| 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 | 33.3 | Very low | 67.8 | Low | 234 Ų | 234 | 119.3 Ų | 119.3 | 100% | 1.153 | 64% | 0.637 | S | S | * | * | 0 | 115.3 | 0 | -97.9 | 168.2 | -177.8 | 0 | 0 | 106.6 | F3 | M1-F3 PolarHBondContact O-N 3.34Š| |||
| 2 | A | 39.6 | Very low | 69.1 | Low | 97 Ų | 97 | 116.2 Ų | 116.2 | 80% | 0.802 | 64% | 0.64 | S | S | * | * | trans | -64.7 | 124.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | Q4 | A2-Q4 PolarHBondContact O-N 3.07Š| ||
| 3 | F | 46.2 | Very low | 70.5 | Confident | 165 Ų | 165 | 114.3 Ų | 114.3 | 72% | 0.724 | 63% | 0.634 | S | S | * | * | trans | -67.2 | 83.5 | 172.6 | -70.6 | -91.1 | 0 | 0 | 0 | 108.5 | M1 D5 G6 | M1-F3 PolarHBondContact O-N 3.34Å; F3-D5 PolarHBondContact O-N 2.96Å; F3-G6 PolarHBondContact O-N 3.43Å | ||
| 4 | Q | 55.8 | Low | 71.9 | Confident | 186 Ų | 186 | 108.6 Ų | 108.6 | 87% | 0.869 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.8 | -28.6 | 172 | -102.7 | -172.9 | -17.7 | 0 | 0 | 111.5 | A2 | A2-Q4 PolarHBondContact O-N 3.07Š|
| 5 | D | 65.2 | Low | 72.8 | Confident | 159 Ų | 159 | 108.2 Ų | 108.2 | 85% | 0.85 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.2 | 6.9 | -176.7 | -60.9 | -43 | 0 | 0 | 0 | 114.1 | F3 | F3-D5 PolarHBondContact O-N 2.96Š|
| 6 | G | 70.6 | Confident | 73.5 | Confident | 30 Ų | 30 | 103.9 Ų | 103.9 | 31% | 0.309 | 58% | 0.584 | S | S | . | * | trans | 70.3 | -180 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | F3 | F3-G6 PolarHBondContact O-N 3.43Š| ||
| 7 | P | 81.9 | Confident | 74.4 | Confident | 75 Ų | 75 | 102.6 Ų | 102.6 | 49% | 0.487 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -88.8 | -4.8 | -174.5 | 34.3 | -35.3 | 0 | 0 | 0 | 114.6 | ||
| 8 | F | 87.6 | Confident | 75.4 | Confident | 54 Ų | 54 | 97.5 Ų | 97.5 | 24% | 0.237 | 55% | 0.547 | C | S | . | . | trans | -116 | 117.1 | -173.7 | -49.8 | -65.4 | 0 | 0 | 0 | 111.5 | W10 A64 N65 W136 | F8-W10 HydrophobicContact CB-CD2 4.03Å; F8-W10 HydrophobicContact CB-CE3 4.42Å; F8-W10 HydrophobicContact CB-CG 4.45Å; F8-W10 HydrophobicContact CB-CH2 4.34Å; F8-W10 HydrophobicContact CB-CZ2 3.94Å; F8-W10 HydrophobicContact CD1-CZ2 4.23Å; F8-W10 HydrophobicContact CD2-CH2 4.04Å; F8-W10 HydrophobicContact CD2-CZ2 4.21Å; F8-W10 HydrophobicContact CG-CH2 4.17Å; F8-W10 AromaticContact CG-CZ2 3.87Å; F8-W10 HydrophobicContact CG-CZ2 3.87Å; F8-W10 PolarHBondContact O-N 3.38Å; F8-A64 HydrophobicContact CD2-CB 4.42Å; F8-A64 HydrophobicContact CE1-CB 4.39Å; F8-A64 WeakPolarHBondContact CE1-O 3.44Å; F8-A64 HydrophobicContact CE2-CB 3.59Å; F8-A64 HydrophobicContact CZ-CB 3.57Å; F8-N65 WeakPolarHBondContact CZ-OD1 3.32Å; F8-W136 AromaticContact CE2-CH2 4Å; F8-W136 HydrophobicContact CE2-CH2 4Å; F8-W136 AromaticContact CE2-CZ2 3.41Å; F8-W136 HydrophobicContact CE2-CZ2 3.41Å; F8-W136 VanDerWaalsContact CE2-CZ2 3.41Å; F8-W136 AromaticContact CZ-CZ2 3.97Å; F8-W136 HydrophobicContact CZ-CZ2 3.97Å | ||
| 9 | D | 87.4 | Confident | 75.9 | Confident | 166 Ų | 166 | 98.2 Ų | 98.2 | 89% | 0.888 | 55% | 0.548 | S | S | * | . | trans | -88.7 | 83.9 | 174.1 | -171.1 | 17.2 | 0 | 0 | 0 | 110 | ||||
| 10 | W | 89.2 | Confident | 76.4 | Confident | 62 Ų | 62 | 94.4 Ų | 94.4 | 24% | 0.235 | 53% | 0.532 | C | S | . | . | trans | -104.1 | 128.2 | 175.1 | -64.7 | -24.5 | 0 | 0 | 0 | 110.3 | F8 T14 Q15 I18 A64 A68 V71 | F8-W10 HydrophobicContact CB-CD2 4.03Å; F8-W10 HydrophobicContact CB-CE3 4.42Å; F8-W10 HydrophobicContact CB-CG 4.45Å; F8-W10 HydrophobicContact CB-CH2 4.34Å; F8-W10 HydrophobicContact CB-CZ2 3.94Å; F8-W10 HydrophobicContact CD1-CZ2 4.23Å; F8-W10 HydrophobicContact CD2-CH2 4.04Å; F8-W10 HydrophobicContact CD2-CZ2 4.21Å; F8-W10 HydrophobicContact CG-CH2 4.17Å; F8-W10 AromaticContact CG-CZ2 3.87Å; F8-W10 HydrophobicContact CG-CZ2 3.87Å; F8-W10 PolarHBondContact O-N 3.38Å; W10-T14 HydrophobicContact CB-CG2 3.99Å; W10-T14 HydrophobicContact CG-CG2 3.99Å; W10-Q15 HydrophobicContact CB-CG 3.97Å; W10-Q15 PolarHBondContact O-NE2 3.11Å; W10-I18 HydrophobicContact CD2-CD1 3.82Å; W10-I18 HydrophobicContact CE3-CD1 3.34Å; W10-I18 HydrophobicContact CH2-CD1 4.07Å; W10-I18 HydrophobicContact CZ2-CD1 4.46Å; W10-I18 HydrophobicContact CZ3-CD1 3.49Å; W10-I18 VanDerWaalsContact CZ3-CD1 3.49Å; W10-A64 HydrophobicContact CH2-CB 4.1Å; W10-A68 HydrophobicContact CD2-CB 4.48Å; W10-A68 HydrophobicContact CZ2-CB 4.45Å; W10-V71 HydrophobicContact CH2-CG2 3.87Å; W10-V71 HydrophobicContact CZ2-CG2 4.29Å | ||
| 11 | D | 89.2 | Confident | 77.2 | Confident | 84 Ų | 84 | 89.9 Ų | 89.9 | 45% | 0.449 | 51% | 0.507 | S | S | . | . | trans | -64 | 161 | 175.9 | 82 | -47.6 | 0 | 0 | 0 | 111.6 | T13 T14 Q15 | D11-T13 PolarHBondContact O-N 2.94Å; D11-T13 VanDerWaalsContact O-N 3.12Å; D11-T13 WeakPolarHBondContact OD2-CB 3.49Å; D11-T13 PolarHBondContact OD2-N 3.45Å; D11-T13 PolarHBondContact OD2-OG1 3.3Å; D11-T14 PolarHBondContact O-N 3.15Å; D11-T14 WeakPolarHBondContact OD1-CB 3.45Å; D11-T14 PolarHBondContact OD1-N 3.48Å; D11-T14 PolarHBondContact OD1-OG1 3Å; D11-Q15 WeakPolarHBondContact O-CG 3.48Å; D11-Q15 PolarHBondContact O-N 3.39Å | ||
| 12 | A | 83.5 | Confident | 80 | Confident | 82 Ų | 82 | 80.3 Ų | 80.3 | 68% | 0.678 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -56.4 | -32.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | G16 | A12-G16 PolarHBondContact O-N 2.94Å |
| 13 | T | 87 | Confident | 82.4 | Confident | 92 Ų | 92 | 77.5 Ų | 77.5 | 56% | 0.564 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -65.6 | -47.7 | 176.3 | -39.9 | 0 | 0 | 0 | 0 | 110.9 | D11 G16 N17 | D11-T13 PolarHBondContact O-N 2.94Å; D11-T13 VanDerWaalsContact O-N 3.12Å; D11-T13 WeakPolarHBondContact OD2-CB 3.49Å; D11-T13 PolarHBondContact OD2-N 3.45Å; D11-T13 PolarHBondContact OD2-OG1 3.3Å; T13-G16 PolarHBondContact O-N 3.04Å; T13-N17 VanDerWaalsContact O-CG 3.26Å; T13-N17 PolarHBondContact O-N 3.15Å; T13-N17 PolarHBondContact O-ND2 2.99Å |
| 14 | T | 89.8 | Confident | 84.5 | Confident | 35 Ų | 35 | 76.3 Ų | 76.3 | 22% | 0.215 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -63.9 | -43.1 | 177.9 | -63 | 0 | 0 | 0 | 0 | 111.6 | W10 D11 G16 N17 I18 A68 | W10-T14 HydrophobicContact CB-CG2 3.99Å; W10-T14 HydrophobicContact CG-CG2 3.99Å; D11-T14 PolarHBondContact O-N 3.15Å; D11-T14 WeakPolarHBondContact OD1-CB 3.45Å; D11-T14 PolarHBondContact OD1-N 3.48Å; D11-T14 PolarHBondContact OD1-OG1 3Å; T14-G16 VanDerWaalsContact C-N 3.35Å; T14-G16 PolarHBondContact O-N 3.25Å; T14-N17 PolarHBondContact O-N 2.88Å; T14-I18 HydrophobicContact CG2-CD1 3.94Å; T14-I18 WeakPolarHBondContact O-CG1 3.41Å; T14-I18 PolarHBondContact O-N 3.23Å; T14-A68 HydrophobicContact CG2-CB 3.41Å; T14-A68 VanDerWaalsContact CG2-CB 3.41Å |
| 15 | Q | 86.1 | Confident | 86.2 | Confident | 102 Ų | 102 | 67.5 Ų | 67.5 | 48% | 0.477 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 175.2 | -65.3 | -178.1 | 10.8 | 0 | 0 | 111.6 | W10 D11 N17 I18 L19 | W10-Q15 HydrophobicContact CB-CG 3.97Å; W10-Q15 PolarHBondContact O-NE2 3.11Å; D11-Q15 WeakPolarHBondContact O-CG 3.48Å; D11-Q15 PolarHBondContact O-N 3.39Å; Q15-N17 VanDerWaalsContact C-N 3.35Å; Q15-N17 PolarHBondContact O-N 3.38Å; Q15-I18 PolarHBondContact O-N 3.26Å; Q15-L19 WeakPolarHBondContact O-CG 3.34Å; Q15-L19 PolarHBondContact O-N 3.44Å |
| 16 | G | 83.8 | Confident | 87.6 | Confident | 40 Ų | 40 | 60.3 Ų | 60.3 | 41% | 0.412 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -59.1 | -43.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A12 T13 T14 L19 G20 | A12-G16 PolarHBondContact O-N 2.94Å; T13-G16 PolarHBondContact O-N 3.04Å; T14-G16 VanDerWaalsContact C-N 3.35Å; T14-G16 PolarHBondContact O-N 3.25Å; G16-L19 PolarHBondContact O-N 3.13Å; G16-G20 PolarHBondContact O-N 3.46Å |
| 17 | N | 89.5 | Confident | 88.6 | Confident | 82 Ų | 82 | 61 Ų | 61 | 44% | 0.439 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.8 | -41.2 | 176.1 | -71.1 | -24.3 | 0 | 0 | 0 | 112.3 | T13 T14 Q15 G20 A21 I72 | T13-N17 VanDerWaalsContact O-CG 3.26Å; T13-N17 PolarHBondContact O-N 3.15Å; T13-N17 PolarHBondContact O-ND2 2.99Å; T14-N17 PolarHBondContact O-N 2.88Å; Q15-N17 VanDerWaalsContact C-N 3.35Å; Q15-N17 PolarHBondContact O-N 3.38Å; N17-G20 PolarHBondContact O-N 2.91Å; N17-A21 VanDerWaalsContact O-CB 3.29Å; N17-A21 WeakPolarHBondContact O-CB 3.22Å; N17-A21 PolarHBondContact O-N 2.74Å; N17-I72 HydrophobicContact CB-CD1 4.16Å |
| 18 | I | 91.2 | Very high | 89.2 | Confident | 10 Ų | 10 | 62 Ų | 62 | 5% | 0.051 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.9 | -43.7 | 176 | -72.8 | 166.8 | 0 | 0 | 0 | 111.4 | W10 T14 Q15 A68 V71 I72 R75 | W10-I18 HydrophobicContact CD2-CD1 3.82Å; W10-I18 HydrophobicContact CE3-CD1 3.34Å; W10-I18 HydrophobicContact CH2-CD1 4.07Å; W10-I18 HydrophobicContact CZ2-CD1 4.46Å; W10-I18 HydrophobicContact CZ3-CD1 3.49Å; W10-I18 VanDerWaalsContact CZ3-CD1 3.49Å; T14-I18 HydrophobicContact CG2-CD1 3.94Å; T14-I18 WeakPolarHBondContact O-CG1 3.41Å; T14-I18 PolarHBondContact O-N 3.23Å; Q15-I18 PolarHBondContact O-N 3.26Å; I18-A68 HydrophobicContact CD1-CB 4.06Å; I18-V71 HydrophobicContact CD1-CG1 4.47Å; I18-V71 HydrophobicContact CG1-CB 4.48Å; I18-V71 HydrophobicContact CG1-CG1 4.33Å; I18-V71 HydrophobicContact CG2-CG1 3.66Å; I18-I72 HydrophobicContact CG1-CD1 4.29Å; I18-I72 HydrophobicContact CG1-CG1 3.74Å; I18-R75 PolarHBondContact O-NH1 2.97Å |
| 19 | L | 85.7 | Confident | 89.5 | Confident | 110 Ų | 110 | 60.3 Ų | 60.3 | 58% | 0.576 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -66.9 | -44.4 | 178.1 | -69.5 | 173.3 | 0 | 0 | 0 | 111.3 | Q15 G16 A21 | Q15-L19 WeakPolarHBondContact O-CG 3.34Å; Q15-L19 PolarHBondContact O-N 3.44Å; G16-L19 PolarHBondContact O-N 3.13Å; L19-A21 VanDerWaalsContact C-N 3.34Å; L19-A21 PolarHBondContact O-N 3.47Å |
| 20 | G | 86.1 | Confident | 89.8 | Confident | 22 Ų | 22 | 52.4 Ų | 52.4 | 23% | 0.227 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.6 | -27.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | G16 N17 F22 F23 | G16-G20 PolarHBondContact O-N 3.46Å; N17-G20 PolarHBondContact O-N 2.91Å; G20-F22 PolarHBondContact O-N 3.32Å; G20-F22 VanDerWaalsContact O-N 3.08Å; G20-F23 PolarHBondContact O-N 3.36Å |
| 21 | A | 92.3 | Very high | 90 | Very high | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.008 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -52 | -36.5 | -175 | 0 | 0 | 0 | 0 | 0 | 114.3 | N17 L19 F23 Y24 I72 R75 V76 | N17-A21 VanDerWaalsContact O-CB 3.29Å; N17-A21 WeakPolarHBondContact O-CB 3.22Å; N17-A21 PolarHBondContact O-N 2.74Å; L19-A21 VanDerWaalsContact C-N 3.34Å; L19-A21 PolarHBondContact O-N 3.47Å; A21-F23 VanDerWaalsContact C-N 3.33Å; A21-F23 PolarHBondContact O-N 3.32Å; A21-Y24 PolarHBondContact O-N 3.47Å; A21-I72 HydrophobicContact CB-CB 4.32Å; A21-I72 HydrophobicContact CB-CG1 4.42Å; A21-I72 HydrophobicContact CB-CG2 3.91Å; A21-R75 HydrophobicContact CB-CB 3.64Å; A21-V76 HydrophobicContact CB-CG2 4.24Å; A21-V76 WeakPolarHBondContact O-CG2 3.44Å |
| 22 | F | 92.3 | Very high | 90.2 | Very high | 33 Ų | 33 | 51.4 Ų | 51.4 | 15% | 0.145 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -56.6 | -45.4 | 176.7 | 173.8 | -94.9 | 0 | 0 | 0 | 112.5 | G20 Y24 G25 Y26 R75 M78 G79 E82 | G20-F22 PolarHBondContact O-N 3.32Å; G20-F22 VanDerWaalsContact O-N 3.08Å; F22-Y24 VanDerWaalsContact C-N 3.31Å; F22-Y24 PolarHBondContact O-N 2.98Å; F22-G25 PolarHBondContact O-N 3.17Å; F22-Y26 AromaticContact CE1-CD2 3.93Å; F22-Y26 HydrophobicContact CE1-CD2 3.93Å; F22-Y26 AromaticContact CE1-CG 3.99Å; F22-Y26 HydrophobicContact CE1-CG 3.99Å; F22-Y26 AromaticContact CZ-CD2 3.79Å; F22-Y26 HydrophobicContact CZ-CD2 3.79Å; F22-Y26 HydrophobicContact CZ-CE2 4.37Å; F22-Y26 HydrophobicContact CZ-CG 4.28Å; F22-Y26 WeakPolarHBondContact O-CB 3.24Å; F22-Y26 PolarHBondContact O-N 3.36Å; F22-R75 WeakPolarHBondContact CA-O 3.24Å; F22-M78 HydrophobicContact CD2-CB 4.14Å; F22-M78 HydrophobicContact CE2-CB 4.39Å; F22-G79 WeakPolarHBondContact O-CA 3.3Å; F22-E82 HydrophobicContact CE2-CB 4.14Å; F22-E82 WeakPolarHBondContact CE2-OE2 3.42Å; F22-E82 HydrophobicContact CZ-CB 4.16Å; F22-E82 HydrophobicContact CZ-CG 4.33Å; F22-E82 WeakPolarHBondContact CZ-OE2 3.25Å |
| 23 | F | 89.3 | Confident | 90.6 | Very high | 38 Ų | 38 | 47.5 Ų | 47.5 | 17% | 0.167 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -67.5 | -31 | -175 | -65.7 | -71.3 | 0 | 0 | 0 | 112.8 | G20 A21 G25 Y26 I27 Y221 T349 I353 | G20-F23 PolarHBondContact O-N 3.36Å; A21-F23 VanDerWaalsContact C-N 3.33Å; A21-F23 PolarHBondContact O-N 3.32Å; F23-G25 VanDerWaalsContact C-N 3.33Å; F23-G25 PolarHBondContact O-N 3.35Å; F23-Y26 PolarHBondContact O-N 3.08Å; F23-I27 WeakPolarHBondContact O-CG1 3.41Å; F23-I27 PolarHBondContact O-N 3.06Å; F23-I27 VanDerWaalsContact O-N 3.1Å; F23-Y221 HydrophobicContact CE1-CE1 4.27Å; F23-T349 HydrophobicContact CB-CG2 4.46Å; F23-T349 HydrophobicContact CD1-CG2 3.77Å; F23-I353 HydrophobicContact CB-CD1 4.18Å; F23-I353 HydrophobicContact CB-CG1 3.85Å; F23-I353 HydrophobicContact CG-CG1 4.44Å |
| 24 | Y | 90.6 | Very high | 90.8 | Very high | 139 Ų | 139 | 43.1 Ų | 43.1 | 55% | 0.545 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.6 | -42.4 | 175.3 | -64.2 | -56.5 | 0 | 0 | 0 | 111.9 | A21 F22 V28 I353 | A21-Y24 PolarHBondContact O-N 3.47Å; F22-Y24 VanDerWaalsContact C-N 3.31Å; F22-Y24 PolarHBondContact O-N 2.98Å; Y24-V28 WeakPolarHBondContact O-CG2 3.39Å; Y24-I353 HydrophobicContact CE1-CD1 4.49Å |
| 25 | G | 92.5 | Very high | 90.7 | Very high | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.01 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -70.3 | -42.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | F22 F23 I27 V28 | F22-G25 PolarHBondContact O-N 3.17Å; F23-G25 VanDerWaalsContact C-N 3.33Å; F23-G25 PolarHBondContact O-N 3.35Å; G25-I27 PolarHBondContact O-N 3.28Å; G25-V28 PolarHBondContact O-N 3.5Å |
| 26 | Y | 93.9 | Very high | 91 | Very high | 8 Ų | 8 | 42 Ų | 42 | 3% | 0.031 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61.9 | -37.8 | -174.5 | -175.2 | -102.1 | 0 | 0 | 0 | 113.7 | F22 F23 V28 Q30 G79 E82 G83 W86 N345 T349 | F22-Y26 AromaticContact CE1-CD2 3.93Å; F22-Y26 HydrophobicContact CE1-CD2 3.93Å; F22-Y26 AromaticContact CE1-CG 3.99Å; F22-Y26 HydrophobicContact CE1-CG 3.99Å; F22-Y26 AromaticContact CZ-CD2 3.79Å; F22-Y26 HydrophobicContact CZ-CD2 3.79Å; F22-Y26 HydrophobicContact CZ-CE2 4.37Å; F22-Y26 HydrophobicContact CZ-CG 4.28Å; F22-Y26 WeakPolarHBondContact O-CB 3.24Å; F22-Y26 PolarHBondContact O-N 3.36Å; F23-Y26 PolarHBondContact O-N 3.08Å; Y26-V28 VanDerWaalsContact C-N 3.31Å; Y26-V28 PolarHBondContact O-N 3.13Å; Y26-Q30 VanDerWaalsContact CE2-NE2 3.3Å; Y26-Q30 WeakPolarHBondContact O-CG 3.43Å; Y26-Q30 PolarHBondContact O-NE2 2.95Å; Y26-Q30 PolarHBondContact OH-NE2 3.46Å; Y26-G79 VanDerWaalsContact CA-O 3.23Å; Y26-G79 WeakPolarHBondContact CA-O 3.23Å; Y26-G79 VanDerWaalsContact N-C 3.34Å; Y26-E82 HydrophobicContact CD2-CB 4.35Å; Y26-E82 HydrophobicContact CE2-CG 4.43Å; Y26-G83 VanDerWaalsContact CD2-CA 3.41Å; Y26-W86 PolarHBondContact OH-NE1 3.19Å; Y26-N345 PolarHBondContact OH-ND2 2.82Å; Y26-N345 VanDerWaalsContact OH-ND2 3.13Å; Y26-T349 HydrophobicContact CD1-CG2 3.73Å; Y26-T349 HydrophobicContact CE1-CG2 4.17Å; Y26-T349 WeakPolarHBondContact CE1-OG1 3.25Å |
| 27 | I | 92.7 | Very high | 91.4 | Very high | 46 Ų | 46 | 40.2 Ų | 40.2 | 24% | 0.236 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -63.6 | -35.6 | 178.1 | -72.4 | 178.2 | 0 | 0 | 0 | 112.1 | F23 G25 T29 T346 T349 I353 | F23-I27 WeakPolarHBondContact O-CG1 3.41Å; F23-I27 PolarHBondContact O-N 3.06Å; F23-I27 VanDerWaalsContact O-N 3.1Å; G25-I27 PolarHBondContact O-N 3.28Å; I27-T29 VanDerWaalsContact C-N 3.35Å; I27-T29 PolarHBondContact O-N 3.48Å; I27-T346 HydrophobicContact CG2-CG2 3.93Å; I27-T349 HydrophobicContact CD1-CG2 3.87Å; I27-T349 HydrophobicContact CG1-CG2 3.47Å; I27-T349 VanDerWaalsContact CG1-CG2 3.47Å; I27-I353 HydrophobicContact CD1-CD1 3.69Å |
| 28 | V | 93.2 | Very high | 91.1 | Very high | 95 Ų | 95 | 38.4 Ų | 38.4 | 58% | 0.576 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -66.9 | -35.7 | -171.4 | 175 | 0 | 0 | 0 | 0 | 112 | Y24 G25 Y26 P32 | Y24-V28 WeakPolarHBondContact O-CG2 3.39Å; G25-V28 PolarHBondContact O-N 3.5Å; Y26-V28 VanDerWaalsContact C-N 3.31Å; Y26-V28 PolarHBondContact O-N 3.13Å; V28-P32 VanDerWaalsContact O-CD 3.26Å; V28-P32 WeakPolarHBondContact O-CD 3.37Å; V28-P32 WeakPolarHBondContact O-CG 3.28Å |
| 29 | T | 95.2 | Very high | 90.9 | Very high | 18 Ų | 18 | 45.8 Ų | 45.8 | 11% | 0.11 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -101.9 | -0.8 | -169.8 | 55.8 | 0 | 0 | 0 | 0 | 115 | I27 G33 I80 G83 | I27-T29 VanDerWaalsContact C-N 3.35Å; I27-T29 PolarHBondContact O-N 3.48Å; T29-G33 VanDerWaalsContact O-CA 3.25Å; T29-G33 WeakPolarHBondContact O-CA 3.43Å; T29-G33 PolarHBondContact O-N 3.13Å; T29-I80 WeakPolarHBondContact CB-O 3.49Å; T29-I80 HydrophobicContact CG2-CB 4.24Å; T29-I80 HydrophobicContact CG2-CG2 3.67Å; T29-I80 VanDerWaalsContact CG2-O 3.28Å; T29-I80 WeakPolarHBondContact CG2-O 3.39Å; T29-I80 PolarHBondContact OG1-O 2.66Å; T29-G83 VanDerWaalsContact OG1-CA 3.27Å; T29-G83 WeakPolarHBondContact OG1-CA 3.35Å |
| 30 | Q | 93.3 | Very high | 91 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.7 | -55.4 | 176.4 | -66.3 | -61.9 | -26.4 | 0 | 0 | 113.1 | Y26 G33 G34 G83 P87 G342 N345 T346 | Y26-Q30 VanDerWaalsContact CE2-NE2 3.3Å; Y26-Q30 WeakPolarHBondContact O-CG 3.43Å; Y26-Q30 PolarHBondContact O-NE2 2.95Å; Y26-Q30 PolarHBondContact OH-NE2 3.46Å; Q30-G33 PolarHBondContact O-N 3.43Å; Q30-G34 PolarHBondContact O-N 3.3Å; Q30-G83 WeakPolarHBondContact CA-O 3.15Å; Q30-G83 PolarHBondContact NE2-O 3.36Å; Q30-G83 PolarHBondContact OE1-O 2.99Å; Q30-G83 VanDerWaalsContact OE1-O 3.08Å; Q30-P87 WeakPolarHBondContact O-CG 3.49Å; Q30-G342 WeakPolarHBondContact CB-O 3.45Å; Q30-N345 HydrophobicContact CG-CB 4.48Å; Q30-N345 PolarHBondContact NE2-ND2 3.32Å; Q30-N345 VanDerWaalsContact NE2-ND2 3.17Å; Q30-N345 PolarHBondContact OE1-ND2 2.84Å; Q30-T346 WeakPolarHBondContact CB-OG1 3.36Å |
| 31 | I | 93.3 | Very high | 91.2 | Very high | 68 Ų | 68 | 45.8 Ų | 45.8 | 35% | 0.349 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -68.2 | -49.8 | -178.9 | -60.3 | 172.6 | 0 | 0 | 0 | 110.7 | G33 G34 L35 L339 I343 | I31-G33 VanDerWaalsContact C-N 3.26Å; I31-G33 PolarHBondContact O-N 2.74Å; I31-G34 PolarHBondContact O-N 3.09Å; I31-L35 PolarHBondContact O-N 2.78Å; I31-L339 HydrophobicContact CG2-CD1 3.9Å; I31-I343 HydrophobicContact CD1-CG1 4.11Å; I31-I343 HydrophobicContact CG1-CG1 3.97Å |
| 32 | P | 92.9 | Very high | 91.3 | Very high | 58 Ų | 58 | 45.9 Ų | 45.9 | 38% | 0.377 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -57 | -39 | 173.1 | -25.7 | 35.4 | 0 | 0 | 0 | 113 | V28 G34 L35 L36 | V28-P32 VanDerWaalsContact O-CD 3.26Å; V28-P32 WeakPolarHBondContact O-CD 3.37Å; V28-P32 WeakPolarHBondContact O-CG 3.28Å; P32-G34 VanDerWaalsContact C-N 3.33Å; P32-G34 PolarHBondContact O-N 3.34Å; P32-L35 WeakPolarHBondContact O-CB 3.4Å; P32-L35 PolarHBondContact O-N 2.68Å; P32-L35 VanDerWaalsContact O-N 3.1Å; P32-L36 WeakPolarHBondContact O-CB 3.35Å; P32-L36 VanDerWaalsContact O-CG 3.23Å; P32-L36 WeakPolarHBondContact O-CG 3.3Å; P32-L36 PolarHBondContact O-N 3.44Å |
| 33 | G | 92.5 | Very high | 91.4 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -58.6 | -42.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T29 Q30 I31 L35 L36 A37 | T29-G33 VanDerWaalsContact O-CA 3.25Å; T29-G33 WeakPolarHBondContact O-CA 3.43Å; T29-G33 PolarHBondContact O-N 3.13Å; Q30-G33 PolarHBondContact O-N 3.43Å; I31-G33 VanDerWaalsContact C-N 3.26Å; I31-G33 PolarHBondContact O-N 2.74Å; G33-L35 PolarHBondContact O-N 3.26Å; G33-L36 PolarHBondContact O-N 2.74Å; G33-A37 WeakPolarHBondContact O-CB 2.92Å; G33-A37 PolarHBondContact O-N 3.32Å |
| 34 | G | 89.8 | Confident | 91.8 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -61.5 | -42.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q30 I31 P32 A37 T38 P87 | Q30-G34 PolarHBondContact O-N 3.3Å; I31-G34 PolarHBondContact O-N 3.09Å; P32-G34 VanDerWaalsContact C-N 3.33Å; P32-G34 PolarHBondContact O-N 3.34Å; G34-A37 PolarHBondContact O-N 3.06Å; G34-T38 PolarHBondContact O-N 2.84Å; G34-T38 PolarHBondContact O-OG1 3.4Å; G34-P87 VanDerWaalsContact N-CB 3.34Å |
| 35 | L | 89.5 | Confident | 92.1 | Very high | 46 Ų | 46 | 42.5 Ų | 42.5 | 24% | 0.241 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -68.9 | -41.9 | 177.5 | -61.6 | 170.5 | 0 | 0 | 0 | 112.3 | I31 P32 G33 A37 T38 K39 F192 I195 L339 | I31-L35 PolarHBondContact O-N 2.78Å; P32-L35 WeakPolarHBondContact O-CB 3.4Å; P32-L35 PolarHBondContact O-N 2.68Å; P32-L35 VanDerWaalsContact O-N 3.1Å; G33-L35 PolarHBondContact O-N 3.26Å; L35-A37 VanDerWaalsContact C-N 3.31Å; L35-A37 PolarHBondContact O-N 3.28Å; L35-T38 PolarHBondContact O-N 3.11Å; L35-K39 WeakPolarHBondContact O-CB 3.41Å; L35-K39 PolarHBondContact O-N 3.01Å; L35-F192 HydrophobicContact CD1-CD2 3.82Å; L35-F192 HydrophobicContact CD1-CE2 3.51Å; L35-F192 HydrophobicContact CD2-CD2 3.92Å; L35-F192 HydrophobicContact CD2-CE2 4.08Å; L35-F192 HydrophobicContact CG-CE2 4.45Å; L35-I195 HydrophobicContact CD2-CD1 3.7Å; L35-L339 HydrophobicContact CD2-CD1 3.86Å; L35-L339 HydrophobicContact CD2-CD2 4.12Å; L35-L339 HydrophobicContact CD2-CG 4.47Å; L35-L339 HydrophobicContact CG-CD1 4.03Å |
| 36 | L | 91.8 | Very high | 92.3 | Very high | 68 Ų | 68 | 44.4 Ų | 44.4 | 36% | 0.356 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -62.1 | -41.2 | 176.3 | -69.9 | 172.6 | 0 | 0 | 0 | 110.4 | P32 G33 T38 K39 F40 V45 | P32-L36 WeakPolarHBondContact O-CB 3.35Å; P32-L36 VanDerWaalsContact O-CG 3.23Å; P32-L36 WeakPolarHBondContact O-CG 3.3Å; P32-L36 PolarHBondContact O-N 3.44Å; G33-L36 PolarHBondContact O-N 2.74Å; L36-T38 VanDerWaalsContact C-N 3.32Å; L36-T38 PolarHBondContact O-N 3.33Å; L36-K39 PolarHBondContact O-N 3.37Å; L36-F40 HydrophobicContact CB-CD2 4.4Å; L36-F40 HydrophobicContact CD2-CD2 3.57Å; L36-F40 HydrophobicContact CD2-CE2 3.48Å; L36-F40 VanDerWaalsContact CD2-CE2 3.48Å; L36-F40 PolarHBondContact O-N 3.47Å; L36-V45 HydrophobicContact CB-CG1 4.32Å; L36-V45 HydrophobicContact CB-CG2 3.9Å |
| 37 | A | 90.9 | Very high | 92.5 | Very high | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.008 | 22% | 0.221 | C | C | . | . | I | π-helix | trans | -62.9 | -39.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | G33 G34 L35 G41 A42 V45 A88 A91 | G33-A37 WeakPolarHBondContact O-CB 2.92Å; G33-A37 PolarHBondContact O-N 3.32Å; G34-A37 PolarHBondContact O-N 3.06Å; L35-A37 VanDerWaalsContact C-N 3.31Å; L35-A37 PolarHBondContact O-N 3.28Å; A37-G41 CarbonylContact O-C 3.46Å; A37-G41 VanDerWaalsContact O-C 3.28Å; A37-G41 VanDerWaalsContact O-CA 3.23Å; A37-G41 WeakPolarHBondContact O-CA 3.13Å; A37-G41 PolarHBondContact O-N 3.23Å; A37-G41 VanDerWaalsContact O-N 3.16Å; A37-A42 HydrophobicContact CB-CB 4.23Å; A37-A42 PolarHBondContact O-N 3.45Å; A37-A42 VanDerWaalsContact O-N 3.13Å; A37-V45 HydrophobicContact CB-CB 4.43Å; A37-A88 HydrophobicContact CB-CB 4.01Å; A37-A91 HydrophobicContact CB-CB 3.8Å |
| 38 | T | 84.3 | Confident | 92.7 | Very high | 45 Ų | 45 | 45.7 Ų | 45.7 | 28% | 0.276 | 23% | 0.23 | S | C | . | . | I | π-helix | trans | -67.1 | -38.6 | 174.1 | -57.7 | 0 | 0 | 0 | 0 | 112.2 | G34 L35 L36 | G34-T38 PolarHBondContact O-N 2.84Å; G34-T38 PolarHBondContact O-OG1 3.4Å; L35-T38 PolarHBondContact O-N 3.11Å; L36-T38 VanDerWaalsContact C-N 3.32Å; L36-T38 PolarHBondContact O-N 3.33Å |
| 39 | K | 86.1 | Confident | 92.9 | Very high | 164 Ų | 164 | 41.3 Ų | 41.3 | 71% | 0.713 | 20% | 0.204 | S | C | * | . | I | π-helix | trans | -84.9 | -46.3 | -173.3 | -175.4 | 176.1 | 178.1 | -178.8 | 0 | 114.4 | L35 L36 | L35-K39 WeakPolarHBondContact O-CB 3.41Å; L35-K39 PolarHBondContact O-N 3.01Å; L36-K39 PolarHBondContact O-N 3.37Å |
| 40 | F | 89 | Confident | 93.1 | Very high | 125 Ų | 125 | 41.7 Ų | 41.7 | 55% | 0.548 | 21% | 0.206 | S | C | . | . | I | π-helix | trans | -104.2 | -5.9 | -173.3 | -63.8 | -69.4 | 0 | 0 | 0 | 113.2 | L36 | L36-F40 HydrophobicContact CB-CD2 4.4Å; L36-F40 HydrophobicContact CD2-CD2 3.57Å; L36-F40 HydrophobicContact CD2-CE2 3.48Å; L36-F40 VanDerWaalsContact CD2-CE2 3.48Å; L36-F40 PolarHBondContact O-N 3.47Å |
| 41 | G | 90.8 | Very high | 93.3 | Very high | 8 Ų | 8 | 44.3 Ų | 44.3 | 8% | 0.082 | 22% | 0.218 | C | C | . | . | I | π-helix | trans | 96 | 127.7 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | A37 K43 W44 V45 N160 | A37-G41 CarbonylContact O-C 3.46Å; A37-G41 VanDerWaalsContact O-C 3.28Å; A37-G41 VanDerWaalsContact O-CA 3.23Å; A37-G41 WeakPolarHBondContact O-CA 3.13Å; A37-G41 PolarHBondContact O-N 3.23Å; A37-G41 VanDerWaalsContact O-N 3.16Å; G41-K43 VanDerWaalsContact C-N 3.28Å; G41-K43 PolarHBondContact O-N 2.94Å; G41-W44 PolarHBondContact O-N 3.38Å; G41-V45 PolarHBondContact O-N 3.11Å; G41-N160 WeakPolarHBondContact CA-OD1 3.5Å |
| 42 | A | 93.1 | Very high | 93.5 | Very high | 2 Ų | 2 | 44.6 Ų | 44.6 | 2% | 0.017 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -57.4 | -34 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | A37 W44 F46 A88 A91 L92 N160 | A37-A42 HydrophobicContact CB-CB 4.23Å; A37-A42 PolarHBondContact O-N 3.45Å; A37-A42 VanDerWaalsContact O-N 3.13Å; A42-W44 PolarHBondContact O-N 3.43Å; A42-F46 VanDerWaalsContact O-CB 3.25Å; A42-F46 WeakPolarHBondContact O-CB 3.28Å; A42-F46 PolarHBondContact O-N 3.08Å; A42-A88 WeakPolarHBondContact CB-O 3.25Å; A42-A91 HydrophobicContact CB-CB 4Å; A42-L92 HydrophobicContact CB-CB 3.81Å; A42-L92 HydrophobicContact CB-CD1 4.05Å; A42-N160 PolarHBondContact N-OD1 3.44Å; A42-N160 VanDerWaalsContact N-OD1 3.11Å |
| 43 | K | 95.3 | Very high | 93.8 | Very high | 20 Ų | 20 | 42.6 Ų | 42.6 | 9% | 0.087 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -54.4 | -51.9 | 175.7 | 175.4 | -162.4 | 174.6 | 165.4 | 0 | 111.1 | G41 G47 W154 T155 V158 N160 | G41-K43 VanDerWaalsContact C-N 3.28Å; G41-K43 PolarHBondContact O-N 2.94Å; K43-G47 PolarHBondContact O-N 3.45Å; K43-W154 PolarHBondContact O-NE1 3.19Å; K43-T155 PolarHBondContact NZ-O 3.06Å; K43-V158 HydrophobicContact CB-CG1 4.43Å; K43-V158 WeakPolarHBondContact CD-O 3.36Å; K43-V158 WeakPolarHBondContact CE-O 3.32Å; K43-V158 HydrophobicContact CG-CB 4.32Å; K43-V158 HydrophobicContact CG-CG1 4.08Å; K43-V158 PolarHBondContact NZ-O 3.24Å; K43-N160 WeakPolarHBondContact CB-OD1 3.41Å; K43-N160 PolarHBondContact N-OD1 2.89Å |
| 44 | W | 96.6 | Very high | 94.1 | Very high | 106 Ų | 106 | 42.8 Ų | 42.8 | 40% | 0.402 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -75.7 | -38.1 | -172.9 | -69.5 | 122 | 0 | 0 | 0 | 111.4 | G41 A42 G47 L48 T155 | G41-W44 PolarHBondContact O-N 3.38Å; A42-W44 PolarHBondContact O-N 3.43Å; W44-G47 PolarHBondContact O-N 3.29Å; W44-L48 WeakPolarHBondContact O-CB 3.25Å; W44-L48 VanDerWaalsContact O-CG 3.25Å; W44-L48 WeakPolarHBondContact O-CG 3.44Å; W44-L48 PolarHBondContact O-N 3.1Å; W44-T155 HydrophobicContact CH2-CG2 4.06Å; W44-T155 HydrophobicContact CZ3-CG2 3.57Å |
| 45 | V | 96.8 | Very high | 94.5 | Very high | 14 Ų | 14 | 45.5 Ų | 45.5 | 9% | 0.085 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.6 | -44.9 | 177 | 178.7 | 0 | 0 | 0 | 0 | 111.1 | L36 A37 G41 G49 V84 A88 | L36-V45 HydrophobicContact CB-CG1 4.32Å; L36-V45 HydrophobicContact CB-CG2 3.9Å; A37-V45 HydrophobicContact CB-CB 4.43Å; G41-V45 PolarHBondContact O-N 3.11Å; V45-G49 PolarHBondContact O-N 3.01Å; V45-V84 HydrophobicContact CG1-CB 3.66Å; V45-V84 HydrophobicContact CG1-CG1 4.47Å; V45-V84 HydrophobicContact CG1-CG2 3.68Å; V45-V84 WeakPolarHBondContact O-CG2 3.35Å; V45-A88 HydrophobicContact CB-CB 4.03Å; V45-A88 HydrophobicContact CG1-CB 3.85Å |
| 46 | F | 97.4 | Very high | 94.9 | Very high | 41 Ų | 41 | 45.1 Ų | 45.1 | 18% | 0.18 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.4 | -50.8 | 174.7 | -171.8 | -87.7 | 0 | 0 | 0 | 112 | A42 G49 T50 T85 A88 W150 W154 | A42-F46 VanDerWaalsContact O-CB 3.25Å; A42-F46 WeakPolarHBondContact O-CB 3.28Å; A42-F46 PolarHBondContact O-N 3.08Å; F46-G49 PolarHBondContact O-N 2.83Å; F46-T50 HydrophobicContact CD1-CG2 4.35Å; F46-T50 HydrophobicContact CE1-CG2 3.97Å; F46-T50 HydrophobicContact CZ-CG2 4.27Å; F46-T50 WeakPolarHBondContact O-CG2 3.45Å; F46-T50 PolarHBondContact O-N 3.24Å; F46-T50 PolarHBondContact O-OG1 3.39Å; F46-T85 VanDerWaalsContact CD2-O 3.23Å; F46-T85 WeakPolarHBondContact CD2-O 3.4Å; F46-A88 HydrophobicContact CB-CB 3.93Å; F46-A88 HydrophobicContact CD2-CB 4.48Å; F46-W150 AromaticContact CD1-CH2 3.82Å; F46-W150 HydrophobicContact CD1-CH2 3.82Å; F46-W150 AromaticContact CE1-CH2 3.42Å; F46-W150 HydrophobicContact CE1-CH2 3.42Å; F46-W150 VanDerWaalsContact CE1-CH2 3.42Å; F46-W150 HydrophobicContact CE1-CZ2 4.09Å; F46-W150 HydrophobicContact CE1-CZ3 4.22Å; F46-W154 HydrophobicContact CB-CZ2 4.2Å; F46-W154 AromaticContact CD1-CE2 3.96Å; F46-W154 AromaticContact CD1-CH2 3.96Å; F46-W154 HydrophobicContact CD1-CH2 3.96Å; F46-W154 AromaticContact CD1-CZ2 3.66Å; F46-W154 HydrophobicContact CD1-CZ2 3.66Å; F46-W154 HydrophobicContact CE1-CH2 4.33Å; F46-W154 HydrophobicContact CE1-CZ2 4.44Å; F46-W154 HydrophobicContact CG-CZ2 4.14Å |
| 47 | G | 97.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.9 | -45.2 | -177 | 0 | 0 | 0 | 0 | 0 | 113.1 | K43 W44 T50 F51 F151 | K43-G47 PolarHBondContact O-N 3.45Å; W44-G47 PolarHBondContact O-N 3.29Å; G47-T50 WeakPolarHBondContact CA-OG1 3.46Å; G47-T50 PolarHBondContact O-OG1 3.13Å; G47-F51 VanDerWaalsContact O-CB 3.24Å; G47-F51 WeakPolarHBondContact O-CB 3.48Å; G47-F51 PolarHBondContact O-N 3.46Å; G47-F151 VanDerWaalsContact C-CD2 3.47Å; G47-F151 WeakPolarHBondContact O-CD2 3.48Å; G47-F151 WeakPolarHBondContact O-CE2 3.32Å |
| 48 | L | 97.7 | Very high | 95.4 | Very high | 80 Ų | 80 | 44.4 Ų | 44.4 | 42% | 0.419 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -69.8 | -35.8 | 178.4 | -68.9 | 172.4 | 0 | 0 | 0 | 111.9 | W44 F51 L52 F151 | W44-L48 WeakPolarHBondContact O-CB 3.25Å; W44-L48 VanDerWaalsContact O-CG 3.25Å; W44-L48 WeakPolarHBondContact O-CG 3.44Å; W44-L48 PolarHBondContact O-N 3.1Å; L48-F51 PolarHBondContact O-N 3.34Å; L48-L52 WeakPolarHBondContact O-CB 3.12Å; L48-L52 VanDerWaalsContact O-CG 3.25Å; L48-L52 WeakPolarHBondContact O-CG 3.49Å; L48-L52 PolarHBondContact O-N 3.49Å; L48-F151 HydrophobicContact CD2-CE2 4.37Å; L48-F151 HydrophobicContact CD2-CZ 3.95Å |
| 49 | G | 97.8 | Very high | 96.1 | Very high | 4 Ų | 4 | 46 Ų | 46 | 4% | 0.041 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.3 | -52.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | V45 F46 F51 L52 T53 A81 | V45-G49 PolarHBondContact O-N 3.01Å; F46-G49 PolarHBondContact O-N 2.83Å; G49-F51 PolarHBondContact O-N 2.96Å; G49-L52 PolarHBondContact O-N 3.15Å; G49-T53 WeakPolarHBondContact O-CB 3.49Å; G49-T53 PolarHBondContact O-N 3.14Å; G49-T53 PolarHBondContact O-OG1 3.42Å; G49-A81 CarbonylContact C-O 3.55Å; G49-A81 WeakPolarHBondContact CA-O 3.47Å |
| 50 | T | 97.6 | Very high | 96.6 | Very high | 25 Ų | 25 | 38.4 Ų | 38.4 | 15% | 0.153 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.6 | -41.6 | 177.2 | 49.4 | 0 | 0 | 0 | 0 | 113.1 | F46 G47 T53 A54 T85 W150 | F46-T50 HydrophobicContact CD1-CG2 4.35Å; F46-T50 HydrophobicContact CE1-CG2 3.97Å; F46-T50 HydrophobicContact CZ-CG2 4.27Å; F46-T50 WeakPolarHBondContact O-CG2 3.45Å; F46-T50 PolarHBondContact O-N 3.24Å; F46-T50 PolarHBondContact O-OG1 3.39Å; G47-T50 WeakPolarHBondContact CA-OG1 3.46Å; G47-T50 PolarHBondContact O-OG1 3.13Å; T50-T53 PolarHBondContact O-N 3.42Å; T50-A54 WeakPolarHBondContact O-CB 3.12Å; T50-A54 PolarHBondContact O-N 3.44Å; T50-T85 HydrophobicContact CG2-CG2 3.81Å; T50-W150 HydrophobicContact CG2-CZ3 4.39Å; T50-W150 WeakPolarHBondContact OG1-CZ3 3.46Å |
| 51 | F | 98.5 | Very high | 96.9 | Very high | 55 Ų | 55 | 32.5 Ų | 32.5 | 24% | 0.241 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.2 | -46.2 | 176.5 | 174.5 | -107.4 | 0 | 0 | 0 | 112.8 | G47 L48 G49 A54 I55 I148 F151 | G47-F51 VanDerWaalsContact O-CB 3.24Å; G47-F51 WeakPolarHBondContact O-CB 3.48Å; G47-F51 PolarHBondContact O-N 3.46Å; L48-F51 PolarHBondContact O-N 3.34Å; G49-F51 PolarHBondContact O-N 2.96Å; F51-A54 WeakPolarHBondContact O-CB 3.13Å; F51-A54 PolarHBondContact O-N 2.96Å; F51-I55 HydrophobicContact CD1-CD1 3.95Å; F51-I55 HydrophobicContact CE1-CD1 3.38Å; F51-I55 HydrophobicContact CE1-CG1 4.42Å; F51-I55 HydrophobicContact CE2-CD1 4.22Å; F51-I55 HydrophobicContact CZ-CD1 3.54Å; F51-I55 HydrophobicContact CZ-CG1 4.29Å; F51-I55 PolarHBondContact O-N 3.02Å; F51-I148 HydrophobicContact CD2-CG1 4.03Å; F51-I148 HydrophobicContact CD2-CG2 4.46Å; F51-I148 HydrophobicContact CE2-CD1 4.47Å; F51-I148 HydrophobicContact CE2-CG1 4.04Å; F51-I148 HydrophobicContact CE2-CG2 4.09Å; F51-F151 HydrophobicContact CB-CB 4.24Å; F51-F151 HydrophobicContact CB-CD1 3.97Å; F51-F151 HydrophobicContact CB-CD2 3.92Å; F51-F151 HydrophobicContact CB-CE1 4.28Å; F51-F151 HydrophobicContact CB-CE2 4.24Å; F51-F151 HydrophobicContact CB-CG 3.77Å; F51-F151 HydrophobicContact CB-CZ 4.4Å; F51-F151 HydrophobicContact CD1-CE1 4.49Å; F51-F151 HydrophobicContact CD2-CB 4.32Å; F51-F151 AromaticContact CD2-CD1 3.54Å; F51-F151 HydrophobicContact CD2-CD1 3.54Å; F51-F151 HydrophobicContact CD2-CE1 4.06Å; F51-F151 HydrophobicContact CD2-CG 4.03Å; F51-F151 HydrophobicContact CE2-CD1 4.21Å; F51-F151 AromaticContact CG-CD1 3.83Å; F51-F151 HydrophobicContact CG-CD1 3.83Å; F51-F151 HydrophobicContact CG-CE1 4.02Å; F51-F151 HydrophobicContact CG-CG 4.15Å |
| 52 | L | 98.2 | Very high | 97.1 | Very high | 75 Ų | 75 | 36.4 Ų | 36.4 | 39% | 0.393 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -66.1 | -41.3 | 177.7 | -72.3 | 173 | 0 | 0 | 0 | 111.3 | L48 G49 A54 I55 F56 A81 | L48-L52 WeakPolarHBondContact O-CB 3.12Å; L48-L52 VanDerWaalsContact O-CG 3.25Å; L48-L52 WeakPolarHBondContact O-CG 3.49Å; L48-L52 PolarHBondContact O-N 3.49Å; G49-L52 PolarHBondContact O-N 3.15Å; L52-A54 PolarHBondContact O-N 3.35Å; L52-I55 HydrophobicContact CD2-CD1 4.36Å; L52-I55 PolarHBondContact O-N 2.99Å; L52-F56 HydrophobicContact CB-CE2 4.2Å; L52-F56 WeakPolarHBondContact O-CD2 3.41Å; L52-F56 WeakPolarHBondContact O-CG 3.46Å; L52-F56 PolarHBondContact O-N 3.22Å; L52-A81 HydrophobicContact CB-CB 3.68Å |
| 53 | T | 98.2 | Very high | 97.3 | Very high | 16 Ų | 16 | 36.5 Ų | 36.5 | 10% | 0.098 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -56.8 | -41.2 | 172.4 | -61.2 | 0 | 0 | 0 | 0 | 111.3 | G49 T50 F56 A57 M78 A81 E82 | G49-T53 WeakPolarHBondContact O-CB 3.49Å; G49-T53 PolarHBondContact O-N 3.14Å; G49-T53 PolarHBondContact O-OG1 3.42Å; T50-T53 PolarHBondContact O-N 3.42Å; T53-F56 PolarHBondContact O-N 3.15Å; T53-A57 WeakPolarHBondContact O-CB 3.42Å; T53-A57 PolarHBondContact O-N 3.17Å; T53-M78 HydrophobicContact CG2-CB 4.49Å; T53-M78 HydrophobicContact CG2-CE 4.15Å; T53-A81 WeakPolarHBondContact OG1-CB 3.38Å; T53-E82 HydrophobicContact CG2-CB 4.31Å; T53-E82 WeakPolarHBondContact CG2-OE2 3.43Å; T53-E82 WeakPolarHBondContact OG1-CB 3.23Å; T53-E82 PolarHBondContact OG1-N 3.16Å |
| 54 | A | 98.2 | Very high | 97.3 | Very high | 4 Ų | 4 | 35.7 Ų | 35.7 | 3% | 0.033 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.2 | -42.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T50 F51 L52 F56 A57 L58 T147 I148 | T50-A54 WeakPolarHBondContact O-CB 3.12Å; T50-A54 PolarHBondContact O-N 3.44Å; F51-A54 WeakPolarHBondContact O-CB 3.13Å; F51-A54 PolarHBondContact O-N 2.96Å; L52-A54 PolarHBondContact O-N 3.35Å; A54-F56 VanDerWaalsContact C-N 3.33Å; A54-F56 PolarHBondContact O-N 3.35Å; A54-A57 WeakPolarHBondContact O-CB 3.35Å; A54-A57 PolarHBondContact O-N 2.96Å; A54-L58 WeakPolarHBondContact O-CG 3.42Å; A54-L58 PolarHBondContact O-N 3.32Å; A54-T147 HydrophobicContact CB-CG2 3.76Å; A54-I148 HydrophobicContact CB-CG1 3.91Å |
| 55 | I | 98.5 | Very high | 97.2 | Very high | 56 Ų | 56 | 36.6 Ų | 36.6 | 29% | 0.287 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -57.5 | -48 | 174 | -70 | 170.6 | 0 | 0 | 0 | 110.4 | F51 L52 A57 L58 L59 | F51-I55 HydrophobicContact CD1-CD1 3.95Å; F51-I55 HydrophobicContact CE1-CD1 3.38Å; F51-I55 HydrophobicContact CE1-CG1 4.42Å; F51-I55 HydrophobicContact CE2-CD1 4.22Å; F51-I55 HydrophobicContact CZ-CD1 3.54Å; F51-I55 HydrophobicContact CZ-CG1 4.29Å; F51-I55 PolarHBondContact O-N 3.02Å; L52-I55 HydrophobicContact CD2-CD1 4.36Å; L52-I55 PolarHBondContact O-N 2.99Å; I55-A57 VanDerWaalsContact C-N 3.33Å; I55-A57 PolarHBondContact O-N 2.85Å; I55-L58 WeakPolarHBondContact O-CB 3.23Å; I55-L58 PolarHBondContact O-N 3.14Å; I55-L59 HydrophobicContact CG2-CD1 4.23Å; I55-L59 WeakPolarHBondContact O-CG 3.47Å; I55-L59 PolarHBondContact O-N 3.45Å |
| 56 | F | 98.2 | Very high | 97.1 | Very high | 39 Ų | 39 | 39.4 Ų | 39.4 | 17% | 0.171 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -68.1 | -33 | 179.8 | -63.1 | -50.1 | 0 | 0 | 0 | 112.6 | L52 T53 A54 L59 T60 V74 L77 M78 A81 | L52-F56 HydrophobicContact CB-CE2 4.2Å; L52-F56 WeakPolarHBondContact O-CD2 3.41Å; L52-F56 WeakPolarHBondContact O-CG 3.46Å; L52-F56 PolarHBondContact O-N 3.22Å; T53-F56 PolarHBondContact O-N 3.15Å; A54-F56 VanDerWaalsContact C-N 3.33Å; A54-F56 PolarHBondContact O-N 3.35Å; F56-L59 HydrophobicContact CD1-CD1 4.14Å; F56-L59 PolarHBondContact O-N 3.43Å; F56-T60 PolarHBondContact O-N 3.26Å; F56-T60 PolarHBondContact O-OG1 2.81Å; F56-T60 VanDerWaalsContact O-OG1 3.09Å; F56-V74 HydrophobicContact CB-CG1 4.05Å; F56-V74 WeakPolarHBondContact O-CG1 3.48Å; F56-L77 HydrophobicContact CD1-CB 4.01Å; F56-L77 HydrophobicContact CD1-CD1 4.12Å; F56-L77 HydrophobicContact CD2-CB 3.89Å; F56-L77 HydrophobicContact CE1-CB 3.93Å; F56-L77 HydrophobicContact CE1-CD1 3.66Å; F56-L77 HydrophobicContact CE1-CG 4.4Å; F56-L77 HydrophobicContact CE2-CB 3.8Å; F56-L77 HydrophobicContact CG-CB 4.02Å; F56-L77 HydrophobicContact CZ-CB 3.83Å; F56-L77 HydrophobicContact CZ-CD1 4.06Å; F56-L77 HydrophobicContact CZ-CG 4.42Å; F56-M78 HydrophobicContact CB-CB 4.43Å; F56-M78 HydrophobicContact CB-CG 3.33Å; F56-M78 HydrophobicContact CB-SD 4.43Å; F56-M78 HydrophobicContact CG-CG 4.35Å; F56-A81 HydrophobicContact CD2-CB 4.21Å; F56-A81 HydrophobicContact CE2-CB 4.14Å |
| 57 | A | 96.9 | Very high | 96.9 | Very high | 13 Ų | 13 | 38.7 Ų | 38.7 | 11% | 0.107 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.3 | -46 | 170.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | T53 A54 I55 L59 T60 M78 | T53-A57 WeakPolarHBondContact O-CB 3.42Å; T53-A57 PolarHBondContact O-N 3.17Å; A54-A57 WeakPolarHBondContact O-CB 3.35Å; A54-A57 PolarHBondContact O-N 2.96Å; I55-A57 VanDerWaalsContact C-N 3.33Å; I55-A57 PolarHBondContact O-N 2.85Å; A57-L59 PolarHBondContact O-N 3.45Å; A57-T60 WeakPolarHBondContact O-CB 3.35Å; A57-T60 PolarHBondContact O-N 2.84Å; A57-T60 PolarHBondContact O-OG1 3.22Å; A57-M78 HydrophobicContact CB-CE 4.01Å |
| 58 | L | 97.7 | Very high | 96.8 | Very high | 41 Ų | 41 | 39.8 Ų | 39.8 | 22% | 0.215 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.5 | -30.7 | 175.8 | -66.1 | 177.3 | 0 | 0 | 0 | 113.2 | A54 I55 T60 P61 Y141 I145 I148 | A54-L58 WeakPolarHBondContact O-CG 3.42Å; A54-L58 PolarHBondContact O-N 3.32Å; I55-L58 WeakPolarHBondContact O-CB 3.23Å; I55-L58 PolarHBondContact O-N 3.14Å; L58-T60 VanDerWaalsContact C-N 3.3Å; L58-P61 WeakPolarHBondContact O-CD 3.21Å; L58-Y141 HydrophobicContact CD2-CD1 3.96Å; L58-Y141 WeakPolarHBondContact O-CE1 3.49Å; L58-I145 HydrophobicContact CD2-CG1 4.21Å; L58-I148 HydrophobicContact CD1-CD1 3.58Å |
| 59 | L | 97.4 | Very high | 96.7 | Very high | 79 Ų | 79 | 38.5 Ų | 38.5 | 41% | 0.414 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -77.4 | -14.2 | 175.8 | -67.5 | 174.2 | 0 | 0 | 0 | 113.3 | I55 F56 A57 V62 A63 | I55-L59 HydrophobicContact CG2-CD1 4.23Å; I55-L59 WeakPolarHBondContact O-CG 3.47Å; I55-L59 PolarHBondContact O-N 3.45Å; F56-L59 HydrophobicContact CD1-CD1 4.14Å; F56-L59 PolarHBondContact O-N 3.43Å; A57-L59 PolarHBondContact O-N 3.45Å; L59-V62 PolarHBondContact O-N 2.89Å; L59-A63 WeakPolarHBondContact O-CB 3.37Å; L59-A63 PolarHBondContact O-N 2.9Å |
| 60 | T | 97 | Very high | 96.6 | Very high | 4 Ų | 4 | 42.3 Ų | 42.3 | 3% | 0.025 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.8 | -43.8 | -174.1 | -63.8 | 0 | 0 | 0 | 0 | 113.1 | F56 A57 L58 V62 A63 A64 F140 | F56-T60 PolarHBondContact O-N 3.26Å; F56-T60 PolarHBondContact O-OG1 2.81Å; F56-T60 VanDerWaalsContact O-OG1 3.09Å; A57-T60 WeakPolarHBondContact O-CB 3.35Å; A57-T60 PolarHBondContact O-N 2.84Å; A57-T60 PolarHBondContact O-OG1 3.22Å; L58-T60 VanDerWaalsContact C-N 3.3Å; T60-V62 PolarHBondContact O-N 3.13Å; T60-A63 PolarHBondContact O-N 2.99Å; T60-A64 WeakPolarHBondContact O-CB 3.42Å; T60-A64 PolarHBondContact O-N 2.96Å; T60-F140 HydrophobicContact CG2-CD1 3.85Å; T60-F140 HydrophobicContact CG2-CE1 3.56Å; T60-F140 HydrophobicContact CG2-CE2 4.4Å; T60-F140 HydrophobicContact CG2-CG 4.39Å; T60-F140 HydrophobicContact CG2-CZ 3.86Å |
| 61 | P | 95.5 | Very high | 96.6 | Very high | 1 Ų | 1 | 41.3 Ų | 41.3 | 1% | 0.006 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.3 | -38.2 | 176.1 | -25.6 | 36.8 | 0 | 0 | 0 | 114.4 | L58 A64 N65 W136 P137 F140 Y141 | L58-P61 WeakPolarHBondContact O-CD 3.21Å; P61-A64 PolarHBondContact O-N 3.11Å; P61-N65 PolarHBondContact O-N 2.79Å; P61-N65 PolarHBondContact O-ND2 2.72Å; P61-W136 HydrophobicContact CB-CH2 4Å; P61-W136 HydrophobicContact CB-CZ2 4.49Å; P61-W136 HydrophobicContact CB-CZ3 4.46Å; P61-W136 HydrophobicContact CG-CH2 4.36Å; P61-W136 HydrophobicContact CG-CZ3 4.34Å; P61-P137 HydrophobicContact CB-CB 3.81Å; P61-P137 HydrophobicContact CB-CG 4.31Å; P61-P137 HydrophobicContact CG-CB 3.79Å; P61-F140 HydrophobicContact CG-CB 3.9Å; P61-F140 HydrophobicContact CG-CD2 4.2Å; P61-F140 HydrophobicContact CG-CG 4.22Å; P61-Y141 HydrophobicContact CB-CE1 4.35Å; P61-Y141 HydrophobicContact CG-CD1 4.49Å; P61-Y141 HydrophobicContact CG-CE1 3.85Å; P61-Y141 HydrophobicContact CG-CE2 4.49Å |
| 62 | V | 95.5 | Very high | 96.6 | Very high | 89 Ų | 89 | 41.2 Ų | 41.2 | 54% | 0.539 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -66.9 | -42 | 176.1 | -178.8 | 0 | 0 | 0 | 0 | 110.3 | L59 T60 A64 N65 A66 | L59-V62 PolarHBondContact O-N 2.89Å; T60-V62 PolarHBondContact O-N 3.13Å; V62-A64 VanDerWaalsContact C-N 3.32Å; V62-A64 PolarHBondContact O-N 2.84Å; V62-N65 PolarHBondContact O-N 3.05Å; V62-A66 PolarHBondContact O-N 3.14Å |
| 63 | A | 96.5 | Very high | 96.5 | Very high | 4 Ų | 4 | 43.1 Ų | 43.1 | 3% | 0.033 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.4 | -37.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | L59 T60 N65 A66 G67 M70 V71 V74 | L59-A63 WeakPolarHBondContact O-CB 3.37Å; L59-A63 PolarHBondContact O-N 2.9Å; T60-A63 PolarHBondContact O-N 2.99Å; A63-N65 VanDerWaalsContact C-N 3.35Å; A63-N65 PolarHBondContact O-N 2.85Å; A63-A66 PolarHBondContact O-N 3.12Å; A63-A66 VanDerWaalsContact O-N 3.1Å; A63-G67 PolarHBondContact O-N 3.2Å; A63-M70 HydrophobicContact CB-CB 4.24Å; A63-M70 HydrophobicContact CB-CG 3.7Å; A63-V71 HydrophobicContact CB-CG2 4.29Å; A63-V74 HydrophobicContact CB-CB 4.32Å; A63-V74 HydrophobicContact CB-CG2 3.75Å |
| 64 | A | 95.7 | Very high | 96.5 | Very high | 3 Ų | 3 | 42.5 Ų | 42.5 | 3% | 0.025 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.3 | -42 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F8 W10 T60 P61 V62 A66 G67 V71 W136 | F8-A64 HydrophobicContact CD2-CB 4.42Å; F8-A64 HydrophobicContact CE1-CB 4.39Å; F8-A64 WeakPolarHBondContact CE1-O 3.44Å; F8-A64 HydrophobicContact CE2-CB 3.59Å; F8-A64 HydrophobicContact CZ-CB 3.57Å; W10-A64 HydrophobicContact CH2-CB 4.1Å; T60-A64 WeakPolarHBondContact O-CB 3.42Å; T60-A64 PolarHBondContact O-N 2.96Å; P61-A64 PolarHBondContact O-N 3.11Å; V62-A64 VanDerWaalsContact C-N 3.32Å; V62-A64 PolarHBondContact O-N 2.84Å; A64-A66 PolarHBondContact O-N 3.24Å; A64-G67 PolarHBondContact O-N 3.16Å; A64-G67 VanDerWaalsContact O-N 3.1Å; A64-V71 HydrophobicContact CB-CG2 3.94Å; A64-W136 HydrophobicContact CB-CH2 3.69Å; A64-W136 HydrophobicContact CB-CZ2 4.21Å |
| 65 | N | 93.7 | Very high | 96.4 | Very high | 125 Ų | 125 | 44.6 Ų | 44.6 | 67% | 0.668 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -65.4 | -26.5 | 174.3 | -69.1 | -37.2 | 0 | 0 | 0 | 113.3 | F8 P61 V62 A63 G67 | F8-N65 WeakPolarHBondContact CZ-OD1 3.32Å; P61-N65 PolarHBondContact O-N 2.79Å; P61-N65 PolarHBondContact O-ND2 2.72Å; V62-N65 PolarHBondContact O-N 3.05Å; A63-N65 VanDerWaalsContact C-N 3.35Å; A63-N65 PolarHBondContact O-N 2.85Å; N65-G67 VanDerWaalsContact C-N 3.32Å |
| 66 | A | 94.9 | Very high | 96.4 | Very high | 74 Ų | 74 | 43.8 Ų | 43.8 | 61% | 0.612 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -82 | -9.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | V62 A63 A64 M70 | V62-A66 PolarHBondContact O-N 3.14Å; A63-A66 PolarHBondContact O-N 3.12Å; A63-A66 VanDerWaalsContact O-N 3.1Å; A64-A66 PolarHBondContact O-N 3.24Å; A66-M70 HydrophobicContact CB-CB 3.99Å; A66-M70 HydrophobicContact CB-CG 4.1Å |
| 67 | G | 94.5 | Very high | 96.4 | Very high | 26 Ų | 26 | 44 Ų | 44 | 27% | 0.268 | 26% | 0.263 | S | S | . | . | trans | 110.3 | 164.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | A63 A64 N65 G69 M70 V71 | A63-G67 PolarHBondContact O-N 3.2Å; A64-G67 PolarHBondContact O-N 3.16Å; A64-G67 VanDerWaalsContact O-N 3.1Å; N65-G67 VanDerWaalsContact C-N 3.32Å; G67-G69 VanDerWaalsContact C-N 3.28Å; G67-G69 PolarHBondContact O-N 2.72Å; G67-M70 PolarHBondContact O-N 3.37Å; G67-V71 PolarHBondContact O-N 2.93Å | ||
| 68 | A | 94.6 | Very high | 96.4 | Very high | 22 Ų | 22 | 44.4 Ų | 44.4 | 18% | 0.182 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -55.4 | -37.8 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114 | W10 T14 I18 M70 V71 I72 | W10-A68 HydrophobicContact CD2-CB 4.48Å; W10-A68 HydrophobicContact CZ2-CB 4.45Å; T14-A68 HydrophobicContact CG2-CB 3.41Å; T14-A68 VanDerWaalsContact CG2-CB 3.41Å; I18-A68 HydrophobicContact CD1-CB 4.06Å; A68-M70 VanDerWaalsContact C-N 3.3Å; A68-M70 PolarHBondContact O-N 2.93Å; A68-V71 PolarHBondContact O-N 3.22Å; A68-I72 WeakPolarHBondContact O-CG1 3.2Å; A68-I72 PolarHBondContact O-N 3.16Å |
| 69 | G | 95.3 | Very high | 96.3 | Very high | 54 Ų | 54 | 42.5 Ų | 42.5 | 56% | 0.557 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -60.6 | -37.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | G67 I72 F73 | G67-G69 VanDerWaalsContact C-N 3.28Å; G67-G69 PolarHBondContact O-N 2.72Å; G69-I72 PolarHBondContact O-N 2.9Å; G69-F73 PolarHBondContact O-N 2.99Å |
| 70 | M | 97 | Very high | 96.3 | Very high | 84 Ų | 84 | 41.9 Ų | 41.9 | 41% | 0.414 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -72.8 | -36 | 177.3 | -169.1 | 61.6 | -168.7 | 0 | 0 | 111.4 | A63 A66 G67 A68 F73 V74 | A63-M70 HydrophobicContact CB-CB 4.24Å; A63-M70 HydrophobicContact CB-CG 3.7Å; A66-M70 HydrophobicContact CB-CB 3.99Å; A66-M70 HydrophobicContact CB-CG 4.1Å; G67-M70 PolarHBondContact O-N 3.37Å; A68-M70 VanDerWaalsContact C-N 3.3Å; A68-M70 PolarHBondContact O-N 2.93Å; M70-F73 HydrophobicContact CE-CD1 4.02Å; M70-F73 PolarHBondContact O-N 3.41Å; M70-F73 HydrophobicContact SD-CD1 4.06Å; M70-V74 HydrophobicContact CE-CG2 4.1Å; M70-V74 WeakPolarHBondContact O-CG2 3.5Å; M70-V74 PolarHBondContact O-N 2.72Å |
| 71 | V | 97.4 | Very high | 96.4 | Very high | 4 Ų | 4 | 42.2 Ų | 42.2 | 2% | 0.024 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.4 | -45.6 | 172.8 | -176.1 | 0 | 0 | 0 | 0 | 110.8 | W10 I18 A63 A64 G67 A68 F73 V74 R75 | W10-V71 HydrophobicContact CH2-CG2 3.87Å; W10-V71 HydrophobicContact CZ2-CG2 4.29Å; I18-V71 HydrophobicContact CD1-CG1 4.47Å; I18-V71 HydrophobicContact CG1-CB 4.48Å; I18-V71 HydrophobicContact CG1-CG1 4.33Å; I18-V71 HydrophobicContact CG2-CG1 3.66Å; A63-V71 HydrophobicContact CB-CG2 4.29Å; A64-V71 HydrophobicContact CB-CG2 3.94Å; G67-V71 PolarHBondContact O-N 2.93Å; A68-V71 PolarHBondContact O-N 3.22Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 2.61Å; V71-V74 PolarHBondContact O-N 3.06Å; V71-R75 HydrophobicContact CG1-CG 4.28Å; V71-R75 WeakPolarHBondContact O-CB 3.31Å; V71-R75 VanDerWaalsContact O-CG 3.25Å; V71-R75 WeakPolarHBondContact O-CG 3.18Å; V71-R75 PolarHBondContact O-N 2.81Å |
| 72 | I | 96.8 | Very high | 96.4 | Very high | 53 Ų | 53 | 45.1 Ų | 45.1 | 27% | 0.272 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -57.2 | -47.5 | 175.5 | -71.2 | 167.8 | 0 | 0 | 0 | 110.1 | N17 I18 A21 A68 G69 V74 R75 V76 | N17-I72 HydrophobicContact CB-CD1 4.16Å; I18-I72 HydrophobicContact CG1-CD1 4.29Å; I18-I72 HydrophobicContact CG1-CG1 3.74Å; A21-I72 HydrophobicContact CB-CB 4.32Å; A21-I72 HydrophobicContact CB-CG1 4.42Å; A21-I72 HydrophobicContact CB-CG2 3.91Å; A68-I72 WeakPolarHBondContact O-CG1 3.2Å; A68-I72 PolarHBondContact O-N 3.16Å; G69-I72 PolarHBondContact O-N 2.9Å; I72-V74 PolarHBondContact O-N 2.98Å; I72-R75 PolarHBondContact O-N 2.67Å; I72-V76 WeakPolarHBondContact O-CG2 3.43Å; I72-V76 PolarHBondContact O-N 3Å |
| 73 | F | 97.8 | Very high | 96.4 | Very high | 114 Ų | 114 | 40.9 Ų | 40.9 | 50% | 0.5 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -59.3 | -48.8 | 178.2 | -180 | -110.7 | 0 | 0 | 0 | 112.3 | G69 M70 V71 R75 V76 L77 | G69-F73 PolarHBondContact O-N 2.99Å; M70-F73 HydrophobicContact CE-CD1 4.02Å; M70-F73 PolarHBondContact O-N 3.41Å; M70-F73 HydrophobicContact SD-CD1 4.06Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 2.61Å; F73-R75 VanDerWaalsContact C-N 3.33Å; F73-R75 PolarHBondContact O-N 3.18Å; F73-V76 PolarHBondContact O-N 3.18Å; F73-L77 HydrophobicContact CD1-CD1 4.09Å; F73-L77 HydrophobicContact CE1-CD1 3.58Å; F73-L77 HydrophobicContact CE1-CG 4.38Å; F73-L77 HydrophobicContact CZ-CD1 3.82Å; F73-L77 HydrophobicContact CZ-CD2 4.44Å; F73-L77 HydrophobicContact CZ-CG 4.29Å; F73-L77 WeakPolarHBondContact O-CG 3.22Å; F73-L77 PolarHBondContact O-N 3.37Å |
| 74 | V | 98 | Very high | 96.4 | Very high | 3 Ų | 3 | 41.4 Ų | 41.4 | 2% | 0.018 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.7 | -40 | 176.5 | 170.9 | 0 | 0 | 0 | 0 | 111.5 | F56 A63 M70 V71 I72 V76 L77 M78 | F56-V74 HydrophobicContact CB-CG1 4.05Å; F56-V74 WeakPolarHBondContact O-CG1 3.48Å; A63-V74 HydrophobicContact CB-CB 4.32Å; A63-V74 HydrophobicContact CB-CG2 3.75Å; M70-V74 HydrophobicContact CE-CG2 4.1Å; M70-V74 WeakPolarHBondContact O-CG2 3.5Å; M70-V74 PolarHBondContact O-N 2.72Å; V71-V74 PolarHBondContact O-N 3.06Å; I72-V74 PolarHBondContact O-N 2.98Å; V74-V76 PolarHBondContact O-N 3.11Å; V74-L77 PolarHBondContact O-N 3.1Å; V74-M78 HydrophobicContact CG1-SD 4.45Å; V74-M78 WeakPolarHBondContact O-CG 3.46Å; V74-M78 PolarHBondContact O-N 2.87Å |
| 75 | R | 96.5 | Very high | 96.4 | Very high | 48 Ų | 48 | 41.7 Ų | 41.7 | 18% | 0.181 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.8 | -40.8 | 175.7 | -75.6 | -70.2 | -171.4 | 104.6 | -4.5 | 112.4 | I18 A21 F22 V71 I72 F73 L77 M78 G79 | I18-R75 PolarHBondContact O-NH1 2.97Å; A21-R75 HydrophobicContact CB-CB 3.64Å; F22-R75 WeakPolarHBondContact CA-O 3.24Å; V71-R75 HydrophobicContact CG1-CG 4.28Å; V71-R75 WeakPolarHBondContact O-CB 3.31Å; V71-R75 VanDerWaalsContact O-CG 3.25Å; V71-R75 WeakPolarHBondContact O-CG 3.18Å; V71-R75 PolarHBondContact O-N 2.81Å; I72-R75 PolarHBondContact O-N 2.67Å; F73-R75 VanDerWaalsContact C-N 3.33Å; F73-R75 PolarHBondContact O-N 3.18Å; R75-L77 VanDerWaalsContact C-N 3.34Å; R75-M78 WeakPolarHBondContact O-CB 3.23Å; R75-M78 PolarHBondContact O-N 3.01Å; R75-G79 PolarHBondContact O-N 2.9Å |
| 76 | V | 97.4 | Very high | 96.5 | Very high | 39 Ų | 39 | 38.1 Ų | 38.1 | 24% | 0.236 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.6 | -44.1 | 173.6 | 172.3 | 0 | 0 | 0 | 0 | 110.4 | A21 I72 F73 V74 M78 G79 I80 | A21-V76 HydrophobicContact CB-CG2 4.24Å; A21-V76 WeakPolarHBondContact O-CG2 3.44Å; I72-V76 WeakPolarHBondContact O-CG2 3.43Å; I72-V76 PolarHBondContact O-N 3Å; F73-V76 PolarHBondContact O-N 3.18Å; V74-V76 PolarHBondContact O-N 3.11Å; V76-M78 PolarHBondContact O-N 3.26Å; V76-G79 PolarHBondContact O-N 3.08Å; V76-I80 HydrophobicContact CG1-CD1 4.03Å; V76-I80 WeakPolarHBondContact O-CG1 3.48Å; V76-I80 PolarHBondContact O-N 3.12Å |
| 77 | L | 98.1 | Very high | 96.4 | Very high | 43 Ų | 43 | 34.6 Ų | 34.6 | 23% | 0.225 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -63.4 | -39.7 | 176.8 | -66.3 | 179.2 | 0 | 0 | 0 | 112.7 | F56 F73 V74 R75 G79 I80 A81 | F56-L77 HydrophobicContact CD1-CB 4.01Å; F56-L77 HydrophobicContact CD1-CD1 4.12Å; F56-L77 HydrophobicContact CD2-CB 3.89Å; F56-L77 HydrophobicContact CE1-CB 3.93Å; F56-L77 HydrophobicContact CE1-CD1 3.66Å; F56-L77 HydrophobicContact CE1-CG 4.4Å; F56-L77 HydrophobicContact CE2-CB 3.8Å; F56-L77 HydrophobicContact CG-CB 4.02Å; F56-L77 HydrophobicContact CZ-CB 3.83Å; F56-L77 HydrophobicContact CZ-CD1 4.06Å; F56-L77 HydrophobicContact CZ-CG 4.42Å; F73-L77 HydrophobicContact CD1-CD1 4.09Å; F73-L77 HydrophobicContact CE1-CD1 3.58Å; F73-L77 HydrophobicContact CE1-CG 4.38Å; F73-L77 HydrophobicContact CZ-CD1 3.82Å; F73-L77 HydrophobicContact CZ-CD2 4.44Å; F73-L77 HydrophobicContact CZ-CG 4.29Å; F73-L77 WeakPolarHBondContact O-CG 3.22Å; F73-L77 PolarHBondContact O-N 3.37Å; V74-L77 PolarHBondContact O-N 3.1Å; R75-L77 VanDerWaalsContact C-N 3.34Å; L77-G79 VanDerWaalsContact C-N 3.33Å; L77-G79 PolarHBondContact O-N 2.87Å; L77-I80 HydrophobicContact CD2-CD1 4.44Å; L77-I80 PolarHBondContact O-N 3.43Å; L77-A81 WeakPolarHBondContact O-CB 3.34Å; L77-A81 PolarHBondContact O-N 3.15Å |
| 78 | M | 97.4 | Very high | 96.5 | Very high | 23 Ų | 23 | 33.3 Ų | 33.3 | 11% | 0.113 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -57.6 | -47.1 | 171.1 | -70.7 | 175.6 | 71.6 | 0 | 0 | 111.1 | F22 T53 F56 A57 V74 R75 V76 I80 A81 E82 | F22-M78 HydrophobicContact CD2-CB 4.14Å; F22-M78 HydrophobicContact CE2-CB 4.39Å; T53-M78 HydrophobicContact CG2-CB 4.49Å; T53-M78 HydrophobicContact CG2-CE 4.15Å; F56-M78 HydrophobicContact CB-CB 4.43Å; F56-M78 HydrophobicContact CB-CG 3.33Å; F56-M78 HydrophobicContact CB-SD 4.43Å; F56-M78 HydrophobicContact CG-CG 4.35Å; A57-M78 HydrophobicContact CB-CE 4.01Å; V74-M78 HydrophobicContact CG1-SD 4.45Å; V74-M78 WeakPolarHBondContact O-CG 3.46Å; V74-M78 PolarHBondContact O-N 2.87Å; R75-M78 WeakPolarHBondContact O-CB 3.23Å; R75-M78 PolarHBondContact O-N 3.01Å; V76-M78 PolarHBondContact O-N 3.26Å; M78-I80 PolarHBondContact O-N 3.05Å; M78-A81 PolarHBondContact O-N 3.39Å; M78-E82 WeakPolarHBondContact O-CB 3.39Å; M78-E82 PolarHBondContact O-N 2.9Å |
| 79 | G | 96.1 | Very high | 96.5 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.2 | -48.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F22 Y26 R75 V76 L77 A81 E82 G83 | F22-G79 WeakPolarHBondContact O-CA 3.3Å; Y26-G79 VanDerWaalsContact CA-O 3.23Å; Y26-G79 WeakPolarHBondContact CA-O 3.23Å; Y26-G79 VanDerWaalsContact N-C 3.34Å; R75-G79 PolarHBondContact O-N 2.9Å; V76-G79 PolarHBondContact O-N 3.08Å; L77-G79 VanDerWaalsContact C-N 3.33Å; L77-G79 PolarHBondContact O-N 2.87Å; G79-A81 VanDerWaalsContact C-N 3.32Å; G79-A81 PolarHBondContact O-N 3.49Å; G79-E82 PolarHBondContact O-N 3.49Å; G79-G83 PolarHBondContact O-N 3.35Å |
| 80 | I | 97.4 | Very high | 96.4 | Very high | 67 Ų | 67 | 30.3 Ų | 30.3 | 34% | 0.344 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -56.9 | -46.8 | 177.5 | -70.7 | 171.3 | 0 | 0 | 0 | 110.7 | T29 V76 L77 M78 | T29-I80 WeakPolarHBondContact CB-O 3.49Å; T29-I80 HydrophobicContact CG2-CB 4.24Å; T29-I80 HydrophobicContact CG2-CG2 3.67Å; T29-I80 VanDerWaalsContact CG2-O 3.28Å; T29-I80 WeakPolarHBondContact CG2-O 3.39Å; T29-I80 PolarHBondContact OG1-O 2.66Å; V76-I80 HydrophobicContact CG1-CD1 4.03Å; V76-I80 WeakPolarHBondContact O-CG1 3.48Å; V76-I80 PolarHBondContact O-N 3.12Å; L77-I80 HydrophobicContact CD2-CD1 4.44Å; L77-I80 PolarHBondContact O-N 3.43Å; M78-I80 PolarHBondContact O-N 3.05Å |
| 81 | A | 97.6 | Very high | 96.2 | Very high | 10 Ų | 10 | 26.9 Ų | 26.9 | 8% | 0.083 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -66.2 | -42.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | G49 L52 T53 F56 L77 M78 G79 V84 | G49-A81 CarbonylContact C-O 3.55Å; G49-A81 WeakPolarHBondContact CA-O 3.47Å; L52-A81 HydrophobicContact CB-CB 3.68Å; T53-A81 WeakPolarHBondContact OG1-CB 3.38Å; F56-A81 HydrophobicContact CD2-CB 4.21Å; F56-A81 HydrophobicContact CE2-CB 4.14Å; L77-A81 WeakPolarHBondContact O-CB 3.34Å; L77-A81 PolarHBondContact O-N 3.15Å; M78-A81 PolarHBondContact O-N 3.39Å; G79-A81 VanDerWaalsContact C-N 3.32Å; G79-A81 PolarHBondContact O-N 3.49Å; A81-V84 WeakPolarHBondContact O-CG2 3.46Å |
| 82 | E | 96.2 | Very high | 96 | Very high | 62 Ų | 62 | 27.4 Ų | 27.4 | 29% | 0.29 | 14% | 0.136 | S | C | . | . | H | α-helix | trans | -78.4 | -28 | -175.8 | -163.3 | 170 | 161.2 | 0 | 0 | 113 | F22 Y26 T53 M78 G79 V84 T85 | F22-E82 HydrophobicContact CE2-CB 4.14Å; F22-E82 WeakPolarHBondContact CE2-OE2 3.42Å; F22-E82 HydrophobicContact CZ-CB 4.16Å; F22-E82 HydrophobicContact CZ-CG 4.33Å; F22-E82 WeakPolarHBondContact CZ-OE2 3.25Å; Y26-E82 HydrophobicContact CD2-CB 4.35Å; Y26-E82 HydrophobicContact CE2-CG 4.43Å; T53-E82 HydrophobicContact CG2-CB 4.31Å; T53-E82 WeakPolarHBondContact CG2-OE2 3.43Å; T53-E82 WeakPolarHBondContact OG1-CB 3.23Å; T53-E82 PolarHBondContact OG1-N 3.16Å; M78-E82 WeakPolarHBondContact O-CB 3.39Å; M78-E82 PolarHBondContact O-N 2.9Å; G79-E82 PolarHBondContact O-N 3.49Å; E82-V84 PolarHBondContact O-N 3.33Å; E82-T85 HydrophobicContact CG-CG2 4.38Å; E82-T85 WeakPolarHBondContact O-CB 3.34Å; E82-T85 VanDerWaalsContact O-CG2 3.28Å; E82-T85 WeakPolarHBondContact O-CG2 3.44Å; E82-T85 PolarHBondContact O-N 2.98Å; E82-T85 PolarHBondContact O-OG1 2.87Å |
| 83 | G | 95.9 | Very high | 95.9 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 13% | 0.127 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -16.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | Y26 T29 Q30 G79 | Y26-G83 VanDerWaalsContact CD2-CA 3.41Å; T29-G83 VanDerWaalsContact OG1-CA 3.27Å; T29-G83 WeakPolarHBondContact OG1-CA 3.35Å; Q30-G83 WeakPolarHBondContact CA-O 3.15Å; Q30-G83 PolarHBondContact NE2-O 3.36Å; Q30-G83 PolarHBondContact OE1-O 2.99Å; Q30-G83 VanDerWaalsContact OE1-O 3.08Å; G79-G83 PolarHBondContact O-N 3.35Å |
| 84 | V | 96.2 | Very high | 95.5 | Very high | 15 Ų | 15 | 21.1 Ų | 21.1 | 9% | 0.091 | 11% | 0.11 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | -14.6 | 175.4 | -53.4 | 0 | 0 | 0 | 0 | 113.9 | V45 A81 E82 P87 A88 | V45-V84 HydrophobicContact CG1-CB 3.66Å; V45-V84 HydrophobicContact CG1-CG1 4.47Å; V45-V84 HydrophobicContact CG1-CG2 3.68Å; V45-V84 WeakPolarHBondContact O-CG2 3.35Å; A81-V84 WeakPolarHBondContact O-CG2 3.46Å; E82-V84 PolarHBondContact O-N 3.33Å; V84-P87 WeakPolarHBondContact O-CD 3.41Å; V84-A88 WeakPolarHBondContact O-CB 3.19Å; V84-A88 PolarHBondContact O-N 2.97Å |
| 85 | T | 96.1 | Very high | 95.1 | Very high | 9 Ų | 9 | 22.8 Ų | 22.8 | 6% | 0.055 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -68.5 | -47.7 | -168.3 | 57.9 | 0 | 0 | 0 | 0 | 112.7 | F46 T50 E82 A88 S89 | F46-T85 VanDerWaalsContact CD2-O 3.23Å; F46-T85 WeakPolarHBondContact CD2-O 3.4Å; T50-T85 HydrophobicContact CG2-CG2 3.81Å; E82-T85 HydrophobicContact CG-CG2 4.38Å; E82-T85 WeakPolarHBondContact O-CB 3.34Å; E82-T85 VanDerWaalsContact O-CG2 3.28Å; E82-T85 WeakPolarHBondContact O-CG2 3.44Å; E82-T85 PolarHBondContact O-N 2.98Å; E82-T85 PolarHBondContact O-OG1 2.87Å; T85-A88 PolarHBondContact O-N 3.33Å; T85-S89 PolarHBondContact O-N 3.41Å; T85-S89 PolarHBondContact O-OG 2.96Å |
| 86 | W | 94.5 | Very high | 95 | Very high | 50 Ų | 50 | 22.5 Ų | 22.5 | 19% | 0.189 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -64.2 | -48.6 | 178.3 | -70.8 | 96.2 | 0 | 0 | 0 | 114 | Y26 A88 S89 Q90 I110 F326 F341 | Y26-W86 PolarHBondContact OH-NE1 3.19Å; W86-A88 PolarHBondContact O-N 3.43Å; W86-S89 PolarHBondContact O-N 3.22Å; W86-S89 PolarHBondContact O-OG 3.18Å; W86-Q90 VanDerWaalsContact O-CG 3.26Å; W86-Q90 WeakPolarHBondContact O-CG 3.34Å; W86-Q90 PolarHBondContact O-N 3.02Å; W86-Q90 VanDerWaalsContact O-N 3.13Å; W86-I110 HydrophobicContact CH2-CG2 3.94Å; W86-I110 HydrophobicContact CZ3-CD1 4.19Å; W86-I110 HydrophobicContact CZ3-CG1 3.96Å; W86-I110 HydrophobicContact CZ3-CG2 4.03Å; W86-F326 HydrophobicContact CZ3-CE1 4.08Å; W86-F341 HydrophobicContact CB-CD1 4.27Å; W86-F341 HydrophobicContact CB-CE1 3.76Å; W86-F341 HydrophobicContact CE3-CE1 4.41Å; W86-F341 HydrophobicContact CE3-CZ 4.35Å; W86-F341 HydrophobicContact CG-CE1 4.44Å |
| 87 | P | 94.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -55.9 | -40.8 | 171.9 | -24 | 30.4 | 0 | 0 | 0 | 112.7 | Q30 G34 V84 A91 G338 | Q30-P87 WeakPolarHBondContact O-CG 3.49Å; G34-P87 VanDerWaalsContact N-CB 3.34Å; V84-P87 WeakPolarHBondContact O-CD 3.41Å; P87-A91 WeakPolarHBondContact O-CB 3.42Å; P87-A91 PolarHBondContact O-N 3.46Å; P87-G338 WeakPolarHBondContact CB-O 3.24Å; P87-G338 WeakPolarHBondContact O-CA 3.12Å |
| 88 | A | 95.5 | Very high | 94.3 | Very high | 0 Ų | 0 | 18.7 Ų | 18.7 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -69.8 | -41.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | A37 A42 V45 F46 V84 T85 W86 Q90 A91 L92 | A37-A88 HydrophobicContact CB-CB 4.01Å; A42-A88 WeakPolarHBondContact CB-O 3.25Å; V45-A88 HydrophobicContact CB-CB 4.03Å; V45-A88 HydrophobicContact CG1-CB 3.85Å; F46-A88 HydrophobicContact CB-CB 3.93Å; F46-A88 HydrophobicContact CD2-CB 4.48Å; V84-A88 WeakPolarHBondContact O-CB 3.19Å; V84-A88 PolarHBondContact O-N 2.97Å; T85-A88 PolarHBondContact O-N 3.33Å; W86-A88 PolarHBondContact O-N 3.43Å; A88-Q90 VanDerWaalsContact C-N 3.29Å; A88-Q90 PolarHBondContact O-N 2.91Å; A88-A91 PolarHBondContact O-N 2.84Å; A88-L92 WeakPolarHBondContact O-CB 3.36Å; A88-L92 PolarHBondContact O-N 2.96Å |
| 89 | S | 95.3 | Very high | 93.7 | Very high | 13 Ų | 13 | 18.6 Ų | 18.6 | 9% | 0.091 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -62 | -40.4 | 176.8 | 64.8 | 0 | 0 | 0 | 0 | 111.2 | T85 W86 L92 F93 | T85-S89 PolarHBondContact O-N 3.41Å; T85-S89 PolarHBondContact O-OG 2.96Å; W86-S89 PolarHBondContact O-N 3.22Å; W86-S89 PolarHBondContact O-OG 3.18Å; S89-L92 WeakPolarHBondContact O-CB 3.25Å; S89-L92 PolarHBondContact O-N 3.44Å; S89-L92 VanDerWaalsContact O-N 3.15Å; S89-F93 WeakPolarHBondContact O-CD2 3.29Å; S89-F93 VanDerWaalsContact O-CG 3.23Å; S89-F93 WeakPolarHBondContact O-CG 3.33Å; S89-F93 PolarHBondContact O-N 3.47Å |
| 90 | Q | 93.6 | Very high | 93.1 | Very high | 0 Ų | 0 | 20.7 Ų | 20.7 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -64.9 | -42.3 | 175.9 | -67.8 | -68.5 | -21.2 | 0 | 0 | 112.5 | W86 A88 L92 F93 A94 T337 F341 | W86-Q90 VanDerWaalsContact O-CG 3.26Å; W86-Q90 WeakPolarHBondContact O-CG 3.34Å; W86-Q90 PolarHBondContact O-N 3.02Å; W86-Q90 VanDerWaalsContact O-N 3.13Å; A88-Q90 VanDerWaalsContact C-N 3.29Å; A88-Q90 PolarHBondContact O-N 2.91Å; Q90-L92 VanDerWaalsContact C-N 3.27Å; Q90-L92 PolarHBondContact O-N 3.03Å; Q90-F93 PolarHBondContact O-N 2.89Å; Q90-A94 PolarHBondContact O-N 3.48Å; Q90-T337 HydrophobicContact CB-CG2 3.93Å; Q90-F341 HydrophobicContact CB-CB 4.24Å; Q90-F341 HydrophobicContact CB-CG 4.32Å; Q90-F341 HydrophobicContact CG-CB 4.06Å; Q90-F341 HydrophobicContact CG-CD1 3.93Å; Q90-F341 HydrophobicContact CG-CD2 3.67Å; Q90-F341 HydrophobicContact CG-CE1 4.33Å; Q90-F341 HydrophobicContact CG-CE2 4.07Å; Q90-F341 HydrophobicContact CG-CG 3.6Å; Q90-F341 HydrophobicContact CG-CZ 4.39Å |
| 91 | A | 92.1 | Very high | 92.7 | Very high | 12 Ų | 12 | 21.2 Ų | 21.2 | 10% | 0.099 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.5 | -33.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A37 A42 P87 A88 | A37-A91 HydrophobicContact CB-CB 3.8Å; A42-A91 HydrophobicContact CB-CB 4Å; P87-A91 WeakPolarHBondContact O-CB 3.42Å; P87-A91 PolarHBondContact O-N 3.46Å; A88-A91 PolarHBondContact O-N 2.84Å |
| 92 | L | 93.9 | Very high | 92.2 | Very high | 15 Ų | 15 | 21 Ų | 21 | 8% | 0.079 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -69.1 | -46.6 | 175.3 | -167 | 66.5 | 0 | 0 | 0 | 110.9 | A42 A88 S89 Q90 A94 K95 W96 W154 V158 | A42-L92 HydrophobicContact CB-CB 3.81Å; A42-L92 HydrophobicContact CB-CD1 4.05Å; A88-L92 WeakPolarHBondContact O-CB 3.36Å; A88-L92 PolarHBondContact O-N 2.96Å; S89-L92 WeakPolarHBondContact O-CB 3.25Å; S89-L92 PolarHBondContact O-N 3.44Å; S89-L92 VanDerWaalsContact O-N 3.15Å; Q90-L92 VanDerWaalsContact C-N 3.27Å; Q90-L92 PolarHBondContact O-N 3.03Å; L92-A94 VanDerWaalsContact C-N 3.27Å; L92-A94 PolarHBondContact O-N 2.81Å; L92-K95 PolarHBondContact O-N 3.06Å; L92-W96 PolarHBondContact O-N 3.5Å; L92-W96 VanDerWaalsContact O-N 3.14Å; L92-W154 HydrophobicContact CD2-CH2 3.63Å; L92-W154 HydrophobicContact CD2-CZ2 3.85Å; L92-V158 HydrophobicContact CD2-CG1 4.24Å |
| 93 | F | 93.5 | Very high | 91.9 | Very high | 18 Ų | 18 | 18 Ų | 18 | 8% | 0.079 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -59.1 | -38.4 | 176.8 | -61.9 | -37.1 | 0 | 0 | 0 | 112.3 | S89 Q90 K95 W96 A97 L105 P106 A109 L330 | S89-F93 WeakPolarHBondContact O-CD2 3.29Å; S89-F93 VanDerWaalsContact O-CG 3.23Å; S89-F93 WeakPolarHBondContact O-CG 3.33Å; S89-F93 PolarHBondContact O-N 3.47Å; Q90-F93 PolarHBondContact O-N 2.89Å; F93-K95 PolarHBondContact O-N 3.46Å; F93-W96 PolarHBondContact O-N 3.19Å; F93-W96 VanDerWaalsContact O-N 3.15Å; F93-A97 VanDerWaalsContact O-CB 3.22Å; F93-A97 WeakPolarHBondContact O-CB 3.42Å; F93-A97 PolarHBondContact O-N 3.33Å; F93-L105 HydrophobicContact CD1-CD2 3.27Å; F93-L105 HydrophobicContact CE1-CD2 3.4Å; F93-L105 VanDerWaalsContact CE1-CD2 3.4Å; F93-L105 HydrophobicContact CG-CD2 4.33Å; F93-P106 HydrophobicContact CB-CG 4.07Å; F93-P106 HydrophobicContact CD1-CG 4.27Å; F93-P106 HydrophobicContact CD2-CB 3.67Å; F93-P106 HydrophobicContact CD2-CG 3.87Å; F93-P106 HydrophobicContact CE2-CB 3.77Å; F93-P106 HydrophobicContact CE2-CG 4.39Å; F93-P106 HydrophobicContact CG-CB 4.11Å; F93-P106 HydrophobicContact CG-CG 3.81Å; F93-P106 HydrophobicContact CZ-CB 4.26Å; F93-A109 HydrophobicContact CE1-CB 3.96Å; F93-A109 HydrophobicContact CZ-CB 3.64Å; F93-L330 HydrophobicContact CB-CD1 4.14Å; F93-L330 HydrophobicContact CB-CD2 4.22Å |
| 94 | A | 90.3 | Very high | 91.7 | Very high | 16 Ų | 16 | 20.9 Ų | 20.9 | 13% | 0.132 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -59.1 | -28 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q90 L92 L330 P334 | Q90-A94 PolarHBondContact O-N 3.48Å; L92-A94 VanDerWaalsContact C-N 3.27Å; L92-A94 PolarHBondContact O-N 2.81Å; A94-L330 HydrophobicContact CB-CD2 3.73Å; A94-P334 WeakPolarHBondContact CB-O 3.35Å |
| 95 | K | 90.1 | Very high | 91.5 | Very high | 39 Ų | 39 | 23.1 Ų | 23.1 | 17% | 0.17 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -94.1 | -13.7 | 179 | -67.7 | -171 | 171.4 | -162.9 | 0 | 114.4 | L92 F93 N160 E161 L180 S187 | L92-K95 PolarHBondContact O-N 3.06Å; F93-K95 PolarHBondContact O-N 3.46Å; K95-N160 WeakPolarHBondContact CD-O 3.45Å; K95-E161 HydrophobicContact CD-CG 3.94Å; K95-E161 IonicContact NZ-OE1 2.81Å; K95-E161 PolarHBondContact NZ-OE1 3.33Å; K95-L180 WeakPolarHBondContact O-CD1 3.48Å; K95-S187 WeakPolarHBondContact CE-OG 3.41Å |
| 96 | W | 92.9 | Very high | 91.4 | Very high | 41 Ų | 41 | 22.7 Ų | 22.7 | 16% | 0.155 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -122.3 | -22.4 | -170.3 | -81.3 | 93.1 | 0 | 0 | 0 | 114.6 | L92 F93 P98 S159 N160 P162 H165 I168 I176 | L92-W96 PolarHBondContact O-N 3.5Å; L92-W96 VanDerWaalsContact O-N 3.14Å; F93-W96 PolarHBondContact O-N 3.19Å; F93-W96 VanDerWaalsContact O-N 3.15Å; W96-P98 VanDerWaalsContact O-CD 3.25Å; W96-P98 WeakPolarHBondContact O-CD 3.44Å; W96-S159 WeakPolarHBondContact CZ2-O 3.29Å; W96-S159 PolarHBondContact NE1-O 3.44Å; W96-N160 PolarHBondContact NE1-O 2.99Å; W96-P162 HydrophobicContact CD2-CG 4.04Å; W96-P162 HydrophobicContact CE3-CG 4.03Å; W96-P162 HydrophobicContact CH2-CB 4.18Å; W96-P162 HydrophobicContact CH2-CG 4.33Å; W96-P162 HydrophobicContact CZ2-CB 4.5Å; W96-P162 HydrophobicContact CZ2-CG 4.32Å; W96-P162 HydrophobicContact CZ3-CB 4.2Å; W96-P162 HydrophobicContact CZ3-CG 4.19Å; W96-H165 HydrophobicContact CH2-CB 3.67Å; W96-H165 AromaticContact CH2-CD2 3.43Å; W96-H165 VanDerWaalsContact CH2-CD2 3.43Å; W96-H165 WeakPolarHBondContact CH2-CD2 3.44Å; W96-H165 AromaticContact CH2-CG 3.68Å; W96-H165 HydrophobicContact CZ2-CB 4.22Å; W96-H165 AromaticContact CZ2-CD2 3.89Å; W96-I168 HydrophobicContact CZ3-CD1 4.06Å; W96-I176 HydrophobicContact CE3-CD1 4.22Å; W96-I176 HydrophobicContact CZ3-CD1 4.34Å |
| 97 | A | 91.8 | Very high | 91.3 | Very high | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 11% | 0.106 | C | C | . | . | trans | -95.9 | 108.9 | -174.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | F93 L105 | F93-A97 VanDerWaalsContact O-CB 3.22Å; F93-A97 WeakPolarHBondContact O-CB 3.42Å; F93-A97 PolarHBondContact O-N 3.33Å; A97-L105 HydrophobicContact CB-CD1 4.42Å | ||
| 98 | P | 89.4 | Confident | 91.3 | Very high | 2 Ų | 2 | 27 Ų | 27 | 1% | 0.013 | 14% | 0.135 | C | C | . | . | trans | -57.4 | 150.8 | 172.4 | -24 | 35.5 | 0 | 0 | 0 | 111.2 | W96 S100 E101 R102 Y175 I176 | W96-P98 VanDerWaalsContact O-CD 3.25Å; W96-P98 WeakPolarHBondContact O-CD 3.44Å; P98-S100 PolarHBondContact O-N 2.8Å; P98-E101 CarbonylContact O-C 3.51Å; P98-E101 PolarHBondContact O-N 3.41Å; P98-R102 PolarHBondContact O-N 3.23Å; P98-Y175 HydrophobicContact CB-CE1 4.01Å; P98-Y175 HydrophobicContact CG-CD1 4.29Å; P98-Y175 HydrophobicContact CG-CE1 3.66Å; P98-I176 HydrophobicContact CG-CG1 4.18Å | ||
| 99 | P | 84.1 | Confident | 91.3 | Very high | 22 Ų | 22 | 29.4 Ų | 29.4 | 14% | 0.143 | 16% | 0.156 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -54.7 | -31.8 | -178.3 | -28.6 | 36 | 0 | 0 | 0 | 114.7 | E101 E183 R268 | P99-E101 VanDerWaalsContact C-N 3.33Å; P99-E183 WeakPolarHBondContact CB-OE1 3.45Å; P99-E183 HydrophobicContact CG-CG 4.23Å; P99-E183 WeakPolarHBondContact CG-OE1 3.48Å; P99-R268 VanDerWaalsContact O-CZ 3.29Å; P99-R268 PolarHBondContact O-NH1 3.35Å; P99-R268 PolarHBondContact O-NH2 3Å |
| 100 | S | 84.6 | Confident | 91.1 | Very high | 43 Ų | 43 | 29 Ų | 29 | 30% | 0.301 | 15% | 0.152 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -76.4 | -15.2 | 177.5 | 47.3 | 0 | 0 | 0 | 0 | 114.7 | P98 Y175 D265 | P98-S100 PolarHBondContact O-N 2.8Å; S100-Y175 PolarHBondContact OG-OH 2.85Å; S100-D265 WeakPolarHBondContact O-CB 3.39Å |
| 101 | E | 87.7 | Confident | 91.1 | Very high | 79 Ų | 79 | 29.1 Ų | 29.1 | 37% | 0.369 | 15% | 0.153 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -122.7 | 5 | -176.2 | -59.3 | -178.9 | 171.8 | 0 | 0 | 112.6 | P98 P99 S103 K104 L105 D265 | P98-E101 CarbonylContact O-C 3.51Å; P98-E101 PolarHBondContact O-N 3.41Å; P99-E101 VanDerWaalsContact C-N 3.33Å; E101-S103 PolarHBondContact O-N 3.4Å; E101-S103 VanDerWaalsContact O-N 3.1Å; E101-K104 PolarHBondContact O-N 3.29Å; E101-K104 VanDerWaalsContact O-N 3.11Å; E101-L105 PolarHBondContact O-N 3.12Å; E101-D265 VanDerWaalsContact CA-OD2 3.32Å; E101-D265 WeakPolarHBondContact CA-OD2 3.28Å |
| 102 | R | 88.2 | Confident | 91.2 | Very high | 4 Ų | 4 | 30.3 Ų | 30.3 | 2% | 0.015 | 17% | 0.167 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | -19.9 | -177.3 | -173.6 | 172.7 | -78.5 | 171.1 | 2.6 | 113.4 | P98 P106 E183 V327 L330 D331 | P98-R102 PolarHBondContact O-N 3.23Å; R102-P106 WeakPolarHBondContact O-CD 3.28Å; R102-P106 VanDerWaalsContact O-CG 3.3Å; R102-P106 WeakPolarHBondContact O-CG 3.45Å; R102-E183 IonicContact CZ-OE2 3.57Å; R102-E183 IonicContact NH1-OE1 3.34Å; R102-E183 IonicContact NH1-OE2 2.67Å; R102-E183 PolarHBondContact NH1-OE2 2.93Å; R102-E183 IonicContact NH2-OE2 3.7Å; R102-E183 PolarHBondContact NH2-OE2 3.38Å; R102-V327 WeakPolarHBondContact O-CG1 3.41Å; R102-L330 HydrophobicContact CG-CB 3.8Å; R102-L330 HydrophobicContact CG-CD1 3.77Å; R102-L330 HydrophobicContact CG-CG 4.42Å; R102-L330 PolarHBondContact NH1-O 2.86Å; R102-D331 WeakPolarHBondContact CD-OD1 3.3Å; R102-D331 IonicContact NH1-OD1 2.74Å |
| 103 | S | 90.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91.1 | -45.1 | 172.7 | -36.3 | 0 | 0 | 0 | 0 | 111.1 | E101 S107 G261 D265 R279 | E101-S103 PolarHBondContact O-N 3.4Å; E101-S103 VanDerWaalsContact O-N 3.1Å; S103-S107 WeakPolarHBondContact O-CB 3.35Å; S103-S107 PolarHBondContact O-N 3.44Å; S103-S107 PolarHBondContact O-OG 2.94Å; S103-G261 WeakPolarHBondContact O-CA 3.25Å; S103-D265 WeakPolarHBondContact CB-OD1 3.49Å; S103-D265 WeakPolarHBondContact CB-OD2 3.46Å; S103-D265 PolarHBondContact N-OD2 2.66Å; S103-D265 PolarHBondContact OG-OD1 3.16Å; S103-R279 PolarHBondContact OG-NH1 2.99Å; S103-R279 PolarHBondContact OG-NH2 2.9Å |
| 104 | K | 91.5 | Very high | 91.2 | Very high | 60 Ų | 60 | 32.1 Ų | 32.1 | 26% | 0.261 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -57.3 | -55.7 | -178.1 | -74.3 | 170.4 | -165.7 | -155.1 | 0 | 113.1 | E101 F108 Q262 D265 | E101-K104 PolarHBondContact O-N 3.29Å; E101-K104 VanDerWaalsContact O-N 3.11Å; K104-F108 VanDerWaalsContact O-CB 3.24Å; K104-F108 WeakPolarHBondContact O-CB 3.48Å; K104-F108 PolarHBondContact O-N 3.46Å; K104-Q262 HydrophobicContact CG-CG 4.26Å; K104-D265 HydrophobicContact CD-CB 4.16Å; K104-D265 VanDerWaalsContact CE-CB 3.41Å; K104-D265 HydrophobicContact CG-CB 4.11Å; K104-D265 WeakPolarHBondContact CG-OD2 3.33Å; K104-D265 PolarHBondContact N-OD2 3.44Å |
| 105 | L | 92.4 | Very high | 91.4 | Very high | 62 Ų | 62 | 35.4 Ų | 35.4 | 33% | 0.325 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -65.3 | -52.4 | -169.7 | -174.7 | 165.9 | 0 | 0 | 0 | 111.6 | F93 A97 E101 F108 A109 | F93-L105 HydrophobicContact CD1-CD2 3.27Å; F93-L105 HydrophobicContact CE1-CD2 3.4Å; F93-L105 VanDerWaalsContact CE1-CD2 3.4Å; F93-L105 HydrophobicContact CG-CD2 4.33Å; A97-L105 HydrophobicContact CB-CD1 4.42Å; E101-L105 PolarHBondContact O-N 3.12Å; L105-F108 PolarHBondContact O-N 3.32Å; L105-A109 WeakPolarHBondContact O-CB 3.44Å; L105-A109 PolarHBondContact O-N 3.44Å |
| 106 | P | 93.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.9 | -41.6 | 178.9 | -23 | 36.5 | 0 | 0 | 0 | 112.8 | F93 R102 F108 A109 I110 V327 L330 | F93-P106 HydrophobicContact CB-CG 4.07Å; F93-P106 HydrophobicContact CD1-CG 4.27Å; F93-P106 HydrophobicContact CD2-CB 3.67Å; F93-P106 HydrophobicContact CD2-CG 3.87Å; F93-P106 HydrophobicContact CE2-CB 3.77Å; F93-P106 HydrophobicContact CE2-CG 4.39Å; F93-P106 HydrophobicContact CG-CB 4.11Å; F93-P106 HydrophobicContact CG-CG 3.81Å; F93-P106 HydrophobicContact CZ-CB 4.26Å; R102-P106 WeakPolarHBondContact O-CD 3.28Å; R102-P106 VanDerWaalsContact O-CG 3.3Å; R102-P106 WeakPolarHBondContact O-CG 3.45Å; P106-F108 VanDerWaalsContact C-N 3.31Å; P106-F108 PolarHBondContact O-N 2.88Å; P106-A109 PolarHBondContact O-N 3.39Å; P106-I110 HydrophobicContact CB-CD1 4.43Å; P106-I110 VanDerWaalsContact O-CB 3.3Å; P106-I110 WeakPolarHBondContact O-CB 3.17Å; P106-I110 WeakPolarHBondContact O-CD1 3.38Å; P106-I110 WeakPolarHBondContact O-CG1 3.49Å; P106-I110 PolarHBondContact O-N 3.48Å; P106-V327 HydrophobicContact CB-CG1 3.69Å; P106-V327 HydrophobicContact CG-CG1 3.9Å; P106-L330 HydrophobicContact CG-CD1 3.92Å |
| 107 | S | 93.3 | Very high | 91.4 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.5 | -41.2 | -179.6 | -56.3 | 0 | 0 | 0 | 0 | 111.5 | S103 S111 Q257 G322 | S103-S107 WeakPolarHBondContact O-CB 3.35Å; S103-S107 PolarHBondContact O-N 3.44Å; S103-S107 PolarHBondContact O-OG 2.94Å; S107-S111 WeakPolarHBondContact O-CB 3.34Å; S107-S111 PolarHBondContact O-N 3.39Å; S107-Q257 WeakPolarHBondContact CB-O 3.26Å; S107-G322 PolarHBondContact OG-O 2.94Å |
| 108 | F | 94 | Very high | 91.4 | Very high | 140 Ų | 140 | 35.5 Ų | 35.5 | 61% | 0.614 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -65.6 | -47.5 | 176.2 | -175.2 | -100.4 | 0 | 0 | 0 | 111.5 | K104 L105 P106 I110 S111 | K104-F108 VanDerWaalsContact O-CB 3.24Å; K104-F108 WeakPolarHBondContact O-CB 3.48Å; K104-F108 PolarHBondContact O-N 3.46Å; L105-F108 PolarHBondContact O-N 3.32Å; P106-F108 VanDerWaalsContact C-N 3.31Å; P106-F108 PolarHBondContact O-N 2.88Å; F108-I110 PolarHBondContact O-N 3.26Å; F108-S111 PolarHBondContact O-N 3.16Å; F108-S111 PolarHBondContact O-OG 3.03Å |
| 109 | A | 94.2 | Very high | 91.6 | Very high | 51 Ų | 51 | 39 Ų | 39 | 42% | 0.421 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60.5 | -44.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | F93 L105 P106 S111 G112 | F93-A109 HydrophobicContact CE1-CB 3.96Å; F93-A109 HydrophobicContact CZ-CB 3.64Å; L105-A109 WeakPolarHBondContact O-CB 3.44Å; L105-A109 PolarHBondContact O-N 3.44Å; P106-A109 PolarHBondContact O-N 3.39Å; A109-S111 VanDerWaalsContact C-N 3.32Å; A109-S111 PolarHBondContact O-N 3.47Å; A109-G112 PolarHBondContact O-N 3.25Å |
| 110 | I | 92.2 | Very high | 91.8 | Very high | 5 Ų | 5 | 39.5 Ų | 39.5 | 3% | 0.026 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -67.9 | -31.9 | -179.2 | -67.1 | 168.7 | 0 | 0 | 0 | 111.7 | W86 P106 F108 G112 C113 F326 | W86-I110 HydrophobicContact CH2-CG2 3.94Å; W86-I110 HydrophobicContact CZ3-CD1 4.19Å; W86-I110 HydrophobicContact CZ3-CG1 3.96Å; W86-I110 HydrophobicContact CZ3-CG2 4.03Å; P106-I110 HydrophobicContact CB-CD1 4.43Å; P106-I110 VanDerWaalsContact O-CB 3.3Å; P106-I110 WeakPolarHBondContact O-CB 3.17Å; P106-I110 WeakPolarHBondContact O-CD1 3.38Å; P106-I110 WeakPolarHBondContact O-CG1 3.49Å; P106-I110 PolarHBondContact O-N 3.48Å; F108-I110 PolarHBondContact O-N 3.26Å; I110-G112 PolarHBondContact O-N 3.02Å; I110-C113 VanDerWaalsContact O-CB 3.3Å; I110-C113 WeakPolarHBondContact O-CB 3.49Å; I110-C113 PolarHBondContact O-N 3.27Å; I110-F326 HydrophobicContact CD1-CD1 3.92Å; I110-F326 HydrophobicContact CD1-CE1 4.46Å; I110-F326 HydrophobicContact CD1-CG 4.42Å |
| 111 | S | 93.6 | Very high | 91.8 | Very high | 2 Ų | 2 | 40.5 Ų | 40.5 | 1% | 0.014 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57.6 | -24.8 | 175.5 | 72.7 | 0 | 0 | 0 | 0 | 113 | S107 F108 A109 C113 F114 I115 S258 | S107-S111 WeakPolarHBondContact O-CB 3.34Å; S107-S111 PolarHBondContact O-N 3.39Å; F108-S111 PolarHBondContact O-N 3.16Å; F108-S111 PolarHBondContact O-OG 3.03Å; A109-S111 VanDerWaalsContact C-N 3.32Å; A109-S111 PolarHBondContact O-N 3.47Å; S111-C113 PolarHBondContact O-N 3.08Å; S111-F114 PolarHBondContact O-N 3.37Å; S111-F114 VanDerWaalsContact O-N 3.13Å; S111-I115 PolarHBondContact O-N 2.9Å; S111-I115 VanDerWaalsContact O-N 3.14Å; S111-S258 VanDerWaalsContact CB-OG 3.26Å; S111-S258 WeakPolarHBondContact CB-OG 3.47Å; S111-S258 PolarHBondContact OG-OG 3.43Å |
| 112 | G | 94.3 | Very high | 91.8 | Very high | 38 Ų | 38 | 40.1 Ų | 40.1 | 39% | 0.392 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -57.5 | -29.9 | 172 | 0 | 0 | 0 | 0 | 0 | 114.1 | A109 I110 F114 I115 G116 | A109-G112 PolarHBondContact O-N 3.25Å; I110-G112 PolarHBondContact O-N 3.02Å; G112-F114 PolarHBondContact O-N 3.47Å; G112-I115 PolarHBondContact O-N 3.08Å; G112-G116 PolarHBondContact O-N 2.85Å |
| 113 | C | 92.7 | Very high | 91.8 | Very high | 58 Ų | 58 | 41.3 Ų | 41.3 | 39% | 0.392 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -61.4 | -44.6 | 174.9 | -64.8 | 0 | 0 | 0 | 0 | 111.3 | I110 S111 G116 T117 | I110-C113 VanDerWaalsContact O-CB 3.3Å; I110-C113 WeakPolarHBondContact O-CB 3.49Å; I110-C113 PolarHBondContact O-N 3.27Å; S111-C113 PolarHBondContact O-N 3.08Å; C113-G116 CarbonylContact O-C 3.47Å; C113-G116 WeakPolarHBondContact O-CA 3.47Å; C113-G116 PolarHBondContact O-N 3.04Å; C113-T117 PolarHBondContact O-N 2.86Å; C113-T117 PolarHBondContact O-OG1 3.12Å; C113-T117 VanDerWaalsContact O-OG1 3.06Å |
| 114 | F | 93.2 | Very high | 91.5 | Very high | 13 Ų | 13 | 42.9 Ų | 42.9 | 6% | 0.057 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -74.5 | -35.8 | -179.2 | -60.2 | -63.8 | 0 | 0 | 0 | 112.3 | S111 G112 G116 T117 V118 Y216 L220 Y250 Q253 A254 | S111-F114 PolarHBondContact O-N 3.37Å; S111-F114 VanDerWaalsContact O-N 3.13Å; G112-F114 PolarHBondContact O-N 3.47Å; F114-G116 VanDerWaalsContact C-N 3.27Å; F114-G116 PolarHBondContact O-N 3.3Å; F114-T117 WeakPolarHBondContact O-CB 3.3Å; F114-T117 PolarHBondContact O-N 3.07Å; F114-V118 WeakPolarHBondContact O-CG2 3.17Å; F114-V118 PolarHBondContact O-N 3.3Å; F114-Y216 WeakPolarHBondContact CZ-OH 3.46Å; F114-L220 HydrophobicContact CE1-CD1 4.1Å; F114-Y250 HydrophobicContact CD1-CD1 4.14Å; F114-Q253 HydrophobicContact CD1-CG 4.35Å; F114-Q253 HydrophobicContact CD2-CG 4.16Å; F114-Q253 VanDerWaalsContact CE1-CD 3.49Å; F114-Q253 HydrophobicContact CE1-CG 4.46Å; F114-Q253 HydrophobicContact CE2-CG 4.28Å; F114-Q253 HydrophobicContact CG-CG 4.22Å; F114-Q253 HydrophobicContact CZ-CG 4.45Å; F114-A254 HydrophobicContact CB-CB 3.78Å |
| 115 | I | 94.9 | Very high | 90.9 | Very high | 84 Ų | 84 | 42.2 Ų | 42.2 | 43% | 0.431 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -59.4 | -44.1 | 168.6 | -61 | 173.5 | 0 | 0 | 0 | 109.6 | S111 G112 T117 V118 V119 A254 | S111-I115 PolarHBondContact O-N 2.9Å; S111-I115 VanDerWaalsContact O-N 3.14Å; G112-I115 PolarHBondContact O-N 3.08Å; I115-T117 VanDerWaalsContact C-N 3.35Å; I115-T117 PolarHBondContact O-N 3.48Å; I115-V118 PolarHBondContact O-N 3.31Å; I115-V119 HydrophobicContact CG2-CG2 4.48Å; I115-V119 WeakPolarHBondContact O-CG2 3.3Å; I115-V119 PolarHBondContact O-N 3.02Å; I115-A254 HydrophobicContact CG1-CB 3.78Å |
| 116 | G | 93.9 | Very high | 90.5 | Very high | 34 Ų | 34 | 45.9 Ų | 45.9 | 35% | 0.351 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -57.8 | -44.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | G112 C113 F114 V118 V119 A120 | G112-G116 PolarHBondContact O-N 2.85Å; C113-G116 CarbonylContact O-C 3.47Å; C113-G116 WeakPolarHBondContact O-CA 3.47Å; C113-G116 PolarHBondContact O-N 3.04Å; F114-G116 VanDerWaalsContact C-N 3.27Å; F114-G116 PolarHBondContact O-N 3.3Å; G116-V118 PolarHBondContact O-N 2.95Å; G116-V119 PolarHBondContact O-N 2.68Å; G116-A120 WeakPolarHBondContact O-CB 3.15Å; G116-A120 PolarHBondContact O-N 3.09Å |
| 117 | T | 89.4 | Confident | 90.3 | Very high | 35 Ų | 35 | 47.5 Ų | 47.5 | 22% | 0.215 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -59.8 | -44.1 | 174.8 | -57.3 | 0 | 0 | 0 | 0 | 112.2 | C113 F114 I115 A120 F121 L224 Y250 | C113-T117 PolarHBondContact O-N 2.86Å; C113-T117 PolarHBondContact O-OG1 3.12Å; C113-T117 VanDerWaalsContact O-OG1 3.06Å; F114-T117 WeakPolarHBondContact O-CB 3.3Å; F114-T117 PolarHBondContact O-N 3.07Å; I115-T117 VanDerWaalsContact C-N 3.35Å; I115-T117 PolarHBondContact O-N 3.48Å; T117-A120 PolarHBondContact O-N 2.71Å; T117-F121 HydrophobicContact CG2-CD2 3.65Å; T117-F121 HydrophobicContact CG2-CE2 3.37Å; T117-F121 HydrophobicContact CG2-CZ 4.29Å; T117-F121 VanDerWaalsContact O-CD2 3.3Å; T117-F121 WeakPolarHBondContact O-CD2 3.27Å; T117-F121 PolarHBondContact O-N 2.91Å; T117-L224 HydrophobicContact CG2-CD1 4.03Å; T117-Y250 HydrophobicContact CG2-CD2 4.22Å; T117-Y250 HydrophobicContact CG2-CG 4.1Å |
| 118 | V | 92.6 | Very high | 89.8 | Confident | 14 Ų | 14 | 49.7 Ų | 49.7 | 9% | 0.085 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.6 | -49.3 | 177.1 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | F114 I115 G116 A120 F121 I122 L251 | F114-V118 WeakPolarHBondContact O-CG2 3.17Å; F114-V118 PolarHBondContact O-N 3.3Å; I115-V118 PolarHBondContact O-N 3.31Å; G116-V118 PolarHBondContact O-N 2.95Å; V118-A120 VanDerWaalsContact C-N 3.3Å; V118-A120 PolarHBondContact O-N 2.62Å; V118-F121 PolarHBondContact O-N 3.4Å; V118-I122 HydrophobicContact CG1-CD1 3.94Å; V118-I122 WeakPolarHBondContact O-CG1 3.29Å; V118-I122 PolarHBondContact O-N 3.46Å; V118-I122 VanDerWaalsContact O-N 3.08Å; V118-L251 HydrophobicContact CG2-CB 3.85Å |
| 119 | V | 92.5 | Very high | 89.2 | Confident | 74 Ų | 74 | 50 Ų | 50 | 45% | 0.448 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.6 | -42.4 | 177.1 | 173.1 | 0 | 0 | 0 | 0 | 110.3 | I115 G116 I122 A123 F143 | I115-V119 HydrophobicContact CG2-CG2 4.48Å; I115-V119 WeakPolarHBondContact O-CG2 3.3Å; I115-V119 PolarHBondContact O-N 3.02Å; G116-V119 PolarHBondContact O-N 2.68Å; V119-I122 PolarHBondContact O-N 3.04Å; V119-A123 HydrophobicContact CG1-CB 4.45Å; V119-A123 WeakPolarHBondContact O-CA 3.35Å; V119-A123 WeakPolarHBondContact O-CB 3.34Å; V119-A123 PolarHBondContact O-N 3.19Å; V119-F143 HydrophobicContact CG1-CE1 4.49Å; V119-F143 HydrophobicContact CG1-CZ 4.49Å |
| 120 | A | 89.3 | Confident | 88.7 | Confident | 33 Ų | 33 | 49 Ų | 49 | 27% | 0.273 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63 | -46.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | G116 T117 V118 I122 S124 F143 | G116-A120 WeakPolarHBondContact O-CB 3.15Å; G116-A120 PolarHBondContact O-N 3.09Å; T117-A120 PolarHBondContact O-N 2.71Å; V118-A120 VanDerWaalsContact C-N 3.3Å; V118-A120 PolarHBondContact O-N 2.62Å; A120-I122 VanDerWaalsContact C-N 3.34Å; A120-I122 PolarHBondContact O-N 3.31Å; A120-S124 WeakPolarHBondContact O-CB 3.17Å; A120-S124 PolarHBondContact O-N 3.45Å; A120-S124 PolarHBondContact O-OG 3.2Å; A120-F143 HydrophobicContact CB-CZ 4.19Å |
| 121 | F | 83.8 | Confident | 88.3 | Confident | 64 Ų | 64 | 56.7 Ų | 56.7 | 28% | 0.281 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 178.1 | -82 | -49.3 | 0 | 0 | 0 | 112.4 | T117 V118 L224 Y250 | T117-F121 HydrophobicContact CG2-CD2 3.65Å; T117-F121 HydrophobicContact CG2-CE2 3.37Å; T117-F121 HydrophobicContact CG2-CZ 4.29Å; T117-F121 VanDerWaalsContact O-CD2 3.3Å; T117-F121 WeakPolarHBondContact O-CD2 3.27Å; T117-F121 PolarHBondContact O-N 2.91Å; V118-F121 PolarHBondContact O-N 3.4Å; F121-L224 HydrophobicContact CE2-CD1 3.96Å; F121-L224 HydrophobicContact CZ-CD1 3.8Å; F121-Y250 HydrophobicContact CD2-CD2 4.45Å; F121-Y250 AromaticContact CE2-CD2 3.9Å; F121-Y250 HydrophobicContact CE2-CD2 3.9Å; F121-Y250 AromaticContact CE2-CE2 3.92Å; F121-Y250 HydrophobicContact CE2-CE2 3.92Å |
| 122 | I | 87.7 | Confident | 87.7 | Confident | 72 Ų | 72 | 61.2 Ų | 61.2 | 37% | 0.369 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -74 | -56.2 | -179 | -63.2 | 171.4 | 0 | 0 | 0 | 110.4 | V118 V119 A120 S124 G125 F126 | V118-I122 HydrophobicContact CG1-CD1 3.94Å; V118-I122 WeakPolarHBondContact O-CG1 3.29Å; V118-I122 PolarHBondContact O-N 3.46Å; V118-I122 VanDerWaalsContact O-N 3.08Å; V119-I122 PolarHBondContact O-N 3.04Å; A120-I122 VanDerWaalsContact C-N 3.34Å; A120-I122 PolarHBondContact O-N 3.31Å; I122-S124 PolarHBondContact O-N 3.3Å; I122-G125 PolarHBondContact O-N 3.44Å; I122-F126 HydrophobicContact CG2-CD2 4.03Å; I122-F126 HydrophobicContact CG2-CE2 3.84Å; I122-F126 VanDerWaalsContact O-CD2 3.22Å; I122-F126 WeakPolarHBondContact O-CD2 3.11Å; I122-F126 PolarHBondContact O-N 3.3Å |
| 123 | A | 87.6 | Confident | 87.3 | Confident | 28 Ų | 28 | 64.3 Ų | 64.3 | 23% | 0.231 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -66.3 | -38.6 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | V119 G125 F126 L127 F143 | V119-A123 HydrophobicContact CG1-CB 4.45Å; V119-A123 WeakPolarHBondContact O-CA 3.35Å; V119-A123 WeakPolarHBondContact O-CB 3.34Å; V119-A123 PolarHBondContact O-N 3.19Å; A123-G125 VanDerWaalsContact C-N 3.29Å; A123-G125 PolarHBondContact O-N 3.2Å; A123-F126 PolarHBondContact O-N 3.05Å; A123-L127 HydrophobicContact CB-CD1 4.47Å; A123-L127 VanDerWaalsContact O-CB 3.23Å; A123-L127 WeakPolarHBondContact O-CB 3.38Å; A123-L127 VanDerWaalsContact O-CG 3.25Å; A123-L127 WeakPolarHBondContact O-CG 3.26Å; A123-L127 PolarHBondContact O-N 3.05Å; A123-F143 HydrophobicContact CB-CZ 4.3Å |
| 124 | S | 85.9 | Confident | 86.9 | Confident | 33 Ų | 33 | 64.5 Ų | 64.5 | 23% | 0.231 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -64.6 | -36.1 | 179.9 | -53.6 | 0 | 0 | 0 | 0 | 111.8 | A120 I122 A128 V139 | A120-S124 WeakPolarHBondContact O-CB 3.17Å; A120-S124 PolarHBondContact O-N 3.45Å; A120-S124 PolarHBondContact O-OG 3.2Å; I122-S124 PolarHBondContact O-N 3.3Å; S124-A128 WeakPolarHBondContact O-CB 3.26Å; S124-A128 PolarHBondContact O-N 3.29Å; S124-V139 WeakPolarHBondContact OG-CG1 3.2Å |
| 125 | G | 78.1 | Confident | 86.6 | Confident | 46 Ų | 46 | 64.3 Ų | 64.3 | 47% | 0.474 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.6 | -47.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | I122 A123 D129 | I122-G125 PolarHBondContact O-N 3.44Å; A123-G125 VanDerWaalsContact C-N 3.29Å; A123-G125 PolarHBondContact O-N 3.2Å; G125-D129 PolarHBondContact O-N 2.85Å |
| 126 | F | 85.1 | Confident | 86.3 | Confident | 139 Ų | 139 | 63.7 Ų | 63.7 | 61% | 0.61 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -69.7 | -40.9 | 177.7 | -73.4 | -70.8 | 0 | 0 | 0 | 113.3 | I122 A123 S130 | I122-F126 HydrophobicContact CG2-CD2 4.03Å; I122-F126 HydrophobicContact CG2-CE2 3.84Å; I122-F126 VanDerWaalsContact O-CD2 3.22Å; I122-F126 WeakPolarHBondContact O-CD2 3.11Å; I122-F126 PolarHBondContact O-N 3.3Å; A123-F126 PolarHBondContact O-N 3.05Å; F126-S130 WeakPolarHBondContact O-CB 3.48Å; F126-S130 PolarHBondContact O-N 2.95Å; F126-S130 VanDerWaalsContact O-N 3.12Å |
| 127 | L | 87.4 | Confident | 86.4 | Confident | 34 Ų | 34 | 62.8 Ų | 62.8 | 18% | 0.178 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -66.9 | -42.5 | -179.9 | -77.1 | 174.6 | 0 | 0 | 0 | 111.5 | A123 D129 S130 S138 V139 C142 | A123-L127 HydrophobicContact CB-CD1 4.47Å; A123-L127 VanDerWaalsContact O-CB 3.23Å; A123-L127 WeakPolarHBondContact O-CB 3.38Å; A123-L127 VanDerWaalsContact O-CG 3.25Å; A123-L127 WeakPolarHBondContact O-CG 3.26Å; A123-L127 PolarHBondContact O-N 3.05Å; L127-D129 PolarHBondContact O-N 3.12Å; L127-S130 PolarHBondContact O-N 2.98Å; L127-S130 PolarHBondContact O-OG 3.47Å; L127-S138 WeakPolarHBondContact CB-OG 3.25Å; L127-S138 PolarHBondContact O-OG 3.26Å; L127-V139 HydrophobicContact CB-CG2 3.83Å; L127-C142 HydrophobicContact CD1-CB 4.18Å |
| 128 | A | 83.7 | Confident | 86.6 | Confident | 46 Ų | 46 | 61.1 Ų | 61.1 | 38% | 0.38 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -67.5 | -33.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | S124 W136 V139 | S124-A128 WeakPolarHBondContact O-CB 3.26Å; S124-A128 PolarHBondContact O-N 3.29Å; A128-W136 HydrophobicContact CB-CB 4.34Å; A128-V139 HydrophobicContact CB-CG2 4.21Å |
| 129 | D | 80.9 | Confident | 86.6 | Confident | 146 Ų | 146 | 61.4 Ų | 61.4 | 78% | 0.781 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -79.8 | -19.7 | 176.2 | -168.5 | 52.9 | 0 | 0 | 0 | 112.9 | G125 L127 | G125-D129 PolarHBondContact O-N 2.85Å; L127-D129 PolarHBondContact O-N 3.12Å |
| 130 | S | 83.9 | Confident | 86.7 | Confident | 30 Ų | 30 | 60 Ų | 60 | 21% | 0.21 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -72.4 | 161.8 | 178.9 | 81 | 0 | 0 | 0 | 0 | 112.5 | F126 L127 I132 G135 | F126-S130 WeakPolarHBondContact O-CB 3.48Å; F126-S130 PolarHBondContact O-N 2.95Å; F126-S130 VanDerWaalsContact O-N 3.12Å; L127-S130 PolarHBondContact O-N 2.98Å; L127-S130 PolarHBondContact O-OG 3.47Å; S130-I132 VanDerWaalsContact C-N 3.27Å; S130-I132 WeakPolarHBondContact OG-CB 3.33Å; S130-I132 PolarHBondContact OG-N 3.01Å; S130-G135 WeakPolarHBondContact O-CA 3.23Å |
| 131 | N | 82.9 | Confident | 87.1 | Confident | 167 Ų | 167 | 61.6 Ų | 61.6 | 89% | 0.893 | 35% | 0.349 | S | S | * | . | trans | -87.5 | 8 | 169.8 | -67.6 | -53.9 | 0 | 0 | 0 | 112.9 | ||||
| 132 | I | 82 | Confident | 87.6 | Confident | 97 Ų | 97 | 60.6 Ų | 60.6 | 50% | 0.497 | 35% | 0.349 | S | S | . | . | G | 310 helix | trans | -73.4 | 136 | -176.3 | -61.9 | 173.2 | 0 | 0 | 0 | 109.2 | S130 G134 G135 S138 | S130-I132 VanDerWaalsContact C-N 3.27Å; S130-I132 WeakPolarHBondContact OG-CB 3.33Å; S130-I132 PolarHBondContact OG-N 3.01Å; I132-G134 PolarHBondContact O-N 2.99Å; I132-G135 PolarHBondContact O-N 2.85Å; I132-S138 WeakPolarHBondContact O-CB 3.33Å |
| 133 | M | 84.9 | Confident | 88 | Confident | 103 Ų | 103 | 60.6 Ų | 60.6 | 51% | 0.507 | 35% | 0.347 | S | S | . | . | G | 310 helix | trans | 46.2 | 33.9 | 177.9 | -59.1 | 177.5 | -178.9 | 0 | 0 | 114.9 | Y141 | M133-Y141 HydrophobicContact CB-CD2 4.09Å; M133-Y141 HydrophobicContact SD-CD2 4.2Å |
| 134 | G | 84.9 | Confident | 88.5 | Confident | 63 Ų | 63 | 59.3 Ų | 59.3 | 65% | 0.649 | 34% | 0.336 | S | S | * | . | G | 310 helix | trans | 86.4 | 13.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | I132 P137 | I132-G134 PolarHBondContact O-N 2.99Å; G134-P137 WeakPolarHBondContact O-CD 3.47Å |
| 135 | G | 87.8 | Confident | 89 | Confident | 8 Ų | 8 | 61.7 Ų | 61.7 | 8% | 0.082 | 35% | 0.346 | C | S | . | . | S | Bend | trans | 85.2 | -118.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | S130 I132 P137 S138 | S130-G135 WeakPolarHBondContact O-CA 3.23Å; I132-G135 PolarHBondContact O-N 2.85Å; G135-P137 VanDerWaalsContact C-N 3.29Å; G135-P137 WeakPolarHBondContact O-CD 3.42Å; G135-P137 VanDerWaalsContact O-N 3.12Å; G135-S138 WeakPolarHBondContact O-CB 3.45Å; G135-S138 PolarHBondContact O-N 3.19Å; G135-S138 PolarHBondContact O-OG 3.41Å |
| 136 | W | 89.1 | Confident | 89.9 | Confident | 71 Ų | 71 | 62.2 Ų | 62.2 | 27% | 0.269 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.1 | -32.4 | -178.9 | 78.3 | -93 | 0 | 0 | 0 | 116 | F8 P61 A64 A128 S138 V139 F140 | F8-W136 AromaticContact CE2-CH2 4Å; F8-W136 HydrophobicContact CE2-CH2 4Å; F8-W136 AromaticContact CE2-CZ2 3.41Å; F8-W136 HydrophobicContact CE2-CZ2 3.41Å; F8-W136 VanDerWaalsContact CE2-CZ2 3.41Å; F8-W136 AromaticContact CZ-CZ2 3.97Å; F8-W136 HydrophobicContact CZ-CZ2 3.97Å; P61-W136 HydrophobicContact CB-CH2 4Å; P61-W136 HydrophobicContact CB-CZ2 4.49Å; P61-W136 HydrophobicContact CB-CZ3 4.46Å; P61-W136 HydrophobicContact CG-CH2 4.36Å; P61-W136 HydrophobicContact CG-CZ3 4.34Å; A64-W136 HydrophobicContact CB-CH2 3.69Å; A64-W136 HydrophobicContact CB-CZ2 4.21Å; A128-W136 HydrophobicContact CB-CB 4.34Å; W136-S138 PolarHBondContact O-N 3.41Å; W136-V139 PolarHBondContact O-N 2.92Å; W136-F140 AromaticContact CE3-CD2 3.96Å; W136-F140 HydrophobicContact CE3-CD2 3.96Å; W136-F140 AromaticContact CE3-CE2 3.66Å; W136-F140 HydrophobicContact CE3-CE2 3.66Å; W136-F140 AromaticContact CZ3-CD2 3.79Å; W136-F140 HydrophobicContact CZ3-CD2 3.79Å; W136-F140 AromaticContact CZ3-CE2 3.52Å; W136-F140 HydrophobicContact CZ3-CE2 3.52Å; W136-F140 HydrophobicContact CZ3-CZ 4.47Å |
| 137 | P | 94.3 | Very high | 90.5 | Very high | 15 Ų | 15 | 57.8 Ų | 57.8 | 10% | 0.097 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.7 | -27.2 | 175.8 | -25.3 | 38.6 | 0 | 0 | 0 | 113.2 | P61 G134 G135 V139 F140 Y141 | P61-P137 HydrophobicContact CB-CB 3.81Å; P61-P137 HydrophobicContact CB-CG 4.31Å; P61-P137 HydrophobicContact CG-CB 3.79Å; G134-P137 WeakPolarHBondContact O-CD 3.47Å; G135-P137 VanDerWaalsContact C-N 3.29Å; G135-P137 WeakPolarHBondContact O-CD 3.42Å; G135-P137 VanDerWaalsContact O-N 3.12Å; P137-V139 PolarHBondContact O-N 3.13Å; P137-F140 PolarHBondContact O-N 3.4Å; P137-Y141 HydrophobicContact CB-CD2 4.08Å; P137-Y141 HydrophobicContact CB-CE2 3.57Å; P137-Y141 WeakPolarHBondContact O-CD2 3.4Å; P137-Y141 PolarHBondContact O-N 2.81Å |
| 138 | S | 94 | Very high | 91.1 | Very high | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -57.6 | -32.4 | -179.9 | 69.4 | 0 | 0 | 0 | 0 | 112.7 | L127 I132 G135 W136 F140 Y141 C142 | L127-S138 WeakPolarHBondContact CB-OG 3.25Å; L127-S138 PolarHBondContact O-OG 3.26Å; I132-S138 WeakPolarHBondContact O-CB 3.33Å; G135-S138 WeakPolarHBondContact O-CB 3.45Å; G135-S138 PolarHBondContact O-N 3.19Å; G135-S138 PolarHBondContact O-OG 3.41Å; W136-S138 PolarHBondContact O-N 3.41Å; S138-F140 PolarHBondContact O-N 3.02Å; S138-Y141 PolarHBondContact O-N 3.4Å; S138-C142 VanDerWaalsContact O-CB 3.26Å; S138-C142 WeakPolarHBondContact O-CB 3.36Å; S138-C142 PolarHBondContact O-N 3.27Å; S138-C142 PolarHBondContact O-SG 3.15Å |
| 139 | V | 92.9 | Very high | 91.8 | Very high | 20 Ų | 20 | 60.5 Ų | 60.5 | 12% | 0.121 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -56.7 | -52.4 | 175.4 | -178.1 | 0 | 0 | 0 | 0 | 109.7 | S124 L127 A128 W136 P137 F143 | S124-V139 WeakPolarHBondContact OG-CG1 3.2Å; L127-V139 HydrophobicContact CB-CG2 3.83Å; A128-V139 HydrophobicContact CB-CG2 4.21Å; W136-V139 PolarHBondContact O-N 2.92Å; P137-V139 PolarHBondContact O-N 3.13Å; V139-F143 HydrophobicContact CG1-CD2 3.93Å; V139-F143 HydrophobicContact CG1-CE2 4.1Å; V139-F143 WeakPolarHBondContact O-CD2 3.5Å; V139-F143 PolarHBondContact O-N 2.98Å; V139-F143 VanDerWaalsContact O-N 3.15Å |
| 140 | F | 95.4 | Very high | 92.6 | Very high | 46 Ų | 46 | 58.1 Ų | 58.1 | 20% | 0.202 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66.2 | -41.2 | -179.4 | -64.6 | -85.1 | 0 | 0 | 0 | 112.1 | T60 P61 W136 P137 S138 G144 | T60-F140 HydrophobicContact CG2-CD1 3.85Å; T60-F140 HydrophobicContact CG2-CE1 3.56Å; T60-F140 HydrophobicContact CG2-CE2 4.4Å; T60-F140 HydrophobicContact CG2-CG 4.39Å; T60-F140 HydrophobicContact CG2-CZ 3.86Å; P61-F140 HydrophobicContact CG-CB 3.9Å; P61-F140 HydrophobicContact CG-CD2 4.2Å; P61-F140 HydrophobicContact CG-CG 4.22Å; W136-F140 AromaticContact CE3-CD2 3.96Å; W136-F140 HydrophobicContact CE3-CD2 3.96Å; W136-F140 AromaticContact CE3-CE2 3.66Å; W136-F140 HydrophobicContact CE3-CE2 3.66Å; W136-F140 AromaticContact CZ3-CD2 3.79Å; W136-F140 HydrophobicContact CZ3-CD2 3.79Å; W136-F140 AromaticContact CZ3-CE2 3.52Å; W136-F140 HydrophobicContact CZ3-CE2 3.52Å; W136-F140 HydrophobicContact CZ3-CZ 4.47Å; P137-F140 PolarHBondContact O-N 3.4Å; S138-F140 PolarHBondContact O-N 3.02Å; F140-G144 WeakPolarHBondContact O-CA 3.13Å; F140-G144 PolarHBondContact O-N 2.73Å |
| 141 | Y | 96.2 | Very high | 93.2 | Very high | 65 Ų | 65 | 57.9 Ų | 57.9 | 26% | 0.255 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -65.5 | -48.9 | 178.9 | -61.4 | -35.7 | 0 | 0 | 0 | 112.8 | L58 P61 M133 P137 S138 G144 I145 | L58-Y141 HydrophobicContact CD2-CD1 3.96Å; L58-Y141 WeakPolarHBondContact O-CE1 3.49Å; P61-Y141 HydrophobicContact CB-CE1 4.35Å; P61-Y141 HydrophobicContact CG-CD1 4.49Å; P61-Y141 HydrophobicContact CG-CE1 3.85Å; P61-Y141 HydrophobicContact CG-CE2 4.49Å; M133-Y141 HydrophobicContact CB-CD2 4.09Å; M133-Y141 HydrophobicContact SD-CD2 4.2Å; P137-Y141 HydrophobicContact CB-CD2 4.08Å; P137-Y141 HydrophobicContact CB-CE2 3.57Å; P137-Y141 WeakPolarHBondContact O-CD2 3.4Å; P137-Y141 PolarHBondContact O-N 2.81Å; S138-Y141 PolarHBondContact O-N 3.4Å; Y141-G144 PolarHBondContact O-N 3.42Å; Y141-I145 WeakPolarHBondContact O-CB 3.28Å; Y141-I145 WeakPolarHBondContact O-CD1 3.25Å; Y141-I145 WeakPolarHBondContact O-CG1 3.46Å; Y141-I145 PolarHBondContact O-N 2.93Å |
| 142 | C | 95.4 | Very high | 94 | Very high | 44 Ų | 44 | 54 Ų | 54 | 30% | 0.297 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -62.4 | -50.1 | -179.8 | -70.5 | 0 | 0 | 0 | 0 | 111.8 | L127 S138 A146 | L127-C142 HydrophobicContact CD1-CB 4.18Å; S138-C142 VanDerWaalsContact O-CB 3.26Å; S138-C142 WeakPolarHBondContact O-CB 3.36Å; S138-C142 PolarHBondContact O-N 3.27Å; S138-C142 PolarHBondContact O-SG 3.15Å; C142-A146 VanDerWaalsContact O-CB 3.25Å; C142-A146 WeakPolarHBondContact O-CB 3.49Å; C142-A146 PolarHBondContact O-N 3.27Å |
| 143 | F | 95.8 | Very high | 94.7 | Very high | 71 Ų | 71 | 53.8 Ų | 53.8 | 31% | 0.311 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -67.7 | -38.7 | 179.4 | -77.3 | -70.1 | 0 | 0 | 0 | 112.3 | V119 A120 A123 V139 T147 | V119-F143 HydrophobicContact CG1-CE1 4.49Å; V119-F143 HydrophobicContact CG1-CZ 4.49Å; A120-F143 HydrophobicContact CB-CZ 4.19Å; A123-F143 HydrophobicContact CB-CZ 4.3Å; V139-F143 HydrophobicContact CG1-CD2 3.93Å; V139-F143 HydrophobicContact CG1-CE2 4.1Å; V139-F143 WeakPolarHBondContact O-CD2 3.5Å; V139-F143 PolarHBondContact O-N 2.98Å; V139-F143 VanDerWaalsContact O-N 3.15Å; F143-T147 WeakPolarHBondContact O-CB 3.38Å; F143-T147 PolarHBondContact O-N 3.29Å; F143-T147 PolarHBondContact O-OG1 3.05Å |
| 144 | G | 97.2 | Very high | 95.3 | Very high | 1 Ų | 1 | 50.7 Ų | 50.7 | 1% | 0.01 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63.1 | -48.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | F140 Y141 T147 I148 | F140-G144 WeakPolarHBondContact O-CA 3.13Å; F140-G144 PolarHBondContact O-N 2.73Å; Y141-G144 PolarHBondContact O-N 3.42Å; G144-T147 PolarHBondContact O-N 3.36Å; G144-I148 WeakPolarHBondContact O-CG1 3.43Å; G144-I148 PolarHBondContact O-N 3.03Å |
| 145 | I | 97.6 | Very high | 95.8 | Very high | 84 Ų | 84 | 49.5 Ų | 49.5 | 43% | 0.431 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63.3 | -46.3 | 177.5 | -67.9 | 166.1 | 0 | 0 | 0 | 110.7 | L58 Y141 T147 I148 L149 | L58-I145 HydrophobicContact CD2-CG1 4.21Å; Y141-I145 WeakPolarHBondContact O-CB 3.28Å; Y141-I145 WeakPolarHBondContact O-CD1 3.25Å; Y141-I145 WeakPolarHBondContact O-CG1 3.46Å; Y141-I145 PolarHBondContact O-N 2.93Å; I145-T147 VanDerWaalsContact C-N 3.27Å; I145-T147 PolarHBondContact O-N 3.33Å; I145-I148 PolarHBondContact O-N 2.94Å; I145-L149 HydrophobicContact CG2-CD1 4.2Å; I145-L149 HydrophobicContact CG2-CG 4.45Å; I145-L149 WeakPolarHBondContact O-CG 3.45Å; I145-L149 PolarHBondContact O-N 3.22Å |
| 146 | A | 97.2 | Very high | 96.1 | Very high | 56 Ų | 56 | 53.6 Ų | 53.6 | 46% | 0.463 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -58.9 | -39.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | C142 L149 W150 | C142-A146 VanDerWaalsContact O-CB 3.25Å; C142-A146 WeakPolarHBondContact O-CB 3.49Å; C142-A146 PolarHBondContact O-N 3.27Å; A146-L149 PolarHBondContact O-N 2.82Å; A146-W150 WeakPolarHBondContact O-CB 3.48Å; A146-W150 PolarHBondContact O-N 3.48Å |
| 147 | T | 98.1 | Very high | 96.3 | Very high | 47 Ų | 47 | 55.5 Ų | 55.5 | 29% | 0.288 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -69.2 | -37.3 | 177.9 | -54.6 | 0 | 0 | 0 | 0 | 112.1 | A54 F143 G144 I145 W150 F151 | A54-T147 HydrophobicContact CB-CG2 3.76Å; F143-T147 WeakPolarHBondContact O-CB 3.38Å; F143-T147 PolarHBondContact O-N 3.29Å; F143-T147 PolarHBondContact O-OG1 3.05Å; G144-T147 PolarHBondContact O-N 3.36Å; I145-T147 VanDerWaalsContact C-N 3.27Å; I145-T147 PolarHBondContact O-N 3.33Å; T147-W150 PolarHBondContact O-N 2.92Å; T147-F151 PolarHBondContact O-N 3.22Å |
| 148 | I | 98.3 | Very high | 96.4 | Very high | 40 Ų | 40 | 56.1 Ų | 56.1 | 21% | 0.205 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.5 | -43.5 | 173.8 | -70.1 | 172.7 | 0 | 0 | 0 | 111.1 | F51 A54 L58 G144 I145 W150 F151 I152 | F51-I148 HydrophobicContact CD2-CG1 4.03Å; F51-I148 HydrophobicContact CD2-CG2 4.46Å; F51-I148 HydrophobicContact CE2-CD1 4.47Å; F51-I148 HydrophobicContact CE2-CG1 4.04Å; F51-I148 HydrophobicContact CE2-CG2 4.09Å; A54-I148 HydrophobicContact CB-CG1 3.91Å; L58-I148 HydrophobicContact CD1-CD1 3.58Å; G144-I148 WeakPolarHBondContact O-CG1 3.43Å; G144-I148 PolarHBondContact O-N 3.03Å; I145-I148 PolarHBondContact O-N 2.94Å; I148-W150 VanDerWaalsContact C-N 3.32Å; I148-W150 PolarHBondContact O-N 2.97Å; I148-F151 WeakPolarHBondContact O-CB 3.23Å; I148-F151 PolarHBondContact O-N 3.44Å; I148-I152 PolarHBondContact O-N 2.99Å; I148-I152 VanDerWaalsContact O-N 3.12Å |
| 149 | L | 98.2 | Very high | 96.4 | Very high | 97 Ų | 97 | 57.2 Ų | 57.2 | 51% | 0.508 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.4 | -41.9 | 175.2 | -67.4 | 176.2 | 0 | 0 | 0 | 111.3 | I145 A146 F151 I152 I153 | I145-L149 HydrophobicContact CG2-CD1 4.2Å; I145-L149 HydrophobicContact CG2-CG 4.45Å; I145-L149 WeakPolarHBondContact O-CG 3.45Å; I145-L149 PolarHBondContact O-N 3.22Å; A146-L149 PolarHBondContact O-N 2.82Å; L149-F151 VanDerWaalsContact C-N 3.31Å; L149-F151 PolarHBondContact O-N 2.9Å; L149-I152 HydrophobicContact CD2-CD1 4.47Å; L149-I152 WeakPolarHBondContact O-CB 3.34Å; L149-I152 PolarHBondContact O-N 2.82Å; L149-I153 WeakPolarHBondContact O-CG1 3.36Å; L149-I153 PolarHBondContact O-N 2.91Å; L149-I153 VanDerWaalsContact O-N 3.15Å |
| 150 | W | 97.8 | Very high | 96.3 | Very high | 96 Ų | 96 | 58 Ų | 58 | 36% | 0.364 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -60.8 | -39.4 | 173.8 | 176 | 91 | 0 | 0 | 0 | 112 | F46 T50 A146 T147 I148 I152 I153 W154 | F46-W150 AromaticContact CD1-CH2 3.82Å; F46-W150 HydrophobicContact CD1-CH2 3.82Å; F46-W150 AromaticContact CE1-CH2 3.42Å; F46-W150 HydrophobicContact CE1-CH2 3.42Å; F46-W150 VanDerWaalsContact CE1-CH2 3.42Å; F46-W150 HydrophobicContact CE1-CZ2 4.09Å; F46-W150 HydrophobicContact CE1-CZ3 4.22Å; T50-W150 HydrophobicContact CG2-CZ3 4.39Å; T50-W150 WeakPolarHBondContact OG1-CZ3 3.46Å; A146-W150 WeakPolarHBondContact O-CB 3.48Å; A146-W150 PolarHBondContact O-N 3.48Å; T147-W150 PolarHBondContact O-N 2.92Å; I148-W150 VanDerWaalsContact C-N 3.32Å; I148-W150 PolarHBondContact O-N 2.97Å; W150-I152 VanDerWaalsContact C-N 3.34Å; W150-I152 PolarHBondContact O-N 3.34Å; W150-I153 WeakPolarHBondContact O-CB 3.34Å; W150-I153 PolarHBondContact O-N 3.4Å; W150-W154 HydrophobicContact CE3-CB 4.4Å; W150-W154 HydrophobicContact CH2-CB 3.85Å; W150-W154 AromaticContact CH2-CD2 3.47Å; W150-W154 HydrophobicContact CH2-CD2 3.47Å; W150-W154 VanDerWaalsContact CH2-CD2 3.47Å; W150-W154 AromaticContact CH2-CE3 3.39Å; W150-W154 HydrophobicContact CH2-CE3 3.39Å; W150-W154 AromaticContact CH2-CG 3.69Å; W150-W154 HydrophobicContact CH2-CG 3.69Å; W150-W154 HydrophobicContact CH2-CZ3 4.07Å; W150-W154 HydrophobicContact CZ2-CB 4.19Å; W150-W154 AromaticContact CZ2-CD2 3.85Å; W150-W154 HydrophobicContact CZ2-CD2 3.85Å; W150-W154 AromaticContact CZ2-CE3 3.26Å; W150-W154 HydrophobicContact CZ2-CE3 3.26Å; W150-W154 HydrophobicContact CZ2-CG 4.26Å; W150-W154 AromaticContact CZ2-CZ3 3.86Å; W150-W154 HydrophobicContact CZ2-CZ3 3.86Å; W150-W154 HydrophobicContact CZ3-CB 4Å; W150-W154 HydrophobicContact CZ3-CD2 4.35Å; W150-W154 HydrophobicContact CZ3-CG 4.12Å; W150-W154 WeakPolarHBondContact O-CB 3.4Å; W150-W154 PolarHBondContact O-N 3.39Å |
| 151 | F | 98.2 | Very high | 96 | Very high | 24 Ų | 24 | 60 Ų | 60 | 11% | 0.105 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.4 | -41.6 | 175.2 | 171.5 | -108.2 | 0 | 0 | 0 | 111.8 | G47 L48 F51 T147 I148 L149 I153 W154 T155 | G47-F151 VanDerWaalsContact C-CD2 3.47Å; G47-F151 WeakPolarHBondContact O-CD2 3.48Å; G47-F151 WeakPolarHBondContact O-CE2 3.32Å; L48-F151 HydrophobicContact CD2-CE2 4.37Å; L48-F151 HydrophobicContact CD2-CZ 3.95Å; F51-F151 HydrophobicContact CB-CB 4.24Å; F51-F151 HydrophobicContact CB-CD1 3.97Å; F51-F151 HydrophobicContact CB-CD2 3.92Å; F51-F151 HydrophobicContact CB-CE1 4.28Å; F51-F151 HydrophobicContact CB-CE2 4.24Å; F51-F151 HydrophobicContact CB-CG 3.77Å; F51-F151 HydrophobicContact CB-CZ 4.4Å; F51-F151 HydrophobicContact CD1-CE1 4.49Å; F51-F151 HydrophobicContact CD2-CB 4.32Å; F51-F151 AromaticContact CD2-CD1 3.54Å; F51-F151 HydrophobicContact CD2-CD1 3.54Å; F51-F151 HydrophobicContact CD2-CE1 4.06Å; F51-F151 HydrophobicContact CD2-CG 4.03Å; F51-F151 HydrophobicContact CE2-CD1 4.21Å; F51-F151 AromaticContact CG-CD1 3.83Å; F51-F151 HydrophobicContact CG-CD1 3.83Å; F51-F151 HydrophobicContact CG-CE1 4.02Å; F51-F151 HydrophobicContact CG-CG 4.15Å; T147-F151 PolarHBondContact O-N 3.22Å; I148-F151 WeakPolarHBondContact O-CB 3.23Å; I148-F151 PolarHBondContact O-N 3.44Å; L149-F151 VanDerWaalsContact C-N 3.31Å; L149-F151 PolarHBondContact O-N 2.9Å; F151-I153 VanDerWaalsContact C-N 3.33Å; F151-I153 PolarHBondContact O-N 2.73Å; F151-W154 WeakPolarHBondContact O-CB 3.31Å; F151-W154 PolarHBondContact O-N 3.29Å; F151-T155 HydrophobicContact CD1-CG2 4.35Å; F151-T155 HydrophobicContact CD2-CG2 4.09Å; F151-T155 HydrophobicContact CE1-CG2 3.9Å; F151-T155 HydrophobicContact CE2-CG2 3.6Å; F151-T155 HydrophobicContact CG-CG2 4.45Å; F151-T155 HydrophobicContact CZ-CG2 3.5Å; F151-T155 VanDerWaalsContact CZ-CG2 3.5Å; F151-T155 WeakPolarHBondContact O-CG2 3.04Å; F151-T155 PolarHBondContact O-N 2.79Å |
| 152 | I | 97.9 | Very high | 95.7 | Very high | 85 Ų | 85 | 57 Ų | 57 | 44% | 0.436 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -58.1 | -48.3 | 175.2 | -65 | 167.2 | 0 | 0 | 0 | 110 | I148 L149 W150 W154 T155 I156 | I148-I152 PolarHBondContact O-N 2.99Å; I148-I152 VanDerWaalsContact O-N 3.12Å; L149-I152 HydrophobicContact CD2-CD1 4.47Å; L149-I152 WeakPolarHBondContact O-CB 3.34Å; L149-I152 PolarHBondContact O-N 2.82Å; W150-I152 VanDerWaalsContact C-N 3.34Å; W150-I152 PolarHBondContact O-N 3.34Å; I152-W154 VanDerWaalsContact C-N 3.34Å; I152-W154 PolarHBondContact O-N 2.98Å; I152-T155 PolarHBondContact O-N 3.42Å; I152-T155 PolarHBondContact O-OG1 2.95Å; I152-I156 HydrophobicContact CG2-CD1 4.14Å; I152-I156 WeakPolarHBondContact O-CG1 3.4Å; I152-I156 PolarHBondContact O-N 3.48Å |
| 153 | I | 97.2 | Very high | 95.3 | Very high | 93 Ų | 93 | 59.5 Ų | 59.5 | 48% | 0.477 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -58.6 | -46.4 | 175.8 | -63.5 | 170.2 | 0 | 0 | 0 | 110.6 | L149 W150 F151 T155 I156 F157 | L149-I153 WeakPolarHBondContact O-CG1 3.36Å; L149-I153 PolarHBondContact O-N 2.91Å; L149-I153 VanDerWaalsContact O-N 3.15Å; W150-I153 WeakPolarHBondContact O-CB 3.34Å; W150-I153 PolarHBondContact O-N 3.4Å; F151-I153 VanDerWaalsContact C-N 3.33Å; F151-I153 PolarHBondContact O-N 2.73Å; I153-T155 VanDerWaalsContact C-N 3.33Å; I153-T155 PolarHBondContact O-N 3.33Å; I153-I156 PolarHBondContact O-N 3.1Å; I153-I156 VanDerWaalsContact O-N 3.13Å; I153-F157 HydrophobicContact CG2-CD2 3.63Å; I153-F157 HydrophobicContact CG2-CE2 4.06Å; I153-F157 VanDerWaalsContact O-CD2 3.3Å; I153-F157 WeakPolarHBondContact O-CD2 3.24Å; I153-F157 PolarHBondContact O-N 3.37Å |
| 154 | W | 97 | Very high | 94.8 | Very high | 39 Ų | 39 | 58.2 Ų | 58.2 | 15% | 0.148 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57.7 | -42.8 | 178.2 | 177.8 | -96 | 0 | 0 | 0 | 112.7 | K43 F46 L92 W150 F151 I152 I156 V158 | K43-W154 PolarHBondContact O-NE1 3.19Å; F46-W154 HydrophobicContact CB-CZ2 4.2Å; F46-W154 AromaticContact CD1-CE2 3.96Å; F46-W154 AromaticContact CD1-CH2 3.96Å; F46-W154 HydrophobicContact CD1-CH2 3.96Å; F46-W154 AromaticContact CD1-CZ2 3.66Å; F46-W154 HydrophobicContact CD1-CZ2 3.66Å; F46-W154 HydrophobicContact CE1-CH2 4.33Å; F46-W154 HydrophobicContact CE1-CZ2 4.44Å; F46-W154 HydrophobicContact CG-CZ2 4.14Å; L92-W154 HydrophobicContact CD2-CH2 3.63Å; L92-W154 HydrophobicContact CD2-CZ2 3.85Å; W150-W154 HydrophobicContact CE3-CB 4.4Å; W150-W154 HydrophobicContact CH2-CB 3.85Å; W150-W154 AromaticContact CH2-CD2 3.47Å; W150-W154 HydrophobicContact CH2-CD2 3.47Å; W150-W154 VanDerWaalsContact CH2-CD2 3.47Å; W150-W154 AromaticContact CH2-CE3 3.39Å; W150-W154 HydrophobicContact CH2-CE3 3.39Å; W150-W154 AromaticContact CH2-CG 3.69Å; W150-W154 HydrophobicContact CH2-CG 3.69Å; W150-W154 HydrophobicContact CH2-CZ3 4.07Å; W150-W154 HydrophobicContact CZ2-CB 4.19Å; W150-W154 AromaticContact CZ2-CD2 3.85Å; W150-W154 HydrophobicContact CZ2-CD2 3.85Å; W150-W154 AromaticContact CZ2-CE3 3.26Å; W150-W154 HydrophobicContact CZ2-CE3 3.26Å; W150-W154 HydrophobicContact CZ2-CG 4.26Å; W150-W154 AromaticContact CZ2-CZ3 3.86Å; W150-W154 HydrophobicContact CZ2-CZ3 3.86Å; W150-W154 HydrophobicContact CZ3-CB 4Å; W150-W154 HydrophobicContact CZ3-CD2 4.35Å; W150-W154 HydrophobicContact CZ3-CG 4.12Å; W150-W154 WeakPolarHBondContact O-CB 3.4Å; W150-W154 PolarHBondContact O-N 3.39Å; F151-W154 WeakPolarHBondContact O-CB 3.31Å; F151-W154 PolarHBondContact O-N 3.29Å; I152-W154 VanDerWaalsContact C-N 3.34Å; I152-W154 PolarHBondContact O-N 2.98Å; W154-I156 VanDerWaalsContact C-N 3.25Å; W154-I156 PolarHBondContact O-N 3.2Å; W154-V158 HydrophobicContact CD2-CB 4.05Å; W154-V158 HydrophobicContact CD2-CG1 4.45Å; W154-V158 HydrophobicContact CD2-CG2 3.71Å; W154-V158 HydrophobicContact CE3-CB 4.25Å; W154-V158 HydrophobicContact CE3-CG2 3.43Å; W154-V158 VanDerWaalsContact CE3-CG2 3.43Å; W154-V158 HydrophobicContact CG-CG2 4.4Å; W154-V158 HydrophobicContact CH2-CB 4.48Å; W154-V158 HydrophobicContact CH2-CG1 3.96Å; W154-V158 HydrophobicContact CH2-CG2 4.11Å; W154-V158 HydrophobicContact CZ2-CB 4.29Å; W154-V158 HydrophobicContact CZ2-CG1 3.77Å; W154-V158 HydrophobicContact CZ2-CG2 4.34Å; W154-V158 HydrophobicContact CZ3-CB 4.46Å; W154-V158 HydrophobicContact CZ3-CG1 4.37Å; W154-V158 HydrophobicContact CZ3-CG2 3.66Å; W154-V158 WeakPolarHBondContact O-CB 3.48Å; W154-V158 PolarHBondContact O-N 2.95Å; W154-V158 VanDerWaalsContact O-N 3.09Å |
| 155 | T | 95.5 | Very high | 94.4 | Very high | 37 Ų | 37 | 59.6 Ų | 59.6 | 23% | 0.227 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -64.9 | -30.5 | 179 | 62.2 | 0 | 0 | 0 | 0 | 113.1 | K43 W44 F151 I152 I153 | K43-T155 PolarHBondContact NZ-O 3.06Å; W44-T155 HydrophobicContact CH2-CG2 4.06Å; W44-T155 HydrophobicContact CZ3-CG2 3.57Å; F151-T155 HydrophobicContact CD1-CG2 4.35Å; F151-T155 HydrophobicContact CD2-CG2 4.09Å; F151-T155 HydrophobicContact CE1-CG2 3.9Å; F151-T155 HydrophobicContact CE2-CG2 3.6Å; F151-T155 HydrophobicContact CG-CG2 4.45Å; F151-T155 HydrophobicContact CZ-CG2 3.5Å; F151-T155 VanDerWaalsContact CZ-CG2 3.5Å; F151-T155 WeakPolarHBondContact O-CG2 3.04Å; F151-T155 PolarHBondContact O-N 2.79Å; I152-T155 PolarHBondContact O-N 3.42Å; I152-T155 PolarHBondContact O-OG1 2.95Å; I153-T155 VanDerWaalsContact C-N 3.33Å; I153-T155 PolarHBondContact O-N 3.33Å |
| 156 | I | 94.6 | Very high | 93.9 | Very high | 95 Ų | 95 | 63.6 Ų | 63.6 | 49% | 0.487 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -79.9 | -46 | -180 | -63.9 | 166.7 | 0 | 0 | 0 | 111 | I152 I153 W154 | I152-I156 HydrophobicContact CG2-CD1 4.14Å; I152-I156 WeakPolarHBondContact O-CG1 3.4Å; I152-I156 PolarHBondContact O-N 3.48Å; I153-I156 PolarHBondContact O-N 3.1Å; I153-I156 VanDerWaalsContact O-N 3.13Å; W154-I156 VanDerWaalsContact C-N 3.25Å; W154-I156 PolarHBondContact O-N 3.2Å |
| 157 | F | 94.4 | Very high | 93.5 | Very high | 111 Ų | 111 | 67.1 Ų | 67.1 | 49% | 0.487 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -99 | -13.8 | -166.6 | -69.2 | -72.8 | 0 | 0 | 0 | 115.8 | I153 H165 F167 | I153-F157 HydrophobicContact CG2-CD2 3.63Å; I153-F157 HydrophobicContact CG2-CE2 4.06Å; I153-F157 VanDerWaalsContact O-CD2 3.3Å; I153-F157 WeakPolarHBondContact O-CD2 3.24Å; I153-F157 PolarHBondContact O-N 3.37Å; F157-H165 PolarHBondContact O-NE2 3.46Å; F157-F167 HydrophobicContact CD1-CD2 4.09Å; F157-F167 AromaticContact CD1-CE2 3.93Å; F157-F167 HydrophobicContact CD1-CE2 3.93Å; F157-F167 HydrophobicContact CE1-CE2 4.22Å; F157-F167 HydrophobicContact CE1-CZ 4.45Å |
| 158 | V | 94.9 | Very high | 93.2 | Very high | 28 Ų | 28 | 65.8 Ų | 65.8 | 17% | 0.17 | 33% | 0.327 | C | S | . | . | trans | -105.9 | 144.4 | -178.1 | -178.9 | 0 | 0 | 0 | 0 | 110.9 | K43 L92 W154 | K43-V158 HydrophobicContact CB-CG1 4.43Å; K43-V158 WeakPolarHBondContact CD-O 3.36Å; K43-V158 WeakPolarHBondContact CE-O 3.32Å; K43-V158 HydrophobicContact CG-CB 4.32Å; K43-V158 HydrophobicContact CG-CG1 4.08Å; K43-V158 PolarHBondContact NZ-O 3.24Å; L92-V158 HydrophobicContact CD2-CG1 4.24Å; W154-V158 HydrophobicContact CD2-CB 4.05Å; W154-V158 HydrophobicContact CD2-CG1 4.45Å; W154-V158 HydrophobicContact CD2-CG2 3.71Å; W154-V158 HydrophobicContact CE3-CB 4.25Å; W154-V158 HydrophobicContact CE3-CG2 3.43Å; W154-V158 VanDerWaalsContact CE3-CG2 3.43Å; W154-V158 HydrophobicContact CG-CG2 4.4Å; W154-V158 HydrophobicContact CH2-CB 4.48Å; W154-V158 HydrophobicContact CH2-CG1 3.96Å; W154-V158 HydrophobicContact CH2-CG2 4.11Å; W154-V158 HydrophobicContact CZ2-CB 4.29Å; W154-V158 HydrophobicContact CZ2-CG1 3.77Å; W154-V158 HydrophobicContact CZ2-CG2 4.34Å; W154-V158 HydrophobicContact CZ3-CB 4.46Å; W154-V158 HydrophobicContact CZ3-CG1 4.37Å; W154-V158 HydrophobicContact CZ3-CG2 3.66Å; W154-V158 WeakPolarHBondContact O-CB 3.48Å; W154-V158 PolarHBondContact O-N 2.95Å; W154-V158 VanDerWaalsContact O-N 3.09Å | ||
| 159 | S | 94.1 | Very high | 92.8 | Very high | 22 Ų | 22 | 65.8 Ų | 65.8 | 15% | 0.154 | 34% | 0.337 | C | S | . | . | trans | -122.9 | 154 | 170.7 | -72.5 | 0 | 0 | 0 | 0 | 111.2 | W96 E161 G164 H165 | W96-S159 WeakPolarHBondContact CZ2-O 3.29Å; W96-S159 PolarHBondContact NE1-O 3.44Å; S159-E161 VanDerWaalsContact C-N 3.27Å; S159-E161 PolarHBondContact O-N 3Å; S159-G164 PolarHBondContact OG-O 3.29Å; S159-G164 VanDerWaalsContact OG-O 3.13Å; S159-H165 WeakPolarHBondContact OG-CA 3.18Å | ||
| 160 | N | 91.4 | Very high | 92.5 | Very high | 38 Ų | 38 | 67.4 Ų | 67.4 | 20% | 0.203 | 35% | 0.347 | C | S | . | . | S | Bend | trans | -63.4 | -36.3 | 176.5 | -79.6 | -50.4 | 0 | 0 | 0 | 112.5 | G41 A42 K43 K95 W96 | G41-N160 WeakPolarHBondContact CA-OD1 3.5Å; A42-N160 PolarHBondContact N-OD1 3.44Å; A42-N160 VanDerWaalsContact N-OD1 3.11Å; K43-N160 WeakPolarHBondContact CB-OD1 3.41Å; K43-N160 PolarHBondContact N-OD1 2.89Å; K95-N160 WeakPolarHBondContact CD-O 3.45Å; W96-N160 PolarHBondContact NE1-O 2.99Å |
| 161 | E | 89.6 | Confident | 92.2 | Very high | 87 Ų | 87 | 66.9 Ų | 66.9 | 41% | 0.407 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -136.4 | 143.5 | -173.8 | -75.6 | 170.6 | -172 | 0 | 0 | 109.2 | K95 S159 E163 G164 H165 | K95-E161 HydrophobicContact CD-CG 3.94Å; K95-E161 IonicContact NZ-OE1 2.81Å; K95-E161 PolarHBondContact NZ-OE1 3.33Å; S159-E161 VanDerWaalsContact C-N 3.27Å; S159-E161 PolarHBondContact O-N 3Å; E161-E163 PolarHBondContact O-N 3.18Å; E161-G164 PolarHBondContact O-N 3.02Å; E161-H165 PolarHBondContact O-N 3.25Å |
| 162 | P | 88.9 | Confident | 92 | Very high | 2 Ų | 2 | 71 Ų | 71 | 1% | 0.013 | 38% | 0.382 | C | S | . | . | G | 310 helix | trans | -56 | -34.7 | 177.9 | -24.3 | 32.2 | 0 | 0 | 0 | 113.5 | W96 G164 H165 I168 K173 I176 V177 | W96-P162 HydrophobicContact CD2-CG 4.04Å; W96-P162 HydrophobicContact CE3-CG 4.03Å; W96-P162 HydrophobicContact CH2-CB 4.18Å; W96-P162 HydrophobicContact CH2-CG 4.33Å; W96-P162 HydrophobicContact CZ2-CB 4.5Å; W96-P162 HydrophobicContact CZ2-CG 4.32Å; W96-P162 HydrophobicContact CZ3-CB 4.2Å; W96-P162 HydrophobicContact CZ3-CG 4.19Å; P162-G164 VanDerWaalsContact C-N 3.31Å; P162-G164 PolarHBondContact O-N 2.92Å; P162-H165 WeakPolarHBondContact O-CB 3.42Å; P162-H165 PolarHBondContact O-N 2.77Å; P162-H165 VanDerWaalsContact O-N 3.15Å; P162-I168 HydrophobicContact CB-CD1 4.45Å; P162-K173 VanDerWaalsContact O-CE 3.25Å; P162-K173 WeakPolarHBondContact O-CE 3.29Å; P162-I176 HydrophobicContact CB-CG2 4.3Å; P162-I176 HydrophobicContact CG-CB 4.34Å; P162-I176 HydrophobicContact CG-CG2 3.61Å; P162-V177 HydrophobicContact CB-CG2 4.32Å |
| 163 | E | 87.1 | Confident | 91.7 | Very high | 97 Ų | 97 | 69.2 Ų | 69.2 | 45% | 0.453 | 37% | 0.371 | S | S | . | . | G | 310 helix | trans | -59.8 | -41.7 | -179.4 | -66.9 | 89.3 | 157.3 | 0 | 0 | 112.1 | E161 H165 K173 V177 | E161-E163 PolarHBondContact O-N 3.18Å; E163-H165 VanDerWaalsContact C-N 3.33Å; E163-K173 PolarHBondContact O-NZ 3.47Å; E163-V177 VanDerWaalsContact CD-CG2 3.48Å; E163-V177 HydrophobicContact CG-CG2 3.96Å; E163-V177 VanDerWaalsContact OE1-CG2 3.3Å; E163-V177 WeakPolarHBondContact OE1-CG2 3.4Å |
| 164 | G | 85.3 | Confident | 91.4 | Very high | 43 Ų | 43 | 68.4 Ų | 68.4 | 44% | 0.443 | 37% | 0.371 | S | S | . | . | G | 310 helix | trans | -88.5 | 9.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | S159 E161 P162 H166 | S159-G164 PolarHBondContact OG-O 3.29Å; S159-G164 VanDerWaalsContact OG-O 3.13Å; E161-G164 PolarHBondContact O-N 3.02Å; P162-G164 VanDerWaalsContact C-N 3.31Å; P162-G164 PolarHBondContact O-N 2.92Å; G164-H166 PolarHBondContact O-CD2 3.47Å |
| 165 | H | 89 | Confident | 91.2 | Very high | 30 Ų | 30 | 71.4 Ų | 71.4 | 14% | 0.139 | 38% | 0.383 | C | S | . | . | trans | -82.9 | 128.9 | 177.3 | -164.5 | -86.2 | 0 | 0 | 0 | 111.4 | W96 F157 S159 E161 P162 E163 F167 I168 | W96-H165 HydrophobicContact CH2-CB 3.67Å; W96-H165 AromaticContact CH2-CD2 3.43Å; W96-H165 VanDerWaalsContact CH2-CD2 3.43Å; W96-H165 WeakPolarHBondContact CH2-CD2 3.44Å; W96-H165 AromaticContact CH2-CG 3.68Å; W96-H165 HydrophobicContact CZ2-CB 4.22Å; W96-H165 AromaticContact CZ2-CD2 3.89Å; F157-H165 PolarHBondContact O-NE2 3.46Å; S159-H165 WeakPolarHBondContact OG-CA 3.18Å; E161-H165 PolarHBondContact O-N 3.25Å; P162-H165 WeakPolarHBondContact O-CB 3.42Å; P162-H165 PolarHBondContact O-N 2.77Å; P162-H165 VanDerWaalsContact O-N 3.15Å; E163-H165 VanDerWaalsContact C-N 3.33Å; H165-F167 PolarHBondContact ND1-N 2.92Å; H165-I168 HydrophobicContact CB-CB 4.15Å; H165-I168 HydrophobicContact CB-CG2 3.75Å; H165-I168 PolarHBondContact ND1-N 3.46Å; H165-I168 VanDerWaalsContact ND1-N 3.11Å | ||
| 166 | H | 86.6 | Confident | 91 | Very high | 168 Ų | 168 | 70 Ų | 70 | 78% | 0.778 | 37% | 0.374 | S | S | * | . | S | Bend | trans | -82 | -29.7 | -172.9 | -65.9 | -177.1 | 0 | 0 | 0 | 113.2 | G164 | G164-H166 PolarHBondContact O-CD2 3.47Š|
| 167 | F | 89.4 | Confident | 90.8 | Very high | 131 Ų | 131 | 66.2 Ų | 66.2 | 58% | 0.575 | 36% | 0.355 | S | S | * | . | S | Bend | trans | -100.9 | 0.9 | -174.5 | -55.2 | -72.1 | 0 | 0 | 0 | 114.1 | F157 H165 | F157-F167 HydrophobicContact CD1-CD2 4.09Å; F157-F167 AromaticContact CD1-CE2 3.93Å; F157-F167 HydrophobicContact CD1-CE2 3.93Å; F157-F167 HydrophobicContact CE1-CE2 4.22Å; F157-F167 HydrophobicContact CE1-CZ 4.45Å; H165-F167 PolarHBondContact ND1-N 2.92Å |
| 168 | I | 91.3 | Very high | 90.5 | Very high | 18 Ų | 18 | 65 Ų | 65 | 9% | 0.092 | 35% | 0.354 | C | S | . | . | trans | -83.3 | 138.2 | -176.5 | -165.3 | 175.3 | 0 | 0 | 0 | 110 | W96 P162 H165 E172 K173 I176 | W96-I168 HydrophobicContact CZ3-CD1 4.06Å; P162-I168 HydrophobicContact CB-CD1 4.45Å; H165-I168 HydrophobicContact CB-CB 4.15Å; H165-I168 HydrophobicContact CB-CG2 3.75Å; H165-I168 PolarHBondContact ND1-N 3.46Å; H165-I168 VanDerWaalsContact ND1-N 3.11Å; I168-E172 HydrophobicContact CD1-CB 4.29Å; I168-E172 HydrophobicContact CD1-CG 3.98Å; I168-E172 HydrophobicContact CG1-CB 4.02Å; I168-E172 HydrophobicContact CG1-CG 4.04Å; I168-K173 HydrophobicContact CD1-CB 4.24Å; I168-K173 HydrophobicContact CG2-CB 4.1Å; I168-I176 HydrophobicContact CD1-CD1 3.87Å | ||
| 169 | G | 90.9 | Very high | 90.2 | Very high | 41 Ų | 41 | 64.7 Ų | 64.7 | 42% | 0.423 | 35% | 0.353 | S | S | . | . | trans | -67.6 | 149.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A171 E172 K173 | G169-A171 VanDerWaalsContact C-N 3.31Å; G169-A171 PolarHBondContact O-N 2.88Å; G169-E172 PolarHBondContact O-N 2.95Å; G169-K173 WeakPolarHBondContact O-CB 3.47Å; G169-K173 PolarHBondContact O-N 2.87Å | ||
| 170 | N | 90.5 | Very high | 89.7 | Confident | 131 Ų | 131 | 64.9 Ų | 64.9 | 70% | 0.701 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60 | -39.2 | -179.8 | -73.3 | -31.4 | 0 | 0 | 0 | 112.8 | K173 T174 | N170-K173 PolarHBondContact O-N 3.49Å; N170-T174 WeakPolarHBondContact O-CB 3.43Å; N170-T174 PolarHBondContact O-N 3.2Å; N170-T174 PolarHBondContact O-OG1 3.44Å; N170-T174 VanDerWaalsContact O-OG1 3.07Å |
| 171 | A | 92.6 | Very high | 89 | Confident | 85 Ų | 85 | 69.6 Ų | 69.6 | 70% | 0.702 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.5 | -45.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | G169 T174 Y175 | G169-A171 VanDerWaalsContact C-N 3.31Å; G169-A171 PolarHBondContact O-N 2.88Å; A171-T174 PolarHBondContact O-N 3.29Å; A171-Y175 WeakPolarHBondContact O-CB 3.34Å; A171-Y175 PolarHBondContact O-N 3.42Å |
| 172 | E | 92.8 | Very high | 87.6 | Confident | 109 Ų | 109 | 71.1 Ų | 71.1 | 51% | 0.509 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -66.4 | -44.4 | 177.4 | -172.2 | -176.3 | 177.6 | 0 | 0 | 111.3 | I168 G169 T174 Y175 I176 | I168-E172 HydrophobicContact CD1-CB 4.29Å; I168-E172 HydrophobicContact CD1-CG 3.98Å; I168-E172 HydrophobicContact CG1-CB 4.02Å; I168-E172 HydrophobicContact CG1-CG 4.04Å; G169-E172 PolarHBondContact O-N 2.95Å; E172-T174 VanDerWaalsContact C-N 3.33Å; E172-T174 PolarHBondContact O-N 3.25Å; E172-Y175 WeakPolarHBondContact O-CB 3.3Å; E172-Y175 PolarHBondContact O-N 3.4Å; E172-Y175 VanDerWaalsContact O-N 3.15Å; E172-I176 HydrophobicContact CG-CD1 4.09Å; E172-I176 WeakPolarHBondContact O-CG1 3.23Å; E172-I176 PolarHBondContact O-N 3.01Å |
| 173 | K | 92.2 | Very high | 86.2 | Confident | 48 Ų | 48 | 73.8 Ų | 73.8 | 21% | 0.209 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -54.3 | -49.6 | 174.4 | -177.6 | 179.2 | -64.1 | -163.6 | 0 | 111.4 | P162 E163 I168 G169 N170 Y175 I176 V177 | P162-K173 VanDerWaalsContact O-CE 3.25Å; P162-K173 WeakPolarHBondContact O-CE 3.29Å; E163-K173 PolarHBondContact O-NZ 3.47Å; I168-K173 HydrophobicContact CD1-CB 4.24Å; I168-K173 HydrophobicContact CG2-CB 4.1Å; G169-K173 WeakPolarHBondContact O-CB 3.47Å; G169-K173 PolarHBondContact O-N 2.87Å; N170-K173 PolarHBondContact O-N 3.49Å; K173-Y175 VanDerWaalsContact C-N 3.34Å; K173-Y175 PolarHBondContact O-N 2.91Å; K173-I176 PolarHBondContact O-N 2.89Å; K173-V177 HydrophobicContact CG-CG2 4.47Å; K173-V177 WeakPolarHBondContact O-CB 3.36Å; K173-V177 VanDerWaalsContact O-CG2 3.24Å; K173-V177 WeakPolarHBondContact O-CG2 3.08Å; K173-V177 PolarHBondContact O-N 3.1Å |
| 174 | T | 92 | Very high | 84.5 | Confident | 77 Ų | 77 | 69.5 Ų | 69.5 | 47% | 0.472 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63 | -40.8 | 178.6 | -61.7 | 0 | 0 | 0 | 0 | 111.7 | N170 A171 E172 N178 | N170-T174 WeakPolarHBondContact O-CB 3.43Å; N170-T174 PolarHBondContact O-N 3.2Å; N170-T174 PolarHBondContact O-OG1 3.44Å; N170-T174 VanDerWaalsContact O-OG1 3.07Å; A171-T174 PolarHBondContact O-N 3.29Å; E172-T174 VanDerWaalsContact C-N 3.33Å; E172-T174 PolarHBondContact O-N 3.25Å; T174-N178 VanDerWaalsContact CG2-ND2 3.34Å; T174-N178 WeakPolarHBondContact CG2-ND2 3.42Å; T174-N178 VanDerWaalsContact O-CB 3.22Å; T174-N178 WeakPolarHBondContact O-CB 3.37Å; T174-N178 PolarHBondContact O-N 3.45Å; T174-N178 PolarHBondContact O-ND2 3.29Å |
| 175 | Y | 91.8 | Very high | 83 | Confident | 101 Ų | 101 | 68.8 Ų | 68.8 | 40% | 0.396 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -59.8 | -52 | 176.7 | 171 | -112.9 | 0 | 0 | 0 | 112.1 | P98 S100 A171 E172 K173 S179 | P98-Y175 HydrophobicContact CB-CE1 4.01Å; P98-Y175 HydrophobicContact CG-CD1 4.29Å; P98-Y175 HydrophobicContact CG-CE1 3.66Å; S100-Y175 PolarHBondContact OG-OH 2.85Å; A171-Y175 WeakPolarHBondContact O-CB 3.34Å; A171-Y175 PolarHBondContact O-N 3.42Å; E172-Y175 WeakPolarHBondContact O-CB 3.3Å; E172-Y175 PolarHBondContact O-N 3.4Å; E172-Y175 VanDerWaalsContact O-N 3.15Å; K173-Y175 VanDerWaalsContact C-N 3.34Å; K173-Y175 PolarHBondContact O-N 2.91Å; Y175-S179 VanDerWaalsContact O-CB 3.28Å; Y175-S179 WeakPolarHBondContact O-CB 3.21Å; Y175-S179 PolarHBondContact O-N 3.3Å; Y175-S179 PolarHBondContact O-OG 3.43Å |
| 176 | I | 92 | Very high | 81.1 | Confident | 8 Ų | 8 | 71 Ų | 71 | 4% | 0.041 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -61.5 | -53.5 | -179 | -61.6 | 170.5 | 0 | 0 | 0 | 110 | W96 P98 P162 I168 E172 K173 N178 S179 L180 | W96-I176 HydrophobicContact CE3-CD1 4.22Å; W96-I176 HydrophobicContact CZ3-CD1 4.34Å; P98-I176 HydrophobicContact CG-CG1 4.18Å; P162-I176 HydrophobicContact CB-CG2 4.3Å; P162-I176 HydrophobicContact CG-CB 4.34Å; P162-I176 HydrophobicContact CG-CG2 3.61Å; I168-I176 HydrophobicContact CD1-CD1 3.87Å; E172-I176 HydrophobicContact CG-CD1 4.09Å; E172-I176 WeakPolarHBondContact O-CG1 3.23Å; E172-I176 PolarHBondContact O-N 3.01Å; K173-I176 PolarHBondContact O-N 2.89Å; I176-N178 VanDerWaalsContact C-N 3.35Å; I176-N178 PolarHBondContact O-N 3.06Å; I176-S179 PolarHBondContact O-N 2.97Å; I176-S179 PolarHBondContact O-OG 2.87Å; I176-L180 HydrophobicContact CG2-CD1 3.77Å; I176-L180 HydrophobicContact CG2-CG 4.4Å; I176-L180 WeakPolarHBondContact O-CG 3.37Å; I176-L180 PolarHBondContact O-N 3.06Å; I176-L180 VanDerWaalsContact O-N 3.08Å |
| 177 | V | 89.9 | Confident | 79.4 | Confident | 15 Ų | 15 | 65.2 Ų | 65.2 | 9% | 0.091 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -60.5 | -43.5 | -175.7 | 172.7 | 0 | 0 | 0 | 0 | 111.8 | P162 E163 K173 L180 K181 | P162-V177 HydrophobicContact CB-CG2 4.32Å; E163-V177 VanDerWaalsContact CD-CG2 3.48Å; E163-V177 HydrophobicContact CG-CG2 3.96Å; E163-V177 VanDerWaalsContact OE1-CG2 3.3Å; E163-V177 WeakPolarHBondContact OE1-CG2 3.4Å; K173-V177 HydrophobicContact CG-CG2 4.47Å; K173-V177 WeakPolarHBondContact O-CB 3.36Å; K173-V177 VanDerWaalsContact O-CG2 3.24Å; K173-V177 WeakPolarHBondContact O-CG2 3.08Å; K173-V177 PolarHBondContact O-N 3.1Å; V177-L180 PolarHBondContact O-N 3.27Å; V177-K181 HydrophobicContact CG1-CD 4.1Å; V177-K181 WeakPolarHBondContact O-CG 3.48Å; V177-K181 PolarHBondContact O-N 3.24Å; V177-K181 VanDerWaalsContact O-N 3.13Å |
| 178 | N | 89 | Confident | 77.3 | Confident | 85 Ų | 85 | 68.3 Ų | 68.3 | 46% | 0.455 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -67.5 | -41.2 | 178.7 | -71.3 | -12.5 | 0 | 0 | 0 | 111.3 | T174 I176 L180 K181 V182 | T174-N178 VanDerWaalsContact CG2-ND2 3.34Å; T174-N178 WeakPolarHBondContact CG2-ND2 3.42Å; T174-N178 VanDerWaalsContact O-CB 3.22Å; T174-N178 WeakPolarHBondContact O-CB 3.37Å; T174-N178 PolarHBondContact O-N 3.45Å; T174-N178 PolarHBondContact O-ND2 3.29Å; I176-N178 VanDerWaalsContact C-N 3.35Å; I176-N178 PolarHBondContact O-N 3.06Å; N178-L180 VanDerWaalsContact C-N 3.27Å; N178-L180 PolarHBondContact O-N 3.2Å; N178-K181 PolarHBondContact O-N 2.94Å; N178-V182 WeakPolarHBondContact O-CG2 3.49Å; N178-V182 PolarHBondContact O-N 3.31Å |
| 179 | S | 87 | Confident | 75.3 | Confident | 22 Ų | 22 | 70.5 Ų | 70.5 | 15% | 0.154 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -62.1 | -33.3 | 178.9 | 77 | 0 | 0 | 0 | 0 | 113.2 | Y175 I176 | Y175-S179 VanDerWaalsContact O-CB 3.28Å; Y175-S179 WeakPolarHBondContact O-CB 3.21Å; Y175-S179 PolarHBondContact O-N 3.3Å; Y175-S179 PolarHBondContact O-OG 3.43Å; I176-S179 PolarHBondContact O-N 2.97Å; I176-S179 PolarHBondContact O-OG 2.87Å |
| 180 | L | 85.3 | Confident | 73.5 | Confident | 27 Ų | 27 | 70.4 Ų | 70.4 | 14% | 0.141 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -81.9 | -32.9 | -179.9 | -65.4 | 173.6 | 0 | 0 | 0 | 113.1 | K95 I176 V177 N178 V182 E183 G185 | K95-L180 WeakPolarHBondContact O-CD1 3.48Å; I176-L180 HydrophobicContact CG2-CD1 3.77Å; I176-L180 HydrophobicContact CG2-CG 4.4Å; I176-L180 WeakPolarHBondContact O-CG 3.37Å; I176-L180 PolarHBondContact O-N 3.06Å; I176-L180 VanDerWaalsContact O-N 3.08Å; V177-L180 PolarHBondContact O-N 3.27Å; N178-L180 VanDerWaalsContact C-N 3.27Å; N178-L180 PolarHBondContact O-N 3.2Å; L180-V182 VanDerWaalsContact C-N 3.33Å; L180-V182 PolarHBondContact O-N 2.67Å; L180-E183 PolarHBondContact O-N 3.47Å; L180-G185 PolarHBondContact O-N 3.24Å |
| 181 | K | 76.2 | Confident | 71.9 | Confident | 137 Ų | 137 | 67.1 Ų | 67.1 | 60% | 0.596 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -64.2 | -38 | 177 | -78.7 | 174.6 | -178.9 | 172.7 | 0 | 112.3 | V177 N178 E183 G184 | V177-K181 HydrophobicContact CG1-CD 4.1Å; V177-K181 WeakPolarHBondContact O-CG 3.48Å; V177-K181 PolarHBondContact O-N 3.24Å; V177-K181 VanDerWaalsContact O-N 3.13Å; N178-K181 PolarHBondContact O-N 2.94Å; K181-E183 PolarHBondContact O-N 3.38Å; K181-G184 PolarHBondContact O-N 2.76Å |
| 182 | V | 60.6 | Low | 70.5 | Confident | 118 Ų | 118 | 69.3 Ų | 69.3 | 72% | 0.715 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -59.5 | -32.6 | 179.7 | 173.8 | 0 | 0 | 0 | 0 | 111.9 | N178 L180 | N178-V182 WeakPolarHBondContact O-CG2 3.49Å; N178-V182 PolarHBondContact O-N 3.31Å; L180-V182 VanDerWaalsContact C-N 3.33Å; L180-V182 PolarHBondContact O-N 2.67Å |
| 183 | E | 58.1 | Low | 69.2 | Low | 59 Ų | 59 | 73.1 Ų | 73.1 | 28% | 0.276 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | 2.7 | 177.9 | -71.6 | -168 | 168.8 | 0 | 0 | 114.5 | P99 R102 L180 K181 G185 | P99-E183 WeakPolarHBondContact CB-OE1 3.45Å; P99-E183 HydrophobicContact CG-CG 4.23Å; P99-E183 WeakPolarHBondContact CG-OE1 3.48Å; R102-E183 IonicContact CZ-OE2 3.57Å; R102-E183 IonicContact NH1-OE1 3.34Å; R102-E183 IonicContact NH1-OE2 2.67Å; R102-E183 PolarHBondContact NH1-OE2 2.93Å; R102-E183 IonicContact NH2-OE2 3.7Å; R102-E183 PolarHBondContact NH2-OE2 3.38Å; L180-E183 PolarHBondContact O-N 3.47Å; K181-E183 PolarHBondContact O-N 3.38Å; E183-G185 VanDerWaalsContact C-N 3.28Å; E183-G185 PolarHBondContact O-N 3.46Å |
| 184 | G | 53 | Low | 68.5 | Low | 7 Ų | 7 | 76 Ų | 76 | 7% | 0.072 | 42% | 0.417 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 72.2 | 19.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | K181 S186 T404 T407 | K181-G184 PolarHBondContact O-N 2.76Å; G184-S186 PolarHBondContact O-N 2.84Å; G184-T404 WeakPolarHBondContact O-CG2 3.4Å; G184-T407 WeakPolarHBondContact CA-OG1 3.4Å |
| 185 | G | 51.9 | Low | 68.1 | Low | 27 Ų | 27 | 73.1 Ų | 73.1 | 28% | 0.278 | 40% | 0.398 | S | S | . | . | trans | -71.3 | 15.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | L180 E183 S187 | L180-G185 PolarHBondContact O-N 3.24Å; E183-G185 VanDerWaalsContact C-N 3.28Å; E183-G185 PolarHBondContact O-N 3.46Å; G185-S187 PolarHBondContact O-N 3.46Å | ||
| 186 | S | 49.8 | Very low | 68 | Low | 78 Ų | 78 | 69.9 Ų | 69.9 | 55% | 0.545 | 39% | 0.389 | S | S | . | . | trans | -68.9 | 94.8 | 178.6 | 63.1 | 0 | 0 | 0 | 0 | 110.3 | G184 K188 | G184-S186 PolarHBondContact O-N 2.84Å; S186-K188 PolarHBondContact O-N 3.48Å | ||
| 187 | S | 50.4 | Low | 67.9 | Low | 45 Ų | 45 | 72.6 Ų | 72.6 | 32% | 0.315 | 40% | 0.404 | S | S | . | . | trans | -70.4 | 67.1 | 171.9 | 65.8 | 0 | 0 | 0 | 0 | 110.5 | K95 G185 G189 | K95-S187 WeakPolarHBondContact CE-OG 3.41Å; G185-S187 PolarHBondContact O-N 3.46Å; S187-G189 PolarHBondContact O-N 3.26Å; S187-G189 VanDerWaalsContact O-N 3.14Å | ||
| 188 | K | 46.3 | Very low | 68.1 | Low | 196 Ų | 196 | 80.1 Ų | 80.1 | 85% | 0.852 | 44% | 0.435 | S | S | * | . | trans | -73 | 106.5 | 161.4 | -82.4 | -169.9 | 177 | -178.5 | 0 | 106.5 | S186 S190 | S186-K188 PolarHBondContact O-N 3.48Å; K188-S190 PolarHBondContact O-N 3.14Å | ||
| 189 | G | 49.1 | Very low | 68.2 | Low | 65 Ų | 65 | 78.1 Ų | 78.1 | 67% | 0.67 | 43% | 0.428 | S | S | * | . | trans | -15.4 | 94.6 | -176 | 0 | 0 | 0 | 0 | 0 | 114.6 | S187 S191 | S187-G189 PolarHBondContact O-N 3.26Å; S187-G189 VanDerWaalsContact O-N 3.14Å; G189-S191 PolarHBondContact O-N 3.21Å | ||
| 190 | S | 52.8 | Low | 68.6 | Low | 39 Ų | 39 | 77.1 Ų | 77.1 | 27% | 0.273 | 42% | 0.421 | S | S | . | . | trans | -61.2 | 114.6 | 167.3 | 54.8 | 0 | 0 | 0 | 0 | 106.6 | K188 | K188-S190 PolarHBondContact O-N 3.14Š| ||
| 191 | S | 57.5 | Low | 69 | Low | 61 Ų | 61 | 79.8 Ų | 79.8 | 43% | 0.427 | 44% | 0.435 | S | S | . | . | trans | -52.4 | 146.6 | 164.2 | 177.8 | 0 | 0 | 0 | 0 | 107.8 | G189 K193 D194 | G189-S191 PolarHBondContact O-N 3.21Å; S191-K193 PolarHBondContact O-N 2.95Å; S191-D194 WeakPolarHBondContact CB-OD2 3.41Å; S191-D194 PolarHBondContact O-N 3.5Å | ||
| 192 | F | 63.3 | Low | 69.9 | Low | 131 Ų | 131 | 77.7 Ų | 77.7 | 58% | 0.575 | 43% | 0.434 | S | S | * | . | G | 310 helix | trans | -53.9 | -28.8 | 179.1 | -173.4 | -99.4 | 0 | 0 | 0 | 112.2 | L35 D194 I195 | L35-F192 HydrophobicContact CD1-CD2 3.82Å; L35-F192 HydrophobicContact CD1-CE2 3.51Å; L35-F192 HydrophobicContact CD2-CD2 3.92Å; L35-F192 HydrophobicContact CD2-CE2 4.08Å; L35-F192 HydrophobicContact CG-CE2 4.45Å; F192-D194 VanDerWaalsContact C-N 3.28Å; F192-D194 PolarHBondContact O-N 3.13Å; F192-I195 HydrophobicContact CD2-CD1 3.73Å; F192-I195 HydrophobicContact CE2-CD1 4.22Å; F192-I195 HydrophobicContact CG-CD1 4.36Å |
| 193 | K | 64.7 | Low | 71.6 | Confident | 189 Ų | 189 | 72.5 Ų | 72.5 | 82% | 0.822 | 40% | 0.403 | S | S | * | . | G | 310 helix | trans | -68.2 | -22.4 | 177.2 | -65.1 | -172.3 | 178 | -176.6 | 0 | 114.2 | S191 | S191-K193 PolarHBondContact O-N 2.95Š|
| 194 | D | 77.5 | Confident | 73.5 | Confident | 109 Ų | 109 | 74.1 Ų | 74.1 | 58% | 0.583 | 41% | 0.412 | S | S | * | . | G | 310 helix | trans | -95.9 | 1.5 | -175.5 | -55.2 | -35 | 0 | 0 | 0 | 112.5 | S191 F192 P196 | S191-D194 WeakPolarHBondContact CB-OD2 3.41Å; S191-D194 PolarHBondContact O-N 3.5Å; F192-D194 VanDerWaalsContact C-N 3.28Å; F192-D194 PolarHBondContact O-N 3.13Å; D194-P196 WeakPolarHBondContact O-CD 3.27Å |
| 195 | I | 84.5 | Confident | 75.7 | Confident | 16 Ų | 16 | 74.2 Ų | 74.2 | 8% | 0.082 | 41% | 0.412 | C | S | . | . | trans | -75.1 | 122.7 | 179.7 | -59.4 | 171.5 | 0 | 0 | 0 | 108.7 | L35 F192 L197 I200 L339 | L35-I195 HydrophobicContact CD2-CD1 3.7Å; F192-I195 HydrophobicContact CD2-CD1 3.73Å; F192-I195 HydrophobicContact CE2-CD1 4.22Å; F192-I195 HydrophobicContact CG-CD1 4.36Å; I195-L197 HydrophobicContact CB-CG 4.41Å; I195-L197 HydrophobicContact CG2-CD2 3.82Å; I195-L197 HydrophobicContact CG2-CG 3.87Å; I195-L197 PolarHBondContact O-N 3.26Å; I195-I200 HydrophobicContact CG2-CD1 3.99Å; I195-L339 HydrophobicContact CD1-CD2 3.92Å; I195-L339 HydrophobicContact CG2-CD2 3.63Å | ||
| 196 | P | 89.3 | Confident | 77.8 | Confident | 33 Ų | 33 | 73 Ų | 73 | 21% | 0.214 | 40% | 0.399 | C | S | . | . | trans | -78.1 | 61.1 | -179.9 | 34.2 | -36.9 | 0 | 0 | 0 | 111.4 | D194 K198 S199 I200 Y336 W401 | D194-P196 WeakPolarHBondContact O-CD 3.27Å; P196-K198 VanDerWaalsContact C-N 3.27Å; P196-K198 PolarHBondContact O-N 2.91Å; P196-S199 PolarHBondContact O-N 3.23Å; P196-I200 WeakPolarHBondContact O-CG1 3.2Å; P196-I200 PolarHBondContact O-N 2.88Å; P196-Y336 HydrophobicContact CG-CE2 4.09Å; P196-W401 HydrophobicContact CG-CE3 3.99Å | ||
| 197 | L | 90.8 | Very high | 80.1 | Confident | 66 Ų | 66 | 74.3 Ų | 74.3 | 35% | 0.346 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -55.4 | -41 | -175.5 | -75.4 | 176.1 | 0 | 0 | 0 | 112.6 | I195 S199 I200 L201 L339 | I195-L197 HydrophobicContact CB-CG 4.41Å; I195-L197 HydrophobicContact CG2-CD2 3.82Å; I195-L197 HydrophobicContact CG2-CG 3.87Å; I195-L197 PolarHBondContact O-N 3.26Å; L197-S199 PolarHBondContact O-N 3.02Å; L197-I200 PolarHBondContact O-N 3.06Å; L197-L201 WeakPolarHBondContact O-CB 3.46Å; L197-L201 VanDerWaalsContact O-CG 3.32Å; L197-L201 WeakPolarHBondContact O-CG 3.49Å; L197-L201 PolarHBondContact O-N 2.78Å; L197-L339 HydrophobicContact CD2-CD2 4.46Å |
| 198 | K | 92.2 | Very high | 82.4 | Confident | 173 Ų | 173 | 72.2 Ų | 72.2 | 75% | 0.752 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -58.4 | -49.6 | 176.2 | -173.9 | 177.8 | 178.6 | -178.9 | 0 | 110.7 | P196 I200 L201 T202 | P196-K198 VanDerWaalsContact C-N 3.27Å; P196-K198 PolarHBondContact O-N 2.91Å; K198-I200 VanDerWaalsContact C-N 3.34Å; K198-I200 PolarHBondContact O-N 3.34Å; K198-L201 PolarHBondContact O-N 3.48Å; K198-T202 HydrophobicContact CG-CG2 4.4Å; K198-T202 WeakPolarHBondContact O-CB 3.48Å; K198-T202 WeakPolarHBondContact O-CG2 3.14Å; K198-T202 PolarHBondContact O-N 3.28Å; K198-T202 PolarHBondContact O-OG1 2.73Å |
| 199 | S | 92.7 | Very high | 84.9 | Confident | 43 Ų | 43 | 62.9 Ų | 62.9 | 30% | 0.301 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.6 | -39.4 | -180 | -50.4 | 0 | 0 | 0 | 0 | 112.3 | P196 L197 T202 S203 | P196-S199 PolarHBondContact O-N 3.23Å; L197-S199 PolarHBondContact O-N 3.02Å; S199-T202 WeakPolarHBondContact CA-OG1 3.47Å; S199-T202 PolarHBondContact O-N 3.45Å; S199-T202 PolarHBondContact O-OG1 2.79Å; S199-S203 VanDerWaalsContact O-CB 3.27Å; S199-S203 WeakPolarHBondContact O-CB 3.47Å; S199-S203 PolarHBondContact O-N 3.35Å; S199-S203 VanDerWaalsContact O-N 3.09Å |
| 200 | I | 93.9 | Very high | 87.2 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59.6 | -52.5 | 174.9 | -68.2 | 166.4 | 0 | 0 | 0 | 109.9 | I195 P196 L197 K198 T202 S203 V340 W401 | I195-I200 HydrophobicContact CG2-CD1 3.99Å; P196-I200 WeakPolarHBondContact O-CG1 3.2Å; P196-I200 PolarHBondContact O-N 2.88Å; L197-I200 PolarHBondContact O-N 3.06Å; K198-I200 VanDerWaalsContact C-N 3.34Å; K198-I200 PolarHBondContact O-N 3.34Å; I200-T202 VanDerWaalsContact C-N 3.29Å; I200-T202 PolarHBondContact O-N 3.09Å; I200-S203 WeakPolarHBondContact O-CB 3.27Å; I200-S203 PolarHBondContact O-N 3.23Å; I200-V340 HydrophobicContact CD1-CG2 4.14Å; I200-V340 HydrophobicContact CG1-CG2 4.36Å; I200-V340 HydrophobicContact CG2-CG1 4.49Å; I200-V340 HydrophobicContact CG2-CG2 3.89Å; I200-W401 HydrophobicContact CD1-CZ3 4.27Å; I200-W401 HydrophobicContact CG1-CE3 4.14Å; I200-W401 HydrophobicContact CG1-CH2 3.66Å; I200-W401 HydrophobicContact CG1-CZ2 4.36Å; I200-W401 HydrophobicContact CG1-CZ3 3.52Å |
| 201 | L | 94.4 | Very high | 89.4 | Confident | 83 Ų | 83 | 59.6 Ų | 59.6 | 44% | 0.435 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -74 | -16.6 | -175.8 | -65.1 | 176.6 | 0 | 0 | 0 | 113.7 | L197 K198 W207 I343 | L197-L201 WeakPolarHBondContact O-CB 3.46Å; L197-L201 VanDerWaalsContact O-CG 3.32Å; L197-L201 WeakPolarHBondContact O-CG 3.49Å; L197-L201 PolarHBondContact O-N 2.78Å; K198-L201 PolarHBondContact O-N 3.48Å; L201-W207 PolarHBondContact O-NE1 2.93Å; L201-I343 HydrophobicContact CD2-CG2 4.4Å |
| 202 | T | 95.6 | Very high | 91.3 | Very high | 94 Ų | 94 | 56.7 Ų | 56.7 | 58% | 0.577 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -97 | -3.1 | 172.8 | 58.3 | 0 | 0 | 0 | 0 | 113.3 | K198 S199 I200 I204 | K198-T202 HydrophobicContact CG-CG2 4.4Å; K198-T202 WeakPolarHBondContact O-CB 3.48Å; K198-T202 WeakPolarHBondContact O-CG2 3.14Å; K198-T202 PolarHBondContact O-N 3.28Å; K198-T202 PolarHBondContact O-OG1 2.73Å; S199-T202 WeakPolarHBondContact CA-OG1 3.47Å; S199-T202 PolarHBondContact O-N 3.45Å; S199-T202 PolarHBondContact O-OG1 2.79Å; I200-T202 VanDerWaalsContact C-N 3.29Å; I200-T202 PolarHBondContact O-N 3.09Å; T202-I204 PolarHBondContact O-N 2.65Å |
| 203 | S | 96.9 | Very high | 92.9 | Very high | 9 Ų | 9 | 50.6 Ų | 50.6 | 6% | 0.063 | 25% | 0.253 | C | S | . | . | trans | -78.9 | 113.7 | -174.6 | -176.9 | 0 | 0 | 0 | 0 | 111.5 | S199 I200 I206 W207 | S199-S203 VanDerWaalsContact O-CB 3.27Å; S199-S203 WeakPolarHBondContact O-CB 3.47Å; S199-S203 PolarHBondContact O-N 3.35Å; S199-S203 VanDerWaalsContact O-N 3.09Å; I200-S203 WeakPolarHBondContact O-CB 3.27Å; I200-S203 PolarHBondContact O-N 3.23Å; S203-I206 WeakPolarHBondContact O-CB 3.45Å; S203-I206 PolarHBondContact O-N 3.13Å; S203-I206 VanDerWaalsContact O-N 3.16Å; S203-I206 WeakPolarHBondContact OG-CG1 3.44Å; S203-W207 PolarHBondContact O-N 3.08Å; S203-W207 VanDerWaalsContact O-N 3.09Å | ||
| 204 | I | 97.5 | Very high | 94.5 | Very high | 93 Ų | 93 | 44.4 Ų | 44.4 | 48% | 0.477 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -58.3 | -45.1 | -179.7 | -68.1 | 171.5 | 0 | 0 | 0 | 112.9 | T202 I206 W207 A208 F393 | T202-I204 PolarHBondContact O-N 2.65Å; I204-I206 VanDerWaalsContact C-N 3.27Å; I204-I206 PolarHBondContact O-N 3.17Å; I204-W207 PolarHBondContact O-N 2.8Å; I204-A208 PolarHBondContact O-N 3.23Å; I204-F393 HydrophobicContact CG2-CB 3.62Å; I204-F393 HydrophobicContact CG2-CD1 3.38Å; I204-F393 HydrophobicContact CG2-CE1 4.19Å; I204-F393 HydrophobicContact CG2-CG 3.63Å |
| 205 | P | 97.7 | Very high | 95.5 | Very high | 9 Ų | 9 | 39.3 Ų | 39.3 | 6% | 0.058 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.7 | -31.1 | 176.6 | -26.6 | 37.1 | 0 | 0 | 0 | 114.2 | A208 A209 L332 K395 | P205-A208 PolarHBondContact O-N 3.4Å; P205-A209 PolarHBondContact O-N 3.16Å; P205-A209 VanDerWaalsContact O-N 3.15Å; P205-L332 HydrophobicContact CB-CD1 4.23Å; P205-L332 HydrophobicContact CB-CD2 3.86Å; P205-K395 HydrophobicContact CB-CB 4Å; P205-K395 HydrophobicContact CB-CG 4.27Å; P205-K395 HydrophobicContact CG-CB 4.03Å; P205-K395 HydrophobicContact CG-CD 3.74Å; P205-K395 HydrophobicContact CG-CG 3.82Å |
| 206 | I | 97.6 | Very high | 96.1 | Very high | 1 Ų | 1 | 38.6 Ų | 38.6 | 1% | 0.005 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -68.9 | -44.4 | 175.8 | -60.9 | -70.6 | 0 | 0 | 0 | 109.5 | S203 I204 A208 A209 M210 L332 V340 W401 | S203-I206 WeakPolarHBondContact O-CB 3.45Å; S203-I206 PolarHBondContact O-N 3.13Å; S203-I206 VanDerWaalsContact O-N 3.16Å; S203-I206 WeakPolarHBondContact OG-CG1 3.44Å; I204-I206 VanDerWaalsContact C-N 3.27Å; I204-I206 PolarHBondContact O-N 3.17Å; I206-A208 VanDerWaalsContact C-N 3.3Å; I206-A208 PolarHBondContact O-N 2.98Å; I206-A209 PolarHBondContact O-N 2.9Å; I206-M210 HydrophobicContact CG2-CE 3.59Å; I206-M210 HydrophobicContact CG2-CG 4.35Å; I206-M210 HydrophobicContact CG2-SD 3.95Å; I206-M210 WeakPolarHBondContact O-CB 3.36Å; I206-M210 VanDerWaalsContact O-CG 3.28Å; I206-M210 WeakPolarHBondContact O-CG 3.17Å; I206-M210 PolarHBondContact O-N 3.44Å; I206-L332 HydrophobicContact CD1-CB 4.01Å; I206-L332 HydrophobicContact CD1-CD1 3.79Å; I206-V340 HydrophobicContact CD1-CG1 3.98Å; I206-V340 HydrophobicContact CG2-CG1 3.74Å; I206-W401 HydrophobicContact CD1-CH2 4.32Å; I206-W401 HydrophobicContact CD1-CZ2 4.07Å; I206-W401 HydrophobicContact CG1-CZ2 3.91Å |
| 207 | W | 98.1 | Very high | 96.4 | Very high | 106 Ų | 106 | 37.3 Ų | 37.3 | 40% | 0.402 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -61.2 | -37 | 173 | -83.7 | 105.4 | 0 | 0 | 0 | 113 | L201 S203 I204 M210 I211 L347 | L201-W207 PolarHBondContact O-NE1 2.93Å; S203-W207 PolarHBondContact O-N 3.08Å; S203-W207 VanDerWaalsContact O-N 3.09Å; I204-W207 PolarHBondContact O-N 2.8Å; W207-M210 PolarHBondContact O-N 3.49Å; W207-I211 WeakPolarHBondContact O-CB 3.35Å; W207-I211 VanDerWaalsContact O-CG1 3.32Å; W207-I211 WeakPolarHBondContact O-CG1 3.43Å; W207-I211 PolarHBondContact O-N 3.35Å; W207-L347 HydrophobicContact CH2-CD1 4.41Å; W207-L347 HydrophobicContact CZ3-CD1 4.32Å |
| 208 | A | 98.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.4 | -48.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | I204 P205 I206 M210 I211 S212 F389 Y390 F393 | I204-A208 PolarHBondContact O-N 3.23Å; P205-A208 PolarHBondContact O-N 3.4Å; I206-A208 VanDerWaalsContact C-N 3.3Å; I206-A208 PolarHBondContact O-N 2.98Å; A208-M210 PolarHBondContact O-N 2.91Å; A208-I211 PolarHBondContact O-N 3.14Å; A208-S212 WeakPolarHBondContact O-CB 3.49Å; A208-S212 PolarHBondContact O-N 2.73Å; A208-F389 HydrophobicContact CB-CD1 3.99Å; A208-F389 HydrophobicContact CB-CE1 3.95Å; A208-Y390 HydrophobicContact CB-CD2 4.02Å; A208-Y390 HydrophobicContact CB-CE2 4.49Å; A208-Y390 WeakPolarHBondContact O-CD2 3.4Å; A208-F393 HydrophobicContact CB-CB 4Å |
| 209 | A | 98.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -64.1 | -38.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | P205 I206 S212 H213 F325 Y329 Y390 | P205-A209 PolarHBondContact O-N 3.16Å; P205-A209 VanDerWaalsContact O-N 3.15Å; I206-A209 PolarHBondContact O-N 2.9Å; A209-S212 PolarHBondContact O-N 3.34Å; A209-H213 WeakPolarHBondContact O-CB 3.43Å; A209-H213 PolarHBondContact O-N 3.03Å; A209-F325 HydrophobicContact CB-CB 4.35Å; A209-Y329 HydrophobicContact CB-CE1 3.83Å; A209-Y329 HydrophobicContact CB-CE2 4.2Å; A209-Y329 WeakPolarHBondContact CB-OH 3.32Å; A209-Y329 PolarHBondContact O-OH 2.97Å; A209-Y390 HydrophobicContact CB-CE2 4.33Å |
| 210 | M | 98 | Very high | 96.6 | Very high | 5 Ų | 5 | 26.3 Ų | 26.3 | 3% | 0.025 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -66 | -41 | 177.9 | -73.3 | 178.6 | 171.2 | 0 | 0 | 113.1 | I206 W207 A208 S212 H213 F214 Y329 V340 I343 L347 | I206-M210 HydrophobicContact CG2-CE 3.59Å; I206-M210 HydrophobicContact CG2-CG 4.35Å; I206-M210 HydrophobicContact CG2-SD 3.95Å; I206-M210 WeakPolarHBondContact O-CB 3.36Å; I206-M210 VanDerWaalsContact O-CG 3.28Å; I206-M210 WeakPolarHBondContact O-CG 3.17Å; I206-M210 PolarHBondContact O-N 3.44Å; W207-M210 PolarHBondContact O-N 3.49Å; A208-M210 PolarHBondContact O-N 2.91Å; M210-S212 VanDerWaalsContact C-N 3.34Å; M210-H213 PolarHBondContact O-N 3.24Å; M210-F214 WeakPolarHBondContact O-CB 3.34Å; M210-F214 PolarHBondContact O-N 3.23Å; M210-Y329 PolarHBondContact N-OH 2.96Å; M210-V340 HydrophobicContact CE-CG1 4.1Å; M210-I343 HydrophobicContact CE-CB 3.98Å; M210-I343 HydrophobicContact CE-CG2 3.63Å; M210-L347 HydrophobicContact SD-CD1 4.18Å |
| 211 | I | 98 | Very high | 96.5 | Very high | 31 Ų | 31 | 27.8 Ų | 27.8 | 16% | 0.159 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.6 | -45.3 | 174.7 | -73.2 | 165.2 | 0 | 0 | 0 | 109.6 | W207 A208 H213 F214 T215 F385 F389 | W207-I211 WeakPolarHBondContact O-CB 3.35Å; W207-I211 VanDerWaalsContact O-CG1 3.32Å; W207-I211 WeakPolarHBondContact O-CG1 3.43Å; W207-I211 PolarHBondContact O-N 3.35Å; A208-I211 PolarHBondContact O-N 3.14Å; I211-H213 PolarHBondContact O-N 2.9Å; I211-F214 PolarHBondContact O-N 2.93Å; I211-T215 HydrophobicContact CG2-CG2 4.39Å; I211-T215 WeakPolarHBondContact O-CG2 3.45Å; I211-T215 PolarHBondContact O-N 3.34Å; I211-T215 PolarHBondContact O-OG1 3.21Å; I211-F385 HydrophobicContact CD1-CE1 4.36Å; I211-F385 HydrophobicContact CG2-CD1 3.96Å; I211-F385 HydrophobicContact CG2-CE1 3.67Å; I211-F389 HydrophobicContact CD1-CD1 3.65Å; I211-F389 HydrophobicContact CD1-CD2 4.23Å; I211-F389 HydrophobicContact CD1-CE1 3.55Å; I211-F389 HydrophobicContact CD1-CE2 4.13Å; I211-F389 HydrophobicContact CD1-CG 4Å; I211-F389 HydrophobicContact CD1-CZ 3.79Å |
| 212 | S | 98.3 | Very high | 96.3 | Very high | 0 Ų | 0 | 23.9 Ų | 23.9 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -56.9 | -50.2 | 175.8 | -176.1 | 0 | 0 | 0 | 0 | 111.5 | A208 A209 M210 F214 T215 Y216 D283 H287 F325 S386 | A208-S212 WeakPolarHBondContact O-CB 3.49Å; A208-S212 PolarHBondContact O-N 2.73Å; A209-S212 PolarHBondContact O-N 3.34Å; M210-S212 VanDerWaalsContact C-N 3.34Å; S212-F214 PolarHBondContact O-N 3.48Å; S212-T215 PolarHBondContact O-N 3.05Å; S212-T215 PolarHBondContact O-OG1 3.3Å; S212-Y216 VanDerWaalsContact O-CB 3.29Å; S212-Y216 WeakPolarHBondContact O-CB 3.43Å; S212-Y216 PolarHBondContact O-N 3.24Å; S212-D283 WeakPolarHBondContact CB-OD2 3.48Å; S212-D283 PolarHBondContact OG-OD1 3.44Å; S212-D283 VanDerWaalsContact OG-OD1 3.05Å; S212-D283 PolarHBondContact OG-OD2 3.33Å; S212-H287 PolarHBondContact O-NE2 3.23Å; S212-H287 PolarHBondContact OG-CE1 3.29Å; S212-F325 VanDerWaalsContact OG-CD1 3.27Å; S212-F325 WeakPolarHBondContact OG-CD1 3.42Å; S212-S386 VanDerWaalsContact CA-OG 3.31Å; S212-S386 WeakPolarHBondContact CA-OG 3.48Å |
| 213 | H | 97.8 | Very high | 96 | Very high | 2 Ų | 2 | 19.6 Ų | 19.6 | 1% | 0.009 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -57.6 | -44.6 | 174.7 | -166.5 | 177.3 | 0 | 0 | 0 | 113.4 | A209 M210 I211 Y216 N217 F325 F341 S344 N345 A348 | A209-H213 WeakPolarHBondContact O-CB 3.43Å; A209-H213 PolarHBondContact O-N 3.03Å; M210-H213 PolarHBondContact O-N 3.24Å; I211-H213 PolarHBondContact O-N 2.9Å; H213-Y216 PolarHBondContact O-N 2.84Å; H213-N217 PolarHBondContact NE2-ND2 3.39Å; H213-N217 WeakPolarHBondContact O-CB 3.32Å; H213-N217 PolarHBondContact O-N 3.01Å; H213-F325 HydrophobicContact CB-CD2 3.67Å; H213-F325 HydrophobicContact CB-CE2 3.37Å; H213-F325 HydrophobicContact CB-CZ 3.96Å; H213-F325 AromaticContact CD2-CE2 3.53Å; H213-F325 AromaticContact CD2-CZ 3.73Å; H213-F325 AromaticContact CG-CE2 3.35Å; H213-F325 AromaticContact CG-CZ 3.95Å; H213-F325 AromaticContact ND1-CE2 3.94Å; H213-F341 AromaticContact CE1-CE1 3.78Å; H213-F341 AromaticContact CE1-CZ 3.48Å; H213-F341 VanDerWaalsContact CE1-CZ 3.48Å; H213-F341 WeakPolarHBondContact CE1-CZ 3.45Å; H213-S344 PolarHBondContact ND1-OG 2.98Å; H213-N345 PolarHBondContact CE1-OD1 2.62Å; H213-N345 PolarHBondContact NE2-OD1 2.95Å; H213-A348 HydrophobicContact CB-CB 4.23Å |
| 214 | F | 97.5 | Very high | 95.6 | Very high | 59 Ų | 59 | 22 Ų | 22 | 26% | 0.259 | 10% | 0.101 | S | C | . | . | H | α-helix | trans | -60.3 | -48 | 178.3 | 177.4 | -84.3 | 0 | 0 | 0 | 111.8 | M210 I211 S212 N217 W218 L347 V350 P351 | M210-F214 WeakPolarHBondContact O-CB 3.34Å; M210-F214 PolarHBondContact O-N 3.23Å; I211-F214 PolarHBondContact O-N 2.93Å; S212-F214 PolarHBondContact O-N 3.48Å; F214-N217 PolarHBondContact O-N 2.86Å; F214-W218 HydrophobicContact CE1-CE3 4.15Å; F214-W218 HydrophobicContact CZ-CE3 4.17Å; F214-W218 PolarHBondContact O-N 3.22Å; F214-L347 WeakPolarHBondContact CD2-O 3.21Å; F214-V350 HydrophobicContact CE2-CB 4.39Å; F214-P351 HydrophobicContact CD1-CG 4.29Å; F214-P351 HydrophobicContact CD2-CG 3.68Å; F214-P351 HydrophobicContact CE1-CG 4.06Å; F214-P351 HydrophobicContact CE2-CG 3.43Å; F214-P351 VanDerWaalsContact CE2-CG 3.43Å; F214-P351 HydrophobicContact CG-CG 4.11Å; F214-P351 HydrophobicContact CZ-CG 3.64Å |
| 215 | T | 97.4 | Very high | 94.9 | Very high | 2 Ų | 2 | 20.7 Ų | 20.7 | 1% | 0.012 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -70.5 | -37.7 | -178.3 | 63 | 0 | 0 | 0 | 0 | 112.1 | I211 S212 W218 A219 H287 L382 Y383 S386 | I211-T215 HydrophobicContact CG2-CG2 4.39Å; I211-T215 WeakPolarHBondContact O-CG2 3.45Å; I211-T215 PolarHBondContact O-N 3.34Å; I211-T215 PolarHBondContact O-OG1 3.21Å; S212-T215 PolarHBondContact O-N 3.05Å; S212-T215 PolarHBondContact O-OG1 3.3Å; T215-W218 PolarHBondContact O-N 3.46Å; T215-A219 PolarHBondContact O-N 3.07Å; T215-H287 PolarHBondContact OG1-NE2 2.77Å; T215-L382 HydrophobicContact CG2-CB 4.02Å; T215-L382 WeakPolarHBondContact CG2-O 3.5Å; T215-Y383 VanDerWaalsContact O-CE1 3.29Å; T215-Y383 WeakPolarHBondContact O-CE1 3.28Å; T215-S386 WeakPolarHBondContact OG1-CB 3.2Å; T215-S386 PolarHBondContact OG1-OG 3.13Å |
| 216 | Y | 97.3 | Very high | 94.3 | Very high | 2 Ų | 2 | 20.3 Ų | 20.3 | 1% | 0.008 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -52.9 | -54.6 | 168.8 | 176.3 | -96.5 | 0 | 0 | 0 | 111.4 | F114 S212 H213 W218 L220 Q253 C321 F325 F326 | F114-Y216 WeakPolarHBondContact CZ-OH 3.46Å; S212-Y216 VanDerWaalsContact O-CB 3.29Å; S212-Y216 WeakPolarHBondContact O-CB 3.43Å; S212-Y216 PolarHBondContact O-N 3.24Å; H213-Y216 PolarHBondContact O-N 2.84Å; Y216-W218 VanDerWaalsContact C-N 3.35Å; Y216-W218 PolarHBondContact O-N 3.3Å; Y216-L220 HydrophobicContact CE1-CD2 3.88Å; Y216-L220 WeakPolarHBondContact O-CB 3.23Å; Y216-L220 PolarHBondContact O-N 3.29Å; Y216-Q253 PolarHBondContact OH-NE2 3.16Å; Y216-C321 HydrophobicContact CD2-CB 4.23Å; Y216-C321 HydrophobicContact CE2-CB 4.4Å; Y216-F325 HydrophobicContact CD1-CE1 4.2Å; Y216-F325 AromaticContact CD1-CZ 3.89Å; Y216-F325 HydrophobicContact CD1-CZ 3.89Å; Y216-F325 HydrophobicContact CD2-CE1 4.25Å; Y216-F325 AromaticContact CG-CE1 3.8Å; Y216-F325 HydrophobicContact CG-CE1 3.8Å; Y216-F325 AromaticContact CG-CZ 3.96Å; Y216-F325 HydrophobicContact CG-CZ 3.96Å; Y216-F326 HydrophobicContact CD1-CE2 4.04Å; Y216-F326 HydrophobicContact CD1-CZ 4.21Å; Y216-F326 AromaticContact CE1-CE2 3.64Å; Y216-F326 HydrophobicContact CE1-CE2 3.64Å; Y216-F326 AromaticContact CE1-CZ 3.73Å; Y216-F326 HydrophobicContact CE1-CZ 3.73Å; Y216-F326 HydrophobicContact CE2-CE2 4.42Å; Y216-F326 AromaticContact CZ-CE2 3.85Å |
| 217 | N | 95.4 | Very high | 93.6 | Very high | 6 Ų | 6 | 20.4 Ų | 20.4 | 3% | 0.032 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -68.1 | -32.5 | -178.7 | -83 | 3.9 | 0 | 0 | 0 | 113 | H213 F214 L220 Y221 A348 | H213-N217 PolarHBondContact NE2-ND2 3.39Å; H213-N217 WeakPolarHBondContact O-CB 3.32Å; H213-N217 PolarHBondContact O-N 3.01Å; F214-N217 PolarHBondContact O-N 2.86Å; N217-L220 PolarHBondContact O-N 3.22Å; N217-Y221 HydrophobicContact CB-CD2 4.05Å; N217-Y221 HydrophobicContact CB-CE2 3.65Å; N217-Y221 WeakPolarHBondContact O-CB 3.47Å; N217-Y221 WeakPolarHBondContact O-CD2 3.18Å; N217-Y221 VanDerWaalsContact O-CG 3.28Å; N217-Y221 PolarHBondContact O-N 3.09Å; N217-A348 HydrophobicContact CB-CB 4.16Å; N217-A348 WeakPolarHBondContact CB-O 3.41Å; N217-A348 VanDerWaalsContact ND2-CB 3.3Å; N217-A348 WeakPolarHBondContact ND2-CB 3.27Å; N217-A348 PolarHBondContact ND2-O 3.49Å |
| 218 | W | 95.4 | Very high | 92.9 | Very high | 25 Ų | 25 | 17.1 Ų | 17.1 | 10% | 0.095 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -55.4 | -57.5 | 175.1 | -179.2 | -75.3 | 0 | 0 | 0 | 111.8 | F214 T215 Y216 L220 Y221 V222 P351 L354 I358 I378 L382 | F214-W218 HydrophobicContact CE1-CE3 4.15Å; F214-W218 HydrophobicContact CZ-CE3 4.17Å; F214-W218 PolarHBondContact O-N 3.22Å; T215-W218 PolarHBondContact O-N 3.46Å; Y216-W218 VanDerWaalsContact C-N 3.35Å; Y216-W218 PolarHBondContact O-N 3.3Å; W218-L220 VanDerWaalsContact C-N 3.35Å; W218-Y221 PolarHBondContact O-N 2.84Å; W218-V222 WeakPolarHBondContact O-CB 3.48Å; W218-V222 VanDerWaalsContact O-CG2 3.25Å; W218-V222 WeakPolarHBondContact O-CG2 3.21Å; W218-V222 PolarHBondContact O-N 3.28Å; W218-P351 VanDerWaalsContact CA-CB 3.41Å; W218-P351 HydrophobicContact CB-CB 3.76Å; W218-P351 HydrophobicContact CB-CG 4.12Å; W218-P351 HydrophobicContact CD2-CB 4.12Å; W218-P351 HydrophobicContact CE3-CB 3.61Å; W218-P351 HydrophobicContact CE3-CG 3.96Å; W218-P351 HydrophobicContact CG-CB 4.24Å; W218-P351 HydrophobicContact CZ3-CB 4.48Å; W218-L354 HydrophobicContact CZ3-CB 4.31Å; W218-I358 HydrophobicContact CH2-CD1 3.73Å; W218-I358 HydrophobicContact CZ2-CD1 4.38Å; W218-I378 HydrophobicContact CZ2-CG2 3.76Å; W218-L382 HydrophobicContact CB-CD1 4.14Å; W218-L382 HydrophobicContact CD2-CD1 3.41Å; W218-L382 VanDerWaalsContact CD2-CD1 3.41Å; W218-L382 HydrophobicContact CE3-CD1 3.99Å; W218-L382 HydrophobicContact CG-CD1 3.43Å; W218-L382 VanDerWaalsContact CG-CD1 3.43Å; W218-L382 HydrophobicContact CZ2-CD1 4.3Å |
| 219 | A | 93.4 | Very high | 92.2 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -67.9 | -37.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | T215 Y221 L223 A379 Y383 | T215-A219 PolarHBondContact O-N 3.07Å; A219-Y221 PolarHBondContact O-N 3.01Å; A219-L223 VanDerWaalsContact O-CB 3.25Å; A219-L223 WeakPolarHBondContact O-CB 3.14Å; A219-L223 WeakPolarHBondContact O-CG 3.36Å; A219-L223 PolarHBondContact O-N 3.18Å; A219-A379 HydrophobicContact CB-CB 4.25Å; A219-Y383 HydrophobicContact CB-CD1 4.42Å; A219-Y383 HydrophobicContact CB-CD2 4.44Å; A219-Y383 HydrophobicContact CB-CE1 3.58Å; A219-Y383 HydrophobicContact CB-CE2 3.56Å; A219-Y383 WeakPolarHBondContact CB-OH 3.21Å |
| 220 | L | 92.6 | Very high | 91.7 | Very high | 26 Ų | 26 | 21.5 Ų | 21.5 | 14% | 0.136 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -57 | -51.4 | 175.7 | 178.7 | 63.2 | 0 | 0 | 0 | 111.5 | F114 Y216 N217 W218 L224 Y250 | F114-L220 HydrophobicContact CE1-CD1 4.1Å; Y216-L220 HydrophobicContact CE1-CD2 3.88Å; Y216-L220 WeakPolarHBondContact O-CB 3.23Å; Y216-L220 PolarHBondContact O-N 3.29Å; N217-L220 PolarHBondContact O-N 3.22Å; W218-L220 VanDerWaalsContact C-N 3.35Å; L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 PolarHBondContact O-N 3.26Å; L220-Y250 HydrophobicContact CD1-CE1 3.97Å |
| 221 | Y | 90.8 | Very high | 91.1 | Very high | 30 Ų | 30 | 21.2 Ų | 21.2 | 12% | 0.118 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -69.6 | -44 | -177.9 | -63.9 | -44.3 | 0 | 0 | 0 | 112.2 | F23 N217 W218 A219 L223 L224 T225 A348 P351 | F23-Y221 HydrophobicContact CE1-CE1 4.27Å; N217-Y221 HydrophobicContact CB-CD2 4.05Å; N217-Y221 HydrophobicContact CB-CE2 3.65Å; N217-Y221 WeakPolarHBondContact O-CB 3.47Å; N217-Y221 WeakPolarHBondContact O-CD2 3.18Å; N217-Y221 VanDerWaalsContact O-CG 3.28Å; N217-Y221 PolarHBondContact O-N 3.09Å; W218-Y221 PolarHBondContact O-N 2.84Å; A219-Y221 PolarHBondContact O-N 3.01Å; Y221-L223 VanDerWaalsContact C-N 3.3Å; Y221-L223 PolarHBondContact O-N 3.48Å; Y221-L224 PolarHBondContact O-N 3.5Å; Y221-T225 PolarHBondContact O-N 2.96Å; Y221-T225 PolarHBondContact O-OG1 3.33Å; Y221-A348 WeakPolarHBondContact CE2-O 3.49Å; Y221-P351 HydrophobicContact CD2-CB 4.35Å |
| 222 | V | 90.6 | Very high | 90.5 | Very high | 2 Ų | 2 | 25.8 Ų | 25.8 | 1% | 0.012 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58 | -44.6 | 176.8 | 167.4 | 0 | 0 | 0 | 0 | 110.9 | W218 G226 V375 | W218-V222 WeakPolarHBondContact O-CB 3.48Å; W218-V222 VanDerWaalsContact O-CG2 3.25Å; W218-V222 WeakPolarHBondContact O-CG2 3.21Å; W218-V222 PolarHBondContact O-N 3.28Å; V222-G226 WeakPolarHBondContact O-CA 3.44Å; V222-G226 PolarHBondContact O-N 2.74Å; V222-V375 HydrophobicContact CG1-CG1 3.58Å |
| 223 | L | 89.9 | Confident | 89.8 | Confident | 4 Ų | 4 | 29.6 Ų | 29.6 | 2% | 0.021 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -72.7 | -41 | 178.1 | -65.3 | 175.3 | 0 | 0 | 0 | 111.3 | A219 Y221 T225 G226 L227 L311 V315 F376 | A219-L223 VanDerWaalsContact O-CB 3.25Å; A219-L223 WeakPolarHBondContact O-CB 3.14Å; A219-L223 WeakPolarHBondContact O-CG 3.36Å; A219-L223 PolarHBondContact O-N 3.18Å; Y221-L223 VanDerWaalsContact C-N 3.3Å; Y221-L223 PolarHBondContact O-N 3.48Å; L223-T225 VanDerWaalsContact C-N 3.34Å; L223-T225 PolarHBondContact O-N 3.49Å; L223-G226 PolarHBondContact O-N 3.34Å; L223-L227 WeakPolarHBondContact O-CA 3.38Å; L223-L227 WeakPolarHBondContact O-CB 3.28Å; L223-L227 PolarHBondContact O-N 2.87Å; L223-L311 HydrophobicContact CD2-CD2 3.91Å; L223-V315 HydrophobicContact CD1-CG2 3.64Å; L223-F376 HydrophobicContact CD2-CD1 4.5Å; L223-F376 HydrophobicContact CD2-CE1 3.98Å |
| 224 | L | 87.3 | Confident | 89.2 | Confident | 58 Ų | 58 | 30.5 Ų | 30.5 | 30% | 0.304 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -60.8 | -42.1 | 179.6 | -170.9 | 70.7 | 0 | 0 | 0 | 112.7 | T117 F121 L220 Y221 Y250 | T117-L224 HydrophobicContact CG2-CD1 4.03Å; F121-L224 HydrophobicContact CE2-CD1 3.96Å; F121-L224 HydrophobicContact CZ-CD1 3.8Å; L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 PolarHBondContact O-N 3.26Å; Y221-L224 PolarHBondContact O-N 3.5Å; L224-Y250 WeakPolarHBondContact CA-OH 3.45Å; L224-Y250 HydrophobicContact CD1-CE1 3.99Å; L224-Y250 HydrophobicContact CD1-CE2 3.94Å; L224-Y250 PolarHBondContact N-OH 3.24Å; L224-Y250 VanDerWaalsContact N-OH 3.15Å |
| 225 | T | 82.8 | Confident | 88.7 | Confident | 66 Ų | 66 | 28.5 Ų | 28.5 | 41% | 0.405 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -83.8 | -35.4 | 177.8 | 59.7 | 0 | 0 | 0 | 0 | 112.6 | Y221 L223 P356 | Y221-T225 PolarHBondContact O-N 2.96Å; Y221-T225 PolarHBondContact O-OG1 3.33Å; L223-T225 VanDerWaalsContact C-N 3.34Å; L223-T225 PolarHBondContact O-N 3.49Å; T225-P356 HydrophobicContact CG2-CG 4.04Å |
| 226 | G | 84.6 | Confident | 88 | Confident | 1 Ų | 1 | 31.5 Ų | 31.5 | 1% | 0.01 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -89.6 | -27.7 | -169.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | V222 L223 L229 Y230 W372 | V222-G226 WeakPolarHBondContact O-CA 3.44Å; V222-G226 PolarHBondContact O-N 2.74Å; L223-G226 PolarHBondContact O-N 3.34Å; G226-L229 WeakPolarHBondContact O-CB 3.26Å; G226-L229 PolarHBondContact O-N 3.33Å; G226-L229 VanDerWaalsContact O-N 3.13Å; G226-Y230 WeakPolarHBondContact O-CB 3.41Å; G226-Y230 PolarHBondContact O-N 3.29Å; G226-W372 WeakPolarHBondContact O-CH2 3.22Å |
| 227 | L | 84.5 | Confident | 87.3 | Confident | 3 Ų | 3 | 34 Ų | 34 | 2% | 0.016 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.4 | -45 | -175.9 | -174 | 70 | 0 | 0 | 0 | 112.8 | L223 L229 Y230 F231 P249 Y250 L311 | L223-L227 WeakPolarHBondContact O-CA 3.38Å; L223-L227 WeakPolarHBondContact O-CB 3.28Å; L223-L227 PolarHBondContact O-N 2.87Å; L227-L229 VanDerWaalsContact C-N 3.26Å; L227-L229 PolarHBondContact O-N 2.93Å; L227-Y230 PolarHBondContact O-N 2.88Å; L227-F231 HydrophobicContact CD1-CD1 4.07Å; L227-F231 HydrophobicContact CD1-CE1 3.51Å; L227-F231 HydrophobicContact CD1-CE2 4.05Å; L227-F231 HydrophobicContact CD1-CZ 3.49Å; L227-F231 VanDerWaalsContact CD1-CZ 3.49Å; L227-F231 HydrophobicContact CD2-CE2 4.24Å; L227-F231 HydrophobicContact CD2-CZ 4.3Å; L227-F231 HydrophobicContact CG-CD2 4.31Å; L227-F231 HydrophobicContact CG-CE1 4.24Å; L227-F231 HydrophobicContact CG-CE2 3.95Å; L227-F231 HydrophobicContact CG-CZ 3.92Å; L227-F231 WeakPolarHBondContact O-CB 3.36Å; L227-F231 PolarHBondContact O-N 3.19Å; L227-P249 HydrophobicContact CD2-CG 4.05Å; L227-Y250 HydrophobicContact CD2-CE2 4.4Å; L227-L311 HydrophobicContact CD1-CB 4.44Å; L227-L311 HydrophobicContact CD1-CD1 3.62Å; L227-L311 HydrophobicContact CD1-CD2 4.4Å; L227-L311 HydrophobicContact CD1-CG 4.36Å |
| 228 | P | 82.3 | Confident | 86.6 | Confident | 37 Ų | 37 | 38.5 Ų | 38.5 | 24% | 0.24 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.9 | -34.2 | 176.4 | -22.5 | 34.9 | 0 | 0 | 0 | 112.8 | K232 N242 | P228-K232 VanDerWaalsContact O-CB 3.28Å; P228-K232 WeakPolarHBondContact O-CB 3.45Å; P228-K232 PolarHBondContact O-N 2.99Å; P228-N242 PolarHBondContact O-ND2 3.17Å |
| 229 | L | 83.8 | Confident | 85.4 | Confident | 90 Ų | 90 | 44.3 Ų | 44.3 | 47% | 0.471 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -71 | -40.9 | 176.7 | -67.1 | 172.2 | 0 | 0 | 0 | 111.4 | G226 L227 N233 W372 | G226-L229 WeakPolarHBondContact O-CB 3.26Å; G226-L229 PolarHBondContact O-N 3.33Å; G226-L229 VanDerWaalsContact O-N 3.13Å; L227-L229 VanDerWaalsContact C-N 3.26Å; L227-L229 PolarHBondContact O-N 2.93Å; L229-N233 WeakPolarHBondContact O-CB 3.43Å; L229-N233 PolarHBondContact O-N 3.44Å; L229-W372 HydrophobicContact CB-CZ2 4.3Å |
| 230 | Y | 87.2 | Confident | 84.4 | Confident | 2 Ų | 2 | 51.7 Ų | 51.7 | 1% | 0.008 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63.4 | -47.5 | 175.5 | -180 | -109.6 | 0 | 0 | 0 | 111.3 | G226 L227 K232 V234 L235 V297 A307 L311 W372 F376 | G226-Y230 WeakPolarHBondContact O-CB 3.41Å; G226-Y230 PolarHBondContact O-N 3.29Å; L227-Y230 PolarHBondContact O-N 2.88Å; Y230-K232 PolarHBondContact O-N 3.25Å; Y230-V234 HydrophobicContact CD2-CB 3.8Å; Y230-V234 HydrophobicContact CD2-CG1 4.22Å; Y230-V234 HydrophobicContact CD2-CG2 3.71Å; Y230-V234 HydrophobicContact CE2-CB 3.87Å; Y230-V234 HydrophobicContact CE2-CG1 3.76Å; Y230-V234 HydrophobicContact CE2-CG2 4.08Å; Y230-V234 WeakPolarHBondContact O-CA 3.45Å; Y230-V234 VanDerWaalsContact O-CB 3.28Å; Y230-V234 WeakPolarHBondContact O-CB 3.27Å; Y230-V234 PolarHBondContact O-N 2.99Å; Y230-L235 HydrophobicContact CD1-CD1 4.22Å; Y230-L235 HydrophobicContact CD1-CG 4.34Å; Y230-L235 HydrophobicContact CE1-CD1 3.77Å; Y230-L235 HydrophobicContact CE1-CD2 4.22Å; Y230-L235 HydrophobicContact CE1-CG 3.92Å; Y230-L235 PolarHBondContact O-N 3Å; Y230-L235 VanDerWaalsContact O-N 3.1Å; Y230-V297 HydrophobicContact CE1-CG1 4.24Å; Y230-A307 HydrophobicContact CE1-CB 4.33Å; Y230-L311 HydrophobicContact CD1-CD1 3.96Å; Y230-L311 HydrophobicContact CE1-CD1 3.81Å; Y230-W372 HydrophobicContact CD2-CB 4.04Å; Y230-W372 AromaticContact CD2-CD1 3.83Å; Y230-W372 AromaticContact CD2-CD2 3.55Å; Y230-W372 HydrophobicContact CD2-CD2 3.55Å; Y230-W372 AromaticContact CD2-CE2 3.87Å; Y230-W372 HydrophobicContact CD2-CE3 4.06Å; Y230-W372 AromaticContact CD2-CG 3.52Å; Y230-W372 HydrophobicContact CD2-CG 3.52Å; Y230-W372 AromaticContact CD2-NE1 3.98Å; Y230-W372 HydrophobicContact CE2-CB 3.96Å; Y230-W372 HydrophobicContact CE2-CD2 4.35Å; Y230-W372 AromaticContact CE2-CG 3.94Å; Y230-W372 HydrophobicContact CE2-CG 3.94Å; Y230-W372 HydrophobicContact CG-CD2 4.25Å; Y230-W372 HydrophobicContact CG-CE3 4.45Å; Y230-F376 HydrophobicContact CD1-CZ 4.32Å; Y230-F376 HydrophobicContact CD2-CE2 4.34Å; Y230-F376 HydrophobicContact CD2-CZ 4.11Å; Y230-F376 HydrophobicContact CE1-CZ 4.27Å; Y230-F376 AromaticContact CE2-CE2 3.88Å; Y230-F376 HydrophobicContact CE2-CE2 3.88Å; Y230-F376 HydrophobicContact CE2-CZ 4.05Å; Y230-F376 HydrophobicContact CG-CZ 4.25Å; Y230-F376 AromaticContact CZ-CE2 4Å |
| 231 | F | 86.5 | Confident | 83.6 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 178.7 | -75.8 | 0.9 | 0 | 0 | 0 | 112.9 | L227 L235 G236 F237 N242 L245 V308 L311 | L227-F231 HydrophobicContact CD1-CD1 4.07Å; L227-F231 HydrophobicContact CD1-CE1 3.51Å; L227-F231 HydrophobicContact CD1-CE2 4.05Å; L227-F231 HydrophobicContact CD1-CZ 3.49Å; L227-F231 VanDerWaalsContact CD1-CZ 3.49Å; L227-F231 HydrophobicContact CD2-CE2 4.24Å; L227-F231 HydrophobicContact CD2-CZ 4.3Å; L227-F231 HydrophobicContact CG-CD2 4.31Å; L227-F231 HydrophobicContact CG-CE1 4.24Å; L227-F231 HydrophobicContact CG-CE2 3.95Å; L227-F231 HydrophobicContact CG-CZ 3.92Å; L227-F231 WeakPolarHBondContact O-CB 3.36Å; L227-F231 PolarHBondContact O-N 3.19Å; F231-L235 HydrophobicContact CD1-CD1 3.6Å; F231-L235 HydrophobicContact CD1-CG 4.43Å; F231-L235 HydrophobicContact CE1-CD1 3.88Å; F231-L235 CarbonylContact O-C 3.49Å; F231-G236 PolarHBondContact O-N 3.13Å; F231-G236 VanDerWaalsContact O-N 3.1Å; F231-F237 HydrophobicContact CB-CD2 4.08Å; F231-F237 HydrophobicContact CG-CD2 4.26Å; F231-F237 PolarHBondContact O-N 3Å; F231-N242 VanDerWaalsContact CB-OD1 3.31Å; F231-N242 WeakPolarHBondContact CB-OD1 3.38Å; F231-N242 WeakPolarHBondContact CD2-OD1 3.34Å; F231-L245 HydrophobicContact CD2-CB 3.98Å; F231-L245 HydrophobicContact CE2-CB 3.74Å; F231-V308 HydrophobicContact CE1-CG2 3.9Å; F231-V308 HydrophobicContact CE2-CG2 4.39Å; F231-V308 HydrophobicContact CZ-CB 4.46Å; F231-V308 HydrophobicContact CZ-CG2 3.73Å; F231-L311 HydrophobicContact CE1-CD1 3.73Å; F231-L311 HydrophobicContact CZ-CD1 4.29Å |
| 232 | K | 84.3 | Confident | 83 | Confident | 126 Ų | 126 | 51.2 Ų | 51.2 | 55% | 0.548 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -72.8 | -55.7 | 177.7 | -175.8 | 179.8 | 177.5 | 179.4 | 0 | 112.2 | P228 Y230 G236 | P228-K232 VanDerWaalsContact O-CB 3.28Å; P228-K232 WeakPolarHBondContact O-CB 3.45Å; P228-K232 PolarHBondContact O-N 2.99Å; Y230-K232 PolarHBondContact O-N 3.25Å; K232-G236 WeakPolarHBondContact O-CA 3.47Å; K232-G236 PolarHBondContact O-N 3.48Å |
| 233 | N | 84.4 | Confident | 82.4 | Confident | 80 Ų | 80 | 52.4 Ų | 52.4 | 43% | 0.428 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -87.6 | -25.1 | -165.1 | -60 | -16.6 | 0 | 0 | 0 | 113.4 | L229 P367 | L229-N233 WeakPolarHBondContact O-CB 3.43Å; L229-N233 PolarHBondContact O-N 3.44Å; N233-P367 HydrophobicContact CB-CB 3.96Å; N233-P367 HydrophobicContact CB-CG 3.59Å |
| 234 | V | 84.7 | Confident | 82.1 | Confident | 22 Ų | 22 | 56.1 Ų | 56.1 | 13% | 0.133 | 32% | 0.315 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.2 | -47.1 | -178.3 | -173.1 | 0 | 0 | 0 | 0 | 111.2 | Y230 P367 F369 W372 | Y230-V234 HydrophobicContact CD2-CB 3.8Å; Y230-V234 HydrophobicContact CD2-CG1 4.22Å; Y230-V234 HydrophobicContact CD2-CG2 3.71Å; Y230-V234 HydrophobicContact CE2-CB 3.87Å; Y230-V234 HydrophobicContact CE2-CG1 3.76Å; Y230-V234 HydrophobicContact CE2-CG2 4.08Å; Y230-V234 WeakPolarHBondContact O-CA 3.45Å; Y230-V234 VanDerWaalsContact O-CB 3.28Å; Y230-V234 WeakPolarHBondContact O-CB 3.27Å; Y230-V234 PolarHBondContact O-N 2.99Å; V234-P367 HydrophobicContact CG2-CB 4.26Å; V234-F369 HydrophobicContact CG1-CD1 3.53Å; V234-F369 HydrophobicContact CG1-CD2 4.22Å; V234-F369 HydrophobicContact CG1-CE1 3.38Å; V234-F369 HydrophobicContact CG1-CE2 4.1Å; V234-F369 HydrophobicContact CG1-CG 3.94Å; V234-F369 HydrophobicContact CG1-CZ 3.68Å; V234-W372 VanDerWaalsContact CG2-CD1 3.46Å; V234-W372 HydrophobicContact CG2-CG 4.38Å |
| 235 | L | 86.8 | Confident | 82.1 | Confident | 17 Ų | 17 | 55 Ų | 55 | 9% | 0.089 | 31% | 0.309 | C | S | . | . | S | Bend | trans | -88.4 | -10.5 | -178.7 | -56.4 | -173.3 | 0 | 0 | 0 | 114 | Y230 F231 F237 A307 V308 F369 | Y230-L235 HydrophobicContact CD1-CD1 4.22Å; Y230-L235 HydrophobicContact CD1-CG 4.34Å; Y230-L235 HydrophobicContact CE1-CD1 3.77Å; Y230-L235 HydrophobicContact CE1-CD2 4.22Å; Y230-L235 HydrophobicContact CE1-CG 3.92Å; Y230-L235 PolarHBondContact O-N 3Å; Y230-L235 VanDerWaalsContact O-N 3.1Å; F231-L235 HydrophobicContact CD1-CD1 3.6Å; F231-L235 HydrophobicContact CD1-CG 4.43Å; F231-L235 HydrophobicContact CE1-CD1 3.88Å; F231-L235 CarbonylContact O-C 3.49Å; L235-F237 HydrophobicContact CB-CD2 3.63Å; L235-F237 HydrophobicContact CB-CE2 3.68Å; L235-F237 HydrophobicContact CD1-CD2 4.2Å; L235-F237 HydrophobicContact CD1-CE2 3.72Å; L235-F237 HydrophobicContact CG-CE2 4.37Å; L235-F237 PolarHBondContact O-N 2.92Å; L235-A307 HydrophobicContact CD1-CB 3.9Å; L235-A307 HydrophobicContact CD2-CB 4.29Å; L235-V308 HydrophobicContact CD1-CG2 4.42Å; L235-F369 HydrophobicContact CD2-CE1 3.98Å; L235-F369 HydrophobicContact CD2-CZ 4.38Å |
| 236 | G | 83 | Confident | 82.3 | Confident | 64 Ų | 64 | 51.9 Ų | 51.9 | 66% | 0.66 | 29% | 0.29 | S | S | * | . | trans | 72.4 | 20.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | F231 K232 | F231-G236 PolarHBondContact O-N 3.13Å; F231-G236 VanDerWaalsContact O-N 3.1Å; K232-G236 WeakPolarHBondContact O-CA 3.47Å; K232-G236 PolarHBondContact O-N 3.48Å | ||
| 237 | F | 83.5 | Confident | 82.6 | Confident | 54 Ų | 54 | 52.2 Ų | 52.2 | 24% | 0.237 | 29% | 0.292 | C | S | . | . | trans | -73.6 | 141 | 177.5 | -70.6 | -61.2 | 0 | 0 | 0 | 112 | F231 L235 L245 V308 | F231-F237 HydrophobicContact CB-CD2 4.08Å; F231-F237 HydrophobicContact CG-CD2 4.26Å; F231-F237 PolarHBondContact O-N 3Å; L235-F237 HydrophobicContact CB-CD2 3.63Å; L235-F237 HydrophobicContact CB-CE2 3.68Å; L235-F237 HydrophobicContact CD1-CD2 4.2Å; L235-F237 HydrophobicContact CD1-CE2 3.72Å; L235-F237 HydrophobicContact CG-CE2 4.37Å; L235-F237 PolarHBondContact O-N 2.92Å; F237-L245 HydrophobicContact CB-CD1 4.49Å; F237-L245 HydrophobicContact CD1-CD1 3.74Å; F237-L245 HydrophobicContact CD2-CD1 3.86Å; F237-L245 HydrophobicContact CE1-CD1 3.8Å; F237-L245 HydrophobicContact CE2-CD1 3.9Å; F237-L245 HydrophobicContact CG-CD1 3.78Å; F237-L245 HydrophobicContact CZ-CD1 3.88Å; F237-V308 HydrophobicContact CE2-CG2 4.02Å; F237-V308 HydrophobicContact CZ-CG2 4.44Å | ||
| 238 | D | 80.4 | Confident | 83 | Confident | 101 Ų | 101 | 54.9 Ų | 54.9 | 54% | 0.54 | 31% | 0.306 | S | S | . | . | trans | -71 | 167.7 | 175.3 | 78.9 | -17 | 0 | 0 | 0 | 111.9 | K240 S241 N242 | D238-K240 VanDerWaalsContact C-N 3.33Å; D238-K240 PolarHBondContact O-N 3.16Å; D238-S241 PolarHBondContact N-OG 3.27Å; D238-S241 PolarHBondContact O-OG 3.35Å; D238-S241 WeakPolarHBondContact OD1-CA 3.48Å; D238-S241 WeakPolarHBondContact OD1-CB 3.3Å; D238-S241 PolarHBondContact OD1-N 2.98Å; D238-S241 PolarHBondContact OD1-OG 2.97Å; D238-N242 WeakPolarHBondContact O-CB 3.41Å; D238-N242 PolarHBondContact O-N 2.87Å | ||
| 239 | L | 69.6 | Low | 83.5 | Confident | 147 Ų | 147 | 53.1 Ų | 53.1 | 77% | 0.77 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -60.4 | -40.3 | -174.9 | -174.7 | 64.9 | 0 | 0 | 0 | 113.1 | N242 G243 | L239-N242 PolarHBondContact O-N 3.49Å; L239-G243 PolarHBondContact O-N 3.28Å |
| 240 | K | 72.3 | Confident | 84.1 | Confident | 156 Ų | 156 | 49 Ų | 49 | 68% | 0.678 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -71.5 | -46.7 | -176.3 | -172.1 | 176.6 | -179.5 | 178.6 | 0 | 111.6 | D238 N242 V244 | D238-K240 VanDerWaalsContact C-N 3.33Å; D238-K240 PolarHBondContact O-N 3.16Å; K240-N242 VanDerWaalsContact C-N 3.29Å; K240-V244 PolarHBondContact O-N 2.71Å |
| 241 | S | 76.5 | Confident | 84.5 | Confident | 37 Ų | 37 | 52.6 Ų | 52.6 | 26% | 0.259 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.9 | -36.6 | 172.8 | 66.3 | 0 | 0 | 0 | 0 | 110.8 | D238 G243 V244 L245 | D238-S241 PolarHBondContact N-OG 3.27Å; D238-S241 PolarHBondContact O-OG 3.35Å; D238-S241 WeakPolarHBondContact OD1-CA 3.48Å; D238-S241 WeakPolarHBondContact OD1-CB 3.3Å; D238-S241 PolarHBondContact OD1-N 2.98Å; D238-S241 PolarHBondContact OD1-OG 2.97Å; S241-G243 PolarHBondContact O-N 3.12Å; S241-V244 PolarHBondContact O-N 3.39Å; S241-L245 WeakPolarHBondContact O-CB 3.49Å; S241-L245 WeakPolarHBondContact O-CG 3.18Å; S241-L245 PolarHBondContact O-N 3.33Å |
| 242 | N | 78.3 | Confident | 85 | Confident | 9 Ų | 9 | 54.7 Ų | 54.7 | 5% | 0.048 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.6 | -45.3 | 177.8 | -172.4 | 13.8 | 0 | 0 | 0 | 112.4 | P228 F231 D238 L239 K240 V244 L245 S246 | P228-N242 PolarHBondContact O-ND2 3.17Å; F231-N242 VanDerWaalsContact CB-OD1 3.31Å; F231-N242 WeakPolarHBondContact CB-OD1 3.38Å; F231-N242 WeakPolarHBondContact CD2-OD1 3.34Å; D238-N242 WeakPolarHBondContact O-CB 3.41Å; D238-N242 PolarHBondContact O-N 2.87Å; L239-N242 PolarHBondContact O-N 3.49Å; K240-N242 VanDerWaalsContact C-N 3.29Å; N242-V244 PolarHBondContact O-N 3.28Å; N242-L245 PolarHBondContact O-N 3.42Å; N242-S246 WeakPolarHBondContact O-CB 3.23Å; N242-S246 PolarHBondContact O-N 3.49Å; N242-S246 PolarHBondContact O-OG 3Å; N242-S246 PolarHBondContact OD1-OG 2.96Å |
| 243 | G | 77.2 | Confident | 85.6 | Confident | 26 Ų | 26 | 48.7 Ų | 48.7 | 27% | 0.268 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L239 S241 S247 | L239-G243 PolarHBondContact O-N 3.28Å; S241-G243 PolarHBondContact O-N 3.12Å; G243-S247 PolarHBondContact O-N 3.21Å |
| 244 | V | 85.3 | Confident | 86.1 | Confident | 82 Ų | 82 | 45 Ų | 45 | 50% | 0.497 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -67.4 | -50.2 | 177.2 | 176.9 | 0 | 0 | 0 | 0 | 111.1 | K240 S241 N242 S246 S247 I248 | K240-V244 PolarHBondContact O-N 2.71Å; S241-V244 PolarHBondContact O-N 3.39Å; N242-V244 PolarHBondContact O-N 3.28Å; V244-S246 VanDerWaalsContact C-N 3.35Å; V244-S246 PolarHBondContact O-N 3.49Å; V244-S247 WeakPolarHBondContact O-CB 3.48Å; V244-S247 PolarHBondContact O-N 2.65Å; V244-S247 VanDerWaalsContact O-N 3.11Å; V244-S247 PolarHBondContact O-OG 3.05Å; V244-I248 PolarHBondContact O-N 2.82Å |
| 245 | L | 86.5 | Confident | 86.7 | Confident | 34 Ų | 34 | 49.2 Ų | 49.2 | 18% | 0.178 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.7 | -40 | -179.4 | -69.9 | 171.4 | 0 | 0 | 0 | 111.8 | F231 F237 S241 N242 S247 I248 P249 V308 | F231-L245 HydrophobicContact CD2-CB 3.98Å; F231-L245 HydrophobicContact CE2-CB 3.74Å; F237-L245 HydrophobicContact CB-CD1 4.49Å; F237-L245 HydrophobicContact CD1-CD1 3.74Å; F237-L245 HydrophobicContact CD2-CD1 3.86Å; F237-L245 HydrophobicContact CE1-CD1 3.8Å; F237-L245 HydrophobicContact CE2-CD1 3.9Å; F237-L245 HydrophobicContact CG-CD1 3.78Å; F237-L245 HydrophobicContact CZ-CD1 3.88Å; S241-L245 WeakPolarHBondContact O-CB 3.49Å; S241-L245 WeakPolarHBondContact O-CG 3.18Å; S241-L245 PolarHBondContact O-N 3.33Å; N242-L245 PolarHBondContact O-N 3.42Å; L245-S247 PolarHBondContact O-N 3.08Å; L245-I248 HydrophobicContact CD2-CD1 4.12Å; L245-I248 PolarHBondContact O-N 3.44Å; L245-P249 WeakPolarHBondContact O-CD 3.08Å; L245-V308 HydrophobicContact CD2-CG1 4.24Å |
| 246 | S | 87.3 | Confident | 87.2 | Confident | 2 Ų | 2 | 50 Ų | 50 | 1% | 0.014 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.7 | -24.3 | 176.8 | -67.1 | 0 | 0 | 0 | 0 | 112.5 | N242 V244 Y250 | N242-S246 WeakPolarHBondContact O-CB 3.23Å; N242-S246 PolarHBondContact O-N 3.49Å; N242-S246 PolarHBondContact O-OG 3Å; N242-S246 PolarHBondContact OD1-OG 2.96Å; V244-S246 VanDerWaalsContact C-N 3.35Å; V244-S246 PolarHBondContact O-N 3.49Å; S246-Y250 WeakPolarHBondContact O-CD2 2.88Å; S246-Y250 WeakPolarHBondContact O-CE2 3.44Å |
| 247 | S | 89.6 | Confident | 87.9 | Confident | 7 Ų | 7 | 47 Ų | 47 | 5% | 0.049 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -76.8 | -27.6 | 176.3 | 78.4 | 0 | 0 | 0 | 0 | 113.5 | G243 V244 L245 Y250 L251 | G243-S247 PolarHBondContact O-N 3.21Å; V244-S247 WeakPolarHBondContact O-CB 3.48Å; V244-S247 PolarHBondContact O-N 2.65Å; V244-S247 VanDerWaalsContact O-N 3.11Å; V244-S247 PolarHBondContact O-OG 3.05Å; L245-S247 PolarHBondContact O-N 3.08Å; S247-Y250 PolarHBondContact O-N 2.89Å; S247-L251 PolarHBondContact O-N 3.46Å |
| 248 | I | 92.9 | Very high | 88.4 | Confident | 60 Ų | 60 | 45.7 Ų | 45.7 | 31% | 0.308 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -58.6 | -49.1 | -175.3 | -66.2 | 170 | 0 | 0 | 0 | 112.5 | V244 L245 Y250 L251 V252 T312 | V244-I248 PolarHBondContact O-N 2.82Å; L245-I248 HydrophobicContact CD2-CD1 4.12Å; L245-I248 PolarHBondContact O-N 3.44Å; I248-Y250 VanDerWaalsContact C-N 3.28Å; I248-Y250 PolarHBondContact O-N 3.37Å; I248-L251 PolarHBondContact O-N 3.06Å; I248-V252 HydrophobicContact CG2-CG2 4.46Å; I248-V252 WeakPolarHBondContact O-CG2 3.47Å; I248-V252 PolarHBondContact O-N 3.15Å; I248-T312 HydrophobicContact CG2-CG2 3.75Å |
| 249 | P | 94.1 | Very high | 89.1 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -55.1 | -41.6 | 178.6 | -26.6 | 33.9 | 0 | 0 | 0 | 113.5 | L227 L245 V252 Q253 V315 | L227-P249 HydrophobicContact CD2-CG 4.05Å; L245-P249 WeakPolarHBondContact O-CD 3.08Å; P249-V252 PolarHBondContact O-N 3.26Å; P249-Q253 WeakPolarHBondContact O-CB 3.33Å; P249-Q253 PolarHBondContact O-N 3.42Å; P249-V315 HydrophobicContact CB-CB 3.64Å; P249-V315 HydrophobicContact CB-CG1 3.92Å; P249-V315 HydrophobicContact CB-CG2 3.88Å |
| 250 | Y | 94.8 | Very high | 90.4 | Very high | 2 Ų | 2 | 36.3 Ų | 36.3 | 1% | 0.008 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -75.7 | -31.8 | 179.9 | -58.7 | -70.6 | 0 | 0 | 0 | 112.8 | F114 T117 F121 L220 L224 L227 S246 S247 I248 Q253 A254 V315 | F114-Y250 HydrophobicContact CD1-CD1 4.14Å; T117-Y250 HydrophobicContact CG2-CD2 4.22Å; T117-Y250 HydrophobicContact CG2-CG 4.1Å; F121-Y250 HydrophobicContact CD2-CD2 4.45Å; F121-Y250 AromaticContact CE2-CD2 3.9Å; F121-Y250 HydrophobicContact CE2-CD2 3.9Å; F121-Y250 AromaticContact CE2-CE2 3.92Å; F121-Y250 HydrophobicContact CE2-CE2 3.92Å; L220-Y250 HydrophobicContact CD1-CE1 3.97Å; L224-Y250 WeakPolarHBondContact CA-OH 3.45Å; L224-Y250 HydrophobicContact CD1-CE1 3.99Å; L224-Y250 HydrophobicContact CD1-CE2 3.94Å; L224-Y250 PolarHBondContact N-OH 3.24Å; L224-Y250 VanDerWaalsContact N-OH 3.15Å; L227-Y250 HydrophobicContact CD2-CE2 4.4Å; S246-Y250 WeakPolarHBondContact O-CD2 2.88Å; S246-Y250 WeakPolarHBondContact O-CE2 3.44Å; S247-Y250 PolarHBondContact O-N 2.89Å; I248-Y250 VanDerWaalsContact C-N 3.28Å; I248-Y250 PolarHBondContact O-N 3.37Å; Y250-Q253 PolarHBondContact O-N 2.91Å; Y250-A254 WeakPolarHBondContact O-CB 3.36Å; Y250-A254 PolarHBondContact O-N 3.32Å; Y250-V315 HydrophobicContact CD1-CG1 3.76Å; Y250-V315 HydrophobicContact CE1-CG1 3.75Å; Y250-V315 HydrophobicContact CG-CG1 4.46Å |
| 251 | L | 95.7 | Very high | 91.4 | Very high | 79 Ų | 79 | 28.9 Ų | 28.9 | 41% | 0.414 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -63 | -46.5 | 171.5 | 179.8 | 60.5 | 0 | 0 | 0 | 110.8 | V118 S247 I248 Q253 A254 L255 | V118-L251 HydrophobicContact CG2-CB 3.85Å; S247-L251 PolarHBondContact O-N 3.46Å; I248-L251 PolarHBondContact O-N 3.06Å; L251-Q253 VanDerWaalsContact C-N 3.29Å; L251-Q253 PolarHBondContact O-N 3.48Å; L251-A254 WeakPolarHBondContact O-CB 3.32Å; L251-A254 PolarHBondContact O-N 3.49Å; L251-L255 HydrophobicContact CG-CD1 4.49Å; L251-L255 WeakPolarHBondContact O-CG 3.29Å; L251-L255 PolarHBondContact O-N 3.2Å; L251-L255 VanDerWaalsContact O-N 3.1Å |
| 252 | V | 97.2 | Very high | 92.2 | Very high | 43 Ų | 43 | 31.6 Ų | 31.6 | 26% | 0.261 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -63.5 | -38.9 | 176.5 | 177.7 | 0 | 0 | 0 | 0 | 110.8 | I248 P249 L255 I256 T312 | I248-V252 HydrophobicContact CG2-CG2 4.46Å; I248-V252 WeakPolarHBondContact O-CG2 3.47Å; I248-V252 PolarHBondContact O-N 3.15Å; P249-V252 PolarHBondContact O-N 3.26Å; V252-L255 PolarHBondContact O-N 3.4Å; V252-I256 HydrophobicContact CG1-CD1 3.73Å; V252-I256 HydrophobicContact CG1-CG1 4.28Å; V252-I256 WeakPolarHBondContact O-CB 3.28Å; V252-I256 WeakPolarHBondContact O-CG1 3.41Å; V252-I256 PolarHBondContact O-N 3.34Å; V252-T312 HydrophobicContact CB-CG2 4.04Å; V252-T312 HydrophobicContact CG1-CG2 4.43Å; V252-T312 HydrophobicContact CG2-CG2 3.57Å |
| 253 | Q | 96.9 | Very high | 93 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.3 | -44.7 | 175.3 | -173.7 | 177.5 | 19.2 | 0 | 0 | 112.2 | F114 Y216 P249 Y250 L251 L255 I256 Q257 V315 S318 | F114-Q253 HydrophobicContact CD1-CG 4.35Å; F114-Q253 HydrophobicContact CD2-CG 4.16Å; F114-Q253 VanDerWaalsContact CE1-CD 3.49Å; F114-Q253 HydrophobicContact CE1-CG 4.46Å; F114-Q253 HydrophobicContact CE2-CG 4.28Å; F114-Q253 HydrophobicContact CG-CG 4.22Å; F114-Q253 HydrophobicContact CZ-CG 4.45Å; Y216-Q253 PolarHBondContact OH-NE2 3.16Å; P249-Q253 WeakPolarHBondContact O-CB 3.33Å; P249-Q253 PolarHBondContact O-N 3.42Å; Y250-Q253 PolarHBondContact O-N 2.91Å; L251-Q253 VanDerWaalsContact C-N 3.29Å; L251-Q253 PolarHBondContact O-N 3.48Å; Q253-L255 PolarHBondContact O-N 3.36Å; Q253-I256 PolarHBondContact O-N 2.83Å; Q253-Q257 WeakPolarHBondContact O-CB 3.27Å; Q253-Q257 PolarHBondContact O-N 3.34Å; Q253-V315 HydrophobicContact CB-CG1 4.11Å; Q253-V315 WeakPolarHBondContact CB-O 3.46Å; Q253-V315 HydrophobicContact CG-CG1 4.49Å; Q253-V315 WeakPolarHBondContact CG-O 3.4Å; Q253-S318 PolarHBondContact NE2-OG 3.21Å |
| 254 | A | 96 | Very high | 93.9 | Very high | 2 Ų | 2 | 33.5 Ų | 33.5 | 2% | 0.017 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -56.5 | -50.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111 | F114 I115 Y250 L251 Q257 S258 | F114-A254 HydrophobicContact CB-CB 3.78Å; I115-A254 HydrophobicContact CG1-CB 3.78Å; Y250-A254 WeakPolarHBondContact O-CB 3.36Å; Y250-A254 PolarHBondContact O-N 3.32Å; L251-A254 WeakPolarHBondContact O-CB 3.32Å; L251-A254 PolarHBondContact O-N 3.49Å; A254-Q257 PolarHBondContact O-N 3.45Å; A254-S258 PolarHBondContact O-N 2.91Å; A254-S258 PolarHBondContact O-OG 2.63Å |
| 255 | L | 96.9 | Very high | 94.2 | Very high | 112 Ų | 112 | 29.6 Ų | 29.6 | 59% | 0.586 | 17% | 0.167 | S | C | * | . | H | α-helix | trans | -62.4 | -47.3 | -178.5 | -65.9 | 173.9 | 0 | 0 | 0 | 112.3 | L251 V252 Q253 Q257 S258 A259 | L251-L255 HydrophobicContact CG-CD1 4.49Å; L251-L255 WeakPolarHBondContact O-CG 3.29Å; L251-L255 PolarHBondContact O-N 3.2Å; L251-L255 VanDerWaalsContact O-N 3.1Å; V252-L255 PolarHBondContact O-N 3.4Å; Q253-L255 PolarHBondContact O-N 3.36Å; L255-Q257 VanDerWaalsContact C-N 3.33Å; L255-Q257 PolarHBondContact O-N 3.29Å; L255-S258 PolarHBondContact O-N 3.38Å; L255-A259 PolarHBondContact O-N 2.87Å; L255-A259 VanDerWaalsContact O-N 3.12Å |
| 256 | I | 97.6 | Very high | 94.5 | Very high | 33 Ų | 33 | 30.3 Ų | 30.3 | 17% | 0.169 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -64.1 | -40.7 | 178 | -70.4 | 177.3 | 0 | 0 | 0 | 110.3 | V252 Q253 A259 A260 F317 L320 | V252-I256 HydrophobicContact CG1-CD1 3.73Å; V252-I256 HydrophobicContact CG1-CG1 4.28Å; V252-I256 WeakPolarHBondContact O-CB 3.28Å; V252-I256 WeakPolarHBondContact O-CG1 3.41Å; V252-I256 PolarHBondContact O-N 3.34Å; Q253-I256 PolarHBondContact O-N 2.83Å; I256-A259 CarbonylContact O-C 3.5Å; I256-A259 PolarHBondContact O-N 2.91Å; I256-A260 VanDerWaalsContact O-CB 3.31Å; I256-A260 WeakPolarHBondContact O-CB 3.4Å; I256-A260 PolarHBondContact O-N 3.39Å; I256-F317 HydrophobicContact CD1-CD1 4.31Å; I256-F317 HydrophobicContact CD1-CD2 4.28Å; I256-F317 HydrophobicContact CD1-CE1 4.42Å; I256-F317 HydrophobicContact CD1-CE2 4.38Å; I256-F317 HydrophobicContact CD1-CG 4.25Å; I256-F317 HydrophobicContact CD1-CZ 4.46Å; I256-L320 HydrophobicContact CG2-CD2 3.92Å; I256-L320 HydrophobicContact CG2-CG 4.01Å |
| 257 | Q | 96.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67.7 | -40.7 | 179.4 | -171 | 171.7 | 44.4 | 0 | 0 | 112.7 | S107 Q253 A254 L255 A259 A260 G319 | S107-Q257 WeakPolarHBondContact CB-O 3.26Å; Q253-Q257 WeakPolarHBondContact O-CB 3.27Å; Q253-Q257 PolarHBondContact O-N 3.34Å; A254-Q257 PolarHBondContact O-N 3.45Å; L255-Q257 VanDerWaalsContact C-N 3.33Å; L255-Q257 PolarHBondContact O-N 3.29Å; Q257-A259 VanDerWaalsContact C-N 3.25Å; Q257-A259 PolarHBondContact O-N 3.43Å; Q257-A260 WeakPolarHBondContact O-CB 3.43Å; Q257-A260 PolarHBondContact O-N 3.45Å; Q257-G319 WeakPolarHBondContact CA-O 3.18Å; Q257-G319 WeakPolarHBondContact CG-O 3.47Å |
| 258 | S | 94.8 | Very high | 95 | Very high | 28 Ų | 28 | 33.4 Ų | 33.4 | 20% | 0.196 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -59.8 | -39.5 | 173.5 | -51.7 | 0 | 0 | 0 | 0 | 111.2 | S111 A254 L255 | S111-S258 VanDerWaalsContact CB-OG 3.26Å; S111-S258 WeakPolarHBondContact CB-OG 3.47Å; S111-S258 PolarHBondContact OG-OG 3.43Å; A254-S258 PolarHBondContact O-N 2.91Å; A254-S258 PolarHBondContact O-OG 2.63Å; L255-S258 PolarHBondContact O-N 3.38Å |
| 259 | A | 95.8 | Very high | 94.9 | Very high | 50 Ų | 50 | 34.5 Ų | 34.5 | 41% | 0.413 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -72.8 | -33.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L255 I256 Q257 G261 Q262 V263 | L255-A259 PolarHBondContact O-N 2.87Å; L255-A259 VanDerWaalsContact O-N 3.12Å; I256-A259 CarbonylContact O-C 3.5Å; I256-A259 PolarHBondContact O-N 2.91Å; Q257-A259 VanDerWaalsContact C-N 3.25Å; Q257-A259 PolarHBondContact O-N 3.43Å; A259-G261 VanDerWaalsContact C-N 3.32Å; A259-G261 PolarHBondContact O-N 2.94Å; A259-Q262 WeakPolarHBondContact O-CB 3.23Å; A259-Q262 PolarHBondContact O-N 2.85Å; A259-V263 WeakPolarHBondContact O-CG2 3.3Å; A259-V263 PolarHBondContact O-N 3.09Å |
| 260 | A | 96.2 | Very high | 94.8 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.008 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -56.4 | -44 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | I256 Q257 Q262 V263 A264 M282 L320 | I256-A260 VanDerWaalsContact O-CB 3.31Å; I256-A260 WeakPolarHBondContact O-CB 3.4Å; I256-A260 PolarHBondContact O-N 3.39Å; Q257-A260 WeakPolarHBondContact O-CB 3.43Å; Q257-A260 PolarHBondContact O-N 3.45Å; A260-Q262 PolarHBondContact O-N 3.33Å; A260-V263 PolarHBondContact O-N 3.22Å; A260-A264 VanDerWaalsContact O-CB 3.3Å; A260-A264 WeakPolarHBondContact O-CB 3.49Å; A260-A264 PolarHBondContact O-N 3.44Å; A260-M282 HydrophobicContact CB-CE 3.46Å; A260-M282 VanDerWaalsContact CB-CE 3.46Å; A260-M282 VanDerWaalsContact O-CE 3.28Å; A260-M282 WeakPolarHBondContact O-CE 3.22Å; A260-L320 HydrophobicContact CB-CD2 4.27Å |
| 261 | G | 92.7 | Very high | 94.7 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | S103 A259 A264 D265 | S103-G261 WeakPolarHBondContact O-CA 3.25Å; A259-G261 VanDerWaalsContact C-N 3.32Å; A259-G261 PolarHBondContact O-N 2.94Å; G261-A264 PolarHBondContact O-N 2.91Å; G261-D265 PolarHBondContact O-N 3.12Å; G261-D265 VanDerWaalsContact O-N 3.08Å |
| 262 | Q | 94.2 | Very high | 94.5 | Very high | 94 Ų | 94 | 51.2 Ų | 51.2 | 44% | 0.439 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 177.7 | -65.1 | -68.6 | -11.4 | 0 | 0 | 112 | K104 A259 A260 T266 | K104-Q262 HydrophobicContact CG-CG 4.26Å; A259-Q262 WeakPolarHBondContact O-CB 3.23Å; A259-Q262 PolarHBondContact O-N 2.85Å; A260-Q262 PolarHBondContact O-N 3.33Å; Q262-T266 VanDerWaalsContact O-CB 3.29Å; Q262-T266 WeakPolarHBondContact O-CB 3.03Å; Q262-T266 PolarHBondContact O-N 2.87Å; Q262-T266 PolarHBondContact O-OG1 3.23Å |
| 263 | V | 95.6 | Very high | 94.3 | Very high | 74 Ų | 74 | 52.1 Ų | 52.1 | 45% | 0.448 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -63.2 | -46.5 | 177 | 173.5 | 0 | 0 | 0 | 0 | 110.4 | A259 A260 D265 T266 M267 M282 | A259-V263 WeakPolarHBondContact O-CG2 3.3Å; A259-V263 PolarHBondContact O-N 3.09Å; A260-V263 PolarHBondContact O-N 3.22Å; V263-D265 PolarHBondContact O-N 3.38Å; V263-T266 PolarHBondContact O-N 2.85Å; V263-M267 HydrophobicContact CG1-CE 3.88Å; V263-M267 WeakPolarHBondContact O-CG 3.49Å; V263-M267 PolarHBondContact O-N 3.46Å; V263-M282 HydrophobicContact CG1-SD 4.48Å |
| 264 | A | 95 | Very high | 94.3 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.3 | -49.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A260 G261 T266 M267 R268 V278 M282 | A260-A264 VanDerWaalsContact O-CB 3.3Å; A260-A264 WeakPolarHBondContact O-CB 3.49Å; A260-A264 PolarHBondContact O-N 3.44Å; G261-A264 PolarHBondContact O-N 2.91Å; A264-T266 VanDerWaalsContact C-N 3.34Å; A264-T266 PolarHBondContact O-N 3.33Å; A264-M267 PolarHBondContact O-N 2.83Å; A264-R268 WeakPolarHBondContact O-CG 3.3Å; A264-R268 PolarHBondContact O-N 3.27Å; A264-R268 VanDerWaalsContact O-N 3.16Å; A264-V278 HydrophobicContact CB-CG1 3.75Å; A264-M282 HydrophobicContact CB-CE 4.4Å; A264-M282 HydrophobicContact CB-CG 4.12Å; A264-M282 HydrophobicContact CB-SD 4.39Å |
| 265 | D | 92.2 | Very high | 94.2 | Very high | 0 Ų | 0 | 57 Ų | 57 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -72.8 | -28.4 | -179.8 | -72.5 | -20.9 | 0 | 0 | 0 | 112.1 | S100 E101 S103 K104 G261 V263 R268 T269 | S100-D265 WeakPolarHBondContact O-CB 3.39Å; E101-D265 VanDerWaalsContact CA-OD2 3.32Å; E101-D265 WeakPolarHBondContact CA-OD2 3.28Å; S103-D265 WeakPolarHBondContact CB-OD1 3.49Å; S103-D265 WeakPolarHBondContact CB-OD2 3.46Å; S103-D265 PolarHBondContact N-OD2 2.66Å; S103-D265 PolarHBondContact OG-OD1 3.16Å; K104-D265 HydrophobicContact CD-CB 4.16Å; K104-D265 VanDerWaalsContact CE-CB 3.41Å; K104-D265 HydrophobicContact CG-CB 4.11Å; K104-D265 WeakPolarHBondContact CG-OD2 3.33Å; K104-D265 PolarHBondContact N-OD2 3.44Å; G261-D265 PolarHBondContact O-N 3.12Å; G261-D265 VanDerWaalsContact O-N 3.08Å; V263-D265 PolarHBondContact O-N 3.38Å; D265-R268 PolarHBondContact O-N 3.48Å; D265-R268 IonicContact OD1-NH1 3.18Å; D265-R268 PolarHBondContact OD1-NH1 3.38Å; D265-R268 VanDerWaalsContact OD1-NH1 3.16Å; D265-T269 WeakPolarHBondContact O-CB 3.4Å; D265-T269 WeakPolarHBondContact O-CG2 3.49Å; D265-T269 PolarHBondContact O-N 2.91Å; D265-T269 PolarHBondContact O-OG1 3.1Å |
| 266 | T | 93.3 | Very high | 94.1 | Very high | 50 Ų | 50 | 53.1 Ų | 53.1 | 31% | 0.307 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -66.4 | -41.4 | 171 | -59.2 | 0 | 0 | 0 | 0 | 111.8 | Q262 V263 A264 R268 T269 K270 C271 | Q262-T266 VanDerWaalsContact O-CB 3.29Å; Q262-T266 WeakPolarHBondContact O-CB 3.03Å; Q262-T266 PolarHBondContact O-N 2.87Å; Q262-T266 PolarHBondContact O-OG1 3.23Å; V263-T266 PolarHBondContact O-N 2.85Å; A264-T266 VanDerWaalsContact C-N 3.34Å; A264-T266 PolarHBondContact O-N 3.33Å; T266-R268 VanDerWaalsContact C-N 3.27Å; T266-R268 PolarHBondContact O-N 3.32Å; T266-T269 PolarHBondContact O-N 3.23Å; T266-K270 HydrophobicContact CG2-CB 4.23Å; T266-K270 HydrophobicContact CG2-CD 3.87Å; T266-K270 HydrophobicContact CG2-CG 4.1Å; T266-K270 WeakPolarHBondContact O-CB 3.4Å; T266-K270 PolarHBondContact O-N 3.37Å; T266-C271 PolarHBondContact O-N 3.41Å |
| 267 | M | 94.9 | Very high | 94.1 | Very high | 29 Ų | 29 | 53.7 Ų | 53.7 | 14% | 0.143 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -60.6 | -37.2 | 174.4 | -77.7 | -167.5 | -73.5 | 0 | 0 | 112.1 | V263 A264 C271 K272 L273 V278 I281 M282 | V263-M267 HydrophobicContact CG1-CE 3.88Å; V263-M267 WeakPolarHBondContact O-CG 3.49Å; V263-M267 PolarHBondContact O-N 3.46Å; A264-M267 PolarHBondContact O-N 2.83Å; M267-C271 CarbonylContact O-C 3.6Å; M267-C271 VanDerWaalsContact O-CB 3.29Å; M267-C271 WeakPolarHBondContact O-CB 3.12Å; M267-C271 PolarHBondContact O-N 3.41Å; M267-K272 PolarHBondContact O-N 3.25Å; M267-L273 HydrophobicContact CB-CD1 4.17Å; M267-L273 HydrophobicContact CG-CD1 4.41Å; M267-L273 PolarHBondContact O-N 2.92Å; M267-L273 VanDerWaalsContact O-N 3.08Å; M267-L273 HydrophobicContact SD-CD1 4.24Å; M267-V278 HydrophobicContact CB-CG2 3.67Å; M267-V278 HydrophobicContact CE-CG1 4.07Å; M267-I281 HydrophobicContact CE-CG2 4.3Å; M267-I281 HydrophobicContact SD-CD1 4.49Å; M267-I281 HydrophobicContact SD-CG2 4.41Å; M267-M282 HydrophobicContact CE-CG 4.03Å; M267-M282 HydrophobicContact CE-SD 3.48Å; M267-M282 WeakPolarHBondContact CE-SD 3.47Å |
| 268 | R | 92 | Very high | 94.2 | Very high | 44 Ų | 44 | 53.7 Ų | 53.7 | 17% | 0.166 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -71.9 | -47.1 | 176.7 | -66.8 | 172 | 64.4 | -145.4 | 0.9 | 112.3 | P99 A264 D265 T266 K272 T275 V278 | P99-R268 VanDerWaalsContact O-CZ 3.29Å; P99-R268 PolarHBondContact O-NH1 3.35Å; P99-R268 PolarHBondContact O-NH2 3Å; A264-R268 WeakPolarHBondContact O-CG 3.3Å; A264-R268 PolarHBondContact O-N 3.27Å; A264-R268 VanDerWaalsContact O-N 3.16Å; D265-R268 PolarHBondContact O-N 3.48Å; D265-R268 IonicContact OD1-NH1 3.18Å; D265-R268 PolarHBondContact OD1-NH1 3.38Å; D265-R268 VanDerWaalsContact OD1-NH1 3.16Å; T266-R268 VanDerWaalsContact C-N 3.27Å; T266-R268 PolarHBondContact O-N 3.32Å; R268-K272 WeakPolarHBondContact O-CA 3.34Å; R268-K272 PolarHBondContact O-N 3.42Å; R268-T275 PolarHBondContact NE-OG1 3.28Å; R268-V278 HydrophobicContact CG-CB 4.11Å; R268-V278 HydrophobicContact CG-CG1 4.23Å; R268-V278 HydrophobicContact CG-CG2 3.72Å |
| 269 | T | 90.4 | Very high | 94.3 | Very high | 84 Ų | 84 | 52.4 Ų | 52.4 | 52% | 0.515 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -82 | -46.7 | -171.8 | 52.7 | 0 | 0 | 0 | 0 | 113.4 | D265 T266 | D265-T269 WeakPolarHBondContact O-CB 3.4Å; D265-T269 WeakPolarHBondContact O-CG2 3.49Å; D265-T269 PolarHBondContact O-N 2.91Å; D265-T269 PolarHBondContact O-OG1 3.1Å; T266-T269 PolarHBondContact O-N 3.23Å |
| 270 | K | 91.7 | Very high | 94.4 | Very high | 167 Ų | 167 | 52.7 Ų | 52.7 | 73% | 0.726 | 28% | 0.279 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.6 | -44.8 | -176.3 | -62 | -166.3 | -176 | 178.9 | 0 | 112.6 | T266 K272 | T266-K270 HydrophobicContact CG2-CB 4.23Å; T266-K270 HydrophobicContact CG2-CD 3.87Å; T266-K270 HydrophobicContact CG2-CG 4.1Å; T266-K270 WeakPolarHBondContact O-CB 3.4Å; T266-K270 PolarHBondContact O-N 3.37Å; K270-K272 VanDerWaalsContact C-N 3.28Å |
| 271 | C | 92.6 | Very high | 94.5 | Very high | 80 Ų | 80 | 55.3 Ų | 55.3 | 54% | 0.541 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -85.1 | -3.8 | -179.5 | -50.4 | 0 | 0 | 0 | 0 | 113 | T266 M267 L273 | T266-C271 PolarHBondContact O-N 3.41Å; M267-C271 CarbonylContact O-C 3.6Å; M267-C271 VanDerWaalsContact O-CB 3.29Å; M267-C271 WeakPolarHBondContact O-CB 3.12Å; M267-C271 PolarHBondContact O-N 3.41Å; C271-L273 HydrophobicContact CB-CG 4.08Å; C271-L273 PolarHBondContact O-N 2.84Å; C271-L273 VanDerWaalsContact O-N 3.12Å |
| 272 | K | 91.6 | Very high | 94.7 | Very high | 185 Ų | 185 | 55.5 Ų | 55.5 | 80% | 0.804 | 29% | 0.293 | S | S | * | . | trans | 53.9 | 29.7 | -179.9 | -57.4 | -176.2 | 178.2 | -177.3 | 0 | 113.4 | M267 R268 K270 | M267-K272 PolarHBondContact O-N 3.25Å; R268-K272 WeakPolarHBondContact O-CA 3.34Å; R268-K272 PolarHBondContact O-N 3.42Å; K270-K272 VanDerWaalsContact C-N 3.28Å | ||
| 273 | L | 94.5 | Very high | 94.9 | Very high | 61 Ų | 61 | 51 Ų | 51 | 32% | 0.319 | 27% | 0.272 | S | S | . | . | trans | -73.7 | 141.5 | 175.3 | -64.2 | -174.3 | 0 | 0 | 0 | 110.1 | M267 C271 V278 I281 | M267-L273 HydrophobicContact CB-CD1 4.17Å; M267-L273 HydrophobicContact CG-CD1 4.41Å; M267-L273 PolarHBondContact O-N 2.92Å; M267-L273 VanDerWaalsContact O-N 3.08Å; M267-L273 HydrophobicContact SD-CD1 4.24Å; C271-L273 HydrophobicContact CB-CG 4.08Å; C271-L273 PolarHBondContact O-N 2.84Å; C271-L273 VanDerWaalsContact O-N 3.12Å; L273-V278 HydrophobicContact CB-CG2 3.66Å; L273-V278 HydrophobicContact CD1-CG2 4.31Å; L273-I281 HydrophobicContact CD1-CD1 4.1Å | ||
| 274 | S | 95 | Very high | 95 | Very high | 72 Ų | 72 | 48.4 Ų | 48.4 | 50% | 0.503 | 26% | 0.257 | S | S | . | . | trans | -63.1 | 149.9 | 175.2 | 69.9 | 0 | 0 | 0 | 0 | 111.1 | T276 C277 V278 | S274-T276 PolarHBondContact O-N 3.21Å; S274-C277 WeakPolarHBondContact O-CB 3.35Å; S274-C277 PolarHBondContact O-N 3.5Å; S274-C277 WeakPolarHBondContact OG-CB 3.43Å; S274-C277 PolarHBondContact OG-N 2.97Å; S274-V278 PolarHBondContact O-N 3.18Å | ||
| 275 | T | 93.9 | Very high | 95.2 | Very high | 32 Ų | 32 | 53.2 Ų | 53.2 | 20% | 0.196 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -53.9 | -44 | 177.4 | -53.5 | 0 | 0 | 0 | 0 | 111 | R268 C277 V278 R279 D331 G396 | R268-T275 PolarHBondContact NE-OG1 3.28Å; T275-C277 PolarHBondContact O-N 3.2Å; T275-V278 PolarHBondContact O-N 3.27Å; T275-R279 HydrophobicContact CG2-CG 4.31Å; T275-R279 WeakPolarHBondContact O-CG 3.46Å; T275-R279 PolarHBondContact O-N 3.44Å; T275-D331 HydrophobicContact CG2-CB 4.38Å; T275-G396 WeakPolarHBondContact CB-O 3.39Å; T275-G396 WeakPolarHBondContact CG2-O 3.32Å |
| 276 | T | 96.5 | Very high | 95.5 | Very high | 32 Ų | 32 | 53.2 Ų | 53.2 | 20% | 0.196 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -56.5 | -46.5 | 175.4 | -58 | 0 | 0 | 0 | 0 | 112.8 | S274 R279 K280 G396 | S274-T276 PolarHBondContact O-N 3.21Å; T276-R279 PolarHBondContact O-N 3.34Å; T276-K280 HydrophobicContact CG2-CD 4.3Å; T276-K280 WeakPolarHBondContact O-CG 3.13Å; T276-K280 PolarHBondContact O-N 2.92Å; T276-G396 PolarHBondContact OG1-N 3.24Å |
| 277 | C | 97.4 | Very high | 95.7 | Very high | 44 Ų | 44 | 50.9 Ų | 50.9 | 30% | 0.297 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.9 | -45.9 | 179.3 | -179.8 | 0 | 0 | 0 | 0 | 110.8 | S274 T275 K280 I281 | S274-C277 WeakPolarHBondContact O-CB 3.35Å; S274-C277 PolarHBondContact O-N 3.5Å; S274-C277 WeakPolarHBondContact OG-CB 3.43Å; S274-C277 PolarHBondContact OG-N 2.97Å; T275-C277 PolarHBondContact O-N 3.2Å; C277-K280 PolarHBondContact O-N 3.32Å; C277-I281 WeakPolarHBondContact O-CG1 3.37Å; C277-I281 PolarHBondContact O-N 3.35Å |
| 278 | V | 97.3 | Very high | 95.9 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.8 | -45.4 | 178.2 | 170.4 | 0 | 0 | 0 | 0 | 111.9 | A264 M267 R268 L273 S274 T275 K280 I281 M282 | A264-V278 HydrophobicContact CB-CG1 3.75Å; M267-V278 HydrophobicContact CB-CG2 3.67Å; M267-V278 HydrophobicContact CE-CG1 4.07Å; R268-V278 HydrophobicContact CG-CB 4.11Å; R268-V278 HydrophobicContact CG-CG1 4.23Å; R268-V278 HydrophobicContact CG-CG2 3.72Å; L273-V278 HydrophobicContact CB-CG2 3.66Å; L273-V278 HydrophobicContact CD1-CG2 4.31Å; S274-V278 PolarHBondContact O-N 3.18Å; T275-V278 PolarHBondContact O-N 3.27Å; V278-K280 VanDerWaalsContact C-N 3.33Å; V278-K280 PolarHBondContact O-N 3.47Å; V278-I281 PolarHBondContact O-N 3.26Å; V278-M282 HydrophobicContact CG1-CG 4.22Å; V278-M282 WeakPolarHBondContact O-CB 3.37Å; V278-M282 VanDerWaalsContact O-CG 3.24Å; V278-M282 WeakPolarHBondContact O-CG 3.46Å; V278-M282 PolarHBondContact O-N 3.45Å |
| 279 | R | 97.4 | Very high | 96.1 | Very high | 1 Ų | 1 | 52.1 Ų | 52.1 | 0% | 0.004 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -58.8 | -45 | 175.8 | -63.6 | -49.3 | 170.5 | -131.5 | -3.6 | 111.7 | S103 T275 T276 M282 D283 G323 D331 Y390 | S103-R279 PolarHBondContact OG-NH1 2.99Å; S103-R279 PolarHBondContact OG-NH2 2.9Å; T275-R279 HydrophobicContact CG2-CG 4.31Å; T275-R279 WeakPolarHBondContact O-CG 3.46Å; T275-R279 PolarHBondContact O-N 3.44Å; T276-R279 PolarHBondContact O-N 3.34Å; R279-M282 PolarHBondContact O-N 3.32Å; R279-D283 WeakPolarHBondContact O-CB 3.39Å; R279-D283 PolarHBondContact O-N 2.93Å; R279-G323 VanDerWaalsContact CD-O 3.23Å; R279-G323 WeakPolarHBondContact CD-O 3.37Å; R279-G323 PolarHBondContact NH1-O 2.88Å; R279-D331 IonicContact CZ-OD2 3.09Å; R279-D331 IonicContact NE-OD2 3.53Å; R279-D331 PolarHBondContact NE-OD2 3.49Å; R279-D331 IonicContact NH2-OD1 3.75Å; R279-D331 IonicContact NH2-OD2 2.71Å; R279-D331 PolarHBondContact NH2-OD2 2.93Å; R279-D331 VanDerWaalsContact NH2-OD2 3.09Å; R279-Y390 HydrophobicContact CB-CE1 4.43Å |
| 280 | K | 98.2 | Very high | 96.5 | Very high | 56 Ų | 56 | 48.1 Ų | 48.1 | 24% | 0.243 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.3 | -47 | 177 | -73.2 | -176 | 179 | -166.5 | 0 | 111.9 | T276 C277 V278 C284 Y390 A391 G394 | T276-K280 HydrophobicContact CG2-CD 4.3Å; T276-K280 WeakPolarHBondContact O-CG 3.13Å; T276-K280 PolarHBondContact O-N 2.92Å; C277-K280 PolarHBondContact O-N 3.32Å; V278-K280 VanDerWaalsContact C-N 3.33Å; V278-K280 PolarHBondContact O-N 3.47Å; K280-C284 WeakPolarHBondContact O-CB 3.38Å; K280-C284 PolarHBondContact O-N 3.05Å; K280-C284 PolarHBondContact O-SG 3.2Å; K280-Y390 HydrophobicContact CG-CD1 4.4Å; K280-Y390 HydrophobicContact CG-CE1 4.35Å; K280-A391 VanDerWaalsContact CE-O 3.23Å; K280-A391 WeakPolarHBondContact CE-O 3.19Å; K280-A391 PolarHBondContact NZ-O 3.1Å; K280-G394 WeakPolarHBondContact CE-O 3.25Å |
| 281 | I | 98 | Very high | 96.8 | Very high | 56 Ų | 56 | 40.3 Ų | 40.3 | 29% | 0.287 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -58.3 | -54.3 | 178 | -70.2 | 168 | 0 | 0 | 0 | 110.2 | M267 L273 C277 V278 D283 F285 | M267-I281 HydrophobicContact CE-CG2 4.3Å; M267-I281 HydrophobicContact SD-CD1 4.49Å; M267-I281 HydrophobicContact SD-CG2 4.41Å; L273-I281 HydrophobicContact CD1-CD1 4.1Å; C277-I281 WeakPolarHBondContact O-CG1 3.37Å; C277-I281 PolarHBondContact O-N 3.35Å; V278-I281 PolarHBondContact O-N 3.26Å; I281-D283 PolarHBondContact O-N 3.5Å; I281-F285 HydrophobicContact CG2-CD2 3.86Å; I281-F285 HydrophobicContact CG2-CE2 4.15Å; I281-F285 WeakPolarHBondContact O-CB 3.43Å; I281-F285 VanDerWaalsContact O-CD2 3.27Å; I281-F285 WeakPolarHBondContact O-CD2 3.3Å; I281-F285 PolarHBondContact O-N 3.29Å |
| 282 | M | 97.8 | Very high | 97 | Very high | 5 Ų | 5 | 40.6 Ų | 40.6 | 3% | 0.025 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.2 | -44.9 | -175.6 | -64.7 | -59.4 | -68.2 | 0 | 0 | 112 | A260 V263 A264 M267 V278 R279 G286 L320 | A260-M282 HydrophobicContact CB-CE 3.46Å; A260-M282 VanDerWaalsContact CB-CE 3.46Å; A260-M282 VanDerWaalsContact O-CE 3.28Å; A260-M282 WeakPolarHBondContact O-CE 3.22Å; V263-M282 HydrophobicContact CG1-SD 4.48Å; A264-M282 HydrophobicContact CB-CE 4.4Å; A264-M282 HydrophobicContact CB-CG 4.12Å; A264-M282 HydrophobicContact CB-SD 4.39Å; M267-M282 HydrophobicContact CE-CG 4.03Å; M267-M282 HydrophobicContact CE-SD 3.48Å; M267-M282 WeakPolarHBondContact CE-SD 3.47Å; V278-M282 HydrophobicContact CG1-CG 4.22Å; V278-M282 WeakPolarHBondContact O-CB 3.37Å; V278-M282 VanDerWaalsContact O-CG 3.24Å; V278-M282 WeakPolarHBondContact O-CG 3.46Å; V278-M282 PolarHBondContact O-N 3.45Å; R279-M282 PolarHBondContact O-N 3.32Å; M282-G286 PolarHBondContact O-N 2.71Å; M282-L320 HydrophobicContact CE-CB 4.36Å; M282-L320 HydrophobicContact CE-CD2 3.85Å; M282-L320 WeakPolarHBondContact O-CB 3.37Å |
| 283 | D | 98.1 | Very high | 97.3 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -71.7 | -45.6 | -178.2 | -155.5 | 72.5 | 0 | 0 | 0 | 112.4 | S212 R279 I281 G286 H287 F325 Y390 | S212-D283 WeakPolarHBondContact CB-OD2 3.48Å; S212-D283 PolarHBondContact OG-OD1 3.44Å; S212-D283 VanDerWaalsContact OG-OD1 3.05Å; S212-D283 PolarHBondContact OG-OD2 3.33Å; R279-D283 WeakPolarHBondContact O-CB 3.39Å; R279-D283 PolarHBondContact O-N 2.93Å; I281-D283 PolarHBondContact O-N 3.5Å; D283-G286 CarbonylContact O-C 3.56Å; D283-G286 PolarHBondContact O-N 2.82Å; D283-H287 PolarHBondContact O-N 2.88Å; D283-H287 PolarHBondContact O-ND1 2.83Å; D283-H287 IonicContact OD1-CE1 3.76Å; D283-H287 IonicContact OD2-CE1 3.63Å; D283-H287 IonicContact OD2-ND1 3.86Å; D283-F325 WeakPolarHBondContact OD1-CB 3.43Å; D283-F325 WeakPolarHBondContact OD1-CD1 3.42Å; D283-F325 PolarHBondContact OD1-N 3.03Å; D283-Y390 HydrophobicContact CB-CD1 3.64Å; D283-Y390 HydrophobicContact CB-CE1 3.48Å; D283-Y390 VanDerWaalsContact CB-CE1 3.48Å; D283-Y390 HydrophobicContact CB-CG 4.28Å; D283-Y390 WeakPolarHBondContact OD2-CD2 3.33Å; D283-Y390 VanDerWaalsContact OD2-CG 3.28Å |
| 284 | C | 98.1 | Very high | 97.4 | Very high | 18 Ų | 18 | 29.4 Ų | 29.4 | 12% | 0.122 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -66.2 | -43.5 | -179.5 | -67.7 | 0 | 0 | 0 | 0 | 111.4 | K280 G286 H287 L288 V387 | K280-C284 WeakPolarHBondContact O-CB 3.38Å; K280-C284 PolarHBondContact O-N 3.05Å; K280-C284 PolarHBondContact O-SG 3.2Å; C284-G286 VanDerWaalsContact C-N 3.32Å; C284-H287 PolarHBondContact O-N 2.9Å; C284-L288 WeakPolarHBondContact O-CB 3.26Å; C284-L288 PolarHBondContact O-N 3.27Å; C284-V387 HydrophobicContact CB-CG1 4.09Å |
| 285 | F | 98.1 | Very high | 97.4 | Very high | 102 Ų | 102 | 28.2 Ų | 28.2 | 45% | 0.447 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -69.1 | -33 | 174.5 | -79.4 | -70.4 | 0 | 0 | 0 | 112.3 | I281 H287 I289 L320 | I281-F285 HydrophobicContact CG2-CD2 3.86Å; I281-F285 HydrophobicContact CG2-CE2 4.15Å; I281-F285 WeakPolarHBondContact O-CB 3.43Å; I281-F285 VanDerWaalsContact O-CD2 3.27Å; I281-F285 WeakPolarHBondContact O-CD2 3.3Å; I281-F285 PolarHBondContact O-N 3.29Å; F285-H287 PolarHBondContact O-N 3.32Å; F285-I289 HydrophobicContact CB-CD1 4.38Å; F285-I289 HydrophobicContact CD1-CD1 4.09Å; F285-I289 HydrophobicContact CD1-CG1 4.3Å; F285-I289 PolarHBondContact O-N 3.27Å; F285-L320 HydrophobicContact CB-CD1 3.81Å |
| 286 | G | 97.9 | Very high | 97.5 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -65.4 | -15.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | M282 D283 C284 P290 F317 S318 | M282-G286 PolarHBondContact O-N 2.71Å; D283-G286 CarbonylContact O-C 3.56Å; D283-G286 PolarHBondContact O-N 2.82Å; C284-G286 VanDerWaalsContact C-N 3.32Å; G286-P290 WeakPolarHBondContact O-CD 3.09Å; G286-P290 WeakPolarHBondContact O-CG 3.49Å; G286-F317 WeakPolarHBondContact CA-O 3.42Å; G286-S318 WeakPolarHBondContact O-CA 3.42Å |
| 287 | H | 98.3 | Very high | 97.4 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -111 | -34.9 | 173.4 | -70.8 | 86 | 0 | 0 | 0 | 112.9 | S212 T215 D283 C284 F285 P290 A291 C321 Y383 V387 | S212-H287 PolarHBondContact O-NE2 3.23Å; S212-H287 PolarHBondContact OG-CE1 3.29Å; T215-H287 PolarHBondContact OG1-NE2 2.77Å; D283-H287 PolarHBondContact O-N 2.88Å; D283-H287 PolarHBondContact O-ND1 2.83Å; D283-H287 IonicContact OD1-CE1 3.76Å; D283-H287 IonicContact OD2-CE1 3.63Å; D283-H287 IonicContact OD2-ND1 3.86Å; C284-H287 PolarHBondContact O-N 2.9Å; F285-H287 PolarHBondContact O-N 3.32Å; H287-P290 WeakPolarHBondContact O-CD 3.41Å; H287-A291 VanDerWaalsContact O-CB 3.24Å; H287-A291 WeakPolarHBondContact O-CB 3.07Å; H287-A291 PolarHBondContact O-N 2.91Å; H287-C321 PolarHBondContact CE1-SG 3.46Å; H287-C321 PolarHBondContact ND1-SG 3.08Å; H287-Y383 AromaticContact CD2-CD1 3.49Å; H287-Y383 VanDerWaalsContact CD2-CD1 3.49Å; H287-Y383 WeakPolarHBondContact CD2-CD1 3.46Å; H287-Y383 AromaticContact CD2-CE1 3.81Å; H287-V387 HydrophobicContact CB-CG2 3.48Å; H287-V387 VanDerWaalsContact CB-CG2 3.48Å |
| 288 | L | 98.3 | Very high | 97 | Very high | 55 Ų | 55 | 29.2 Ų | 29.2 | 29% | 0.288 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -70.3 | -47 | -176.2 | -176.6 | 61.9 | 0 | 0 | 0 | 112.4 | C284 A291 I292 F384 V387 | C284-L288 WeakPolarHBondContact O-CB 3.26Å; C284-L288 PolarHBondContact O-N 3.27Å; L288-A291 WeakPolarHBondContact O-CB 3.32Å; L288-A291 PolarHBondContact O-N 3.36Å; L288-I292 HydrophobicContact CD1-CD1 4.23Å; L288-I292 HydrophobicContact CG-CD1 4.18Å; L288-I292 WeakPolarHBondContact O-CG1 3.46Å; L288-I292 PolarHBondContact O-N 3.46Å; L288-F384 HydrophobicContact CD1-CD2 4.39Å; L288-V387 HydrophobicContact CB-CG2 3.85Å |
| 289 | I | 98 | Very high | 96.8 | Very high | 45 Ų | 45 | 36.2 Ų | 36.2 | 23% | 0.231 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -62.6 | -47.8 | 178.1 | -61.6 | 167.7 | 0 | 0 | 0 | 109.4 | F285 A291 I292 C293 F317 | F285-I289 HydrophobicContact CB-CD1 4.38Å; F285-I289 HydrophobicContact CD1-CD1 4.09Å; F285-I289 HydrophobicContact CD1-CG1 4.3Å; F285-I289 PolarHBondContact O-N 3.27Å; I289-A291 PolarHBondContact O-N 3.18Å; I289-I292 PolarHBondContact O-N 3.48Å; I289-C293 WeakPolarHBondContact O-CB 3.11Å; I289-C293 PolarHBondContact O-N 3.43Å; I289-C293 PolarHBondContact O-SG 3.31Å; I289-C293 VanDerWaalsContact O-SG 3.36Å; I289-F317 HydrophobicContact CB-CB 4Å; I289-F317 HydrophobicContact CB-CG 4.24Å; I289-F317 HydrophobicContact CD1-CB 4.43Å; I289-F317 HydrophobicContact CD1-CD1 3.62Å; I289-F317 HydrophobicContact CD1-CE1 3.99Å; I289-F317 HydrophobicContact CD1-CG 4.02Å; I289-F317 HydrophobicContact CG2-CB 3.77Å; I289-F317 HydrophobicContact CG2-CD1 4.41Å; I289-F317 HydrophobicContact CG2-CD2 3.73Å; I289-F317 HydrophobicContact CG2-CE2 4.45Å; I289-F317 HydrophobicContact CG2-CG 3.71Å |
| 290 | P | 97.9 | Very high | 96.5 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61 | -38.5 | 174.5 | -29.5 | 42.4 | 0 | 0 | 0 | 114.3 | G286 H287 I292 C293 V294 S314 F317 Y383 | G286-P290 WeakPolarHBondContact O-CD 3.09Å; G286-P290 WeakPolarHBondContact O-CG 3.49Å; H287-P290 WeakPolarHBondContact O-CD 3.41Å; P290-I292 VanDerWaalsContact C-N 3.35Å; P290-I292 PolarHBondContact O-N 2.76Å; P290-C293 PolarHBondContact O-N 2.65Å; P290-V294 WeakPolarHBondContact O-CB 3.21Å; P290-V294 VanDerWaalsContact O-CG1 3.27Å; P290-V294 WeakPolarHBondContact O-CG1 3.41Å; P290-V294 PolarHBondContact O-N 3.37Å; P290-S314 WeakPolarHBondContact CA-OG 3.32Å; P290-S314 WeakPolarHBondContact CB-O 3.09Å; P290-S314 WeakPolarHBondContact CB-OG 3.38Å; P290-S314 WeakPolarHBondContact CG-O 3.46Å; P290-S314 PolarHBondContact O-OG 3.28Å; P290-F317 HydrophobicContact CG-CB 4.21Å; P290-Y383 HydrophobicContact CB-CD2 3.79Å; P290-Y383 HydrophobicContact CB-CE2 3.4Å; P290-Y383 VanDerWaalsContact CB-CE2 3.4Å |
| 291 | A | 97.9 | Very high | 96 | Very high | 3 Ų | 3 | 36.3 Ų | 36.3 | 3% | 0.025 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -57.8 | -47.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | H287 L288 I289 V294 I295 Y383 | H287-A291 VanDerWaalsContact O-CB 3.24Å; H287-A291 WeakPolarHBondContact O-CB 3.07Å; H287-A291 PolarHBondContact O-N 2.91Å; L288-A291 WeakPolarHBondContact O-CB 3.32Å; L288-A291 PolarHBondContact O-N 3.36Å; I289-A291 PolarHBondContact O-N 3.18Å; A291-V294 WeakPolarHBondContact O-CG1 3.47Å; A291-I295 WeakPolarHBondContact O-CB 3.47Å; A291-I295 WeakPolarHBondContact O-CD1 3.43Å; A291-I295 WeakPolarHBondContact O-CG1 3.15Å; A291-I295 PolarHBondContact O-N 3.35Å; A291-Y383 HydrophobicContact CB-CD2 4.43Å |
| 292 | I | 97.9 | Very high | 95.4 | Very high | 85 Ų | 85 | 39 Ų | 39 | 44% | 0.436 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -63.6 | -55.1 | 178.4 | -67.4 | 168.8 | 0 | 0 | 0 | 109 | L288 I289 P290 V294 I295 F296 | L288-I292 HydrophobicContact CD1-CD1 4.23Å; L288-I292 HydrophobicContact CG-CD1 4.18Å; L288-I292 WeakPolarHBondContact O-CG1 3.46Å; L288-I292 PolarHBondContact O-N 3.46Å; I289-I292 PolarHBondContact O-N 3.48Å; P290-I292 VanDerWaalsContact C-N 3.35Å; P290-I292 PolarHBondContact O-N 2.76Å; I292-V294 PolarHBondContact O-N 3.48Å; I292-I295 PolarHBondContact O-N 3.11Å; I292-F296 HydrophobicContact CG2-CD2 3.67Å; I292-F296 HydrophobicContact CG2-CE2 3.78Å; I292-F296 VanDerWaalsContact O-CD2 3.24Å; I292-F296 WeakPolarHBondContact O-CD2 3.49Å; I292-F296 PolarHBondContact O-N 3.32Å |
| 293 | C | 97.2 | Very high | 95 | Very high | 12 Ų | 12 | 43.1 Ų | 43.1 | 8% | 0.081 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -57 | -48.7 | -176.6 | -71.1 | 0 | 0 | 0 | 0 | 112.3 | I289 P290 I295 F296 V297 L310 | I289-C293 WeakPolarHBondContact O-CB 3.11Å; I289-C293 PolarHBondContact O-N 3.43Å; I289-C293 PolarHBondContact O-SG 3.31Å; I289-C293 VanDerWaalsContact O-SG 3.36Å; P290-C293 PolarHBondContact O-N 2.65Å; C293-I295 PolarHBondContact O-N 3.4Å; C293-F296 PolarHBondContact O-N 2.93Å; C293-V297 WeakPolarHBondContact O-CG2 3.36Å; C293-V297 PolarHBondContact O-N 3.46Å; C293-V297 VanDerWaalsContact O-N 3.09Å; C293-L310 HydrophobicContact CB-CD2 4.48Å; C293-L310 WeakPolarHBondContact CB-O 3.29Å |
| 294 | V | 95.5 | Very high | 94.6 | Very high | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.1 | -39.6 | -177.9 | 78.3 | 0 | 0 | 0 | 0 | 111.8 | P290 A291 I292 F296 V297 F376 A379 | P290-V294 WeakPolarHBondContact O-CB 3.21Å; P290-V294 VanDerWaalsContact O-CG1 3.27Å; P290-V294 WeakPolarHBondContact O-CG1 3.41Å; P290-V294 PolarHBondContact O-N 3.37Å; A291-V294 WeakPolarHBondContact O-CG1 3.47Å; I292-V294 PolarHBondContact O-N 3.48Å; V294-F296 PolarHBondContact O-N 3.28Å; V294-V297 WeakPolarHBondContact O-CB 3.2Å; V294-V297 PolarHBondContact O-N 3.37Å; V294-F376 HydrophobicContact CG2-CB 3.99Å; V294-F376 HydrophobicContact CG2-CD1 3.59Å; V294-F376 HydrophobicContact CG2-CE1 4.46Å; V294-F376 HydrophobicContact CG2-CG 4.08Å; V294-F376 WeakPolarHBondContact O-CB 3.33Å; V294-A379 HydrophobicContact CG1-CB 4.46Å; V294-A379 HydrophobicContact CG2-CB 4.43Å |
| 295 | I | 95.8 | Very high | 94.3 | Very high | 47 Ų | 47 | 47.2 Ų | 47.2 | 24% | 0.241 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.4 | -45.6 | 175.7 | -71.1 | 169.3 | 0 | 0 | 0 | 110.5 | A291 I292 C293 V297 G298 Y299 | A291-I295 WeakPolarHBondContact O-CB 3.47Å; A291-I295 WeakPolarHBondContact O-CD1 3.43Å; A291-I295 WeakPolarHBondContact O-CG1 3.15Å; A291-I295 PolarHBondContact O-N 3.35Å; I292-I295 PolarHBondContact O-N 3.11Å; C293-I295 PolarHBondContact O-N 3.4Å; I295-V297 VanDerWaalsContact C-N 3.29Å; I295-V297 PolarHBondContact O-N 2.92Å; I295-G298 PolarHBondContact O-N 2.62Å; I295-Y299 HydrophobicContact CG2-CE2 4.11Å; I295-Y299 WeakPolarHBondContact O-CD2 3.31Å |
| 296 | F | 96.1 | Very high | 94.1 | Very high | 119 Ų | 119 | 43.6 Ų | 43.6 | 52% | 0.522 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -66.3 | -27.2 | -178.9 | -85.3 | -77.2 | 0 | 0 | 0 | 113.4 | I292 C293 V294 G298 Y299 V300 L310 | I292-F296 HydrophobicContact CG2-CD2 3.67Å; I292-F296 HydrophobicContact CG2-CE2 3.78Å; I292-F296 VanDerWaalsContact O-CD2 3.24Å; I292-F296 WeakPolarHBondContact O-CD2 3.49Å; I292-F296 PolarHBondContact O-N 3.32Å; C293-F296 PolarHBondContact O-N 2.93Å; V294-F296 PolarHBondContact O-N 3.28Å; F296-G298 PolarHBondContact O-N 2.95Å; F296-Y299 PolarHBondContact O-N 2.86Å; F296-V300 WeakPolarHBondContact O-CG1 3.36Å; F296-V300 PolarHBondContact O-N 3.49Å; F296-L310 HydrophobicContact CB-CD1 3.88Å |
| 297 | V | 93.6 | Very high | 93.8 | Very high | 1 Ų | 1 | 43.6 Ų | 43.6 | 1% | 0.006 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -56.5 | -34.7 | 171.2 | 176.9 | 0 | 0 | 0 | 0 | 111.1 | Y230 C293 V294 I295 Y299 V300 A307 L310 L311 F376 | Y230-V297 HydrophobicContact CE1-CG1 4.24Å; C293-V297 WeakPolarHBondContact O-CG2 3.36Å; C293-V297 PolarHBondContact O-N 3.46Å; C293-V297 VanDerWaalsContact O-N 3.09Å; V294-V297 WeakPolarHBondContact O-CB 3.2Å; V294-V297 PolarHBondContact O-N 3.37Å; I295-V297 VanDerWaalsContact C-N 3.29Å; I295-V297 PolarHBondContact O-N 2.92Å; V297-Y299 PolarHBondContact O-N 3.05Å; V297-Y299 VanDerWaalsContact O-N 3.1Å; V297-V300 WeakPolarHBondContact O-CG2 3.16Å; V297-A307 HydrophobicContact CG1-CB 4.44Å; V297-L310 HydrophobicContact CG2-CB 3.44Å; V297-L310 VanDerWaalsContact CG2-CB 3.44Å; V297-L310 HydrophobicContact CG2-CD1 4.19Å; V297-L310 HydrophobicContact CG2-CG 4.49Å; V297-L311 HydrophobicContact CB-CG 4.49Å; V297-L311 HydrophobicContact CG1-CD1 4.03Å; V297-L311 HydrophobicContact CG1-CD2 4.21Å; V297-L311 HydrophobicContact CG1-CG 4.01Å; V297-L311 HydrophobicContact CG2-CD2 3.92Å; V297-L311 HydrophobicContact CG2-CG 3.68Å; V297-F376 HydrophobicContact CB-CD2 4.23Å; V297-F376 HydrophobicContact CB-CE2 4.25Å; V297-F376 HydrophobicContact CG1-CD2 3.97Å; V297-F376 HydrophobicContact CG1-CE2 3.49Å; V297-F376 VanDerWaalsContact CG1-CE2 3.49Å; V297-F376 HydrophobicContact CG1-CZ 3.86Å |
| 298 | G | 90.4 | Very high | 93.6 | Very high | 9 Ų | 9 | 44.4 Ų | 44.4 | 9% | 0.093 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65 | -11 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | I295 F296 | I295-G298 PolarHBondContact O-N 2.62Å; F296-G298 PolarHBondContact O-N 2.95Å |
| 299 | Y | 93 | Very high | 93.4 | Very high | 147 Ų | 147 | 44.2 Ų | 44.2 | 58% | 0.576 | 26% | 0.261 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117 | -7.2 | -175.1 | -67 | -81.6 | 0 | 0 | 0 | 114.5 | I295 F296 V297 G301 | I295-Y299 HydrophobicContact CG2-CE2 4.11Å; I295-Y299 WeakPolarHBondContact O-CD2 3.31Å; F296-Y299 PolarHBondContact O-N 2.86Å; V297-Y299 PolarHBondContact O-N 3.05Å; V297-Y299 VanDerWaalsContact O-N 3.1Å; Y299-G301 PolarHBondContact O-N 3.23Å |
| 300 | V | 91.4 | Very high | 93.4 | Very high | 34 Ų | 34 | 43.9 Ų | 43.9 | 21% | 0.206 | 26% | 0.26 | C | S | . | . | trans | -73.5 | -13.9 | -179.5 | -57.8 | 0 | 0 | 0 | 0 | 113.9 | F296 V297 C302 N303 A306 A307 L310 | F296-V300 WeakPolarHBondContact O-CG1 3.36Å; F296-V300 PolarHBondContact O-N 3.49Å; V297-V300 WeakPolarHBondContact O-CG2 3.16Å; V300-C302 PolarHBondContact O-N 3Å; V300-N303 WeakPolarHBondContact O-CB 3.42Å; V300-N303 PolarHBondContact O-N 3.39Å; V300-A306 HydrophobicContact CB-CB 4.16Å; V300-A306 HydrophobicContact CG1-CB 3.96Å; V300-A307 HydrophobicContact CG2-CB 3.69Å; V300-L310 HydrophobicContact CG1-CD1 3.51Å | ||
| 301 | G | 86 | Confident | 93.2 | Very high | 25 Ų | 25 | 44 Ų | 44 | 26% | 0.258 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.3 | -133.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y299 N303 F369 | Y299-G301 PolarHBondContact O-N 3.23Å; G301-N303 PolarHBondContact O-N 3.37Å; G301-N303 VanDerWaalsContact O-N 3.07Å; G301-F369 VanDerWaalsContact C-CE1 3.46Å; G301-F369 WeakPolarHBondContact O-CE1 3.39Å; G301-F369 WeakPolarHBondContact O-CZ 3.37Å |
| 302 | C | 85.6 | Confident | 93.1 | Very high | 113 Ų | 113 | 44.6 Ų | 44.6 | 76% | 0.764 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.6 | 0.8 | -176.6 | -53.9 | 0 | 0 | 0 | 0 | 115.1 | V300 S304 | V300-C302 PolarHBondContact O-N 3Å; C302-S304 VanDerWaalsContact C-N 3.31Å; C302-S304 PolarHBondContact O-N 3.37Å |
| 303 | N | 90.9 | Very high | 93.1 | Very high | 90 Ų | 90 | 44.1 Ų | 44.1 | 48% | 0.481 | 26% | 0.262 | S | S | . | . | trans | -78.6 | 81.6 | 176.6 | -170.1 | -21.2 | 0 | 0 | 0 | 110.8 | V300 G301 A305 A306 A307 | V300-N303 WeakPolarHBondContact O-CB 3.42Å; V300-N303 PolarHBondContact O-N 3.39Å; G301-N303 PolarHBondContact O-N 3.37Å; G301-N303 VanDerWaalsContact O-N 3.07Å; N303-A305 VanDerWaalsContact C-N 3.25Å; N303-A305 PolarHBondContact O-N 3.32Å; N303-A305 PolarHBondContact OD1-N 2.82Å; N303-A306 HydrophobicContact CB-CB 4.03Å; N303-A306 VanDerWaalsContact CG-CB 3.46Å; N303-A306 PolarHBondContact O-N 3.46Å; N303-A306 VanDerWaalsContact O-N 3.16Å; N303-A306 WeakPolarHBondContact OD1-CB 3.39Å; N303-A306 PolarHBondContact OD1-N 2.88Å; N303-A307 PolarHBondContact O-N 3.32Å | ||
| 304 | S | 89 | Confident | 93.1 | Very high | 29 Ų | 29 | 43.5 Ų | 43.5 | 20% | 0.203 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -59 | -34.9 | -178.3 | -52.3 | 0 | 0 | 0 | 0 | 112.9 | C302 A307 V308 | C302-S304 VanDerWaalsContact C-N 3.31Å; C302-S304 PolarHBondContact O-N 3.37Å; S304-A307 PolarHBondContact O-N 3.47Å; S304-V308 VanDerWaalsContact O-CG2 3.27Å; S304-V308 WeakPolarHBondContact O-CG2 3.17Å; S304-V308 PolarHBondContact O-N 3.01Å |
| 305 | A | 91 | Very high | 93.1 | Very high | 75 Ų | 75 | 43.8 Ų | 43.8 | 62% | 0.62 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -65.4 | -43.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | N303 A309 | N303-A305 VanDerWaalsContact C-N 3.25Å; N303-A305 PolarHBondContact O-N 3.32Å; N303-A305 PolarHBondContact OD1-N 2.82Å; A305-A309 WeakPolarHBondContact O-CB 3.09Å; A305-A309 PolarHBondContact O-N 3.23Å |
| 306 | A | 93.6 | Very high | 93.2 | Very high | 27 Ų | 27 | 41.5 Ų | 41.5 | 22% | 0.223 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.8 | -39.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | V300 N303 A309 L310 | V300-A306 HydrophobicContact CB-CB 4.16Å; V300-A306 HydrophobicContact CG1-CB 3.96Å; N303-A306 HydrophobicContact CB-CB 4.03Å; N303-A306 VanDerWaalsContact CG-CB 3.46Å; N303-A306 PolarHBondContact O-N 3.46Å; N303-A306 VanDerWaalsContact O-N 3.16Å; N303-A306 WeakPolarHBondContact OD1-CB 3.39Å; N303-A306 PolarHBondContact OD1-N 2.88Å; A306-A309 PolarHBondContact O-N 2.79Å; A306-L310 WeakPolarHBondContact O-CB 3.33Å; A306-L310 WeakPolarHBondContact O-CG 3.44Å; A306-L310 PolarHBondContact O-N 2.98Å |
| 307 | A | 93.2 | Very high | 93.2 | Very high | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.6 | -51 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y230 L235 V297 V300 N303 S304 A309 L310 L311 | Y230-A307 HydrophobicContact CE1-CB 4.33Å; L235-A307 HydrophobicContact CD1-CB 3.9Å; L235-A307 HydrophobicContact CD2-CB 4.29Å; V297-A307 HydrophobicContact CG1-CB 4.44Å; V300-A307 HydrophobicContact CG2-CB 3.69Å; N303-A307 PolarHBondContact O-N 3.32Å; S304-A307 PolarHBondContact O-N 3.47Å; A307-A309 VanDerWaalsContact C-N 3.35Å; A307-A309 PolarHBondContact O-N 3.15Å; A307-L310 PolarHBondContact O-N 3.4Å; A307-L311 WeakPolarHBondContact O-CB 3.08Å; A307-L311 WeakPolarHBondContact O-CD1 3.29Å; A307-L311 VanDerWaalsContact O-CG 3.27Å; A307-L311 WeakPolarHBondContact O-CG 3.06Å; A307-L311 PolarHBondContact O-N 3.44Å |
| 308 | V | 92.5 | Very high | 93.4 | Very high | 17 Ų | 17 | 39 Ų | 39 | 10% | 0.103 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61 | -43.7 | 177.9 | 173.3 | 0 | 0 | 0 | 0 | 111 | F231 L235 F237 L245 S304 L311 T312 | F231-V308 HydrophobicContact CE1-CG2 3.9Å; F231-V308 HydrophobicContact CE2-CG2 4.39Å; F231-V308 HydrophobicContact CZ-CB 4.46Å; F231-V308 HydrophobicContact CZ-CG2 3.73Å; L235-V308 HydrophobicContact CD1-CG2 4.42Å; F237-V308 HydrophobicContact CE2-CG2 4.02Å; F237-V308 HydrophobicContact CZ-CG2 4.44Å; L245-V308 HydrophobicContact CD2-CG1 4.24Å; S304-V308 VanDerWaalsContact O-CG2 3.27Å; S304-V308 WeakPolarHBondContact O-CG2 3.17Å; S304-V308 PolarHBondContact O-N 3.01Å; V308-L311 PolarHBondContact O-N 2.88Å; V308-T312 VanDerWaalsContact O-CB 3.26Å; V308-T312 WeakPolarHBondContact O-CB 3.32Å; V308-T312 PolarHBondContact O-N 3.5Å; V308-T312 PolarHBondContact O-OG1 3.36Å |
| 309 | A | 95.6 | Very high | 93.7 | Very high | 51 Ų | 51 | 38.5 Ų | 38.5 | 42% | 0.421 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.9 | -46.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | A305 A306 A307 T312 L313 | A305-A309 WeakPolarHBondContact O-CB 3.09Å; A305-A309 PolarHBondContact O-N 3.23Å; A306-A309 PolarHBondContact O-N 2.79Å; A307-A309 VanDerWaalsContact C-N 3.35Å; A307-A309 PolarHBondContact O-N 3.15Å; A309-T312 WeakPolarHBondContact O-CB 3.16Å; A309-T312 PolarHBondContact O-N 2.98Å; A309-L313 VanDerWaalsContact O-CG 3.3Å; A309-L313 WeakPolarHBondContact O-CG 3.01Å; A309-L313 PolarHBondContact O-N 3.26Å |
| 310 | L | 96.5 | Very high | 93.9 | Very high | 38 Ų | 38 | 32.9 Ų | 32.9 | 20% | 0.199 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.6 | -40.5 | 178.5 | -72.2 | 172.2 | 0 | 0 | 0 | 112.3 | C293 F296 V297 V300 A306 A307 T312 L313 S314 | C293-L310 HydrophobicContact CB-CD2 4.48Å; C293-L310 WeakPolarHBondContact CB-O 3.29Å; F296-L310 HydrophobicContact CB-CD1 3.88Å; V297-L310 HydrophobicContact CG2-CB 3.44Å; V297-L310 VanDerWaalsContact CG2-CB 3.44Å; V297-L310 HydrophobicContact CG2-CD1 4.19Å; V297-L310 HydrophobicContact CG2-CG 4.49Å; V300-L310 HydrophobicContact CG1-CD1 3.51Å; A306-L310 WeakPolarHBondContact O-CB 3.33Å; A306-L310 WeakPolarHBondContact O-CG 3.44Å; A306-L310 PolarHBondContact O-N 2.98Å; A307-L310 PolarHBondContact O-N 3.4Å; L310-T312 VanDerWaalsContact C-N 3.31Å; L310-T312 PolarHBondContact O-N 3.24Å; L310-L313 PolarHBondContact O-N 2.94Å; L310-S314 WeakPolarHBondContact O-CB 3.33Å; L310-S314 PolarHBondContact O-N 3.36Å |
| 311 | L | 95.2 | Very high | 94.2 | Very high | 1 Ų | 1 | 31.2 Ų | 31.2 | 1% | 0.005 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.9 | -39.8 | 174.8 | -72.9 | 162.9 | 0 | 0 | 0 | 111.2 | L223 L227 Y230 F231 V297 A307 V308 S314 V315 F376 | L223-L311 HydrophobicContact CD2-CD2 3.91Å; L227-L311 HydrophobicContact CD1-CB 4.44Å; L227-L311 HydrophobicContact CD1-CD1 3.62Å; L227-L311 HydrophobicContact CD1-CD2 4.4Å; L227-L311 HydrophobicContact CD1-CG 4.36Å; Y230-L311 HydrophobicContact CD1-CD1 3.96Å; Y230-L311 HydrophobicContact CE1-CD1 3.81Å; F231-L311 HydrophobicContact CE1-CD1 3.73Å; F231-L311 HydrophobicContact CZ-CD1 4.29Å; V297-L311 HydrophobicContact CB-CG 4.49Å; V297-L311 HydrophobicContact CG1-CD1 4.03Å; V297-L311 HydrophobicContact CG1-CD2 4.21Å; V297-L311 HydrophobicContact CG1-CG 4.01Å; V297-L311 HydrophobicContact CG2-CD2 3.92Å; V297-L311 HydrophobicContact CG2-CG 3.68Å; A307-L311 WeakPolarHBondContact O-CB 3.08Å; A307-L311 WeakPolarHBondContact O-CD1 3.29Å; A307-L311 VanDerWaalsContact O-CG 3.27Å; A307-L311 WeakPolarHBondContact O-CG 3.06Å; A307-L311 PolarHBondContact O-N 3.44Å; V308-L311 PolarHBondContact O-N 2.88Å; L311-S314 PolarHBondContact O-N 3.22Å; L311-V315 WeakPolarHBondContact O-CG2 3.38Å; L311-V315 PolarHBondContact O-N 3.48Å; L311-F376 HydrophobicContact CD2-CE1 4.15Å; L311-F376 HydrophobicContact CD2-CZ 4.42Å |
| 312 | T | 95.9 | Very high | 94.5 | Very high | 17 Ų | 17 | 30 Ų | 30 | 10% | 0.104 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62 | -45.5 | 174.6 | -61 | 0 | 0 | 0 | 0 | 111.6 | I248 V252 V308 A309 L310 S314 G316 | I248-T312 HydrophobicContact CG2-CG2 3.75Å; V252-T312 HydrophobicContact CB-CG2 4.04Å; V252-T312 HydrophobicContact CG1-CG2 4.43Å; V252-T312 HydrophobicContact CG2-CG2 3.57Å; V308-T312 VanDerWaalsContact O-CB 3.26Å; V308-T312 WeakPolarHBondContact O-CB 3.32Å; V308-T312 PolarHBondContact O-N 3.5Å; V308-T312 PolarHBondContact O-OG1 3.36Å; A309-T312 WeakPolarHBondContact O-CB 3.16Å; A309-T312 PolarHBondContact O-N 2.98Å; L310-T312 VanDerWaalsContact C-N 3.31Å; L310-T312 PolarHBondContact O-N 3.24Å; T312-S314 VanDerWaalsContact C-N 3.35Å; T312-G316 VanDerWaalsContact O-CA 3.3Å; T312-G316 WeakPolarHBondContact O-CA 3.38Å; T312-G316 PolarHBondContact O-N 3.31Å |
| 313 | L | 97.1 | Very high | 94.9 | Very high | 74 Ų | 74 | 24.7 Ų | 24.7 | 39% | 0.387 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -64 | -41.3 | 175.3 | -69.2 | 168.3 | 0 | 0 | 0 | 111.2 | A309 L310 F317 | A309-L313 VanDerWaalsContact O-CG 3.3Å; A309-L313 WeakPolarHBondContact O-CG 3.01Å; A309-L313 PolarHBondContact O-N 3.26Å; L310-L313 PolarHBondContact O-N 2.94Å; L313-F317 HydrophobicContact CB-CD2 4.43Å; L313-F317 HydrophobicContact CD2-CD2 4.21Å; L313-F317 HydrophobicContact CD2-CE2 3.76Å; L313-F317 WeakPolarHBondContact O-CB 3.42Å; L313-F317 WeakPolarHBondContact O-CD2 3.5Å; L313-F317 PolarHBondContact O-N 2.88Å |
| 314 | S | 96.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.2 | -56.5 | 179.5 | -175.3 | 0 | 0 | 0 | 0 | 112.2 | P290 L310 L311 T312 G316 S318 | P290-S314 WeakPolarHBondContact CA-OG 3.32Å; P290-S314 WeakPolarHBondContact CB-O 3.09Å; P290-S314 WeakPolarHBondContact CB-OG 3.38Å; P290-S314 WeakPolarHBondContact CG-O 3.46Å; P290-S314 PolarHBondContact O-OG 3.28Å; L310-S314 WeakPolarHBondContact O-CB 3.33Å; L310-S314 PolarHBondContact O-N 3.36Å; L311-S314 PolarHBondContact O-N 3.22Å; T312-S314 VanDerWaalsContact C-N 3.35Å; S314-G316 VanDerWaalsContact C-N 3.31Å; S314-G316 PolarHBondContact O-N 2.91Å; S314-S318 PolarHBondContact O-N 2.86Å |
| 315 | V | 96.1 | Very high | 95.5 | Very high | 5 Ų | 5 | 19 Ų | 19 | 3% | 0.03 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -66.1 | -40.5 | 179.3 | 178.6 | 0 | 0 | 0 | 0 | 109.9 | L223 P249 Y250 Q253 L311 S318 | L223-V315 HydrophobicContact CD1-CG2 3.64Å; P249-V315 HydrophobicContact CB-CB 3.64Å; P249-V315 HydrophobicContact CB-CG1 3.92Å; P249-V315 HydrophobicContact CB-CG2 3.88Å; Y250-V315 HydrophobicContact CD1-CG1 3.76Å; Y250-V315 HydrophobicContact CE1-CG1 3.75Å; Y250-V315 HydrophobicContact CG-CG1 4.46Å; Q253-V315 HydrophobicContact CB-CG1 4.11Å; Q253-V315 WeakPolarHBondContact CB-O 3.46Å; Q253-V315 HydrophobicContact CG-CG1 4.49Å; Q253-V315 WeakPolarHBondContact CG-O 3.4Å; L311-V315 WeakPolarHBondContact O-CG2 3.38Å; L311-V315 PolarHBondContact O-N 3.48Å; V315-S318 WeakPolarHBondContact O-CB 3.25Å; V315-S318 PolarHBondContact O-N 2.88Å; V315-S318 PolarHBondContact O-OG 2.82Å |
| 316 | G | 96.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 15.7 Ų | 15.7 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -54.7 | -58.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | T312 S314 S318 G319 | T312-G316 VanDerWaalsContact O-CA 3.3Å; T312-G316 WeakPolarHBondContact O-CA 3.38Å; T312-G316 PolarHBondContact O-N 3.31Å; S314-G316 VanDerWaalsContact C-N 3.31Å; S314-G316 PolarHBondContact O-N 2.91Å; G316-S318 PolarHBondContact O-N 3.38Å; G316-G319 PolarHBondContact O-N 2.96Å |
| 317 | F | 97.6 | Very high | 95.7 | Very high | 63 Ų | 63 | 14.4 Ų | 14.4 | 28% | 0.276 | 8% | 0.082 | S | C | . | . | H | α-helix | trans | -69.8 | -19.4 | -176.9 | -83 | -80.4 | 0 | 0 | 0 | 113.5 | I256 G286 I289 P290 L313 G319 L320 | I256-F317 HydrophobicContact CD1-CD1 4.31Å; I256-F317 HydrophobicContact CD1-CD2 4.28Å; I256-F317 HydrophobicContact CD1-CE1 4.42Å; I256-F317 HydrophobicContact CD1-CE2 4.38Å; I256-F317 HydrophobicContact CD1-CG 4.25Å; I256-F317 HydrophobicContact CD1-CZ 4.46Å; G286-F317 WeakPolarHBondContact CA-O 3.42Å; I289-F317 HydrophobicContact CB-CB 4Å; I289-F317 HydrophobicContact CB-CG 4.24Å; I289-F317 HydrophobicContact CD1-CB 4.43Å; I289-F317 HydrophobicContact CD1-CD1 3.62Å; I289-F317 HydrophobicContact CD1-CE1 3.99Å; I289-F317 HydrophobicContact CD1-CG 4.02Å; I289-F317 HydrophobicContact CG2-CB 3.77Å; I289-F317 HydrophobicContact CG2-CD1 4.41Å; I289-F317 HydrophobicContact CG2-CD2 3.73Å; I289-F317 HydrophobicContact CG2-CE2 4.45Å; I289-F317 HydrophobicContact CG2-CG 3.71Å; P290-F317 HydrophobicContact CG-CB 4.21Å; L313-F317 HydrophobicContact CB-CD2 4.43Å; L313-F317 HydrophobicContact CD2-CD2 4.21Å; L313-F317 HydrophobicContact CD2-CE2 3.76Å; L313-F317 WeakPolarHBondContact O-CB 3.42Å; L313-F317 WeakPolarHBondContact O-CD2 3.5Å; L313-F317 PolarHBondContact O-N 2.88Å; F317-G319 PolarHBondContact O-N 2.76Å; F317-G319 VanDerWaalsContact O-N 3.13Å; F317-L320 HydrophobicContact CD1-CD1 3.88Å; F317-L320 HydrophobicContact CD1-CG 4.39Å; F317-L320 WeakPolarHBondContact O-CB 3.37Å; F317-L320 WeakPolarHBondContact O-CG 3.29Å; F317-L320 PolarHBondContact O-N 2.81Å |
| 318 | S | 97 | Very high | 95.8 | Very high | 3 Ų | 3 | 14.4 Ų | 14.4 | 2% | 0.021 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -60.6 | -19.3 | 168.6 | 82.5 | 0 | 0 | 0 | 0 | 112.8 | Q253 G286 S314 V315 G316 L320 C321 | Q253-S318 PolarHBondContact NE2-OG 3.21Å; G286-S318 WeakPolarHBondContact O-CA 3.42Å; S314-S318 PolarHBondContact O-N 2.86Å; V315-S318 WeakPolarHBondContact O-CB 3.25Å; V315-S318 PolarHBondContact O-N 2.88Å; V315-S318 PolarHBondContact O-OG 2.82Å; G316-S318 PolarHBondContact O-N 3.38Å; S318-L320 PolarHBondContact O-N 3.44Å; S318-C321 VanDerWaalsContact O-CB 3.28Å; S318-C321 WeakPolarHBondContact O-CB 3.36Å; S318-C321 PolarHBondContact O-N 2.96Å; S318-C321 VanDerWaalsContact O-N 3.12Å; S318-C321 PolarHBondContact O-SG 3.18Å; S318-C321 VanDerWaalsContact O-SG 3.39Å |
| 319 | G | 96.7 | Very high | 95.9 | Very high | 0 Ų | 0 | 13.6 Ų | 13.6 | 0% | 0 | 8% | 0.077 | C | C | . | . | G | 310 helix | trans | -59.2 | -23.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q257 G316 F317 C321 G322 | Q257-G319 WeakPolarHBondContact CA-O 3.18Å; Q257-G319 WeakPolarHBondContact CG-O 3.47Å; G316-G319 PolarHBondContact O-N 2.96Å; F317-G319 PolarHBondContact O-N 2.76Å; F317-G319 VanDerWaalsContact O-N 3.13Å; G319-C321 PolarHBondContact O-N 3.28Å; G319-G322 PolarHBondContact O-N 3.32Å |
| 320 | L | 97.5 | Very high | 95.8 | Very high | 28 Ų | 28 | 11.2 Ų | 11.2 | 15% | 0.147 | 6% | 0.057 | C | C | . | . | G | 310 helix | trans | -60 | -27.2 | 174.6 | -67.7 | 177.3 | 0 | 0 | 0 | 112.7 | I256 A260 M282 F285 F317 S318 G322 G323 | I256-L320 HydrophobicContact CG2-CD2 3.92Å; I256-L320 HydrophobicContact CG2-CG 4.01Å; A260-L320 HydrophobicContact CB-CD2 4.27Å; M282-L320 HydrophobicContact CE-CB 4.36Å; M282-L320 HydrophobicContact CE-CD2 3.85Å; M282-L320 WeakPolarHBondContact O-CB 3.37Å; F285-L320 HydrophobicContact CB-CD1 3.81Å; F317-L320 HydrophobicContact CD1-CD1 3.88Å; F317-L320 HydrophobicContact CD1-CG 4.39Å; F317-L320 WeakPolarHBondContact O-CB 3.37Å; F317-L320 WeakPolarHBondContact O-CG 3.29Å; F317-L320 PolarHBondContact O-N 2.81Å; S318-L320 PolarHBondContact O-N 3.44Å; L320-G322 PolarHBondContact O-N 3.46Å; L320-G323 PolarHBondContact O-N 3.38Å |
| 321 | C | 96.6 | Very high | 95.6 | Very high | 0 Ų | 0 | 9.9 Ų | 9.9 | 0% | 0 | 5% | 0.05 | C | C | . | . | G | 310 helix | trans | -59.6 | -19.3 | 176 | -61.8 | 0 | 0 | 0 | 0 | 113.1 | Y216 H287 S318 G319 G323 G324 F325 F326 | Y216-C321 HydrophobicContact CD2-CB 4.23Å; Y216-C321 HydrophobicContact CE2-CB 4.4Å; H287-C321 PolarHBondContact CE1-SG 3.46Å; H287-C321 PolarHBondContact ND1-SG 3.08Å; S318-C321 VanDerWaalsContact O-CB 3.28Å; S318-C321 WeakPolarHBondContact O-CB 3.36Å; S318-C321 PolarHBondContact O-N 2.96Å; S318-C321 VanDerWaalsContact O-N 3.12Å; S318-C321 PolarHBondContact O-SG 3.18Å; S318-C321 VanDerWaalsContact O-SG 3.39Å; G319-C321 PolarHBondContact O-N 3.28Å; C321-G323 PolarHBondContact O-N 2.9Å; C321-G324 CarbonylContact O-C 3.45Å; C321-G324 WeakPolarHBondContact O-CA 3.35Å; C321-G324 PolarHBondContact O-N 3.34Å; C321-F325 HydrophobicContact CB-CD1 3.89Å; C321-F325 HydrophobicContact CB-CE1 3.69Å; C321-F326 HydrophobicContact CB-CD2 4.33Å; C321-F326 PolarHBondContact O-N 3.41Å |
| 322 | G | 93.5 | Very high | 95.5 | Very high | 0 Ų | 0 | 9.8 Ų | 9.8 | 0% | 0 | 5% | 0.05 | C | C | . | . | G | 310 helix | trans | -54.8 | -37.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 113 | S107 G319 L320 V327 | S107-G322 PolarHBondContact OG-O 2.94Å; G319-G322 PolarHBondContact O-N 3.32Å; L320-G322 PolarHBondContact O-N 3.46Å; G322-V327 WeakPolarHBondContact O-CG1 3.27Å; G322-V327 WeakPolarHBondContact O-CG2 3.37Å |
| 323 | G | 94.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 9 Ų | 9 | 0% | 0 | 5% | 0.045 | C | C | . | . | G | 310 helix | trans | -90.1 | -1.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | R279 L320 C321 | R279-G323 VanDerWaalsContact CD-O 3.23Å; R279-G323 WeakPolarHBondContact CD-O 3.37Å; R279-G323 PolarHBondContact NH1-O 2.88Å; L320-G323 PolarHBondContact O-N 3.38Å; C321-G323 PolarHBondContact O-N 2.9Å |
| 324 | G | 95.7 | Very high | 94.9 | Very high | 0 Ų | 0 | 5.9 Ų | 5.9 | 0% | 0 | 3% | 0.029 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.2 | -121.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | C321 F326 V327 N328 | C321-G324 CarbonylContact O-C 3.45Å; C321-G324 WeakPolarHBondContact O-CA 3.35Å; C321-G324 PolarHBondContact O-N 3.34Å; G324-F326 VanDerWaalsContact C-N 3.27Å; G324-F326 PolarHBondContact O-N 3.1Å; G324-V327 WeakPolarHBondContact O-CG2 3.44Å; G324-V327 PolarHBondContact O-N 3.31Å; G324-N328 WeakPolarHBondContact O-CB 3.39Å; G324-N328 PolarHBondContact O-N 3.2Å |
| 325 | F | 95.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 7.3 Ų | 7.3 | 0% | 0 | 4% | 0.036 | C | C | . | . | H | α-helix | trans | -58.3 | -34.1 | -175.3 | 83.4 | -94.5 | 0 | 0 | 0 | 113.9 | A209 S212 H213 Y216 D283 C321 V327 N328 Y329 Y390 | A209-F325 HydrophobicContact CB-CB 4.35Å; S212-F325 VanDerWaalsContact OG-CD1 3.27Å; S212-F325 WeakPolarHBondContact OG-CD1 3.42Å; H213-F325 HydrophobicContact CB-CD2 3.67Å; H213-F325 HydrophobicContact CB-CE2 3.37Å; H213-F325 HydrophobicContact CB-CZ 3.96Å; H213-F325 AromaticContact CD2-CE2 3.53Å; H213-F325 AromaticContact CD2-CZ 3.73Å; H213-F325 AromaticContact CG-CE2 3.35Å; H213-F325 AromaticContact CG-CZ 3.95Å; H213-F325 AromaticContact ND1-CE2 3.94Å; Y216-F325 HydrophobicContact CD1-CE1 4.2Å; Y216-F325 AromaticContact CD1-CZ 3.89Å; Y216-F325 HydrophobicContact CD1-CZ 3.89Å; Y216-F325 HydrophobicContact CD2-CE1 4.25Å; Y216-F325 AromaticContact CG-CE1 3.8Å; Y216-F325 HydrophobicContact CG-CE1 3.8Å; Y216-F325 AromaticContact CG-CZ 3.96Å; Y216-F325 HydrophobicContact CG-CZ 3.96Å; D283-F325 WeakPolarHBondContact OD1-CB 3.43Å; D283-F325 WeakPolarHBondContact OD1-CD1 3.42Å; D283-F325 PolarHBondContact OD1-N 3.03Å; C321-F325 HydrophobicContact CB-CD1 3.89Å; C321-F325 HydrophobicContact CB-CE1 3.69Å; F325-V327 VanDerWaalsContact C-N 3.26Å; F325-V327 PolarHBondContact O-N 3.17Å; F325-N328 WeakPolarHBondContact O-CB 3.36Å; F325-N328 PolarHBondContact O-N 3.47Å; F325-Y329 HydrophobicContact CD2-CE2 4.18Å; F325-Y329 WeakPolarHBondContact O-CD2 3.37Å; F325-Y329 WeakPolarHBondContact O-CE2 3.33Å; F325-Y390 HydrophobicContact CB-CE2 4.24Å |
| 326 | F | 94.4 | Very high | 94 | Very high | 5 Ų | 5 | 8.6 Ų | 8.6 | 2% | 0.022 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -57.2 | -40.6 | -174.1 | -96 | -74 | 0 | 0 | 0 | 112.6 | W86 I110 Y216 C321 G324 F341 | W86-F326 HydrophobicContact CZ3-CE1 4.08Å; I110-F326 HydrophobicContact CD1-CD1 3.92Å; I110-F326 HydrophobicContact CD1-CE1 4.46Å; I110-F326 HydrophobicContact CD1-CG 4.42Å; Y216-F326 HydrophobicContact CD1-CE2 4.04Å; Y216-F326 HydrophobicContact CD1-CZ 4.21Å; Y216-F326 AromaticContact CE1-CE2 3.64Å; Y216-F326 HydrophobicContact CE1-CE2 3.64Å; Y216-F326 AromaticContact CE1-CZ 3.73Å; Y216-F326 HydrophobicContact CE1-CZ 3.73Å; Y216-F326 HydrophobicContact CE2-CE2 4.42Å; Y216-F326 AromaticContact CZ-CE2 3.85Å; C321-F326 HydrophobicContact CB-CD2 4.33Å; C321-F326 PolarHBondContact O-N 3.41Å; G324-F326 VanDerWaalsContact C-N 3.27Å; G324-F326 PolarHBondContact O-N 3.1Å; F326-F341 HydrophobicContact CD1-CE2 4.01Å; F326-F341 HydrophobicContact CD1-CZ 4.1Å; F326-F341 HydrophobicContact CE1-CE2 4.38Å; F326-F341 HydrophobicContact CE1-CZ 4.02Å |
| 327 | V | 94.7 | Very high | 93.7 | Very high | 0 Ų | 0 | 8.6 Ų | 8.6 | 0% | 0 | 4% | 0.04 | C | C | . | . | H | α-helix | trans | -95.9 | -9.1 | 178.5 | -66.2 | 0 | 0 | 0 | 0 | 112.5 | R102 P106 G322 G324 F325 Y329 L330 | R102-V327 WeakPolarHBondContact O-CG1 3.41Å; P106-V327 HydrophobicContact CB-CG1 3.69Å; P106-V327 HydrophobicContact CG-CG1 3.9Å; G322-V327 WeakPolarHBondContact O-CG1 3.27Å; G322-V327 WeakPolarHBondContact O-CG2 3.37Å; G324-V327 WeakPolarHBondContact O-CG2 3.44Å; G324-V327 PolarHBondContact O-N 3.31Å; F325-V327 VanDerWaalsContact C-N 3.26Å; F325-V327 PolarHBondContact O-N 3.17Å; V327-Y329 VanDerWaalsContact C-N 3.28Å; V327-Y329 PolarHBondContact O-N 3.01Å; V327-L330 HydrophobicContact CB-CD1 4.34Å; V327-L330 HydrophobicContact CG1-CD1 4.43Å; V327-L330 VanDerWaalsContact O-CB 3.27Å; V327-L330 WeakPolarHBondContact O-CB 3.46Å; V327-L330 PolarHBondContact O-N 3.32Å |
| 328 | N | 96.3 | Very high | 93.3 | Very high | 0 Ų | 0 | 5.8 Ų | 5.8 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -65.6 | -31.3 | -174.3 | -171.8 | -157.8 | 0 | 0 | 0 | 112.8 | G324 F325 L330 D331 L332 Y390 K395 | G324-N328 WeakPolarHBondContact O-CB 3.39Å; G324-N328 PolarHBondContact O-N 3.2Å; F325-N328 WeakPolarHBondContact O-CB 3.36Å; F325-N328 PolarHBondContact O-N 3.47Å; N328-L330 PolarHBondContact O-N 2.88Å; N328-D331 WeakPolarHBondContact O-CB 3.49Å; N328-D331 PolarHBondContact O-N 3.49Å; N328-L332 WeakPolarHBondContact O-CG 3.47Å; N328-L332 PolarHBondContact O-N 3.41Å; N328-Y390 PolarHBondContact OD1-OH 2.92Å; N328-K395 PolarHBondContact ND2-O 3.34Å; N328-K395 PolarHBondContact OD1-O 3.38Å |
| 329 | Y | 94.6 | Very high | 93.1 | Very high | 0 Ų | 0 | 5.9 Ų | 5.9 | 0% | 0 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -61.8 | -27.9 | 174.4 | -58.3 | -79.7 | 0 | 0 | 0 | 113.4 | A209 M210 F325 V327 D331 C333 T337 V340 F341 S344 | A209-Y329 HydrophobicContact CB-CE1 3.83Å; A209-Y329 HydrophobicContact CB-CE2 4.2Å; A209-Y329 WeakPolarHBondContact CB-OH 3.32Å; A209-Y329 PolarHBondContact O-OH 2.97Å; M210-Y329 PolarHBondContact N-OH 2.96Å; F325-Y329 HydrophobicContact CD2-CE2 4.18Å; F325-Y329 WeakPolarHBondContact O-CD2 3.37Å; F325-Y329 WeakPolarHBondContact O-CE2 3.33Å; V327-Y329 VanDerWaalsContact C-N 3.28Å; V327-Y329 PolarHBondContact O-N 3.01Å; Y329-D331 VanDerWaalsContact C-N 3.28Å; Y329-C333 CarbonylContact O-C 3.28Å; Y329-C333 PolarHBondContact O-N 2.92Å; Y329-C333 VanDerWaalsContact O-N 3.12Å; Y329-C333 PolarHBondContact O-SG 3.37Å; Y329-T337 PolarHBondContact O-OG1 2.96Å; Y329-V340 HydrophobicContact CD1-CB 4.37Å; Y329-V340 HydrophobicContact CD1-CG1 3.59Å; Y329-V340 HydrophobicContact CE1-CG1 3.82Å; Y329-F341 AromaticContact CD2-CD2 3.61Å; Y329-F341 HydrophobicContact CD2-CD2 3.61Å; Y329-F341 HydrophobicContact CD2-CE2 4.26Å; Y329-F341 AromaticContact CE2-CD2 3.75Å; Y329-F341 HydrophobicContact CE2-CD2 3.75Å; Y329-F341 HydrophobicContact CE2-CE2 4.16Å; Y329-F341 HydrophobicContact CG-CD2 4.4Å; Y329-S344 WeakPolarHBondContact OH-CB 3.5Å; Y329-S344 PolarHBondContact OH-OG 3.35Å |
| 330 | L | 92.6 | Very high | 93 | Very high | 1 Ų | 1 | 5.9 Ų | 5.9 | 1% | 0.005 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -71 | -28 | 174.6 | -61 | 165.9 | 0 | 0 | 0 | 111 | F93 A94 R102 P106 V327 N328 P334 T337 | F93-L330 HydrophobicContact CB-CD1 4.14Å; F93-L330 HydrophobicContact CB-CD2 4.22Å; A94-L330 HydrophobicContact CB-CD2 3.73Å; R102-L330 HydrophobicContact CG-CB 3.8Å; R102-L330 HydrophobicContact CG-CD1 3.77Å; R102-L330 HydrophobicContact CG-CG 4.42Å; R102-L330 PolarHBondContact NH1-O 2.86Å; P106-L330 HydrophobicContact CG-CD1 3.92Å; V327-L330 HydrophobicContact CB-CD1 4.34Å; V327-L330 HydrophobicContact CG1-CD1 4.43Å; V327-L330 VanDerWaalsContact O-CB 3.27Å; V327-L330 WeakPolarHBondContact O-CB 3.46Å; V327-L330 PolarHBondContact O-N 3.32Å; N328-L330 PolarHBondContact O-N 2.88Å; L330-P334 WeakPolarHBondContact O-CD 3.14Å; L330-P334 VanDerWaalsContact O-CG 3.23Å; L330-P334 WeakPolarHBondContact O-CG 3.05Å; L330-T337 HydrophobicContact CD2-CG2 3.53Å; L330-T337 HydrophobicContact CG-CG2 3.94Å |
| 331 | D | 92.7 | Very high | 92.9 | Very high | 10 Ų | 10 | 4.5 Ų | 4.5 | 5% | 0.053 | 2% | 0.022 | C | C | . | . | H | α-helix | trans | -83.9 | -36.6 | 175.9 | -53.8 | -45.8 | 0 | 0 | 0 | 112 | R102 T275 R279 N328 Y329 T397 L398 | R102-D331 WeakPolarHBondContact CD-OD1 3.3Å; R102-D331 IonicContact NH1-OD1 2.74Å; T275-D331 HydrophobicContact CG2-CB 4.38Å; R279-D331 IonicContact CZ-OD2 3.09Å; R279-D331 IonicContact NE-OD2 3.53Å; R279-D331 PolarHBondContact NE-OD2 3.49Å; R279-D331 IonicContact NH2-OD1 3.75Å; R279-D331 IonicContact NH2-OD2 2.71Å; R279-D331 PolarHBondContact NH2-OD2 2.93Å; R279-D331 VanDerWaalsContact NH2-OD2 3.09Å; N328-D331 WeakPolarHBondContact O-CB 3.49Å; N328-D331 PolarHBondContact O-N 3.49Å; Y329-D331 VanDerWaalsContact C-N 3.28Å; D331-T397 CarbonylContact O-C 3.58Å; D331-L398 VanDerWaalsContact O-CA 3.29Å; D331-L398 WeakPolarHBondContact O-CA 3.24Å; D331-L398 PolarHBondContact O-N 3.24Å |
| 332 | L | 93.6 | Very high | 92.8 | Very high | 0 Ų | 0 | 4.5 Ų | 4.5 | 0% | 0 | 2% | 0.022 | C | C | . | . | H | α-helix | trans | -78.2 | -37.9 | -174.3 | -68.3 | 174.1 | 0 | 0 | 0 | 113.1 | P205 I206 N328 K395 Q399 | P205-L332 HydrophobicContact CB-CD1 4.23Å; P205-L332 HydrophobicContact CB-CD2 3.86Å; I206-L332 HydrophobicContact CD1-CB 4.01Å; I206-L332 HydrophobicContact CD1-CD1 3.79Å; N328-L332 WeakPolarHBondContact O-CG 3.47Å; N328-L332 PolarHBondContact O-N 3.41Å; L332-K395 HydrophobicContact CD2-CB 4.19Å; L332-K395 VanDerWaalsContact CD2-O 3.29Å; L332-K395 WeakPolarHBondContact CD2-O 3.29Å; L332-Q399 HydrophobicContact CB-CG 4.23Å; L332-Q399 HydrophobicContact CD2-CG 3.96Å; L332-Q399 PolarHBondContact O-N 3.43Å |
| 333 | C | 91.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 5.4 Ų | 5.4 | 0% | 0 | 3% | 0.027 | C | C | . | . | trans | -160.5 | 63.8 | -171.1 | 52.7 | 0 | 0 | 0 | 0 | 112.7 | Y329 Q335 Y336 T337 W401 A402 | Y329-C333 CarbonylContact O-C 3.28Å; Y329-C333 PolarHBondContact O-N 2.92Å; Y329-C333 VanDerWaalsContact O-N 3.12Å; Y329-C333 PolarHBondContact O-SG 3.37Å; C333-Q335 PolarHBondContact O-N 3.37Å; C333-Q335 VanDerWaalsContact O-N 3.08Å; C333-Y336 CarbonylContact O-C 3.58Å; C333-Y336 PolarHBondContact O-N 2.85Å; C333-T337 PolarHBondContact O-N 3.39Å; C333-T337 PolarHBondContact O-OG1 3.41Å; C333-W401 HydrophobicContact CB-CH2 3.53Å; C333-W401 HydrophobicContact CB-CZ2 4.44Å; C333-W401 HydrophobicContact CB-CZ3 3.95Å; C333-A402 HydrophobicContact CB-CB 4.03Å | ||
| 334 | P | 87.9 | Confident | 93 | Very high | 9 Ų | 9 | 5.4 Ų | 5.4 | 6% | 0.058 | 3% | 0.027 | C | C | . | . | G | 310 helix | trans | -47.3 | -42.1 | -174 | -15.6 | 15.2 | 0 | 0 | 0 | 114.7 | A94 L330 Y336 T337 L398 | A94-P334 WeakPolarHBondContact CB-O 3.35Å; L330-P334 WeakPolarHBondContact O-CD 3.14Å; L330-P334 VanDerWaalsContact O-CG 3.23Å; L330-P334 WeakPolarHBondContact O-CG 3.05Å; P334-Y336 VanDerWaalsContact C-N 3.29Å; P334-Y336 PolarHBondContact O-N 3.36Å; P334-T337 VanDerWaalsContact CA-OG1 3.23Å; P334-T337 WeakPolarHBondContact CA-OG1 3.45Å; P334-T337 PolarHBondContact O-N 3.46Å; P334-T337 PolarHBondContact O-OG1 3.39Å; P334-T337 VanDerWaalsContact O-OG1 3.12Å; P334-L398 VanDerWaalsContact CD-CD1 3.48Å; P334-L398 HydrophobicContact CG-CD1 4.24Å |
| 335 | Q | 84.2 | Confident | 93 | Very high | 29 Ų | 29 | 5.6 Ų | 5.6 | 14% | 0.136 | 3% | 0.027 | C | C | . | . | G | 310 helix | trans | -74.2 | -19.1 | -177.2 | 75.8 | -81.1 | 25.5 | 0 | 0 | 113.9 | C333 A402 | C333-Q335 PolarHBondContact O-N 3.37Å; C333-Q335 VanDerWaalsContact O-N 3.08Å; Q335-A402 VanDerWaalsContact NE2-C 3.32Å; Q335-A402 VanDerWaalsContact NE2-CA 3.32Å; Q335-A402 PolarHBondContact NE2-O 3.24Å |
| 336 | Y | 89.3 | Confident | 92.9 | Very high | 33 Ų | 33 | 6.8 Ų | 6.8 | 13% | 0.129 | 4% | 0.035 | C | C | . | . | G | 310 helix | trans | -113.8 | 4.4 | 179.1 | -56 | -62.5 | 0 | 0 | 0 | 112.3 | P196 C333 P334 G338 L339 V340 W401 | P196-Y336 HydrophobicContact CG-CE2 4.09Å; C333-Y336 CarbonylContact O-C 3.58Å; C333-Y336 PolarHBondContact O-N 2.85Å; P334-Y336 VanDerWaalsContact C-N 3.29Å; P334-Y336 PolarHBondContact O-N 3.36Å; Y336-G338 VanDerWaalsContact C-N 3.32Å; Y336-G338 PolarHBondContact O-N 3.3Å; Y336-L339 PolarHBondContact O-N 3.22Å; Y336-V340 WeakPolarHBondContact O-CG2 3.18Å; Y336-V340 PolarHBondContact O-N 2.95Å; Y336-W401 AromaticContact CD2-CZ3 3.86Å; Y336-W401 HydrophobicContact CD2-CZ3 3.86Å; Y336-W401 HydrophobicContact CE2-CZ3 4.33Å |
| 337 | T | 91.3 | Very high | 93 | Very high | 0 Ų | 0 | 9.7 Ų | 9.7 | 0% | 0 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -52 | -47.4 | -173.3 | -57.7 | 0 | 0 | 0 | 0 | 111.9 | Q90 Y329 L330 C333 P334 L339 V340 F341 | Q90-T337 HydrophobicContact CB-CG2 3.93Å; Y329-T337 PolarHBondContact O-OG1 2.96Å; L330-T337 HydrophobicContact CD2-CG2 3.53Å; L330-T337 HydrophobicContact CG-CG2 3.94Å; C333-T337 PolarHBondContact O-N 3.39Å; C333-T337 PolarHBondContact O-OG1 3.41Å; P334-T337 VanDerWaalsContact CA-OG1 3.23Å; P334-T337 WeakPolarHBondContact CA-OG1 3.45Å; P334-T337 PolarHBondContact O-N 3.46Å; P334-T337 PolarHBondContact O-OG1 3.39Å; P334-T337 VanDerWaalsContact O-OG1 3.12Å; T337-L339 PolarHBondContact O-N 3.3Å; T337-V340 PolarHBondContact O-N 3.44Å; T337-F341 WeakPolarHBondContact O-CB 3.34Å; T337-F341 PolarHBondContact O-N 3.06Å |
| 338 | G | 90.3 | Very high | 93 | Very high | 3 Ų | 3 | 9.7 Ų | 9.7 | 3% | 0.031 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -59.6 | -43.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113.4 | P87 Y336 G342 | P87-G338 WeakPolarHBondContact CB-O 3.24Å; P87-G338 WeakPolarHBondContact O-CA 3.12Å; Y336-G338 VanDerWaalsContact C-N 3.32Å; Y336-G338 PolarHBondContact O-N 3.3Å; G338-G342 PolarHBondContact O-N 2.87Å |
| 339 | L | 91.6 | Very high | 92.7 | Very high | 5 Ų | 5 | 9.7 Ų | 9.7 | 3% | 0.026 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -68 | -49.6 | 177.9 | 173.9 | 63 | 0 | 0 | 0 | 111.9 | I31 L35 I195 L197 Y336 T337 F341 G342 I343 | I31-L339 HydrophobicContact CG2-CD1 3.9Å; L35-L339 HydrophobicContact CD2-CD1 3.86Å; L35-L339 HydrophobicContact CD2-CD2 4.12Å; L35-L339 HydrophobicContact CD2-CG 4.47Å; L35-L339 HydrophobicContact CG-CD1 4.03Å; I195-L339 HydrophobicContact CD1-CD2 3.92Å; I195-L339 HydrophobicContact CG2-CD2 3.63Å; L197-L339 HydrophobicContact CD2-CD2 4.46Å; Y336-L339 PolarHBondContact O-N 3.22Å; T337-L339 PolarHBondContact O-N 3.3Å; L339-F341 VanDerWaalsContact C-N 3.34Å; L339-G342 WeakPolarHBondContact O-CA 3.06Å; L339-G342 PolarHBondContact O-N 3.41Å; L339-G342 VanDerWaalsContact O-N 3.14Å; L339-I343 HydrophobicContact CD1-CD1 4.39Å; L339-I343 HydrophobicContact CG-CD1 4.3Å; L339-I343 WeakPolarHBondContact O-CG1 3.27Å; L339-I343 PolarHBondContact O-N 3.45Å |
| 340 | V | 94.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 12.3 Ų | 12.3 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -65.5 | -41 | -177.4 | 177.9 | 0 | 0 | 0 | 0 | 110.5 | I200 I206 M210 Y329 Y336 T337 G342 I343 S344 | I200-V340 HydrophobicContact CD1-CG2 4.14Å; I200-V340 HydrophobicContact CG1-CG2 4.36Å; I200-V340 HydrophobicContact CG2-CG1 4.49Å; I200-V340 HydrophobicContact CG2-CG2 3.89Å; I206-V340 HydrophobicContact CD1-CG1 3.98Å; I206-V340 HydrophobicContact CG2-CG1 3.74Å; M210-V340 HydrophobicContact CE-CG1 4.1Å; Y329-V340 HydrophobicContact CD1-CB 4.37Å; Y329-V340 HydrophobicContact CD1-CG1 3.59Å; Y329-V340 HydrophobicContact CE1-CG1 3.82Å; Y336-V340 WeakPolarHBondContact O-CG2 3.18Å; Y336-V340 PolarHBondContact O-N 2.95Å; T337-V340 PolarHBondContact O-N 3.44Å; V340-G342 VanDerWaalsContact C-N 3.32Å; V340-I343 PolarHBondContact O-N 3Å; V340-S344 WeakPolarHBondContact O-CB 2.88Å; V340-S344 PolarHBondContact O-N 2.89Å |
| 341 | F | 94.8 | Very high | 92.4 | Very high | 0 Ų | 0 | 12.2 Ų | 12.2 | 0% | 0 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -63 | -40.8 | 172.5 | -166.8 | -80.6 | 0 | 0 | 0 | 110.8 | W86 Q90 H213 F326 Y329 T337 L339 I343 S344 N345 | W86-F341 HydrophobicContact CB-CD1 4.27Å; W86-F341 HydrophobicContact CB-CE1 3.76Å; W86-F341 HydrophobicContact CE3-CE1 4.41Å; W86-F341 HydrophobicContact CE3-CZ 4.35Å; W86-F341 HydrophobicContact CG-CE1 4.44Å; Q90-F341 HydrophobicContact CB-CB 4.24Å; Q90-F341 HydrophobicContact CB-CG 4.32Å; Q90-F341 HydrophobicContact CG-CB 4.06Å; Q90-F341 HydrophobicContact CG-CD1 3.93Å; Q90-F341 HydrophobicContact CG-CD2 3.67Å; Q90-F341 HydrophobicContact CG-CE1 4.33Å; Q90-F341 HydrophobicContact CG-CE2 4.07Å; Q90-F341 HydrophobicContact CG-CG 3.6Å; Q90-F341 HydrophobicContact CG-CZ 4.39Å; H213-F341 AromaticContact CE1-CE1 3.78Å; H213-F341 AromaticContact CE1-CZ 3.48Å; H213-F341 VanDerWaalsContact CE1-CZ 3.48Å; H213-F341 WeakPolarHBondContact CE1-CZ 3.45Å; F326-F341 HydrophobicContact CD1-CE2 4.01Å; F326-F341 HydrophobicContact CD1-CZ 4.1Å; F326-F341 HydrophobicContact CE1-CE2 4.38Å; F326-F341 HydrophobicContact CE1-CZ 4.02Å; Y329-F341 AromaticContact CD2-CD2 3.61Å; Y329-F341 HydrophobicContact CD2-CD2 3.61Å; Y329-F341 HydrophobicContact CD2-CE2 4.26Å; Y329-F341 AromaticContact CE2-CD2 3.75Å; Y329-F341 HydrophobicContact CE2-CD2 3.75Å; Y329-F341 HydrophobicContact CE2-CE2 4.16Å; Y329-F341 HydrophobicContact CG-CD2 4.4Å; T337-F341 WeakPolarHBondContact O-CB 3.34Å; T337-F341 PolarHBondContact O-N 3.06Å; L339-F341 VanDerWaalsContact C-N 3.34Å; F341-I343 PolarHBondContact O-N 2.96Å; F341-S344 CarbonylContact O-C 3.49Å; F341-S344 WeakPolarHBondContact O-CB 3.43Å; F341-S344 PolarHBondContact O-N 3.37Å; F341-S344 VanDerWaalsContact O-N 3.16Å; F341-N345 HydrophobicContact CD1-CB 4.12Å; F341-N345 HydrophobicContact CE1-CB 3.96Å; F341-N345 VanDerWaalsContact O-CB 3.27Å; F341-N345 WeakPolarHBondContact O-CB 3.45Å; F341-N345 PolarHBondContact O-N 3.17Å |
| 342 | G | 95.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -56.6 | -49 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q30 G338 L339 V340 S344 N345 T346 | Q30-G342 WeakPolarHBondContact CB-O 3.45Å; G338-G342 PolarHBondContact O-N 2.87Å; L339-G342 WeakPolarHBondContact O-CA 3.06Å; L339-G342 PolarHBondContact O-N 3.41Å; L339-G342 VanDerWaalsContact O-N 3.14Å; V340-G342 VanDerWaalsContact C-N 3.32Å; G342-S344 VanDerWaalsContact C-N 3.31Å; G342-S344 PolarHBondContact O-N 3.39Å; G342-N345 PolarHBondContact O-N 3.01Å; G342-T346 PolarHBondContact O-N 3.35Å; G342-T346 PolarHBondContact O-OG1 3.13Å |
| 343 | I | 95.7 | Very high | 91.7 | Very high | 19 Ų | 19 | 13.9 Ų | 13.9 | 10% | 0.097 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -57.8 | -46.1 | 174 | -63.4 | 166.4 | 0 | 0 | 0 | 110.5 | I31 L201 M210 L339 V340 F341 N345 T346 L347 | I31-I343 HydrophobicContact CD1-CG1 4.11Å; I31-I343 HydrophobicContact CG1-CG1 3.97Å; L201-I343 HydrophobicContact CD2-CG2 4.4Å; M210-I343 HydrophobicContact CE-CB 3.98Å; M210-I343 HydrophobicContact CE-CG2 3.63Å; L339-I343 HydrophobicContact CD1-CD1 4.39Å; L339-I343 HydrophobicContact CG-CD1 4.3Å; L339-I343 WeakPolarHBondContact O-CG1 3.27Å; L339-I343 PolarHBondContact O-N 3.45Å; V340-I343 PolarHBondContact O-N 3Å; F341-I343 PolarHBondContact O-N 2.96Å; I343-N345 VanDerWaalsContact C-N 3.34Å; I343-N345 PolarHBondContact O-N 2.5Å; I343-T346 WeakPolarHBondContact O-CB 3.31Å; I343-T346 PolarHBondContact O-N 2.89Å; I343-L347 PolarHBondContact O-N 3.41Å |
| 344 | S | 96.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 17.8 Ų | 17.8 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -62 | -42.3 | 178.7 | -173.6 | 0 | 0 | 0 | 0 | 112.3 | H213 Y329 V340 F341 G342 L347 A348 | H213-S344 PolarHBondContact ND1-OG 2.98Å; Y329-S344 WeakPolarHBondContact OH-CB 3.5Å; Y329-S344 PolarHBondContact OH-OG 3.35Å; V340-S344 WeakPolarHBondContact O-CB 2.88Å; V340-S344 PolarHBondContact O-N 2.89Å; F341-S344 CarbonylContact O-C 3.49Å; F341-S344 WeakPolarHBondContact O-CB 3.43Å; F341-S344 PolarHBondContact O-N 3.37Å; F341-S344 VanDerWaalsContact O-N 3.16Å; G342-S344 VanDerWaalsContact C-N 3.31Å; G342-S344 PolarHBondContact O-N 3.39Å; S344-L347 PolarHBondContact O-N 2.94Å; S344-A348 VanDerWaalsContact O-CB 3.25Å; S344-A348 WeakPolarHBondContact O-CB 3.19Å; S344-A348 PolarHBondContact O-N 2.92Å |
| 345 | N | 95.1 | Very high | 91.6 | Very high | 3 Ų | 3 | 17.3 Ų | 17.3 | 2% | 0.016 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -73.6 | -32.9 | -176.1 | -159.5 | 30.2 | 0 | 0 | 0 | 110.9 | Y26 Q30 H213 F341 G342 I343 A348 T349 | Y26-N345 PolarHBondContact OH-ND2 2.82Å; Y26-N345 VanDerWaalsContact OH-ND2 3.13Å; Q30-N345 HydrophobicContact CG-CB 4.48Å; Q30-N345 PolarHBondContact NE2-ND2 3.32Å; Q30-N345 VanDerWaalsContact NE2-ND2 3.17Å; Q30-N345 PolarHBondContact OE1-ND2 2.84Å; H213-N345 PolarHBondContact CE1-OD1 2.62Å; H213-N345 PolarHBondContact NE2-OD1 2.95Å; F341-N345 HydrophobicContact CD1-CB 4.12Å; F341-N345 HydrophobicContact CE1-CB 3.96Å; F341-N345 VanDerWaalsContact O-CB 3.27Å; F341-N345 WeakPolarHBondContact O-CB 3.45Å; F341-N345 PolarHBondContact O-N 3.17Å; G342-N345 PolarHBondContact O-N 3.01Å; I343-N345 VanDerWaalsContact C-N 3.34Å; I343-N345 PolarHBondContact O-N 2.5Å; N345-A348 CarbonylContact O-C 3.6Å; N345-A348 PolarHBondContact O-N 3.24Å; N345-T349 WeakPolarHBondContact O-CB 3.2Å; N345-T349 PolarHBondContact O-N 3.4Å; N345-T349 PolarHBondContact O-OG1 2.8Å |
| 346 | T | 95.1 | Very high | 91.6 | Very high | 26 Ų | 26 | 17.6 Ų | 17.6 | 16% | 0.16 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -54.9 | -51.7 | 167.7 | -59.8 | 0 | 0 | 0 | 0 | 110.5 | I27 Q30 G342 I343 T349 | I27-T346 HydrophobicContact CG2-CG2 3.93Å; Q30-T346 WeakPolarHBondContact CB-OG1 3.36Å; G342-T346 PolarHBondContact O-N 3.35Å; G342-T346 PolarHBondContact O-OG1 3.13Å; I343-T346 WeakPolarHBondContact O-CB 3.31Å; I343-T346 PolarHBondContact O-N 2.89Å; T346-T349 PolarHBondContact O-N 2.9Å |
| 347 | L | 95 | Very high | 91.5 | Very high | 65 Ų | 65 | 21.3 Ų | 21.3 | 34% | 0.34 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -63.8 | -44.5 | 177.7 | -64.1 | 175.9 | 0 | 0 | 0 | 111.2 | W207 M210 F214 I343 S344 T349 V350 | W207-L347 HydrophobicContact CH2-CD1 4.41Å; W207-L347 HydrophobicContact CZ3-CD1 4.32Å; M210-L347 HydrophobicContact SD-CD1 4.18Å; F214-L347 WeakPolarHBondContact CD2-O 3.21Å; I343-L347 PolarHBondContact O-N 3.41Å; S344-L347 PolarHBondContact O-N 2.94Å; L347-T349 PolarHBondContact O-N 3.22Å; L347-V350 WeakPolarHBondContact O-CB 3.25Å; L347-V350 WeakPolarHBondContact O-CG2 3.34Å; L347-V350 PolarHBondContact O-N 3.39Å |
| 348 | A | 94.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -73.4 | -3.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | H213 N217 Y221 S344 N345 P351 | H213-A348 HydrophobicContact CB-CB 4.23Å; N217-A348 HydrophobicContact CB-CB 4.16Å; N217-A348 WeakPolarHBondContact CB-O 3.41Å; N217-A348 VanDerWaalsContact ND2-CB 3.3Å; N217-A348 WeakPolarHBondContact ND2-CB 3.27Å; N217-A348 PolarHBondContact ND2-O 3.49Å; Y221-A348 WeakPolarHBondContact CE2-O 3.49Å; S344-A348 VanDerWaalsContact O-CB 3.25Å; S344-A348 WeakPolarHBondContact O-CB 3.19Å; S344-A348 PolarHBondContact O-N 2.92Å; N345-A348 CarbonylContact O-C 3.6Å; N345-A348 PolarHBondContact O-N 3.24Å; A348-P351 WeakPolarHBondContact O-CD 3.25Å |
| 349 | T | 91.8 | Very high | 91.4 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -88 | -24.6 | 170.7 | -59.1 | 0 | 0 | 0 | 0 | 111.9 | F23 Y26 I27 N345 T346 L347 P351 G352 | F23-T349 HydrophobicContact CB-CG2 4.46Å; F23-T349 HydrophobicContact CD1-CG2 3.77Å; Y26-T349 HydrophobicContact CD1-CG2 3.73Å; Y26-T349 HydrophobicContact CE1-CG2 4.17Å; Y26-T349 WeakPolarHBondContact CE1-OG1 3.25Å; I27-T349 HydrophobicContact CD1-CG2 3.87Å; I27-T349 HydrophobicContact CG1-CG2 3.47Å; I27-T349 VanDerWaalsContact CG1-CG2 3.47Å; N345-T349 WeakPolarHBondContact O-CB 3.2Å; N345-T349 PolarHBondContact O-N 3.4Å; N345-T349 PolarHBondContact O-OG1 2.8Å; T346-T349 PolarHBondContact O-N 2.9Å; L347-T349 PolarHBondContact O-N 3.22Å; T349-P351 VanDerWaalsContact C-N 3.27Å; T349-G352 WeakPolarHBondContact O-CA 3.32Å; T349-G352 PolarHBondContact O-N 3.32Å |
| 350 | V | 91.1 | Very high | 91.2 | Very high | 55 Ų | 55 | 26.1 Ų | 26.1 | 33% | 0.333 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -51.4 | -41.6 | 177.4 | 176.5 | 0 | 0 | 0 | 0 | 112.5 | F214 L347 G352 I353 L354 | F214-V350 HydrophobicContact CE2-CB 4.39Å; L347-V350 WeakPolarHBondContact O-CB 3.25Å; L347-V350 WeakPolarHBondContact O-CG2 3.34Å; L347-V350 PolarHBondContact O-N 3.39Å; V350-G352 PolarHBondContact O-N 3.35Å; V350-I353 PolarHBondContact O-N 2.91Å; V350-L354 HydrophobicContact CG1-CD1 3.64Å; V350-L354 HydrophobicContact CG1-CG 4.01Å; V350-L354 PolarHBondContact O-N 2.97Å |
| 351 | P | 89.6 | Confident | 90.9 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.6 | -25.5 | 173.1 | -24.1 | 34.4 | 0 | 0 | 0 | 115.3 | F214 W218 Y221 A348 T349 I353 G355 P356 | F214-P351 HydrophobicContact CD1-CG 4.29Å; F214-P351 HydrophobicContact CD2-CG 3.68Å; F214-P351 HydrophobicContact CE1-CG 4.06Å; F214-P351 HydrophobicContact CE2-CG 3.43Å; F214-P351 VanDerWaalsContact CE2-CG 3.43Å; F214-P351 HydrophobicContact CG-CG 4.11Å; F214-P351 HydrophobicContact CZ-CG 3.64Å; W218-P351 VanDerWaalsContact CA-CB 3.41Å; W218-P351 HydrophobicContact CB-CB 3.76Å; W218-P351 HydrophobicContact CB-CG 4.12Å; W218-P351 HydrophobicContact CD2-CB 4.12Å; W218-P351 HydrophobicContact CE3-CB 3.61Å; W218-P351 HydrophobicContact CE3-CG 3.96Å; W218-P351 HydrophobicContact CG-CB 4.24Å; W218-P351 HydrophobicContact CZ3-CB 4.48Å; Y221-P351 HydrophobicContact CD2-CB 4.35Å; A348-P351 WeakPolarHBondContact O-CD 3.25Å; T349-P351 VanDerWaalsContact C-N 3.27Å; P351-I353 PolarHBondContact O-N 3.48Å; P351-G355 VanDerWaalsContact O-CA 3.27Å; P351-G355 WeakPolarHBondContact O-CA 3.37Å; P351-G355 PolarHBondContact O-N 2.8Å; P351-P356 WeakPolarHBondContact O-CD 3.27Å |
| 352 | G | 84.7 | Confident | 90.6 | Very high | 4 Ų | 4 | 37 Ų | 37 | 4% | 0.041 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67.5 | -24.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | T349 V350 P356 | T349-G352 WeakPolarHBondContact O-CA 3.32Å; T349-G352 PolarHBondContact O-N 3.32Å; V350-G352 PolarHBondContact O-N 3.35Å; G352-P356 VanDerWaalsContact O-CD 3.32Å; G352-P356 WeakPolarHBondContact O-CD 3.36Å; G352-P356 WeakPolarHBondContact O-CG 3.42Å |
| 353 | I | 85.5 | Confident | 90.1 | Very high | 41 Ų | 41 | 38 Ų | 38 | 21% | 0.21 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -90.6 | -49.3 | 173.8 | -58.3 | 174 | 0 | 0 | 0 | 110.1 | F23 Y24 I27 V350 P351 N357 | F23-I353 HydrophobicContact CB-CD1 4.18Å; F23-I353 HydrophobicContact CB-CG1 3.85Å; F23-I353 HydrophobicContact CG-CG1 4.44Å; Y24-I353 HydrophobicContact CE1-CD1 4.49Å; I27-I353 HydrophobicContact CD1-CD1 3.69Å; V350-I353 PolarHBondContact O-N 2.91Å; P351-I353 PolarHBondContact O-N 3.48Å; I353-N357 WeakPolarHBondContact O-CB 3.41Å; I353-N357 PolarHBondContact O-ND2 3.4Å |
| 354 | L | 89 | Confident | 89.4 | Confident | 81 Ų | 81 | 45.3 Ų | 45.3 | 42% | 0.424 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -76.1 | -41.7 | -173.9 | -64.5 | -176.3 | 0 | 0 | 0 | 113 | W218 V350 N357 I358 | W218-L354 HydrophobicContact CZ3-CB 4.31Å; V350-L354 HydrophobicContact CG1-CD1 3.64Å; V350-L354 HydrophobicContact CG1-CG 4.01Å; V350-L354 PolarHBondContact O-N 2.97Å; L354-N357 PolarHBondContact O-N 2.98Å; L354-I358 HydrophobicContact CB-CD1 4.12Å; L354-I358 WeakPolarHBondContact O-CB 3.49Å; L354-I358 WeakPolarHBondContact O-CD1 3.33Å; L354-I358 VanDerWaalsContact O-CG1 3.23Å; L354-I358 WeakPolarHBondContact O-CG1 3.47Å; L354-I358 PolarHBondContact O-N 3.39Å |
| 355 | G | 88.3 | Confident | 88 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -58.7 | -56.4 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | P351 N357 I358 T359 | P351-G355 VanDerWaalsContact O-CA 3.27Å; P351-G355 WeakPolarHBondContact O-CA 3.37Å; P351-G355 PolarHBondContact O-N 2.8Å; G355-N357 VanDerWaalsContact C-N 3.34Å; G355-N357 PolarHBondContact O-N 3.27Å; G355-I358 PolarHBondContact O-N 3.01Å; G355-T359 WeakPolarHBondContact O-CB 3.49Å; G355-T359 PolarHBondContact O-N 2.77Å; G355-T359 PolarHBondContact O-OG1 3.25Å |
| 356 | P | 85.5 | Confident | 86.8 | Confident | 34 Ų | 34 | 56.1 Ų | 56.1 | 22% | 0.221 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.7 | -38.5 | 177.1 | -25.4 | 35.7 | 0 | 0 | 0 | 113.2 | T225 P351 G352 T359 G360 | T225-P356 HydrophobicContact CG2-CG 4.04Å; P351-P356 WeakPolarHBondContact O-CD 3.27Å; G352-P356 VanDerWaalsContact O-CD 3.32Å; G352-P356 WeakPolarHBondContact O-CD 3.36Å; G352-P356 WeakPolarHBondContact O-CG 3.42Å; P356-T359 PolarHBondContact O-N 2.96Å; P356-G360 PolarHBondContact O-N 2.98Å |
| 357 | N | 87 | Confident | 85.8 | Confident | 112 Ų | 112 | 57.1 Ų | 57.1 | 60% | 0.599 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -66.1 | -45 | 178.4 | -78.2 | -33.8 | 0 | 0 | 0 | 112.3 | I353 L354 G355 T359 G360 W361 | I353-N357 WeakPolarHBondContact O-CB 3.41Å; I353-N357 PolarHBondContact O-ND2 3.4Å; L354-N357 PolarHBondContact O-N 2.98Å; G355-N357 VanDerWaalsContact C-N 3.34Å; G355-N357 PolarHBondContact O-N 3.27Å; N357-T359 VanDerWaalsContact C-N 3.34Å; N357-G360 PolarHBondContact O-N 2.85Å; N357-W361 WeakPolarHBondContact O-CB 3.24Å; N357-W361 PolarHBondContact O-N 3.35Å |
| 358 | I | 90.1 | Very high | 85.3 | Confident | 59 Ų | 59 | 55.9 Ų | 55.9 | 30% | 0.303 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.6 | -42.4 | 175.4 | -69.7 | 164.8 | 0 | 0 | 0 | 110 | W218 L354 G355 W361 L362 | W218-I358 HydrophobicContact CH2-CD1 3.73Å; W218-I358 HydrophobicContact CZ2-CD1 4.38Å; L354-I358 HydrophobicContact CB-CD1 4.12Å; L354-I358 WeakPolarHBondContact O-CB 3.49Å; L354-I358 WeakPolarHBondContact O-CD1 3.33Å; L354-I358 VanDerWaalsContact O-CG1 3.23Å; L354-I358 WeakPolarHBondContact O-CG1 3.47Å; L354-I358 PolarHBondContact O-N 3.39Å; G355-I358 PolarHBondContact O-N 3.01Å; I358-W361 PolarHBondContact O-N 3.35Å; I358-L362 HydrophobicContact CG2-CD1 3.75Å; I358-L362 HydrophobicContact CG2-CG 4.22Å; I358-L362 WeakPolarHBondContact O-CB 3.27Å; I358-L362 VanDerWaalsContact O-CG 3.28Å; I358-L362 WeakPolarHBondContact O-CG 3.34Å; I358-L362 PolarHBondContact O-N 3.36Å |
| 359 | T | 89 | Confident | 84.8 | Confident | 9 Ų | 9 | 58.9 Ų | 58.9 | 6% | 0.055 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -58.8 | -50.5 | 175.9 | -58.8 | 0 | 0 | 0 | 0 | 110.6 | G355 P356 N357 W361 L362 T363 W372 V375 | G355-T359 WeakPolarHBondContact O-CB 3.49Å; G355-T359 PolarHBondContact O-N 2.77Å; G355-T359 PolarHBondContact O-OG1 3.25Å; P356-T359 PolarHBondContact O-N 2.96Å; N357-T359 VanDerWaalsContact C-N 3.34Å; T359-W361 VanDerWaalsContact C-N 3.29Å; T359-W361 PolarHBondContact O-N 3.37Å; T359-L362 PolarHBondContact O-N 3.07Å; T359-T363 HydrophobicContact CG2-CG2 4.42Å; T359-T363 WeakPolarHBondContact O-CG2 3.47Å; T359-T363 PolarHBondContact O-N 2.96Å; T359-T363 PolarHBondContact O-OG1 3.47Å; T359-W372 HydrophobicContact CG2-CH2 3.79Å; T359-W372 HydrophobicContact CG2-CZ2 4.39Å; T359-W372 HydrophobicContact CG2-CZ3 4.05Å; T359-V375 HydrophobicContact CG2-CG1 4.01Å; T359-V375 HydrophobicContact CG2-CG2 4.05Å |
| 360 | G | 86.6 | Confident | 84.6 | Confident | 41 Ų | 41 | 64.7 Ų | 64.7 | 42% | 0.423 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.1 | -35.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | P356 N357 K364 | P356-G360 PolarHBondContact O-N 2.98Å; N357-G360 PolarHBondContact O-N 2.85Å; G360-K364 PolarHBondContact O-N 3.45Å |
| 361 | W | 87.6 | Confident | 84.6 | Confident | 190 Ų | 190 | 63.2 Ų | 63.2 | 72% | 0.72 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -69.1 | -44.4 | 173.6 | 178.4 | 75.1 | 0 | 0 | 0 | 112.4 | N357 I358 T359 T363 K364 | N357-W361 WeakPolarHBondContact O-CB 3.24Å; N357-W361 PolarHBondContact O-N 3.35Å; I358-W361 PolarHBondContact O-N 3.35Å; T359-W361 VanDerWaalsContact C-N 3.29Å; T359-W361 PolarHBondContact O-N 3.37Å; W361-T363 VanDerWaalsContact C-N 3.3Å; W361-T363 PolarHBondContact O-N 2.89Å; W361-K364 VanDerWaalsContact O-CB 3.32Å; W361-K364 WeakPolarHBondContact O-CB 3.34Å; W361-K364 PolarHBondContact O-N 2.79Å |
| 362 | L | 88.7 | Confident | 84.7 | Confident | 37 Ų | 37 | 63.4 Ų | 63.4 | 19% | 0.194 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -66.6 | -30.5 | 178.4 | -72.3 | 172.6 | 0 | 0 | 0 | 112.8 | I358 T359 S371 I374 V375 I378 | I358-L362 HydrophobicContact CG2-CD1 3.75Å; I358-L362 HydrophobicContact CG2-CG 4.22Å; I358-L362 WeakPolarHBondContact O-CB 3.27Å; I358-L362 VanDerWaalsContact O-CG 3.28Å; I358-L362 WeakPolarHBondContact O-CG 3.34Å; I358-L362 PolarHBondContact O-N 3.36Å; T359-L362 PolarHBondContact O-N 3.07Å; L362-S371 WeakPolarHBondContact O-CB 3.46Å; L362-I374 HydrophobicContact CD1-CG2 3.99Å; L362-I374 HydrophobicContact CD2-CG2 4.15Å; L362-V375 HydrophobicContact CB-CG2 4.15Å; L362-V375 HydrophobicContact CD1-CG2 3.88Å; L362-I378 HydrophobicContact CD1-CD1 3.89Å |
| 363 | T | 85 | Confident | 85.1 | Confident | 21 Ų | 21 | 67.5 Ų | 67.5 | 13% | 0.129 | 36% | 0.356 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | 13.6 | 179.4 | 65.9 | 0 | 0 | 0 | 0 | 113.1 | T359 W361 W372 V375 | T359-T363 HydrophobicContact CG2-CG2 4.42Å; T359-T363 WeakPolarHBondContact O-CG2 3.47Å; T359-T363 PolarHBondContact O-N 2.96Å; T359-T363 PolarHBondContact O-OG1 3.47Å; W361-T363 VanDerWaalsContact C-N 3.3Å; W361-T363 PolarHBondContact O-N 2.89Å; T363-W372 HydrophobicContact CG2-CD2 4.24Å; T363-W372 HydrophobicContact CG2-CG 4.37Å; T363-W372 HydrophobicContact CG2-CZ2 4.24Å; T363-V375 HydrophobicContact CG2-CG2 4.38Å |
| 364 | K | 80.5 | Confident | 85.4 | Confident | 173 Ų | 173 | 69.7 Ų | 69.7 | 75% | 0.752 | 37% | 0.367 | S | S | * | . | S | Bend | trans | -68.8 | 137.5 | -179.1 | -170.1 | 177.5 | -179.8 | -179.7 | 0 | 110.7 | G360 W361 E366 | G360-K364 PolarHBondContact O-N 3.45Å; W361-K364 VanDerWaalsContact O-CB 3.32Å; W361-K364 WeakPolarHBondContact O-CB 3.34Å; W361-K364 PolarHBondContact O-N 2.79Å; K364-E366 PolarHBondContact O-N 3.26Å |
| 365 | G | 67.8 | Low | 85.7 | Confident | 77 Ų | 77 | 66 Ų | 66 | 79% | 0.794 | 35% | 0.348 | S | S | * | . | S | Bend | trans | 91.3 | -52.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 366 | E | 71.1 | Confident | 86 | Confident | 154 Ų | 154 | 66.1 Ų | 66.1 | 72% | 0.72 | 35% | 0.349 | S | S | * | . | trans | -147.4 | 106 | 176.5 | -69.1 | -172.4 | 172.9 | 0 | 0 | 110.7 | K364 S368 | K364-E366 PolarHBondContact O-N 3.26Å; E366-S368 VanDerWaalsContact C-N 3.35Å; E366-S368 PolarHBondContact O-N 2.95Å | ||
| 367 | P | 73.3 | Confident | 86.5 | Confident | 47 Ų | 47 | 70.1 Ų | 70.1 | 31% | 0.305 | 36% | 0.363 | S | S | . | . | trans | -67.4 | 94.5 | 172.5 | 26.4 | -31.4 | 0 | 0 | 0 | 109.4 | N233 V234 | N233-P367 HydrophobicContact CB-CB 3.96Å; N233-P367 HydrophobicContact CB-CG 3.59Å; V234-P367 HydrophobicContact CG2-CB 4.26Å | ||
| 368 | S | 83.7 | Confident | 86.9 | Confident | 38 Ų | 38 | 67.3 Ų | 67.3 | 27% | 0.266 | 35% | 0.348 | S | S | . | . | trans | -106.1 | 163.9 | 179.1 | 72.3 | 0 | 0 | 0 | 0 | 111.7 | E366 E370 S371 W372 | E366-S368 VanDerWaalsContact C-N 3.35Å; E366-S368 PolarHBondContact O-N 2.95Å; S368-E370 PolarHBondContact O-N 2.92Å; S368-E370 PolarHBondContact OG-N 3.47Å; S368-S371 PolarHBondContact O-N 3.26Å; S368-S371 PolarHBondContact OG-N 2.9Å; S368-S371 VanDerWaalsContact OG-N 3.13Å; S368-S371 PolarHBondContact OG-OG 3.47Å; S368-W372 PolarHBondContact O-N 2.95Å | ||
| 369 | F | 86 | Confident | 87.1 | Confident | 63 Ų | 63 | 64.6 Ų | 64.6 | 28% | 0.276 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -55.1 | -34 | 169.1 | -68.7 | -74.3 | 0 | 0 | 0 | 112.1 | V234 L235 G301 R373 | V234-F369 HydrophobicContact CG1-CD1 3.53Å; V234-F369 HydrophobicContact CG1-CD2 4.22Å; V234-F369 HydrophobicContact CG1-CE1 3.38Å; V234-F369 HydrophobicContact CG1-CE2 4.1Å; V234-F369 HydrophobicContact CG1-CG 3.94Å; V234-F369 HydrophobicContact CG1-CZ 3.68Å; L235-F369 HydrophobicContact CD2-CE1 3.98Å; L235-F369 HydrophobicContact CD2-CZ 4.38Å; G301-F369 VanDerWaalsContact C-CE1 3.46Å; G301-F369 WeakPolarHBondContact O-CE1 3.39Å; G301-F369 WeakPolarHBondContact O-CZ 3.37Å; F369-R373 VanDerWaalsContact O-CB 3.3Å; F369-R373 WeakPolarHBondContact O-CB 3.47Å; F369-R373 PolarHBondContact O-N 3.25Å |
| 370 | E | 86.9 | Confident | 87.5 | Confident | 123 Ų | 123 | 64.2 Ų | 64.2 | 58% | 0.575 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -71.8 | -43.9 | -177.9 | -56.1 | -163 | 138.9 | 0 | 0 | 112.5 | S368 W372 R373 I374 | S368-E370 PolarHBondContact O-N 2.92Å; S368-E370 PolarHBondContact OG-N 3.47Å; E370-W372 VanDerWaalsContact C-N 3.34Å; E370-W372 PolarHBondContact O-N 3Å; E370-R373 WeakPolarHBondContact O-CB 3.38Å; E370-R373 PolarHBondContact O-N 3.16Å; E370-R373 IonicContact OE1-NH2 3.16Å; E370-I374 PolarHBondContact O-N 3.27Å |
| 371 | S | 90.1 | Very high | 88 | Confident | 23 Ų | 23 | 64.5 Ų | 64.5 | 16% | 0.161 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.4 | -44.7 | 176 | -57.6 | 0 | 0 | 0 | 0 | 111 | L362 S368 I374 V375 | L362-S371 WeakPolarHBondContact O-CB 3.46Å; S368-S371 PolarHBondContact O-N 3.26Å; S368-S371 PolarHBondContact OG-N 2.9Å; S368-S371 VanDerWaalsContact OG-N 3.13Å; S368-S371 PolarHBondContact OG-OG 3.47Å; S371-I374 PolarHBondContact O-N 3.36Å; S371-V375 PolarHBondContact O-N 3.33Å |
| 372 | W | 91.4 | Very high | 88.5 | Confident | 4 Ų | 4 | 57.5 Ų | 57.5 | 2% | 0.015 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -69.1 | -31.9 | 177.3 | -82.8 | 95.9 | 0 | 0 | 0 | 113.3 | G226 L229 Y230 V234 T359 T363 S368 E370 I374 V375 F376 | G226-W372 WeakPolarHBondContact O-CH2 3.22Å; L229-W372 HydrophobicContact CB-CZ2 4.3Å; Y230-W372 HydrophobicContact CD2-CB 4.04Å; Y230-W372 AromaticContact CD2-CD1 3.83Å; Y230-W372 AromaticContact CD2-CD2 3.55Å; Y230-W372 HydrophobicContact CD2-CD2 3.55Å; Y230-W372 AromaticContact CD2-CE2 3.87Å; Y230-W372 HydrophobicContact CD2-CE3 4.06Å; Y230-W372 AromaticContact CD2-CG 3.52Å; Y230-W372 HydrophobicContact CD2-CG 3.52Å; Y230-W372 AromaticContact CD2-NE1 3.98Å; Y230-W372 HydrophobicContact CE2-CB 3.96Å; Y230-W372 HydrophobicContact CE2-CD2 4.35Å; Y230-W372 AromaticContact CE2-CG 3.94Å; Y230-W372 HydrophobicContact CE2-CG 3.94Å; Y230-W372 HydrophobicContact CG-CD2 4.25Å; Y230-W372 HydrophobicContact CG-CE3 4.45Å; V234-W372 VanDerWaalsContact CG2-CD1 3.46Å; V234-W372 HydrophobicContact CG2-CG 4.38Å; T359-W372 HydrophobicContact CG2-CH2 3.79Å; T359-W372 HydrophobicContact CG2-CZ2 4.39Å; T359-W372 HydrophobicContact CG2-CZ3 4.05Å; T363-W372 HydrophobicContact CG2-CD2 4.24Å; T363-W372 HydrophobicContact CG2-CG 4.37Å; T363-W372 HydrophobicContact CG2-CZ2 4.24Å; S368-W372 PolarHBondContact O-N 2.95Å; E370-W372 VanDerWaalsContact C-N 3.34Å; E370-W372 PolarHBondContact O-N 3Å; W372-I374 PolarHBondContact O-N 2.96Å; W372-V375 HydrophobicContact CE3-CB 4.19Å; W372-V375 HydrophobicContact CE3-CG1 4.15Å; W372-V375 HydrophobicContact CZ3-CG1 4.11Å; W372-V375 WeakPolarHBondContact O-CB 3.13Å; W372-V375 PolarHBondContact O-N 3.43Å; W372-V375 VanDerWaalsContact O-N 3.1Å; W372-F376 HydrophobicContact CB-CD2 4.34Å; W372-F376 HydrophobicContact CB-CE2 3.88Å; W372-F376 HydrophobicContact CB-CZ 4.44Å; W372-F376 HydrophobicContact CD2-CZ 4.42Å; W372-F376 AromaticContact CE3-CE1 3.92Å; W372-F376 HydrophobicContact CE3-CE1 3.92Å; W372-F376 HydrophobicContact CE3-CE2 4.23Å; W372-F376 AromaticContact CE3-CZ 3.67Å; W372-F376 HydrophobicContact CE3-CZ 3.67Å; W372-F376 HydrophobicContact CZ3-CE1 4.32Å; W372-F376 HydrophobicContact CZ3-CZ 4.37Å; W372-F376 WeakPolarHBondContact O-CD2 3.45Å; W372-F376 WeakPolarHBondContact O-CG 3.38Å; W372-F376 PolarHBondContact O-N 3Å |
| 373 | R | 93.2 | Very high | 88.9 | Confident | 91 Ų | 91 | 55.9 Ų | 55.9 | 34% | 0.343 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -57.5 | -37.9 | 173.2 | -179 | 174.9 | 64 | -154.6 | -3.6 | 111.6 | F369 E370 F377 | F369-R373 VanDerWaalsContact O-CB 3.3Å; F369-R373 WeakPolarHBondContact O-CB 3.47Å; F369-R373 PolarHBondContact O-N 3.25Å; E370-R373 WeakPolarHBondContact O-CB 3.38Å; E370-R373 PolarHBondContact O-N 3.16Å; E370-R373 IonicContact OE1-NH2 3.16Å; R373-F377 VanDerWaalsContact O-CB 3.29Å; R373-F377 WeakPolarHBondContact O-CB 3.25Å; R373-F377 PolarHBondContact O-N 3.35Å |
| 374 | I | 93.4 | Very high | 89.5 | Confident | 86 Ų | 86 | 60.4 Ų | 60.4 | 44% | 0.441 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -65.3 | -46 | 175.1 | -59.2 | 170.7 | 0 | 0 | 0 | 110.5 | L362 E370 S371 W372 F376 F377 I378 | L362-I374 HydrophobicContact CD1-CG2 3.99Å; L362-I374 HydrophobicContact CD2-CG2 4.15Å; E370-I374 PolarHBondContact O-N 3.27Å; S371-I374 PolarHBondContact O-N 3.36Å; W372-I374 PolarHBondContact O-N 2.96Å; I374-F376 VanDerWaalsContact C-N 3.33Å; I374-F376 PolarHBondContact O-N 3.09Å; I374-F377 PolarHBondContact O-N 3.23Å; I374-I378 HydrophobicContact CG2-CD1 4.13Å; I374-I378 WeakPolarHBondContact O-CG1 3.45Å; I374-I378 PolarHBondContact O-N 3.49Å |
| 375 | V | 93.7 | Very high | 90.3 | Very high | 4 Ų | 4 | 57.2 Ų | 57.2 | 2% | 0.024 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -57.4 | -47.5 | 178.1 | 177.9 | 0 | 0 | 0 | 0 | 110.9 | V222 T359 L362 T363 S371 W372 I378 A379 | V222-V375 HydrophobicContact CG1-CG1 3.58Å; T359-V375 HydrophobicContact CG2-CG1 4.01Å; T359-V375 HydrophobicContact CG2-CG2 4.05Å; L362-V375 HydrophobicContact CB-CG2 4.15Å; L362-V375 HydrophobicContact CD1-CG2 3.88Å; T363-V375 HydrophobicContact CG2-CG2 4.38Å; S371-V375 PolarHBondContact O-N 3.33Å; W372-V375 HydrophobicContact CE3-CB 4.19Å; W372-V375 HydrophobicContact CE3-CG1 4.15Å; W372-V375 HydrophobicContact CZ3-CG1 4.11Å; W372-V375 WeakPolarHBondContact O-CB 3.13Å; W372-V375 PolarHBondContact O-N 3.43Å; W372-V375 VanDerWaalsContact O-N 3.1Å; V375-I378 PolarHBondContact O-N 3.04Å; V375-A379 PolarHBondContact O-N 3.44Å |
| 376 | F | 94.9 | Very high | 91.8 | Very high | 3 Ų | 3 | 53.6 Ų | 53.6 | 1% | 0.013 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.8 | -36.9 | 178 | -64.9 | -38.9 | 0 | 0 | 0 | 112.9 | L223 Y230 V294 V297 L311 W372 I374 A379 G380 | L223-F376 HydrophobicContact CD2-CD1 4.5Å; L223-F376 HydrophobicContact CD2-CE1 3.98Å; Y230-F376 HydrophobicContact CD1-CZ 4.32Å; Y230-F376 HydrophobicContact CD2-CE2 4.34Å; Y230-F376 HydrophobicContact CD2-CZ 4.11Å; Y230-F376 HydrophobicContact CE1-CZ 4.27Å; Y230-F376 AromaticContact CE2-CE2 3.88Å; Y230-F376 HydrophobicContact CE2-CE2 3.88Å; Y230-F376 HydrophobicContact CE2-CZ 4.05Å; Y230-F376 HydrophobicContact CG-CZ 4.25Å; Y230-F376 AromaticContact CZ-CE2 4Å; V294-F376 HydrophobicContact CG2-CB 3.99Å; V294-F376 HydrophobicContact CG2-CD1 3.59Å; V294-F376 HydrophobicContact CG2-CE1 4.46Å; V294-F376 HydrophobicContact CG2-CG 4.08Å; V294-F376 WeakPolarHBondContact O-CB 3.33Å; V297-F376 HydrophobicContact CB-CD2 4.23Å; V297-F376 HydrophobicContact CB-CE2 4.25Å; V297-F376 HydrophobicContact CG1-CD2 3.97Å; V297-F376 HydrophobicContact CG1-CE2 3.49Å; V297-F376 VanDerWaalsContact CG1-CE2 3.49Å; V297-F376 HydrophobicContact CG1-CZ 3.86Å; L311-F376 HydrophobicContact CD2-CE1 4.15Å; L311-F376 HydrophobicContact CD2-CZ 4.42Å; W372-F376 HydrophobicContact CB-CD2 4.34Å; W372-F376 HydrophobicContact CB-CE2 3.88Å; W372-F376 HydrophobicContact CB-CZ 4.44Å; W372-F376 HydrophobicContact CD2-CZ 4.42Å; W372-F376 AromaticContact CE3-CE1 3.92Å; W372-F376 HydrophobicContact CE3-CE1 3.92Å; W372-F376 HydrophobicContact CE3-CE2 4.23Å; W372-F376 AromaticContact CE3-CZ 3.67Å; W372-F376 HydrophobicContact CE3-CZ 3.67Å; W372-F376 HydrophobicContact CZ3-CE1 4.32Å; W372-F376 HydrophobicContact CZ3-CZ 4.37Å; W372-F376 WeakPolarHBondContact O-CD2 3.45Å; W372-F376 WeakPolarHBondContact O-CG 3.38Å; W372-F376 PolarHBondContact O-N 3Å; I374-F376 VanDerWaalsContact C-N 3.33Å; I374-F376 PolarHBondContact O-N 3.09Å; F376-A379 PolarHBondContact O-N 3.35Å; F376-G380 PolarHBondContact O-N 3.21Å |
| 377 | F | 95.6 | Very high | 93.1 | Very high | 117 Ų | 117 | 47.1 Ų | 47.1 | 51% | 0.513 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64.9 | -40.3 | 176.3 | -166.8 | -96.7 | 0 | 0 | 0 | 112 | R373 I374 G380 A381 | R373-F377 VanDerWaalsContact O-CB 3.29Å; R373-F377 WeakPolarHBondContact O-CB 3.25Å; R373-F377 PolarHBondContact O-N 3.35Å; I374-F377 PolarHBondContact O-N 3.23Å; F377-G380 PolarHBondContact O-N 2.88Å; F377-A381 VanDerWaalsContact O-CB 3.25Å; F377-A381 WeakPolarHBondContact O-CB 3.44Å; F377-A381 PolarHBondContact O-N 3.4Å |
| 378 | I | 95.7 | Very high | 94.3 | Very high | 54 Ų | 54 | 48 Ų | 48 | 28% | 0.277 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -60.5 | -48.8 | 174.4 | -66.6 | 165.5 | 0 | 0 | 0 | 110.3 | W218 L362 I374 V375 G380 A381 L382 | W218-I378 HydrophobicContact CZ2-CG2 3.76Å; L362-I378 HydrophobicContact CD1-CD1 3.89Å; I374-I378 HydrophobicContact CG2-CD1 4.13Å; I374-I378 WeakPolarHBondContact O-CG1 3.45Å; I374-I378 PolarHBondContact O-N 3.49Å; V375-I378 PolarHBondContact O-N 3.04Å; I378-G380 PolarHBondContact O-N 3.48Å; I378-A381 PolarHBondContact O-N 3.36Å; I378-L382 HydrophobicContact CG2-CD1 4.08Å; I378-L382 VanDerWaalsContact O-CG 3.32Å; I378-L382 WeakPolarHBondContact O-CG 3.32Å; I378-L382 PolarHBondContact O-N 2.85Å |
| 379 | A | 95.7 | Very high | 95 | Very high | 2 Ų | 2 | 48.3 Ų | 48.3 | 2% | 0.017 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.4 | -45.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A219 V294 V375 F376 L382 Y383 | A219-A379 HydrophobicContact CB-CB 4.25Å; V294-A379 HydrophobicContact CG1-CB 4.46Å; V294-A379 HydrophobicContact CG2-CB 4.43Å; V375-A379 PolarHBondContact O-N 3.44Å; F376-A379 PolarHBondContact O-N 3.35Å; A379-L382 PolarHBondContact O-N 3.27Å; A379-Y383 PolarHBondContact O-N 3.4Å |
| 380 | G | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.9 | -40 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | F376 F377 I378 Y383 F384 | F376-G380 PolarHBondContact O-N 3.21Å; F377-G380 PolarHBondContact O-N 2.88Å; I378-G380 PolarHBondContact O-N 3.48Å; G380-Y383 PolarHBondContact O-N 2.92Å; G380-F384 WeakPolarHBondContact O-CB 3.28Å; G380-F384 PolarHBondContact O-N 3.06Å |
| 381 | A | 97.2 | Very high | 96.1 | Very high | 47 Ų | 47 | 41.5 Ų | 41.5 | 39% | 0.388 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -64.9 | -41.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | F377 I378 F384 F385 | F377-A381 VanDerWaalsContact O-CB 3.25Å; F377-A381 WeakPolarHBondContact O-CB 3.44Å; F377-A381 PolarHBondContact O-N 3.4Å; I378-A381 PolarHBondContact O-N 3.36Å; A381-F384 PolarHBondContact O-N 3.1Å; A381-F385 WeakPolarHBondContact O-CB 3.43Å; A381-F385 PolarHBondContact O-N 2.97Å |
| 382 | L | 97.4 | Very high | 96.5 | Very high | 43 Ų | 43 | 45.4 Ų | 45.4 | 23% | 0.225 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.1 | -44.6 | 175 | -73.4 | 173.3 | 0 | 0 | 0 | 111.6 | T215 W218 I378 A379 F385 S386 | T215-L382 HydrophobicContact CG2-CB 4.02Å; T215-L382 WeakPolarHBondContact CG2-O 3.5Å; W218-L382 HydrophobicContact CB-CD1 4.14Å; W218-L382 HydrophobicContact CD2-CD1 3.41Å; W218-L382 VanDerWaalsContact CD2-CD1 3.41Å; W218-L382 HydrophobicContact CE3-CD1 3.99Å; W218-L382 HydrophobicContact CG-CD1 3.43Å; W218-L382 VanDerWaalsContact CG-CD1 3.43Å; W218-L382 HydrophobicContact CZ2-CD1 4.3Å; I378-L382 HydrophobicContact CG2-CD1 4.08Å; I378-L382 VanDerWaalsContact O-CG 3.32Å; I378-L382 WeakPolarHBondContact O-CG 3.32Å; I378-L382 PolarHBondContact O-N 2.85Å; A379-L382 PolarHBondContact O-N 3.27Å; L382-F385 PolarHBondContact O-N 2.85Å; L382-S386 PolarHBondContact O-N 3.42Å |
| 383 | Y | 97.8 | Very high | 96.8 | Very high | 3 Ų | 3 | 48.8 Ų | 48.8 | 1% | 0.012 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60 | -46.4 | 173.6 | -77 | -21.8 | 0 | 0 | 0 | 112.6 | T215 A219 H287 P290 A291 A379 G380 F385 S386 V387 | T215-Y383 VanDerWaalsContact O-CE1 3.29Å; T215-Y383 WeakPolarHBondContact O-CE1 3.28Å; A219-Y383 HydrophobicContact CB-CD1 4.42Å; A219-Y383 HydrophobicContact CB-CD2 4.44Å; A219-Y383 HydrophobicContact CB-CE1 3.58Å; A219-Y383 HydrophobicContact CB-CE2 3.56Å; A219-Y383 WeakPolarHBondContact CB-OH 3.21Å; H287-Y383 AromaticContact CD2-CD1 3.49Å; H287-Y383 VanDerWaalsContact CD2-CD1 3.49Å; H287-Y383 WeakPolarHBondContact CD2-CD1 3.46Å; H287-Y383 AromaticContact CD2-CE1 3.81Å; P290-Y383 HydrophobicContact CB-CD2 3.79Å; P290-Y383 HydrophobicContact CB-CE2 3.4Å; P290-Y383 VanDerWaalsContact CB-CE2 3.4Å; A291-Y383 HydrophobicContact CB-CD2 4.43Å; A379-Y383 PolarHBondContact O-N 3.4Å; G380-Y383 PolarHBondContact O-N 2.92Å; Y383-F385 VanDerWaalsContact C-N 3.32Å; Y383-F385 PolarHBondContact O-N 3.1Å; Y383-S386 WeakPolarHBondContact O-CB 3.33Å; Y383-S386 PolarHBondContact O-N 3.46Å; Y383-S386 VanDerWaalsContact O-N 3.17Å; Y383-V387 WeakPolarHBondContact O-CG2 3.14Å; Y383-V387 PolarHBondContact O-N 2.75Å |
| 384 | F | 97.7 | Very high | 97 | Very high | 117 Ų | 117 | 44.6 Ų | 44.6 | 51% | 0.513 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -61.5 | -41.3 | 177.6 | -175.3 | -97.8 | 0 | 0 | 0 | 112.1 | L288 G380 A381 S386 V387 V388 | L288-F384 HydrophobicContact CD1-CD2 4.39Å; G380-F384 WeakPolarHBondContact O-CB 3.28Å; G380-F384 PolarHBondContact O-N 3.06Å; A381-F384 PolarHBondContact O-N 3.1Å; F384-S386 VanDerWaalsContact C-N 3.33Å; F384-S386 PolarHBondContact O-N 3.18Å; F384-V387 WeakPolarHBondContact O-CB 3.23Å; F384-V387 PolarHBondContact O-N 3.39Å; F384-V388 HydrophobicContact CD1-CG2 4.33Å; F384-V388 HydrophobicContact CE1-CG2 3.88Å; F384-V388 HydrophobicContact CZ-CG2 4.09Å; F384-V388 PolarHBondContact O-N 3.34Å; F384-V388 VanDerWaalsContact O-N 3.13Å |
| 385 | F | 98 | Very high | 97.1 | Very high | 106 Ų | 106 | 45.4 Ų | 45.4 | 47% | 0.465 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -58.8 | -44.1 | 173.9 | 174.5 | -103.5 | 0 | 0 | 0 | 112 | I211 A381 L382 Y383 V387 V388 F389 | I211-F385 HydrophobicContact CD1-CE1 4.36Å; I211-F385 HydrophobicContact CG2-CD1 3.96Å; I211-F385 HydrophobicContact CG2-CE1 3.67Å; A381-F385 WeakPolarHBondContact O-CB 3.43Å; A381-F385 PolarHBondContact O-N 2.97Å; L382-F385 PolarHBondContact O-N 2.85Å; Y383-F385 VanDerWaalsContact C-N 3.32Å; Y383-F385 PolarHBondContact O-N 3.1Å; F385-V387 PolarHBondContact O-N 2.88Å; F385-V388 PolarHBondContact O-N 2.83Å; F385-F389 HydrophobicContact CZ-CD2 4.19Å; F385-F389 WeakPolarHBondContact O-CB 3.04Å; F385-F389 PolarHBondContact O-N 2.89Å |
| 386 | S | 98.1 | Very high | 97.1 | Very high | 1 Ų | 1 | 45.5 Ų | 45.5 | 1% | 0.007 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.4 | -46 | 174.5 | 177.7 | 0 | 0 | 0 | 0 | 112.2 | S212 T215 L382 Y383 F384 V388 F389 Y390 | S212-S386 VanDerWaalsContact CA-OG 3.31Å; S212-S386 WeakPolarHBondContact CA-OG 3.48Å; T215-S386 WeakPolarHBondContact OG1-CB 3.2Å; T215-S386 PolarHBondContact OG1-OG 3.13Å; L382-S386 PolarHBondContact O-N 3.42Å; Y383-S386 WeakPolarHBondContact O-CB 3.33Å; Y383-S386 PolarHBondContact O-N 3.46Å; Y383-S386 VanDerWaalsContact O-N 3.17Å; F384-S386 VanDerWaalsContact C-N 3.33Å; F384-S386 PolarHBondContact O-N 3.18Å; S386-V388 VanDerWaalsContact C-N 3.35Å; S386-V388 PolarHBondContact O-N 3.4Å; S386-F389 PolarHBondContact O-N 2.99Å; S386-Y390 WeakPolarHBondContact O-CB 2.98Å; S386-Y390 PolarHBondContact O-N 3.04Å |
| 387 | V | 98.5 | Very high | 97 | Very high | 18 Ų | 18 | 49 Ų | 49 | 11% | 0.109 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -54.4 | -51.2 | 177.2 | 174.7 | 0 | 0 | 0 | 0 | 111 | C284 H287 L288 Y383 F384 F385 A391 | C284-V387 HydrophobicContact CB-CG1 4.09Å; H287-V387 HydrophobicContact CB-CG2 3.48Å; H287-V387 VanDerWaalsContact CB-CG2 3.48Å; L288-V387 HydrophobicContact CB-CG2 3.85Å; Y383-V387 WeakPolarHBondContact O-CG2 3.14Å; Y383-V387 PolarHBondContact O-N 2.75Å; F384-V387 WeakPolarHBondContact O-CB 3.23Å; F384-V387 PolarHBondContact O-N 3.39Å; F385-V387 PolarHBondContact O-N 2.88Å; V387-A391 WeakPolarHBondContact O-CB 3.35Å; V387-A391 PolarHBondContact O-N 3.43Å |
| 388 | V | 98.3 | Very high | 96.8 | Very high | 64 Ų | 64 | 45.6 Ų | 45.6 | 39% | 0.388 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.5 | -49.7 | -178.2 | 175.2 | 0 | 0 | 0 | 0 | 110.6 | F384 F385 S386 A391 I392 | F384-V388 HydrophobicContact CD1-CG2 4.33Å; F384-V388 HydrophobicContact CE1-CG2 3.88Å; F384-V388 HydrophobicContact CZ-CG2 4.09Å; F384-V388 PolarHBondContact O-N 3.34Å; F384-V388 VanDerWaalsContact O-N 3.13Å; F385-V388 PolarHBondContact O-N 2.83Å; S386-V388 VanDerWaalsContact C-N 3.35Å; S386-V388 PolarHBondContact O-N 3.4Å; V388-A391 PolarHBondContact O-N 2.84Å; V388-I392 HydrophobicContact CG1-CD1 3.98Å; V388-I392 VanDerWaalsContact O-CG1 3.32Å; V388-I392 WeakPolarHBondContact O-CG1 3.42Å; V388-I392 PolarHBondContact O-N 2.85Å |
| 389 | F | 98.2 | Very high | 96.6 | Very high | 46 Ų | 46 | 43.7 Ų | 43.7 | 20% | 0.202 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.3 | -45.4 | -176.1 | -164.2 | -85.3 | 0 | 0 | 0 | 111.6 | A208 I211 F385 S386 I392 F393 | A208-F389 HydrophobicContact CB-CD1 3.99Å; A208-F389 HydrophobicContact CB-CE1 3.95Å; I211-F389 HydrophobicContact CD1-CD1 3.65Å; I211-F389 HydrophobicContact CD1-CD2 4.23Å; I211-F389 HydrophobicContact CD1-CE1 3.55Å; I211-F389 HydrophobicContact CD1-CE2 4.13Å; I211-F389 HydrophobicContact CD1-CG 4Å; I211-F389 HydrophobicContact CD1-CZ 3.79Å; F385-F389 HydrophobicContact CZ-CD2 4.19Å; F385-F389 WeakPolarHBondContact O-CB 3.04Å; F385-F389 PolarHBondContact O-N 2.89Å; S386-F389 PolarHBondContact O-N 2.99Å; F389-I392 PolarHBondContact O-N 3.02Å; F389-F393 HydrophobicContact CD1-CB 4.35Å; F389-F393 AromaticContact CD1-CD2 3.88Å; F389-F393 HydrophobicContact CD1-CD2 3.88Å; F389-F393 AromaticContact CD2-CD2 3.77Å; F389-F393 HydrophobicContact CD2-CD2 3.77Å; F389-F393 AromaticContact CD2-CE2 3.94Å; F389-F393 HydrophobicContact CD2-CE2 3.94Å; F389-F393 HydrophobicContact CE1-CB 4.08Å; F389-F393 AromaticContact CE1-CD2 3.7Å; F389-F393 HydrophobicContact CE1-CD2 3.7Å; F389-F393 HydrophobicContact CE1-CG 4.21Å; F389-F393 AromaticContact CE2-CD2 3.6Å; F389-F393 HydrophobicContact CE2-CD2 3.6Å; F389-F393 AromaticContact CE2-CE2 3.68Å; F389-F393 HydrophobicContact CE2-CE2 3.68Å; F389-F393 AromaticContact CG-CD2 3.91Å; F389-F393 HydrophobicContact CG-CD2 3.91Å; F389-F393 AromaticContact CZ-CD2 3.57Å; F389-F393 HydrophobicContact CZ-CD2 3.57Å; F389-F393 HydrophobicContact CZ-CE2 4.02Å; F389-F393 HydrophobicContact CZ-CG 4.28Å; F389-F393 WeakPolarHBondContact O-CB 3.48Å; F389-F393 WeakPolarHBondContact O-CD2 3.4Å; F389-F393 PolarHBondContact O-N 3.42Å |
| 390 | Y | 98.4 | Very high | 96.3 | Very high | 1 Ų | 1 | 47.9 Ų | 47.9 | 0% | 0.004 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -69.8 | -36.8 | 179.6 | -161.6 | -86.4 | 0 | 0 | 0 | 112.3 | A208 A209 R279 K280 D283 F325 N328 S386 I392 G394 | A208-Y390 HydrophobicContact CB-CD2 4.02Å; A208-Y390 HydrophobicContact CB-CE2 4.49Å; A208-Y390 WeakPolarHBondContact O-CD2 3.4Å; A209-Y390 HydrophobicContact CB-CE2 4.33Å; R279-Y390 HydrophobicContact CB-CE1 4.43Å; K280-Y390 HydrophobicContact CG-CD1 4.4Å; K280-Y390 HydrophobicContact CG-CE1 4.35Å; D283-Y390 HydrophobicContact CB-CD1 3.64Å; D283-Y390 HydrophobicContact CB-CE1 3.48Å; D283-Y390 VanDerWaalsContact CB-CE1 3.48Å; D283-Y390 HydrophobicContact CB-CG 4.28Å; D283-Y390 WeakPolarHBondContact OD2-CD2 3.33Å; D283-Y390 VanDerWaalsContact OD2-CG 3.28Å; F325-Y390 HydrophobicContact CB-CE2 4.24Å; N328-Y390 PolarHBondContact OD1-OH 2.92Å; S386-Y390 WeakPolarHBondContact O-CB 2.98Å; S386-Y390 PolarHBondContact O-N 3.04Å; Y390-I392 VanDerWaalsContact C-N 3.27Å; Y390-I392 PolarHBondContact O-N 3.12Å; Y390-G394 VanDerWaalsContact O-CA 3.29Å; Y390-G394 WeakPolarHBondContact O-CA 3.3Å; Y390-G394 PolarHBondContact O-N 3.01Å |
| 391 | A | 98 | Very high | 95.9 | Very high | 41 Ų | 41 | 50.5 Ų | 50.5 | 34% | 0.339 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.2 | -37.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K280 V387 V388 | K280-A391 VanDerWaalsContact CE-O 3.23Å; K280-A391 WeakPolarHBondContact CE-O 3.19Å; K280-A391 PolarHBondContact NZ-O 3.1Å; V387-A391 WeakPolarHBondContact O-CB 3.35Å; V387-A391 PolarHBondContact O-N 3.43Å; V388-A391 PolarHBondContact O-N 2.84Å |
| 392 | I | 98 | Very high | 95.4 | Very high | 106 Ų | 106 | 48.3 Ų | 48.3 | 54% | 0.544 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -78.9 | -53.2 | 178.8 | -62.9 | 168.3 | 0 | 0 | 0 | 110.2 | V388 F389 Y390 | V388-I392 HydrophobicContact CG1-CD1 3.98Å; V388-I392 VanDerWaalsContact O-CG1 3.32Å; V388-I392 WeakPolarHBondContact O-CG1 3.42Å; V388-I392 PolarHBondContact O-N 2.85Å; F389-I392 PolarHBondContact O-N 3.02Å; Y390-I392 VanDerWaalsContact C-N 3.27Å; Y390-I392 PolarHBondContact O-N 3.12Å |
| 393 | F | 98 | Very high | 94.6 | Very high | 75 Ų | 75 | 49.1 Ų | 49.1 | 33% | 0.329 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -102.9 | -14.2 | -163.1 | -65.2 | -60.9 | 0 | 0 | 0 | 115.5 | I204 A208 F389 | I204-F393 HydrophobicContact CG2-CB 3.62Å; I204-F393 HydrophobicContact CG2-CD1 3.38Å; I204-F393 HydrophobicContact CG2-CE1 4.19Å; I204-F393 HydrophobicContact CG2-CG 3.63Å; A208-F393 HydrophobicContact CB-CB 4Å; F389-F393 HydrophobicContact CD1-CB 4.35Å; F389-F393 AromaticContact CD1-CD2 3.88Å; F389-F393 HydrophobicContact CD1-CD2 3.88Å; F389-F393 AromaticContact CD2-CD2 3.77Å; F389-F393 HydrophobicContact CD2-CD2 3.77Å; F389-F393 AromaticContact CD2-CE2 3.94Å; F389-F393 HydrophobicContact CD2-CE2 3.94Å; F389-F393 HydrophobicContact CE1-CB 4.08Å; F389-F393 AromaticContact CE1-CD2 3.7Å; F389-F393 HydrophobicContact CE1-CD2 3.7Å; F389-F393 HydrophobicContact CE1-CG 4.21Å; F389-F393 AromaticContact CE2-CD2 3.6Å; F389-F393 HydrophobicContact CE2-CD2 3.6Å; F389-F393 AromaticContact CE2-CE2 3.68Å; F389-F393 HydrophobicContact CE2-CE2 3.68Å; F389-F393 AromaticContact CG-CD2 3.91Å; F389-F393 HydrophobicContact CG-CD2 3.91Å; F389-F393 AromaticContact CZ-CD2 3.57Å; F389-F393 HydrophobicContact CZ-CD2 3.57Å; F389-F393 HydrophobicContact CZ-CE2 4.02Å; F389-F393 HydrophobicContact CZ-CG 4.28Å; F389-F393 WeakPolarHBondContact O-CB 3.48Å; F389-F393 WeakPolarHBondContact O-CD2 3.4Å; F389-F393 PolarHBondContact O-N 3.42Å |
| 394 | G | 97.1 | Very high | 93.1 | Very high | 2 Ų | 2 | 50.9 Ų | 50.9 | 2% | 0.021 | 26% | 0.264 | C | S | . | . | trans | -60.3 | 136 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | K280 Y390 | K280-G394 WeakPolarHBondContact CE-O 3.25Å; Y390-G394 VanDerWaalsContact O-CA 3.29Å; Y390-G394 WeakPolarHBondContact O-CA 3.3Å; Y390-G394 PolarHBondContact O-N 3.01Å | ||
| 395 | K | 96.8 | Very high | 91.1 | Very high | 104 Ų | 104 | 53.9 Ų | 53.9 | 45% | 0.452 | 28% | 0.276 | S | S | . | . | trans | -133.2 | 149 | 173.7 | -65.5 | -167.6 | -179.9 | -176.1 | 0 | 109.7 | P205 N328 L332 | P205-K395 HydrophobicContact CB-CB 4Å; P205-K395 HydrophobicContact CB-CG 4.27Å; P205-K395 HydrophobicContact CG-CB 4.03Å; P205-K395 HydrophobicContact CG-CD 3.74Å; P205-K395 HydrophobicContact CG-CG 3.82Å; N328-K395 PolarHBondContact ND2-O 3.34Å; N328-K395 PolarHBondContact OD1-O 3.38Å; L332-K395 HydrophobicContact CD2-CB 4.19Å; L332-K395 VanDerWaalsContact CD2-O 3.29Å; L332-K395 WeakPolarHBondContact CD2-O 3.29Å | ||
| 396 | G | 93.2 | Very high | 88.9 | Confident | 6 Ų | 6 | 52.1 Ų | 52.1 | 6% | 0.062 | 28% | 0.282 | C | S | . | . | trans | -118.2 | 30.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | T275 T276 | T275-G396 WeakPolarHBondContact CB-O 3.39Å; T275-G396 WeakPolarHBondContact CG2-O 3.32Å; T276-G396 PolarHBondContact OG1-N 3.24Å | ||
| 397 | T | 92.6 | Very high | 86.7 | Confident | 77 Ų | 77 | 52.8 Ų | 52.8 | 47% | 0.472 | 29% | 0.285 | S | S | . | . | S | Bend | trans | -122.5 | 147.6 | -179 | 59.4 | 0 | 0 | 0 | 0 | 110.4 | D331 Q399 | D331-T397 CarbonylContact O-C 3.58Å; T397-Q399 PolarHBondContact O-N 2.55Å; T397-Q399 PolarHBondContact O-NE2 3.07Å |
| 398 | L | 91.5 | Very high | 84.4 | Confident | 44 Ų | 44 | 56.3 Ų | 56.3 | 23% | 0.23 | 30% | 0.301 | C | S | . | . | trans | -53.1 | 129.1 | 176.5 | -175 | 64.7 | 0 | 0 | 0 | 110.4 | D331 P334 A402 Q403 T407 | D331-L398 VanDerWaalsContact O-CA 3.29Å; D331-L398 WeakPolarHBondContact O-CA 3.24Å; D331-L398 PolarHBondContact O-N 3.24Å; P334-L398 VanDerWaalsContact CD-CD1 3.48Å; P334-L398 HydrophobicContact CG-CD1 4.24Å; L398-A402 HydrophobicContact CD1-CB 3.86Å; L398-Q403 HydrophobicContact CD2-CG 3.83Å; L398-Q403 HydrophobicContact CG-CG 4.22Å; L398-T407 HydrophobicContact CD2-CG2 4.02Å | ||
| 399 | Q | 92.2 | Very high | 82.1 | Confident | 14 Ų | 14 | 57.1 Ų | 57.1 | 7% | 0.065 | 31% | 0.31 | C | S | . | . | trans | -76.8 | 144.2 | -179.6 | -62.9 | -58 | -70.4 | 0 | 0 | 110.9 | L332 T397 W401 A402 Q403 | L332-Q399 HydrophobicContact CB-CG 4.23Å; L332-Q399 HydrophobicContact CD2-CG 3.96Å; L332-Q399 PolarHBondContact O-N 3.43Å; T397-Q399 PolarHBondContact O-N 2.55Å; T397-Q399 PolarHBondContact O-NE2 3.07Å; Q399-W401 VanDerWaalsContact C-N 3.28Å; Q399-W401 HydrophobicContact CB-CD2 4.18Å; Q399-W401 HydrophobicContact CB-CG 4.38Å; Q399-W401 HydrophobicContact CB-CZ2 3.85Å; Q399-W401 HydrophobicContact CG-CZ2 4.02Å; Q399-W401 PolarHBondContact O-N 3.33Å; Q399-A402 HydrophobicContact CB-CB 4.45Å; Q399-A402 CarbonylContact O-C 3.46Å; Q399-A402 WeakPolarHBondContact O-CA 3.39Å; Q399-A402 WeakPolarHBondContact O-CB 3.42Å; Q399-A402 PolarHBondContact O-N 3.38Å; Q399-Q403 PolarHBondContact O-N 2.94Å | ||
| 400 | P | 89.3 | Confident | 80 | Confident | 91 Ų | 91 | 57.4 Ų | 57.4 | 59% | 0.591 | 32% | 0.32 | S | S | * | . | G | 310 helix | trans | -57 | -37.7 | -175.5 | -27.7 | 34.7 | 0 | 0 | 0 | 114.2 | A402 Q403 | P400-A402 PolarHBondContact O-N 3.1Å; P400-Q403 WeakPolarHBondContact O-CB 3.37Å; P400-Q403 PolarHBondContact O-N 3.06Å; P400-Q403 VanDerWaalsContact O-N 3.16Å |
| 401 | W | 88.3 | Confident | 77.8 | Confident | 54 Ų | 54 | 60.1 Ų | 60.1 | 21% | 0.205 | 34% | 0.337 | C | S | . | . | G | 310 helix | trans | -70.3 | -13.4 | 176.9 | 56.7 | -101.5 | 0 | 0 | 0 | 113.5 | P196 I200 I206 C333 Y336 Q399 | P196-W401 HydrophobicContact CG-CE3 3.99Å; I200-W401 HydrophobicContact CD1-CZ3 4.27Å; I200-W401 HydrophobicContact CG1-CE3 4.14Å; I200-W401 HydrophobicContact CG1-CH2 3.66Å; I200-W401 HydrophobicContact CG1-CZ2 4.36Å; I200-W401 HydrophobicContact CG1-CZ3 3.52Å; I206-W401 HydrophobicContact CD1-CH2 4.32Å; I206-W401 HydrophobicContact CD1-CZ2 4.07Å; I206-W401 HydrophobicContact CG1-CZ2 3.91Å; C333-W401 HydrophobicContact CB-CH2 3.53Å; C333-W401 HydrophobicContact CB-CZ2 4.44Å; C333-W401 HydrophobicContact CB-CZ3 3.95Å; Y336-W401 AromaticContact CD2-CZ3 3.86Å; Y336-W401 HydrophobicContact CD2-CZ3 3.86Å; Y336-W401 HydrophobicContact CE2-CZ3 4.33Å; Q399-W401 VanDerWaalsContact C-N 3.28Å; Q399-W401 HydrophobicContact CB-CD2 4.18Å; Q399-W401 HydrophobicContact CB-CG 4.38Å; Q399-W401 HydrophobicContact CB-CZ2 3.85Å; Q399-W401 HydrophobicContact CG-CZ2 4.02Å; Q399-W401 PolarHBondContact O-N 3.33Å |
| 402 | A | 86.4 | Confident | 75.5 | Confident | 2 Ų | 2 | 63.5 Ų | 63.5 | 2% | 0.017 | 35% | 0.349 | C | S | . | . | G | 310 helix | trans | -98.2 | 1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | C333 Q335 L398 Q399 P400 | C333-A402 HydrophobicContact CB-CB 4.03Å; Q335-A402 VanDerWaalsContact NE2-C 3.32Å; Q335-A402 VanDerWaalsContact NE2-CA 3.32Å; Q335-A402 PolarHBondContact NE2-O 3.24Å; L398-A402 HydrophobicContact CD1-CB 3.86Å; Q399-A402 HydrophobicContact CB-CB 4.45Å; Q399-A402 CarbonylContact O-C 3.46Å; Q399-A402 WeakPolarHBondContact O-CA 3.39Å; Q399-A402 WeakPolarHBondContact O-CB 3.42Å; Q399-A402 PolarHBondContact O-N 3.38Å; P400-A402 PolarHBondContact O-N 3.1Å |
| 403 | Q | 79.6 | Confident | 73.2 | Confident | 60 Ų | 60 | 60.7 Ų | 60.7 | 28% | 0.28 | 34% | 0.341 | S | S | . | . | trans | -75.5 | 137 | 175.3 | -68 | 176.2 | -10.2 | 0 | 0 | 110.3 | L398 Q399 P400 Q408 | L398-Q403 HydrophobicContact CD2-CG 3.83Å; L398-Q403 HydrophobicContact CG-CG 4.22Å; Q399-Q403 PolarHBondContact O-N 2.94Å; P400-Q403 WeakPolarHBondContact O-CB 3.37Å; P400-Q403 PolarHBondContact O-N 3.06Å; P400-Q403 VanDerWaalsContact O-N 3.16Å; Q403-Q408 HydrophobicContact CB-CG 4.27Å | ||
| 404 | T | 67.8 | Low | 71 | Confident | 39 Ų | 39 | 61 Ų | 61 | 24% | 0.239 | 35% | 0.349 | C | S | . | . | trans | -85.5 | 163.4 | 168 | 65.2 | 0 | 0 | 0 | 0 | 109.7 | G184 A406 T407 Q408 | G184-T404 WeakPolarHBondContact O-CG2 3.4Å; T404-A406 PolarHBondContact O-N 3.46Å; T404-A406 VanDerWaalsContact O-N 3.14Å; T404-T407 PolarHBondContact N-OG1 3.37Å; T404-T407 WeakPolarHBondContact O-CB 3.43Å; T404-T407 PolarHBondContact O-N 2.91Å; T404-T407 PolarHBondContact OG1-OG1 2.83Å; T404-Q408 PolarHBondContact O-N 3.3Å; T404-Q408 VanDerWaalsContact O-N 3.13Å | ||
| 405 | K | 54.2 | Low | 68.7 | Low | 180 Ų | 180 | 64.6 Ų | 64.6 | 78% | 0.783 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -53.4 | -34.3 | 175.1 | -72.6 | -172.8 | 178 | -176.2 | 0 | 112.5 | Q408 S409 | K405-Q408 PolarHBondContact O-N 3.29Å; K405-S409 PolarHBondContact O-N 3.36Å; K405-S409 PolarHBondContact O-OG 3.28Å |
| 406 | A | 52.7 | Low | 66 | Low | 70 Ų | 70 | 66.3 Ų | 66.3 | 58% | 0.579 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -67.8 | -35 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | T404 A410 | T404-A406 PolarHBondContact O-N 3.46Å; T404-A406 VanDerWaalsContact O-N 3.14Å; A406-A410 PolarHBondContact O-N 3.1Å |
| 407 | T | 52.3 | Low | 63.7 | Low | 14 Ų | 14 | 71.7 Ų | 71.7 | 9% | 0.086 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -71.4 | -37.7 | 177 | -33.2 | 0 | 0 | 0 | 0 | 111.2 | G184 L398 T404 S409 A410 T411 | G184-T407 WeakPolarHBondContact CA-OG1 3.4Å; L398-T407 HydrophobicContact CD2-CG2 4.02Å; T404-T407 PolarHBondContact N-OG1 3.37Å; T404-T407 WeakPolarHBondContact O-CB 3.43Å; T404-T407 PolarHBondContact O-N 2.91Å; T404-T407 PolarHBondContact OG1-OG1 2.83Å; T407-S409 VanDerWaalsContact C-N 3.35Å; T407-S409 PolarHBondContact O-N 3.21Å; T407-A410 PolarHBondContact O-N 3.49Å; T407-T411 PolarHBondContact O-N 3.42Å; T407-T411 PolarHBondContact O-OG1 2.91Å |
| 408 | Q | 50.5 | Low | 61.4 | Low | 93 Ų | 93 | 75 Ų | 75 | 44% | 0.435 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -60 | -43 | 176.5 | -68.9 | 176.2 | -17.7 | 0 | 0 | 111.9 | Q403 T404 K405 T411 L412 | Q403-Q408 HydrophobicContact CB-CG 4.27Å; T404-Q408 PolarHBondContact O-N 3.3Å; T404-Q408 VanDerWaalsContact O-N 3.13Å; K405-Q408 PolarHBondContact O-N 3.29Å; Q408-T411 PolarHBondContact O-N 2.98Å; Q408-L412 WeakPolarHBondContact O-CD1 3.28Å; Q408-L412 VanDerWaalsContact O-CG 3.28Å; Q408-L412 WeakPolarHBondContact O-CG 3.48Å; Q408-L412 PolarHBondContact O-N 3.43Å |
| 409 | S | 49.3 | Very low | 58.9 | Low | 81 Ų | 81 | 79.5 Ų | 79.5 | 57% | 0.566 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -65.2 | -38.8 | 175.4 | -59.6 | 0 | 0 | 0 | 0 | 113.2 | K405 T407 L412 A413 | K405-S409 PolarHBondContact O-N 3.36Å; K405-S409 PolarHBondContact O-OG 3.28Å; T407-S409 VanDerWaalsContact C-N 3.35Å; T407-S409 PolarHBondContact O-N 3.21Å; S409-L412 PolarHBondContact O-N 3.18Å; S409-A413 PolarHBondContact O-N 3.33Å; S409-A413 VanDerWaalsContact O-N 3.1Å |
| 410 | A | 54.3 | Low | 56.5 | Low | 51 Ų | 51 | 87 Ų | 87 | 42% | 0.421 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.7 | -39.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | A406 T407 A413 T414 | A406-A410 PolarHBondContact O-N 3.1Å; T407-A410 PolarHBondContact O-N 3.49Å; A410-A413 PolarHBondContact O-N 3.17Å; A410-T414 PolarHBondContact O-N 2.88Å; A410-T414 VanDerWaalsContact O-N 3.08Å; A410-T414 PolarHBondContact O-OG1 3.21Å |
| 411 | T | 52.6 | Low | 54.9 | Low | 59 Ų | 59 | 86.8 Ų | 86.8 | 36% | 0.362 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.7 | -38.6 | 175.4 | -53.7 | 0 | 0 | 0 | 0 | 111.7 | T407 Q408 T414 V415 | T407-T411 PolarHBondContact O-N 3.42Å; T407-T411 PolarHBondContact O-OG1 2.91Å; Q408-T411 PolarHBondContact O-N 2.98Å; T411-T414 WeakPolarHBondContact CA-OG1 3.41Å; T411-T414 PolarHBondContact O-N 3.28Å; T411-T414 PolarHBondContact O-OG1 3.42Å; T411-V415 VanDerWaalsContact O-CG2 3.31Å; T411-V415 WeakPolarHBondContact O-CG2 3.32Å; T411-V415 PolarHBondContact O-N 2.88Å; T411-V415 VanDerWaalsContact O-N 3.11Å |
| 412 | L | 49 | Very low | 53.1 | Low | 111 Ų | 111 | 88.5 Ų | 88.5 | 58% | 0.581 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.3 | -43.6 | 174.6 | -74.2 | 164.6 | 0 | 0 | 0 | 111.6 | Q408 S409 T414 V415 E416 | Q408-L412 WeakPolarHBondContact O-CD1 3.28Å; Q408-L412 VanDerWaalsContact O-CG 3.28Å; Q408-L412 WeakPolarHBondContact O-CG 3.48Å; Q408-L412 PolarHBondContact O-N 3.43Å; S409-L412 PolarHBondContact O-N 3.18Å; L412-T414 PolarHBondContact O-N 2.98Å; L412-V415 PolarHBondContact O-N 2.91Å; L412-E416 PolarHBondContact O-N 3.25Å |
| 413 | A | 49.7 | Very low | 51.3 | Low | 47 Ų | 47 | 93.3 Ų | 93.3 | 39% | 0.388 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.8 | -40.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | S409 A410 V415 E416 D417 | S409-A413 PolarHBondContact O-N 3.33Å; S409-A413 VanDerWaalsContact O-N 3.1Å; A410-A413 PolarHBondContact O-N 3.17Å; A413-V415 VanDerWaalsContact C-N 3.33Å; A413-V415 PolarHBondContact O-N 3.32Å; A413-E416 PolarHBondContact O-N 3.14Å; A413-D417 PolarHBondContact O-N 3.13Å; A413-D417 VanDerWaalsContact O-N 3.11Å |
| 414 | T | 50.9 | Low | 49.6 | Very low | 82 Ų | 82 | 95.2 Ų | 95.2 | 50% | 0.503 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -69.7 | -28 | 176.6 | 50.2 | 0 | 0 | 0 | 0 | 113.8 | A410 T411 L412 D418 | A410-T414 PolarHBondContact O-N 2.88Å; A410-T414 VanDerWaalsContact O-N 3.08Å; A410-T414 PolarHBondContact O-OG1 3.21Å; T411-T414 WeakPolarHBondContact CA-OG1 3.41Å; T411-T414 PolarHBondContact O-N 3.28Å; T411-T414 PolarHBondContact O-OG1 3.42Å; L412-T414 PolarHBondContact O-N 2.98Å; T414-D418 PolarHBondContact O-N 3.38Å |
| 415 | V | 48.9 | Very low | 48.5 | Very low | 77 Ų | 77 | 98.8 Ų | 98.8 | 47% | 0.467 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -76.4 | -36.4 | 175.5 | 172.6 | 0 | 0 | 0 | 0 | 110.5 | T411 L412 A413 D417 D418 D419 | T411-V415 VanDerWaalsContact O-CG2 3.31Å; T411-V415 WeakPolarHBondContact O-CG2 3.32Å; T411-V415 PolarHBondContact O-N 2.88Å; T411-V415 VanDerWaalsContact O-N 3.11Å; L412-V415 PolarHBondContact O-N 2.91Å; A413-V415 VanDerWaalsContact C-N 3.33Å; A413-V415 PolarHBondContact O-N 3.32Å; V415-D417 VanDerWaalsContact C-N 3.34Å; V415-D418 PolarHBondContact O-N 2.87Å; V415-D419 PolarHBondContact O-N 3.27Å |
| 416 | E | 40.1 | Very low | 48.1 | Very low | 140 Ų | 140 | 93.3 Ų | 93.3 | 65% | 0.654 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -64.9 | -35.5 | 173.4 | -74.9 | 177.8 | 175.8 | 0 | 0 | 112.5 | L412 A413 | L412-E416 PolarHBondContact O-N 3.25Å; A413-E416 PolarHBondContact O-N 3.14Å |
| 417 | D | 46.2 | Very low | 47.8 | Very low | 120 Ų | 120 | 95 Ų | 95 | 64% | 0.642 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -73.4 | -25.7 | 176 | -81 | -20.8 | 0 | 0 | 0 | 113.6 | A413 V415 T420 | A413-D417 PolarHBondContact O-N 3.13Å; A413-D417 VanDerWaalsContact O-N 3.11Å; V415-D417 VanDerWaalsContact C-N 3.34Å; D417-T420 PolarHBondContact O-OG1 3.32Å |
| 418 | D | 43.1 | Very low | 47.4 | Very low | 145 Ų | 145 | 101.2 Ų | 101.2 | 78% | 0.775 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -82.3 | -17.3 | 176.6 | -92.6 | -12.9 | 0 | 0 | 0 | 112.6 | T414 V415 | T414-D418 PolarHBondContact O-N 3.38Å; V415-D418 PolarHBondContact O-N 2.87Å |
| 419 | D | 40.1 | Very low | 47.2 | Very low | 140 Ų | 140 | 101.9 Ų | 101.9 | 75% | 0.749 | 60% | 0.596 | S | S | * | * | trans | -95.1 | 3.3 | 179.4 | -82.6 | -20.3 | 0 | 0 | 0 | 113.7 | V415 | V415-D419 PolarHBondContact O-N 3.27Š| ||
| 420 | T | 41.9 | Very low | 47 | Very low | 170 Ų | 170 | 103.8 Ų | 103.8 | 100% | 1.043 | 60% | 0.599 | S | S | * | * | trans | -114.7 | 0 | 173.3 | 59.9 | 0 | 0 | 0 | 0 | 112.5 | D417 | D417-T420 PolarHBondContact O-OG1 3.32Š|
Retrieved 420 of 420 residues in 133.5 ms
(Link to these results)