.3 | Confident | 182 Ų | 182 | 97.1 Ų | 97.1 | 71% | 0.714 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -81.6 | 154.3 | -175.4 | -59.5 | -74.4 | 0 | 0 | 0 | 112.1 | S34 N39 | S34-Y36 PolarHBondContact OG-N 2.95Å; Y36-N39 PolarHBondContact O-ND2 3.14Å; Y36-N39 PolarHBondContact O-OD1 2.95Å |
| 37 | L | 80.7 | Confident | 88.4 | Confident | 177 Ų | 177 | 97.5 Ų | 97.5 | 93% | 0.927 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -72.2 | -40.7 | 176.3 | -171.3 | 74.4 | 0 | 0 | 0 | 111.4 | ||
| 38 | I | 87.3 | Confident | 88.6 | Confident | 156 Ų | 156 | 105.5 Ų | 105.5 | 80% | 0.8 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -100.7 | 112.3 | 175.2 | -58.9 | 170.7 | 0 | 0 | 0 | 107.4 | ||
| 39 | N | 89.8 | Confident | 88.9 | Confident | 24 Ų | 24 | 106.8 Ų | 106.8 | 13% | 0.128 | 53% | 0.527 | C | S | . | . | trans | -108.5 | 167.7 | -173.9 | -71.4 | -24 | 0 | 0 | 0 | 112.5 | S34 Y36 I43 T44 Q47 | S34-N39 WeakPolarHBondContact CB-OD1 3.27Å; S34-N39 PolarHBondContact OG-OD1 3.37Å; Y36-N39 PolarHBondContact O-ND2 3.14Å; Y36-N39 PolarHBondContact O-OD1 2.95Å; N39-I43 HydrophobicContact CB-CB 3.89Å; N39-I43 HydrophobicContact CB-CG2 3.75Å; N39-T44 HydrophobicContact CB-CG2 4.1Å; N39-Q47 PolarHBondContact ND2-NE2 2.83Å | ||
| 40 | N | 90.8 | Very high | 89.1 | Confident | 114 Ų | 114 | 103.1 Ų | 103.1 | 61% | 0.61 | 51% | 0.508 | S | S | * | . | trans | -62 | 152.9 | 172.3 | -166 | 0.6 | 0 | 0 | 0 | 111 | L42 I43 T44 | N40-L42 PolarHBondContact O-N 3.47Å; N40-L42 VanDerWaalsContact O-N 3.11Å; N40-I43 PolarHBondContact O-N 3.28Å; N40-T44 PolarHBondContact O-N 3.05Å | ||
| 41 | R | 90.1 | Very high | 89.3 | Confident | 210 Ų | 210 | 106.7 Ų | 106.7 | 79% | 0.792 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -52 | -36.2 | -178.5 | -63.6 | -178.3 | -179.4 | -179.6 | 0.3 | 113.2 | T44 T45 | R41-T44 WeakPolarHBondContact CA-OG1 3.42Å; R41-T44 PolarHBondContact O-OG1 2.98Å; R41-T45 VanDerWaalsContact O-CG2 3.32Å; R41-T45 WeakPolarHBondContact O-CG2 3.12Å; R41-T45 PolarHBondContact O-N 3.33Å; R41-T45 PolarHBondContact O-OG1 2.93Å |
| 42 | L | 90.3 | Very high | 89.5 | Confident | 86 Ų | 86 | 107.3 Ų | 107.3 | 45% | 0.45 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.6 | -44 | 177.2 | -173.9 | 152.3 | 0 | 0 | 0 | 111.4 | P32 N40 T45 Q46 | P32-L42 HydrophobicContact CG-CD2 3.62Å; N40-L42 PolarHBondContact O-N 3.47Å; N40-L42 VanDerWaalsContact O-N 3.11Å; L42-T45 PolarHBondContact O-OG1 2.99Å; L42-Q46 VanDerWaalsContact CD2-CD 3.44Å; L42-Q46 HydrophobicContact CD2-CG 4.3Å; L42-Q46 WeakPolarHBondContact O-CB 3.33Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.41Å; L42-Q46 PolarHBondContact O-N 3.45Å |
| 43 | I | 92 | Very high | 89.5 | Confident | 20 Ų | 20 | 105.6 Ų | 105.6 | 10% | 0.103 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -70.7 | -37.3 | 179.7 | -60.8 | 175.4 | 0 | 0 | 0 | 110.5 | P32 N39 N40 Q46 Q47 | P32-I43 HydrophobicContact CB-CD1 4.42Å; P32-I43 HydrophobicContact CG-CD1 4.38Å; P32-I43 HydrophobicContact CG-CG1 4Å; N39-I43 HydrophobicContact CB-CB 3.89Å; N39-I43 HydrophobicContact CB-CG2 3.75Å; N40-I43 PolarHBondContact O-N 3.28Å; I43-Q46 PolarHBondContact O-N 3.28Å; I43-Q47 HydrophobicContact CG2-CG 4.27Å; I43-Q47 WeakPolarHBondContact O-CB 3.3Å; I43-Q47 VanDerWaalsContact O-CG 3.25Å; I43-Q47 WeakPolarHBondContact O-CG 3.33Å; I43-Q47 PolarHBondContact O-N 3.34Å |
| 44 | T | 92 | Very high | 89.7 | Confident | 63 Ų | 63 | 100.6 Ų | 100.6 | 39% | 0.387 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67 | -41.3 | 177.8 | 59 | 0 | 0 | 0 | 0 | 112 | N39 N40 R41 Q47 W48 | N39-T44 HydrophobicContact CB-CG2 4.1Å; N40-T44 PolarHBondContact O-N 3.05Å; R41-T44 WeakPolarHBondContact CA-OG1 3.42Å; R41-T44 PolarHBondContact O-OG1 2.98Å; T44-Q47 PolarHBondContact O-N 3.43Å; T44-W48 VanDerWaalsContact O-CB 3.32Å; T44-W48 WeakPolarHBondContact O-CB 3.19Å; T44-W48 PolarHBondContact O-N 3.29Å |
| 45 | T | 91.5 | Very high | 89.7 | Confident | 87 Ų | 87 | 106 Ų | 106 | 53% | 0.534 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.9 | -40.7 | 174.7 | 50.3 | 0 | 0 | 0 | 0 | 111.8 | R41 L42 W48 L49 | R41-T45 VanDerWaalsContact O-CG2 3.32Å; R41-T45 WeakPolarHBondContact O-CG2 3.12Å; R41-T45 PolarHBondContact O-N 3.33Å; R41-T45 PolarHBondContact O-OG1 2.93Å; L42-T45 PolarHBondContact O-OG1 2.99Å; T45-W48 PolarHBondContact O-N 2.97Å; T45-L49 WeakPolarHBondContact O-CB 3.35Å; T45-L49 PolarHBondContact O-N 3.44Å |
| 46 | Q | 91.3 | Very high | 89.8 | Confident | 45 Ų | 45 | 102 Ų | 102 | 21% | 0.21 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -60.5 | -50.5 | 172.7 | -76.1 | 176.5 | -18.1 | 0 | 0 | 112.1 | L30 L42 I43 W48 L49 I50 | L30-Q46 PolarHBondContact O-NE2 3.41Å; L42-Q46 VanDerWaalsContact CD2-CD 3.44Å; L42-Q46 HydrophobicContact CD2-CG 4.3Å; L42-Q46 WeakPolarHBondContact O-CB 3.33Å; L42-Q46 VanDerWaalsContact O-CG 3.25Å; L42-Q46 WeakPolarHBondContact O-CG 3.41Å; L42-Q46 PolarHBondContact O-N 3.45Å; I43-Q46 PolarHBondContact O-N 3.28Å; Q46-W48 VanDerWaalsContact C-N 3.28Å; Q46-W48 PolarHBondContact O-N 3.09Å; Q46-L49 PolarHBondContact O-N 3.16Å; Q46-I50 VanDerWaalsContact O-CG1 3.24Å; Q46-I50 WeakPolarHBondContact O-CG1 3.39Å; Q46-I50 PolarHBondContact O-N 3.3Å |
| 47 | Q | 90.6 | Very high | 89.7 | Confident | 97 Ų | 97 | 94.1 Ų | 94.1 | 45% | 0.453 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.3 | -38.6 | 178.2 | -74.8 | 176 | -13.8 | 0 | 0 | 112.1 | N39 I43 T44 K51 | N39-Q47 PolarHBondContact ND2-NE2 2.83Å; I43-Q47 HydrophobicContact CG2-CG 4.27Å; I43-Q47 WeakPolarHBondContact O-CB 3.3Å; I43-Q47 VanDerWaalsContact O-CG 3.25Å; I43-Q47 WeakPolarHBondContact O-CG 3.33Å; I43-Q47 PolarHBondContact O-N 3.34Å; T44-Q47 PolarHBondContact O-N 3.43Å; Q47-K51 WeakPolarHBondContact O-CB 3.31Å; Q47-K51 PolarHBondContact O-N 2.96Å |
| 48 | W | 92.6 | Very high | 89.9 | Confident | 171 Ų | 171 | 86.7 Ų | 86.7 | 65% | 0.648 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -64.2 | -45 | 175.6 | -177.6 | 81.9 | 0 | 0 | 0 | 111.9 | T44 T45 Q46 K51 L52 | T44-W48 VanDerWaalsContact O-CB 3.32Å; T44-W48 WeakPolarHBondContact O-CB 3.19Å; T44-W48 PolarHBondContact O-N 3.29Å; T45-W48 PolarHBondContact O-N 2.97Å; Q46-W48 VanDerWaalsContact C-N 3.28Å; Q46-W48 PolarHBondContact O-N 3.09Å; W48-K51 PolarHBondContact O-N 2.93Å; W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.36Å; W48-L52 HydrophobicContact CE3-CD1 3.73Å; W48-L52 HydrophobicContact CH2-CD1 3.4Å; W48-L52 HydrophobicContact CZ2-CD1 3.4Å; W48-L52 VanDerWaalsContact CZ2-CD1 3.4Å; W48-L52 HydrophobicContact CZ2-CG 4.42Å; W48-L52 HydrophobicContact CZ3-CD1 3.55Å; W48-L52 WeakPolarHBondContact O-CG 3.4Å; W48-L52 PolarHBondContact O-N 2.83Å |
| 49 | L | 91.1 | Very high | 89.8 | Confident | 97 Ų | 97 | 84 Ų | 84 | 51% | 0.508 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 177.9 | -162.2 | 154.7 | 0 | 0 | 0 | 111.6 | T45 Q46 K51 L52 T53 | T45-L49 WeakPolarHBondContact O-CB 3.35Å; T45-L49 PolarHBondContact O-N 3.44Å; Q46-L49 PolarHBondContact O-N 3.16Å; L49-K51 VanDerWaalsContact C-N 3.34Å; L49-K51 PolarHBondContact O-N 2.99Å; L49-L52 PolarHBondContact O-N 3.44Å; L49-T53 HydrophobicContact CD2-CG2 3.95Å; L49-T53 WeakPolarHBondContact O-CG2 3.3Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.43Å |
| 50 | I | 91.4 | Very high | 89.2 | Confident | 60 Ų | 60 | 86.6 Ų | 86.6 | 31% | 0.308 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -60.2 | -44.8 | 175.1 | -67 | 169.7 | 0 | 0 | 0 | 110.7 | Q46 L52 T53 S54 V73 I77 | Q46-I50 VanDerWaalsContact O-CG1 3.24Å; Q46-I50 WeakPolarHBondContact O-CG1 3.39Å; Q46-I50 PolarHBondContact O-N 3.3Å; I50-L52 PolarHBondContact O-N 3.02Å; I50-T53 WeakPolarHBondContact CA-OG1 3.35Å; I50-T53 PolarHBondContact O-OG1 3.48Å; I50-S54 VanDerWaalsContact O-CB 3.29Å; I50-S54 WeakPolarHBondContact O-CB 3.43Å; I50-S54 PolarHBondContact O-N 2.86Å; I50-S54 PolarHBondContact O-OG 3.14Å; I50-V73 HydrophobicContact CG2-CG1 3.84Å; I50-I77 HydrophobicContact CD1-CD1 4.02Å; I50-I77 HydrophobicContact CG1-CD1 3.73Å |
| 51 | K | 91.2 | Very high | 88.8 | Confident | 152 Ų | 152 | 81.4 Ų | 81.4 | 66% | 0.661 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -64.5 | -39.5 | 179.3 | -175.1 | 177.7 | -178.8 | 178.6 | 0 | 112.5 | Q47 W48 L49 S54 K55 | Q47-K51 WeakPolarHBondContact O-CB 3.31Å; Q47-K51 PolarHBondContact O-N 2.96Å; W48-K51 PolarHBondContact O-N 2.93Å; L49-K51 VanDerWaalsContact C-N 3.34Å; L49-K51 PolarHBondContact O-N 2.99Å; K51-S54 PolarHBondContact O-OG 3.47Å; K51-S54 VanDerWaalsContact O-OG 3.08Å; K51-K55 VanDerWaalsContact O-CB 3.22Å; K51-K55 WeakPolarHBondContact O-CB 3.24Å; K51-K55 PolarHBondContact O-N 3.27Å |
| 52 | L | 91.4 | Very high | 88.4 | Confident | 67 Ų | 67 | 76.3 Ų | 76.3 | 35% | 0.351 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.9 | -51.1 | 178 | -75.6 | 178.4 | 0 | 0 | 0 | 111.7 | W48 L49 I50 S54 K55 Q56 | W48-L52 HydrophobicContact CD2-CD1 3.74Å; W48-L52 HydrophobicContact CD2-CG 4.36Å; W48-L52 HydrophobicContact CE3-CD1 3.73Å; W48-L52 HydrophobicContact CH2-CD1 3.4Å; W48-L52 HydrophobicContact CZ2-CD1 3.4Å; W48-L52 VanDerWaalsContact CZ2-CD1 3.4Å; W48-L52 HydrophobicContact CZ2-CG 4.42Å; W48-L52 HydrophobicContact CZ3-CD1 3.55Å; W48-L52 WeakPolarHBondContact O-CG 3.4Å; W48-L52 PolarHBondContact O-N 2.83Å; L49-L52 PolarHBondContact O-N 3.44Å; I50-L52 PolarHBondContact O-N 3.02Å; L52-S54 PolarHBondContact O-N 3.07Å; L52-K55 PolarHBondContact O-N 3.34Å; L52-Q56 WeakPolarHBondContact O-CG 3.32Å; L52-Q56 PolarHBondContact O-N 3.11Å |
| 53 | T | 88.4 | Confident | 87.8 | Confident | 23 Ų | 23 | 77.7 Ų | 77.7 | 14% | 0.141 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -61.2 | -45.4 | 179.6 | 50.5 | 0 | 0 | 0 | 0 | 111.1 | L49 I50 K55 Q56 M57 | L49-T53 HydrophobicContact CD2-CG2 3.95Å; L49-T53 WeakPolarHBondContact O-CG2 3.3Å; L49-T53 PolarHBondContact O-N 3.35Å; L49-T53 PolarHBondContact O-OG1 3.43Å; I50-T53 WeakPolarHBondContact CA-OG1 3.35Å; I50-T53 PolarHBondContact O-OG1 3.48Å; T53-K55 VanDerWaalsContact C-N 3.34Å; T53-K55 PolarHBondContact O-N 3.24Å; T53-Q56 PolarHBondContact O-N 3.17Å; T53-M57 WeakPolarHBondContact O-CB 3.38Å; T53-M57 VanDerWaalsContact O-CG 3.25Å; T53-M57 WeakPolarHBondContact O-CG 3.48Å; T53-M57 PolarHBondContact O-N 3.29Å |
| 54 | S | 89.4 | Confident | 87.2 | Confident | 33 Ų | 33 | 82.5 Ų | 82.5 | 23% | 0.231 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -61.2 | -43 | 175.9 | 72.6 | 0 | 0 | 0 | 0 | 111.5 | I50 K51 L52 M58 | I50-S54 VanDerWaalsContact O-CB 3.29Å; I50-S54 WeakPolarHBondContact O-CB 3.43Å; I50-S54 PolarHBondContact O-N 2.86Å; I50-S54 PolarHBondContact O-OG 3.14Å; K51-S54 PolarHBondContact O-OG 3.47Å; K51-S54 VanDerWaalsContact O-OG 3.08Å; L52-S54 PolarHBondContact O-N 3.07Å; S54-M58 VanDerWaalsContact O-CB 3.23Å; S54-M58 WeakPolarHBondContact O-CB 3.41Å; S54-M58 PolarHBondContact O-N 2.81Å |
| 55 | K | 89.1 | Confident | 86.6 | Confident | 151 Ų | 151 | 79.5 Ų | 79.5 | 66% | 0.657 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -63 | -46.2 | 179.9 | -176.1 | -180 | 178.1 | -175.3 | 0 | 111.3 | K51 L52 T53 T59 | K51-K55 VanDerWaalsContact O-CB 3.22Å; K51-K55 WeakPolarHBondContact O-CB 3.24Å; K51-K55 PolarHBondContact O-N 3.27Å; L52-K55 PolarHBondContact O-N 3.34Å; T53-K55 VanDerWaalsContact C-N 3.34Å; T53-K55 PolarHBondContact O-N 3.24Å; K55-T59 WeakPolarHBondContact O-CG2 3.39Å; K55-T59 PolarHBondContact O-N 3.4Å |
| 56 | Q | 86.9 | Confident | 86.2 | Confident | 127 Ų | 127 | 81.7 Ų | 81.7 | 59% | 0.593 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -66.8 | -41.6 | -179.5 | -73.6 | 179.7 | -30.8 | 0 | 0 | 112.5 | L52 T53 T59 | L52-Q56 WeakPolarHBondContact O-CG 3.32Å; L52-Q56 PolarHBondContact O-N 3.11Å; T53-Q56 PolarHBondContact O-N 3.17Å; Q56-T59 PolarHBondContact O-OG1 3.21Å |
| 57 | M | 84.8 | Confident | 85.9 | Confident | 16 Ų | 16 | 84.4 Ų | 84.4 | 8% | 0.079 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -68.4 | -36.9 | 178.3 | -68.1 | -119.8 | 164.5 | 0 | 0 | 111.9 | T53 T60 H61 I76 Y212 T215 | T53-M57 WeakPolarHBondContact O-CB 3.38Å; T53-M57 VanDerWaalsContact O-CG 3.25Å; T53-M57 WeakPolarHBondContact O-CG 3.48Å; T53-M57 PolarHBondContact O-N 3.29Å; M57-T60 PolarHBondContact O-OG1 2.78Å; M57-H61 PolarHBondContact O-CD2 3.18Å; M57-I76 HydrophobicContact CE-CD1 4.03Å; M57-Y212 HydrophobicContact CE-CD2 3.92Å; M57-Y212 HydrophobicContact CE-CE2 3.89Å; M57-T215 VanDerWaalsContact CE-OG1 3.23Å; M57-T215 WeakPolarHBondContact CE-OG1 3.32Å |
| 58 | M | 85.6 | Confident | 85.7 | Confident | 22 Ų | 22 | 82.2 Ų | 82.2 | 11% | 0.108 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -83.5 | -10.8 | -172.4 | -140.3 | 59.6 | 48.1 | 0 | 0 | 115.1 | S54 T60 H61 R66 S69 | S54-M58 VanDerWaalsContact O-CB 3.23Å; S54-M58 WeakPolarHBondContact O-CB 3.41Å; S54-M58 PolarHBondContact O-N 2.81Å; M58-T60 PolarHBondContact O-N 3.11Å; M58-H61 PolarHBondContact O-N 3.13Å; M58-H61 HydrophobicContact SD-CB 4.24Å; M58-R66 HydrophobicContact CG-CB 4.17Å; M58-R66 HydrophobicContact CG-CG 3.59Å; M58-R66 VanDerWaalsContact SD-CA 3.57Å; M58-R66 HydrophobicContact SD-CB 3.91Å; M58-R66 HydrophobicContact SD-CG 3.77Å; M58-S69 WeakPolarHBondContact CE-OG 3.4Å |
| 59 | T | 84.7 | Confident | 85.5 | Confident | 99 Ų | 99 | 75.7 Ų | 75.7 | 61% | 0.607 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64 | -31.5 | -179 | 53.6 | 0 | 0 | 0 | 0 | 112.2 | K55 Q56 | K55-T59 WeakPolarHBondContact O-CG2 3.39Å; K55-T59 PolarHBondContact O-N 3.4Å; Q56-T59 PolarHBondContact O-OG1 3.21Å |
| 60 | T | 78.9 | Confident | 85.5 | Confident | 79 Ų | 79 | 77.9 Ų | 77.9 | 49% | 0.485 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.3 | -9.5 | -178.6 | 58.6 | 0 | 0 | 0 | 0 | 113.2 | M57 M58 H223 | M57-T60 PolarHBondContact O-OG1 2.78Å; M58-T60 PolarHBondContact O-N 3.11Å; T60-H223 PolarHBondContact O-CE1 3.29Å; T60-H223 PolarHBondContact O-ND1 3.49Å |
| 61 | H | 82.1 | Confident | 85.4 | Confident | 5 Ų | 5 | 78.1 Ų | 78.1 | 2% | 0.023 | 40% | 0.397 | C | S | . | . | trans | -102.8 | 137.7 | -169.8 | -81 | -67.1 | 0 | 0 | 0 | 114.9 | M57 M58 R66 S219 | M57-H61 PolarHBondContact O-CD2 3.18Å; M58-H61 PolarHBondContact O-N 3.13Å; M58-H61 HydrophobicContact SD-CB 4.24Å; H61-R66 HydrophobicContact CB-CG 4.38Å; H61-R66 PolarHBondContact O-NE 2.91Å; H61-S219 PolarHBondContact CE1-O 2.98Å; H61-S219 PolarHBondContact NE2-O 3.13Å; H61-S219 PolarHBondContact NE2-OG 3.07Å | ||
| 62 | N | 80 | Confident | 85.4 | Confident | 103 Ų | 103 | 71 Ų | 71 | 55% | 0.551 | 37% | 0.367 | S | S | * | . | trans | -70.9 | 165.2 | 167.8 | -80.8 | -21 | 0 | 0 | 0 | 112 | K64 G65 R66 | N62-K64 VanDerWaalsContact C-N 3.25Å; N62-K64 PolarHBondContact O-N 3.23Å; N62-K64 VanDerWaalsContact O-N 3.11Å; N62-G65 WeakPolarHBondContact O-CA 3.01Å; N62-G65 PolarHBondContact O-N 2.95Å; N62-R66 WeakPolarHBondContact O-CG 3.49Å; N62-R66 PolarHBondContact O-N 3.36Å | ||
| 63 | T | 79.7 | Confident | 85.4 | Confident | 115 Ų | 115 | 68.7 Ų | 68.7 | 71% | 0.706 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.2 | -37.2 | -174.8 | 54.2 | 0 | 0 | 0 | 0 | 114.3 | R66 | T63-R66 PolarHBondContact O-N 2.78Š|
| 64 | K | 78.8 | Confident | 85.5 | Confident | 120 Ų | 120 | 70.7 Ų | 70.7 | 52% | 0.522 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.1 | -44.8 | 174.2 | -69 | -177.6 | -178.6 | 175.7 | 0 | 112.3 | N62 R66 T67 | N62-K64 VanDerWaalsContact C-N 3.25Å; N62-K64 PolarHBondContact O-N 3.23Å; N62-K64 VanDerWaalsContact O-N 3.11Å; K64-R66 PolarHBondContact O-N 3.45Å; K64-T67 WeakPolarHBondContact O-CB 3.17Å; K64-T67 PolarHBondContact O-N 2.78Å; K64-T67 PolarHBondContact O-OG1 3.08Å |
| 65 | G | 78.1 | Confident | 85.6 | Confident | 0 Ų | 0 | 70 Ų | 70 | 0% | 0 | 36% | 0.364 | C | S | . | . | G | 310 helix | trans | -62.3 | -31.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | N62 T67 W68 | N62-G65 WeakPolarHBondContact O-CA 3.01Å; N62-G65 PolarHBondContact O-N 2.95Å; G65-T67 PolarHBondContact O-N 3.17Å; G65-T67 VanDerWaalsContact O-N 3.13Å; G65-W68 PolarHBondContact O-N 3.39Å |
| 66 | R | 83.3 | Confident | 85.7 | Confident | 133 Ų | 133 | 63.8 Ų | 63.8 | 50% | 0.502 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | -62.6 | -21.2 | 176.9 | -56.9 | -161.9 | 178 | 167.3 | -2.9 | 114.6 | M58 H61 N62 T63 K64 W68 S69 | M58-R66 HydrophobicContact CG-CB 4.17Å; M58-R66 HydrophobicContact CG-CG 3.59Å; M58-R66 VanDerWaalsContact SD-CA 3.57Å; M58-R66 HydrophobicContact SD-CB 3.91Å; M58-R66 HydrophobicContact SD-CG 3.77Å; H61-R66 HydrophobicContact CB-CG 4.38Å; H61-R66 PolarHBondContact O-NE 2.91Å; N62-R66 WeakPolarHBondContact O-CG 3.49Å; N62-R66 PolarHBondContact O-N 3.36Å; T63-R66 PolarHBondContact O-N 2.78Å; K64-R66 PolarHBondContact O-N 3.45Å; R66-W68 PolarHBondContact O-N 3.06Å; R66-S69 WeakPolarHBondContact O-CB 3.2Å; R66-S69 PolarHBondContact O-N 3.33Å; R66-S69 VanDerWaalsContact O-N 3.13Å |
| 67 | T | 86.3 | Confident | 85.9 | Confident | 103 Ų | 103 | 59.4 Ų | 59.4 | 63% | 0.632 | 32% | 0.318 | S | S | * | . | G | 310 helix | trans | -64.4 | -25.7 | 175.3 | 62.8 | 0 | 0 | 0 | 0 | 112.4 | K64 G65 S69 | K64-T67 WeakPolarHBondContact O-CB 3.17Å; K64-T67 PolarHBondContact O-N 2.78Å; K64-T67 PolarHBondContact O-OG1 3.08Å; G65-T67 PolarHBondContact O-N 3.17Å; G65-T67 VanDerWaalsContact O-N 3.13Å; T67-S69 VanDerWaalsContact C-N 3.27Å; T67-S69 PolarHBondContact O-N 3.37Å |
| 68 | W | 86.6 | Confident | 86.1 | Confident | 50 Ų | 50 | 60.9 Ų | 60.9 | 19% | 0.189 | 32% | 0.324 | C | S | . | . | G | 310 helix | trans | -84.6 | 1.2 | 177.6 | -74.2 | 53.2 | 0 | 0 | 0 | 113.4 | G65 R66 L70 M71 L72 M115 L222 | G65-W68 PolarHBondContact O-N 3.39Å; R66-W68 PolarHBondContact O-N 3.06Å; W68-L70 VanDerWaalsContact C-N 3.3Å; W68-L70 PolarHBondContact O-N 3.34Å; W68-M71 HydrophobicContact CD2-CE 3.95Å; W68-M71 HydrophobicContact CE3-CE 3.03Å; W68-M71 HydrophobicContact CH2-CE 4.08Å; W68-M71 HydrophobicContact CZ3-CE 3.12Å; W68-M71 HydrophobicContact CZ3-SD 4.46Å; W68-M71 PolarHBondContact O-N 3.48Å; W68-L72 PolarHBondContact O-N 2.93Å; W68-M115 HydrophobicContact CZ2-SD 3.93Å; W68-M115 PolarHBondContact NE1-SD 3.27Å; W68-L222 HydrophobicContact CB-CD2 3.58Å; W68-L222 HydrophobicContact CD2-CD1 3.48Å; W68-L222 VanDerWaalsContact CD2-CD1 3.48Å; W68-L222 HydrophobicContact CD2-CD2 4.22Å; W68-L222 HydrophobicContact CE3-CD1 3.55Å; W68-L222 HydrophobicContact CE3-CD2 4.49Å; W68-L222 HydrophobicContact CG-CD1 3.85Å; W68-L222 HydrophobicContact CG-CD2 3.77Å; W68-L222 HydrophobicContact CG-CG 4.48Å; W68-L222 HydrophobicContact CZ2-CD1 4.4Å; W68-L222 HydrophobicContact CZ3-CD1 4.08Å |
| 69 | S | 87.5 | Confident | 86.4 | Confident | 34 Ų | 34 | 59.9 Ų | 59.9 | 24% | 0.238 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -50.9 | -48.4 | -179.6 | 174 | 0 | 0 | 0 | 0 | 113.2 | M58 R66 T67 M71 L72 V73 | M58-S69 WeakPolarHBondContact CE-OG 3.4Å; R66-S69 WeakPolarHBondContact O-CB 3.2Å; R66-S69 PolarHBondContact O-N 3.33Å; R66-S69 VanDerWaalsContact O-N 3.13Å; T67-S69 VanDerWaalsContact C-N 3.27Å; T67-S69 PolarHBondContact O-N 3.37Å; S69-M71 PolarHBondContact O-N 3.41Å; S69-L72 PolarHBondContact O-N 2.88Å; S69-V73 WeakPolarHBondContact O-CB 3.44Å; S69-V73 VanDerWaalsContact O-CG2 3.27Å; S69-V73 WeakPolarHBondContact O-CG2 3.22Å; S69-V73 PolarHBondContact O-N 3.05Å |
| 70 | L | 90.9 | Very high | 86.6 | Confident | 144 Ų | 144 | 56.6 Ų | 56.6 | 75% | 0.754 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -59.1 | -41.3 | -178.3 | -175.3 | 70.1 | 0 | 0 | 0 | 111.3 | W68 S74 | W68-L70 VanDerWaalsContact C-N 3.3Å; W68-L70 PolarHBondContact O-N 3.34Å; L70-S74 WeakPolarHBondContact O-CB 3.37Å; L70-S74 PolarHBondContact O-N 3.21Å; L70-S74 PolarHBondContact O-OG 3.35Å |
| 71 | M | 90.8 | Very high | 87.2 | Confident | 64 Ų | 64 | 54.3 Ų | 54.3 | 32% | 0.315 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -72.4 | -41.6 | -178 | -167.1 | 178.5 | 69.2 | 0 | 0 | 112.1 | W68 S69 V73 S74 L75 L108 | W68-M71 HydrophobicContact CD2-CE 3.95Å; W68-M71 HydrophobicContact CE3-CE 3.03Å; W68-M71 HydrophobicContact CH2-CE 4.08Å; W68-M71 HydrophobicContact CZ3-CE 3.12Å; W68-M71 HydrophobicContact CZ3-SD 4.46Å; W68-M71 PolarHBondContact O-N 3.48Å; S69-M71 PolarHBondContact O-N 3.41Å; M71-V73 VanDerWaalsContact C-N 3.32Å; M71-V73 PolarHBondContact O-N 2.64Å; M71-S74 PolarHBondContact O-N 3.13Å; M71-S74 PolarHBondContact O-OG 2.87Å; M71-L75 WeakPolarHBondContact O-CB 3.21Å; M71-L75 PolarHBondContact O-N 3.38Å; M71-L108 HydrophobicContact CE-CD2 3.28Å; M71-L108 HydrophobicContact CG-CD2 4.2Å; M71-L108 HydrophobicContact SD-CD2 3.5Å; M71-L108 WeakPolarHBondContact SD-CD2 3.32Å |
| 72 | L | 90.1 | Very high | 87.6 | Confident | 3 Ų | 3 | 54.3 Ų | 54.3 | 2% | 0.016 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -63.9 | -40.7 | 176.9 | -68.3 | 172.9 | 0 | 0 | 0 | 111.5 | W68 S69 L75 I76 V218 | W68-L72 PolarHBondContact O-N 2.93Å; S69-L72 PolarHBondContact O-N 2.88Å; L72-L75 PolarHBondContact O-N 3.48Å; L72-I76 PolarHBondContact O-N 3.3Å; L72-V218 HydrophobicContact CD2-CB 4.25Å; L72-V218 HydrophobicContact CD2-CG1 3.88Å |
| 73 | V | 91.2 | Very high | 88.1 | Confident | 18 Ų | 18 | 49.5 Ų | 49.5 | 11% | 0.109 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -69.9 | -42.6 | 178.4 | 173 | 0 | 0 | 0 | 0 | 111.5 | I50 S69 M71 L75 I76 I77 | I50-V73 HydrophobicContact CG2-CG1 3.84Å; S69-V73 WeakPolarHBondContact O-CB 3.44Å; S69-V73 VanDerWaalsContact O-CG2 3.27Å; S69-V73 WeakPolarHBondContact O-CG2 3.22Å; S69-V73 PolarHBondContact O-N 3.05Å; M71-V73 VanDerWaalsContact C-N 3.32Å; M71-V73 PolarHBondContact O-N 2.64Å; V73-L75 VanDerWaalsContact C-N 3.28Å; V73-L75 PolarHBondContact O-N 2.96Å; V73-I76 VanDerWaalsContact O-CG2 3.31Å; V73-I76 WeakPolarHBondContact O-CG2 3.41Å; V73-I77 HydrophobicContact CG1-CD1 3.79Å; V73-I77 VanDerWaalsContact O-CD1 3.27Å; V73-I77 WeakPolarHBondContact O-CD1 3.19Å; V73-I77 WeakPolarHBondContact O-CG1 3.38Å; V73-I77 PolarHBondContact O-N 3.44Å |
| 74 | S | 91.3 | Very high | 88.5 | Confident | 66 Ų | 66 | 48.9 Ų | 48.9 | 46% | 0.462 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.2 | -38.3 | 176.3 | 65.3 | 0 | 0 | 0 | 0 | 111.6 | L70 M71 F78 | L70-S74 WeakPolarHBondContact O-CB 3.37Å; L70-S74 PolarHBondContact O-N 3.21Å; L70-S74 PolarHBondContact O-OG 3.35Å; M71-S74 PolarHBondContact O-N 3.13Å; M71-S74 PolarHBondContact O-OG 2.87Å; S74-F78 VanDerWaalsContact O-CB 3.3Å; S74-F78 WeakPolarHBondContact O-CB 3.38Å; S74-F78 PolarHBondContact O-N 3.13Å |
| 75 | L | 90.4 | Very high | 89.1 | Confident | 18 Ų | 18 | 44.9 Ų | 44.9 | 9% | 0.094 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.9 | -47.8 | 179.4 | -170.5 | 95.7 | 0 | 0 | 0 | 112.6 | M71 L72 V73 I77 F78 I79 L108 F214 T215 | M71-L75 WeakPolarHBondContact O-CB 3.21Å; M71-L75 PolarHBondContact O-N 3.38Å; L72-L75 PolarHBondContact O-N 3.48Å; V73-L75 VanDerWaalsContact C-N 3.28Å; V73-L75 PolarHBondContact O-N 2.96Å; L75-I77 VanDerWaalsContact C-N 3.29Å; L75-I77 PolarHBondContact O-N 3.37Å; L75-F78 PolarHBondContact O-N 3.31Å; L75-I79 HydrophobicContact CD1-CD1 4.39Å; L75-I79 HydrophobicContact CD2-CD1 4.08Å; L75-I79 HydrophobicContact CG-CD1 3.86Å; L75-I79 WeakPolarHBondContact O-CG1 3.5Å; L75-I79 PolarHBondContact O-N 3.36Å; L75-L108 HydrophobicContact CD1-CD1 3.35Å; L75-L108 HydrophobicContact CD2-CD1 4.04Å; L75-L108 HydrophobicContact CG-CD1 4.35Å; L75-F214 HydrophobicContact CD1-CE1 4.36Å; L75-F214 HydrophobicContact CD2-CD1 3.56Å; L75-F214 HydrophobicContact CD2-CE1 3.48Å; L75-F214 VanDerWaalsContact CD2-CE1 3.48Å; L75-F214 HydrophobicContact CG-CE1 4.34Å; L75-T215 HydrophobicContact CB-CG2 4.31Å; L75-T215 HydrophobicContact CD2-CG2 3.41Å; L75-T215 VanDerWaalsContact CD2-CG2 3.41Å; L75-T215 HydrophobicContact CG-CG2 4.1Å |
| 76 | I | 90.9 | Very high | 89.4 | Confident | 20 Ų | 20 | 44.9 Ų | 44.9 | 10% | 0.103 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.7 | -40.7 | -179.9 | -166.8 | 170.3 | 0 | 0 | 0 | 111 | M57 L72 V73 A80 A211 Y212 T215 | M57-I76 HydrophobicContact CE-CD1 4.03Å; L72-I76 PolarHBondContact O-N 3.3Å; V73-I76 VanDerWaalsContact O-CG2 3.31Å; V73-I76 WeakPolarHBondContact O-CG2 3.41Å; I76-A80 WeakPolarHBondContact O-CB 3.06Å; I76-A80 PolarHBondContact O-N 3.26Å; I76-A211 HydrophobicContact CG1-CB 4.47Å; I76-Y212 HydrophobicContact CD1-CD2 4.21Å; I76-T215 VanDerWaalsContact CA-CG2 3.46Å; I76-T215 HydrophobicContact CB-CG2 3.46Å; I76-T215 VanDerWaalsContact CB-CG2 3.46Å; I76-T215 HydrophobicContact CG1-CG2 3.98Å |
| 77 | I | 91.3 | Very high | 89.6 | Confident | 35 Ų | 35 | 40.3 Ų | 40.3 | 18% | 0.179 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -66.6 | -42.6 | 178.7 | -63.8 | 165.6 | 0 | 0 | 0 | 110.3 | I31 I50 V73 L75 T81 | I31-I77 HydrophobicContact CD1-CG2 3.33Å; I31-I77 HydrophobicContact CG1-CG2 4.39Å; I50-I77 HydrophobicContact CD1-CD1 4.02Å; I50-I77 HydrophobicContact CG1-CD1 3.73Å; V73-I77 HydrophobicContact CG1-CD1 3.79Å; V73-I77 VanDerWaalsContact O-CD1 3.27Å; V73-I77 WeakPolarHBondContact O-CD1 3.19Å; V73-I77 WeakPolarHBondContact O-CG1 3.38Å; V73-I77 PolarHBondContact O-N 3.44Å; L75-I77 VanDerWaalsContact C-N 3.29Å; L75-I77 PolarHBondContact O-N 3.37Å; I77-T81 HydrophobicContact CG2-CG2 4.29Å; I77-T81 WeakPolarHBondContact O-CB 3.45Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.3Å; I77-T81 PolarHBondContact O-N 2.94Å; I77-T81 PolarHBondContact O-OG1 2.99Å |
| 78 | F | 90.6 | Very high | 89.6 | Confident | 48 Ų | 48 | 40 Ų | 40 | 21% | 0.211 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.8 | -49.4 | 178.7 | 179.6 | -102.7 | 0 | 0 | 0 | 112.4 | I24 S74 L75 T81 T82 M100 M104 | I24-F78 HydrophobicContact CG2-CZ 4.31Å; S74-F78 VanDerWaalsContact O-CB 3.3Å; S74-F78 WeakPolarHBondContact O-CB 3.38Å; S74-F78 PolarHBondContact O-N 3.13Å; L75-F78 PolarHBondContact O-N 3.31Å; F78-T81 PolarHBondContact O-OG1 3.22Å; F78-T81 VanDerWaalsContact O-OG1 3.11Å; F78-T82 HydrophobicContact CD2-CG2 4.3Å; F78-T82 HydrophobicContact CE1-CG2 4.23Å; F78-T82 HydrophobicContact CE2-CG2 3.91Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CB 3.31Å; F78-T82 VanDerWaalsContact O-CG2 3.32Å; F78-T82 WeakPolarHBondContact O-CG2 3.15Å; F78-T82 PolarHBondContact O-N 3.22Å; F78-T82 PolarHBondContact O-OG1 3.05Å; F78-M100 HydrophobicContact CE1-CE 3.84Å; F78-M100 HydrophobicContact CZ-CE 3.81Å; F78-M104 HydrophobicContact CD1-SD 3.9Å; F78-M104 HydrophobicContact CE1-CE 4.19Å; F78-M104 HydrophobicContact CE1-SD 3.6Å |
| 79 | I | 90.6 | Very high | 89.4 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67.7 | -42 | -179.5 | -59.9 | 169.2 | 0 | 0 | 0 | 110.6 | L75 T82 N83 L160 A211 F214 | L75-I79 HydrophobicContact CD1-CD1 4.39Å; L75-I79 HydrophobicContact CD2-CD1 4.08Å; L75-I79 HydrophobicContact CG-CD1 3.86Å; L75-I79 WeakPolarHBondContact O-CG1 3.5Å; L75-I79 PolarHBondContact O-N 3.36Å; I79-T82 WeakPolarHBondContact CA-OG1 3.26Å; I79-T82 PolarHBondContact O-OG1 3.31Å; I79-N83 WeakPolarHBondContact CG2-ND2 3.37Å; I79-N83 WeakPolarHBondContact O-CB 3.48Å; I79-N83 PolarHBondContact O-N 3.26Å; I79-N83 PolarHBondContact O-ND2 3.28Å; I79-L160 HydrophobicContact CG2-CD1 3.95Å; I79-L160 HydrophobicContact CG2-CD2 4.22Å; I79-A211 HydrophobicContact CB-CB 4.03Å; I79-A211 HydrophobicContact CG2-CB 3.77Å; I79-F214 HydrophobicContact CD1-CB 4.3Å; I79-F214 HydrophobicContact CD1-CD1 3.52Å; I79-F214 HydrophobicContact CD1-CD2 4.3Å; I79-F214 HydrophobicContact CD1-CE1 3.82Å; I79-F214 HydrophobicContact CD1-CG 3.79Å; I79-F214 HydrophobicContact CD1-CZ 4.33Å |
| 80 | A | 90.1 | Very high | 89.1 | Confident | 31 Ų | 31 | 50.9 Ų | 50.9 | 26% | 0.256 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63.8 | -44.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112 | I76 L84 A211 | I76-A80 WeakPolarHBondContact O-CB 3.06Å; I76-A80 PolarHBondContact O-N 3.26Å; A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.3Å; A80-L84 PolarHBondContact O-N 3.4Å; A80-A211 HydrophobicContact CB-CB 3.94Å |
| 81 | T | 90.8 | Very high | 88.8 | Confident | 31 Ų | 31 | 45.8 Ų | 45.8 | 19% | 0.19 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -69 | -44.9 | -179.8 | 51.7 | 0 | 0 | 0 | 0 | 112 | P27 I77 F78 N83 L84 L85 | P27-T81 WeakPolarHBondContact CB-OG1 3.49Å; I77-T81 HydrophobicContact CG2-CG2 4.29Å; I77-T81 WeakPolarHBondContact O-CB 3.45Å; I77-T81 VanDerWaalsContact O-CG2 3.25Å; I77-T81 WeakPolarHBondContact O-CG2 3.3Å; I77-T81 PolarHBondContact O-N 2.94Å; I77-T81 PolarHBondContact O-OG1 2.99Å; F78-T81 PolarHBondContact O-OG1 3.22Å; F78-T81 VanDerWaalsContact O-OG1 3.11Å; T81-N83 PolarHBondContact O-N 2.9Å; T81-L84 PolarHBondContact O-N 3.01Å; T81-L85 VanDerWaalsContact O-CB 3.29Å; T81-L85 WeakPolarHBondContact O-CB 3.49Å; T81-L85 VanDerWaalsContact O-CD1 3.22Å; T81-L85 WeakPolarHBondContact O-CD1 3.38Å; T81-L85 WeakPolarHBondContact O-CG 3.45Å; T81-L85 PolarHBondContact O-N 3.44Å |
| 82 | T | 90.4 | Very high | 88.3 | Confident | 4 Ų | 4 | 44 Ų | 44 | 3% | 0.025 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -60.6 | -42.6 | 176.6 | 48.2 | 0 | 0 | 0 | 0 | 112.6 | P27 F78 I79 G86 | P27-T82 HydrophobicContact CB-CG2 4.18Å; P27-T82 HydrophobicContact CG-CG2 3.38Å; F78-T82 HydrophobicContact CD2-CG2 4.3Å; F78-T82 HydrophobicContact CE1-CG2 4.23Å; F78-T82 HydrophobicContact CE2-CG2 3.91Å; F78-T82 HydrophobicContact CZ-CG2 3.87Å; F78-T82 WeakPolarHBondContact O-CB 3.31Å; F78-T82 VanDerWaalsContact O-CG2 3.32Å; F78-T82 WeakPolarHBondContact O-CG2 3.15Å; F78-T82 PolarHBondContact O-N 3.22Å; F78-T82 PolarHBondContact O-OG1 3.05Å; I79-T82 WeakPolarHBondContact CA-OG1 3.26Å; I79-T82 PolarHBondContact O-OG1 3.31Å; T82-G86 PolarHBondContact O-N 3.44Å |
| 83 | N | 90.5 | Very high | 88 | Confident | 3 Ų | 3 | 44 Ų | 44 | 2% | 0.016 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -68.2 | -41.5 | 177.8 | -67 | -11.6 | 0 | 0 | 0 | 112.1 | I79 T81 G86 L87 T95 I164 A207 | I79-N83 WeakPolarHBondContact CG2-ND2 3.37Å; I79-N83 WeakPolarHBondContact O-CB 3.48Å; I79-N83 PolarHBondContact O-N 3.26Å; I79-N83 PolarHBondContact O-ND2 3.28Å; T81-N83 PolarHBondContact O-N 2.9Å; N83-G86 WeakPolarHBondContact O-CA 3.32Å; N83-G86 PolarHBondContact O-N 3.11Å; N83-G86 VanDerWaalsContact O-N 3.12Å; N83-L87 PolarHBondContact O-N 3.19Å; N83-T95 WeakPolarHBondContact OD1-CB 3.45Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.45Å; N83-T95 PolarHBondContact OD1-OG1 2.92Å; N83-I164 HydrophobicContact CB-CD1 4.35Å; N83-I164 VanDerWaalsContact CG-CD1 3.45Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.36Å; N83-A207 HydrophobicContact CB-CB 3.92Å; N83-A207 PolarHBondContact ND2-O 3.43Å |
| 84 | L | 89.4 | Confident | 87.6 | Confident | 101 Ų | 101 | 43.7 Ų | 43.7 | 53% | 0.529 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -67.5 | -44.7 | -179.8 | -165.8 | 83.5 | 0 | 0 | 0 | 112 | A80 T81 G86 L87 I204 | A80-L84 VanDerWaalsContact O-CB 3.3Å; A80-L84 WeakPolarHBondContact O-CB 3.3Å; A80-L84 PolarHBondContact O-N 3.4Å; T81-L84 PolarHBondContact O-N 3.01Å; L84-G86 PolarHBondContact O-N 2.92Å; L84-L87 PolarHBondContact O-N 2.82Å; L84-I204 HydrophobicContact CD1-CG2 4.28Å |
| 85 | L | 89.4 | Confident | 87.2 | Confident | 36 Ų | 36 | 40.6 Ų | 40.6 | 19% | 0.188 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -56.9 | -31.5 | 170.5 | -87.7 | 147.8 | 0 | 0 | 0 | 111.9 | F26 P27 L30 T81 L87 L88 S91 | F26-L85 HydrophobicContact CD1-CD1 4.25Å; F26-L85 HydrophobicContact CD1-CD2 3.71Å; F26-L85 HydrophobicContact CE1-CD2 3.61Å; P27-L85 HydrophobicContact CB-CD1 3.86Å; P27-L85 HydrophobicContact CG-CD1 4.01Å; L30-L85 HydrophobicContact CD1-CD1 3.47Å; L30-L85 VanDerWaalsContact CD1-CD1 3.47Å; L30-L85 HydrophobicContact CD1-CD2 4Å; L30-L85 HydrophobicContact CD1-CG 3.98Å; T81-L85 VanDerWaalsContact O-CB 3.29Å; T81-L85 WeakPolarHBondContact O-CB 3.49Å; T81-L85 VanDerWaalsContact O-CD1 3.22Å; T81-L85 WeakPolarHBondContact O-CD1 3.38Å; T81-L85 WeakPolarHBondContact O-CG 3.45Å; T81-L85 PolarHBondContact O-N 3.44Å; L85-L87 VanDerWaalsContact C-N 3.31Å; L85-L87 PolarHBondContact O-N 2.97Å; L85-L88 HydrophobicContact CD2-CD1 4.17Å; L85-L88 WeakPolarHBondContact O-CB 3.45Å; L85-L88 WeakPolarHBondContact O-CG 3.42Å; L85-L88 PolarHBondContact O-N 2.92Å; L85-S91 PolarHBondContact O-OG 3.35Å |
| 86 | G | 85.6 | Confident | 87 | Confident | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.01 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.1 | -32.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | T82 N83 L84 L88 S91 H168 | T82-G86 PolarHBondContact O-N 3.44Å; N83-G86 WeakPolarHBondContact O-CA 3.32Å; N83-G86 PolarHBondContact O-N 3.11Å; N83-G86 VanDerWaalsContact O-N 3.12Å; L84-G86 PolarHBondContact O-N 2.92Å; G86-L88 PolarHBondContact O-N 2.95Å; G86-S91 PolarHBondContact O-OG 2.94Å; G86-H168 PolarHBondContact O-CE1 2.81Å; G86-H168 PolarHBondContact O-NE2 2.99Å; G86-H168 VanDerWaalsContact O-NE2 3.13Å |
| 87 | L | 86.4 | Confident | 86.9 | Confident | 37 Ų | 37 | 42.6 Ų | 42.6 | 19% | 0.194 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.8 | -4.6 | -178.6 | -60.5 | 175.3 | 0 | 0 | 0 | 113 | N83 L84 L85 M171 E203 I204 A207 | N83-L87 PolarHBondContact O-N 3.19Å; L84-L87 PolarHBondContact O-N 2.82Å; L85-L87 VanDerWaalsContact C-N 3.31Å; L85-L87 PolarHBondContact O-N 2.97Å; L87-M171 HydrophobicContact CD2-CE 4.02Å; L87-E203 HydrophobicContact CD1-CG 4.42Å; L87-E203 HydrophobicContact CD2-CB 4.18Å; L87-E203 HydrophobicContact CD2-CG 3.38Å; L87-I204 HydrophobicContact CD1-CB 4.2Å; L87-I204 HydrophobicContact CD1-CG1 3.61Å; L87-A207 HydrophobicContact CD1-CB 4.09Å |
| 88 | L | 87.1 | Confident | 86.6 | Confident | 97 Ų | 97 | 44.1 Ų | 44.1 | 51% | 0.508 | 24% | 0.238 | S | C | . | . | S | Bend | trans | -66.4 | 146.1 | 174.7 | -65.3 | 173.8 | 0 | 0 | 0 | 110.7 | L85 G86 H90 S91 | L85-L88 HydrophobicContact CD2-CD1 4.17Å; L85-L88 WeakPolarHBondContact O-CB 3.45Å; L85-L88 WeakPolarHBondContact O-CG 3.42Å; L85-L88 PolarHBondContact O-N 2.92Å; G86-L88 PolarHBondContact O-N 2.95Å; L88-H90 PolarHBondContact O-N 3Å; L88-S91 PolarHBondContact O-N 3.02Å; L88-S91 PolarHBondContact O-OG 2.95Å; L88-S91 VanDerWaalsContact O-OG 3.05Å |
| 89 | P | 81.9 | Confident | 86.5 | Confident | 111 Ų | 111 | 46 Ų | 46 | 72% | 0.721 | 26% | 0.256 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | 132.6 | 178.8 | 24.8 | -33.5 | 0 | 0 | 0 | 110.5 | S91 | P89-S91 PolarHBondContact O-N 3.13Å; P89-S91 VanDerWaalsContact O-N 3.17Å |
| 90 | H | 81.8 | Confident | 86.3 | Confident | 200 Ų | 200 | 47.9 Ų | 47.9 | 93% | 0.926 | 27% | 0.266 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.1 | 16.9 | -179.8 | -56.6 | -67.3 | 0 | 0 | 0 | 116 | L88 | L88-H90 PolarHBondContact O-N 3Š|
| 91 | S | 83.8 | Confident | 86.2 | Confident | 38 Ų | 38 | 46.4 Ų | 46.4 | 27% | 0.266 | 25% | 0.254 | S | S | . | . | trans | -81.1 | 143.5 | 170.9 | 70.2 | 0 | 0 | 0 | 0 | 111 | L85 G86 L88 P89 | L85-S91 PolarHBondContact O-OG 3.35Å; G86-S91 PolarHBondContact O-OG 2.94Å; L88-S91 PolarHBondContact O-N 3.02Å; L88-S91 PolarHBondContact O-OG 2.95Å; L88-S91 VanDerWaalsContact O-OG 3.05Å; P89-S91 PolarHBondContact O-N 3.13Å; P89-S91 VanDerWaalsContact O-N 3.17Å | ||
| 92 | F | 81.8 | Confident | 86 | Confident | 27 Ų | 27 | 47.1 Ų | 47.1 | 12% | 0.118 | 26% | 0.256 | C | S | . | . | trans | -88.7 | 123.1 | 171.4 | 171.3 | -95.1 | 0 | 0 | 0 | 109.2 | S8 P12 A20 I23 P94 Q97 | S8-F92 WeakPolarHBondContact O-CD2 2.98Å; P12-F92 HydrophobicContact CG-CB 4.41Å; P12-F92 HydrophobicContact CG-CD1 4.13Å; P12-F92 HydrophobicContact CG-CG 4.11Å; A20-F92 HydrophobicContact CB-CE1 4.38Å; I23-F92 HydrophobicContact CD1-CB 4.03Å; I23-F92 HydrophobicContact CD1-CD1 3.89Å; I23-F92 HydrophobicContact CD1-CG 4.34Å; I23-F92 HydrophobicContact CG2-CD1 4.44Å; F92-P94 HydrophobicContact CE1-CB 4.41Å; F92-P94 WeakPolarHBondContact O-CD 3.38Å; F92-Q97 HydrophobicContact CZ-CG 4.17Å | ||
| 93 | T | 83.3 | Confident | 85.9 | Confident | 3 Ų | 3 | 50 Ų | 50 | 2% | 0.018 | 28% | 0.28 | C | S | . | . | trans | -91.3 | 110.9 | 177.3 | 28.4 | 0 | 0 | 0 | 0 | 111.1 | T95 T96 I164 | T93-T95 PolarHBondContact O-N 3.03Å; T93-T95 VanDerWaalsContact O-N 3.17Å; T93-T96 PolarHBondContact O-N 3.39Å; T93-T96 PolarHBondContact O-OG1 3.34Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.3Å; T93-I164 HydrophobicContact CG2-CG2 4.26Å | ||
| 94 | P | 81.8 | Confident | 85.6 | Confident | 11 Ų | 11 | 50.9 Ų | 50.9 | 7% | 0.071 | 29% | 0.285 | C | S | . | . | G | 310 helix | trans | -64 | -22.9 | 176.8 | 26.3 | -33.6 | 0 | 0 | 0 | 112.6 | I24 F92 T96 Q97 M100 | I24-P94 HydrophobicContact CD1-CB 4.3Å; I24-P94 HydrophobicContact CG1-CB 3.73Å; I24-P94 HydrophobicContact CG1-CG 4.08Å; F92-P94 HydrophobicContact CE1-CB 4.41Å; F92-P94 WeakPolarHBondContact O-CD 3.38Å; P94-T96 VanDerWaalsContact C-N 3.27Å; P94-T96 PolarHBondContact O-N 3.25Å; P94-Q97 PolarHBondContact O-N 3.46Å; P94-M100 WeakPolarHBondContact O-CB 3.41Å |
| 95 | T | 84.6 | Confident | 85.5 | Confident | 1 Ų | 1 | 46.2 Ų | 46.2 | 1% | 0.006 | 26% | 0.26 | C | S | . | . | G | 310 helix | trans | -75.9 | -7.3 | 178.9 | 51.1 | 0 | 0 | 0 | 0 | 114.4 | N83 T93 Q97 N101 L160 I164 | N83-T95 WeakPolarHBondContact OD1-CB 3.45Å; N83-T95 WeakPolarHBondContact OD1-CG2 3.45Å; N83-T95 PolarHBondContact OD1-OG1 2.92Å; T93-T95 PolarHBondContact O-N 3.03Å; T93-T95 VanDerWaalsContact O-N 3.17Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; T95-N101 PolarHBondContact O-ND2 3.34Å; T95-N101 PolarHBondContact O-OD1 3.33Å; T95-L160 HydrophobicContact CG2-CD2 4.31Å; T95-I164 VanDerWaalsContact OG1-CD1 3.3Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.26Å |
| 96 | T | 85.4 | Confident | 85.4 | Confident | 10 Ų | 10 | 48.4 Ų | 48.4 | 6% | 0.061 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -74.4 | -27.5 | 169.7 | 56.5 | 0 | 0 | 0 | 0 | 112.4 | F9 T93 P94 L98 T161 I164 T165 | F9-T96 HydrophobicContact CD1-CG2 3.82Å; F9-T96 HydrophobicContact CE1-CG2 3.71Å; T93-T96 PolarHBondContact O-N 3.39Å; T93-T96 PolarHBondContact O-OG1 3.34Å; T93-T96 WeakPolarHBondContact OG1-CG2 3.3Å; P94-T96 VanDerWaalsContact C-N 3.27Å; P94-T96 PolarHBondContact O-N 3.25Å; T96-L98 PolarHBondContact O-N 3.08Å; T96-T161 WeakPolarHBondContact O-CG2 3.23Å; T96-I164 HydrophobicContact CG2-CB 4.4Å; T96-I164 HydrophobicContact CG2-CG2 3.68Å; T96-T165 HydrophobicContact CG2-CG2 3.75Å |
| 97 | Q | 88.4 | Confident | 85.5 | Confident | 69 Ų | 69 | 52.2 Ų | 52.2 | 32% | 0.322 | 30% | 0.296 | S | S | . | . | S | Bend | trans | -77.9 | 119.3 | 178.2 | -66 | -63.3 | -28.7 | 0 | 0 | 109.6 | F9 F92 P94 T95 S99 M100 | F9-Q97 PolarHBondContact O-NE2 2.93Å; F92-Q97 HydrophobicContact CZ-CG 4.17Å; P94-Q97 PolarHBondContact O-N 3.46Å; T95-Q97 VanDerWaalsContact C-N 3.33Å; Q97-S99 PolarHBondContact O-N 3.17Å; Q97-S99 VanDerWaalsContact O-N 3.17Å; Q97-M100 PolarHBondContact O-N 2.94Å; Q97-M100 VanDerWaalsContact O-N 3.08Å |
| 98 | L | 86.1 | Confident | 85.6 | Confident | 68 Ų | 68 | 51.3 Ų | 51.3 | 36% | 0.356 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -57.1 | -32.6 | 178.6 | -177.1 | 64 | 0 | 0 | 0 | 112.3 | T96 M100 N101 L102 M154 A157 V158 T161 | T96-L98 PolarHBondContact O-N 3.08Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.28Å; L98-N101 PolarHBondContact O-N 3.08Å; L98-L102 VanDerWaalsContact O-CB 3.22Å; L98-L102 WeakPolarHBondContact O-CB 3.36Å; L98-L102 PolarHBondContact O-N 3.13Å; L98-M154 HydrophobicContact CD2-CE 4.07Å; L98-A157 HydrophobicContact CD1-CB 4.39Å; L98-V158 HydrophobicContact CD1-CG2 3.93Å; L98-T161 VanDerWaalsContact CA-CG2 3.43Å; L98-T161 HydrophobicContact CB-CG2 4.01Å; L98-T161 HydrophobicContact CD1-CG2 3.97Å |
| 99 | S | 87.7 | Confident | 85.5 | Confident | 86 Ų | 86 | 48.7 Ų | 48.7 | 60% | 0.601 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -56.7 | -43.8 | 176.5 | 57 | 0 | 0 | 0 | 0 | 112.6 | Q97 A103 | Q97-S99 PolarHBondContact O-N 3.17Å; Q97-S99 VanDerWaalsContact O-N 3.17Å; S99-A103 WeakPolarHBondContact O-CB 3.39Å; S99-A103 PolarHBondContact O-N 2.8Å |
| 100 | M | 86.9 | Confident | 85.7 | Confident | 41 Ų | 41 | 44.7 Ų | 44.7 | 20% | 0.202 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.2 | -45.9 | -179 | -176.2 | 62.1 | -172.2 | 0 | 0 | 111.3 | I24 F78 P94 Q97 L98 L102 A103 M104 | I24-M100 HydrophobicContact CD1-SD 4.4Å; I24-M100 HydrophobicContact CG2-CE 4.36Å; F78-M100 HydrophobicContact CE1-CE 3.84Å; F78-M100 HydrophobicContact CZ-CE 3.81Å; P94-M100 WeakPolarHBondContact O-CB 3.41Å; Q97-M100 PolarHBondContact O-N 2.94Å; Q97-M100 VanDerWaalsContact O-N 3.08Å; L98-M100 VanDerWaalsContact C-N 3.32Å; L98-M100 PolarHBondContact O-N 3.28Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.3Å; M100-A103 PolarHBondContact O-N 3.33Å; M100-M104 HydrophobicContact CE-CE 3.86Å; M100-M104 HydrophobicContact CE-CG 4.34Å; M100-M104 HydrophobicContact CE-SD 4.12Å; M100-M104 HydrophobicContact CG-CE 3.71Å; M100-M104 PolarHBondContact O-N 2.69Å; M100-M104 HydrophobicContact SD-CE 4.47Å |
| 101 | N | 87.6 | Confident | 85.8 | Confident | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -68.5 | -37.5 | -178 | -64.1 | -4.1 | 0 | 0 | 0 | 111.6 | T95 L98 M104 A105 A157 L160 T161 | T95-N101 PolarHBondContact O-ND2 3.34Å; T95-N101 PolarHBondContact O-OD1 3.33Å; L98-N101 PolarHBondContact O-N 3.08Å; N101-M104 PolarHBondContact O-N 3.18Å; N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.49Å; N101-A105 PolarHBondContact O-N 3.17Å; N101-A157 HydrophobicContact CB-CB 3.94Å; N101-A157 PolarHBondContact ND2-O 3.47Å; N101-L160 HydrophobicContact CB-CD2 4.27Å; N101-L160 WeakPolarHBondContact ND2-CB 3.43Å; N101-L160 VanDerWaalsContact ND2-CD2 3.33Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.26Å; N101-L160 WeakPolarHBondContact ND2-CG 3.44Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.38Å; N101-T161 HydrophobicContact CB-CG2 4.3Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.29Å; N101-T161 PolarHBondContact ND2-N 3.41Å |
| 102 | L | 85.6 | Confident | 85.8 | Confident | 45 Ų | 45 | 34.4 Ų | 34.4 | 24% | 0.236 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -69.8 | -39.3 | 176.8 | -164.7 | 64.7 | 0 | 0 | 0 | 111.5 | L98 M100 M104 A105 I106 M154 A157 | L98-L102 VanDerWaalsContact O-CB 3.22Å; L98-L102 WeakPolarHBondContact O-CB 3.36Å; L98-L102 PolarHBondContact O-N 3.13Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.3Å; L102-M104 PolarHBondContact O-N 3.39Å; L102-A105 PolarHBondContact O-N 2.91Å; L102-I106 HydrophobicContact CD1-CD1 3.7Å; L102-I106 HydrophobicContact CD1-CG1 3.75Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.48Å; L102-I106 VanDerWaalsContact CG-CD1 3.48Å; L102-I106 HydrophobicContact CG-CG1 3.93Å; L102-I106 WeakPolarHBondContact O-CG1 3.41Å; L102-I106 PolarHBondContact O-N 3.43Å; L102-M154 HydrophobicContact CD1-SD 3.44Å; L102-M154 WeakPolarHBondContact CD1-SD 3.42Å; L102-M154 HydrophobicContact CD2-SD 4.19Å; L102-M154 HydrophobicContact CG-SD 4.46Å; L102-A157 HydrophobicContact CB-CB 4.44Å; L102-A157 HydrophobicContact CD1-CB 4.13Å |
| 103 | A | 88.5 | Confident | 85.8 | Confident | 64 Ų | 64 | 33.9 Ų | 33.9 | 53% | 0.529 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -62.6 | -29.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | S99 M100 P107 | S99-A103 WeakPolarHBondContact O-CB 3.39Å; S99-A103 PolarHBondContact O-N 2.8Å; M100-A103 PolarHBondContact O-N 3.33Å; A103-P107 WeakPolarHBondContact O-CD 3.29Å; A103-P107 WeakPolarHBondContact O-CG 3.21Å |
| 104 | M | 85.2 | Confident | 85.8 | Confident | 23 Ų | 23 | 38.5 Ų | 38.5 | 11% | 0.113 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -79.5 | -45.1 | 171.1 | -70.9 | -173.5 | -87.6 | 0 | 0 | 112.5 | F78 M100 N101 L102 L108 | F78-M104 HydrophobicContact CD1-SD 3.9Å; F78-M104 HydrophobicContact CE1-CE 4.19Å; F78-M104 HydrophobicContact CE1-SD 3.6Å; M100-M104 HydrophobicContact CE-CE 3.86Å; M100-M104 HydrophobicContact CE-CG 4.34Å; M100-M104 HydrophobicContact CE-SD 4.12Å; M100-M104 HydrophobicContact CG-CE 3.71Å; M100-M104 PolarHBondContact O-N 2.69Å; M100-M104 HydrophobicContact SD-CE 4.47Å; N101-M104 PolarHBondContact O-N 3.18Å; L102-M104 PolarHBondContact O-N 3.39Å; M104-L108 WeakPolarHBondContact O-CD1 3.4Å; M104-L108 VanDerWaalsContact O-CG 3.26Å; M104-L108 WeakPolarHBondContact O-CG 3.36Å |
| 105 | A | 86.1 | Confident | 85.8 | Confident | 2 Ų | 2 | 40.2 Ų | 40.2 | 2% | 0.017 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -71.5 | -44.8 | -171.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | N101 L102 L108 W109 L156 A157 F214 | N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.49Å; N101-A105 PolarHBondContact O-N 3.17Å; L102-A105 PolarHBondContact O-N 2.91Å; A105-L108 PolarHBondContact O-N 2.98Å; A105-W109 WeakPolarHBondContact O-CB 3.09Å; A105-W109 PolarHBondContact O-N 3.2Å; A105-L156 HydrophobicContact CB-CD2 4.37Å; A105-A157 HydrophobicContact CB-CB 4.22Å; A105-F214 HydrophobicContact CB-CE2 4.37Å; A105-F214 HydrophobicContact CB-CZ 4.19Å |
| 106 | I | 87.4 | Confident | 85.3 | Confident | 82 Ų | 82 | 40.2 Ų | 40.2 | 42% | 0.421 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.9 | -50.1 | -175.3 | -63.3 | 176.1 | 0 | 0 | 0 | 111.7 | L102 L108 W109 A110 | L102-I106 HydrophobicContact CD1-CD1 3.7Å; L102-I106 HydrophobicContact CD1-CG1 3.75Å; L102-I106 HydrophobicContact CD2-CD1 4Å; L102-I106 HydrophobicContact CG-CD1 3.48Å; L102-I106 VanDerWaalsContact CG-CD1 3.48Å; L102-I106 HydrophobicContact CG-CG1 3.93Å; L102-I106 WeakPolarHBondContact O-CG1 3.41Å; L102-I106 PolarHBondContact O-N 3.43Å; I106-L108 PolarHBondContact O-N 2.99Å; I106-W109 PolarHBondContact O-N 3.47Å; I106-A110 WeakPolarHBondContact O-CB 3.4Å; I106-A110 PolarHBondContact O-N 3.29Å |
| 107 | P | 88.8 | Confident | 84.9 | Confident | 81 Ų | 81 | 43.5 Ų | 43.5 | 53% | 0.526 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -65.3 | -37.4 | -177.9 | -23.9 | 36.9 | 0 | 0 | 0 | 113.2 | A103 G111 | A103-P107 WeakPolarHBondContact O-CD 3.29Å; A103-P107 WeakPolarHBondContact O-CG 3.21Å; P107-G111 PolarHBondContact O-N 3.5Å |
| 108 | L | 87.3 | Confident | 84.3 | Confident | 19 Ų | 19 | 50.4 Ų | 50.4 | 10% | 0.099 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -66.1 | -46.5 | 178.5 | -69.9 | 167.7 | 0 | 0 | 0 | 111.6 | M71 L75 M104 A105 I106 G111 A112 F214 V218 | M71-L108 HydrophobicContact CE-CD2 3.28Å; M71-L108 HydrophobicContact CG-CD2 4.2Å; M71-L108 HydrophobicContact SD-CD2 3.5Å; M71-L108 WeakPolarHBondContact SD-CD2 3.32Å; L75-L108 HydrophobicContact CD1-CD1 3.35Å; L75-L108 HydrophobicContact CD2-CD1 4.04Å; L75-L108 HydrophobicContact CG-CD1 4.35Å; M104-L108 WeakPolarHBondContact O-CD1 3.4Å; M104-L108 VanDerWaalsContact O-CG 3.26Å; M104-L108 WeakPolarHBondContact O-CG 3.36Å; A105-L108 PolarHBondContact O-N 2.98Å; I106-L108 PolarHBondContact O-N 2.99Å; L108-G111 PolarHBondContact O-N 3.46Å; L108-A112 PolarHBondContact O-N 3.46Å; L108-F214 HydrophobicContact CD1-CE1 4.12Å; L108-V218 HydrophobicContact CB-CG1 4.37Å |
| 109 | W | 85.9 | Confident | 83.5 | Confident | 42 Ų | 42 | 49.5 Ų | 49.5 | 16% | 0.159 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64 | -47.8 | 175.8 | 172.1 | 89.5 | 0 | 0 | 0 | 111.3 | A105 I106 G111 A112 V113 L149 L150 P153 | A105-W109 WeakPolarHBondContact O-CB 3.09Å; A105-W109 PolarHBondContact O-N 3.2Å; I106-W109 PolarHBondContact O-N 3.47Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 2.67Å; W109-A112 PolarHBondContact O-N 2.88Å; W109-A112 VanDerWaalsContact O-N 3.14Å; W109-V113 HydrophobicContact CD2-CG2 4.09Å; W109-V113 HydrophobicContact CH2-CG2 4.43Å; W109-V113 HydrophobicContact CZ2-CG2 3.92Å; W109-V113 WeakPolarHBondContact O-CG2 3.16Å; W109-V113 PolarHBondContact O-N 3.39Å; W109-L149 HydrophobicContact CH2-CD2 4.18Å; W109-L149 HydrophobicContact CZ2-CD2 3.48Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.48Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.3Å; W109-L149 WeakPolarHBondContact CZ2-O 3.33Å; W109-L149 PolarHBondContact NE1-O 2.93Å; W109-L150 HydrophobicContact CH2-CD2 3.75Å; W109-L150 HydrophobicContact CZ2-CD2 4.26Å; W109-P153 HydrophobicContact CB-CB 3.88Å; W109-P153 HydrophobicContact CB-CG 4.38Å; W109-P153 HydrophobicContact CD2-CB 4.27Å; W109-P153 HydrophobicContact CD2-CG 3.78Å; W109-P153 HydrophobicContact CE3-CG 4.31Å; W109-P153 HydrophobicContact CG-CB 3.81Å; W109-P153 HydrophobicContact CG-CG 3.79Å |
| 110 | A | 84.8 | Confident | 82.6 | Confident | 27 Ų | 27 | 49.6 Ų | 49.6 | 22% | 0.223 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.4 | -41.2 | 179 | 0 | 0 | 0 | 0 | 0 | 110.8 | I106 V113 I114 | I106-A110 WeakPolarHBondContact O-CB 3.4Å; I106-A110 PolarHBondContact O-N 3.29Å; A110-V113 PolarHBondContact O-N 3.06Å; A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.27Å; A110-I114 WeakPolarHBondContact O-CD1 3.17Å; A110-I114 WeakPolarHBondContact O-CG1 3.42Å; A110-I114 PolarHBondContact O-N 2.89Å |
| 111 | G | 85.1 | Confident | 81.5 | Confident | 21 Ų | 21 | 52.9 Ų | 52.9 | 22% | 0.216 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113 | P107 L108 W109 M115 | P107-G111 PolarHBondContact O-N 3.5Å; L108-G111 PolarHBondContact O-N 3.46Å; W109-G111 VanDerWaalsContact C-N 3.28Å; W109-G111 PolarHBondContact O-N 2.67Å; G111-M115 VanDerWaalsContact O-CB 3.31Å; G111-M115 WeakPolarHBondContact O-CB 3.28Å; G111-M115 PolarHBondContact O-N 3.46Å |
| 112 | A | 82.9 | Confident | 80.3 | Confident | 1 Ų | 1 | 61.9 Ų | 61.9 | 1% | 0.008 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.6 | -45.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L108 W109 M115 G116 L222 | L108-A112 PolarHBondContact O-N 3.46Å; W109-A112 PolarHBondContact O-N 2.88Å; W109-A112 VanDerWaalsContact O-N 3.14Å; A112-M115 PolarHBondContact O-N 3.27Å; A112-G116 PolarHBondContact O-N 3.45Å; A112-L222 HydrophobicContact CB-CD1 4.49Å |
| 113 | V | 82.4 | Confident | 79.4 | Confident | 16 Ų | 16 | 64.3 Ų | 64.3 | 10% | 0.097 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.2 | -46.3 | 178.8 | 172.5 | 0 | 0 | 0 | 0 | 111.4 | W109 A110 M115 G116 F117 | W109-V113 HydrophobicContact CD2-CG2 4.09Å; W109-V113 HydrophobicContact CH2-CG2 4.43Å; W109-V113 HydrophobicContact CZ2-CG2 3.92Å; W109-V113 WeakPolarHBondContact O-CG2 3.16Å; W109-V113 PolarHBondContact O-N 3.39Å; A110-V113 PolarHBondContact O-N 3.06Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.48Å; V113-G116 PolarHBondContact O-N 2.99Å; V113-G116 VanDerWaalsContact O-N 3.14Å; V113-F117 HydrophobicContact CG1-CD2 3.63Å; V113-F117 HydrophobicContact CG1-CE2 3.36Å; V113-F117 WeakPolarHBondContact O-CD2 3.16Å; V113-F117 PolarHBondContact O-N 3.07Å |
| 114 | I | 83.8 | Confident | 78.1 | Confident | 99 Ų | 99 | 62.1 Ų | 62.1 | 51% | 0.508 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -61.2 | -39.2 | 176.7 | -68.4 | 163.6 | 0 | 0 | 0 | 110.5 | A110 G116 F117 R118 | A110-I114 VanDerWaalsContact O-CB 3.3Å; A110-I114 WeakPolarHBondContact O-CB 3.27Å; A110-I114 WeakPolarHBondContact O-CD1 3.17Å; A110-I114 WeakPolarHBondContact O-CG1 3.42Å; A110-I114 PolarHBondContact O-N 2.89Å; I114-G116 VanDerWaalsContact C-N 3.35Å; I114-F117 PolarHBondContact O-N 2.92Å; I114-R118 HydrophobicContact CG2-CG 4.41Å; I114-R118 WeakPolarHBondContact O-CB 3.49Å; I114-R118 VanDerWaalsContact O-CG 3.31Å; I114-R118 WeakPolarHBondContact O-CG 3.31Å; I114-R118 PolarHBondContact O-N 2.83Å |
| 115 | M | 80.6 | Confident | 77.1 | Confident | 47 Ų | 47 | 65.5 Ų | 65.5 | 23% | 0.232 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.6 | -37.7 | 176.1 | -171.4 | 170 | -178.3 | 0 | 0 | 112.1 | W68 G111 A112 V113 R118 S119 L222 T226 | W68-M115 HydrophobicContact CZ2-SD 3.93Å; W68-M115 PolarHBondContact NE1-SD 3.27Å; G111-M115 VanDerWaalsContact O-CB 3.31Å; G111-M115 WeakPolarHBondContact O-CB 3.28Å; G111-M115 PolarHBondContact O-N 3.46Å; A112-M115 PolarHBondContact O-N 3.27Å; V113-M115 VanDerWaalsContact C-N 3.28Å; V113-M115 PolarHBondContact O-N 3.48Å; M115-R118 PolarHBondContact O-N 3.37Å; M115-S119 VanDerWaalsContact O-CB 3.32Å; M115-S119 WeakPolarHBondContact O-CB 3.09Å; M115-S119 PolarHBondContact O-N 3.32Å; M115-S119 PolarHBondContact O-OG 3.03Å; M115-S119 VanDerWaalsContact O-OG 3.05Å; M115-L222 HydrophobicContact SD-CD1 4.29Å; M115-T226 HydrophobicContact CE-CG2 4.38Å |
| 116 | G | 74.8 | Confident | 75.9 | Confident | 1 Ų | 1 | 67.9 Ų | 67.9 | 1% | 0.01 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -61.5 | -50.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A112 V113 I114 R118 S119 K120 N225 | A112-G116 PolarHBondContact O-N 3.45Å; V113-G116 PolarHBondContact O-N 2.99Å; V113-G116 VanDerWaalsContact O-N 3.14Å; I114-G116 VanDerWaalsContact C-N 3.35Å; G116-R118 VanDerWaalsContact C-N 3.32Å; G116-R118 PolarHBondContact O-N 3.43Å; G116-S119 PolarHBondContact O-N 3.13Å; G116-S119 PolarHBondContact O-OG 3.16Å; G116-K120 CarbonylContact O-C 3.59Å; G116-K120 PolarHBondContact O-N 3.23Å; G116-N225 VanDerWaalsContact CA-O 3.24Å; G116-N225 WeakPolarHBondContact CA-O 3.08Å |
| 117 | F | 77.2 | Confident | 74.7 | Confident | 80 Ų | 80 | 69.2 Ų | 69.2 | 35% | 0.351 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.2 | -40.3 | 175.7 | -77 | -63.9 | 0 | 0 | 0 | 112.2 | V113 I114 I121 A124 L125 F128 | V113-F117 HydrophobicContact CG1-CD2 3.63Å; V113-F117 HydrophobicContact CG1-CE2 3.36Å; V113-F117 WeakPolarHBondContact O-CD2 3.16Å; V113-F117 PolarHBondContact O-N 3.07Å; I114-F117 PolarHBondContact O-N 2.92Å; F117-I121 WeakPolarHBondContact O-CG1 3.33Å; F117-A124 HydrophobicContact CD1-CB 4.29Å; F117-A124 HydrophobicContact CE1-CB 4.38Å; F117-L125 HydrophobicContact CD1-CD1 4.21Å; F117-L125 HydrophobicContact CE1-CD1 3.84Å; F117-F128 HydrophobicContact CZ-CE2 4.47Å |
| 118 | R | 76.3 | Confident | 73.5 | Confident | 214 Ų | 214 | 67.1 Ų | 67.1 | 81% | 0.808 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -70.7 | -34.1 | 179.1 | -73.5 | -178.2 | 69.7 | -169 | 1.8 | 113.6 | I114 M115 G116 | I114-R118 HydrophobicContact CG2-CG 4.41Å; I114-R118 WeakPolarHBondContact O-CB 3.49Å; I114-R118 VanDerWaalsContact O-CG 3.31Å; I114-R118 WeakPolarHBondContact O-CG 3.31Å; I114-R118 PolarHBondContact O-N 2.83Å; M115-R118 PolarHBondContact O-N 3.37Å; G116-R118 VanDerWaalsContact C-N 3.32Å; G116-R118 PolarHBondContact O-N 3.43Å |
| 119 | S | 68.1 | Low | 72.3 | Confident | 49 Ų | 49 | 69.2 Ų | 69.2 | 34% | 0.343 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -88.8 | -39 | -172.9 | 71.4 | 0 | 0 | 0 | 0 | 113.5 | M115 G116 N225 | M115-S119 VanDerWaalsContact O-CB 3.32Å; M115-S119 WeakPolarHBondContact O-CB 3.09Å; M115-S119 PolarHBondContact O-N 3.32Å; M115-S119 PolarHBondContact O-OG 3.03Å; M115-S119 VanDerWaalsContact O-OG 3.05Å; G116-S119 PolarHBondContact O-N 3.13Å; G116-S119 PolarHBondContact O-OG 3.16Å; S119-N225 PolarHBondContact OG-O 3.44Å |
| 120 | K | 69.3 | Low | 71 | Confident | 88 Ų | 88 | 70.5 Ų | 70.5 | 38% | 0.383 | 36% | 0.362 | S | S | . | . | trans | -147.5 | 71.8 | -176.8 | -67.3 | 175.1 | -178.4 | 159.5 | 0 | 111.4 | G116 K122 N123 A124 T226 | G116-K120 CarbonylContact O-C 3.59Å; G116-K120 PolarHBondContact O-N 3.23Å; K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 3.5Å; K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.26Å; K120-N123 PolarHBondContact O-N 2.87Å; K120-N123 VanDerWaalsContact O-N 3.11Å; K120-A124 WeakPolarHBondContact O-CB 3.5Å; K120-A124 PolarHBondContact O-N 3.28Å; K120-T226 WeakPolarHBondContact CE-O 3.26Å; K120-T226 PolarHBondContact NZ-O 3.41Å; K120-T226 PolarHBondContact NZ-OXT 3.44Å | ||
| 121 | I | 63.8 | Low | 69.9 | Low | 110 Ų | 110 | 78.7 Ų | 78.7 | 56% | 0.564 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -47.3 | -49.4 | 177.5 | -60 | 170.4 | 0 | 0 | 0 | 111.7 | F117 N123 L125 | F117-I121 WeakPolarHBondContact O-CG1 3.33Å; I121-N123 PolarHBondContact O-N 3.19Å; I121-L125 HydrophobicContact CG2-CD1 3.78Å; I121-L125 WeakPolarHBondContact O-CD1 3.37Å; I121-L125 PolarHBondContact O-N 3.42Å |
| 122 | K | 62.1 | Low | 68.8 | Low | 188 Ų | 188 | 81.6 Ų | 81.6 | 82% | 0.817 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -66.5 | -36.6 | -176 | -64.3 | -175.5 | -179.3 | -177.5 | 0 | 113.4 | K120 A126 | K120-K122 VanDerWaalsContact C-N 3.27Å; K120-K122 PolarHBondContact O-N 3.5Å; K122-A126 VanDerWaalsContact O-CB 3.27Å; K122-A126 WeakPolarHBondContact O-CB 3.41Å; K122-A126 PolarHBondContact O-N 2.77Å |
| 123 | N | 66.2 | Low | 68.2 | Low | 97 Ų | 97 | 83.2 Ų | 83.2 | 52% | 0.519 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -79.4 | -36 | -178.1 | -147.3 | 61.2 | 0 | 0 | 0 | 111.3 | K120 I121 A126 H127 | K120-N123 HydrophobicContact CB-CB 3.91Å; K120-N123 HydrophobicContact CD-CB 4.26Å; K120-N123 PolarHBondContact O-N 2.87Å; K120-N123 VanDerWaalsContact O-N 3.11Å; I121-N123 PolarHBondContact O-N 3.19Å; N123-A126 PolarHBondContact O-N 3.25Å; N123-H127 PolarHBondContact O-N 3.35Å; N123-H127 VanDerWaalsContact O-N 3.09Å |
| 124 | A | 62.7 | Low | 67.8 | Low | 17 Ų | 17 | 86.1 Ų | 86.1 | 14% | 0.14 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -63.3 | -42.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | F117 K120 H127 | F117-A124 HydrophobicContact CD1-CB 4.29Å; F117-A124 HydrophobicContact CE1-CB 4.38Å; K120-A124 WeakPolarHBondContact O-CB 3.5Å; K120-A124 PolarHBondContact O-N 3.28Å; A124-H127 PolarHBondContact O-N 3.38Å |
| 125 | L | 62.7 | Low | 67.4 | Low | 95 Ų | 95 | 87 Ų | 87 | 50% | 0.497 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -70.7 | -32.5 | 174.4 | -86.4 | 86.8 | 0 | 0 | 0 | 113 | F117 I121 H127 F128 | F117-L125 HydrophobicContact CD1-CD1 4.21Å; F117-L125 HydrophobicContact CE1-CD1 3.84Å; I121-L125 HydrophobicContact CG2-CD1 3.78Å; I121-L125 WeakPolarHBondContact O-CD1 3.37Å; I121-L125 PolarHBondContact O-N 3.42Å; L125-H127 VanDerWaalsContact C-N 3.26Å; L125-H127 PolarHBondContact O-N 3Å; L125-F128 PolarHBondContact O-N 3.32Å |
| 126 | A | 61.7 | Low | 67.5 | Low | 51 Ų | 51 | 89.9 Ų | 89.9 | 42% | 0.421 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.1 | -27.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | K122 N123 F128 L129 | K122-A126 VanDerWaalsContact O-CB 3.27Å; K122-A126 WeakPolarHBondContact O-CB 3.41Å; K122-A126 PolarHBondContact O-N 2.77Å; N123-A126 PolarHBondContact O-N 3.25Å; A126-F128 PolarHBondContact O-N 3.04Å; A126-L129 CarbonylContact O-C 3.59Å; A126-L129 PolarHBondContact O-N 3.28Å |
| 127 | H | 63.1 | Low | 67.7 | Low | 110 Ų | 110 | 94.8 Ų | 94.8 | 51% | 0.509 | 51% | 0.512 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | -18.3 | 176.7 | -149.5 | -58.5 | 0 | 0 | 0 | 113.2 | N123 A124 L125 L129 | N123-H127 PolarHBondContact O-N 3.35Å; N123-H127 VanDerWaalsContact O-N 3.09Å; A124-H127 PolarHBondContact O-N 3.38Å; L125-H127 VanDerWaalsContact C-N 3.26Å; L125-H127 PolarHBondContact O-N 3Å; H127-L129 PolarHBondContact O-N 3.28Å |
| 128 | F | 61.8 | Low | 67.8 | Low | 38 Ų | 38 | 93.3 Ų | 93.3 | 17% | 0.167 | 51% | 0.507 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -15.1 | 172.2 | -67.1 | -57.4 | 0 | 0 | 0 | 113.4 | F117 L125 A126 L141 E145 T146 L149 | F117-F128 HydrophobicContact CZ-CE2 4.47Å; L125-F128 PolarHBondContact O-N 3.32Å; A126-F128 PolarHBondContact O-N 3.04Å; F128-L141 WeakPolarHBondContact O-CD2 3.29Å; F128-E145 HydrophobicContact CD1-CB 4.25Å; F128-E145 HydrophobicContact CD1-CG 3.86Å; F128-T146 HydrophobicContact CD1-CG2 4.17Å; F128-T146 HydrophobicContact CE1-CG2 3.95Å; F128-T146 HydrophobicContact CZ-CG2 4.43Å; F128-L149 HydrophobicContact CE1-CD1 4.45Å |
| 129 | L | 62.2 | Low | 67.9 | Low | 62 Ų | 62 | 87.1 Ų | 87.1 | 33% | 0.325 | 49% | 0.494 | S | S | . | . | S | Bend | trans | -122.4 | 112.8 | 176.5 | -105.2 | 73.2 | 0 | 0 | 0 | 110.9 | A126 H127 Q131 I138 V142 | A126-L129 CarbonylContact O-C 3.59Å; A126-L129 PolarHBondContact O-N 3.28Å; H127-L129 PolarHBondContact O-N 3.28Å; L129-Q131 PolarHBondContact O-N 3.08Å; L129-I138 HydrophobicContact CD1-CG2 3.97Å; L129-I138 HydrophobicContact CD2-CD1 4.26Å; L129-I138 HydrophobicContact CD2-CG1 4.39Å; L129-I138 HydrophobicContact CD2-CG2 3.85Å; L129-I138 HydrophobicContact CG-CG2 4.22Å; L129-V142 HydrophobicContact CD1-CG2 3.28Å |
| 130 | P | 60 | Low | 68.6 | Low | 70 Ų | 70 | 90.2 Ų | 90.2 | 46% | 0.455 | 51% | 0.505 | S | S | . | . | trans | -62 | 135.3 | 164.9 | 16 | -15.5 | 0 | 0 | 0 | 109.5 | G132 T133 L141 | P130-G132 PolarHBondContact O-N 3.36Å; P130-T133 HydrophobicContact CB-CG2 4.38Å; P130-T133 HydrophobicContact CG-CG2 3.73Å; P130-T133 WeakPolarHBondContact O-CG2 3.48Å; P130-L141 HydrophobicContact CG-CD1 3.78Å; P130-L141 HydrophobicContact CG-CD2 4.02Å | ||
| 131 | Q | 60.7 | Low | 69.3 | Low | 199 Ų | 199 | 88.3 Ų | 88.3 | 93% | 0.93 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | 130.1 | -178.8 | -62 | -151.9 | 0.4 | 0 | 0 | 110.5 | L129 | L129-Q131 PolarHBondContact O-N 3.08Š|
| 132 | G | 62.2 | Low | 70.1 | Confident | 82 Ų | 82 | 85.2 Ų | 85.2 | 85% | 0.845 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 99.5 | 10.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | P130 | P130-G132 PolarHBondContact O-N 3.36Š|
| 133 | T | 71.1 | Confident | 71.1 | Confident | 35 Ų | 35 | 80.7 Ų | 80.7 | 22% | 0.215 | 47% | 0.469 | C | S | . | . | trans | -72.4 | 134 | 175.8 | 54 | 0 | 0 | 0 | 0 | 112.1 | P130 L141 | P130-T133 HydrophobicContact CB-CG2 4.38Å; P130-T133 HydrophobicContact CG-CG2 3.73Å; P130-T133 WeakPolarHBondContact O-CG2 3.48Å; T133-L141 HydrophobicContact CG2-CD1 3.8Å | ||
| 134 | P | 73.8 | Confident | 72.1 | Confident | 77 Ų | 77 | 80.4 Ų | 80.4 | 50% | 0.5 | 47% | 0.466 | S | S | . | . | trans | -65 | 139.6 | 176.8 | 28.2 | -34.7 | 0 | 0 | 0 | 111 | P136 L137 | P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.41Å; P134-P136 VanDerWaalsContact O-N 3.11Å; P134-L137 HydrophobicContact CG-CB 4.43Å; P134-L137 HydrophobicContact CG-CD1 3.76Å; P134-L137 HydrophobicContact CG-CG 4.22Å; P134-L137 PolarHBondContact O-N 3.19Å | ||
| 135 | T | 75.7 | Confident | 73 | Confident | 118 Ų | 118 | 82.7 Ų | 82.7 | 72% | 0.724 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -48.3 | -36 | -172.6 | 48.4 | 0 | 0 | 0 | 0 | 116.9 | I138 | T135-I138 HydrophobicContact CG2-CD1 4.44Š|
| 136 | P | 81.8 | Confident | 73.9 | Confident | 106 Ų | 106 | 80.7 Ų | 80.7 | 69% | 0.688 | 47% | 0.466 | S | S | * | . | G | 310 helix | trans | -74.4 | -22.9 | 179 | 26.4 | -34.6 | 0 | 0 | 0 | 114.7 | P134 | P134-P136 VanDerWaalsContact C-N 3.35Å; P134-P136 WeakPolarHBondContact O-CD 3.41Å; P134-P136 VanDerWaalsContact O-N 3.11Å |
| 137 | L | 79.6 | Confident | 75 | Confident | 105 Ų | 105 | 82.3 Ų | 82.3 | 55% | 0.55 | 47% | 0.466 | S | S | . | . | G | 310 helix | trans | -87.6 | -11.2 | -177.7 | -66.3 | 177.8 | 0 | 0 | 0 | 113.3 | P134 M140 L141 | P134-L137 HydrophobicContact CG-CB 4.43Å; P134-L137 HydrophobicContact CG-CD1 3.76Å; P134-L137 HydrophobicContact CG-CG 4.22Å; P134-L137 PolarHBondContact O-N 3.19Å; L137-M140 PolarHBondContact O-N 3.33Å; L137-L141 PolarHBondContact O-N 3.44Å; L137-L141 VanDerWaalsContact O-N 3.11Å |
| 138 | I | 78.6 | Confident | 75.9 | Confident | 48 Ų | 48 | 79.5 Ų | 79.5 | 25% | 0.246 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -56.3 | -48.9 | -175.5 | -64.4 | 178 | 0 | 0 | 0 | 112.6 | L129 T135 M140 L141 V142 | L129-I138 HydrophobicContact CD1-CG2 3.97Å; L129-I138 HydrophobicContact CD2-CD1 4.26Å; L129-I138 HydrophobicContact CD2-CG1 4.39Å; L129-I138 HydrophobicContact CD2-CG2 3.85Å; L129-I138 HydrophobicContact CG-CG2 4.22Å; T135-I138 HydrophobicContact CG2-CD1 4.44Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 3.35Å; I138-L141 PolarHBondContact O-N 3.31Å; I138-V142 HydrophobicContact CG2-CG2 4.48Å; I138-V142 WeakPolarHBondContact O-CG2 3.36Å; I138-V142 PolarHBondContact O-N 3.24Å; I138-V142 VanDerWaalsContact O-N 3.15Å |
| 139 | P | 78.9 | Confident | 76.9 | Confident | 84 Ų | 84 | 79.8 Ų | 79.8 | 55% | 0.545 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -64.2 | -36.9 | -176 | -21.2 | 33.8 | 0 | 0 | 0 | 112.8 | I143 | P139-I143 WeakPolarHBondContact O-CG1 3.36Å; P139-I143 PolarHBondContact O-N 3.41Å |
| 140 | M | 82.4 | Confident | 77.8 | Confident | 114 Ų | 114 | 82 Ų | 82 | 56% | 0.562 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -70 | -40.7 | 178.9 | -173.4 | 63.8 | -172.5 | 0 | 0 | 111.6 | L137 I138 I143 I144 | L137-M140 PolarHBondContact O-N 3.33Å; I138-M140 VanDerWaalsContact C-N 3.32Å; I138-M140 PolarHBondContact O-N 3.35Å; M140-I143 PolarHBondContact O-N 3.17Å; M140-I144 HydrophobicContact CE-CD1 3.95Å; M140-I144 HydrophobicContact CE-CG1 4.17Å; M140-I144 HydrophobicContact CG-CD1 4.09Å; M140-I144 WeakPolarHBondContact O-CG1 2.98Å; M140-I144 PolarHBondContact O-N 3.42Å; M140-I144 VanDerWaalsContact O-N 3.1Å |
| 141 | L | 83.9 | Confident | 79 | Confident | 48 Ų | 48 | 83.4 Ų | 83.4 | 25% | 0.251 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65.9 | -41.2 | -178.8 | -167.5 | 151.5 | 0 | 0 | 0 | 111.9 | F128 P130 T133 L137 I138 I143 I144 E145 | F128-L141 WeakPolarHBondContact O-CD2 3.29Å; P130-L141 HydrophobicContact CG-CD1 3.78Å; P130-L141 HydrophobicContact CG-CD2 4.02Å; T133-L141 HydrophobicContact CG2-CD1 3.8Å; L137-L141 PolarHBondContact O-N 3.44Å; L137-L141 VanDerWaalsContact O-N 3.11Å; I138-L141 PolarHBondContact O-N 3.31Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 3.38Å; L141-I144 PolarHBondContact O-N 2.89Å; L141-E145 WeakPolarHBondContact O-CB 3.3Å; L141-E145 PolarHBondContact O-N 3.05Å |
| 142 | V | 80.6 | Confident | 80 | Confident | 46 Ų | 46 | 77.3 Ų | 77.3 | 28% | 0.279 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -59.7 | -41.5 | 176.1 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | L129 I138 E145 T146 | L129-V142 HydrophobicContact CD1-CG2 3.28Å; I138-V142 HydrophobicContact CG2-CG2 4.48Å; I138-V142 WeakPolarHBondContact O-CG2 3.36Å; I138-V142 PolarHBondContact O-N 3.24Å; I138-V142 VanDerWaalsContact O-N 3.15Å; V142-E145 PolarHBondContact O-N 3.46Å; V142-T146 HydrophobicContact CG1-CG2 4.35Å; V142-T146 WeakPolarHBondContact O-CB 3.41Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.32Å; V142-T146 PolarHBondContact O-N 3.02Å; V142-T146 PolarHBondContact O-OG1 2.77Å |
| 143 | I | 84.4 | Confident | 80.8 | Confident | 92 Ų | 92 | 73.9 Ų | 73.9 | 47% | 0.472 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -63.5 | -44.1 | 177.2 | -66.2 | 167.4 | 0 | 0 | 0 | 110.5 | P139 M140 L141 T146 I147 | P139-I143 WeakPolarHBondContact O-CG1 3.36Å; P139-I143 PolarHBondContact O-N 3.41Å; M140-I143 PolarHBondContact O-N 3.17Å; L141-I143 VanDerWaalsContact C-N 3.29Å; L141-I143 PolarHBondContact O-N 3.38Å; I143-T146 WeakPolarHBondContact CA-OG1 3.43Å; I143-T146 PolarHBondContact O-OG1 3.01Å; I143-I147 HydrophobicContact CG2-CD1 3.77Å; I143-I147 WeakPolarHBondContact O-CB 3.3Å; I143-I147 WeakPolarHBondContact O-CD1 3.34Å; I143-I147 VanDerWaalsContact O-CG1 3.22Å; I143-I147 WeakPolarHBondContact O-CG1 3.25Å; I143-I147 PolarHBondContact O-N 3.02Å |
| 144 | I | 85.3 | Confident | 81.3 | Confident | 92 Ų | 92 | 75.9 Ų | 75.9 | 47% | 0.472 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -65.4 | -43.3 | 179.2 | -64.7 | 165.1 | 0 | 0 | 0 | 111.2 | M140 L141 I147 S148 | M140-I144 HydrophobicContact CE-CD1 3.95Å; M140-I144 HydrophobicContact CE-CG1 4.17Å; M140-I144 HydrophobicContact CG-CD1 4.09Å; M140-I144 WeakPolarHBondContact O-CG1 2.98Å; M140-I144 PolarHBondContact O-N 3.42Å; M140-I144 VanDerWaalsContact O-N 3.1Å; L141-I144 PolarHBondContact O-N 2.89Å; I144-I147 PolarHBondContact O-N 3.11Å; I144-S148 WeakPolarHBondContact O-CB 3.27Å; I144-S148 PolarHBondContact O-N 2.97Å |
| 145 | E | 83.3 | Confident | 81.8 | Confident | 65 Ų | 65 | 74.2 Ų | 74.2 | 30% | 0.304 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -67.5 | -39.7 | -178.7 | -166.3 | 60.3 | -154.6 | 0 | 0 | 111.7 | F128 L141 V142 I147 S148 L149 | F128-E145 HydrophobicContact CD1-CB 4.25Å; F128-E145 HydrophobicContact CD1-CG 3.86Å; L141-E145 WeakPolarHBondContact O-CB 3.3Å; L141-E145 PolarHBondContact O-N 3.05Å; V142-E145 PolarHBondContact O-N 3.46Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 2.7Å; E145-S148 WeakPolarHBondContact O-CB 3.21Å; E145-S148 PolarHBondContact O-N 3.26Å; E145-L149 WeakPolarHBondContact O-CB 3.31Å; E145-L149 PolarHBondContact O-N 2.92Å |
| 146 | T | 80.8 | Confident | 82 | Confident | 52 Ų | 52 | 69 Ų | 69 | 32% | 0.319 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.5 | -39 | 173.9 | 52.2 | 0 | 0 | 0 | 0 | 112.2 | F128 V142 I143 L150 | F128-T146 HydrophobicContact CD1-CG2 4.17Å; F128-T146 HydrophobicContact CE1-CG2 3.95Å; F128-T146 HydrophobicContact CZ-CG2 4.43Å; V142-T146 HydrophobicContact CG1-CG2 4.35Å; V142-T146 WeakPolarHBondContact O-CB 3.41Å; V142-T146 VanDerWaalsContact O-CG2 3.26Å; V142-T146 WeakPolarHBondContact O-CG2 3.32Å; V142-T146 PolarHBondContact O-N 3.02Å; V142-T146 PolarHBondContact O-OG1 2.77Å; I143-T146 WeakPolarHBondContact CA-OG1 3.43Å; I143-T146 PolarHBondContact O-OG1 3.01Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 3.29Å |
| 147 | I | 84.8 | Confident | 82 | Confident | 85 Ų | 85 | 63.9 Ų | 63.9 | 44% | 0.436 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -67 | -43.7 | 173.8 | -68.3 | 167 | 0 | 0 | 0 | 110.9 | I143 I144 E145 L149 L150 I151 | I143-I147 HydrophobicContact CG2-CD1 3.77Å; I143-I147 WeakPolarHBondContact O-CB 3.3Å; I143-I147 WeakPolarHBondContact O-CD1 3.34Å; I143-I147 VanDerWaalsContact O-CG1 3.22Å; I143-I147 WeakPolarHBondContact O-CG1 3.25Å; I143-I147 PolarHBondContact O-N 3.02Å; I144-I147 PolarHBondContact O-N 3.11Å; E145-I147 VanDerWaalsContact C-N 3.34Å; E145-I147 PolarHBondContact O-N 2.7Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 2.96Å; I147-L150 PolarHBondContact O-N 3Å; I147-L150 VanDerWaalsContact O-N 3.16Å; I147-I151 HydrophobicContact CG2-CD1 3.46Å; I147-I151 VanDerWaalsContact CG2-CD1 3.46Å; I147-I151 HydrophobicContact CG2-CG1 4.13Å; I147-I151 WeakPolarHBondContact O-CG1 3.36Å; I147-I151 PolarHBondContact O-N 3.47Å |
| 148 | S | 82.9 | Confident | 82.3 | Confident | 52 Ų | 52 | 61.8 Ų | 61.8 | 36% | 0.364 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -57.4 | -46.4 | 178.2 | -176.8 | 0 | 0 | 0 | 0 | 111.7 | I144 E145 L150 I151 Q152 | I144-S148 WeakPolarHBondContact O-CB 3.27Å; I144-S148 PolarHBondContact O-N 2.97Å; E145-S148 WeakPolarHBondContact O-CB 3.21Å; E145-S148 PolarHBondContact O-N 3.26Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.32Å; S148-I151 PolarHBondContact O-N 3.27Å; S148-Q152 PolarHBondContact O-N 3.08Å; S148-Q152 VanDerWaalsContact O-N 3.11Å |
| 149 | L | 81.9 | Confident | 82.7 | Confident | 43 Ų | 43 | 64.4 Ų | 64.4 | 23% | 0.225 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60.3 | -36.5 | 177.4 | -174.1 | 120.3 | 0 | 0 | 0 | 112.3 | W109 F128 E145 I147 P153 | W109-L149 HydrophobicContact CH2-CD2 4.18Å; W109-L149 HydrophobicContact CZ2-CD2 3.48Å; W109-L149 VanDerWaalsContact CZ2-CD2 3.48Å; W109-L149 HydrophobicContact CZ2-CG 3.91Å; W109-L149 VanDerWaalsContact CZ2-O 3.3Å; W109-L149 WeakPolarHBondContact CZ2-O 3.33Å; W109-L149 PolarHBondContact NE1-O 2.93Å; F128-L149 HydrophobicContact CE1-CD1 4.45Å; E145-L149 WeakPolarHBondContact O-CB 3.31Å; E145-L149 PolarHBondContact O-N 2.92Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 2.96Å; L149-P153 WeakPolarHBondContact O-CD 3.33Å |
| 150 | L | 81.8 | Confident | 82.7 | Confident | 109 Ų | 109 | 60.4 Ų | 60.4 | 57% | 0.571 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -77.7 | -35.3 | 177.4 | -71.3 | 173.5 | 0 | 0 | 0 | 113.6 | W109 T146 I147 S148 P153 | W109-L150 HydrophobicContact CH2-CD2 3.75Å; W109-L150 HydrophobicContact CZ2-CD2 4.26Å; T146-L150 WeakPolarHBondContact O-CG 3.47Å; T146-L150 PolarHBondContact O-N 3.29Å; I147-L150 PolarHBondContact O-N 3Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 VanDerWaalsContact C-N 3.29Å; S148-L150 PolarHBondContact O-N 3.32Å; L150-P153 WeakPolarHBondContact O-CD 3.47Å; L150-P153 WeakPolarHBondContact O-CG 3.38Å |
| 151 | I | 84.4 | Confident | 82.8 | Confident | 100 Ų | 100 | 55.6 Ų | 55.6 | 51% | 0.513 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -73.1 | -31.8 | -179.1 | -69.2 | 173.7 | 0 | 0 | 0 | 111.2 | I147 S148 M154 A155 | I147-I151 HydrophobicContact CG2-CD1 3.46Å; I147-I151 VanDerWaalsContact CG2-CD1 3.46Å; I147-I151 HydrophobicContact CG2-CG1 4.13Å; I147-I151 WeakPolarHBondContact O-CG1 3.36Å; I147-I151 PolarHBondContact O-N 3.47Å; S148-I151 PolarHBondContact O-N 3.27Å; I151-M154 WeakPolarHBondContact O-CB 3.13Å; I151-M154 PolarHBondContact O-N 2.95Å; I151-M154 VanDerWaalsContact O-N 3.11Å; I151-A155 HydrophobicContact CG2-CB 4.44Å; I151-A155 WeakPolarHBondContact O-CB 3.05Å; I151-A155 PolarHBondContact O-N 3.08Å |
| 152 | Q | 82.1 | Confident | 82.8 | Confident | 71 Ų | 71 | 55.3 Ų | 55.3 | 33% | 0.332 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -50.5 | -52.7 | -177.8 | -108.7 | 174.8 | -16.9 | 0 | 0 | 116.1 | S148 M154 A155 L156 Y221 | S148-Q152 PolarHBondContact O-N 3.08Å; S148-Q152 VanDerWaalsContact O-N 3.11Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 2.91Å; Q152-A155 PolarHBondContact O-N 3.14Å; Q152-L156 WeakPolarHBondContact O-CB 3.23Å; Q152-L156 PolarHBondContact O-N 2.86Å; Q152-Y221 HydrophobicContact CG-CE1 4.41Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.5Å; Q152-Y221 PolarHBondContact NE2-OH 2.76Å; Q152-Y221 PolarHBondContact OE1-OH 3.34Å |
| 153 | P | 77.9 | Confident | 83.1 | Confident | 9 Ų | 9 | 56 Ų | 56 | 6% | 0.058 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.4 | -34 | 178.5 | 24.2 | -34.7 | 0 | 0 | 0 | 112.2 | W109 L149 L150 A157 | W109-P153 HydrophobicContact CB-CB 3.88Å; W109-P153 HydrophobicContact CB-CG 4.38Å; W109-P153 HydrophobicContact CD2-CB 4.27Å; W109-P153 HydrophobicContact CD2-CG 3.78Å; W109-P153 HydrophobicContact CE3-CG 4.31Å; W109-P153 HydrophobicContact CG-CB 3.81Å; W109-P153 HydrophobicContact CG-CG 3.79Å; L149-P153 WeakPolarHBondContact O-CD 3.33Å; L150-P153 WeakPolarHBondContact O-CD 3.47Å; L150-P153 WeakPolarHBondContact O-CG 3.38Å; P153-A157 PolarHBondContact O-N 3.48Å; P153-A157 VanDerWaalsContact O-N 3.17Å |
| 154 | M | 82.6 | Confident | 83.1 | Confident | 78 Ų | 78 | 51.9 Ų | 51.9 | 38% | 0.384 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -67 | -46 | 175 | -169.7 | 66.3 | -171.9 | 0 | 0 | 111 | L98 L102 I151 Q152 L156 A157 V158 | L98-M154 HydrophobicContact CD2-CE 4.07Å; L102-M154 HydrophobicContact CD1-SD 3.44Å; L102-M154 WeakPolarHBondContact CD1-SD 3.42Å; L102-M154 HydrophobicContact CD2-SD 4.19Å; L102-M154 HydrophobicContact CG-SD 4.46Å; I151-M154 WeakPolarHBondContact O-CB 3.13Å; I151-M154 PolarHBondContact O-N 2.95Å; I151-M154 VanDerWaalsContact O-N 3.11Å; Q152-M154 VanDerWaalsContact C-N 3.28Å; Q152-M154 PolarHBondContact O-N 2.91Å; M154-L156 VanDerWaalsContact C-N 3.28Å; M154-L156 PolarHBondContact O-N 3.48Å; M154-A157 PolarHBondContact O-N 3.47Å; M154-V158 HydrophobicContact CE-CG2 4.03Å; M154-V158 HydrophobicContact CG-CG2 4.45Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.14Å; M154-V158 PolarHBondContact O-N 3.36Å |
| 155 | A | 84 | Confident | 83.2 | Confident | 41 Ų | 41 | 49.2 Ų | 49.2 | 34% | 0.339 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.6 | -37 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I151 Q152 R159 | I151-A155 HydrophobicContact CG2-CB 4.44Å; I151-A155 WeakPolarHBondContact O-CB 3.05Å; I151-A155 PolarHBondContact O-N 3.08Å; Q152-A155 PolarHBondContact O-N 3.14Å; A155-R159 VanDerWaalsContact O-CB 3.32Å; A155-R159 WeakPolarHBondContact O-CB 3.29Å; A155-R159 PolarHBondContact O-N 2.87Å |
| 156 | L | 79 | Confident | 83.4 | Confident | 8 Ų | 8 | 48.8 Ų | 48.8 | 4% | 0.042 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 174.7 | -165.5 | 89.1 | 0 | 0 | 0 | 111.8 | A105 Q152 M154 R159 L160 F214 L217 V218 | A105-L156 HydrophobicContact CB-CD2 4.37Å; Q152-L156 WeakPolarHBondContact O-CB 3.23Å; Q152-L156 PolarHBondContact O-N 2.86Å; M154-L156 VanDerWaalsContact C-N 3.28Å; M154-L156 PolarHBondContact O-N 3.48Å; L156-R159 PolarHBondContact O-N 2.83Å; L156-L160 PolarHBondContact O-N 2.9Å; L156-F214 HydrophobicContact CD1-CD2 4.27Å; L156-F214 HydrophobicContact CD1-CG 4.49Å; L156-F214 HydrophobicContact CD2-CD1 4.04Å; L156-F214 HydrophobicContact CD2-CD2 3.32Å; L156-F214 HydrophobicContact CD2-CE1 3.9Å; L156-F214 HydrophobicContact CD2-CE2 3.15Å; L156-F214 HydrophobicContact CD2-CG 3.78Å; L156-F214 HydrophobicContact CD2-CZ 3.47Å; L156-F214 VanDerWaalsContact CD2-CZ 3.47Å; L156-F214 HydrophobicContact CG-CD2 3.48Å; L156-F214 VanDerWaalsContact CG-CD2 3.48Å; L156-F214 HydrophobicContact CG-CE2 3.7Å; L156-F214 HydrophobicContact CG-CG 4.12Å; L156-F214 HydrophobicContact CG-CZ 4.47Å; L156-L217 HydrophobicContact CD1-CB 3.89Å; L156-L217 HydrophobicContact CD1-CD1 3.35Å; L156-L217 HydrophobicContact CD1-CG 4.25Å; L156-V218 HydrophobicContact CD2-CG2 4.43Å |
| 157 | A | 82.3 | Confident | 83.7 | Confident | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.9 | -44.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L98 N101 L102 A105 P153 M154 R159 L160 T161 | L98-A157 HydrophobicContact CD1-CB 4.39Å; N101-A157 HydrophobicContact CB-CB 3.94Å; N101-A157 PolarHBondContact ND2-O 3.47Å; L102-A157 HydrophobicContact CB-CB 4.44Å; L102-A157 HydrophobicContact CD1-CB 4.13Å; A105-A157 HydrophobicContact CB-CB 4.22Å; P153-A157 PolarHBondContact O-N 3.48Å; P153-A157 VanDerWaalsContact O-N 3.17Å; M154-A157 PolarHBondContact O-N 3.47Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.17Å; A157-L160 PolarHBondContact O-N 3.45Å; A157-T161 PolarHBondContact O-N 3.32Å; A157-T161 VanDerWaalsContact O-N 3.13Å; A157-T161 PolarHBondContact O-OG1 3.2Å |
| 158 | V | 86.1 | Confident | 83.9 | Confident | 61 Ų | 61 | 44 Ų | 44 | 37% | 0.37 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -63.6 | -38.6 | 177.4 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | L98 M154 L160 T161 A162 | L98-V158 HydrophobicContact CD1-CG2 3.93Å; M154-V158 HydrophobicContact CE-CG2 4.03Å; M154-V158 HydrophobicContact CG-CG2 4.45Å; M154-V158 VanDerWaalsContact O-CG2 3.3Å; M154-V158 WeakPolarHBondContact O-CG2 3.14Å; M154-V158 PolarHBondContact O-N 3.36Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.02Å; V158-T161 WeakPolarHBondContact CA-OG1 3.25Å; V158-T161 PolarHBondContact O-N 3Å; V158-T161 PolarHBondContact O-OG1 3.38Å; V158-A162 WeakPolarHBondContact O-CB 3.42Å; V158-A162 PolarHBondContact O-N 3Å |
| 159 | R | 86.2 | Confident | 84.1 | Confident | 102 Ų | 102 | 43.5 Ų | 43.5 | 39% | 0.385 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -61.5 | -42.5 | 177.6 | -168.1 | -173.3 | -60.6 | 160.4 | 1.5 | 111.7 | A155 L156 A157 N163 Q210 | A155-R159 VanDerWaalsContact O-CB 3.32Å; A155-R159 WeakPolarHBondContact O-CB 3.29Å; A155-R159 PolarHBondContact O-N 2.87Å; L156-R159 PolarHBondContact O-N 2.83Å; A157-R159 VanDerWaalsContact C-N 3.34Å; A157-R159 PolarHBondContact O-N 3.17Å; R159-N163 WeakPolarHBondContact O-CB 3.38Å; R159-N163 VanDerWaalsContact O-CG 3.29Å; R159-N163 PolarHBondContact O-N 3.33Å; R159-N163 PolarHBondContact O-ND2 2.92Å; R159-Q210 VanDerWaalsContact C-NE2 3.28Å; R159-Q210 VanDerWaalsContact CG-NE2 3.32Å |
| 160 | L | 80.2 | Confident | 84.5 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -66.3 | -45.1 | 178.9 | -174.1 | 73.5 | 0 | 0 | 0 | 110.7 | I79 T95 N101 L156 A157 V158 I164 Q210 | I79-L160 HydrophobicContact CG2-CD1 3.95Å; I79-L160 HydrophobicContact CG2-CD2 4.22Å; T95-L160 HydrophobicContact CG2-CD2 4.31Å; N101-L160 HydrophobicContact CB-CD2 4.27Å; N101-L160 WeakPolarHBondContact ND2-CB 3.43Å; N101-L160 VanDerWaalsContact ND2-CD2 3.33Å; N101-L160 WeakPolarHBondContact ND2-CD2 3.26Å; N101-L160 WeakPolarHBondContact ND2-CG 3.44Å; N101-L160 WeakPolarHBondContact OD1-CD2 3.38Å; L156-L160 PolarHBondContact O-N 2.9Å; A157-L160 PolarHBondContact O-N 3.45Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 3.02Å; L160-I164 HydrophobicContact CD1-CD1 4.02Å; L160-I164 HydrophobicContact CG-CD1 4.17Å; L160-I164 WeakPolarHBondContact O-CG1 3.08Å; L160-I164 PolarHBondContact O-N 3.17Å; L160-Q210 VanDerWaalsContact CA-NE2 3.3Å; L160-Q210 HydrophobicContact CB-CG 4.38Å; L160-Q210 HydrophobicContact CD1-CB 4.31Å; L160-Q210 HydrophobicContact CD1-CG 3.32Å; L160-Q210 HydrophobicContact CG-CG 4.43Å |
| 161 | T | 84.3 | Confident | 84.9 | Confident | 14 Ų | 14 | 41.3 Ų | 41.3 | 9% | 0.086 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.9 | -46.3 | 178.1 | 48.2 | 0 | 0 | 0 | 0 | 112.3 | T96 L98 N101 A157 V158 N163 I164 T165 | T96-T161 WeakPolarHBondContact O-CG2 3.23Å; L98-T161 VanDerWaalsContact CA-CG2 3.43Å; L98-T161 HydrophobicContact CB-CG2 4.01Å; L98-T161 HydrophobicContact CD1-CG2 3.97Å; N101-T161 HydrophobicContact CB-CG2 4.3Å; N101-T161 WeakPolarHBondContact ND2-CG2 3.29Å; N101-T161 PolarHBondContact ND2-N 3.41Å; A157-T161 PolarHBondContact O-N 3.32Å; A157-T161 VanDerWaalsContact O-N 3.13Å; A157-T161 PolarHBondContact O-OG1 3.2Å; V158-T161 WeakPolarHBondContact CA-OG1 3.25Å; V158-T161 PolarHBondContact O-N 3Å; V158-T161 PolarHBondContact O-OG1 3.38Å; T161-N163 PolarHBondContact O-N 2.96Å; T161-I164 PolarHBondContact O-N 3.38Å; T161-T165 VanDerWaalsContact O-CB 3.29Å; T161-T165 WeakPolarHBondContact O-CB 3.3Å; T161-T165 WeakPolarHBondContact O-CG2 3.4Å; T161-T165 PolarHBondContact O-N 2.95Å; T161-T165 PolarHBondContact O-OG1 3.41Å |
| 162 | A | 84 | Confident | 85.1 | Confident | 42 Ų | 42 | 40.8 Ų | 40.8 | 35% | 0.347 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -63.9 | -44.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | V158 T165 A166 | V158-A162 WeakPolarHBondContact O-CB 3.42Å; V158-A162 PolarHBondContact O-N 3Å; A162-T165 PolarHBondContact O-OG1 3.25Å; A162-A166 WeakPolarHBondContact O-CB 3.23Å; A162-A166 PolarHBondContact O-N 3.05Å |
| 163 | N | 87.6 | Confident | 85.5 | Confident | 60 Ų | 60 | 41.8 Ų | 41.8 | 32% | 0.321 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.9 | -48.2 | -179.3 | -69.4 | -6.4 | 0 | 0 | 0 | 111.5 | R159 T161 G167 V206 | R159-N163 WeakPolarHBondContact O-CB 3.38Å; R159-N163 VanDerWaalsContact O-CG 3.29Å; R159-N163 PolarHBondContact O-N 3.33Å; R159-N163 PolarHBondContact O-ND2 2.92Å; T161-N163 PolarHBondContact O-N 2.96Å; N163-G167 PolarHBondContact O-N 3.22Å; N163-V206 HydrophobicContact CB-CG1 4.08Å |
| 164 | I | 84.4 | Confident | 86.1 | Confident | 5 Ų | 5 | 43 Ų | 43 | 3% | 0.026 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -70.8 | -41.3 | -176.9 | -59.3 | 171.8 | 0 | 0 | 0 | 111.2 | N83 T93 T95 T96 L160 T161 H168 | N83-I164 HydrophobicContact CB-CD1 4.35Å; N83-I164 VanDerWaalsContact CG-CD1 3.45Å; N83-I164 WeakPolarHBondContact OD1-CD1 3.36Å; T93-I164 HydrophobicContact CG2-CG2 4.26Å; T95-I164 VanDerWaalsContact OG1-CD1 3.3Å; T95-I164 WeakPolarHBondContact OG1-CD1 3.26Å; T96-I164 HydrophobicContact CG2-CB 4.4Å; T96-I164 HydrophobicContact CG2-CG2 3.68Å; L160-I164 HydrophobicContact CD1-CD1 4.02Å; L160-I164 HydrophobicContact CG-CD1 4.17Å; L160-I164 WeakPolarHBondContact O-CG1 3.08Å; L160-I164 PolarHBondContact O-N 3.17Å; T161-I164 PolarHBondContact O-N 3.38Å; I164-H168 WeakPolarHBondContact O-CB 3.48Å; I164-H168 PolarHBondContact O-CD2 3.29Å; I164-H168 VanDerWaalsContact O-CD2 3.27Å; I164-H168 PolarHBondContact O-N 3.07Å; I164-H168 VanDerWaalsContact O-N 3.08Å |
| 165 | T | 87 | Confident | 86.5 | Confident | 37 Ų | 37 | 40.4 Ų | 40.4 | 23% | 0.227 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -65.6 | -47 | 177.3 | 53.2 | 0 | 0 | 0 | 0 | 111.8 | F9 T96 T161 A162 H168 L169 | F9-T165 HydrophobicContact CD1-CG2 4.44Å; F9-T165 HydrophobicContact CE1-CG2 4.16Å; T96-T165 HydrophobicContact CG2-CG2 3.75Å; T161-T165 VanDerWaalsContact O-CB 3.29Å; T161-T165 WeakPolarHBondContact O-CB 3.3Å; T161-T165 WeakPolarHBondContact O-CG2 3.4Å; T161-T165 PolarHBondContact O-N 2.95Å; T161-T165 PolarHBondContact O-OG1 3.41Å; A162-T165 PolarHBondContact O-OG1 3.25Å; T165-H168 PolarHBondContact O-N 3.23Å; T165-L169 WeakPolarHBondContact O-CB 3.41Å; T165-L169 WeakPolarHBondContact O-CG 3.36Å; T165-L169 PolarHBondContact O-N 3.32Å |
| 166 | A | 86.9 | Confident | 86.7 | Confident | 55 Ų | 55 | 41.1 Ų | 41.1 | 46% | 0.455 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.5 | -44.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | A162 H168 L169 L170 | A162-A166 WeakPolarHBondContact O-CB 3.23Å; A162-A166 PolarHBondContact O-N 3.05Å; A166-H168 PolarHBondContact O-N 2.98Å; A166-L169 PolarHBondContact O-N 3.13Å; A166-L170 VanDerWaalsContact O-CB 3.23Å; A166-L170 WeakPolarHBondContact O-CB 3.22Å; A166-L170 PolarHBondContact O-N 3.17Å |
| 167 | G | 87.6 | Confident | 87.2 | Confident | 5 Ų | 5 | 43 Ų | 43 | 5% | 0.052 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -58.7 | -47.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | N163 L170 M171 E203 | N163-G167 PolarHBondContact O-N 3.22Å; G167-L170 PolarHBondContact O-N 3.44Å; G167-M171 WeakPolarHBondContact O-CG 3.35Å; G167-M171 PolarHBondContact O-N 3.38Å; G167-E203 WeakPolarHBondContact CA-OE2 3.46Å |
| 168 | H | 88 | Confident | 87.6 | Confident | 32 Ų | 32 | 44.1 Ų | 44.1 | 15% | 0.148 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62.8 | -43.6 | 175.7 | -89.5 | -89.9 | 0 | 0 | 0 | 113.5 | F9 G86 I164 T165 A166 L170 M171 H172 | F9-H168 HydrophobicContact CE1-CB 4.11Å; F9-H168 HydrophobicContact CZ-CB 3.83Å; G86-H168 PolarHBondContact O-CE1 2.81Å; G86-H168 PolarHBondContact O-NE2 2.99Å; G86-H168 VanDerWaalsContact O-NE2 3.13Å; I164-H168 WeakPolarHBondContact O-CB 3.48Å; I164-H168 PolarHBondContact O-CD2 3.29Å; I164-H168 VanDerWaalsContact O-CD2 3.27Å; I164-H168 PolarHBondContact O-N 3.07Å; I164-H168 VanDerWaalsContact O-N 3.08Å; T165-H168 PolarHBondContact O-N 3.23Å; A166-H168 PolarHBondContact O-N 2.98Å; H168-L170 VanDerWaalsContact C-N 3.31Å; H168-L170 PolarHBondContact O-N 3.05Å; H168-M171 PolarHBondContact O-N 2.93Å; H168-H172 PolarHBondContact O-N 3.24Å |
| 169 | L | 87.9 | Confident | 87.8 | Confident | 41 Ų | 41 | 47.3 Ų | 47.3 | 22% | 0.215 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -61.5 | -42.4 | 175.5 | -77.9 | 169.2 | 0 | 0 | 0 | 111.3 | F6 F9 T165 A166 H172 L173 | F6-L169 HydrophobicContact CD1-CD2 4.38Å; F6-L169 HydrophobicContact CE1-CD1 4.1Å; F6-L169 HydrophobicContact CE1-CD2 4Å; F6-L169 HydrophobicContact CZ-CD2 4.4Å; F9-L169 HydrophobicContact CE2-CD1 4.47Å; F9-L169 HydrophobicContact CE2-CD2 3.71Å; F9-L169 HydrophobicContact CE2-CG 3.78Å; F9-L169 HydrophobicContact CZ-CD2 4.34Å; F9-L169 HydrophobicContact CZ-CG 3.94Å; T165-L169 WeakPolarHBondContact O-CB 3.41Å; T165-L169 WeakPolarHBondContact O-CG 3.36Å; T165-L169 PolarHBondContact O-N 3.32Å; A166-L169 PolarHBondContact O-N 3.13Å; L169-H172 PolarHBondContact O-N 3.12Å; L169-L173 WeakPolarHBondContact O-CB 3.29Å; L169-L173 VanDerWaalsContact O-CG 3.32Å; L169-L173 WeakPolarHBondContact O-CG 3.3Å; L169-L173 PolarHBondContact O-N 3.01Å |
| 170 | L | 89.9 | Confident | 87.9 | Confident | 75 Ų | 75 | 44.8 Ų | 44.8 | 39% | 0.393 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.8 | -43.4 | -179.3 | -155.9 | 170.7 | 0 | 0 | 0 | 110.8 | A166 G167 H168 H172 L173 I174 L199 | A166-L170 VanDerWaalsContact O-CB 3.23Å; A166-L170 WeakPolarHBondContact O-CB 3.22Å; A166-L170 PolarHBondContact O-N 3.17Å; G167-L170 PolarHBondContact O-N 3.44Å; H168-L170 VanDerWaalsContact C-N 3.31Å; H168-L170 PolarHBondContact O-N 3.05Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 3.34Å; L170-L173 PolarHBondContact O-N 2.76Å; L170-I174 HydrophobicContact CD2-CD1 3.23Å; L170-I174 HydrophobicContact CD2-CG1 3.82Å; L170-I174 PolarHBondContact O-N 3.18Å; L170-L199 HydrophobicContact CB-CD2 4.47Å; L170-L199 HydrophobicContact CD1-CD1 4.01Å; L170-L199 HydrophobicContact CD2-CD1 3.22Å; L170-L199 HydrophobicContact CD2-CD2 3.85Å; L170-L199 HydrophobicContact CD2-CG 4.14Å; L170-L199 HydrophobicContact CG-CD1 4.16Å |
| 171 | M | 90.6 | Very high | 88.3 | Confident | 31 Ų | 31 | 48.2 Ų | 48.2 | 15% | 0.153 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -56.9 | -44.5 | 171.6 | -75.7 | -171.6 | -71.3 | 0 | 0 | 112 | L87 G167 H168 G175 L199 T200 E203 | L87-M171 HydrophobicContact CD2-CE 4.02Å; G167-M171 WeakPolarHBondContact O-CG 3.35Å; G167-M171 PolarHBondContact O-N 3.38Å; H168-M171 PolarHBondContact O-N 2.93Å; M171-G175 PolarHBondContact O-N 3.32Å; M171-L199 HydrophobicContact CB-CD2 4.24Å; M171-L199 HydrophobicContact CG-CD2 3.25Å; M171-T200 HydrophobicContact SD-CG2 3.85Å; M171-E203 HydrophobicContact CE-CG 4.16Å |
| 172 | H | 89.1 | Confident | 88.4 | Confident | 89 Ų | 89 | 51.1 Ų | 51.1 | 41% | 0.412 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -67.9 | -41.1 | 179.6 | -168.6 | -58 | 0 | 0 | 0 | 112.1 | L5 H168 L169 L170 G175 S176 | L5-H172 WeakPolarHBondContact CD2-CE1 3.37Å; L5-H172 WeakPolarHBondContact CD2-ND1 3.38Å; H168-H172 PolarHBondContact O-N 3.24Å; L169-H172 PolarHBondContact O-N 3.12Å; L170-H172 VanDerWaalsContact C-N 3.32Å; L170-H172 PolarHBondContact O-N 3.34Å; H172-G175 PolarHBondContact O-N 2.94Å; H172-S176 WeakPolarHBondContact O-CB 3.42Å; H172-S176 PolarHBondContact O-N 3.35Å; H172-S176 PolarHBondContact O-OG 3.47Å |
| 173 | L | 89.9 | Confident | 88.6 | Confident | 92 Ų | 92 | 55 Ų | 55 | 48% | 0.482 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64 | -48.4 | 178.5 | -74.3 | 171.9 | 0 | 0 | 0 | 111.2 | L5 L169 L170 G175 S176 A177 | L5-L173 HydrophobicContact CD1-CD2 4.11Å; L5-L173 HydrophobicContact CD2-CD2 4.45Å; L169-L173 WeakPolarHBondContact O-CB 3.29Å; L169-L173 VanDerWaalsContact O-CG 3.32Å; L169-L173 WeakPolarHBondContact O-CG 3.3Å; L169-L173 PolarHBondContact O-N 3.01Å; L170-L173 PolarHBondContact O-N 2.76Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 2.88Å; L173-S176 PolarHBondContact O-N 3Å; L173-S176 PolarHBondContact O-OG 3.48Å; L173-A177 WeakPolarHBondContact O-CB 3.47Å; L173-A177 PolarHBondContact O-N 2.99Å |
| 174 | I | 91.1 | Very high | 88.6 | Confident | 35 Ų | 35 | 57.1 Ų | 57.1 | 18% | 0.179 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.3 | -41.3 | 176.5 | -66.5 | 179 | 0 | 0 | 0 | 110.5 | L170 S176 A177 T178 I195 L196 L199 | L170-I174 HydrophobicContact CD2-CD1 3.23Å; L170-I174 HydrophobicContact CD2-CG1 3.82Å; L170-I174 PolarHBondContact O-N 3.18Å; I174-S176 VanDerWaalsContact C-N 3.32Å; I174-S176 PolarHBondContact O-N 3.41Å; I174-A177 WeakPolarHBondContact O-CB 3.29Å; I174-A177 PolarHBondContact O-N 2.89Å; I174-A177 VanDerWaalsContact O-N 3.16Å; I174-T178 HydrophobicContact CG2-CG2 3.96Å; I174-T178 WeakPolarHBondContact O-CG2 3.24Å; I174-T178 PolarHBondContact O-N 3.42Å; I174-I195 HydrophobicContact CD1-CG2 3.98Å; I174-L196 HydrophobicContact CB-CD1 4.24Å; I174-L196 HydrophobicContact CG2-CB 3.95Å; I174-L196 HydrophobicContact CG2-CD1 4.01Å; I174-L199 HydrophobicContact CD1-CD1 4.19Å |
| 175 | G | 90.3 | Very high | 88.8 | Confident | 23 Ų | 23 | 61.4 Ų | 61.4 | 24% | 0.237 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -60.5 | -38.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | M171 H172 L173 T178 L179 | M171-G175 PolarHBondContact O-N 3.32Å; H172-G175 PolarHBondContact O-N 2.94Å; L173-G175 VanDerWaalsContact C-N 3.34Å; L173-G175 PolarHBondContact O-N 2.88Å; G175-T178 PolarHBondContact O-OG1 2.88Å; G175-L179 WeakPolarHBondContact O-CB 3.1Å; G175-L179 PolarHBondContact O-N 3.41Å; G175-L179 VanDerWaalsContact O-N 3.15Å |
| 176 | S | 89.1 | Confident | 88.8 | Confident | 57 Ų | 57 | 66.2 Ų | 66.2 | 40% | 0.399 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -70 | -36.1 | 174.4 | 71.8 | 0 | 0 | 0 | 0 | 112.3 | H172 L173 I174 L179 A180 | H172-S176 WeakPolarHBondContact O-CB 3.42Å; H172-S176 PolarHBondContact O-N 3.35Å; H172-S176 PolarHBondContact O-OG 3.47Å; L173-S176 PolarHBondContact O-N 3Å; L173-S176 PolarHBondContact O-OG 3.48Å; I174-S176 VanDerWaalsContact C-N 3.32Å; I174-S176 PolarHBondContact O-N 3.41Å; S176-L179 PolarHBondContact O-N 3.27Å; S176-A180 WeakPolarHBondContact O-CB 3.41Å; S176-A180 PolarHBondContact O-N 3.44Å |
| 177 | A | 88.6 | Confident | 88.9 | Confident | 47 Ų | 47 | 68 Ų | 68 | 39% | 0.388 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -68.2 | -41.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L173 I174 L179 A180 M181 | L173-A177 WeakPolarHBondContact O-CB 3.47Å; L173-A177 PolarHBondContact O-N 2.99Å; I174-A177 WeakPolarHBondContact O-CB 3.29Å; I174-A177 PolarHBondContact O-N 2.89Å; I174-A177 VanDerWaalsContact O-N 3.16Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 3.33Å; A177-A180 PolarHBondContact O-N 3.46Å; A177-M181 WeakPolarHBondContact O-CB 3.22Å; A177-M181 WeakPolarHBondContact O-CG 3.48Å; A177-M181 PolarHBondContact O-N 3.02Å |
| 178 | T | 90.9 | Very high | 89 | Confident | 23 Ų | 23 | 69.5 Ų | 69.5 | 14% | 0.141 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -62.4 | -40.7 | 177 | 67.1 | 0 | 0 | 0 | 0 | 110.7 | I174 G175 M181 S182 S192 | I174-T178 HydrophobicContact CG2-CG2 3.96Å; I174-T178 WeakPolarHBondContact O-CG2 3.24Å; I174-T178 PolarHBondContact O-N 3.42Å; G175-T178 PolarHBondContact O-OG1 2.88Å; T178-M181 PolarHBondContact O-N 3.47Å; T178-S182 PolarHBondContact O-N 2.98Å; T178-S192 WeakPolarHBondContact CB-OG 3.5Å; T178-S192 WeakPolarHBondContact CG2-OG 3.48Å |
| 179 | L | 89.9 | Confident | 89.2 | Confident | 128 Ų | 128 | 69 Ų | 69 | 67% | 0.67 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -66.1 | -42 | 176.1 | -166.8 | 126.5 | 0 | 0 | 0 | 111.9 | G175 S176 A177 S182 | G175-L179 WeakPolarHBondContact O-CB 3.1Å; G175-L179 PolarHBondContact O-N 3.41Å; G175-L179 VanDerWaalsContact O-N 3.15Å; S176-L179 PolarHBondContact O-N 3.27Å; A177-L179 VanDerWaalsContact C-N 3.3Å; A177-L179 PolarHBondContact O-N 3.33Å; L179-S182 WeakPolarHBondContact O-CB 3.48Å; L179-S182 PolarHBondContact O-N 2.91Å; L179-S182 PolarHBondContact O-OG 2.99Å |
| 180 | A | 89.1 | Confident | 89.3 | Confident | 50 Ų | 50 | 72.5 Ų | 72.5 | 41% | 0.413 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -64.3 | -45.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | S176 A177 S182 T183 | S176-A180 WeakPolarHBondContact O-CB 3.41Å; S176-A180 PolarHBondContact O-N 3.44Å; A177-A180 PolarHBondContact O-N 3.46Å; A180-S182 PolarHBondContact O-N 3.29Å; A180-T183 PolarHBondContact O-N 2.99Å; A180-T183 PolarHBondContact O-OG1 2.85Å |
| 181 | M | 87.4 | Confident | 89.5 | Confident | 72 Ų | 72 | 74 Ų | 74 | 36% | 0.355 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.7 | -25.3 | 177.5 | -67.4 | -76.2 | 114.5 | 0 | 0 | 112.4 | A177 T178 T183 I184 N185 T189 | A177-M181 WeakPolarHBondContact O-CB 3.22Å; A177-M181 WeakPolarHBondContact O-CG 3.48Å; A177-M181 PolarHBondContact O-N 3.02Å; T178-M181 PolarHBondContact O-N 3.47Å; M181-T183 PolarHBondContact O-N 3.3Å; M181-I184 HydrophobicContact CE-CD1 3.8Å; M181-I184 PolarHBondContact O-N 3.47Å; M181-N185 PolarHBondContact O-N 3.33Å; M181-T189 HydrophobicContact CB-CG2 3.87Å; M181-T189 WeakPolarHBondContact O-CG2 3.32Å |
| 182 | S | 88 | Confident | 89.5 | Confident | 75 Ų | 75 | 73.3 Ų | 73.3 | 52% | 0.524 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -60 | -28.5 | 179.6 | 79.6 | 0 | 0 | 0 | 0 | 113.3 | T178 L179 A180 T189 | T178-S182 PolarHBondContact O-N 2.98Å; L179-S182 WeakPolarHBondContact O-CB 3.48Å; L179-S182 PolarHBondContact O-N 2.91Å; L179-S182 PolarHBondContact O-OG 2.99Å; A180-S182 PolarHBondContact O-N 3.29Å; S182-T189 VanDerWaalsContact N-CG2 3.31Å |
| 183 | T | 87.8 | Confident | 89.7 | Confident | 122 Ų | 122 | 74.7 Ų | 74.7 | 75% | 0.748 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.3 | -17 | 178.5 | 66.3 | 0 | 0 | 0 | 0 | 113.4 | A180 M181 | A180-T183 PolarHBondContact O-N 2.99Å; A180-T183 PolarHBondContact O-OG1 2.85Å; M181-T183 PolarHBondContact O-N 3.3Å |
| 184 | I | 87.7 | Confident | 89.9 | Confident | 105 Ų | 105 | 73.8 Ų | 73.8 | 54% | 0.538 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.9 | -65.7 | -173.1 | -56.1 | 172.1 | 0 | 0 | 0 | 110.4 | M181 | M181-I184 HydrophobicContact CE-CD1 3.8Å; M181-I184 PolarHBondContact O-N 3.47Å |
| 185 | N | 87.6 | Confident | 90 | Very high | 96 Ų | 96 | 76.1 Ų | 76.1 | 51% | 0.513 | 44% | 0.443 | S | S | . | . | trans | -151 | 125.2 | -170.5 | -83 | -24.3 | 0 | 0 | 0 | 112.7 | M181 S188 T189 | M181-N185 PolarHBondContact O-N 3.33Å; N185-S188 PolarHBondContact O-N 2.88Å; N185-S188 PolarHBondContact O-OG 3.44Å; N185-T189 VanDerWaalsContact O-CG2 3.28Å; N185-T189 WeakPolarHBondContact O-CG2 3.42Å; N185-T189 PolarHBondContact O-N 2.99Å | ||
| 186 | L | 87.9 | Confident | 90.2 | Very high | 137 Ų | 137 | 76.7 Ų | 76.7 | 72% | 0.717 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -57.4 | -40.4 | 178.1 | -165.2 | 73.3 | 0 | 0 | 0 | 116 | S188 T189 L190 | L186-S188 VanDerWaalsContact C-N 3.34Å; L186-S188 PolarHBondContact O-N 3.12Å; L186-T189 PolarHBondContact O-N 3.34Å; L186-T189 PolarHBondContact O-OG1 2.59Å; L186-L190 PolarHBondContact O-N 3.27Å |
| 187 | P | 89.5 | Confident | 90.4 | Very high | 93 Ų | 93 | 77.6 Ų | 77.6 | 60% | 0.604 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -67.8 | -35 | 179.9 | 23.4 | -32.5 | 0 | 0 | 0 | 112.5 | T189 L190 I191 | P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 3.33Å; P187-L190 PolarHBondContact O-N 3.07Å; P187-I191 WeakPolarHBondContact O-CG1 3.45Å; P187-I191 PolarHBondContact O-N 3.45Å |
| 188 | S | 87.9 | Confident | 90.7 | Very high | 37 Ų | 37 | 81.2 Ų | 81.2 | 26% | 0.259 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -68 | -33.8 | 177.5 | 70.9 | 0 | 0 | 0 | 0 | 112.3 | N185 L186 I191 S192 | N185-S188 PolarHBondContact O-N 2.88Å; N185-S188 PolarHBondContact O-OG 3.44Å; L186-S188 VanDerWaalsContact C-N 3.34Å; L186-S188 PolarHBondContact O-N 3.12Å; S188-I191 PolarHBondContact O-N 3.38Å; S188-S192 PolarHBondContact O-N 3Å |
| 189 | T | 92.2 | Very high | 90.8 | Very high | 21 Ų | 21 | 81.2 Ų | 81.2 | 13% | 0.129 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -69.3 | -41.6 | 179.4 | 65 | 0 | 0 | 0 | 0 | 110.9 | M181 S182 N185 L186 P187 I191 S192 F193 | M181-T189 HydrophobicContact CB-CG2 3.87Å; M181-T189 WeakPolarHBondContact O-CG2 3.32Å; S182-T189 VanDerWaalsContact N-CG2 3.31Å; N185-T189 VanDerWaalsContact O-CG2 3.28Å; N185-T189 WeakPolarHBondContact O-CG2 3.42Å; N185-T189 PolarHBondContact O-N 2.99Å; L186-T189 PolarHBondContact O-N 3.34Å; L186-T189 PolarHBondContact O-OG1 2.59Å; P187-T189 VanDerWaalsContact C-N 3.32Å; P187-T189 PolarHBondContact O-N 3.33Å; T189-I191 VanDerWaalsContact C-N 3.28Å; T189-I191 PolarHBondContact O-N 3.35Å; T189-S192 WeakPolarHBondContact CA-OG 3.13Å; T189-S192 PolarHBondContact O-N 2.8Å; T189-S192 VanDerWaalsContact O-N 3.15Å; T189-S192 PolarHBondContact O-OG 2.97Å; T189-F193 VanDerWaalsContact O-CB 3.29Å; T189-F193 WeakPolarHBondContact O-CB 3.03Å; T189-F193 PolarHBondContact O-N 3.39Å |
| 190 | L | 91.9 | Very high | 90.8 | Very high | 114 Ų | 114 | 77.6 Ų | 77.6 | 60% | 0.597 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -59.5 | -42.3 | 178.9 | -148.5 | 114.1 | 0 | 0 | 0 | 110.9 | L186 P187 F193 T194 | L186-L190 PolarHBondContact O-N 3.27Å; P187-L190 PolarHBondContact O-N 3.07Å; L190-F193 PolarHBondContact O-N 3.34Å; L190-T194 WeakPolarHBondContact O-CG2 3.35Å; L190-T194 PolarHBondContact O-N 3.47Å; L190-T194 PolarHBondContact O-OG1 3.31Å |
| 191 | I | 92.8 | Very high | 91 | Very high | 106 Ų | 106 | 80 Ų | 80 | 54% | 0.544 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -63.7 | -47.1 | 175.1 | -63.2 | 162.9 | 0 | 0 | 0 | 111.1 | P187 S188 T189 F193 T194 I195 | P187-I191 WeakPolarHBondContact O-CG1 3.45Å; P187-I191 PolarHBondContact O-N 3.45Å; S188-I191 PolarHBondContact O-N 3.38Å; T189-I191 VanDerWaalsContact C-N 3.28Å; T189-I191 PolarHBondContact O-N 3.35Å; I191-F193 VanDerWaalsContact C-N 3.26Å; I191-F193 PolarHBondContact O-N 2.95Å; I191-T194 PolarHBondContact O-N 2.86Å; I191-T194 PolarHBondContact O-OG1 3.21Å; I191-I195 HydrophobicContact CG2-CD1 4.22Å; I191-I195 WeakPolarHBondContact O-CG1 3.27Å; I191-I195 PolarHBondContact O-N 2.9Å |
| 192 | S | 91.4 | Very high | 91.2 | Very high | 18 Ų | 18 | 81.4 Ų | 81.4 | 13% | 0.126 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -64.3 | -33.2 | 178.7 | 70.4 | 0 | 0 | 0 | 0 | 112.6 | T178 S188 T189 I195 L196 | T178-S192 WeakPolarHBondContact CB-OG 3.5Å; T178-S192 WeakPolarHBondContact CG2-OG 3.48Å; S188-S192 PolarHBondContact O-N 3Å; T189-S192 WeakPolarHBondContact CA-OG 3.13Å; T189-S192 PolarHBondContact O-N 2.8Å; T189-S192 VanDerWaalsContact O-N 3.15Å; T189-S192 PolarHBondContact O-OG 2.97Å; S192-I195 PolarHBondContact O-N 3.31Å; S192-L196 PolarHBondContact O-N 3.43Å |
| 193 | F | 92.6 | Very high | 91.4 | Very high | 117 Ų | 117 | 78.5 Ų | 78.5 | 51% | 0.513 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -73.2 | -38.5 | 179 | -174.1 | -105.7 | 0 | 0 | 0 | 112.1 | T189 L190 I191 I195 L196 I197 | T189-F193 VanDerWaalsContact O-CB 3.29Å; T189-F193 WeakPolarHBondContact O-CB 3.03Å; T189-F193 PolarHBondContact O-N 3.39Å; L190-F193 PolarHBondContact O-N 3.34Å; I191-F193 VanDerWaalsContact C-N 3.26Å; I191-F193 PolarHBondContact O-N 2.95Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 2.97Å; F193-L196 WeakPolarHBondContact O-CB 3.25Å; F193-L196 PolarHBondContact O-N 3.19Å; F193-I197 HydrophobicContact CD1-CD1 3.78Å; F193-I197 HydrophobicContact CE1-CD1 3.45Å; F193-I197 VanDerWaalsContact CE1-CD1 3.45Å; F193-I197 HydrophobicContact CE1-CG1 4.26Å; F193-I197 HydrophobicContact CZ-CD1 4.07Å; F193-I197 HydrophobicContact CZ-CG1 4.47Å; F193-I197 WeakPolarHBondContact O-CG1 3.45Å; F193-I197 PolarHBondContact O-N 2.91Å |
| 194 | T | 93.8 | Very high | 91.5 | Very high | 74 Ų | 74 | 76.7 Ų | 76.7 | 45% | 0.454 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 173 | 56 | 0 | 0 | 0 | 0 | 111.5 | L190 I191 I197 L198 | L190-T194 WeakPolarHBondContact O-CG2 3.35Å; L190-T194 PolarHBondContact O-N 3.47Å; L190-T194 PolarHBondContact O-OG1 3.31Å; I191-T194 PolarHBondContact O-N 2.86Å; I191-T194 PolarHBondContact O-OG1 3.21Å; T194-I197 PolarHBondContact O-N 2.97Å; T194-L198 PolarHBondContact O-N 3.41Å |
| 195 | I | 94.3 | Very high | 91.7 | Very high | 84 Ų | 84 | 73.8 Ų | 73.8 | 43% | 0.431 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62 | -43.3 | 173.3 | -64.4 | 166.7 | 0 | 0 | 0 | 110.7 | I174 I191 S192 F193 I197 L198 L199 | I174-I195 HydrophobicContact CD1-CG2 3.98Å; I191-I195 HydrophobicContact CG2-CD1 4.22Å; I191-I195 WeakPolarHBondContact O-CG1 3.27Å; I191-I195 PolarHBondContact O-N 2.9Å; S192-I195 PolarHBondContact O-N 3.31Å; F193-I195 VanDerWaalsContact C-N 3.31Å; F193-I195 PolarHBondContact O-N 2.97Å; I195-I197 VanDerWaalsContact C-N 3.35Å; I195-I197 PolarHBondContact O-N 3.49Å; I195-L198 PolarHBondContact O-N 3.26Å; I195-L199 WeakPolarHBondContact O-CB 3.25Å; I195-L199 PolarHBondContact O-N 2.87Å |
| 196 | L | 93.4 | Very high | 91.9 | Very high | 34 Ų | 34 | 71.1 Ų | 71.1 | 18% | 0.178 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -59.2 | -44.3 | 176.8 | -176.1 | 66.2 | 0 | 0 | 0 | 111.8 | I174 S192 F193 L199 T200 | I174-L196 HydrophobicContact CB-CD1 4.24Å; I174-L196 HydrophobicContact CG2-CB 3.95Å; I174-L196 HydrophobicContact CG2-CD1 4.01Å; S192-L196 PolarHBondContact O-N 3.43Å; F193-L196 WeakPolarHBondContact O-CB 3.25Å; F193-L196 PolarHBondContact O-N 3.19Å; L196-L199 PolarHBondContact O-N 3.15Å; L196-T200 WeakPolarHBondContact O-CG2 3.38Å; L196-T200 PolarHBondContact O-N 2.95Å |
| 197 | I | 93.1 | Very high | 91.9 | Very high | 77 Ų | 77 | 64.8 Ų | 64.8 | 40% | 0.395 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 176.3 | -67.7 | 165.6 | 0 | 0 | 0 | 111.3 | F193 T194 I195 L199 T200 I201 | F193-I197 HydrophobicContact CD1-CD1 3.78Å; F193-I197 HydrophobicContact CE1-CD1 3.45Å; F193-I197 VanDerWaalsContact CE1-CD1 3.45Å; F193-I197 HydrophobicContact CE1-CG1 4.26Å; F193-I197 HydrophobicContact CZ-CD1 4.07Å; F193-I197 HydrophobicContact CZ-CG1 4.47Å; F193-I197 WeakPolarHBondContact O-CG1 3.45Å; F193-I197 PolarHBondContact O-N 2.91Å; T194-I197 PolarHBondContact O-N 2.97Å; I195-I197 VanDerWaalsContact C-N 3.35Å; I195-I197 PolarHBondContact O-N 3.49Å; I197-L199 PolarHBondContact O-N 2.88Å; I197-T200 PolarHBondContact O-N 2.8Å; I197-T200 PolarHBondContact O-OG1 3.48Å; I197-I201 HydrophobicContact CG2-CD1 4.1Å; I197-I201 WeakPolarHBondContact O-CG1 3.41Å; I197-I201 PolarHBondContact O-N 3.18Å |
| 198 | L | 94.8 | Very high | 91.9 | Very high | 122 Ų | 122 | 65.9 Ų | 65.9 | 64% | 0.639 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -62.3 | -38.4 | 178.2 | -175.2 | 64.6 | 0 | 0 | 0 | 111.1 | T194 I195 I201 L202 | T194-L198 PolarHBondContact O-N 3.41Å; I195-L198 PolarHBondContact O-N 3.26Å; L198-I201 PolarHBondContact O-N 3.41Å; L198-L202 PolarHBondContact O-N 3.01Å |
| 199 | L | 93.3 | Very high | 92 | Very high | 24 Ų | 24 | 68.7 Ų | 68.7 | 13% | 0.126 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -68.9 | -38.4 | 179.3 | -163 | 116.5 | 0 | 0 | 0 | 112.7 | L170 M171 I174 I195 L196 I197 I201 L202 E203 | L170-L199 HydrophobicContact CB-CD2 4.47Å; L170-L199 HydrophobicContact CD1-CD1 4.01Å; L170-L199 HydrophobicContact CD2-CD1 3.22Å; L170-L199 HydrophobicContact CD2-CD2 3.85Å; L170-L199 HydrophobicContact CD2-CG 4.14Å; L170-L199 HydrophobicContact CG-CD1 4.16Å; M171-L199 HydrophobicContact CB-CD2 4.24Å; M171-L199 HydrophobicContact CG-CD2 3.25Å; I174-L199 HydrophobicContact CD1-CD1 4.19Å; I195-L199 WeakPolarHBondContact O-CB 3.25Å; I195-L199 PolarHBondContact O-N 2.87Å; L196-L199 PolarHBondContact O-N 3.15Å; I197-L199 PolarHBondContact O-N 2.88Å; L199-I201 VanDerWaalsContact C-N 3.32Å; L199-I201 PolarHBondContact O-N 3.36Å; L199-L202 WeakPolarHBondContact O-CB 3.34Å; L199-L202 PolarHBondContact O-N 3.48Å; L199-E203 PolarHBondContact O-N 3.16Å |
| 200 | T | 91.4 | Very high | 91.8 | Very high | 52 Ų | 52 | 68.2 Ų | 68.2 | 32% | 0.319 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -65 | -38.5 | 175.4 | 57.4 | 0 | 0 | 0 | 0 | 111.4 | M171 L196 I197 L202 E203 I204 | M171-T200 HydrophobicContact SD-CG2 3.85Å; L196-T200 WeakPolarHBondContact O-CG2 3.38Å; L196-T200 PolarHBondContact O-N 2.95Å; I197-T200 PolarHBondContact O-N 2.8Å; I197-T200 PolarHBondContact O-OG1 3.48Å; T200-L202 VanDerWaalsContact C-N 3.35Å; T200-E203 PolarHBondContact O-N 3.38Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.4Å; T200-I204 PolarHBondContact O-N 3.16Å |
| 201 | I | 92.8 | Very high | 91.7 | Very high | 101 Ų | 101 | 62.8 Ų | 62.8 | 52% | 0.518 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -62.3 | -44.1 | 173.9 | -65.5 | 166.6 | 0 | 0 | 0 | 110.8 | I197 L198 L199 E203 I204 A205 | I197-I201 HydrophobicContact CG2-CD1 4.1Å; I197-I201 WeakPolarHBondContact O-CG1 3.41Å; I197-I201 PolarHBondContact O-N 3.18Å; L198-I201 PolarHBondContact O-N 3.41Å; L199-I201 VanDerWaalsContact C-N 3.32Å; L199-I201 PolarHBondContact O-N 3.36Å; I201-E203 VanDerWaalsContact C-N 3.34Å; I201-E203 PolarHBondContact O-N 3.27Å; I201-I204 PolarHBondContact O-N 3.44Å; I201-A205 PolarHBondContact O-N 3.02Å; I201-A205 VanDerWaalsContact O-N 3.16Å |
| 202 | L | 91.9 | Very high | 91.5 | Very high | 101 Ų | 101 | 62.7 Ų | 62.7 | 53% | 0.529 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.5 | -45.9 | 176.1 | 179.7 | 68 | 0 | 0 | 0 | 111 | L198 L199 T200 I204 A205 V206 | L198-L202 PolarHBondContact O-N 3.01Å; L199-L202 WeakPolarHBondContact O-CB 3.34Å; L199-L202 PolarHBondContact O-N 3.48Å; T200-L202 VanDerWaalsContact C-N 3.35Å; L202-I204 PolarHBondContact O-N 2.9Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 3.26Å; L202-A205 VanDerWaalsContact O-N 3.12Å; L202-V206 HydrophobicContact CD1-CG2 4.36Å; L202-V206 HydrophobicContact CG-CG2 4.33Å; L202-V206 WeakPolarHBondContact O-CG2 3.5Å; L202-V206 PolarHBondContact O-N 3.48Å |
| 203 | E | 90.8 | Very high | 91.5 | Very high | 14 Ų | 14 | 63.8 Ų | 63.8 | 7% | 0.065 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -66.9 | -36.7 | -176.9 | -162.5 | 64.6 | -161.1 | 0 | 0 | 112.1 | L87 G167 M171 L199 T200 I201 A205 V206 A207 | L87-E203 HydrophobicContact CD1-CG 4.42Å; L87-E203 HydrophobicContact CD2-CB 4.18Å; L87-E203 HydrophobicContact CD2-CG 3.38Å; G167-E203 WeakPolarHBondContact CA-OE2 3.46Å; M171-E203 HydrophobicContact CE-CG 4.16Å; L199-E203 PolarHBondContact O-N 3.16Å; T200-E203 PolarHBondContact O-N 3.38Å; I201-E203 VanDerWaalsContact C-N 3.34Å; I201-E203 PolarHBondContact O-N 3.27Å; E203-A205 VanDerWaalsContact C-N 3.31Å; E203-A205 PolarHBondContact O-N 2.93Å; E203-V206 PolarHBondContact O-N 3.32Å; E203-A207 VanDerWaalsContact O-CB 3.29Å; E203-A207 WeakPolarHBondContact O-CB 3.43Å; E203-A207 PolarHBondContact O-N 3.02Å |
| 204 | I | 90.8 | Very high | 91.2 | Very high | 83 Ų | 83 | 58.2 Ų | 58.2 | 43% | 0.426 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.7 | -43.3 | 171.7 | -67.3 | 164.7 | 0 | 0 | 0 | 110.7 | L84 L87 T200 I201 L202 L208 | L84-I204 HydrophobicContact CD1-CG2 4.28Å; L87-I204 HydrophobicContact CD1-CB 4.2Å; L87-I204 HydrophobicContact CD1-CG1 3.61Å; T200-I204 VanDerWaalsContact O-CG1 3.28Å; T200-I204 WeakPolarHBondContact O-CG1 3.4Å; T200-I204 PolarHBondContact O-N 3.16Å; I201-I204 PolarHBondContact O-N 3.44Å; L202-I204 PolarHBondContact O-N 2.9Å; I204-L208 PolarHBondContact O-N 3.11Å |
| 205 | A | 91.5 | Very high | 90.9 | Very high | 45 Ų | 45 | 54.7 Ų | 54.7 | 37% | 0.372 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -65.4 | -45.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | I201 L202 E203 A207 L208 I209 | I201-A205 PolarHBondContact O-N 3.02Å; I201-A205 VanDerWaalsContact O-N 3.16Å; L202-A205 WeakPolarHBondContact O-CB 3.32Å; L202-A205 PolarHBondContact O-N 3.26Å; L202-A205 VanDerWaalsContact O-N 3.12Å; E203-A205 VanDerWaalsContact C-N 3.31Å; E203-A205 PolarHBondContact O-N 2.93Å; A205-A207 PolarHBondContact O-N 2.92Å; A205-L208 PolarHBondContact O-N 2.97Å; A205-I209 WeakPolarHBondContact O-CB 3.44Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.28Å; A205-I209 PolarHBondContact O-N 3.07Å |
| 206 | V | 91.5 | Very high | 90.6 | Very high | 39 Ų | 39 | 53.6 Ų | 53.6 | 24% | 0.236 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.7 | -42.5 | 178.2 | 173.2 | 0 | 0 | 0 | 0 | 111.1 | N163 L202 E203 L208 I209 Q210 | N163-V206 HydrophobicContact CB-CG1 4.08Å; L202-V206 HydrophobicContact CD1-CG2 4.36Å; L202-V206 HydrophobicContact CG-CG2 4.33Å; L202-V206 WeakPolarHBondContact O-CG2 3.5Å; L202-V206 PolarHBondContact O-N 3.48Å; E203-V206 PolarHBondContact O-N 3.32Å; V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 PolarHBondContact O-N 2.88Å; V206-I209 PolarHBondContact O-N 2.97Å; V206-Q210 WeakPolarHBondContact O-CB 3.06Å; V206-Q210 PolarHBondContact O-N 3.23Å |
| 207 | A | 88.9 | Confident | 90.2 | Very high | 4 Ų | 4 | 53.7 Ų | 53.7 | 3% | 0.033 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -57.3 | -41.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | N83 L87 E203 A205 A211 | N83-A207 HydrophobicContact CB-CB 3.92Å; N83-A207 PolarHBondContact ND2-O 3.43Å; L87-A207 HydrophobicContact CD1-CB 4.09Å; E203-A207 VanDerWaalsContact O-CB 3.29Å; E203-A207 WeakPolarHBondContact O-CB 3.43Å; E203-A207 PolarHBondContact O-N 3.02Å; A205-A207 PolarHBondContact O-N 2.92Å; A207-A211 PolarHBondContact O-N 3Å |
| 208 | L | 88.5 | Confident | 89.8 | Confident | 116 Ų | 116 | 50.4 Ų | 50.4 | 61% | 0.607 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -75.4 | -45.5 | 179 | -168.9 | 151.8 | 0 | 0 | 0 | 111.9 | I204 A205 V206 Q210 A211 Y212 | I204-L208 PolarHBondContact O-N 3.11Å; A205-L208 PolarHBondContact O-N 2.97Å; V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 PolarHBondContact O-N 2.88Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 3.3Å; L208-A211 PolarHBondContact O-N 3.27Å; L208-Y212 PolarHBondContact O-N 3.43Å |
| 209 | I | 90.4 | Very high | 89.3 | Confident | 96 Ų | 96 | 45 Ų | 45 | 49% | 0.492 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60.4 | -40.6 | 178.5 | -69 | 167 | 0 | 0 | 0 | 110.3 | A205 V206 A211 Y212 V213 | A205-I209 WeakPolarHBondContact O-CB 3.44Å; A205-I209 VanDerWaalsContact O-CG1 3.27Å; A205-I209 WeakPolarHBondContact O-CG1 3.28Å; A205-I209 PolarHBondContact O-N 3.07Å; V206-I209 PolarHBondContact O-N 2.97Å; I209-A211 PolarHBondContact O-N 2.6Å; I209-Y212 WeakPolarHBondContact O-CB 3.5Å; I209-Y212 PolarHBondContact O-N 2.75Å; I209-Y212 VanDerWaalsContact O-N 3.17Å; I209-V213 HydrophobicContact CG2-CG2 4.03Å; I209-V213 WeakPolarHBondContact O-CG2 3.49Å; I209-V213 PolarHBondContact O-N 3.28Å |
| 210 | Q | 88.7 | Confident | 88.8 | Confident | 11 Ų | 11 | 47.5 Ų | 47.5 | 5% | 0.051 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -67.6 | -37 | -177.2 | -174.3 | 63.7 | 7.9 | 0 | 0 | 112.3 | R159 L160 V206 L208 Y212 F214 | R159-Q210 VanDerWaalsContact C-NE2 3.28Å; R159-Q210 VanDerWaalsContact CG-NE2 3.32Å; L160-Q210 VanDerWaalsContact CA-NE2 3.3Å; L160-Q210 HydrophobicContact CB-CG 4.38Å; L160-Q210 HydrophobicContact CD1-CB 4.31Å; L160-Q210 HydrophobicContact CD1-CG 3.32Å; L160-Q210 HydrophobicContact CG-CG 4.43Å; V206-Q210 WeakPolarHBondContact O-CB 3.06Å; V206-Q210 PolarHBondContact O-N 3.23Å; L208-Q210 VanDerWaalsContact C-N 3.26Å; L208-Q210 PolarHBondContact O-N 3.3Å; Q210-Y212 VanDerWaalsContact C-N 3.33Å; Q210-F214 VanDerWaalsContact O-CB 3.31Å; Q210-F214 WeakPolarHBondContact O-CB 3.46Å; Q210-F214 PolarHBondContact O-N 3.46Å |
| 211 | A | 89.3 | Confident | 88.3 | Confident | 1 Ų | 1 | 46 Ų | 46 | 1% | 0.008 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.2 | -42.1 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | I76 I79 A80 A207 L208 I209 T215 | I76-A211 HydrophobicContact CG1-CB 4.47Å; I79-A211 HydrophobicContact CB-CB 4.03Å; I79-A211 HydrophobicContact CG2-CB 3.77Å; A80-A211 HydrophobicContact CB-CB 3.94Å; A207-A211 PolarHBondContact O-N 3Å; L208-A211 PolarHBondContact O-N 3.27Å; I209-A211 PolarHBondContact O-N 2.6Å; A211-T215 VanDerWaalsContact O-CG2 3.28Å; A211-T215 WeakPolarHBondContact O-CG2 3.39Å; A211-T215 PolarHBondContact O-N 3.37Å; A211-T215 PolarHBondContact O-OG1 2.77Å |
| 212 | Y | 89.3 | Confident | 87.7 | Confident | 103 Ų | 103 | 41.3 Ų | 41.3 | 40% | 0.404 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -64.7 | -49.5 | 176.8 | 176.9 | -100.8 | 0 | 0 | 0 | 112.5 | M57 I76 L208 I209 Q210 F214 T215 L216 | M57-Y212 HydrophobicContact CE-CD2 3.92Å; M57-Y212 HydrophobicContact CE-CE2 3.89Å; I76-Y212 HydrophobicContact CD1-CD2 4.21Å; L208-Y212 PolarHBondContact O-N 3.43Å; I209-Y212 WeakPolarHBondContact O-CB 3.5Å; I209-Y212 PolarHBondContact O-N 2.75Å; I209-Y212 VanDerWaalsContact O-N 3.17Å; Q210-Y212 VanDerWaalsContact C-N 3.33Å; Y212-F214 VanDerWaalsContact C-N 3.3Å; Y212-F214 PolarHBondContact O-N 2.87Å; Y212-T215 PolarHBondContact O-N 3.35Å; Y212-T215 PolarHBondContact O-OG1 3.47Å; Y212-L216 HydrophobicContact CE1-CD1 3.65Å; Y212-L216 HydrophobicContact CE2-CD1 4.47Å; Y212-L216 VanDerWaalsContact O-CB 3.29Å; Y212-L216 WeakPolarHBondContact O-CB 3.43Å; Y212-L216 PolarHBondContact O-N 3.04Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.37Å |
| 213 | V | 89.4 | Confident | 87.1 | Confident | 42 Ų | 42 | 40.2 Ų | 40.2 | 26% | 0.255 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -62.5 | -38.9 | 179.7 | 172.4 | 0 | 0 | 0 | 0 | 111.3 | I209 L217 | I209-V213 HydrophobicContact CG2-CG2 4.03Å; I209-V213 WeakPolarHBondContact O-CG2 3.49Å; I209-V213 PolarHBondContact O-N 3.28Å; V213-L217 HydrophobicContact CG1-CD1 3.93Å; V213-L217 WeakPolarHBondContact O-CG 3.13Å; V213-L217 PolarHBondContact O-N 3.03Å |
| 214 | F | 86.7 | Confident | 86.4 | Confident | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.3 | -52.3 | 176.4 | -174 | -72.4 | 0 | 0 | 0 | 111 | L75 I79 A105 L108 L156 Q210 Y212 L217 V218 | L75-F214 HydrophobicContact CD1-CE1 4.36Å; L75-F214 HydrophobicContact CD2-CD1 3.56Å; L75-F214 HydrophobicContact CD2-CE1 3.48Å; L75-F214 VanDerWaalsContact CD2-CE1 3.48Å; L75-F214 HydrophobicContact CG-CE1 4.34Å; I79-F214 HydrophobicContact CD1-CB 4.3Å; I79-F214 HydrophobicContact CD1-CD1 3.52Å; I79-F214 HydrophobicContact CD1-CD2 4.3Å; I79-F214 HydrophobicContact CD1-CE1 3.82Å; I79-F214 HydrophobicContact CD1-CG 3.79Å; I79-F214 HydrophobicContact CD1-CZ 4.33Å; A105-F214 HydrophobicContact CB-CE2 4.37Å; A105-F214 HydrophobicContact CB-CZ 4.19Å; L108-F214 HydrophobicContact CD1-CE1 4.12Å; L156-F214 HydrophobicContact CD1-CD2 4.27Å; L156-F214 HydrophobicContact CD1-CG 4.49Å; L156-F214 HydrophobicContact CD2-CD1 4.04Å; L156-F214 HydrophobicContact CD2-CD2 3.32Å; L156-F214 HydrophobicContact CD2-CE1 3.9Å; L156-F214 HydrophobicContact CD2-CE2 3.15Å; L156-F214 HydrophobicContact CD2-CG 3.78Å; L156-F214 HydrophobicContact CD2-CZ 3.47Å; L156-F214 VanDerWaalsContact CD2-CZ 3.47Å; L156-F214 HydrophobicContact CG-CD2 3.48Å; L156-F214 VanDerWaalsContact CG-CD2 3.48Å; L156-F214 HydrophobicContact CG-CE2 3.7Å; L156-F214 HydrophobicContact CG-CG 4.12Å; L156-F214 HydrophobicContact CG-CZ 4.47Å; Q210-F214 VanDerWaalsContact O-CB 3.31Å; Q210-F214 WeakPolarHBondContact O-CB 3.46Å; Q210-F214 PolarHBondContact O-N 3.46Å; Y212-F214 VanDerWaalsContact C-N 3.3Å; Y212-F214 PolarHBondContact O-N 2.87Å; F214-L217 PolarHBondContact O-N 2.82Å; F214-V218 HydrophobicContact CD1-CG2 4.27Å; F214-V218 HydrophobicContact CE1-CG2 4.05Å; F214-V218 WeakPolarHBondContact O-CG2 3.37Å; F214-V218 PolarHBondContact O-N 3.44Å |
| 215 | T | 88.2 | Confident | 85.6 | Confident | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -70.4 | -34.7 | -176.4 | 55.6 | 0 | 0 | 0 | 0 | 112.6 | M57 L75 I76 A211 Y212 V218 S219 | M57-T215 VanDerWaalsContact CE-OG1 3.23Å; M57-T215 WeakPolarHBondContact CE-OG1 3.32Å; L75-T215 HydrophobicContact CB-CG2 4.31Å; L75-T215 HydrophobicContact CD2-CG2 3.41Å; L75-T215 VanDerWaalsContact CD2-CG2 3.41Å; L75-T215 HydrophobicContact CG-CG2 4.1Å; I76-T215 VanDerWaalsContact CA-CG2 3.46Å; I76-T215 HydrophobicContact CB-CG2 3.46Å; I76-T215 VanDerWaalsContact CB-CG2 3.46Å; I76-T215 HydrophobicContact CG1-CG2 3.98Å; A211-T215 VanDerWaalsContact O-CG2 3.28Å; A211-T215 WeakPolarHBondContact O-CG2 3.39Å; A211-T215 PolarHBondContact O-N 3.37Å; A211-T215 PolarHBondContact O-OG1 2.77Å; Y212-T215 PolarHBondContact O-N 3.35Å; Y212-T215 PolarHBondContact O-OG1 3.47Å; T215-V218 PolarHBondContact O-N 3.34Å; T215-S219 VanDerWaalsContact O-CB 3.26Å; T215-S219 WeakPolarHBondContact O-CB 3.15Å; T215-S219 PolarHBondContact O-N 3.47Å |
| 216 | L | 87 | Confident | 84.5 | Confident | 61 Ų | 61 | 39.1 Ų | 39.1 | 32% | 0.319 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -64.7 | -41.6 | 174.9 | -175 | 148.7 | 0 | 0 | 0 | 112 | Y212 S219 L220 | Y212-L216 HydrophobicContact CE1-CD1 3.65Å; Y212-L216 HydrophobicContact CE2-CD1 4.47Å; Y212-L216 VanDerWaalsContact O-CB 3.29Å; Y212-L216 WeakPolarHBondContact O-CB 3.43Å; Y212-L216 PolarHBondContact O-N 3.04Å; Y212-L216 WeakPolarHBondContact OH-CD1 3.37Å; L216-S219 CarbonylContact O-C 3.6Å; L216-S219 WeakPolarHBondContact O-CB 3.47Å; L216-S219 PolarHBondContact O-N 2.85Å; L216-L220 WeakPolarHBondContact O-CB 3.45Å; L216-L220 PolarHBondContact O-N 2.82Å |
| 217 | L | 85.6 | Confident | 84.1 | Confident | 36 Ų | 36 | 39.2 Ų | 39.2 | 19% | 0.188 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.6 | -42.4 | 177.2 | -75.4 | 168.3 | 0 | 0 | 0 | 111.4 | L156 V213 F214 S219 L220 Y221 | L156-L217 HydrophobicContact CD1-CB 3.89Å; L156-L217 HydrophobicContact CD1-CD1 3.35Å; L156-L217 HydrophobicContact CD1-CG 4.25Å; V213-L217 HydrophobicContact CG1-CD1 3.93Å; V213-L217 WeakPolarHBondContact O-CG 3.13Å; V213-L217 PolarHBondContact O-N 3.03Å; F214-L217 PolarHBondContact O-N 2.82Å; L217-S219 VanDerWaalsContact C-N 3.3Å; L217-S219 PolarHBondContact O-N 3.24Å; L217-L220 PolarHBondContact O-N 3.17Å; L217-Y221 HydrophobicContact CB-CE2 4.15Å; L217-Y221 WeakPolarHBondContact O-CD2 3.34Å; L217-Y221 WeakPolarHBondContact O-CE2 3.17Å; L217-Y221 PolarHBondContact O-N 3.21Å |
| 218 | V | 84.4 | Confident | 83.9 | Confident | 8 Ų | 8 | 41 Ų | 41 | 5% | 0.048 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.8 | -42 | 173.3 | 178.3 | 0 | 0 | 0 | 0 | 111.5 | L72 L108 L156 F214 T215 Y221 L222 | L72-V218 HydrophobicContact CD2-CB 4.25Å; L72-V218 HydrophobicContact CD2-CG1 3.88Å; L108-V218 HydrophobicContact CB-CG1 4.37Å; L156-V218 HydrophobicContact CD2-CG2 4.43Å; F214-V218 HydrophobicContact CD1-CG2 4.27Å; F214-V218 HydrophobicContact CE1-CG2 4.05Å; F214-V218 WeakPolarHBondContact O-CG2 3.37Å; F214-V218 PolarHBondContact O-N 3.44Å; T215-V218 PolarHBondContact O-N 3.34Å; V218-Y221 PolarHBondContact O-N 3.22Å; V218-L222 PolarHBondContact O-N 3.31Å |
| 219 | S | 85.6 | Confident | 83.6 | Confident | 8 Ų | 8 | 36.8 Ų | 36.8 | 6% | 0.056 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60 | -43.4 | 174 | 172.7 | 0 | 0 | 0 | 0 | 111.9 | H61 T215 L216 L217 L222 H223 | H61-S219 PolarHBondContact CE1-O 2.98Å; H61-S219 PolarHBondContact NE2-O 3.13Å; H61-S219 PolarHBondContact NE2-OG 3.07Å; T215-S219 VanDerWaalsContact O-CB 3.26Å; T215-S219 WeakPolarHBondContact O-CB 3.15Å; T215-S219 PolarHBondContact O-N 3.47Å; L216-S219 CarbonylContact O-C 3.6Å; L216-S219 WeakPolarHBondContact O-CB 3.47Å; L216-S219 PolarHBondContact O-N 2.85Å; L217-S219 VanDerWaalsContact C-N 3.3Å; L217-S219 PolarHBondContact O-N 3.24Å; S219-L222 WeakPolarHBondContact O-CB 3.28Å; S219-L222 PolarHBondContact O-N 3.37Å; S219-H223 PolarHBondContact O-N 3.31Å |
| 220 | L | 83 | Confident | 83.2 | Confident | 77 Ų | 77 | 33.4 Ų | 33.4 | 40% | 0.403 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -65.7 | -42.4 | 177.7 | -170.7 | 148.3 | 0 | 0 | 0 | 111.7 | L216 L217 L222 H223 D224 | L216-L220 WeakPolarHBondContact O-CB 3.45Å; L216-L220 PolarHBondContact O-N 2.82Å; L217-L220 PolarHBondContact O-N 3.17Å; L220-L222 VanDerWaalsContact C-N 3.25Å; L220-L222 PolarHBondContact O-N 3.49Å; L220-H223 WeakPolarHBondContact O-CA 3.49Å; L220-H223 VanDerWaalsContact O-CB 3.3Å; L220-H223 WeakPolarHBondContact O-CB 3.45Å; L220-H223 PolarHBondContact O-N 3.2Å; L220-D224 WeakPolarHBondContact CD2-OD2 3.44Å; L220-D224 PolarHBondContact O-N 3.36Å |
| 221 | Y | 78.9 | Confident | 82.9 | Confident | 20 Ų | 20 | 34.8 Ų | 34.8 | 8% | 0.078 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61 | -37.3 | 174 | -62.8 | -50.9 | 0 | 0 | 0 | 112.6 | Q152 L217 V218 H223 N225 | Q152-Y221 HydrophobicContact CG-CE1 4.41Å; Q152-Y221 WeakPolarHBondContact CG-OH 3.5Å; Q152-Y221 PolarHBondContact NE2-OH 2.76Å; Q152-Y221 PolarHBondContact OE1-OH 3.34Å; L217-Y221 HydrophobicContact CB-CE2 4.15Å; L217-Y221 WeakPolarHBondContact O-CD2 3.34Å; L217-Y221 WeakPolarHBondContact O-CE2 3.17Å; L217-Y221 PolarHBondContact O-N 3.21Å; V218-Y221 PolarHBondContact O-N 3.22Å; Y221-H223 VanDerWaalsContact C-N 3.28Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.38Å; Y221-N225 PolarHBondContact O-N 3Å; Y221-N225 VanDerWaalsContact O-N 3.13Å; Y221-N225 PolarHBondContact O-ND2 3.39Å |
| 222 | L | 80.8 | Confident | 82.5 | Confident | 2 Ų | 2 | 37 Ų | 37 | 1% | 0.01 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -64.7 | -38 | 174.9 | -165.7 | 82 | 0 | 0 | 0 | 110.9 | W68 A112 M115 V218 S219 L220 N225 T226 | W68-L222 HydrophobicContact CB-CD2 3.58Å; W68-L222 HydrophobicContact CD2-CD1 3.48Å; W68-L222 VanDerWaalsContact CD2-CD1 3.48Å; W68-L222 HydrophobicContact CD2-CD2 4.22Å; W68-L222 HydrophobicContact CE3-CD1 3.55Å; W68-L222 HydrophobicContact CE3-CD2 4.49Å; W68-L222 HydrophobicContact CG-CD1 3.85Å; W68-L222 HydrophobicContact CG-CD2 3.77Å; W68-L222 HydrophobicContact CG-CG 4.48Å; W68-L222 HydrophobicContact CZ2-CD1 4.4Å; W68-L222 HydrophobicContact CZ3-CD1 4.08Å; A112-L222 HydrophobicContact CB-CD1 4.49Å; M115-L222 HydrophobicContact SD-CD1 4.29Å; V218-L222 PolarHBondContact O-N 3.31Å; S219-L222 WeakPolarHBondContact O-CB 3.28Å; S219-L222 PolarHBondContact O-N 3.37Å; L220-L222 VanDerWaalsContact C-N 3.25Å; L220-L222 PolarHBondContact O-N 3.49Å; L222-N225 PolarHBondContact O-N 3.15Å; L222-T226 HydrophobicContact CG-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CB 3.29Å; L222-T226 WeakPolarHBondContact O-CG2 3.36Å; L222-T226 PolarHBondContact O-N 3.44Å; L222-T226 VanDerWaalsContact O-N 3.13Å; L222-T226 PolarHBondContact O-OG1 2.73Å |
| 223 | H | 80.4 | Confident | 82 | Confident | 78 Ų | 78 | 32.3 Ų | 32.3 | 36% | 0.361 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -63.7 | -49.9 | 177.7 | -173.2 | 79.4 | 0 | 0 | 0 | 111.2 | T60 S219 L220 Y221 N225 T226 | T60-H223 PolarHBondContact O-CE1 3.29Å; T60-H223 PolarHBondContact O-ND1 3.49Å; S219-H223 PolarHBondContact O-N 3.31Å; L220-H223 WeakPolarHBondContact O-CA 3.49Å; L220-H223 VanDerWaalsContact O-CB 3.3Å; L220-H223 WeakPolarHBondContact O-CB 3.45Å; L220-H223 PolarHBondContact O-N 3.2Å; Y221-H223 VanDerWaalsContact C-N 3.28Å; H223-N225 PolarHBondContact O-N 2.98Å; H223-T226 PolarHBondContact O-N 3.37Å; H223-T226 PolarHBondContact O-OG1 3.25Å |
| 224 | D | 76.4 | Confident | 81.4 | Confident | 68 Ų | 68 | 31.5 Ų | 31.5 | 36% | 0.364 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -62.6 | -30.1 | -179.5 | -63.5 | -15 | 0 | 0 | 0 | 112.3 | L220 | L220-D224 WeakPolarHBondContact CD2-OD2 3.44Å; L220-D224 PolarHBondContact O-N 3.36Å |
| 225 | N | 73 | Confident | 80.9 | Confident | 29 Ų | 29 | 34.2 Ų | 34.2 | 16% | 0.155 | 18% | 0.177 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.1 | -0.2 | -179.4 | -73.6 | -66.4 | 0 | 0 | 0 | 114.6 | G116 S119 Y221 L222 H223 | G116-N225 VanDerWaalsContact CA-O 3.24Å; G116-N225 WeakPolarHBondContact CA-O 3.08Å; S119-N225 PolarHBondContact OG-O 3.44Å; Y221-N225 VanDerWaalsContact O-CB 3.3Å; Y221-N225 WeakPolarHBondContact O-CB 3.38Å; Y221-N225 PolarHBondContact O-N 3Å; Y221-N225 VanDerWaalsContact O-N 3.13Å; Y221-N225 PolarHBondContact O-ND2 3.39Å; L222-N225 PolarHBondContact O-N 3.15Å; H223-N225 PolarHBondContact O-N 2.98Å |
| 226 | T | 68 | Low | 80.3 | Confident | 23 Ų | 23 | 37.3 Ų | 37.3 | 14% | 0.141 | 19% | 0.193 | C | C | . | . | trans | -110.5 | 0 | -178.7 | 51.4 | 0 | 0 | 0 | 0 | 114.9 | M115 K120 L222 H223 | M115-T226 HydrophobicContact CE-CG2 4.38Å; K120-T226 WeakPolarHBondContact CE-O 3.26Å; K120-T226 PolarHBondContact NZ-O 3.41Å; K120-T226 PolarHBondContact NZ-OXT 3.44Å; L222-T226 HydrophobicContact CG-CG2 4.28Å; L222-T226 WeakPolarHBondContact O-CB 3.29Å; L222-T226 WeakPolarHBondContact O-CG2 3.36Å; L222-T226 PolarHBondContact O-N 3.44Å; L222-T226 VanDerWaalsContact O-N 3.13Å; L222-T226 PolarHBondContact O-OG1 2.73Å; H223-T226 PolarHBondContact O-N 3.37Å; H223-T226 PolarHBondContact O-OG1 3.25Å |
Retrieved 226 of 226 residues in 40.6 ms
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