| 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 | R | 38 | Very low | 48.5 | Very low | 288 Ų | 288 | 130.9 Ų | 130.9 | 100% | 1.087 | 73% | 0.726 | S | S | * | * | 0 | 79.9 | 0 | -167.8 | -175.6 | -130.9 | 164.7 | 3.5 | 108.9 | |||||
| 2 | Q | 37.6 | Very low | 51.4 | Low | 193 Ų | 193 | 128.8 Ų | 128.8 | 90% | 0.902 | 72% | 0.722 | S | S | * | * | trans | -173.3 | 97 | 145.4 | -114 | 163.7 | -20.5 | 0 | 0 | 104.7 | ||||
| 3 | D | 37.9 | Very low | 53.9 | Low | 155 Ų | 155 | 128.8 Ų | 128.8 | 83% | 0.829 | 71% | 0.713 | S | S | * | * | trans | -68.4 | 140.9 | -169.9 | -60.1 | -57.8 | 0 | 0 | 0 | 110.9 | A5 | D3-A5 PolarHBondContact O-N 3.03Š| ||
| 4 | A | 40.8 | Very low | 56.3 | Low | 101 Ų | 101 | 123.8 Ų | 123.8 | 84% | 0.835 | 69% | 0.688 | S | S | * | * | trans | -57.5 | 101.9 | 167.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | M6 | A4-M6 VanDerWaalsContact C-N 3.3Å; A4-M6 PolarHBondContact O-N 3.11Å; A4-M6 VanDerWaalsContact O-N 3.11Å | ||
| 5 | A | 40.1 | Very low | 58.4 | Low | 95 Ų | 95 | 124.8 Ų | 124.8 | 79% | 0.785 | 68% | 0.682 | S | S | * | * | trans | -79.2 | 89.9 | 161.5 | 0 | 0 | 0 | 0 | 0 | 108.1 | D3 N7 | D3-A5 PolarHBondContact O-N 3.03Å; A5-N7 PolarHBondContact O-N 3.06Å | ||
| 6 | M | 42.4 | Very low | 60.3 | Low | 146 Ų | 146 | 118.3 Ų | 118.3 | 72% | 0.719 | 65% | 0.647 | S | S | * | * | trans | -42.6 | 98.9 | 165.8 | -170.6 | 163.3 | 73.1 | 0 | 0 | 111.8 | A4 Q8 | A4-M6 VanDerWaalsContact C-N 3.3Å; A4-M6 PolarHBondContact O-N 3.11Å; A4-M6 VanDerWaalsContact O-N 3.11Å; M6-Q8 HydrophobicContact CG-CB 3.99Å; M6-Q8 HydrophobicContact CG-CG 4.25Å; M6-Q8 PolarHBondContact O-N 3.05Å | ||
| 7 | N | 41.3 | Very low | 62.1 | Low | 153 Ų | 153 | 116.2 Ų | 116.2 | 82% | 0.818 | 64% | 0.641 | S | S | * | * | trans | -79.2 | 51.6 | 164.2 | -95.9 | -5.9 | 0 | 0 | 0 | 110.1 | A5 | A5-N7 PolarHBondContact O-N 3.06Š| ||
| 8 | Q | 52.3 | Low | 63.6 | Low | 151 Ų | 151 | 113.8 Ų | 113.8 | 71% | 0.706 | 62% | 0.623 | S | S | * | * | trans | -91.7 | 100.6 | 159.7 | -83.6 | 177.6 | -23.6 | 0 | 0 | 106.1 | M6 G10 | M6-Q8 HydrophobicContact CG-CB 3.99Å; M6-Q8 HydrophobicContact CG-CG 4.25Å; M6-Q8 PolarHBondContact O-N 3.05Å; Q8-G10 PolarHBondContact O-N 2.77Å | ||
| 9 | T | 57.5 | Low | 65.1 | Low | 47 Ų | 47 | 112.5 Ų | 112.5 | 29% | 0.288 | 62% | 0.621 | S | S | . | * | trans | -56.2 | 103.3 | 164 | 10.5 | 0 | 0 | 0 | 0 | 107.3 | C11 P252 E255 | T9-C11 PolarHBondContact O-N 2.92Å; T9-P252 HydrophobicContact CG2-CB 4.04Å; T9-P252 WeakPolarHBondContact OG1-CB 3.24Å; T9-E255 WeakPolarHBondContact CB-OE2 3.35Å; T9-E255 PolarHBondContact OG1-OE2 3.08Å | ||
| 10 | G | 65.9 | Low | 66.5 | Low | 75 Ų | 75 | 109.9 Ų | 109.9 | 77% | 0.773 | 61% | 0.608 | S | S | * | * | trans | -71.8 | 59.1 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q8 P12 | Q8-G10 PolarHBondContact O-N 2.77Å; G10-P12 VanDerWaalsContact O-CD 3.24Å; G10-P12 WeakPolarHBondContact O-CD 3.49Å | ||
| 11 | C | 79.2 | Confident | 67.7 | Low | 36 Ų | 36 | 105.1 Ų | 105.1 | 24% | 0.243 | 58% | 0.581 | C | S | . | * | trans | -101.4 | 97.2 | -177.5 | -57.9 | 0 | 0 | 0 | 0 | 109 | T9 C256 | T9-C11 PolarHBondContact O-N 2.92Å; C11-C256 HydrophobicContact CB-CB 4.16Å; C11-C256 VanDerWaalsContact SG-CA 3.56Å; C11-C256 WeakPolarHBondContact SG-CB 3.37Å | ||
| 12 | P | 83.8 | Confident | 70.3 | Confident | 105 Ų | 105 | 93.9 Ų | 93.9 | 68% | 0.682 | 54% | 0.54 | S | S | * | . | trans | -63 | 142.3 | 176.5 | 27.8 | -34.2 | 0 | 0 | 0 | 109.8 | G10 V14 S259 | G10-P12 VanDerWaalsContact O-CD 3.24Å; G10-P12 WeakPolarHBondContact O-CD 3.49Å; P12-V14 PolarHBondContact O-N 2.55Å; P12-S259 PolarHBondContact O-OG 3.36Å | ||
| 13 | E | 83.6 | Confident | 72.9 | Confident | 130 Ų | 130 | 88.8 Ų | 88.8 | 61% | 0.607 | 52% | 0.522 | S | S | * | . | trans | -62.5 | 124.5 | 173.8 | -170.9 | 176.1 | -149.2 | 0 | 0 | 109.8 | K15 S259 | E13-K15 HydrophobicContact CG-CG 4.37Å; E13-K15 PolarHBondContact O-N 3.05Å; E13-K15 WeakPolarHBondContact OE2-CE 3.43Å; E13-K15 IonicContact OE2-NZ 3.7Å; E13-S259 WeakPolarHBondContact CA-OG 3.43Å | ||
| 14 | V | 87.9 | Confident | 75.6 | Confident | 58 Ų | 58 | 82.3 Ų | 82.3 | 35% | 0.352 | 49% | 0.488 | S | S | . | . | trans | -87.7 | 100.7 | 179.6 | 178 | 0 | 0 | 0 | 0 | 108.7 | P12 S259 L260 | P12-V14 PolarHBondContact O-N 2.55Å; V14-S259 PolarHBondContact N-O 3.14Å; V14-S259 PolarHBondContact N-OG 2.63Å; V14-L260 HydrophobicContact CB-CD2 4.07Å; V14-L260 HydrophobicContact CG2-CD2 3.67Å | ||
| 15 | K | 88.1 | Confident | 78 | Confident | 139 Ų | 139 | 77.6 Ų | 77.6 | 60% | 0.604 | 45% | 0.449 | S | S | * | . | P | Polyproline II helix | trans | -88 | 134.4 | 176.5 | -61 | -165.8 | 174.8 | -167.9 | 0 | 111.6 | E13 E262 | E13-K15 HydrophobicContact CG-CG 4.37Å; E13-K15 PolarHBondContact O-N 3.05Å; E13-K15 WeakPolarHBondContact OE2-CE 3.43Å; E13-K15 IonicContact OE2-NZ 3.7Å; K15-E262 VanDerWaalsContact CA-OE2 3.23Å; K15-E262 WeakPolarHBondContact CA-OE2 3.17Å |
| 16 | V | 89 | Confident | 80.5 | Confident | 21 Ų | 21 | 78.1 Ų | 78.1 | 13% | 0.127 | 44% | 0.438 | C | S | . | . | P | Polyproline II helix | trans | -97.2 | 130.6 | 172.2 | -177.5 | 0 | 0 | 0 | 0 | 109.4 | F18 V20 F21 E262 L263 V266 | V16-F18 PolarHBondContact O-N 3.06Å; V16-V20 HydrophobicContact CG1-CB 3.79Å; V16-V20 HydrophobicContact CG1-CG1 3.95Å; V16-V20 HydrophobicContact CG1-CG2 4.21Å; V16-F21 HydrophobicContact CB-CD2 4.43Å; V16-F21 HydrophobicContact CB-CE2 3.71Å; V16-F21 HydrophobicContact CB-CZ 4.15Å; V16-F21 HydrophobicContact CG1-CD2 4.39Å; V16-F21 HydrophobicContact CG1-CE2 4.12Å; V16-E262 HydrophobicContact CB-CB 4.49Å; V16-E262 HydrophobicContact CG2-CB 4.15Å; V16-E262 PolarHBondContact N-OE2 3.2Å; V16-L263 HydrophobicContact CG2-CB 4.45Å; V16-V266 HydrophobicContact CB-CG2 3.98Å; V16-V266 HydrophobicContact CG1-CG2 3.78Å; V16-V266 HydrophobicContact CG2-CG2 3.98Å |
| 17 | P | 90.9 | Very high | 83 | Confident | 83 Ų | 83 | 74 Ų | 74 | 54% | 0.539 | 42% | 0.42 | S | S | . | . | P | Polyproline II helix | trans | -59 | 134.4 | 179.1 | -23.7 | 33.4 | 0 | 0 | 0 | 112.5 | P19 V20 | P17-P19 VanDerWaalsContact C-N 3.27Å; P17-P19 VanDerWaalsContact O-N 3.12Å; P17-V20 HydrophobicContact CB-CG2 4.39Å; P17-V20 WeakPolarHBondContact O-CB 3.22Å; P17-V20 PolarHBondContact O-N 3.11Å |
| 18 | F | 88.9 | Confident | 85.5 | Confident | 72 Ų | 72 | 66.7 Ų | 66.7 | 32% | 0.316 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -47 | -39.3 | 175.1 | -67.9 | -62.7 | 0 | 0 | 0 | 115 | V16 V20 F21 F22 I74 V75 | V16-F18 PolarHBondContact O-N 3.06Å; F18-V20 PolarHBondContact O-N 3.32Å; F18-V20 VanDerWaalsContact O-N 3.15Å; F18-F21 PolarHBondContact O-N 3.27Å; F18-F21 VanDerWaalsContact O-N 3.11Å; F18-F22 HydrophobicContact CB-CD2 4.3Å; F18-F22 HydrophobicContact CB-CE2 4.08Å; F18-F22 WeakPolarHBondContact O-CD2 3.45Å; F18-F22 PolarHBondContact O-N 2.99Å; F18-I74 HydrophobicContact CE1-CG2 3.96Å; F18-I74 HydrophobicContact CZ-CG2 4.01Å; F18-V75 HydrophobicContact CB-CG2 4.19Å; F18-V75 HydrophobicContact CD1-CG2 3.35Å; F18-V75 HydrophobicContact CD2-CG2 3.75Å; F18-V75 HydrophobicContact CE1-CG2 3.47Å; F18-V75 VanDerWaalsContact CE1-CG2 3.47Å; F18-V75 HydrophobicContact CE2-CG2 3.85Å; F18-V75 HydrophobicContact CG-CG2 3.49Å; F18-V75 VanDerWaalsContact CG-CG2 3.49Å; F18-V75 HydrophobicContact CZ-CG2 3.71Å |
| 19 | P | 92.5 | Very high | 87.5 | Confident | 89 Ų | 89 | 62 Ų | 62 | 58% | 0.578 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -55.6 | -32.3 | 175.8 | -28.1 | 36.5 | 0 | 0 | 0 | 114 | P17 T23 | P17-P19 VanDerWaalsContact C-N 3.27Å; P17-P19 VanDerWaalsContact O-N 3.12Å; P19-T23 VanDerWaalsContact O-CB 3.26Å; P19-T23 WeakPolarHBondContact O-CB 3.48Å; P19-T23 PolarHBondContact O-N 3.27Å; P19-T23 PolarHBondContact O-OG1 3.43Å |
| 20 | V | 92.8 | Very high | 89.2 | Confident | 60 Ų | 60 | 62.5 Ų | 62.5 | 36% | 0.364 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -68.4 | -47.2 | 177.4 | 179.9 | 0 | 0 | 0 | 0 | 110.2 | V16 P17 F18 F22 T23 V24 V266 | V16-V20 HydrophobicContact CG1-CB 3.79Å; V16-V20 HydrophobicContact CG1-CG1 3.95Å; V16-V20 HydrophobicContact CG1-CG2 4.21Å; P17-V20 HydrophobicContact CB-CG2 4.39Å; P17-V20 WeakPolarHBondContact O-CB 3.22Å; P17-V20 PolarHBondContact O-N 3.11Å; F18-V20 PolarHBondContact O-N 3.32Å; F18-V20 VanDerWaalsContact O-N 3.15Å; V20-F22 PolarHBondContact O-N 3.21Å; V20-T23 PolarHBondContact O-N 3.3Å; V20-V24 HydrophobicContact CG1-CG2 4.39Å; V20-V24 WeakPolarHBondContact O-CB 3.23Å; V20-V24 WeakPolarHBondContact O-CG2 3.1Å; V20-V24 PolarHBondContact O-N 3.35Å; V20-V266 HydrophobicContact CG1-CG1 4.15Å |
| 21 | F | 90.6 | Very high | 90.5 | Very high | 10 Ų | 10 | 62 Ų | 62 | 4% | 0.044 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -57.7 | -47.5 | 176.9 | -77.4 | -73.1 | 0 | 0 | 0 | 112.3 | V16 F18 G25 E262 V265 V266 M269 | V16-F21 HydrophobicContact CB-CD2 4.43Å; V16-F21 HydrophobicContact CB-CE2 3.71Å; V16-F21 HydrophobicContact CB-CZ 4.15Å; V16-F21 HydrophobicContact CG1-CD2 4.39Å; V16-F21 HydrophobicContact CG1-CE2 4.12Å; F18-F21 PolarHBondContact O-N 3.27Å; F18-F21 VanDerWaalsContact O-N 3.11Å; F21-G25 PolarHBondContact O-N 3.23Å; F21-E262 HydrophobicContact CZ-CB 4.22Å; F21-V265 HydrophobicContact CE1-CG1 4.06Å; F21-V266 HydrophobicContact CD1-CG2 3.71Å; F21-V266 HydrophobicContact CD2-CG2 4.47Å; F21-V266 HydrophobicContact CE1-CB 4.36Å; F21-V266 HydrophobicContact CE1-CG2 3.17Å; F21-V266 HydrophobicContact CE2-CG2 4.03Å; F21-V266 HydrophobicContact CG-CG2 4.34Å; F21-V266 HydrophobicContact CZ-CG2 3.35Å; F21-M269 HydrophobicContact CD1-CE 4.5Å; F21-M269 HydrophobicContact CD1-SD 3.74Å; F21-M269 HydrophobicContact CE1-SD 4.17Å |
| 22 | F | 92.4 | Very high | 91.2 | Very high | 52 Ų | 52 | 60.3 Ų | 60.3 | 23% | 0.228 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67.5 | -40.2 | 178.7 | -71.1 | -63.3 | 0 | 0 | 0 | 112.5 | F18 V20 G25 I26 N71 L72 V75 | F18-F22 HydrophobicContact CB-CD2 4.3Å; F18-F22 HydrophobicContact CB-CE2 4.08Å; F18-F22 WeakPolarHBondContact O-CD2 3.45Å; F18-F22 PolarHBondContact O-N 2.99Å; V20-F22 PolarHBondContact O-N 3.21Å; F22-G25 PolarHBondContact O-N 3.43Å; F22-I26 WeakPolarHBondContact O-CB 3.41Å; F22-I26 VanDerWaalsContact O-CG1 3.26Å; F22-I26 WeakPolarHBondContact O-CG1 3.5Å; F22-I26 PolarHBondContact O-N 3.17Å; F22-N71 HydrophobicContact CE1-CB 4.22Å; F22-N71 HydrophobicContact CZ-CB 4.2Å; F22-L72 HydrophobicContact CE1-CB 4.15Å; F22-L72 HydrophobicContact CZ-CB 4.35Å; F22-V75 HydrophobicContact CE2-CG2 4.05Å; F22-V75 HydrophobicContact CZ-CG2 4.2Å |
| 23 | T | 93.4 | Very high | 91.6 | Very high | 87 Ų | 87 | 59.3 Ų | 59.3 | 53% | 0.534 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -62.3 | -50.2 | 177.6 | -57.9 | 0 | 0 | 0 | 0 | 110.4 | P19 V20 G25 I26 V27 | P19-T23 VanDerWaalsContact O-CB 3.26Å; P19-T23 WeakPolarHBondContact O-CB 3.48Å; P19-T23 PolarHBondContact O-N 3.27Å; P19-T23 PolarHBondContact O-OG1 3.43Å; V20-T23 PolarHBondContact O-N 3.3Å; T23-G25 VanDerWaalsContact C-N 3.32Å; T23-G25 PolarHBondContact O-N 3.18Å; T23-I26 PolarHBondContact O-N 3.46Å; T23-V27 HydrophobicContact CG2-CG2 4.33Å; T23-V27 WeakPolarHBondContact O-CB 3.06Å; T23-V27 WeakPolarHBondContact O-CG2 3.49Å; T23-V27 PolarHBondContact O-N 3.33Å |
| 24 | V | 93.2 | Very high | 92 | Very high | 19 Ų | 19 | 54.8 Ų | 54.8 | 12% | 0.115 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58.5 | -46.5 | 177.1 | 168.1 | 0 | 0 | 0 | 0 | 110.7 | V20 S28 M269 L273 | V20-V24 HydrophobicContact CG1-CG2 4.39Å; V20-V24 WeakPolarHBondContact O-CB 3.23Å; V20-V24 WeakPolarHBondContact O-CG2 3.1Å; V20-V24 PolarHBondContact O-N 3.35Å; V24-S28 WeakPolarHBondContact O-CB 3.07Å; V24-S28 PolarHBondContact O-N 3.04Å; V24-M269 HydrophobicContact CG1-CB 3.79Å; V24-L273 HydrophobicContact CB-CD1 4.23Å; V24-L273 HydrophobicContact CG1-CD1 3.8Å; V24-L273 HydrophobicContact CG1-CG 4.36Å; V24-L273 HydrophobicContact CG2-CD1 4.11Å |
| 25 | G | 92.7 | Very high | 92.2 | Very high | 1 Ų | 1 | 52.1 Ų | 52.1 | 1% | 0.01 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.1 | -46.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | F21 F22 T23 S28 L29 T68 | F21-G25 PolarHBondContact O-N 3.23Å; F22-G25 PolarHBondContact O-N 3.43Å; T23-G25 VanDerWaalsContact C-N 3.32Å; T23-G25 PolarHBondContact O-N 3.18Å; G25-S28 PolarHBondContact O-N 2.86Å; G25-L29 VanDerWaalsContact O-CB 3.27Å; G25-L29 WeakPolarHBondContact O-CB 3.48Å; G25-L29 PolarHBondContact O-N 2.89Å; G25-T68 VanDerWaalsContact CA-CG2 3.46Å |
| 26 | I | 92.2 | Very high | 92.5 | Very high | 107 Ų | 107 | 46.5 Ų | 46.5 | 55% | 0.549 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -67.6 | -44.8 | -179.6 | -68.7 | 167.8 | 0 | 0 | 0 | 111.1 | F22 T23 S28 L29 A30 | F22-I26 WeakPolarHBondContact O-CB 3.41Å; F22-I26 VanDerWaalsContact O-CG1 3.26Å; F22-I26 WeakPolarHBondContact O-CG1 3.5Å; F22-I26 PolarHBondContact O-N 3.17Å; T23-I26 PolarHBondContact O-N 3.46Å; I26-S28 VanDerWaalsContact C-N 3.33Å; I26-L29 PolarHBondContact O-N 3.39Å; I26-A30 WeakPolarHBondContact O-CB 3.34Å; I26-A30 PolarHBondContact O-N 2.05Å |
| 27 | V | 94.3 | Very high | 92.6 | Very high | 58 Ų | 58 | 47 Ų | 47 | 35% | 0.352 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 178.4 | 178.2 | 0 | 0 | 0 | 0 | 109.9 | T23 L29 A30 E31 L273 | T23-V27 HydrophobicContact CG2-CG2 4.33Å; T23-V27 WeakPolarHBondContact O-CB 3.06Å; T23-V27 WeakPolarHBondContact O-CG2 3.49Å; T23-V27 PolarHBondContact O-N 3.33Å; V27-L29 VanDerWaalsContact C-N 3.34Å; V27-L29 PolarHBondContact O-N 3.45Å; V27-A30 PolarHBondContact O-N 3.32Å; V27-E31 HydrophobicContact CG1-CG 4.28Å; V27-E31 WeakPolarHBondContact O-CG 3.47Å; V27-E31 PolarHBondContact O-N 3.45Å; V27-L273 HydrophobicContact CB-CD2 3.65Å; V27-L273 HydrophobicContact CG1-CD2 3.45Å; V27-L273 VanDerWaalsContact CG1-CD2 3.45Å |
| 28 | S | 94.3 | Very high | 92.5 | Very high | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.007 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.8 | -43 | 178.3 | 178.2 | 0 | 0 | 0 | 0 | 111.9 | V24 G25 I26 N32 S64 A272 | V24-S28 WeakPolarHBondContact O-CB 3.07Å; V24-S28 PolarHBondContact O-N 3.04Å; G25-S28 PolarHBondContact O-N 2.86Å; I26-S28 VanDerWaalsContact C-N 3.33Å; S28-N32 WeakPolarHBondContact O-CB 3.43Å; S28-N32 PolarHBondContact O-N 3.34Å; S28-N32 PolarHBondContact O-ND2 2.98Å; S28-N32 PolarHBondContact OG-ND2 3.33Å; S28-S64 WeakPolarHBondContact CB-OG 3.4Å; S28-S64 PolarHBondContact OG-OG 3.29Å; S28-A272 WeakPolarHBondContact OG-CB 3.49Å |
| 29 | L | 94 | Very high | 92.6 | Very high | 53 Ų | 53 | 39.9 Ų | 39.9 | 28% | 0.277 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -59.6 | -49.3 | 175.2 | 177.8 | 57.1 | 0 | 0 | 0 | 111.3 | G25 I26 V27 L33 T61 V65 | G25-L29 VanDerWaalsContact O-CB 3.27Å; G25-L29 WeakPolarHBondContact O-CB 3.48Å; G25-L29 PolarHBondContact O-N 2.89Å; I26-L29 PolarHBondContact O-N 3.39Å; V27-L29 VanDerWaalsContact C-N 3.34Å; V27-L29 PolarHBondContact O-N 3.45Å; L29-L33 WeakPolarHBondContact O-CB 3.29Å; L29-L33 PolarHBondContact O-N 3.03Å; L29-T61 HydrophobicContact CD1-CG2 3.77Å; L29-V65 HydrophobicContact CD1-CG2 3.63Å; L29-V65 HydrophobicContact CD2-CG2 4.3Å |
| 30 | A | 92.8 | Very high | 92.4 | Very high | 57 Ų | 57 | 41.5 Ų | 41.5 | 47% | 0.471 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -62.5 | -46.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | I26 V27 L34 | I26-A30 WeakPolarHBondContact O-CB 3.34Å; I26-A30 PolarHBondContact O-N 2.05Å; V27-A30 PolarHBondContact O-N 3.32Å; A30-L34 WeakPolarHBondContact O-CB 3.43Å; A30-L34 PolarHBondContact O-N 2.76Å |
| 31 | E | 93 | Very high | 92 | Very high | 64 Ų | 64 | 43.2 Ų | 43.2 | 30% | 0.299 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -69.8 | -42.2 | -177.1 | -69.2 | -177.7 | 159 | 0 | 0 | 112.7 | V27 L34 V35 P276 | V27-E31 HydrophobicContact CG1-CG 4.28Å; V27-E31 WeakPolarHBondContact O-CG 3.47Å; V27-E31 PolarHBondContact O-N 3.45Å; E31-L34 WeakPolarHBondContact O-CB 3.36Å; E31-L34 PolarHBondContact O-N 3.37Å; E31-V35 WeakPolarHBondContact O-CG2 3.29Å; E31-V35 PolarHBondContact O-N 2.95Å; E31-P276 HydrophobicContact CB-CB 3.82Å; E31-P276 HydrophobicContact CB-CG 3.82Å |
| 32 | N | 94.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -71.6 | -36 | 177.8 | -74.7 | -79.5 | 0 | 0 | 0 | 111.9 | S28 L34 V35 V36 A57 N60 T61 A272 | S28-N32 WeakPolarHBondContact O-CB 3.43Å; S28-N32 PolarHBondContact O-N 3.34Å; S28-N32 PolarHBondContact O-ND2 2.98Å; S28-N32 PolarHBondContact OG-ND2 3.33Å; N32-L34 VanDerWaalsContact C-N 3.32Å; N32-L34 PolarHBondContact O-N 2.99Å; N32-V35 WeakPolarHBondContact O-CB 3.4Å; N32-V35 PolarHBondContact O-N 3.49Å; N32-V36 WeakPolarHBondContact O-CG2 3.39Å; N32-V36 PolarHBondContact O-N 3.24Å; N32-A57 HydrophobicContact CB-CB 4.4Å; N32-A57 WeakPolarHBondContact CB-O 3.42Å; N32-N60 HydrophobicContact CB-CB 4.29Å; N32-N60 VanDerWaalsContact OD1-CB 3.29Å; N32-N60 WeakPolarHBondContact OD1-CB 3.39Å; N32-N60 PolarHBondContact OD1-ND2 3.44Å; N32-T61 WeakPolarHBondContact CB-OG1 3.32Å; N32-A272 PolarHBondContact ND2-O 2.85Å |
| 33 | L | 92.6 | Very high | 91.1 | Very high | 85 Ų | 85 | 50.7 Ų | 50.7 | 45% | 0.445 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 172.3 | -174.8 | 63.8 | 0 | 0 | 0 | 111.1 | L29 V35 V36 V37 | L29-L33 WeakPolarHBondContact O-CB 3.29Å; L29-L33 PolarHBondContact O-N 3.03Å; L33-V35 VanDerWaalsContact C-N 3.32Å; L33-V35 PolarHBondContact O-N 3.13Å; L33-V36 PolarHBondContact O-N 3.48Å; L33-V37 HydrophobicContact CD1-CG2 4.4Å; L33-V37 HydrophobicContact CG-CG2 4.4Å; L33-V37 WeakPolarHBondContact O-CB 3.46Å; L33-V37 WeakPolarHBondContact O-CG2 3.19Å; L33-V37 PolarHBondContact O-N 3.11Å |
| 34 | L | 91.8 | Very high | 90.4 | Very high | 35 Ų | 35 | 53.6 Ų | 53.6 | 18% | 0.183 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -58.7 | -43 | 173.6 | 178.2 | 65.3 | 0 | 0 | 0 | 111.6 | A30 E31 N32 A38 F290 M293 L303 | A30-L34 WeakPolarHBondContact O-CB 3.43Å; A30-L34 PolarHBondContact O-N 2.76Å; E31-L34 WeakPolarHBondContact O-CB 3.36Å; E31-L34 PolarHBondContact O-N 3.37Å; N32-L34 VanDerWaalsContact C-N 3.32Å; N32-L34 PolarHBondContact O-N 2.99Å; L34-A38 WeakPolarHBondContact O-CB 3.43Å; L34-A38 PolarHBondContact O-N 3.33Å; L34-F290 HydrophobicContact CD1-CD1 4.43Å; L34-F290 HydrophobicContact CD2-CD1 4.03Å; L34-F290 HydrophobicContact CD2-CE1 4.34Å; L34-F290 HydrophobicContact CD2-CG 4.3Å; L34-F290 HydrophobicContact CG-CD1 3.93Å; L34-F290 HydrophobicContact CG-CE1 3.99Å; L34-M293 HydrophobicContact CD1-CB 4.49Å; L34-M293 HydrophobicContact CD1-SD 4.3Å; L34-L303 HydrophobicContact CD1-CD1 4.39Å |
| 35 | V | 93.2 | Very high | 89.9 | Confident | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.006 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60 | -48.4 | 175.1 | 176.2 | 0 | 0 | 0 | 0 | 110.9 | E31 N32 L33 A38 V39 A57 P276 Y279 F290 | E31-V35 WeakPolarHBondContact O-CG2 3.29Å; E31-V35 PolarHBondContact O-N 2.95Å; N32-V35 WeakPolarHBondContact O-CB 3.4Å; N32-V35 PolarHBondContact O-N 3.49Å; L33-V35 VanDerWaalsContact C-N 3.32Å; L33-V35 PolarHBondContact O-N 3.13Å; V35-A38 PolarHBondContact O-N 2.98Å; V35-V39 WeakPolarHBondContact O-CG2 3.46Å; V35-V39 PolarHBondContact O-N 3.47Å; V35-A57 HydrophobicContact CB-CB 3.81Å; V35-A57 HydrophobicContact CG1-CB 3.6Å; V35-P276 HydrophobicContact CG2-CB 3.86Å; V35-P276 HydrophobicContact CG2-CG 4.04Å; V35-Y279 HydrophobicContact CG2-CD2 4.34Å; V35-F290 HydrophobicContact CG2-CE1 4.43Å; V35-F290 HydrophobicContact CG2-CZ 3.77Å |
| 36 | V | 93.7 | Very high | 89.4 | Confident | 22 Ų | 22 | 57.2 Ų | 57.2 | 13% | 0.133 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60 | -52.1 | -179.8 | 171.3 | 0 | 0 | 0 | 0 | 110.7 | N32 L33 A38 V39 M40 A57 A58 | N32-V36 WeakPolarHBondContact O-CG2 3.39Å; N32-V36 PolarHBondContact O-N 3.24Å; L33-V36 PolarHBondContact O-N 3.48Å; V36-A38 PolarHBondContact O-N 3.25Å; V36-V39 PolarHBondContact O-N 2.73Å; V36-M40 HydrophobicContact CG1-CE 3.91Å; V36-M40 HydrophobicContact CG1-SD 4.14Å; V36-M40 VanDerWaalsContact O-CG 3.31Å; V36-M40 WeakPolarHBondContact O-CG 3.41Å; V36-M40 PolarHBondContact O-N 3.47Å; V36-A57 HydrophobicContact CG2-CB 3.86Å; V36-A58 HydrophobicContact CG2-CB 4.2Å |
| 37 | V | 90.8 | Very high | 89.2 | Confident | 30 Ų | 30 | 54 Ų | 54 | 18% | 0.182 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59 | -39.1 | 176.8 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | L33 V39 M40 R41 L303 | L33-V37 HydrophobicContact CD1-CG2 4.4Å; L33-V37 HydrophobicContact CG-CG2 4.4Å; L33-V37 WeakPolarHBondContact O-CB 3.46Å; L33-V37 WeakPolarHBondContact O-CG2 3.19Å; L33-V37 PolarHBondContact O-N 3.11Å; V37-V39 PolarHBondContact O-N 3.02Å; V37-M40 HydrophobicContact CG2-CE 4.4Å; V37-M40 PolarHBondContact O-N 3.41Å; V37-R41 VanDerWaalsContact O-CB 3.27Å; V37-R41 WeakPolarHBondContact O-CB 3.39Å; V37-R41 PolarHBondContact O-N 3.32Å; V37-L303 HydrophobicContact CB-CD1 4.33Å; V37-L303 HydrophobicContact CG1-CD1 3.79Å |
| 38 | A | 89.4 | Confident | 89.1 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65.2 | -43.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L34 V35 V36 S42 T289 F290 M293 | L34-A38 WeakPolarHBondContact O-CB 3.43Å; L34-A38 PolarHBondContact O-N 3.33Å; V35-A38 PolarHBondContact O-N 2.98Å; V36-A38 PolarHBondContact O-N 3.25Å; A38-S42 WeakPolarHBondContact O-CB 3.41Å; A38-S42 PolarHBondContact O-N 2.96Å; A38-S42 VanDerWaalsContact O-N 3.08Å; A38-T289 HydrophobicContact CB-CG2 4.07Å; A38-F290 HydrophobicContact CB-CD1 4.02Å; A38-F290 HydrophobicContact CB-CE1 3.66Å; A38-M293 HydrophobicContact CB-CE 3.75Å; A38-M293 HydrophobicContact CB-SD 3.62Å |
| 39 | V | 90.3 | Very high | 88.8 | Confident | 7 Ų | 7 | 53.1 Ų | 53.1 | 4% | 0.042 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -68.7 | -41.4 | 177.5 | 177.4 | 0 | 0 | 0 | 0 | 110.9 | V35 V36 V37 R41 L45 C54 | V35-V39 WeakPolarHBondContact O-CG2 3.46Å; V35-V39 PolarHBondContact O-N 3.47Å; V36-V39 PolarHBondContact O-N 2.73Å; V37-V39 PolarHBondContact O-N 3.02Å; V39-R41 PolarHBondContact O-N 2.96Å; V39-L45 HydrophobicContact CG2-CD1 4.42Å; V39-C54 HydrophobicContact CB-CB 4.01Å; V39-C54 HydrophobicContact CG1-CB 3.9Å; V39-C54 HydrophobicContact CG2-CB 4.17Å |
| 40 | M | 88.1 | Confident | 88.7 | Confident | 123 Ų | 123 | 51.7 Ų | 51.7 | 61% | 0.606 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -66 | -36.2 | 179.8 | -69.1 | -170.5 | -50.9 | 0 | 0 | 113.3 | V36 V37 | V36-M40 HydrophobicContact CG1-CE 3.91Å; V36-M40 HydrophobicContact CG1-SD 4.14Å; V36-M40 VanDerWaalsContact O-CG 3.31Å; V36-M40 WeakPolarHBondContact O-CG 3.41Å; V36-M40 PolarHBondContact O-N 3.47Å; V37-M40 HydrophobicContact CG2-CE 4.4Å; V37-M40 PolarHBondContact O-N 3.41Å |
| 41 | R | 85.1 | Confident | 88.8 | Confident | 96 Ų | 96 | 50 Ų | 50 | 36% | 0.362 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -87.6 | -29.5 | -174.5 | -156 | 172.4 | -175.6 | 166.4 | -2.4 | 112.3 | V37 V39 M293 K300 F301 C302 | V37-R41 VanDerWaalsContact O-CB 3.27Å; V37-R41 WeakPolarHBondContact O-CB 3.39Å; V37-R41 PolarHBondContact O-N 3.32Å; V39-R41 PolarHBondContact O-N 2.96Å; R41-M293 HydrophobicContact CB-CE 4.34Å; R41-K300 PolarHBondContact NE-O 3.24Å; R41-K300 PolarHBondContact NH2-O 3.01Å; R41-F301 VanDerWaalsContact C-CE1 3.49Å; R41-F301 HydrophobicContact CB-CD1 4.06Å; R41-F301 HydrophobicContact CB-CE1 3.64Å; R41-F301 HydrophobicContact CG-CD1 3.65Å; R41-F301 HydrophobicContact CG-CE1 3.47Å; R41-F301 VanDerWaalsContact CG-CE1 3.47Å; R41-F301 HydrophobicContact CG-CZ 4.18Å; R41-F301 VanDerWaalsContact CZ-CA 3.41Å; R41-F301 WeakPolarHBondContact O-CE1 3.42Å; R41-F301 WeakPolarHBondContact O-CZ 3.33Å; R41-C302 PolarHBondContact NH1-O 3.23Å; R41-C302 PolarHBondContact NH2-O 2.95Å |
| 42 | S | 83.8 | Confident | 88.9 | Confident | 5 Ų | 5 | 47 Ų | 47 | 4% | 0.035 | 23% | 0.227 | C | C | . | . | trans | -93.3 | 105.9 | -174.4 | -170.9 | 0 | 0 | 0 | 0 | 112.5 | A38 N44 L45 | A38-S42 WeakPolarHBondContact O-CB 3.41Å; A38-S42 PolarHBondContact O-N 2.96Å; A38-S42 VanDerWaalsContact O-N 3.08Å; S42-N44 PolarHBondContact O-N 3.45Å; S42-N44 VanDerWaalsContact O-N 3.13Å; S42-L45 PolarHBondContact O-N 3.22Å | ||
| 43 | R | 80.4 | Confident | 88.8 | Confident | 214 Ų | 214 | 47.1 Ų | 47.1 | 81% | 0.808 | 23% | 0.228 | S | C | * | . | G | 310 helix | trans | -57.9 | -27.4 | 173.4 | -72 | -172.4 | 170.8 | -169.6 | -2.8 | 113.6 | L45 H46 | R43-L45 PolarHBondContact O-N 3.44Å; R43-H46 PolarHBondContact O-N 2.94Å |
| 44 | N | 79.4 | Confident | 88.9 | Confident | 147 Ų | 147 | 44 Ų | 44 | 79% | 0.786 | 21% | 0.213 | S | C | * | . | G | 310 helix | trans | -68.5 | -17.7 | 177.9 | -66.4 | -19.6 | 0 | 0 | 0 | 112.6 | S42 | S42-N44 PolarHBondContact O-N 3.45Å; S42-N44 VanDerWaalsContact O-N 3.13Å |
| 45 | L | 81.7 | Confident | 89.2 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.005 | 21% | 0.206 | C | C | . | . | G | 310 helix | trans | -100.9 | 7.2 | 178.2 | -59.4 | 177.4 | 0 | 0 | 0 | 112.4 | V39 S42 R43 S47 Y50 E285 L286 T289 | V39-L45 HydrophobicContact CG2-CD1 4.42Å; S42-L45 PolarHBondContact O-N 3.22Å; R43-L45 PolarHBondContact O-N 3.44Å; L45-S47 PolarHBondContact O-N 3.08Å; L45-Y50 HydrophobicContact CB-CD2 4.01Å; L45-Y50 HydrophobicContact CB-CG 4.14Å; L45-Y50 HydrophobicContact CD2-CD1 4.13Å; L45-Y50 HydrophobicContact CD2-CD2 3.95Å; L45-Y50 HydrophobicContact CD2-CE1 3.85Å; L45-Y50 HydrophobicContact CD2-CE2 3.67Å; L45-Y50 HydrophobicContact CD2-CG 4.2Å; L45-Y50 WeakPolarHBondContact O-CB 3.18Å; L45-Y50 VanDerWaalsContact O-CD2 3.26Å; L45-Y50 WeakPolarHBondContact O-CD2 3.43Å; L45-E285 HydrophobicContact CD2-CB 4.07Å; L45-L286 HydrophobicContact CD1-CD2 3.68Å; L45-L286 HydrophobicContact CD1-CG 4.49Å; L45-L286 HydrophobicContact CD2-CG 4.48Å; L45-T289 HydrophobicContact CD1-CG2 4.07Å |
| 46 | H | 82.8 | Confident | 89.3 | Confident | 95 Ų | 95 | 42.6 Ų | 42.6 | 44% | 0.44 | 21% | 0.206 | S | C | . | . | trans | -77.6 | 64.7 | 175.5 | -69.3 | 170.1 | 0 | 0 | 0 | 112 | R43 | R43-H46 PolarHBondContact O-N 2.94Š| ||
| 47 | S | 88.1 | Confident | 89.4 | Confident | 39 Ų | 39 | 41.6 Ų | 41.6 | 27% | 0.273 | 20% | 0.2 | S | C | . | . | S | Bend | trans | -121.2 | 147.6 | 172 | 174.1 | 0 | 0 | 0 | 0 | 109.2 | L45 M49 Y50 C51 | L45-S47 PolarHBondContact O-N 3.08Å; S47-M49 PolarHBondContact O-N 3.31Å; S47-M49 VanDerWaalsContact O-N 3.11Å; S47-Y50 PolarHBondContact O-N 2.88Å; S47-C51 PolarHBondContact O-N 2.73Å |
| 48 | P | 90.7 | Very high | 89.6 | Confident | 11 Ų | 11 | 41.1 Ų | 41.1 | 7% | 0.071 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -48.2 | -42.9 | -178.8 | -32.1 | 37.3 | 0 | 0 | 0 | 114.5 | Y50 C51 F52 M132 M134 T137 | P48-Y50 PolarHBondContact O-N 3.19Å; P48-C51 WeakPolarHBondContact O-CB 3.33Å; P48-C51 PolarHBondContact O-N 3.08Å; P48-F52 HydrophobicContact CB-CE2 4.49Å; P48-F52 WeakPolarHBondContact O-CD2 3.45Å; P48-F52 PolarHBondContact O-N 2.66Å; P48-F52 VanDerWaalsContact O-N 3.13Å; P48-M132 HydrophobicContact CG-CB 4.24Å; P48-M134 HydrophobicContact CG-SD 4.28Å; P48-T137 HydrophobicContact CB-CG2 4.18Å; P48-T137 WeakPolarHBondContact CB-OG1 3.48Å |
| 49 | M | 89.8 | Confident | 90 | Very high | 30 Ų | 30 | 41.1 Ų | 41.1 | 15% | 0.148 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -48.8 | -51.2 | 173.9 | 161.2 | 170.2 | -172.4 | 0 | 0 | 113.4 | S47 C51 F52 M53 D117 R118 M283 | S47-M49 PolarHBondContact O-N 3.31Å; S47-M49 VanDerWaalsContact O-N 3.11Å; M49-C51 VanDerWaalsContact C-N 3.34Å; M49-F52 PolarHBondContact O-N 3.11Å; M49-M53 HydrophobicContact CE-CE 3.39Å; M49-M53 HydrophobicContact CE-SD 4.01Å; M49-M53 HydrophobicContact CG-CE 4.16Å; M49-M53 HydrophobicContact CG-SD 4.2Å; M49-M53 WeakPolarHBondContact O-CG 3.32Å; M49-M53 PolarHBondContact O-N 2.92Å; M49-M53 VanDerWaalsContact O-N 3.13Å; M49-D117 WeakPolarHBondContact CB-OD2 3.26Å; M49-R118 PolarHBondContact SD-NH1 2.89Å; M49-R118 PolarHBondContact SD-NH2 3.26Å; M49-M283 HydrophobicContact CE-CE 4.2Å; M49-M283 HydrophobicContact CE-SD 4.06Å |
| 50 | Y | 91.4 | Very high | 90.2 | Very high | 24 Ų | 24 | 41 Ų | 41 | 9% | 0.094 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -75.2 | -27 | -175.4 | -66.1 | -62.4 | 0 | 0 | 0 | 111.4 | L45 S47 P48 M53 C54 L286 | L45-Y50 HydrophobicContact CB-CD2 4.01Å; L45-Y50 HydrophobicContact CB-CG 4.14Å; L45-Y50 HydrophobicContact CD2-CD1 4.13Å; L45-Y50 HydrophobicContact CD2-CD2 3.95Å; L45-Y50 HydrophobicContact CD2-CE1 3.85Å; L45-Y50 HydrophobicContact CD2-CE2 3.67Å; L45-Y50 HydrophobicContact CD2-CG 4.2Å; L45-Y50 WeakPolarHBondContact O-CB 3.18Å; L45-Y50 VanDerWaalsContact O-CD2 3.26Å; L45-Y50 WeakPolarHBondContact O-CD2 3.43Å; S47-Y50 PolarHBondContact O-N 2.88Å; P48-Y50 PolarHBondContact O-N 3.19Å; Y50-M53 HydrophobicContact CD1-SD 4.09Å; Y50-M53 PolarHBondContact O-N 3.31Å; Y50-C54 VanDerWaalsContact O-CB 3.31Å; Y50-C54 WeakPolarHBondContact O-CB 3.34Å; Y50-C54 PolarHBondContact O-N 3.45Å; Y50-L286 HydrophobicContact CD1-CD1 4.16Å; Y50-L286 HydrophobicContact CD1-CG 4.38Å; Y50-L286 HydrophobicContact CE1-CD1 3.94Å; Y50-L286 HydrophobicContact CE1-CG 4.03Å |
| 51 | C | 94.5 | Very high | 90.6 | Very high | 22 Ų | 22 | 36.2 Ų | 36.2 | 15% | 0.149 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.7 | -41.3 | 171.3 | -62.2 | 0 | 0 | 0 | 0 | 111.7 | S47 P48 M49 C54 S55 M134 T137 L141 | S47-C51 PolarHBondContact O-N 2.73Å; P48-C51 WeakPolarHBondContact O-CB 3.33Å; P48-C51 PolarHBondContact O-N 3.08Å; M49-C51 VanDerWaalsContact C-N 3.34Å; C51-C54 WeakPolarHBondContact O-CB 3.5Å; C51-C54 PolarHBondContact O-N 3.15Å; C51-S55 PolarHBondContact O-N 3.06Å; C51-M134 VanDerWaalsContact SG-CE 3.59Å; C51-T137 HydrophobicContact CB-CG2 3.83Å; C51-L141 HydrophobicContact CB-CD1 4Å |
| 52 | F | 95.1 | Very high | 91.1 | Very high | 1 Ų | 1 | 33.7 Ų | 33.7 | 0% | 0.004 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -66.9 | -36.9 | 173.6 | -63.2 | -56.1 | 0 | 0 | 0 | 112.5 | P48 M49 S55 L56 A113 I114 D117 T137 I140 L141 | P48-F52 HydrophobicContact CB-CE2 4.49Å; P48-F52 WeakPolarHBondContact O-CD2 3.45Å; P48-F52 PolarHBondContact O-N 2.66Å; P48-F52 VanDerWaalsContact O-N 3.13Å; M49-F52 PolarHBondContact O-N 3.11Å; F52-S55 WeakPolarHBondContact O-CB 3.28Å; F52-S55 PolarHBondContact O-N 2.73Å; F52-L56 PolarHBondContact O-N 3.27Å; F52-A113 HydrophobicContact CD1-CB 3.67Å; F52-A113 HydrophobicContact CD2-CB 4.46Å; F52-A113 HydrophobicContact CE1-CB 3.76Å; F52-A113 HydrophobicContact CG-CB 4.06Å; F52-A113 HydrophobicContact CZ-CB 4.18Å; F52-I114 HydrophobicContact CB-CD1 4.29Å; F52-I114 HydrophobicContact CB-CG1 3.56Å; F52-D117 HydrophobicContact CD2-CB 4.24Å; F52-D117 HydrophobicContact CE2-CB 4.12Å; F52-T137 HydrophobicContact CE1-CG2 4.18Å; F52-T137 HydrophobicContact CE2-CG2 4.24Å; F52-T137 HydrophobicContact CZ-CG2 3.93Å; F52-I140 HydrophobicContact CE1-CB 4.32Å; F52-I140 HydrophobicContact CE1-CG2 3.75Å; F52-I140 HydrophobicContact CZ-CB 4.47Å; F52-I140 HydrophobicContact CZ-CD1 4.41Å; F52-I140 HydrophobicContact CZ-CG2 4.07Å; F52-L141 HydrophobicContact CD1-CD2 3.65Å; F52-L141 HydrophobicContact CD1-CG 4.26Å; F52-L141 HydrophobicContact CE1-CD2 4.01Å; F52-L141 HydrophobicContact CE1-CG 4.2Å |
| 53 | M | 93.3 | Very high | 91.6 | Very high | 1 Ų | 1 | 34.4 Ų | 34.4 | 1% | 0.005 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.2 | -39.1 | 172.8 | -70.2 | 175.2 | 170.7 | 0 | 0 | 112.5 | M49 Y50 S55 L56 A57 I114 L224 Y279 M283 | M49-M53 HydrophobicContact CE-CE 3.39Å; M49-M53 HydrophobicContact CE-SD 4.01Å; M49-M53 HydrophobicContact CG-CE 4.16Å; M49-M53 HydrophobicContact CG-SD 4.2Å; M49-M53 WeakPolarHBondContact O-CG 3.32Å; M49-M53 PolarHBondContact O-N 2.92Å; M49-M53 VanDerWaalsContact O-N 3.13Å; Y50-M53 HydrophobicContact CD1-SD 4.09Å; Y50-M53 PolarHBondContact O-N 3.31Å; M53-S55 VanDerWaalsContact C-N 3.31Å; M53-L56 PolarHBondContact O-N 3.06Å; M53-A57 WeakPolarHBondContact O-CB 3.25Å; M53-A57 PolarHBondContact O-N 3.39Å; M53-I114 HydrophobicContact CG-CD1 4.14Å; M53-L224 HydrophobicContact CE-CD2 3.74Å; M53-Y279 HydrophobicContact CE-CE1 4.05Å; M53-Y279 HydrophobicContact CG-CE1 4.36Å; M53-Y279 HydrophobicContact SD-CE1 4.13Å; M53-M283 HydrophobicContact CE-CE 3.33Å; M53-M283 HydrophobicContact CE-SD 3.87Å; M53-M283 HydrophobicContact SD-CE 4.04Å; M53-M283 HydrophobicContact SD-SD 3.83Å |
| 54 | C | 94.7 | Very high | 92.3 | Very high | 21 Ų | 21 | 24.6 Ų | 24.6 | 14% | 0.142 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.9 | -39 | 174.1 | -173 | 0 | 0 | 0 | 0 | 111.3 | V39 Y50 C51 A57 A58 | V39-C54 HydrophobicContact CB-CB 4.01Å; V39-C54 HydrophobicContact CG1-CB 3.9Å; V39-C54 HydrophobicContact CG2-CB 4.17Å; Y50-C54 VanDerWaalsContact O-CB 3.31Å; Y50-C54 WeakPolarHBondContact O-CB 3.34Å; Y50-C54 PolarHBondContact O-N 3.45Å; C51-C54 WeakPolarHBondContact O-CB 3.5Å; C51-C54 PolarHBondContact O-N 3.15Å; C54-A57 PolarHBondContact O-N 2.9Å; C54-A58 WeakPolarHBondContact O-CB 3.37Å; C54-A58 PolarHBondContact O-N 2.95Å |
| 55 | S | 96.3 | Very high | 93 | Very high | 6 Ų | 6 | 20.8 Ų | 20.8 | 4% | 0.042 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.8 | -45.2 | 173.4 | -172.1 | 0 | 0 | 0 | 0 | 111.8 | C51 F52 M53 A58 F59 L141 W145 | C51-S55 PolarHBondContact O-N 3.06Å; F52-S55 WeakPolarHBondContact O-CB 3.28Å; F52-S55 PolarHBondContact O-N 2.73Å; M53-S55 VanDerWaalsContact C-N 3.31Å; S55-A58 PolarHBondContact O-N 3.28Å; S55-F59 WeakPolarHBondContact O-CD2 3.39Å; S55-F59 PolarHBondContact O-N 3.4Å; S55-L141 VanDerWaalsContact CB-CD2 3.48Å; S55-W145 PolarHBondContact OG-NE1 2.86Å |
| 56 | L | 95.2 | Very high | 93.5 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -59.6 | -46.5 | 174.7 | 178.2 | 58 | 0 | 0 | 0 | 111.4 | F52 M53 A58 F59 N60 F111 I114 Y279 | F52-L56 PolarHBondContact O-N 3.27Å; M53-L56 PolarHBondContact O-N 3.06Å; L56-A58 VanDerWaalsContact C-N 3.3Å; L56-A58 PolarHBondContact O-N 3.34Å; L56-F59 PolarHBondContact O-N 3.49Å; L56-N60 PolarHBondContact O-N 3.48Å; L56-F111 HydrophobicContact CD1-CE2 4.18Å; L56-F111 HydrophobicContact CD2-CD1 4.47Å; L56-F111 HydrophobicContact CD2-CE1 3.94Å; L56-F111 HydrophobicContact CD2-CE2 4.15Å; L56-F111 HydrophobicContact CD2-CZ 3.76Å; L56-I114 HydrophobicContact CD2-CD1 4.36Å; L56-Y279 WeakPolarHBondContact CD2-OH 3.49Å |
| 57 | A | 95.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -63.3 | -34.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113 | N32 V35 V36 M53 C54 N60 T61 | N32-A57 HydrophobicContact CB-CB 4.4Å; N32-A57 WeakPolarHBondContact CB-O 3.42Å; V35-A57 HydrophobicContact CB-CB 3.81Å; V35-A57 HydrophobicContact CG1-CB 3.6Å; V36-A57 HydrophobicContact CG2-CB 3.86Å; M53-A57 WeakPolarHBondContact O-CB 3.25Å; M53-A57 PolarHBondContact O-N 3.39Å; C54-A57 PolarHBondContact O-N 2.9Å; A57-N60 PolarHBondContact O-N 2.97Å; A57-T61 WeakPolarHBondContact O-CB 3.35Å; A57-T61 PolarHBondContact O-N 2.92Å; A57-T61 PolarHBondContact O-OG1 2.95Å |
| 58 | A | 96.7 | Very high | 94.1 | Very high | 21 Ų | 21 | 16.7 Ų | 16.7 | 17% | 0.174 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -69.1 | -41.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | V36 C54 S55 L56 T61 I62 W145 | V36-A58 HydrophobicContact CG2-CB 4.2Å; C54-A58 WeakPolarHBondContact O-CB 3.37Å; C54-A58 PolarHBondContact O-N 2.95Å; S55-A58 PolarHBondContact O-N 3.28Å; L56-A58 VanDerWaalsContact C-N 3.3Å; L56-A58 PolarHBondContact O-N 3.34Å; A58-T61 WeakPolarHBondContact O-CB 3.32Å; A58-T61 PolarHBondContact O-N 3.46Å; A58-I62 WeakPolarHBondContact O-CG1 3.43Å; A58-I62 PolarHBondContact O-N 2.92Å; A58-W145 HydrophobicContact CB-CH2 3.87Å; A58-W145 HydrophobicContact CB-CZ2 3.67Å |
| 59 | F | 96.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -62.8 | -42.7 | 171.3 | -73.9 | -58.3 | 0 | 0 | 0 | 112.1 | S55 L56 T61 I62 A63 M102 S103 G106 I144 W145 C148 | S55-F59 WeakPolarHBondContact O-CD2 3.39Å; S55-F59 PolarHBondContact O-N 3.4Å; L56-F59 PolarHBondContact O-N 3.49Å; F59-T61 VanDerWaalsContact C-N 3.31Å; F59-T61 PolarHBondContact O-N 3.41Å; F59-I62 PolarHBondContact O-N 2.97Å; F59-A63 PolarHBondContact O-N 3.47Å; F59-M102 HydrophobicContact CE1-CG 4.14Å; F59-M102 HydrophobicContact CE1-SD 4.36Å; F59-S103 VanDerWaalsContact O-CB 3.29Å; F59-S103 WeakPolarHBondContact O-CB 3.33Å; F59-S103 PolarHBondContact O-OG 3.36Å; F59-S103 VanDerWaalsContact O-OG 3.11Å; F59-G106 VanDerWaalsContact CD2-C 3.45Å; F59-I144 HydrophobicContact CE2-CG2 4.13Å; F59-I144 HydrophobicContact CZ-CG2 4.32Å; F59-W145 HydrophobicContact CD1-CH2 4.21Å; F59-W145 HydrophobicContact CD1-CZ2 4.34Å; F59-W145 HydrophobicContact CD1-CZ3 4.44Å; F59-W145 HydrophobicContact CD2-CZ2 4.37Å; F59-W145 AromaticContact CE1-CD2 3.97Å; F59-W145 HydrophobicContact CE1-CD2 3.97Å; F59-W145 AromaticContact CE1-CE3 3.93Å; F59-W145 HydrophobicContact CE1-CE3 3.93Å; F59-W145 HydrophobicContact CE1-CH2 4.08Å; F59-W145 HydrophobicContact CE1-CZ2 4.1Å; F59-W145 AromaticContact CE1-CZ3 4Å; F59-W145 HydrophobicContact CE1-CZ3 4Å; F59-W145 HydrophobicContact CE2-CD2 4.37Å; F59-W145 AromaticContact CE2-CE2 3.86Å; F59-W145 HydrophobicContact CE2-CZ2 4.14Å; F59-W145 AromaticContact CE2-NE1 3.77Å; F59-W145 HydrophobicContact CG-CZ2 4.47Å; F59-W145 AromaticContact CZ-CD1 3.95Å; F59-W145 AromaticContact CZ-CD2 3.64Å; F59-W145 HydrophobicContact CZ-CD2 3.64Å; F59-W145 AromaticContact CZ-CE2 3.57Å; F59-W145 HydrophobicContact CZ-CE3 4.1Å; F59-W145 AromaticContact CZ-CG 3.91Å; F59-W145 HydrophobicContact CZ-CG 3.91Å; F59-W145 HydrophobicContact CZ-CH2 4.43Å; F59-W145 AromaticContact CZ-CZ2 4Å; F59-W145 HydrophobicContact CZ-CZ2 4Å; F59-W145 HydrophobicContact CZ-CZ3 4.47Å; F59-W145 AromaticContact CZ-NE1 3.76Å; F59-C148 HydrophobicContact CZ-CB 4.45Å |
| 60 | N | 95.6 | Very high | 94 | Very high | 3 Ų | 3 | 22.5 Ų | 22.5 | 2% | 0.016 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62.2 | -37.6 | 174.6 | -76.9 | -16.6 | 0 | 0 | 0 | 112.4 | N32 L56 A57 A63 S64 A272 D275 | N32-N60 HydrophobicContact CB-CB 4.29Å; N32-N60 VanDerWaalsContact OD1-CB 3.29Å; N32-N60 WeakPolarHBondContact OD1-CB 3.39Å; N32-N60 PolarHBondContact OD1-ND2 3.44Å; L56-N60 PolarHBondContact O-N 3.48Å; A57-N60 PolarHBondContact O-N 2.97Å; N60-A63 PolarHBondContact O-N 3.3Å; N60-S64 WeakPolarHBondContact O-CB 3.31Å; N60-S64 PolarHBondContact O-N 2.71Å; N60-S64 PolarHBondContact O-OG 2.8Å; N60-A272 HydrophobicContact CB-CB 3.82Å; N60-D275 PolarHBondContact ND2-OD2 2.93Å |
| 61 | T | 95.6 | Very high | 93.9 | Very high | 24 Ų | 24 | 21.9 Ų | 21.9 | 15% | 0.147 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.1 | -48.5 | 173 | -62.2 | 0 | 0 | 0 | 0 | 110.8 | L29 N32 A57 A58 F59 S64 V65 | L29-T61 HydrophobicContact CD1-CG2 3.77Å; N32-T61 WeakPolarHBondContact CB-OG1 3.32Å; A57-T61 WeakPolarHBondContact O-CB 3.35Å; A57-T61 PolarHBondContact O-N 2.92Å; A57-T61 PolarHBondContact O-OG1 2.95Å; A58-T61 WeakPolarHBondContact O-CB 3.32Å; A58-T61 PolarHBondContact O-N 3.46Å; F59-T61 VanDerWaalsContact C-N 3.31Å; F59-T61 PolarHBondContact O-N 3.41Å; T61-S64 PolarHBondContact O-N 2.89Å; T61-V65 WeakPolarHBondContact O-CG2 3.43Å; T61-V65 PolarHBondContact O-N 2.92Å |
| 62 | I | 95.9 | Very high | 93.7 | Very high | 42 Ų | 42 | 24.2 Ų | 24.2 | 22% | 0.215 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -59.5 | -50.2 | 177.5 | -66.5 | 166 | 0 | 0 | 0 | 110.2 | A58 F59 S64 V65 T66 L99 S103 W145 | A58-I62 WeakPolarHBondContact O-CG1 3.43Å; A58-I62 PolarHBondContact O-N 2.92Å; F59-I62 PolarHBondContact O-N 2.97Å; I62-S64 VanDerWaalsContact C-N 3.28Å; I62-S64 PolarHBondContact O-N 3.49Å; I62-V65 PolarHBondContact O-N 3.48Å; I62-T66 WeakPolarHBondContact O-CB 3.46Å; I62-T66 PolarHBondContact O-N 3.24Å; I62-T66 PolarHBondContact O-OG1 2.96Å; I62-T66 VanDerWaalsContact O-OG1 3.1Å; I62-L99 HydrophobicContact CG2-CB 3.98Å; I62-L99 HydrophobicContact CG2-CD2 4.17Å; I62-S103 WeakPolarHBondContact CB-OG 3.07Å; I62-S103 WeakPolarHBondContact CG2-OG 3.49Å; I62-W145 HydrophobicContact CD1-CH2 3.69Å; I62-W145 HydrophobicContact CD1-CZ3 3.67Å |
| 63 | A | 94.8 | Very high | 93.3 | Very high | 21 Ų | 21 | 27.1 Ų | 27.1 | 17% | 0.174 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -56.7 | -41.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | F59 N60 K67 L100 S103 | F59-A63 PolarHBondContact O-N 3.47Å; N60-A63 PolarHBondContact O-N 3.3Å; A63-K67 PolarHBondContact O-N 2.82Å; A63-L100 HydrophobicContact CB-CD2 4.18Å; A63-S103 PolarHBondContact N-OG 3.47Å |
| 64 | S | 94.3 | Very high | 92.9 | Very high | 7 Ų | 7 | 30.3 Ų | 30.3 | 5% | 0.049 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65.9 | -48.5 | 179.6 | -55.6 | 0 | 0 | 0 | 0 | 111.1 | S28 N60 T61 I62 T66 K67 T68 | S28-S64 WeakPolarHBondContact CB-OG 3.4Å; S28-S64 PolarHBondContact OG-OG 3.29Å; N60-S64 WeakPolarHBondContact O-CB 3.31Å; N60-S64 PolarHBondContact O-N 2.71Å; N60-S64 PolarHBondContact O-OG 2.8Å; T61-S64 PolarHBondContact O-N 2.89Å; I62-S64 VanDerWaalsContact C-N 3.28Å; I62-S64 PolarHBondContact O-N 3.49Å; S64-T66 PolarHBondContact O-N 2.91Å; S64-K67 PolarHBondContact O-N 3.26Å; S64-T68 WeakPolarHBondContact O-CB 3.49Å; S64-T68 VanDerWaalsContact O-CG2 3.26Å; S64-T68 WeakPolarHBondContact O-CG2 3.37Å; S64-T68 PolarHBondContact O-N 3.17Å; S64-T68 PolarHBondContact O-OG1 3.32Å |
| 65 | V | 94.1 | Very high | 92.6 | Very high | 68 Ų | 68 | 31.3 Ų | 31.3 | 41% | 0.412 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -57.1 | -51.2 | 176.2 | 171.3 | 0 | 0 | 0 | 0 | 110 | L29 T61 I62 K67 T68 W69 | L29-V65 HydrophobicContact CD1-CG2 3.63Å; L29-V65 HydrophobicContact CD2-CG2 4.3Å; T61-V65 WeakPolarHBondContact O-CG2 3.43Å; T61-V65 PolarHBondContact O-N 2.92Å; I62-V65 PolarHBondContact O-N 3.48Å; V65-K67 PolarHBondContact O-N 3.14Å; V65-T68 WeakPolarHBondContact CA-OG1 3.37Å; V65-T68 PolarHBondContact O-N 3.34Å; V65-T68 PolarHBondContact O-OG1 3.38Å; V65-W69 WeakPolarHBondContact O-CB 3.34Å; V65-W69 PolarHBondContact O-N 2.96Å |
| 66 | T | 93.1 | Very high | 92.1 | Very high | 4 Ų | 4 | 33.9 Ų | 33.9 | 3% | 0.025 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.8 | -47.1 | -177.2 | -60.9 | 0 | 0 | 0 | 0 | 112.4 | I62 S64 T68 W69 E70 M96 L99 L100 | I62-T66 WeakPolarHBondContact O-CB 3.46Å; I62-T66 PolarHBondContact O-N 3.24Å; I62-T66 PolarHBondContact O-OG1 2.96Å; I62-T66 VanDerWaalsContact O-OG1 3.1Å; S64-T66 PolarHBondContact O-N 2.91Å; T66-T68 PolarHBondContact O-N 3.41Å; T66-W69 WeakPolarHBondContact O-CB 3.3Å; T66-W69 PolarHBondContact O-N 3.41Å; T66-E70 WeakPolarHBondContact O-CB 3.42Å; T66-E70 PolarHBondContact O-N 3.38Å; T66-M96 HydrophobicContact CG2-CB 3.54Å; T66-M96 HydrophobicContact CG2-CG 4.08Å; T66-M96 VanDerWaalsContact CG2-O 3.26Å; T66-M96 WeakPolarHBondContact CG2-O 3.45Å; T66-M96 HydrophobicContact CG2-SD 3.64Å; T66-L99 HydrophobicContact CG2-CB 4.47Å; T66-L100 HydrophobicContact CG2-CD1 3.8Å; T66-L100 HydrophobicContact CG2-CD2 4Å; T66-L100 HydrophobicContact CG2-CG 3.5Å |
| 67 | K | 90 | Very high | 91.6 | Very high | 19 Ų | 19 | 35.3 Ų | 35.3 | 8% | 0.083 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.2 | -35 | 176.9 | -82.9 | -58.8 | 176.4 | -153.8 | 0 | 113.2 | A63 S64 V65 W69 E70 N71 L100 V265 M269 | A63-K67 PolarHBondContact O-N 2.82Å; S64-K67 PolarHBondContact O-N 3.26Å; V65-K67 PolarHBondContact O-N 3.14Å; K67-W69 VanDerWaalsContact C-N 3.29Å; K67-W69 PolarHBondContact O-N 2.95Å; K67-E70 WeakPolarHBondContact CD-OE2 3.08Å; K67-E70 WeakPolarHBondContact CE-OE2 3.4Å; K67-E70 IonicContact NZ-OE1 2.82Å; K67-E70 PolarHBondContact NZ-OE1 2.91Å; K67-E70 IonicContact NZ-OE2 2.63Å; K67-E70 PolarHBondContact NZ-OE2 3.04Å; K67-N71 WeakPolarHBondContact O-CB 3.4Å; K67-N71 PolarHBondContact O-N 3.5Å; K67-N71 PolarHBondContact O-ND2 3.17Å; K67-L100 HydrophobicContact CD-CD1 3.88Å; K67-L100 HydrophobicContact CD-CD2 4.31Å; K67-L100 HydrophobicContact CG-CD1 4.18Å; K67-L100 HydrophobicContact CG-CD2 3.67Å; K67-V265 HydrophobicContact CD-CG1 4.47Å; K67-M269 HydrophobicContact CB-CE 3.54Å; K67-M269 HydrophobicContact CB-CG 4.25Å; K67-M269 HydrophobicContact CB-SD 3.77Å; K67-M269 HydrophobicContact CD-SD 4.37Å; K67-M269 HydrophobicContact CG-CE 4.3Å; K67-M269 HydrophobicContact CG-CG 3.99Å; K67-M269 HydrophobicContact CG-SD 3.89Å |
| 68 | T | 91.8 | Very high | 91 | Very high | 26 Ų | 26 | 40.4 Ų | 40.4 | 16% | 0.16 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.4 | -38.2 | 174 | 53.3 | 0 | 0 | 0 | 0 | 111.7 | G25 S64 V65 T66 L72 | G25-T68 VanDerWaalsContact CA-CG2 3.46Å; S64-T68 WeakPolarHBondContact O-CB 3.49Å; S64-T68 VanDerWaalsContact O-CG2 3.26Å; S64-T68 WeakPolarHBondContact O-CG2 3.37Å; S64-T68 PolarHBondContact O-N 3.17Å; S64-T68 PolarHBondContact O-OG1 3.32Å; V65-T68 WeakPolarHBondContact CA-OG1 3.37Å; V65-T68 PolarHBondContact O-N 3.34Å; V65-T68 PolarHBondContact O-OG1 3.38Å; T66-T68 PolarHBondContact O-N 3.41Å; T68-L72 WeakPolarHBondContact O-CB 3.26Å; T68-L72 PolarHBondContact O-N 2.98Å |
| 69 | W | 90.8 | Very high | 90.4 | Very high | 122 Ų | 122 | 42.3 Ų | 42.3 | 46% | 0.462 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -65.2 | -49.9 | 176.2 | -178.7 | -90.6 | 0 | 0 | 0 | 111.5 | V65 T66 K67 N71 L72 M73 M96 | V65-W69 WeakPolarHBondContact O-CB 3.34Å; V65-W69 PolarHBondContact O-N 2.96Å; T66-W69 WeakPolarHBondContact O-CB 3.3Å; T66-W69 PolarHBondContact O-N 3.41Å; K67-W69 VanDerWaalsContact C-N 3.29Å; K67-W69 PolarHBondContact O-N 2.95Å; W69-N71 PolarHBondContact O-N 2.87Å; W69-L72 WeakPolarHBondContact O-CB 3.41Å; W69-L72 PolarHBondContact O-N 3.3Å; W69-L72 VanDerWaalsContact O-N 3.12Å; W69-M73 HydrophobicContact CZ2-SD 4.08Å; W69-M73 WeakPolarHBondContact O-CG 3.38Å; W69-M73 PolarHBondContact O-N 3.2Å; W69-M96 VanDerWaalsContact CD1-CE 3.49Å; W69-M96 HydrophobicContact CG-CE 4.01Å |
| 70 | E | 88.9 | Confident | 89.6 | Confident | 41 Ų | 41 | 45.4 Ų | 45.4 | 19% | 0.192 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -57.1 | -47.4 | 177.5 | -171.8 | -174.4 | 141.4 | 0 | 0 | 111.8 | T66 K67 L72 M73 I74 | T66-E70 WeakPolarHBondContact O-CB 3.42Å; T66-E70 PolarHBondContact O-N 3.38Å; K67-E70 WeakPolarHBondContact CD-OE2 3.08Å; K67-E70 WeakPolarHBondContact CE-OE2 3.4Å; K67-E70 IonicContact NZ-OE1 2.82Å; K67-E70 PolarHBondContact NZ-OE1 2.91Å; K67-E70 IonicContact NZ-OE2 2.63Å; K67-E70 PolarHBondContact NZ-OE2 3.04Å; E70-L72 VanDerWaalsContact C-N 3.33Å; E70-L72 PolarHBondContact O-N 3.41Å; E70-M73 PolarHBondContact O-N 3.19Å; E70-I74 HydrophobicContact CG-CD1 4.24Å; E70-I74 VanDerWaalsContact O-CG1 3.32Å; E70-I74 WeakPolarHBondContact O-CG1 3.4Å; E70-I74 PolarHBondContact O-N 3.18Å |
| 71 | N | 89.1 | Confident | 88.8 | Confident | 10 Ų | 10 | 52.4 Ų | 52.4 | 5% | 0.053 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.7 | -37.3 | 176.1 | -76.5 | -61.3 | 0 | 0 | 0 | 112.7 | F22 K67 W69 I74 V75 | F22-N71 HydrophobicContact CE1-CB 4.22Å; F22-N71 HydrophobicContact CZ-CB 4.2Å; K67-N71 WeakPolarHBondContact O-CB 3.4Å; K67-N71 PolarHBondContact O-N 3.5Å; K67-N71 PolarHBondContact O-ND2 3.17Å; W69-N71 PolarHBondContact O-N 2.87Å; N71-I74 PolarHBondContact O-N 3.38Å; N71-V75 WeakPolarHBondContact O-CG2 3.35Å; N71-V75 PolarHBondContact O-N 2.79Å |
| 72 | L | 89.8 | Confident | 87.7 | Confident | 72 Ų | 72 | 54 Ų | 54 | 38% | 0.377 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 174.3 | 178.3 | 63.2 | 0 | 0 | 0 | 111.4 | F22 T68 W69 E70 V75 L76 | F22-L72 HydrophobicContact CE1-CB 4.15Å; F22-L72 HydrophobicContact CZ-CB 4.35Å; T68-L72 WeakPolarHBondContact O-CB 3.26Å; T68-L72 PolarHBondContact O-N 2.98Å; W69-L72 WeakPolarHBondContact O-CB 3.41Å; W69-L72 PolarHBondContact O-N 3.3Å; W69-L72 VanDerWaalsContact O-N 3.12Å; E70-L72 VanDerWaalsContact C-N 3.33Å; E70-L72 PolarHBondContact O-N 3.41Å; L72-V75 PolarHBondContact O-N 3.02Å; L72-L76 HydrophobicContact CD1-CD1 4.18Å; L72-L76 HydrophobicContact CD1-CG 4.28Å; L72-L76 HydrophobicContact CG-CD1 4.03Å; L72-L76 WeakPolarHBondContact O-CB 3.37Å; L72-L76 VanDerWaalsContact O-CG 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3Å |
| 73 | M | 87 | Confident | 86.1 | Confident | 61 Ų | 61 | 58.2 Ų | 58.2 | 30% | 0.3 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 178.2 | -66.2 | -58.8 | -72.4 | 0 | 0 | 111.6 | W69 E70 V75 L76 A77 L82 | W69-M73 HydrophobicContact CZ2-SD 4.08Å; W69-M73 WeakPolarHBondContact O-CG 3.38Å; W69-M73 PolarHBondContact O-N 3.2Å; E70-M73 PolarHBondContact O-N 3.19Å; M73-V75 PolarHBondContact O-N 3.42Å; M73-L76 PolarHBondContact O-N 3.49Å; M73-A77 WeakPolarHBondContact O-CB 3.48Å; M73-A77 PolarHBondContact O-N 3.39Å; M73-L82 HydrophobicContact CE-CD1 3.5Å; M73-L82 HydrophobicContact CE-CD2 4.29Å; M73-L82 HydrophobicContact SD-CD1 3.98Å |
| 74 | I | 85.3 | Confident | 84.4 | Confident | 68 Ų | 68 | 67.6 Ų | 67.6 | 35% | 0.349 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -59.6 | -47.3 | 175.2 | -68 | 165.5 | 0 | 0 | 0 | 110.7 | F18 E70 N71 L76 A77 D78 | F18-I74 HydrophobicContact CE1-CG2 3.96Å; F18-I74 HydrophobicContact CZ-CG2 4.01Å; E70-I74 HydrophobicContact CG-CD1 4.24Å; E70-I74 VanDerWaalsContact O-CG1 3.32Å; E70-I74 WeakPolarHBondContact O-CG1 3.4Å; E70-I74 PolarHBondContact O-N 3.18Å; N71-I74 PolarHBondContact O-N 3.38Å; I74-L76 PolarHBondContact O-N 2.93Å; I74-A77 PolarHBondContact O-N 2.94Å; I74-D78 PolarHBondContact O-N 3.31Å |
| 75 | V | 87.6 | Confident | 82.1 | Confident | 42 Ų | 42 | 75.5 Ų | 75.5 | 26% | 0.255 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.4 | -42.2 | 179 | 170.4 | 0 | 0 | 0 | 0 | 112.1 | F18 F22 N71 L72 M73 A77 D78 A79 | F18-V75 HydrophobicContact CB-CG2 4.19Å; F18-V75 HydrophobicContact CD1-CG2 3.35Å; F18-V75 HydrophobicContact CD2-CG2 3.75Å; F18-V75 HydrophobicContact CE1-CG2 3.47Å; F18-V75 VanDerWaalsContact CE1-CG2 3.47Å; F18-V75 HydrophobicContact CE2-CG2 3.85Å; F18-V75 HydrophobicContact CG-CG2 3.49Å; F18-V75 VanDerWaalsContact CG-CG2 3.49Å; F18-V75 HydrophobicContact CZ-CG2 3.71Å; F22-V75 HydrophobicContact CE2-CG2 4.05Å; F22-V75 HydrophobicContact CZ-CG2 4.2Å; N71-V75 WeakPolarHBondContact O-CG2 3.35Å; N71-V75 PolarHBondContact O-N 2.79Å; L72-V75 PolarHBondContact O-N 3.02Å; M73-V75 PolarHBondContact O-N 3.42Å; V75-A77 VanDerWaalsContact C-N 3.32Å; V75-D78 PolarHBondContact O-N 3.43Å; V75-A79 WeakPolarHBondContact O-CB 3.49Å; V75-A79 PolarHBondContact O-N 2.95Å |
| 76 | L | 86.4 | Confident | 80.1 | Confident | 61 Ų | 61 | 74.3 Ų | 74.3 | 32% | 0.319 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -66.5 | -35 | 177.9 | -72.5 | 173.5 | 0 | 0 | 0 | 112 | L72 M73 I74 G80 H81 L82 | L72-L76 HydrophobicContact CD1-CD1 4.18Å; L72-L76 HydrophobicContact CD1-CG 4.28Å; L72-L76 HydrophobicContact CG-CD1 4.03Å; L72-L76 WeakPolarHBondContact O-CB 3.37Å; L72-L76 VanDerWaalsContact O-CG 3.31Å; L72-L76 WeakPolarHBondContact O-CG 3.31Å; L72-L76 PolarHBondContact O-N 3Å; M73-L76 PolarHBondContact O-N 3.49Å; I74-L76 PolarHBondContact O-N 2.93Å; L76-G80 PolarHBondContact O-N 2.93Å; L76-H81 WeakPolarHBondContact O-CB 3.43Å; L76-H81 PolarHBondContact O-N 3.2Å; L76-L82 HydrophobicContact CB-CD1 3.48Å; L76-L82 VanDerWaalsContact CB-CD1 3.48Å; L76-L82 HydrophobicContact CB-CG 4.05Å; L76-L82 HydrophobicContact CD1-CD1 4.31Å; L76-L82 PolarHBondContact O-N 3.12Å |
| 77 | A | 84 | Confident | 77.9 | Confident | 29 Ų | 29 | 78.8 Ų | 78.8 | 24% | 0.24 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -67.9 | -45 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | M73 I74 V75 A79 G80 L82 | M73-A77 WeakPolarHBondContact O-CB 3.48Å; M73-A77 PolarHBondContact O-N 3.39Å; I74-A77 PolarHBondContact O-N 2.94Å; V75-A77 VanDerWaalsContact C-N 3.32Å; A77-A79 VanDerWaalsContact C-N 3.27Å; A77-A79 PolarHBondContact O-N 3.24Å; A77-G80 PolarHBondContact O-N 3.27Å; A77-L82 HydrophobicContact CB-CB 4.27Å |
| 78 | D | 83.1 | Confident | 76.1 | Confident | 108 Ų | 108 | 81.9 Ų | 81.9 | 58% | 0.578 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -64.2 | -31.9 | 176.8 | -82.4 | -1.4 | 0 | 0 | 0 | 112.5 | I74 V75 G80 | I74-D78 PolarHBondContact O-N 3.31Å; V75-D78 PolarHBondContact O-N 3.43Å; D78-G80 PolarHBondContact O-N 3.32Å |
| 79 | A | 85.2 | Confident | 74.4 | Confident | 61 Ų | 61 | 84.1 Ų | 84.1 | 50% | 0.504 | 45% | 0.445 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | -2.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | V75 A77 H81 | V75-A79 WeakPolarHBondContact O-CB 3.49Å; V75-A79 PolarHBondContact O-N 2.95Å; A77-A79 VanDerWaalsContact C-N 3.27Å; A77-A79 PolarHBondContact O-N 3.24Å; A79-H81 VanDerWaalsContact C-N 3.29Å; A79-H81 PolarHBondContact O-N 3.49Å |
| 80 | G | 79.4 | Confident | 73.3 | Confident | 64 Ų | 64 | 82 Ų | 82 | 66% | 0.66 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.1 | 13.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | L76 A77 D78 | L76-G80 PolarHBondContact O-N 2.93Å; A77-G80 PolarHBondContact O-N 3.27Å; D78-G80 PolarHBondContact O-N 3.32Å |
| 81 | H | 78.3 | Confident | 72.8 | Confident | 151 Ų | 151 | 85.1 Ų | 85.1 | 70% | 0.699 | 46% | 0.463 | S | S | * | . | S | Bend | trans | -85.8 | -16.1 | 177.9 | -70.4 | -60.8 | 0 | 0 | 0 | 113.5 | L76 A79 | L76-H81 WeakPolarHBondContact O-CB 3.43Å; L76-H81 PolarHBondContact O-N 3.2Å; A79-H81 VanDerWaalsContact C-N 3.29Å; A79-H81 PolarHBondContact O-N 3.49Å |
| 82 | L | 72.6 | Confident | 72.5 | Confident | 56 Ų | 56 | 89.6 Ų | 89.6 | 29% | 0.293 | 49% | 0.487 | S | S | . | . | S | Bend | trans | -120.8 | 119.1 | 172.8 | -67.7 | 164.6 | 0 | 0 | 0 | 108.6 | M73 L76 A77 R84 | M73-L82 HydrophobicContact CE-CD1 3.5Å; M73-L82 HydrophobicContact CE-CD2 4.29Å; M73-L82 HydrophobicContact SD-CD1 3.98Å; L76-L82 HydrophobicContact CB-CD1 3.48Å; L76-L82 VanDerWaalsContact CB-CD1 3.48Å; L76-L82 HydrophobicContact CB-CG 4.05Å; L76-L82 HydrophobicContact CD1-CD1 4.31Å; L76-L82 PolarHBondContact O-N 3.12Å; A77-L82 HydrophobicContact CB-CB 4.27Å; L82-R84 PolarHBondContact O-N 3.39Å |
| 83 | E | 62.8 | Low | 72.3 | Confident | 132 Ų | 132 | 89.9 Ų | 89.9 | 62% | 0.617 | 49% | 0.489 | S | S | * | . | trans | -72.4 | 121.6 | 164.7 | -75 | -173.5 | 151 | 0 | 0 | 107.8 | R85 | E83-R85 VanDerWaalsContact C-N 3.34Å; E83-R85 HydrophobicContact CB-CB 4.36Å; E83-R85 WeakPolarHBondContact O-CB 3.17Å; E83-R85 PolarHBondContact O-N 3.04Å; E83-R85 IonicContact OE1-NH1 3.53Å; E83-R85 VanDerWaalsContact OE2-CD 3.32Å; E83-R85 WeakPolarHBondContact OE2-CD 3.4Å; E83-R85 IonicContact OE2-CZ 3.64Å; E83-R85 IonicContact OE2-NE 3.86Å; E83-R85 IonicContact OE2-NH1 2.71Å; E83-R85 PolarHBondContact OE2-NH1 3.32Å | ||
| 84 | R | 58.1 | Low | 72.4 | Confident | 217 Ų | 217 | 90.5 Ų | 90.5 | 82% | 0.819 | 49% | 0.493 | S | S | * | . | trans | -57.4 | 96.8 | 167.3 | -78.9 | -170.3 | -157.9 | 121.8 | 7.1 | 108.6 | L82 E89 | L82-R84 PolarHBondContact O-N 3.39Å; R84-E89 VanDerWaalsContact CA-OE2 3.31Å; R84-E89 WeakPolarHBondContact CA-OE2 3.47Å | ||
| 85 | R | 46.4 | Very low | 72.7 | Confident | 173 Ų | 173 | 90.9 Ų | 90.9 | 65% | 0.653 | 50% | 0.498 | S | S | * | . | trans | -132.3 | 91.7 | -169.4 | -153.8 | 150.3 | -169.2 | 136.9 | 6.7 | 112.1 | E83 E89 | E83-R85 VanDerWaalsContact C-N 3.34Å; E83-R85 HydrophobicContact CB-CB 4.36Å; E83-R85 WeakPolarHBondContact O-CB 3.17Å; E83-R85 PolarHBondContact O-N 3.04Å; E83-R85 IonicContact OE1-NH1 3.53Å; E83-R85 VanDerWaalsContact OE2-CD 3.32Å; E83-R85 WeakPolarHBondContact OE2-CD 3.4Å; E83-R85 IonicContact OE2-CZ 3.64Å; E83-R85 IonicContact OE2-NE 3.86Å; E83-R85 IonicContact OE2-NH1 2.71Å; E83-R85 PolarHBondContact OE2-NH1 3.32Å; R85-E89 VanDerWaalsContact N-CD 3.35Å; R85-E89 PolarHBondContact N-OE2 3.24Å | ||
| 86 | G | 52.4 | Low | 72.9 | Confident | 44 Ų | 44 | 90.6 Ų | 90.6 | 45% | 0.454 | 50% | 0.495 | S | S | . | . | S | Bend | trans | 67.9 | -171.1 | 151.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | P88 E89 | G86-P88 WeakPolarHBondContact O-CD 3.33Å; G86-E89 PolarHBondContact O-N 3.33Å; G86-E89 VanDerWaalsContact O-N 3.13Å |
| 87 | P | 46.9 | Very low | 73.2 | Confident | 97 Ų | 97 | 90.4 Ų | 90.4 | 63% | 0.63 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -58.8 | -26.1 | -161.7 | 19.5 | -30.5 | 0 | 0 | 0 | 119.2 | E89 T90 D91 | P87-E89 VanDerWaalsContact C-N 3.31Å; P87-E89 PolarHBondContact O-N 3.41Å; P87-T90 WeakPolarHBondContact CA-OG1 3.49Å; P87-T90 PolarHBondContact O-N 3.45Å; P87-T90 PolarHBondContact O-OG1 2.97Å; P87-D91 PolarHBondContact O-N 2.97Å |
| 88 | P | 52 | Low | 73.7 | Confident | 84 Ų | 84 | 90 Ų | 90 | 55% | 0.545 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -72.2 | -21.3 | 174.7 | 25.3 | -32 | 0 | 0 | 0 | 113.8 | G86 L92 | G86-P88 WeakPolarHBondContact O-CD 3.33Å; P88-L92 PolarHBondContact O-N 2.82Å |
| 89 | E | 57 | Low | 74.3 | Confident | 73 Ų | 73 | 87.6 Ų | 87.6 | 34% | 0.341 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -72 | -35.4 | 172.2 | -69.8 | -173.6 | 157.1 | 0 | 0 | 111.6 | R84 R85 G86 P87 L92 D93 | R84-E89 VanDerWaalsContact CA-OE2 3.31Å; R84-E89 WeakPolarHBondContact CA-OE2 3.47Å; R85-E89 VanDerWaalsContact N-CD 3.35Å; R85-E89 PolarHBondContact N-OE2 3.24Å; G86-E89 PolarHBondContact O-N 3.33Å; G86-E89 VanDerWaalsContact O-N 3.13Å; P87-E89 VanDerWaalsContact C-N 3.31Å; P87-E89 PolarHBondContact O-N 3.41Å; E89-L92 PolarHBondContact O-N 2.63Å; E89-D93 WeakPolarHBondContact O-CB 3.38Å; E89-D93 PolarHBondContact O-N 2.92Å |
| 90 | T | 66.3 | Low | 74.7 | Confident | 78 Ų | 78 | 85.8 Ų | 85.8 | 48% | 0.479 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -68.7 | -34.6 | 175.6 | 45.2 | 0 | 0 | 0 | 0 | 112.5 | P87 D93 D94 | P87-T90 WeakPolarHBondContact CA-OG1 3.49Å; P87-T90 PolarHBondContact O-N 3.45Å; P87-T90 PolarHBondContact O-OG1 2.97Å; T90-D93 PolarHBondContact O-N 3.01Å; T90-D94 WeakPolarHBondContact O-CB 3.41Å; T90-D94 VanDerWaalsContact O-CG 3.32Å; T90-D94 PolarHBondContact O-N 3.13Å |
| 91 | D | 78.3 | Confident | 75.4 | Confident | 106 Ų | 106 | 83.5 Ų | 83.5 | 57% | 0.567 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -68.5 | -37.6 | 177.4 | -74.2 | -13.8 | 0 | 0 | 0 | 112 | P87 V95 | P87-D91 PolarHBondContact O-N 2.97Å; D91-V95 VanDerWaalsContact O-CG2 3.22Å; D91-V95 WeakPolarHBondContact O-CG2 3.43Å; D91-V95 PolarHBondContact O-N 2.7Å; D91-V95 VanDerWaalsContact O-N 3.16Å |
| 92 | L | 84.3 | Confident | 76.3 | Confident | 105 Ų | 105 | 77.7 Ų | 77.7 | 55% | 0.55 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -72.7 | -39 | 175.9 | -74.3 | 173.6 | 0 | 0 | 0 | 112 | P88 E89 V95 M96 | P88-L92 PolarHBondContact O-N 2.82Å; E89-L92 PolarHBondContact O-N 2.63Å; L92-V95 PolarHBondContact O-N 3.47Å; L92-M96 VanDerWaalsContact O-CG 3.3Å; L92-M96 WeakPolarHBondContact O-CG 3.4Å; L92-M96 PolarHBondContact O-N 3.41Å |
| 93 | D | 85.2 | Confident | 77.3 | Confident | 78 Ų | 78 | 75.1 Ų | 75.1 | 42% | 0.417 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -60.7 | -48.3 | 174.7 | -164.1 | 48.2 | 0 | 0 | 0 | 110.9 | E89 T90 V95 M96 D97 | E89-D93 WeakPolarHBondContact O-CB 3.38Å; E89-D93 PolarHBondContact O-N 2.92Å; T90-D93 PolarHBondContact O-N 3.01Å; D93-V95 VanDerWaalsContact C-N 3.28Å; D93-V95 PolarHBondContact O-N 3.47Å; D93-M96 PolarHBondContact O-N 2.87Å; D93-D97 PolarHBondContact O-N 2.87Å |
| 94 | D | 89.1 | Confident | 78.8 | Confident | 74 Ų | 74 | 69 Ų | 69 | 40% | 0.396 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -59.1 | -36.8 | 175.5 | -80.2 | -7 | 0 | 0 | 0 | 112.5 | T90 S98 V156 | T90-D94 WeakPolarHBondContact O-CB 3.41Å; T90-D94 VanDerWaalsContact O-CG 3.32Å; T90-D94 PolarHBondContact O-N 3.13Å; D94-S98 WeakPolarHBondContact O-CB 3.31Å; D94-S98 PolarHBondContact O-N 3.32Å; D94-S98 PolarHBondContact O-OG 3Å; D94-V156 HydrophobicContact CB-CG1 4.34Å |
| 95 | V | 91.4 | Very high | 80.6 | Confident | 75 Ų | 75 | 58.8 Ų | 58.8 | 46% | 0.455 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -67.3 | -44.1 | 175.1 | 167.5 | 0 | 0 | 0 | 0 | 110.8 | D91 L92 D93 S98 L99 | D91-V95 VanDerWaalsContact O-CG2 3.22Å; D91-V95 WeakPolarHBondContact O-CG2 3.43Å; D91-V95 PolarHBondContact O-N 2.7Å; D91-V95 VanDerWaalsContact O-N 3.16Å; L92-V95 PolarHBondContact O-N 3.47Å; D93-V95 VanDerWaalsContact C-N 3.28Å; D93-V95 PolarHBondContact O-N 3.47Å; V95-S98 WeakPolarHBondContact O-CB 3.34Å; V95-S98 PolarHBondContact O-N 3.39Å; V95-L99 HydrophobicContact CG1-CD1 4.22Å; V95-L99 WeakPolarHBondContact O-CG 3.36Å; V95-L99 PolarHBondContact O-N 3.45Å |
| 96 | M | 92.2 | Very high | 82.9 | Confident | 36 Ų | 36 | 50.5 Ų | 50.5 | 18% | 0.177 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -64 | -47.7 | 177.5 | -69.1 | -58.1 | 169 | 0 | 0 | 110.6 | T66 W69 L92 D93 S98 L99 L100 | T66-M96 HydrophobicContact CG2-CB 3.54Å; T66-M96 HydrophobicContact CG2-CG 4.08Å; T66-M96 VanDerWaalsContact CG2-O 3.26Å; T66-M96 WeakPolarHBondContact CG2-O 3.45Å; T66-M96 HydrophobicContact CG2-SD 3.64Å; W69-M96 VanDerWaalsContact CD1-CE 3.49Å; W69-M96 HydrophobicContact CG-CE 4.01Å; L92-M96 VanDerWaalsContact O-CG 3.3Å; L92-M96 WeakPolarHBondContact O-CG 3.4Å; L92-M96 PolarHBondContact O-N 3.41Å; D93-M96 PolarHBondContact O-N 2.87Å; M96-S98 VanDerWaalsContact C-N 3.26Å; M96-S98 PolarHBondContact O-N 3.41Å; M96-L99 WeakPolarHBondContact O-CB 3.46Å; M96-L99 PolarHBondContact O-N 2.91Å; M96-L99 HydrophobicContact SD-CD1 4.34Å; M96-L100 WeakPolarHBondContact O-CG 3.36Å; M96-L100 PolarHBondContact O-N 3.48Å |
| 97 | D | 91.4 | Very high | 85 | Confident | 58 Ų | 58 | 48.5 Ų | 48.5 | 31% | 0.31 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -59.7 | -37.5 | 174.2 | -85.6 | -11.3 | 0 | 0 | 0 | 112.3 | D93 L100 C101 V156 | D93-D97 PolarHBondContact O-N 2.87Å; D97-L100 PolarHBondContact O-N 3.3Å; D97-C101 WeakPolarHBondContact O-CB 3.37Å; D97-C101 PolarHBondContact O-N 3.01Å; D97-V156 HydrophobicContact CB-CG1 4Å; D97-V156 HydrophobicContact CB-CG2 4.15Å |
| 98 | S | 94.8 | Very high | 87.2 | Confident | 19 Ų | 19 | 44 Ų | 44 | 13% | 0.133 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -64.6 | -41.2 | 174.5 | -65.4 | 0 | 0 | 0 | 0 | 111.7 | D94 V95 M96 L100 C101 M102 A152 | D94-S98 WeakPolarHBondContact O-CB 3.31Å; D94-S98 PolarHBondContact O-N 3.32Å; D94-S98 PolarHBondContact O-OG 3Å; V95-S98 WeakPolarHBondContact O-CB 3.34Å; V95-S98 PolarHBondContact O-N 3.39Å; M96-S98 VanDerWaalsContact C-N 3.26Å; M96-S98 PolarHBondContact O-N 3.41Å; S98-L100 VanDerWaalsContact C-N 3.35Å; S98-C101 PolarHBondContact O-N 3.24Å; S98-M102 VanDerWaalsContact O-CB 3.22Å; S98-M102 WeakPolarHBondContact O-CB 3.24Å; S98-M102 PolarHBondContact O-N 2.97Å; S98-A152 WeakPolarHBondContact O-CB 3.33Å |
| 99 | L | 95.4 | Very high | 89.2 | Confident | 59 Ų | 59 | 41.1 Ų | 41.1 | 31% | 0.309 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -66.7 | -35.9 | 176 | -71.4 | 171.6 | 0 | 0 | 0 | 112 | I62 T66 V95 M96 S103 | I62-L99 HydrophobicContact CG2-CB 3.98Å; I62-L99 HydrophobicContact CG2-CD2 4.17Å; T66-L99 HydrophobicContact CG2-CB 4.47Å; V95-L99 HydrophobicContact CG1-CD1 4.22Å; V95-L99 WeakPolarHBondContact O-CG 3.36Å; V95-L99 PolarHBondContact O-N 3.45Å; M96-L99 WeakPolarHBondContact O-CB 3.46Å; M96-L99 PolarHBondContact O-N 2.91Å; M96-L99 HydrophobicContact SD-CD1 4.34Å; L99-S103 WeakPolarHBondContact O-CB 3.43Å; L99-S103 PolarHBondContact O-N 3.38Å; L99-S103 PolarHBondContact O-OG 3.04Å |
| 100 | L | 93.6 | Very high | 91.1 | Very high | 22 Ų | 22 | 37.6 Ų | 37.6 | 12% | 0.115 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67.5 | -47.2 | 173.9 | -72.3 | 167.9 | 0 | 0 | 0 | 112 | A63 T66 K67 M96 D97 S98 M102 S103 F104 | A63-L100 HydrophobicContact CB-CD2 4.18Å; T66-L100 HydrophobicContact CG2-CD1 3.8Å; T66-L100 HydrophobicContact CG2-CD2 4Å; T66-L100 HydrophobicContact CG2-CG 3.5Å; K67-L100 HydrophobicContact CD-CD1 3.88Å; K67-L100 HydrophobicContact CD-CD2 4.31Å; K67-L100 HydrophobicContact CG-CD1 4.18Å; K67-L100 HydrophobicContact CG-CD2 3.67Å; M96-L100 WeakPolarHBondContact O-CG 3.36Å; M96-L100 PolarHBondContact O-N 3.48Å; D97-L100 PolarHBondContact O-N 3.3Å; S98-L100 VanDerWaalsContact C-N 3.35Å; L100-M102 VanDerWaalsContact C-N 3.29Å; L100-M102 PolarHBondContact O-N 3.32Å; L100-S103 WeakPolarHBondContact O-CB 3.43Å; L100-S103 PolarHBondContact O-N 3.43Å; L100-F104 PolarHBondContact O-N 2.84Å |
| 101 | C | 94.8 | Very high | 92.3 | Very high | 16 Ų | 16 | 33.9 Ų | 33.9 | 11% | 0.108 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.8 | -40 | 175.8 | -174 | 0 | 0 | 0 | 0 | 111 | D97 S98 S103 F104 V105 A152 V156 | D97-C101 WeakPolarHBondContact O-CB 3.37Å; D97-C101 PolarHBondContact O-N 3.01Å; S98-C101 PolarHBondContact O-N 3.24Å; C101-S103 VanDerWaalsContact C-N 3.33Å; C101-S103 PolarHBondContact O-N 3.12Å; C101-F104 WeakPolarHBondContact O-CB 3.34Å; C101-F104 PolarHBondContact O-N 3.47Å; C101-V105 WeakPolarHBondContact O-CG2 3.3Å; C101-V105 PolarHBondContact O-N 3.25Å; C101-A152 HydrophobicContact CB-CB 3.95Å; C101-V156 HydrophobicContact CB-CG2 4.12Å |
| 102 | M | 96.2 | Very high | 93 | Very high | 30 Ų | 30 | 32 Ų | 32 | 15% | 0.148 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.9 | -45.3 | 174.8 | -176.1 | -157 | -133.9 | 0 | 0 | 110.9 | F59 S98 L100 F104 V105 G106 C148 A149 A152 | F59-M102 HydrophobicContact CE1-CG 4.14Å; F59-M102 HydrophobicContact CE1-SD 4.36Å; S98-M102 VanDerWaalsContact O-CB 3.22Å; S98-M102 WeakPolarHBondContact O-CB 3.24Å; S98-M102 PolarHBondContact O-N 2.97Å; L100-M102 VanDerWaalsContact C-N 3.29Å; L100-M102 PolarHBondContact O-N 3.32Å; M102-F104 VanDerWaalsContact C-N 3.31Å; M102-F104 PolarHBondContact O-N 2.85Å; M102-V105 PolarHBondContact O-N 2.9Å; M102-G106 WeakPolarHBondContact O-CA 3.26Å; M102-G106 PolarHBondContact O-N 2.88Å; M102-C148 HydrophobicContact CG-CB 4.13Å; M102-A149 HydrophobicContact CE-CB 3.29Å; M102-A152 VanDerWaalsContact CA-CB 3.49Å; M102-A152 HydrophobicContact CB-CB 3.68Å; M102-A152 VanDerWaalsContact N-CB 3.27Å |
| 103 | S | 95.5 | Very high | 93.5 | Very high | 2 Ų | 2 | 27.6 Ų | 27.6 | 1% | 0.014 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63.3 | -38.8 | 179.4 | -58.8 | 0 | 0 | 0 | 0 | 112.1 | F59 I62 A63 L99 L100 C101 S107 | F59-S103 VanDerWaalsContact O-CB 3.29Å; F59-S103 WeakPolarHBondContact O-CB 3.33Å; F59-S103 PolarHBondContact O-OG 3.36Å; F59-S103 VanDerWaalsContact O-OG 3.11Å; I62-S103 WeakPolarHBondContact CB-OG 3.07Å; I62-S103 WeakPolarHBondContact CG2-OG 3.49Å; A63-S103 PolarHBondContact N-OG 3.47Å; L99-S103 WeakPolarHBondContact O-CB 3.43Å; L99-S103 PolarHBondContact O-N 3.38Å; L99-S103 PolarHBondContact O-OG 3.04Å; L100-S103 WeakPolarHBondContact O-CB 3.43Å; L100-S103 PolarHBondContact O-N 3.43Å; C101-S103 VanDerWaalsContact C-N 3.33Å; C101-S103 PolarHBondContact O-N 3.12Å; S103-S107 WeakPolarHBondContact O-CB 3.46Å; S103-S107 PolarHBondContact O-N 3.43Å; S103-S107 PolarHBondContact O-OG 2.8Å |
| 104 | F | 93.8 | Very high | 93.8 | Very high | 2 Ų | 2 | 23.9 Ų | 23.9 | 1% | 0.009 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.8 | -55 | 174.5 | 168.8 | -105.9 | 0 | 0 | 0 | 112.7 | L100 C101 M102 G106 S107 I108 F168 F172 F231 W235 F239 | L100-F104 PolarHBondContact O-N 2.84Å; C101-F104 WeakPolarHBondContact O-CB 3.34Å; C101-F104 PolarHBondContact O-N 3.47Å; M102-F104 VanDerWaalsContact C-N 3.31Å; M102-F104 PolarHBondContact O-N 2.85Å; F104-G106 PolarHBondContact O-N 3.33Å; F104-S107 WeakPolarHBondContact O-CB 3.48Å; F104-S107 PolarHBondContact O-N 3.27Å; F104-S107 VanDerWaalsContact O-N 3.12Å; F104-I108 HydrophobicContact CD2-CD1 4.43Å; F104-I108 HydrophobicContact CE1-CD1 3.72Å; F104-I108 HydrophobicContact CE2-CD1 3.66Å; F104-I108 HydrophobicContact CE2-CG1 4.25Å; F104-I108 HydrophobicContact CZ-CD1 3.25Å; F104-I108 HydrophobicContact CZ-CG1 4.28Å; F104-I108 PolarHBondContact O-N 2.99Å; F104-I108 VanDerWaalsContact O-N 3.12Å; F104-F168 AromaticContact CD1-CE2 3.6Å; F104-F168 HydrophobicContact CD1-CE2 3.6Å; F104-F168 AromaticContact CD1-CZ 3.44Å; F104-F168 HydrophobicContact CD1-CZ 3.44Å; F104-F168 VanDerWaalsContact CD1-CZ 3.44Å; F104-F168 AromaticContact CE1-CE2 3.43Å; F104-F168 HydrophobicContact CE1-CE2 3.43Å; F104-F168 VanDerWaalsContact CE1-CE2 3.43Å; F104-F168 AromaticContact CE1-CZ 3.42Å; F104-F168 HydrophobicContact CE1-CZ 3.42Å; F104-F168 VanDerWaalsContact CE1-CZ 3.42Å; F104-F168 HydrophobicContact CG-CZ 4.46Å; F104-F168 HydrophobicContact CZ-CZ 4.4Å; F104-F172 HydrophobicContact CE2-CD2 4.02Å; F104-F172 HydrophobicContact CE2-CE2 4.12Å; F104-F172 HydrophobicContact CZ-CB 4.3Å; F104-F172 AromaticContact CZ-CD2 3.51Å; F104-F172 HydrophobicContact CZ-CD2 3.51Å; F104-F172 HydrophobicContact CZ-CE2 4.08Å; F104-F172 HydrophobicContact CZ-CG 4.21Å; F104-F231 HydrophobicContact CD2-CE2 4.46Å; F104-F231 HydrophobicContact CD2-CZ 4.18Å; F104-F231 HydrophobicContact CE2-CE2 4.43Å; F104-F231 AromaticContact CE2-CZ 3.73Å; F104-F231 HydrophobicContact CE2-CZ 3.73Å; F104-W235 HydrophobicContact CB-CH2 3.6Å; F104-W235 HydrophobicContact CB-CZ2 4.31Å; F104-W235 HydrophobicContact CB-CZ3 3.82Å; F104-W235 AromaticContact CD2-CD2 3.62Å; F104-W235 HydrophobicContact CD2-CD2 3.62Å; F104-W235 AromaticContact CD2-CE2 3.91Å; F104-W235 AromaticContact CD2-CE3 3.24Å; F104-W235 HydrophobicContact CD2-CE3 3.24Å; F104-W235 AromaticContact CD2-CH2 3.54Å; F104-W235 HydrophobicContact CD2-CH2 3.54Å; F104-W235 AromaticContact CD2-CZ2 3.89Å; F104-W235 HydrophobicContact CD2-CZ2 3.89Å; F104-W235 AromaticContact CD2-CZ3 3.2Å; F104-W235 HydrophobicContact CD2-CZ3 3.2Å; F104-W235 AromaticContact CE2-CD2 3.85Å; F104-W235 HydrophobicContact CE2-CD2 3.85Å; F104-W235 AromaticContact CE2-CE3 3.54Å; F104-W235 HydrophobicContact CE2-CE3 3.54Å; F104-W235 HydrophobicContact CE2-CG 4.35Å; F104-W235 AromaticContact CE2-CZ3 3.96Å; F104-W235 HydrophobicContact CE2-CZ3 3.96Å; F104-W235 HydrophobicContact CG-CE3 4.19Å; F104-W235 AromaticContact CG-CH2 3.96Å; F104-W235 HydrophobicContact CG-CH2 3.96Å; F104-W235 AromaticContact CG-CZ3 3.72Å; F104-W235 HydrophobicContact CG-CZ3 3.72Å; F104-F239 HydrophobicContact CD1-CZ 4.31Å; F104-F239 HydrophobicContact CD2-CE2 4.31Å; F104-F239 HydrophobicContact CE1-CE1 4.44Å; F104-F239 AromaticContact CE1-CE2 3.99Å; F104-F239 HydrophobicContact CE1-CE2 3.99Å; F104-F239 AromaticContact CE1-CZ 3.42Å; F104-F239 HydrophobicContact CE1-CZ 3.42Å; F104-F239 VanDerWaalsContact CE1-CZ 3.42Å; F104-F239 AromaticContact CE2-CE2 3.39Å; F104-F239 HydrophobicContact CE2-CE2 3.39Å; F104-F239 AromaticContact CE2-CZ 3.76Å; F104-F239 HydrophobicContact CE2-CZ 3.76Å; F104-F239 HydrophobicContact CZ-CD2 4.41Å; F104-F239 HydrophobicContact CZ-CE1 4.19Å; F104-F239 AromaticContact CZ-CE2 3.18Å; F104-F239 HydrophobicContact CZ-CE2 3.18Å; F104-F239 AromaticContact CZ-CZ 3.05Å; F104-F239 HydrophobicContact CZ-CZ 3.05Å |
| 105 | V | 95.2 | Very high | 93.9 | Very high | 3 Ų | 3 | 20.5 Ų | 20.5 | 2% | 0.018 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.3 | -38.7 | 179.5 | 178.3 | 0 | 0 | 0 | 0 | 110.3 | C101 M102 I108 S109 C148 L151 F168 F171 | C101-V105 WeakPolarHBondContact O-CG2 3.3Å; C101-V105 PolarHBondContact O-N 3.25Å; M102-V105 PolarHBondContact O-N 2.9Å; V105-I108 PolarHBondContact O-N 3.13Å; V105-S109 WeakPolarHBondContact O-CB 3.45Å; V105-S109 PolarHBondContact O-N 3.02Å; V105-S109 PolarHBondContact O-OG 3.18Å; V105-C148 HydrophobicContact CB-CB 4.37Å; V105-C148 HydrophobicContact CG1-CB 4.17Å; V105-C148 VanDerWaalsContact CG1-SG 3.58Å; V105-L151 HydrophobicContact CG1-CD2 3.84Å; V105-L151 HydrophobicContact CG2-CD2 4.19Å; V105-F168 HydrophobicContact CG2-CE2 4.42Å; V105-F171 HydrophobicContact CG1-CE1 4.19Å; V105-F171 HydrophobicContact CG1-CZ 4Å; V105-F171 HydrophobicContact CG2-CE1 4.22Å |
| 106 | G | 95.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -62.5 | -39.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | F59 M102 F104 S109 S110 C148 | F59-G106 VanDerWaalsContact CD2-C 3.45Å; M102-G106 WeakPolarHBondContact O-CA 3.26Å; M102-G106 PolarHBondContact O-N 2.88Å; F104-G106 PolarHBondContact O-N 3.33Å; G106-S109 PolarHBondContact O-N 3.23Å; G106-S110 VanDerWaalsContact O-CB 3.28Å; G106-S110 WeakPolarHBondContact O-CB 3.36Å; G106-S110 PolarHBondContact O-N 3.21Å; G106-S110 PolarHBondContact O-OG 3.34Å; G106-C148 WeakPolarHBondContact CA-SG 3.5Å; G106-C148 PolarHBondContact N-SG 3.48Å; G106-C148 VanDerWaalsContact N-SG 3.44Å |
| 107 | S | 94.8 | Very high | 93.8 | Very high | 1 Ų | 1 | 18 Ų | 18 | 1% | 0.007 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -64.8 | -47.4 | 176.7 | -62.6 | 0 | 0 | 0 | 0 | 111.5 | S103 F104 S109 S110 F111 | S103-S107 WeakPolarHBondContact O-CB 3.46Å; S103-S107 PolarHBondContact O-N 3.43Å; S103-S107 PolarHBondContact O-OG 2.8Å; F104-S107 WeakPolarHBondContact O-CB 3.48Å; F104-S107 PolarHBondContact O-N 3.27Å; F104-S107 VanDerWaalsContact O-N 3.12Å; S107-S109 PolarHBondContact O-N 3.38Å; S107-S110 PolarHBondContact O-N 3.01Å; S107-F111 WeakPolarHBondContact O-CD2 3.39Å; S107-F111 PolarHBondContact O-N 3.38Å |
| 108 | I | 93.9 | Very high | 93.7 | Very high | 3 Ų | 3 | 15.8 Ų | 15.8 | 2% | 0.015 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -58 | -48.7 | 174.8 | -70.1 | -179.2 | 0 | 0 | 0 | 111.1 | F104 V105 S110 F111 L112 F171 F172 S175 I179 F231 | F104-I108 HydrophobicContact CD2-CD1 4.43Å; F104-I108 HydrophobicContact CE1-CD1 3.72Å; F104-I108 HydrophobicContact CE2-CD1 3.66Å; F104-I108 HydrophobicContact CE2-CG1 4.25Å; F104-I108 HydrophobicContact CZ-CD1 3.25Å; F104-I108 HydrophobicContact CZ-CG1 4.28Å; F104-I108 PolarHBondContact O-N 2.99Å; F104-I108 VanDerWaalsContact O-N 3.12Å; V105-I108 PolarHBondContact O-N 3.13Å; I108-S110 VanDerWaalsContact C-N 3.28Å; I108-S110 PolarHBondContact O-N 3.23Å; I108-F111 PolarHBondContact O-N 3.43Å; I108-L112 PolarHBondContact O-N 3.48Å; I108-F171 HydrophobicContact CD1-CE1 4.24Å; I108-F172 HydrophobicContact CD1-CD2 3.97Å; I108-S175 VanDerWaalsContact CG2-CB 3.46Å; I108-I179 HydrophobicContact CG2-CD1 4.19Å; I108-F231 HydrophobicContact CD1-CE1 4.34Å; I108-F231 HydrophobicContact CD1-CZ 3.98Å; I108-F231 HydrophobicContact CG1-CE1 3.85Å; I108-F231 HydrophobicContact CG1-CE2 4.3Å; I108-F231 HydrophobicContact CG1-CZ 3.39Å |
| 109 | S | 95.2 | Very high | 93.4 | Very high | 23 Ų | 23 | 18 Ų | 18 | 16% | 0.161 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -63.8 | -37.1 | -178.7 | -58.2 | 0 | 0 | 0 | 0 | 111.5 | V105 G106 S107 L112 A113 | V105-S109 WeakPolarHBondContact O-CB 3.45Å; V105-S109 PolarHBondContact O-N 3.02Å; V105-S109 PolarHBondContact O-OG 3.18Å; G106-S109 PolarHBondContact O-N 3.23Å; S107-S109 PolarHBondContact O-N 3.38Å; S109-L112 PolarHBondContact O-N 2.95Å; S109-A113 WeakPolarHBondContact O-CB 3.41Å; S109-A113 PolarHBondContact O-N 3.24Å |
| 110 | S | 94.9 | Very high | 93.1 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -67.6 | -42.9 | 174.8 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | G106 S107 I108 L112 A113 I114 | G106-S110 VanDerWaalsContact O-CB 3.28Å; G106-S110 WeakPolarHBondContact O-CB 3.36Å; G106-S110 PolarHBondContact O-N 3.21Å; G106-S110 PolarHBondContact O-OG 3.34Å; S107-S110 PolarHBondContact O-N 3.01Å; I108-S110 VanDerWaalsContact C-N 3.28Å; I108-S110 PolarHBondContact O-N 3.23Å; S110-L112 VanDerWaalsContact C-N 3.33Å; S110-L112 PolarHBondContact O-N 3.4Å; S110-A113 PolarHBondContact O-N 3.06Å; S110-I114 WeakPolarHBondContact O-CB 3.49Å; S110-I114 WeakPolarHBondContact O-CD1 3.19Å; S110-I114 WeakPolarHBondContact O-CG1 3.46Å; S110-I114 PolarHBondContact O-N 3.16Å |
| 111 | F | 92.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -60.3 | -42.9 | 173.4 | -83.9 | -59.7 | 0 | 0 | 0 | 112.3 | L56 S107 I108 I114 A115 I179 L227 F231 H271 | L56-F111 HydrophobicContact CD1-CE2 4.18Å; L56-F111 HydrophobicContact CD2-CD1 4.47Å; L56-F111 HydrophobicContact CD2-CE1 3.94Å; L56-F111 HydrophobicContact CD2-CE2 4.15Å; L56-F111 HydrophobicContact CD2-CZ 3.76Å; S107-F111 WeakPolarHBondContact O-CD2 3.39Å; S107-F111 PolarHBondContact O-N 3.38Å; I108-F111 PolarHBondContact O-N 3.43Å; F111-I114 PolarHBondContact O-N 3.38Å; F111-A115 WeakPolarHBondContact O-CB 3.43Å; F111-A115 PolarHBondContact O-N 2.91Å; F111-I179 HydrophobicContact CB-CD1 4.13Å; F111-L227 HydrophobicContact CE1-CB 3.73Å; F111-L227 HydrophobicContact CZ-CB 4.23Å; F111-F231 HydrophobicContact CD2-CB 4.49Å; F111-F231 HydrophobicContact CD2-CD2 4.15Å; F111-F231 HydrophobicContact CD2-CG 4.19Å; F111-F231 HydrophobicContact CE2-CB 3.79Å; F111-F231 AromaticContact CE2-CD2 3.66Å; F111-F231 HydrophobicContact CE2-CD2 3.66Å; F111-F231 HydrophobicContact CE2-CE2 4.45Å; F111-F231 AromaticContact CE2-CG 3.8Å; F111-F231 HydrophobicContact CE2-CG 3.8Å; F111-F231 HydrophobicContact CZ-CB 4.16Å; F111-H271 AromaticContact CE2-NE2 3.92Å |
| 112 | L | 93.1 | Very high | 92.3 | Very high | 66 Ų | 66 | 17.1 Ų | 17.1 | 35% | 0.346 | 9% | 0.092 | S | C | . | . | H | α-helix | trans | -62.6 | -45.6 | 175.7 | -178.6 | 61.7 | 0 | 0 | 0 | 111.3 | I108 S109 S110 I114 A115 V116 I179 L182 | I108-L112 PolarHBondContact O-N 3.48Å; S109-L112 PolarHBondContact O-N 2.95Å; S110-L112 VanDerWaalsContact C-N 3.33Å; S110-L112 PolarHBondContact O-N 3.4Å; L112-I114 VanDerWaalsContact C-N 3.33Å; L112-I114 PolarHBondContact O-N 3.05Å; L112-A115 PolarHBondContact O-N 2.79Å; L112-V116 HydrophobicContact CD1-CG2 4.49Å; L112-V116 WeakPolarHBondContact O-CG2 3Å; L112-V116 PolarHBondContact O-N 3.42Å; L112-I179 HydrophobicContact CB-CD1 4.47Å; L112-I179 HydrophobicContact CB-CG1 4.3Å; L112-I179 HydrophobicContact CD1-CG1 4.18Å; L112-L182 HydrophobicContact CD1-CD1 3.55Å |
| 113 | A | 94.1 | Very high | 91.7 | Very high | 13 Ų | 13 | 17.7 Ų | 17.7 | 11% | 0.107 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -61.1 | -41.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | F52 S109 S110 V116 D117 I144 | F52-A113 HydrophobicContact CD1-CB 3.67Å; F52-A113 HydrophobicContact CD2-CB 4.46Å; F52-A113 HydrophobicContact CE1-CB 3.76Å; F52-A113 HydrophobicContact CG-CB 4.06Å; F52-A113 HydrophobicContact CZ-CB 4.18Å; S109-A113 WeakPolarHBondContact O-CB 3.41Å; S109-A113 PolarHBondContact O-N 3.24Å; S110-A113 PolarHBondContact O-N 3.06Å; A113-V116 PolarHBondContact O-N 2.96Å; A113-D117 WeakPolarHBondContact O-CB 3.49Å; A113-D117 PolarHBondContact O-N 3.3Å; A113-I144 HydrophobicContact CB-CD1 3.98Å |
| 114 | I | 92.6 | Very high | 91.2 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.4 | -42.3 | 174.9 | -68 | 164.1 | 0 | 0 | 0 | 111 | F52 M53 L56 S110 F111 L112 D117 R118 L224 | F52-I114 HydrophobicContact CB-CD1 4.29Å; F52-I114 HydrophobicContact CB-CG1 3.56Å; M53-I114 HydrophobicContact CG-CD1 4.14Å; L56-I114 HydrophobicContact CD2-CD1 4.36Å; S110-I114 WeakPolarHBondContact O-CB 3.49Å; S110-I114 WeakPolarHBondContact O-CD1 3.19Å; S110-I114 WeakPolarHBondContact O-CG1 3.46Å; S110-I114 PolarHBondContact O-N 3.16Å; F111-I114 PolarHBondContact O-N 3.38Å; L112-I114 VanDerWaalsContact C-N 3.33Å; L112-I114 PolarHBondContact O-N 3.05Å; I114-D117 PolarHBondContact O-N 3.26Å; I114-R118 WeakPolarHBondContact O-CG 3.45Å; I114-R118 PolarHBondContact O-N 3.27Å; I114-L224 HydrophobicContact CG2-CD1 3.54Å; I114-L224 HydrophobicContact CG2-CD2 3.43Å; I114-L224 VanDerWaalsContact CG2-CD2 3.43Å; I114-L224 HydrophobicContact CG2-CG 4.07Å |
| 115 | A | 90.1 | Very high | 90.7 | Very high | 3 Ų | 3 | 23 Ų | 23 | 3% | 0.025 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -63.1 | -43.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | F111 L112 R118 Y119 L182 Y183 | F111-A115 WeakPolarHBondContact O-CB 3.43Å; F111-A115 PolarHBondContact O-N 2.91Å; L112-A115 PolarHBondContact O-N 2.79Å; A115-R118 PolarHBondContact O-N 2.71Å; A115-Y119 WeakPolarHBondContact O-CB 3.27Å; A115-Y119 PolarHBondContact O-N 2.76Å; A115-L182 HydrophobicContact CB-CD1 4.43Å; A115-Y183 HydrophobicContact CB-CE1 4.11Å |
| 116 | V | 91.3 | Very high | 90.2 | Very high | 57 Ų | 57 | 30.6 Ų | 30.6 | 35% | 0.345 | 16% | 0.164 | S | C | . | . | H | α-helix | trans | -64.9 | -44.8 | 175.6 | 172.1 | 0 | 0 | 0 | 0 | 111.4 | L112 A113 R118 Y119 I120 L182 | L112-V116 HydrophobicContact CD1-CG2 4.49Å; L112-V116 WeakPolarHBondContact O-CG2 3Å; L112-V116 PolarHBondContact O-N 3.42Å; A113-V116 PolarHBondContact O-N 2.96Å; V116-R118 VanDerWaalsContact C-N 3.31Å; V116-R118 PolarHBondContact O-N 3.47Å; V116-Y119 WeakPolarHBondContact O-CB 3.39Å; V116-Y119 PolarHBondContact O-N 3.27Å; V116-I120 HydrophobicContact CG1-CD1 3.96Å; V116-I120 WeakPolarHBondContact O-CG1 3.01Å; V116-I120 PolarHBondContact O-N 3.49Å; V116-L182 HydrophobicContact CG2-CD1 4.46Å |
| 117 | D | 91.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.3 | -42.5 | 176.1 | 173.9 | 70.2 | 0 | 0 | 0 | 111.6 | M49 F52 A113 I114 I120 T121 Y128 | M49-D117 WeakPolarHBondContact CB-OD2 3.26Å; F52-D117 HydrophobicContact CD2-CB 4.24Å; F52-D117 HydrophobicContact CE2-CB 4.12Å; A113-D117 WeakPolarHBondContact O-CB 3.49Å; A113-D117 PolarHBondContact O-N 3.3Å; I114-D117 PolarHBondContact O-N 3.26Å; D117-I120 PolarHBondContact O-N 2.67Å; D117-T121 WeakPolarHBondContact O-CB 3.39Å; D117-T121 PolarHBondContact O-N 3.38Å; D117-T121 PolarHBondContact O-OG1 3.26Å; D117-Y128 VanDerWaalsContact OD1-CE2 3.28Å; D117-Y128 WeakPolarHBondContact OD1-CE2 3.39Å; D117-Y128 PolarHBondContact OD1-OH 2.94Å |
| 118 | R | 88.2 | Confident | 89.6 | Confident | 13 Ų | 13 | 40.7 Ų | 40.7 | 5% | 0.049 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.3 | -42.3 | 174.6 | -71.4 | -71.5 | 166.3 | -66.1 | -40.9 | 113.4 | M49 I114 A115 V116 I120 T121 I122 M186 L224 | M49-R118 PolarHBondContact SD-NH1 2.89Å; M49-R118 PolarHBondContact SD-NH2 3.26Å; I114-R118 WeakPolarHBondContact O-CG 3.45Å; I114-R118 PolarHBondContact O-N 3.27Å; A115-R118 PolarHBondContact O-N 2.71Å; V116-R118 VanDerWaalsContact C-N 3.31Å; V116-R118 PolarHBondContact O-N 3.47Å; R118-I120 VanDerWaalsContact C-N 3.28Å; R118-I120 PolarHBondContact O-N 3.46Å; R118-T121 PolarHBondContact O-N 2.98Å; R118-T121 VanDerWaalsContact O-N 3.16Å; R118-I122 WeakPolarHBondContact O-CB 3.42Å; R118-I122 VanDerWaalsContact O-CG1 3.3Å; R118-I122 WeakPolarHBondContact O-CG1 3.38Å; R118-I122 PolarHBondContact O-N 2.88Å; R118-M186 HydrophobicContact CB-SD 4.12Å; R118-L224 HydrophobicContact CB-CD1 4.39Å; R118-L224 HydrophobicContact CG-CD1 3.16Å; R118-L224 VanDerWaalsContact NE-CD1 3.26Å |
| 119 | Y | 87.7 | Confident | 89.3 | Confident | 66 Ų | 66 | 47.9 Ų | 47.9 | 26% | 0.259 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -54.3 | -50.5 | 175.9 | 173.8 | -94.8 | 0 | 0 | 0 | 109.9 | A115 V116 T121 I122 F123 Y185 | A115-Y119 WeakPolarHBondContact O-CB 3.27Å; A115-Y119 PolarHBondContact O-N 2.76Å; V116-Y119 WeakPolarHBondContact O-CB 3.39Å; V116-Y119 PolarHBondContact O-N 3.27Å; Y119-T121 PolarHBondContact O-N 3.13Å; Y119-I122 PolarHBondContact O-N 3.48Å; Y119-F123 AromaticContact CD2-CD2 3.26Å; Y119-F123 HydrophobicContact CD2-CD2 3.26Å; Y119-F123 AromaticContact CD2-CE2 3.51Å; Y119-F123 HydrophobicContact CD2-CE2 3.51Å; Y119-F123 HydrophobicContact CD2-CG 4.38Å; Y119-F123 HydrophobicContact CE2-CB 4.5Å; Y119-F123 AromaticContact CE2-CD2 3.23Å; Y119-F123 HydrophobicContact CE2-CD2 3.23Å; Y119-F123 AromaticContact CE2-CE2 3.62Å; Y119-F123 HydrophobicContact CE2-CE2 3.62Å; Y119-F123 AromaticContact CE2-CG 4Å; Y119-F123 HydrophobicContact CE2-CG 4Å; Y119-F123 AromaticContact CG-CD2 3.99Å; Y119-F123 HydrophobicContact CG-CD2 3.99Å; Y119-F123 HydrophobicContact CG-CE2 4.49Å; Y119-F123 AromaticContact CZ-CD2 3.99Å; Y119-F123 VanDerWaalsContact O-CD2 3.24Å; Y119-F123 WeakPolarHBondContact O-CD2 3.5Å; Y119-F123 PolarHBondContact O-N 3.36Å; Y119-Y185 HydrophobicContact CD2-CE1 4.48Å; Y119-Y185 HydrophobicContact CE2-CD1 4.11Å; Y119-Y185 AromaticContact CE2-CE1 3.65Å; Y119-Y185 HydrophobicContact CE2-CE1 3.65Å |
| 120 | I | 89.9 | Confident | 89.1 | Confident | 19 Ų | 19 | 52.7 Ų | 52.7 | 10% | 0.097 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.4 | -41.1 | 178 | -58.3 | 165.6 | 0 | 0 | 0 | 110.8 | V116 D117 R118 I122 H124 Y128 I131 M132 | V116-I120 HydrophobicContact CG1-CD1 3.96Å; V116-I120 WeakPolarHBondContact O-CG1 3.01Å; V116-I120 PolarHBondContact O-N 3.49Å; D117-I120 PolarHBondContact O-N 2.67Å; R118-I120 VanDerWaalsContact C-N 3.28Å; R118-I120 PolarHBondContact O-N 3.46Å; I120-I122 VanDerWaalsContact C-N 3.31Å; I120-I122 PolarHBondContact O-N 2.92Å; I120-H124 HydrophobicContact CG2-CB 4.07Å; I120-H124 CarbonylContact O-C 3.16Å; I120-H124 WeakPolarHBondContact O-CA 3.28Å; I120-H124 WeakPolarHBondContact O-CB 3.19Å; I120-H124 PolarHBondContact O-N 3.47Å; I120-Y128 HydrophobicContact CB-CD2 4.39Å; I120-Y128 HydrophobicContact CG2-CD2 3.91Å; I120-I131 HydrophobicContact CD1-CG2 4.25Å; I120-I131 HydrophobicContact CG2-CB 4.35Å; I120-I131 HydrophobicContact CG2-CD1 4.03Å; I120-I131 HydrophobicContact CG2-CG2 4.1Å; I120-M132 HydrophobicContact CD1-CE 3.59Å; I120-M132 HydrophobicContact CD1-CG 4.36Å |
| 121 | T | 87.1 | Confident | 88.9 | Confident | 29 Ų | 29 | 55.5 Ų | 55.5 | 18% | 0.178 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.4 | -37.7 | 178.6 | -58.1 | 0 | 0 | 0 | 0 | 112.6 | D117 R118 Y119 A125 Y128 | D117-T121 WeakPolarHBondContact O-CB 3.39Å; D117-T121 PolarHBondContact O-N 3.38Å; D117-T121 PolarHBondContact O-OG1 3.26Å; R118-T121 PolarHBondContact O-N 2.98Å; R118-T121 VanDerWaalsContact O-N 3.16Å; Y119-T121 PolarHBondContact O-N 3.13Å; T121-A125 WeakPolarHBondContact O-CA 3.26Å; T121-A125 WeakPolarHBondContact O-CB 3.43Å; T121-Y128 WeakPolarHBondContact OG1-CE2 3.38Å |
| 122 | I | 83.9 | Confident | 88.9 | Confident | 30 Ų | 30 | 56.5 Ų | 56.5 | 15% | 0.154 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -82.7 | -50.1 | -176.5 | -68 | 166.5 | 0 | 0 | 0 | 110.9 | R118 Y119 I120 M186 N217 A221 | R118-I122 WeakPolarHBondContact O-CB 3.42Å; R118-I122 VanDerWaalsContact O-CG1 3.3Å; R118-I122 WeakPolarHBondContact O-CG1 3.38Å; R118-I122 PolarHBondContact O-N 2.88Å; Y119-I122 PolarHBondContact O-N 3.48Å; I120-I122 VanDerWaalsContact C-N 3.31Å; I120-I122 PolarHBondContact O-N 2.92Å; I122-M186 HydrophobicContact CD1-CG 3.87Å; I122-M186 HydrophobicContact CD1-SD 3.61Å; I122-N217 HydrophobicContact CG1-CB 4.3Å; I122-A221 HydrophobicContact CD1-CB 4.17Å |
| 123 | F | 84.7 | Confident | 88.9 | Confident | 42 Ų | 42 | 55.6 Ų | 55.6 | 18% | 0.184 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -91.1 | -24.8 | -172.1 | -62.6 | -71.3 | 0 | 0 | 0 | 113.7 | Y119 M186 M189 H193 | Y119-F123 AromaticContact CD2-CD2 3.26Å; Y119-F123 HydrophobicContact CD2-CD2 3.26Å; Y119-F123 AromaticContact CD2-CE2 3.51Å; Y119-F123 HydrophobicContact CD2-CE2 3.51Å; Y119-F123 HydrophobicContact CD2-CG 4.38Å; Y119-F123 HydrophobicContact CE2-CB 4.5Å; Y119-F123 AromaticContact CE2-CD2 3.23Å; Y119-F123 HydrophobicContact CE2-CD2 3.23Å; Y119-F123 AromaticContact CE2-CE2 3.62Å; Y119-F123 HydrophobicContact CE2-CE2 3.62Å; Y119-F123 AromaticContact CE2-CG 4Å; Y119-F123 HydrophobicContact CE2-CG 4Å; Y119-F123 AromaticContact CG-CD2 3.99Å; Y119-F123 HydrophobicContact CG-CD2 3.99Å; Y119-F123 HydrophobicContact CG-CE2 4.49Å; Y119-F123 AromaticContact CZ-CD2 3.99Å; Y119-F123 VanDerWaalsContact O-CD2 3.24Å; Y119-F123 WeakPolarHBondContact O-CD2 3.5Å; Y119-F123 PolarHBondContact O-N 3.36Å; F123-M186 HydrophobicContact CE2-CB 4.35Å; F123-M186 HydrophobicContact CE2-CG 4.09Å; F123-M189 HydrophobicContact CE1-CB 3.41Å; F123-M189 VanDerWaalsContact CE1-CB 3.41Å; F123-M189 HydrophobicContact CE1-CG 4.47Å; F123-M189 HydrophobicContact CZ-CB 3.39Å; F123-M189 HydrophobicContact CZ-CG 4.43Å; F123-H193 AromaticContact CD1-NE2 3.71Å; F123-H193 AromaticContact CE1-CD2 3.66Å; F123-H193 AromaticContact CE1-NE2 3.73Å |
| 124 | H | 85.1 | Confident | 88.8 | Confident | 82 Ų | 82 | 59 Ų | 59 | 38% | 0.38 | 29% | 0.29 | S | S | . | . | S | Bend | trans | -121 | 36.8 | -180 | -60.7 | -57.4 | 0 | 0 | 0 | 112 | I120 L126 R127 Y128 I131 | I120-H124 HydrophobicContact CG2-CB 4.07Å; I120-H124 CarbonylContact O-C 3.16Å; I120-H124 WeakPolarHBondContact O-CA 3.28Å; I120-H124 WeakPolarHBondContact O-CB 3.19Å; I120-H124 PolarHBondContact O-N 3.47Å; H124-L126 PolarHBondContact O-N 3.06Å; H124-R127 CarbonylContact O-C 3.53Å; H124-R127 PolarHBondContact O-N 3.28Å; H124-Y128 PolarHBondContact O-N 3.26Å; H124-I131 HydrophobicContact CB-CD1 4.19Å |
| 125 | A | 83.8 | Confident | 88.9 | Confident | 33 Ų | 33 | 67 Ų | 67 | 27% | 0.273 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.4 | -36.8 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | T121 | T121-A125 WeakPolarHBondContact O-CA 3.26Å; T121-A125 WeakPolarHBondContact O-CB 3.43Å |
| 126 | L | 84.1 | Confident | 89.2 | Confident | 163 Ų | 163 | 73.5 Ų | 73.5 | 85% | 0.853 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.8 | -26.2 | 179.8 | -65.5 | 176.1 | 0 | 0 | 0 | 113.5 | H124 | H124-L126 PolarHBondContact O-N 3.06Š|
| 127 | R | 88.2 | Confident | 89.4 | Confident | 178 Ų | 178 | 70.9 Ų | 70.9 | 67% | 0.672 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.6 | -6.6 | 179.4 | -65.7 | -175.8 | 178.1 | -177.3 | -0.4 | 112.6 | H124 H129 N130 I131 | H124-R127 CarbonylContact O-C 3.53Å; H124-R127 PolarHBondContact O-N 3.28Å; R127-H129 VanDerWaalsContact C-N 3.3Å; R127-H129 PolarHBondContact O-N 3.16Å; R127-N130 PolarHBondContact O-N 2.85Å; R127-I131 HydrophobicContact CB-CD1 3.7Å; R127-I131 HydrophobicContact CB-CG1 4.21Å; R127-I131 WeakPolarHBondContact O-CG1 3.42Å; R127-I131 PolarHBondContact O-N 3.29Å |
| 128 | Y | 89.6 | Confident | 89.5 | Confident | 35 Ų | 35 | 73.8 Ų | 73.8 | 14% | 0.137 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -49 | -50.3 | -176.2 | 176.6 | -99.4 | 0 | 0 | 0 | 112.3 | D117 I120 T121 H124 N130 I131 M132 | D117-Y128 VanDerWaalsContact OD1-CE2 3.28Å; D117-Y128 WeakPolarHBondContact OD1-CE2 3.39Å; D117-Y128 PolarHBondContact OD1-OH 2.94Å; I120-Y128 HydrophobicContact CB-CD2 4.39Å; I120-Y128 HydrophobicContact CG2-CD2 3.91Å; T121-Y128 WeakPolarHBondContact OG1-CE2 3.38Å; H124-Y128 PolarHBondContact O-N 3.26Å; Y128-N130 PolarHBondContact O-N 2.88Å; Y128-I131 PolarHBondContact O-N 3.09Å; Y128-M132 HydrophobicContact CD2-CB 4.29Å; Y128-M132 HydrophobicContact CD2-CG 4.44Å; Y128-M132 HydrophobicContact CE2-CB 3.81Å; Y128-M132 HydrophobicContact CE2-CG 3.93Å; Y128-M132 PolarHBondContact O-N 3.45Å |
| 129 | H | 87.1 | Confident | 90 | Very high | 154 Ų | 154 | 76.4 Ų | 76.4 | 71% | 0.713 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -64.9 | -24.9 | -177.5 | -163.2 | 67.2 | 0 | 0 | 0 | 113.7 | R127 | R127-H129 VanDerWaalsContact C-N 3.3Å; R127-H129 PolarHBondContact O-N 3.16Å |
| 130 | N | 90.6 | Very high | 90.4 | Very high | 123 Ų | 123 | 76 Ų | 76 | 66% | 0.658 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -87.8 | -24.9 | 175.5 | -66.2 | 1.4 | 0 | 0 | 0 | 112.2 | R127 Y128 R136 | R127-N130 PolarHBondContact O-N 2.85Å; Y128-N130 PolarHBondContact O-N 2.88Å; N130-R136 PolarHBondContact O-NH1 2.98Å |
| 131 | I | 91.8 | Very high | 90.8 | Very high | 60 Ų | 60 | 76.6 Ų | 76.6 | 31% | 0.308 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -84.4 | -55 | -180 | -65 | 166.6 | 0 | 0 | 0 | 110.2 | I120 H124 R127 Y128 R136 | I120-I131 HydrophobicContact CD1-CG2 4.25Å; I120-I131 HydrophobicContact CG2-CB 4.35Å; I120-I131 HydrophobicContact CG2-CD1 4.03Å; I120-I131 HydrophobicContact CG2-CG2 4.1Å; H124-I131 HydrophobicContact CB-CD1 4.19Å; R127-I131 HydrophobicContact CB-CD1 3.7Å; R127-I131 HydrophobicContact CB-CG1 4.21Å; R127-I131 WeakPolarHBondContact O-CG1 3.42Å; R127-I131 PolarHBondContact O-N 3.29Å; Y128-I131 PolarHBondContact O-N 3.09Å; I131-R136 VanDerWaalsContact O-CD 3.32Å; I131-R136 WeakPolarHBondContact O-CD 3.46Å; I131-R136 PolarHBondContact O-NH1 2.93Å |
| 132 | M | 92.2 | Very high | 91.3 | Very high | 20 Ų | 20 | 76.9 Ų | 76.9 | 10% | 0.099 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -100.2 | 96.5 | -176.3 | -79.3 | -62.5 | -178.3 | 0 | 0 | 110.6 | P48 I120 Y128 I140 | P48-M132 HydrophobicContact CG-CB 4.24Å; I120-M132 HydrophobicContact CD1-CE 3.59Å; I120-M132 HydrophobicContact CD1-CG 4.36Å; Y128-M132 HydrophobicContact CD2-CB 4.29Å; Y128-M132 HydrophobicContact CD2-CG 4.44Å; Y128-M132 HydrophobicContact CE2-CB 3.81Å; Y128-M132 HydrophobicContact CE2-CG 3.93Å; Y128-M132 PolarHBondContact O-N 3.45Å; M132-I140 HydrophobicContact CE-CD1 4.26Å; M132-I140 HydrophobicContact SD-CD1 4.37Å |
| 133 | T | 94 | Very high | 91.9 | Very high | 48 Ų | 48 | 81 Ų | 81 | 29% | 0.294 | 42% | 0.42 | S | S | . | . | trans | -104 | 154.6 | 173.4 | 68.5 | 0 | 0 | 0 | 0 | 110.3 | Q135 R136 T137 | T133-Q135 PolarHBondContact O-N 2.94Å; T133-R136 PolarHBondContact O-N 3.1Å; T133-R136 WeakPolarHBondContact OG1-CG 3.42Å; T133-R136 PolarHBondContact OG1-N 3.31Å; T133-T137 PolarHBondContact O-N 2.9Å; T133-T137 PolarHBondContact O-OG1 2.92Å; T133-T137 VanDerWaalsContact O-OG1 3.09Å | ||
| 134 | M | 91.6 | Very high | 92.5 | Very high | 85 Ų | 85 | 79.8 Ų | 79.8 | 42% | 0.419 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -59 | -33.7 | -179.6 | -67 | -62.6 | -69.6 | 0 | 0 | 113.3 | P48 C51 T137 A138 | P48-M134 HydrophobicContact CG-SD 4.28Å; C51-M134 VanDerWaalsContact SG-CE 3.59Å; M134-T137 PolarHBondContact O-N 3.44Å; M134-A138 WeakPolarHBondContact O-CB 3.42Å; M134-A138 PolarHBondContact O-N 2.81Å |
| 135 | Q | 94.4 | Very high | 93.2 | Very high | 168 Ų | 168 | 79.7 Ų | 79.7 | 79% | 0.785 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -64.6 | -43.9 | 175.1 | -70.2 | 178.1 | -18.7 | 0 | 0 | 111.7 | T133 A138 A139 | T133-Q135 PolarHBondContact O-N 2.94Å; Q135-A138 PolarHBondContact O-N 3.07Å; Q135-A139 PolarHBondContact O-N 2.92Å |
| 136 | R | 95.7 | Very high | 93.8 | Very high | 138 Ų | 138 | 82.1 Ų | 82.1 | 52% | 0.521 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 175.7 | -70.8 | 177.3 | 176.3 | 176.4 | 0.4 | 111.1 | N130 I131 T133 A138 A139 I140 | N130-R136 PolarHBondContact O-NH1 2.98Å; I131-R136 VanDerWaalsContact O-CD 3.32Å; I131-R136 WeakPolarHBondContact O-CD 3.46Å; I131-R136 PolarHBondContact O-NH1 2.93Å; T133-R136 PolarHBondContact O-N 3.1Å; T133-R136 WeakPolarHBondContact OG1-CG 3.42Å; T133-R136 PolarHBondContact OG1-N 3.31Å; R136-A138 VanDerWaalsContact C-N 3.35Å; R136-A138 PolarHBondContact O-N 3.29Å; R136-A139 PolarHBondContact O-N 3.29Å; R136-I140 VanDerWaalsContact O-CG1 3.25Å; R136-I140 WeakPolarHBondContact O-CG1 3.26Å; R136-I140 PolarHBondContact O-N 3.06Å |
| 137 | T | 95.4 | Very high | 94.4 | Very high | 2 Ų | 2 | 77 Ų | 77 | 1% | 0.012 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -58.8 | -46.2 | 174.1 | -55 | 0 | 0 | 0 | 0 | 111.4 | P48 C51 F52 T133 M134 A139 I140 L141 | P48-T137 HydrophobicContact CB-CG2 4.18Å; P48-T137 WeakPolarHBondContact CB-OG1 3.48Å; C51-T137 HydrophobicContact CB-CG2 3.83Å; F52-T137 HydrophobicContact CE1-CG2 4.18Å; F52-T137 HydrophobicContact CE2-CG2 4.24Å; F52-T137 HydrophobicContact CZ-CG2 3.93Å; T133-T137 PolarHBondContact O-N 2.9Å; T133-T137 PolarHBondContact O-OG1 2.92Å; T133-T137 VanDerWaalsContact O-OG1 3.09Å; M134-T137 PolarHBondContact O-N 3.44Å; T137-A139 VanDerWaalsContact C-N 3.33Å; T137-A139 PolarHBondContact O-N 3.18Å; T137-I140 PolarHBondContact O-N 3.42Å; T137-L141 HydrophobicContact CG2-CD1 4.25Å; T137-L141 WeakPolarHBondContact O-CB 3.46Å; T137-L141 WeakPolarHBondContact O-CG 3.46Å; T137-L141 PolarHBondContact O-N 3.32Å |
| 138 | A | 95.4 | Very high | 94.8 | Very high | 62 Ų | 62 | 68.5 Ų | 68.5 | 51% | 0.512 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -61.2 | -41.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | M134 Q135 R136 L141 G142 | M134-A138 WeakPolarHBondContact O-CB 3.42Å; M134-A138 PolarHBondContact O-N 2.81Å; Q135-A138 PolarHBondContact O-N 3.07Å; R136-A138 VanDerWaalsContact C-N 3.35Å; R136-A138 PolarHBondContact O-N 3.29Å; A138-L141 PolarHBondContact O-N 3.49Å; A138-G142 PolarHBondContact O-N 3.39Å |
| 139 | A | 97.3 | Very high | 95.1 | Very high | 67 Ų | 67 | 68.3 Ų | 68.3 | 55% | 0.554 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -63.7 | -43.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q135 R136 T137 L141 G142 L143 | Q135-A139 PolarHBondContact O-N 2.92Å; R136-A139 PolarHBondContact O-N 3.29Å; T137-A139 VanDerWaalsContact C-N 3.33Å; T137-A139 PolarHBondContact O-N 3.18Å; A139-L141 VanDerWaalsContact C-N 3.35Å; A139-L141 PolarHBondContact O-N 3.29Å; A139-G142 PolarHBondContact O-N 3.43Å; A139-L143 PolarHBondContact O-N 2.87Å |
| 140 | I | 97.2 | Very high | 95.5 | Very high | 58 Ų | 58 | 65.3 Ų | 65.3 | 30% | 0.297 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 175.6 | -66.8 | 163.5 | 0 | 0 | 0 | 110.4 | F52 M132 R136 T137 L143 I144 | F52-I140 HydrophobicContact CE1-CB 4.32Å; F52-I140 HydrophobicContact CE1-CG2 3.75Å; F52-I140 HydrophobicContact CZ-CB 4.47Å; F52-I140 HydrophobicContact CZ-CD1 4.41Å; F52-I140 HydrophobicContact CZ-CG2 4.07Å; M132-I140 HydrophobicContact CE-CD1 4.26Å; M132-I140 HydrophobicContact SD-CD1 4.37Å; R136-I140 VanDerWaalsContact O-CG1 3.25Å; R136-I140 WeakPolarHBondContact O-CG1 3.26Å; R136-I140 PolarHBondContact O-N 3.06Å; T137-I140 PolarHBondContact O-N 3.42Å; I140-L143 PolarHBondContact O-N 2.96Å; I140-I144 HydrophobicContact CG2-CD1 3.84Å; I140-I144 HydrophobicContact CG2-CG1 4.44Å; I140-I144 VanDerWaalsContact O-CG1 3.31Å; I140-I144 WeakPolarHBondContact O-CG1 3.09Å; I140-I144 PolarHBondContact O-N 3.27Å |
| 141 | L | 97.4 | Very high | 95.7 | Very high | 31 Ų | 31 | 61.9 Ų | 61.9 | 16% | 0.162 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62 | -47.2 | 176.2 | -72.9 | 175.2 | 0 | 0 | 0 | 111.6 | C51 F52 S55 T137 A138 A139 L143 I144 W145 | C51-L141 HydrophobicContact CB-CD1 4Å; F52-L141 HydrophobicContact CD1-CD2 3.65Å; F52-L141 HydrophobicContact CD1-CG 4.26Å; F52-L141 HydrophobicContact CE1-CD2 4.01Å; F52-L141 HydrophobicContact CE1-CG 4.2Å; S55-L141 VanDerWaalsContact CB-CD2 3.48Å; T137-L141 HydrophobicContact CG2-CD1 4.25Å; T137-L141 WeakPolarHBondContact O-CB 3.46Å; T137-L141 WeakPolarHBondContact O-CG 3.46Å; T137-L141 PolarHBondContact O-N 3.32Å; A138-L141 PolarHBondContact O-N 3.49Å; A139-L141 VanDerWaalsContact C-N 3.35Å; A139-L141 PolarHBondContact O-N 3.29Å; L141-L143 VanDerWaalsContact C-N 3.27Å; L141-L143 PolarHBondContact O-N 3.49Å; L141-I144 PolarHBondContact O-N 3.38Å; L141-I144 VanDerWaalsContact O-N 3.15Å; L141-W145 PolarHBondContact O-N 3.44Å |
| 142 | G | 97.6 | Very high | 95.9 | Very high | 36 Ų | 36 | 59 Ų | 59 | 37% | 0.371 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -57.1 | -41.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A138 A139 T146 | A138-G142 PolarHBondContact O-N 3.39Å; A139-G142 PolarHBondContact O-N 3.43Å; G142-T146 WeakPolarHBondContact O-CB 3.2Å; G142-T146 VanDerWaalsContact O-CG2 3.27Å; G142-T146 WeakPolarHBondContact O-CG2 3.13Å; G142-T146 PolarHBondContact O-N 2.84Å; G142-T146 PolarHBondContact O-OG1 2.81Å |
| 143 | L | 97.5 | Very high | 95.9 | Very high | 117 Ų | 117 | 61.9 Ų | 61.9 | 61% | 0.613 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -63.8 | -46.7 | 175 | -179 | 63.2 | 0 | 0 | 0 | 111.8 | A139 I140 L141 T146 S147 | A139-L143 PolarHBondContact O-N 2.87Å; I140-L143 PolarHBondContact O-N 2.96Å; L141-L143 VanDerWaalsContact C-N 3.27Å; L141-L143 PolarHBondContact O-N 3.49Å; L143-T146 PolarHBondContact O-N 3.24Å; L143-T146 PolarHBondContact O-OG1 3.44Å; L143-T146 VanDerWaalsContact O-OG1 3.06Å; L143-S147 VanDerWaalsContact O-CB 3.31Å; L143-S147 WeakPolarHBondContact O-CB 3.02Å; L143-S147 PolarHBondContact O-N 2.86Å; L143-S147 PolarHBondContact O-OG 3.49Å |
| 144 | I | 97.4 | Very high | 95.8 | Very high | 15 Ų | 15 | 63.5 Ų | 63.5 | 8% | 0.077 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -58.5 | -51.7 | 178.5 | -72 | 167.9 | 0 | 0 | 0 | 110.3 | F59 A113 I140 L141 T146 S147 C148 | F59-I144 HydrophobicContact CE2-CG2 4.13Å; F59-I144 HydrophobicContact CZ-CG2 4.32Å; A113-I144 HydrophobicContact CB-CD1 3.98Å; I140-I144 HydrophobicContact CG2-CD1 3.84Å; I140-I144 HydrophobicContact CG2-CG1 4.44Å; I140-I144 VanDerWaalsContact O-CG1 3.31Å; I140-I144 WeakPolarHBondContact O-CG1 3.09Å; I140-I144 PolarHBondContact O-N 3.27Å; L141-I144 PolarHBondContact O-N 3.38Å; L141-I144 VanDerWaalsContact O-N 3.15Å; I144-T146 PolarHBondContact O-N 2.87Å; I144-S147 PolarHBondContact O-N 3.23Å; I144-S147 PolarHBondContact O-OG 3.4Å; I144-S147 VanDerWaalsContact O-OG 3.06Å; I144-C148 VanDerWaalsContact O-CB 3.29Å; I144-C148 WeakPolarHBondContact O-CB 3.4Å; I144-C148 PolarHBondContact O-N 2.97Å; I144-C148 PolarHBondContact O-SG 2.99Å |
| 145 | W | 98.1 | Very high | 95.8 | Very high | 80 Ų | 80 | 60.6 Ų | 60.6 | 30% | 0.303 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | -176.9 | -82.4 | 73.7 | 0 | 0 | 0 | 112.4 | S55 A58 F59 I62 L141 C148 A149 | S55-W145 PolarHBondContact OG-NE1 2.86Å; A58-W145 HydrophobicContact CB-CH2 3.87Å; A58-W145 HydrophobicContact CB-CZ2 3.67Å; F59-W145 HydrophobicContact CD1-CH2 4.21Å; F59-W145 HydrophobicContact CD1-CZ2 4.34Å; F59-W145 HydrophobicContact CD1-CZ3 4.44Å; F59-W145 HydrophobicContact CD2-CZ2 4.37Å; F59-W145 AromaticContact CE1-CD2 3.97Å; F59-W145 HydrophobicContact CE1-CD2 3.97Å; F59-W145 AromaticContact CE1-CE3 3.93Å; F59-W145 HydrophobicContact CE1-CE3 3.93Å; F59-W145 HydrophobicContact CE1-CH2 4.08Å; F59-W145 HydrophobicContact CE1-CZ2 4.1Å; F59-W145 AromaticContact CE1-CZ3 4Å; F59-W145 HydrophobicContact CE1-CZ3 4Å; F59-W145 HydrophobicContact CE2-CD2 4.37Å; F59-W145 AromaticContact CE2-CE2 3.86Å; F59-W145 HydrophobicContact CE2-CZ2 4.14Å; F59-W145 AromaticContact CE2-NE1 3.77Å; F59-W145 HydrophobicContact CG-CZ2 4.47Å; F59-W145 AromaticContact CZ-CD1 3.95Å; F59-W145 AromaticContact CZ-CD2 3.64Å; F59-W145 HydrophobicContact CZ-CD2 3.64Å; F59-W145 AromaticContact CZ-CE2 3.57Å; F59-W145 HydrophobicContact CZ-CE3 4.1Å; F59-W145 AromaticContact CZ-CG 3.91Å; F59-W145 HydrophobicContact CZ-CG 3.91Å; F59-W145 HydrophobicContact CZ-CH2 4.43Å; F59-W145 AromaticContact CZ-CZ2 4Å; F59-W145 HydrophobicContact CZ-CZ2 4Å; F59-W145 HydrophobicContact CZ-CZ3 4.47Å; F59-W145 AromaticContact CZ-NE1 3.76Å; I62-W145 HydrophobicContact CD1-CH2 3.69Å; I62-W145 HydrophobicContact CD1-CZ3 3.67Å; L141-W145 PolarHBondContact O-N 3.44Å; W145-C148 PolarHBondContact O-N 3.29Å; W145-A149 WeakPolarHBondContact O-CB 3.46Å; W145-A149 PolarHBondContact O-N 3.45Å |
| 146 | T | 97.4 | Very high | 95.7 | Very high | 84 Ų | 84 | 53.7 Ų | 53.7 | 52% | 0.515 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -67.4 | -43.5 | 178.9 | 53.5 | 0 | 0 | 0 | 0 | 111.9 | G142 L143 I144 C148 A149 V150 | G142-T146 WeakPolarHBondContact O-CB 3.2Å; G142-T146 VanDerWaalsContact O-CG2 3.27Å; G142-T146 WeakPolarHBondContact O-CG2 3.13Å; G142-T146 PolarHBondContact O-N 2.84Å; G142-T146 PolarHBondContact O-OG1 2.81Å; L143-T146 PolarHBondContact O-N 3.24Å; L143-T146 PolarHBondContact O-OG1 3.44Å; L143-T146 VanDerWaalsContact O-OG1 3.06Å; I144-T146 PolarHBondContact O-N 2.87Å; T146-C148 PolarHBondContact O-N 3.42Å; T146-A149 WeakPolarHBondContact O-CB 3.5Å; T146-A149 PolarHBondContact O-N 3.34Å; T146-V150 WeakPolarHBondContact O-CG2 3.32Å; T146-V150 PolarHBondContact O-N 2.84Å; T146-V150 VanDerWaalsContact O-N 3.12Å |
| 147 | S | 96.1 | Very high | 95.4 | Very high | 56 Ų | 56 | 54 Ų | 54 | 39% | 0.392 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.9 | -38.4 | 177.6 | 67.8 | 0 | 0 | 0 | 0 | 112.2 | L143 I144 L151 | L143-S147 VanDerWaalsContact O-CB 3.31Å; L143-S147 WeakPolarHBondContact O-CB 3.02Å; L143-S147 PolarHBondContact O-N 2.86Å; L143-S147 PolarHBondContact O-OG 3.49Å; I144-S147 PolarHBondContact O-N 3.23Å; I144-S147 PolarHBondContact O-OG 3.4Å; I144-S147 VanDerWaalsContact O-OG 3.06Å; S147-L151 VanDerWaalsContact O-CB 3.3Å; S147-L151 WeakPolarHBondContact O-CB 3.45Å; S147-L151 PolarHBondContact O-N 2.88Å |
| 148 | C | 97.1 | Very high | 95.2 | Very high | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.5 | -40.7 | 177 | -65.6 | 0 | 0 | 0 | 0 | 111.5 | F59 M102 V105 G106 I144 W145 T146 A152 | F59-C148 HydrophobicContact CZ-CB 4.45Å; M102-C148 HydrophobicContact CG-CB 4.13Å; V105-C148 HydrophobicContact CB-CB 4.37Å; V105-C148 HydrophobicContact CG1-CB 4.17Å; V105-C148 VanDerWaalsContact CG1-SG 3.58Å; G106-C148 WeakPolarHBondContact CA-SG 3.5Å; G106-C148 PolarHBondContact N-SG 3.48Å; G106-C148 VanDerWaalsContact N-SG 3.44Å; I144-C148 VanDerWaalsContact O-CB 3.29Å; I144-C148 WeakPolarHBondContact O-CB 3.4Å; I144-C148 PolarHBondContact O-N 2.97Å; I144-C148 PolarHBondContact O-SG 2.99Å; W145-C148 PolarHBondContact O-N 3.29Å; T146-C148 PolarHBondContact O-N 3.42Å; C148-A152 WeakPolarHBondContact O-CB 3.48Å; C148-A152 PolarHBondContact O-N 2.95Å |
| 149 | A | 96.2 | Very high | 94.9 | Very high | 30 Ų | 30 | 59.1 Ų | 59.1 | 25% | 0.248 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -57.9 | -52.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | M102 W145 T146 A152 V153 | M102-A149 HydrophobicContact CE-CB 3.29Å; W145-A149 WeakPolarHBondContact O-CB 3.46Å; W145-A149 PolarHBondContact O-N 3.45Å; T146-A149 WeakPolarHBondContact O-CB 3.5Å; T146-A149 PolarHBondContact O-N 3.34Å; A149-A152 PolarHBondContact O-N 2.94Å; A149-V153 WeakPolarHBondContact O-CG2 3.34Å; A149-V153 PolarHBondContact O-N 3.46Å; A149-V153 VanDerWaalsContact O-N 3.13Å |
| 150 | V | 95.6 | Very high | 94.4 | Very high | 91 Ų | 91 | 63 Ų | 63 | 55% | 0.552 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -63.3 | -47.4 | -178.3 | 173 | 0 | 0 | 0 | 0 | 110.5 | T146 A152 L154 | T146-V150 WeakPolarHBondContact O-CG2 3.32Å; T146-V150 PolarHBondContact O-N 2.84Å; T146-V150 VanDerWaalsContact O-N 3.12Å; V150-A152 VanDerWaalsContact C-N 3.34Å; V150-A152 PolarHBondContact O-N 3.31Å; V150-L154 HydrophobicContact CG1-CD1 3.87Å; V150-L154 HydrophobicContact CG1-CG 4.48Å; V150-L154 WeakPolarHBondContact O-CB 3.47Å; V150-L154 VanDerWaalsContact O-CG 3.24Å; V150-L154 WeakPolarHBondContact O-CG 3.3Å; V150-L154 PolarHBondContact O-N 2.7Å; V150-L154 VanDerWaalsContact O-N 3.11Å |
| 151 | L | 94.1 | Very high | 94 | Very high | 51 Ų | 51 | 66.3 Ų | 66.3 | 27% | 0.267 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.3 | -42.6 | -179.6 | -174 | 58.2 | 0 | 0 | 0 | 111.5 | V105 S147 L154 M155 F171 | V105-L151 HydrophobicContact CG1-CD2 3.84Å; V105-L151 HydrophobicContact CG2-CD2 4.19Å; S147-L151 VanDerWaalsContact O-CB 3.3Å; S147-L151 WeakPolarHBondContact O-CB 3.45Å; S147-L151 PolarHBondContact O-N 2.88Å; L151-L154 PolarHBondContact O-N 3.16Å; L151-M155 HydrophobicContact CD1-CE 3.73Å; L151-M155 HydrophobicContact CD1-CG 4.13Å; L151-M155 HydrophobicContact CG-CG 4.24Å; L151-M155 WeakPolarHBondContact O-CB 3.13Å; L151-M155 WeakPolarHBondContact O-CG 3.15Å; L151-M155 PolarHBondContact O-N 3.33Å; L151-F171 HydrophobicContact CD2-CE2 4.35Å; L151-F171 HydrophobicContact CD2-CZ 4.32Å |
| 152 | A | 95.5 | Very high | 93.6 | Very high | 1 Ų | 1 | 71.5 Ų | 71.5 | 1% | 0.008 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.9 | -47.9 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | S98 C101 M102 C148 A149 V150 L154 M155 V156 | S98-A152 WeakPolarHBondContact O-CB 3.33Å; C101-A152 HydrophobicContact CB-CB 3.95Å; M102-A152 VanDerWaalsContact CA-CB 3.49Å; M102-A152 HydrophobicContact CB-CB 3.68Å; M102-A152 VanDerWaalsContact N-CB 3.27Å; C148-A152 WeakPolarHBondContact O-CB 3.48Å; C148-A152 PolarHBondContact O-N 2.95Å; A149-A152 PolarHBondContact O-N 2.94Å; V150-A152 VanDerWaalsContact C-N 3.34Å; V150-A152 PolarHBondContact O-N 3.31Å; A152-L154 VanDerWaalsContact C-N 3.3Å; A152-L154 PolarHBondContact O-N 3.35Å; A152-M155 PolarHBondContact O-N 2.88Å; A152-V156 PolarHBondContact O-N 2.88Å |
| 153 | V | 93.3 | Very high | 93.3 | Very high | 79 Ų | 79 | 76.8 Ų | 76.8 | 48% | 0.479 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -60.8 | -41.9 | 177.6 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | A149 K157 | A149-V153 WeakPolarHBondContact O-CG2 3.34Å; A149-V153 PolarHBondContact O-N 3.46Å; A149-V153 VanDerWaalsContact O-N 3.13Å; V153-K157 WeakPolarHBondContact O-CB 3.35Å; V153-K157 PolarHBondContact O-N 3.39Å |
| 154 | L | 92.1 | Very high | 93.1 | Very high | 82 Ų | 82 | 72.6 Ų | 72.6 | 43% | 0.429 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -64.3 | -42.2 | 176.4 | -70.2 | 173.9 | 0 | 0 | 0 | 111.9 | V150 L151 A152 F158 | V150-L154 HydrophobicContact CG1-CD1 3.87Å; V150-L154 HydrophobicContact CG1-CG 4.48Å; V150-L154 WeakPolarHBondContact O-CB 3.47Å; V150-L154 VanDerWaalsContact O-CG 3.24Å; V150-L154 WeakPolarHBondContact O-CG 3.3Å; V150-L154 PolarHBondContact O-N 2.7Å; V150-L154 VanDerWaalsContact O-N 3.11Å; L151-L154 PolarHBondContact O-N 3.16Å; A152-L154 VanDerWaalsContact C-N 3.3Å; A152-L154 PolarHBondContact O-N 3.35Å; L154-F158 HydrophobicContact CD2-CD2 4.35Å; L154-F158 HydrophobicContact CD2-CE2 3.97Å; L154-F158 WeakPolarHBondContact O-CB 3.5Å; L154-F158 VanDerWaalsContact O-CD2 3.3Å; L154-F158 WeakPolarHBondContact O-CD2 3.36Å; L154-F158 PolarHBondContact O-N 3.01Å |
| 155 | M | 91.3 | Very high | 92.7 | Very high | 25 Ų | 25 | 72.7 Ų | 72.7 | 12% | 0.123 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -64.4 | -43.8 | -179.4 | -73 | -66 | 121 | 0 | 0 | 112 | L151 A152 F159 I164 F168 | L151-M155 HydrophobicContact CD1-CE 3.73Å; L151-M155 HydrophobicContact CD1-CG 4.13Å; L151-M155 HydrophobicContact CG-CG 4.24Å; L151-M155 WeakPolarHBondContact O-CB 3.13Å; L151-M155 WeakPolarHBondContact O-CG 3.15Å; L151-M155 PolarHBondContact O-N 3.33Å; A152-M155 PolarHBondContact O-N 2.88Å; M155-F159 WeakPolarHBondContact O-CA 3.22Å; M155-F159 WeakPolarHBondContact O-CB 3.21Å; M155-F159 PolarHBondContact O-N 3.05Å; M155-I164 HydrophobicContact CE-CG2 3.96Å; M155-I164 HydrophobicContact SD-CG2 3.59Å; M155-I164 VanDerWaalsContact SD-CG2 3.59Å; M155-F168 HydrophobicContact CG-CD2 4.41Å; M155-F168 HydrophobicContact SD-CB 3.92Å; M155-F168 HydrophobicContact SD-CD2 4.31Å; M155-F168 HydrophobicContact SD-CG 4.42Å |
| 156 | V | 91.3 | Very high | 92.4 | Very high | 22 Ų | 22 | 73 Ų | 73 | 13% | 0.133 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -72.4 | -49.4 | -179.4 | 175.7 | 0 | 0 | 0 | 0 | 111.2 | D94 D97 C101 A152 F158 F159 | D94-V156 HydrophobicContact CB-CG1 4.34Å; D97-V156 HydrophobicContact CB-CG1 4Å; D97-V156 HydrophobicContact CB-CG2 4.15Å; C101-V156 HydrophobicContact CB-CG2 4.12Å; A152-V156 PolarHBondContact O-N 2.88Å; V156-F158 PolarHBondContact O-N 3.18Å; V156-F158 VanDerWaalsContact O-N 3.12Å; V156-F159 VanDerWaalsContact O-CB 3.24Å; V156-F159 WeakPolarHBondContact O-CB 3.37Å; V156-F159 PolarHBondContact O-N 2.89Å |
| 157 | K | 90.9 | Very high | 92.2 | Very high | 144 Ų | 144 | 71.1 Ų | 71.1 | 63% | 0.626 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -56.9 | -34.8 | -180 | -177 | 172.2 | -177.8 | 170 | 0 | 113.3 | V153 | V153-K157 WeakPolarHBondContact O-CB 3.35Å; V153-K157 PolarHBondContact O-N 3.39Å |
| 158 | F | 91.1 | Very high | 91.9 | Very high | 79 Ų | 79 | 69.5 Ų | 69.5 | 35% | 0.346 | 35% | 0.348 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.6 | 18.4 | -179.2 | -60.7 | -73.7 | 0 | 0 | 0 | 113.2 | L154 V156 N160 F161 I164 | L154-F158 HydrophobicContact CD2-CD2 4.35Å; L154-F158 HydrophobicContact CD2-CE2 3.97Å; L154-F158 WeakPolarHBondContact O-CB 3.5Å; L154-F158 VanDerWaalsContact O-CD2 3.3Å; L154-F158 WeakPolarHBondContact O-CD2 3.36Å; L154-F158 PolarHBondContact O-N 3.01Å; V156-F158 PolarHBondContact O-N 3.18Å; V156-F158 VanDerWaalsContact O-N 3.12Å; F158-N160 PolarHBondContact O-N 3Å; F158-F161 HydrophobicContact CB-CD2 3.98Å; F158-F161 HydrophobicContact CD1-CD2 4Å; F158-F161 AromaticContact CD1-CE2 3.81Å; F158-F161 HydrophobicContact CD1-CE2 3.81Å; F158-F161 WeakPolarHBondContact O-CB 3.33Å; F158-F161 WeakPolarHBondContact O-CD2 3.2Å; F158-F161 PolarHBondContact O-N 3.06Å; F158-I164 HydrophobicContact CB-CD1 4.28Å; F158-I164 HydrophobicContact CB-CG1 3.76Å; F158-I164 HydrophobicContact CB-CG2 4.41Å; F158-I164 WeakPolarHBondContact O-CB 3.29Å; F158-I164 WeakPolarHBondContact O-CG1 3.43Å |
| 159 | F | 88.3 | Confident | 91.7 | Very high | 93 Ų | 93 | 70.8 Ų | 70.8 | 41% | 0.408 | 35% | 0.354 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -32.9 | -175.7 | -174.5 | -99.6 | 0 | 0 | 0 | 113.5 | M155 V156 F161 M165 L242 | M155-F159 WeakPolarHBondContact O-CA 3.22Å; M155-F159 WeakPolarHBondContact O-CB 3.21Å; M155-F159 PolarHBondContact O-N 3.05Å; V156-F159 VanDerWaalsContact O-CB 3.24Å; V156-F159 WeakPolarHBondContact O-CB 3.37Å; V156-F159 PolarHBondContact O-N 2.89Å; F159-F161 PolarHBondContact O-N 3.18Å; F159-F161 VanDerWaalsContact O-N 3.13Å; F159-M165 HydrophobicContact CD2-CG 4.19Å; F159-M165 HydrophobicContact CE1-CE 4.28Å; F159-M165 HydrophobicContact CE1-SD 4.31Å; F159-M165 HydrophobicContact CE2-CE 4.18Å; F159-M165 HydrophobicContact CE2-CG 3.99Å; F159-M165 HydrophobicContact CE2-SD 4.49Å; F159-M165 HydrophobicContact CZ-CE 3.69Å; F159-M165 HydrophobicContact CZ-CG 4.25Å; F159-M165 HydrophobicContact CZ-SD 4.15Å; F159-M165 WeakPolarHBondContact O-CG 3.15Å; F159-L242 HydrophobicContact CE2-CD2 4.39Å; F159-L242 HydrophobicContact CZ-CD2 4.23Å |
| 160 | N | 86.6 | Confident | 91.6 | Very high | 149 Ų | 149 | 73 Ų | 73 | 80% | 0.797 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -23.4 | 177.2 | -70.7 | -61.1 | 0 | 0 | 0 | 113.7 | F158 K162 | F158-N160 PolarHBondContact O-N 3Å; N160-K162 PolarHBondContact O-N 3.39Å |
| 161 | F | 90.3 | Very high | 91.4 | Very high | 128 Ų | 128 | 71.7 Ų | 71.7 | 56% | 0.561 | 35% | 0.352 | S | S | * | . | S | Bend | trans | -80.5 | 113.7 | 175.6 | -65.4 | -83.7 | 0 | 0 | 0 | 109.5 | F158 F159 F163 I164 M165 | F158-F161 HydrophobicContact CB-CD2 3.98Å; F158-F161 HydrophobicContact CD1-CD2 4Å; F158-F161 AromaticContact CD1-CE2 3.81Å; F158-F161 HydrophobicContact CD1-CE2 3.81Å; F158-F161 WeakPolarHBondContact O-CB 3.33Å; F158-F161 WeakPolarHBondContact O-CD2 3.2Å; F158-F161 PolarHBondContact O-N 3.06Å; F159-F161 PolarHBondContact O-N 3.18Å; F159-F161 VanDerWaalsContact O-N 3.13Å; F161-F163 PolarHBondContact O-N 2.9Å; F161-I164 HydrophobicContact CB-CB 4.46Å; F161-I164 HydrophobicContact CB-CG1 3.93Å; F161-I164 WeakPolarHBondContact O-CA 3.33Å; F161-I164 WeakPolarHBondContact O-CB 3.17Å; F161-I164 PolarHBondContact O-N 2.89Å; F161-M165 PolarHBondContact O-N 3.25Å |
| 162 | K | 88.5 | Confident | 91.3 | Very high | 139 Ų | 139 | 69.7 Ų | 69.7 | 60% | 0.604 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -48.9 | -34.6 | 176.4 | -66 | -172.5 | 179.2 | -174.6 | 0 | 113.3 | N160 I164 M165 I166 | N160-K162 PolarHBondContact O-N 3.39Å; K162-I164 VanDerWaalsContact C-N 3.31Å; K162-I164 PolarHBondContact O-N 2.96Å; K162-M165 PolarHBondContact O-N 3.39Å; K162-I166 VanDerWaalsContact O-CG1 3.3Å; K162-I166 WeakPolarHBondContact O-CG1 3.5Å; K162-I166 PolarHBondContact O-N 3.36Å |
| 163 | F | 91.3 | Very high | 91.1 | Very high | 148 Ų | 148 | 73.6 Ų | 73.6 | 65% | 0.649 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -56.4 | -42.7 | 174.6 | 176.5 | -103 | 0 | 0 | 0 | 112.6 | F161 I166 C167 | F161-F163 PolarHBondContact O-N 2.9Å; F163-I166 PolarHBondContact O-N 3.06Å; F163-C167 VanDerWaalsContact CZ-SG 3.52Å; F163-C167 WeakPolarHBondContact O-CB 3.28Å; F163-C167 PolarHBondContact O-N 2.97Å; F163-C167 PolarHBondContact O-SG 3.47Å |
| 164 | I | 92.4 | Very high | 91.2 | Very high | 29 Ų | 29 | 74 Ų | 74 | 15% | 0.149 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -68.7 | -41.9 | 180 | -60.8 | -65.4 | 0 | 0 | 0 | 110.8 | M155 F158 F161 K162 I166 C167 F168 | M155-I164 HydrophobicContact CE-CG2 3.96Å; M155-I164 HydrophobicContact SD-CG2 3.59Å; M155-I164 VanDerWaalsContact SD-CG2 3.59Å; F158-I164 HydrophobicContact CB-CD1 4.28Å; F158-I164 HydrophobicContact CB-CG1 3.76Å; F158-I164 HydrophobicContact CB-CG2 4.41Å; F158-I164 WeakPolarHBondContact O-CB 3.29Å; F158-I164 WeakPolarHBondContact O-CG1 3.43Å; F161-I164 HydrophobicContact CB-CB 4.46Å; F161-I164 HydrophobicContact CB-CG1 3.93Å; F161-I164 WeakPolarHBondContact O-CA 3.33Å; F161-I164 WeakPolarHBondContact O-CB 3.17Å; F161-I164 PolarHBondContact O-N 2.89Å; K162-I164 VanDerWaalsContact C-N 3.31Å; K162-I164 PolarHBondContact O-N 2.96Å; I164-I166 VanDerWaalsContact C-N 3.33Å; I164-I166 PolarHBondContact O-N 3.37Å; I164-C167 WeakPolarHBondContact O-CB 3.4Å; I164-C167 PolarHBondContact O-N 3.03Å; I164-F168 PolarHBondContact O-N 2.97Å |
| 165 | M | 89.7 | Confident | 91.1 | Very high | 17 Ų | 17 | 71 Ų | 71 | 8% | 0.084 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -58.6 | -44.5 | 172.6 | -63.2 | -177.6 | 72.8 | 0 | 0 | 111.8 | F159 F161 K162 F168 I169 L242 I245 T246 | F159-M165 HydrophobicContact CD2-CG 4.19Å; F159-M165 HydrophobicContact CE1-CE 4.28Å; F159-M165 HydrophobicContact CE1-SD 4.31Å; F159-M165 HydrophobicContact CE2-CE 4.18Å; F159-M165 HydrophobicContact CE2-CG 3.99Å; F159-M165 HydrophobicContact CE2-SD 4.49Å; F159-M165 HydrophobicContact CZ-CE 3.69Å; F159-M165 HydrophobicContact CZ-CG 4.25Å; F159-M165 HydrophobicContact CZ-SD 4.15Å; F159-M165 WeakPolarHBondContact O-CG 3.15Å; F161-M165 PolarHBondContact O-N 3.25Å; K162-M165 PolarHBondContact O-N 3.39Å; M165-F168 PolarHBondContact O-N 3.2Å; M165-I169 WeakPolarHBondContact O-CG1 3.35Å; M165-I169 PolarHBondContact O-N 3.13Å; M165-L242 HydrophobicContact CE-CD2 4.26Å; M165-I245 HydrophobicContact CE-CG2 4.23Å; M165-T246 WeakPolarHBondContact CE-OG1 3.3Å |
| 166 | I | 91.9 | Very high | 91.1 | Very high | 85 Ų | 85 | 71.1 Ų | 71.1 | 44% | 0.436 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -62.6 | -46 | 176.3 | -67.4 | 166.1 | 0 | 0 | 0 | 110.6 | K162 F163 I164 F168 I169 V170 T246 | K162-I166 VanDerWaalsContact O-CG1 3.3Å; K162-I166 WeakPolarHBondContact O-CG1 3.5Å; K162-I166 PolarHBondContact O-N 3.36Å; F163-I166 PolarHBondContact O-N 3.06Å; I164-I166 VanDerWaalsContact C-N 3.33Å; I164-I166 PolarHBondContact O-N 3.37Å; I166-F168 VanDerWaalsContact C-N 3.26Å; I166-F168 PolarHBondContact O-N 3.08Å; I166-I169 PolarHBondContact O-N 3.48Å; I166-V170 HydrophobicContact CG2-CG2 4.23Å; I166-V170 WeakPolarHBondContact O-CB 3.3Å; I166-V170 VanDerWaalsContact O-CG2 3.3Å; I166-V170 WeakPolarHBondContact O-CG2 3.34Å; I166-V170 PolarHBondContact O-N 2.99Å; I166-T246 HydrophobicContact CD1-CG2 4.47Å; I166-T246 HydrophobicContact CG1-CG2 4.02Å |
| 167 | C | 92.5 | Very high | 91.2 | Very high | 46 Ų | 46 | 72.9 Ų | 72.9 | 31% | 0.311 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -56.9 | -40.4 | 175.5 | -74.9 | 0 | 0 | 0 | 0 | 112 | F163 I164 V170 F171 | F163-C167 VanDerWaalsContact CZ-SG 3.52Å; F163-C167 WeakPolarHBondContact O-CB 3.28Å; F163-C167 PolarHBondContact O-N 2.97Å; F163-C167 PolarHBondContact O-SG 3.47Å; I164-C167 WeakPolarHBondContact O-CB 3.4Å; I164-C167 PolarHBondContact O-N 3.03Å; C167-V170 PolarHBondContact O-N 3.31Å; C167-F171 VanDerWaalsContact O-CB 3.29Å; C167-F171 WeakPolarHBondContact O-CB 3.44Å; C167-F171 PolarHBondContact O-N 2.76Å |
| 168 | F | 91.1 | Very high | 91.1 | Very high | 22 Ų | 22 | 68 Ų | 68 | 10% | 0.096 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -67.1 | -43.6 | 177.6 | -173.2 | -129 | 0 | 0 | 0 | 112.6 | F104 V105 M155 I164 M165 I166 F171 F172 F239 L242 | F104-F168 AromaticContact CD1-CE2 3.6Å; F104-F168 HydrophobicContact CD1-CE2 3.6Å; F104-F168 AromaticContact CD1-CZ 3.44Å; F104-F168 HydrophobicContact CD1-CZ 3.44Å; F104-F168 VanDerWaalsContact CD1-CZ 3.44Å; F104-F168 AromaticContact CE1-CE2 3.43Å; F104-F168 HydrophobicContact CE1-CE2 3.43Å; F104-F168 VanDerWaalsContact CE1-CE2 3.43Å; F104-F168 AromaticContact CE1-CZ 3.42Å; F104-F168 HydrophobicContact CE1-CZ 3.42Å; F104-F168 VanDerWaalsContact CE1-CZ 3.42Å; F104-F168 HydrophobicContact CG-CZ 4.46Å; F104-F168 HydrophobicContact CZ-CZ 4.4Å; V105-F168 HydrophobicContact CG2-CE2 4.42Å; M155-F168 HydrophobicContact CG-CD2 4.41Å; M155-F168 HydrophobicContact SD-CB 3.92Å; M155-F168 HydrophobicContact SD-CD2 4.31Å; M155-F168 HydrophobicContact SD-CG 4.42Å; I164-F168 PolarHBondContact O-N 2.97Å; M165-F168 PolarHBondContact O-N 3.2Å; I166-F168 VanDerWaalsContact C-N 3.26Å; I166-F168 PolarHBondContact O-N 3.08Å; F168-F171 PolarHBondContact O-N 2.99Å; F168-F172 PolarHBondContact O-N 2.84Å; F168-F239 AromaticContact CD1-CE1 3.88Å; F168-F239 HydrophobicContact CD1-CE1 3.88Å; F168-F239 HydrophobicContact CD1-CZ 4.28Å; F168-F239 AromaticContact CE1-CE1 3.67Å; F168-F239 HydrophobicContact CE1-CE1 3.67Å; F168-F239 AromaticContact CE1-CZ 3.61Å; F168-F239 HydrophobicContact CE1-CZ 3.61Å; F168-F239 HydrophobicContact CE2-CZ 4.39Å; F168-F239 HydrophobicContact CG-CE1 4.46Å; F168-F239 HydrophobicContact CZ-CE1 4.1Å; F168-F239 AromaticContact CZ-CZ 3.68Å; F168-F239 HydrophobicContact CZ-CZ 3.68Å; F168-L242 HydrophobicContact CD1-CD1 3.84Å; F168-L242 HydrophobicContact CE1-CD1 3.82Å |
| 169 | I | 92.5 | Very high | 91 | Very high | 26 Ų | 26 | 64.2 Ų | 64.2 | 13% | 0.133 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -61.6 | -46 | 174.4 | -67.6 | 161.4 | 0 | 0 | 0 | 110.5 | M165 I166 F172 V173 F239 L242 V243 | M165-I169 WeakPolarHBondContact O-CG1 3.35Å; M165-I169 PolarHBondContact O-N 3.13Å; I166-I169 PolarHBondContact O-N 3.48Å; I169-F172 PolarHBondContact O-N 3.26Å; I169-V173 WeakPolarHBondContact O-CG2 3.49Å; I169-V173 PolarHBondContact O-N 3.27Å; I169-F239 HydrophobicContact CG1-CD1 4.49Å; I169-L242 HydrophobicContact CD1-CB 4.22Å; I169-L242 HydrophobicContact CG1-CB 4.26Å; I169-V243 HydrophobicContact CD1-CG2 3.87Å; I169-V243 HydrophobicContact CG1-CG2 4.3Å; I169-V243 HydrophobicContact CG2-CG2 3.85Å |
| 170 | V | 93.7 | Very high | 91.1 | Very high | 78 Ų | 78 | 62.7 Ų | 62.7 | 47% | 0.473 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.4 | -44.7 | 177.8 | 170.1 | 0 | 0 | 0 | 0 | 110.7 | I166 C167 F172 V173 V174 | I166-V170 HydrophobicContact CG2-CG2 4.23Å; I166-V170 WeakPolarHBondContact O-CB 3.3Å; I166-V170 VanDerWaalsContact O-CG2 3.3Å; I166-V170 WeakPolarHBondContact O-CG2 3.34Å; I166-V170 PolarHBondContact O-N 2.99Å; C167-V170 PolarHBondContact O-N 3.31Å; V170-F172 VanDerWaalsContact C-N 3.34Å; V170-F172 PolarHBondContact O-N 2.91Å; V170-V173 PolarHBondContact O-N 3.46Å; V170-V174 HydrophobicContact CG1-CG2 4.04Å; V170-V174 WeakPolarHBondContact O-CB 3.19Å; V170-V174 VanDerWaalsContact O-CG2 3.26Å; V170-V174 WeakPolarHBondContact O-CG2 3.42Å; V170-V174 PolarHBondContact O-N 3.23Å |
| 171 | F | 91.6 | Very high | 91.2 | Very high | 62 Ų | 62 | 61.9 Ų | 61.9 | 27% | 0.272 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -54.8 | -50.1 | 175.4 | 171.8 | -98.4 | 0 | 0 | 0 | 111 | V105 I108 L151 C167 F168 V173 V174 S175 | V105-F171 HydrophobicContact CG1-CE1 4.19Å; V105-F171 HydrophobicContact CG1-CZ 4Å; V105-F171 HydrophobicContact CG2-CE1 4.22Å; I108-F171 HydrophobicContact CD1-CE1 4.24Å; L151-F171 HydrophobicContact CD2-CE2 4.35Å; L151-F171 HydrophobicContact CD2-CZ 4.32Å; C167-F171 VanDerWaalsContact O-CB 3.29Å; C167-F171 WeakPolarHBondContact O-CB 3.44Å; C167-F171 PolarHBondContact O-N 2.76Å; F168-F171 PolarHBondContact O-N 2.99Å; F171-V173 PolarHBondContact O-N 3.05Å; F171-V174 PolarHBondContact O-N 3.38Å; F171-S175 WeakPolarHBondContact O-CB 3.34Å; F171-S175 PolarHBondContact O-N 3.26Å; F171-S175 PolarHBondContact O-OG 3.41Å; F171-S175 VanDerWaalsContact O-OG 3.05Å |
| 172 | F | 90.7 | Very high | 91 | Very high | 10 Ų | 10 | 57.8 Ų | 57.8 | 4% | 0.044 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -57.8 | -50.8 | 177.2 | 173.6 | -116.5 | 0 | 0 | 0 | 112.5 | F104 I108 F168 I169 V170 V174 S175 L176 F231 W235 F239 | F104-F172 HydrophobicContact CE2-CD2 4.02Å; F104-F172 HydrophobicContact CE2-CE2 4.12Å; F104-F172 HydrophobicContact CZ-CB 4.3Å; F104-F172 AromaticContact CZ-CD2 3.51Å; F104-F172 HydrophobicContact CZ-CD2 3.51Å; F104-F172 HydrophobicContact CZ-CE2 4.08Å; F104-F172 HydrophobicContact CZ-CG 4.21Å; I108-F172 HydrophobicContact CD1-CD2 3.97Å; F168-F172 PolarHBondContact O-N 2.84Å; I169-F172 PolarHBondContact O-N 3.26Å; V170-F172 VanDerWaalsContact C-N 3.34Å; V170-F172 PolarHBondContact O-N 2.91Å; F172-V174 PolarHBondContact O-N 2.92Å; F172-S175 PolarHBondContact O-N 3.26Å; F172-L176 HydrophobicContact CD1-CD1 4.15Å; F172-L176 HydrophobicContact CD2-CD1 4.22Å; F172-L176 HydrophobicContact CD2-CD2 4.48Å; F172-L176 HydrophobicContact CD2-CG 4Å; F172-L176 HydrophobicContact CE1-CD1 3.55Å; F172-L176 HydrophobicContact CE1-CG 4.35Å; F172-L176 HydrophobicContact CE2-CD1 3.69Å; F172-L176 HydrophobicContact CE2-CD2 3.98Å; F172-L176 HydrophobicContact CE2-CG 3.76Å; F172-L176 HydrophobicContact CG-CD1 4.49Å; F172-L176 HydrophobicContact CG-CG 4.49Å; F172-L176 HydrophobicContact CZ-CD1 3.34Å; F172-L176 HydrophobicContact CZ-CD2 4.4Å; F172-L176 HydrophobicContact CZ-CG 3.98Å; F172-L176 WeakPolarHBondContact O-CB 3.44Å; F172-L176 WeakPolarHBondContact O-CG 3.37Å; F172-L176 PolarHBondContact O-N 3.39Å; F172-F231 HydrophobicContact CE2-CE1 4.06Å; F172-F231 HydrophobicContact CE2-CZ 4.47Å; F172-W235 HydrophobicContact CE2-CB 4.33Å; F172-W235 HydrophobicContact CZ-CB 4.31Å; F172-F239 HydrophobicContact CB-CD1 3.72Å; F172-F239 HydrophobicContact CB-CE1 3.41Å; F172-F239 VanDerWaalsContact CB-CE1 3.41Å; F172-F239 HydrophobicContact CB-CE2 4.34Å; F172-F239 HydrophobicContact CB-CG 4.32Å; F172-F239 HydrophobicContact CB-CZ 3.79Å; F172-F239 HydrophobicContact CD1-CB 3.72Å; F172-F239 AromaticContact CD1-CD1 3.42Å; F172-F239 HydrophobicContact CD1-CD1 3.42Å; F172-F239 VanDerWaalsContact CD1-CD1 3.42Å; F172-F239 AromaticContact CD1-CD2 3.6Å; F172-F239 HydrophobicContact CD1-CD2 3.6Å; F172-F239 AromaticContact CD1-CE1 3.97Å; F172-F239 HydrophobicContact CD1-CE1 3.97Å; F172-F239 HydrophobicContact CD1-CE2 4.13Å; F172-F239 AromaticContact CD1-CG 3.23Å; F172-F239 HydrophobicContact CD1-CG 3.23Å; F172-F239 HydrophobicContact CD1-CZ 4.31Å; F172-F239 AromaticContact CD2-CD2 3.93Å; F172-F239 HydrophobicContact CD2-CD2 3.93Å; F172-F239 HydrophobicContact CD2-CE1 4.36Å; F172-F239 AromaticContact CD2-CE2 3.75Å; F172-F239 HydrophobicContact CD2-CE2 3.75Å; F172-F239 HydrophobicContact CD2-CG 4.35Å; F172-F239 HydrophobicContact CD2-CZ 4Å; F172-F239 HydrophobicContact CE1-CB 3.54Å; F172-F239 HydrophobicContact CE1-CD1 4.08Å; F172-F239 AromaticContact CE1-CD2 3.47Å; F172-F239 HydrophobicContact CE1-CD2 3.47Å; F172-F239 VanDerWaalsContact CE1-CD2 3.47Å; F172-F239 HydrophobicContact CE1-CE2 4.27Å; F172-F239 AromaticContact CE1-CG 3.37Å; F172-F239 HydrophobicContact CE1-CG 3.37Å; F172-F239 AromaticContact CE2-CD2 3.77Å; F172-F239 HydrophobicContact CE2-CD2 3.77Å; F172-F239 AromaticContact CE2-CE2 3.86Å; F172-F239 HydrophobicContact CE2-CE2 3.86Å; F172-F239 HydrophobicContact CE2-CG 4.42Å; F172-F239 AromaticContact CG-CD1 3.66Å; F172-F239 HydrophobicContact CG-CD1 3.66Å; F172-F239 AromaticContact CG-CD2 3.79Å; F172-F239 HydrophobicContact CG-CD2 3.79Å; F172-F239 AromaticContact CG-CE1 3.68Å; F172-F239 HydrophobicContact CG-CE1 3.68Å; F172-F239 AromaticContact CG-CE2 3.82Å; F172-F239 HydrophobicContact CG-CE2 3.82Å; F172-F239 AromaticContact CG-CG 3.73Å; F172-F239 HydrophobicContact CG-CG 3.73Å; F172-F239 AromaticContact CG-CZ 3.79Å; F172-F239 HydrophobicContact CG-CZ 3.79Å; F172-F239 HydrophobicContact CZ-CB 4.33Å; F172-F239 AromaticContact CZ-CD2 3.51Å; F172-F239 HydrophobicContact CZ-CD2 3.51Å; F172-F239 HydrophobicContact CZ-CE2 4.09Å; F172-F239 AromaticContact CZ-CG 3.95Å; F172-F239 HydrophobicContact CZ-CG 3.95Å |
| 173 | V | 92.9 | Very high | 90.9 | Very high | 83 Ų | 83 | 51.5 Ų | 51.5 | 50% | 0.503 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.3 | -44 | -178.5 | 173.3 | 0 | 0 | 0 | 0 | 111.4 | I169 V170 F171 L176 A177 | I169-V173 WeakPolarHBondContact O-CG2 3.49Å; I169-V173 PolarHBondContact O-N 3.27Å; V170-V173 PolarHBondContact O-N 3.46Å; F171-V173 PolarHBondContact O-N 3.05Å; V173-L176 PolarHBondContact O-N 3.12Å; V173-A177 WeakPolarHBondContact O-CB 3.14Å; V173-A177 PolarHBondContact O-N 3.01Å |
| 174 | V | 93.9 | Very high | 90.8 | Very high | 87 Ų | 87 | 47.9 Ų | 47.9 | 53% | 0.527 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64.1 | -44.8 | 178 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | V170 F171 F172 A177 A178 | V170-V174 HydrophobicContact CG1-CG2 4.04Å; V170-V174 WeakPolarHBondContact O-CB 3.19Å; V170-V174 VanDerWaalsContact O-CG2 3.26Å; V170-V174 WeakPolarHBondContact O-CG2 3.42Å; V170-V174 PolarHBondContact O-N 3.23Å; F171-V174 PolarHBondContact O-N 3.38Å; F172-V174 PolarHBondContact O-N 2.92Å; V174-A177 PolarHBondContact O-N 2.85Å; V174-A178 WeakPolarHBondContact O-CB 3.32Å; V174-A178 PolarHBondContact O-N 3.46Å |
| 175 | S | 91.5 | Very high | 90.5 | Very high | 18 Ų | 18 | 50.1 Ų | 50.1 | 13% | 0.126 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63 | -43 | 176.9 | -66.9 | 0 | 0 | 0 | 0 | 112.3 | I108 F171 F172 A178 I179 | I108-S175 VanDerWaalsContact CG2-CB 3.46Å; F171-S175 WeakPolarHBondContact O-CB 3.34Å; F171-S175 PolarHBondContact O-N 3.26Å; F171-S175 PolarHBondContact O-OG 3.41Å; F171-S175 VanDerWaalsContact O-OG 3.05Å; F172-S175 PolarHBondContact O-N 3.26Å; S175-A178 PolarHBondContact O-N 3.47Å; S175-I179 VanDerWaalsContact O-CG1 3.28Å; S175-I179 WeakPolarHBondContact O-CG1 3.49Å; S175-I179 PolarHBondContact O-N 3.11Å |
| 176 | L | 90.8 | Very high | 90.3 | Very high | 29 Ų | 29 | 49.5 Ų | 49.5 | 15% | 0.152 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.9 | -45.8 | 174.6 | -75.5 | -168.5 | 0 | 0 | 0 | 111.8 | F172 V173 A178 I179 C180 F228 F231 V232 | F172-L176 HydrophobicContact CD1-CD1 4.15Å; F172-L176 HydrophobicContact CD2-CD1 4.22Å; F172-L176 HydrophobicContact CD2-CD2 4.48Å; F172-L176 HydrophobicContact CD2-CG 4Å; F172-L176 HydrophobicContact CE1-CD1 3.55Å; F172-L176 HydrophobicContact CE1-CG 4.35Å; F172-L176 HydrophobicContact CE2-CD1 3.69Å; F172-L176 HydrophobicContact CE2-CD2 3.98Å; F172-L176 HydrophobicContact CE2-CG 3.76Å; F172-L176 HydrophobicContact CG-CD1 4.49Å; F172-L176 HydrophobicContact CG-CG 4.49Å; F172-L176 HydrophobicContact CZ-CD1 3.34Å; F172-L176 HydrophobicContact CZ-CD2 4.4Å; F172-L176 HydrophobicContact CZ-CG 3.98Å; F172-L176 WeakPolarHBondContact O-CB 3.44Å; F172-L176 WeakPolarHBondContact O-CG 3.37Å; F172-L176 PolarHBondContact O-N 3.39Å; V173-L176 PolarHBondContact O-N 3.12Å; L176-A178 VanDerWaalsContact C-N 3.34Å; L176-A178 PolarHBondContact O-N 3.29Å; L176-I179 PolarHBondContact O-N 2.94Å; L176-C180 WeakPolarHBondContact O-CB 3.24Å; L176-C180 PolarHBondContact O-N 3.01Å; L176-F228 HydrophobicContact CD2-CE2 3.67Å; L176-F228 HydrophobicContact CD2-CZ 3.82Å; L176-F231 HydrophobicContact CD2-CD1 4.17Å; L176-F231 HydrophobicContact CD2-CE1 3.95Å; L176-V232 HydrophobicContact CD1-CG2 4.39Å; L176-V232 HydrophobicContact CD2-CG2 3.72Å |
| 177 | A | 92.4 | Very high | 89.9 | Confident | 59 Ų | 59 | 48 Ų | 48 | 49% | 0.488 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.4 | -43.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | V173 V174 C180 F181 | V173-A177 WeakPolarHBondContact O-CB 3.14Å; V173-A177 PolarHBondContact O-N 3.01Å; V174-A177 PolarHBondContact O-N 2.85Å; A177-C180 PolarHBondContact O-N 3.31Å; A177-F181 WeakPolarHBondContact O-CB 3.45Å; A177-F181 PolarHBondContact O-N 3.26Å |
| 178 | A | 90.4 | Very high | 89.6 | Confident | 40 Ų | 40 | 50.8 Ų | 50.8 | 33% | 0.331 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -62.9 | -47.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | V174 S175 L176 F181 L182 | V174-A178 WeakPolarHBondContact O-CB 3.32Å; V174-A178 PolarHBondContact O-N 3.46Å; S175-A178 PolarHBondContact O-N 3.47Å; L176-A178 VanDerWaalsContact C-N 3.34Å; L176-A178 PolarHBondContact O-N 3.29Å; A178-F181 PolarHBondContact O-N 3.36Å; A178-L182 WeakPolarHBondContact O-CG 3.4Å; A178-L182 PolarHBondContact O-N 3.38Å |
| 179 | I | 88.2 | Confident | 89.1 | Confident | 1 Ų | 1 | 52 Ų | 52 | 1% | 0.005 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -66.4 | -43.3 | 178.9 | -64.3 | 165 | 0 | 0 | 0 | 110.7 | I108 F111 L112 S175 L176 L182 Y183 F228 | I108-I179 HydrophobicContact CG2-CD1 4.19Å; F111-I179 HydrophobicContact CB-CD1 4.13Å; L112-I179 HydrophobicContact CB-CD1 4.47Å; L112-I179 HydrophobicContact CB-CG1 4.3Å; L112-I179 HydrophobicContact CD1-CG1 4.18Å; S175-I179 VanDerWaalsContact O-CG1 3.28Å; S175-I179 WeakPolarHBondContact O-CG1 3.49Å; S175-I179 PolarHBondContact O-N 3.11Å; L176-I179 PolarHBondContact O-N 2.94Å; I179-L182 PolarHBondContact O-N 3.22Å; I179-Y183 HydrophobicContact CG2-CD2 3.68Å; I179-Y183 HydrophobicContact CG2-CE2 3.38Å; I179-Y183 WeakPolarHBondContact O-CD2 3.37Å; I179-Y183 PolarHBondContact O-N 3.01Å; I179-F228 HydrophobicContact CB-CD2 4.32Å; I179-F228 HydrophobicContact CB-CE1 4.5Å; I179-F228 HydrophobicContact CB-CE2 3.71Å; I179-F228 HydrophobicContact CB-CZ 3.8Å; I179-F228 HydrophobicContact CD1-CE2 4Å; I179-F228 HydrophobicContact CG1-CE2 4.47Å; I179-F228 HydrophobicContact CG2-CD1 4.1Å; I179-F228 HydrophobicContact CG2-CD2 3.49Å; I179-F228 VanDerWaalsContact CG2-CD2 3.49Å; I179-F228 HydrophobicContact CG2-CE1 4Å; I179-F228 HydrophobicContact CG2-CE2 3.38Å; I179-F228 HydrophobicContact CG2-CG 3.85Å; I179-F228 HydrophobicContact CG2-CZ 3.64Å |
| 180 | C | 89.6 | Confident | 88.4 | Confident | 60 Ų | 60 | 50.9 Ų | 50.9 | 41% | 0.405 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.3 | -47.2 | 176.3 | -173.8 | 0 | 0 | 0 | 0 | 111.2 | L176 A177 L182 Y183 V184 F228 | L176-C180 WeakPolarHBondContact O-CB 3.24Å; L176-C180 PolarHBondContact O-N 3.01Å; A177-C180 PolarHBondContact O-N 3.31Å; C180-L182 PolarHBondContact O-N 3.15Å; C180-Y183 PolarHBondContact O-N 3.4Å; C180-V184 WeakPolarHBondContact O-CB 3.5Å; C180-V184 WeakPolarHBondContact O-CG2 3.38Å; C180-V184 PolarHBondContact O-N 3.05Å; C180-F228 HydrophobicContact CB-CE1 4.18Å; C180-F228 HydrophobicContact CB-CZ 4.49Å |
| 181 | F | 89.9 | Confident | 87.8 | Confident | 132 Ų | 132 | 55.3 Ų | 55.3 | 58% | 0.579 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -56.8 | -48.2 | 175.2 | 172.5 | -97.9 | 0 | 0 | 0 | 111.6 | A177 A178 Y183 V184 Y185 | A177-F181 WeakPolarHBondContact O-CB 3.45Å; A177-F181 PolarHBondContact O-N 3.26Å; A178-F181 PolarHBondContact O-N 3.36Å; F181-Y183 VanDerWaalsContact C-N 3.33Å; F181-Y183 PolarHBondContact O-N 2.94Å; F181-V184 PolarHBondContact O-N 3.34Å; F181-Y185 WeakPolarHBondContact O-CB 3.29Å; F181-Y185 PolarHBondContact O-N 2.89Å |
| 182 | L | 86.6 | Confident | 87.3 | Confident | 43 Ų | 43 | 56.3 Ų | 56.3 | 23% | 0.225 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -60 | -41.8 | 178.5 | -75.2 | 172.6 | 0 | 0 | 0 | 112.2 | L112 A115 V116 A178 I179 C180 M186 | L112-L182 HydrophobicContact CD1-CD1 3.55Å; A115-L182 HydrophobicContact CB-CD1 4.43Å; V116-L182 HydrophobicContact CG2-CD1 4.46Å; A178-L182 WeakPolarHBondContact O-CG 3.4Å; A178-L182 PolarHBondContact O-N 3.38Å; I179-L182 PolarHBondContact O-N 3.22Å; C180-L182 PolarHBondContact O-N 3.15Å; L182-M186 WeakPolarHBondContact O-CB 3.38Å; L182-M186 PolarHBondContact O-N 3.36Å |
| 183 | Y | 86.1 | Confident | 86.7 | Confident | 7 Ų | 7 | 59.3 Ų | 59.3 | 3% | 0.027 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -68.2 | -47.9 | 177.1 | -76.1 | -44.6 | 0 | 0 | 0 | 112.4 | A115 I179 C180 F181 Y185 M186 F187 L224 F228 | A115-Y183 HydrophobicContact CB-CE1 4.11Å; I179-Y183 HydrophobicContact CG2-CD2 3.68Å; I179-Y183 HydrophobicContact CG2-CE2 3.38Å; I179-Y183 WeakPolarHBondContact O-CD2 3.37Å; I179-Y183 PolarHBondContact O-N 3.01Å; C180-Y183 PolarHBondContact O-N 3.4Å; F181-Y183 VanDerWaalsContact C-N 3.33Å; F181-Y183 PolarHBondContact O-N 2.94Å; Y183-Y185 VanDerWaalsContact C-N 3.32Å; Y183-Y185 PolarHBondContact O-N 2.95Å; Y183-M186 HydrophobicContact CD1-CE 3.61Å; Y183-M186 HydrophobicContact CE1-CE 4.24Å; Y183-M186 PolarHBondContact O-N 3.12Å; Y183-F187 WeakPolarHBondContact O-CD2 3.39Å; Y183-F187 PolarHBondContact O-N 3.24Å; Y183-L224 HydrophobicContact CE1-CB 4.08Å; Y183-F228 HydrophobicContact CD2-CB 4.21Å; Y183-F228 AromaticContact CD2-CD1 3.75Å; Y183-F228 HydrophobicContact CD2-CD1 3.75Å; Y183-F228 HydrophobicContact CD2-CE1 4.37Å; Y183-F228 HydrophobicContact CD2-CG 4.06Å; Y183-F228 HydrophobicContact CE2-CB 3.49Å; Y183-F228 VanDerWaalsContact CE2-CB 3.49Å; Y183-F228 AromaticContact CE2-CD1 3.83Å; Y183-F228 HydrophobicContact CE2-CD1 3.83Å; Y183-F228 HydrophobicContact CE2-CD2 4.36Å; Y183-F228 AromaticContact CE2-CG 3.63Å; Y183-F228 HydrophobicContact CE2-CG 3.63Å |
| 184 | V | 87.6 | Confident | 85.9 | Confident | 72 Ų | 72 | 57.4 Ų | 57.4 | 44% | 0.436 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -58.9 | -46.7 | 177.2 | 172.4 | 0 | 0 | 0 | 0 | 110.1 | C180 F181 M186 F187 M188 | C180-V184 WeakPolarHBondContact O-CB 3.5Å; C180-V184 WeakPolarHBondContact O-CG2 3.38Å; C180-V184 PolarHBondContact O-N 3.05Å; F181-V184 PolarHBondContact O-N 3.34Å; V184-M186 PolarHBondContact O-N 3.42Å; V184-F187 PolarHBondContact O-N 2.88Å; V184-M188 HydrophobicContact CG1-CE 3.96Å; V184-M188 HydrophobicContact CG1-CG 4.33Å; V184-M188 HydrophobicContact CG1-SD 4.24Å; V184-M188 WeakPolarHBondContact O-CB 3.37Å; V184-M188 VanDerWaalsContact O-CG 3.32Å; V184-M188 WeakPolarHBondContact O-CG 3.48Å; V184-M188 PolarHBondContact O-N 3.3Å |
| 185 | Y | 86.8 | Confident | 85.2 | Confident | 75 Ų | 75 | 60.3 Ų | 60.3 | 29% | 0.294 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -58.9 | -47.8 | 175.8 | -179.4 | -112 | 0 | 0 | 0 | 111.9 | Y119 F181 Y183 F187 M188 M189 | Y119-Y185 HydrophobicContact CD2-CE1 4.48Å; Y119-Y185 HydrophobicContact CE2-CD1 4.11Å; Y119-Y185 AromaticContact CE2-CE1 3.65Å; Y119-Y185 HydrophobicContact CE2-CE1 3.65Å; F181-Y185 WeakPolarHBondContact O-CB 3.29Å; F181-Y185 PolarHBondContact O-N 2.89Å; Y183-Y185 VanDerWaalsContact C-N 3.32Å; Y183-Y185 PolarHBondContact O-N 2.95Å; Y185-F187 PolarHBondContact O-N 3.26Å; Y185-M188 PolarHBondContact O-N 3.4Å; Y185-M189 HydrophobicContact CD1-CG 4.49Å; Y185-M189 HydrophobicContact CD2-CG 3.94Å; Y185-M189 HydrophobicContact CE1-CG 4.15Å; Y185-M189 HydrophobicContact CE2-CG 3.51Å; Y185-M189 HydrophobicContact CE2-SD 4.11Å; Y185-M189 HydrophobicContact CG-CG 4.4Å; Y185-M189 WeakPolarHBondContact O-CB 3.42Å; Y185-M189 WeakPolarHBondContact O-CG 3.32Å; Y185-M189 PolarHBondContact O-N 3.45Å |
| 186 | M | 84.7 | Confident | 84.7 | Confident | 5 Ų | 5 | 63.9 Ų | 63.9 | 3% | 0.025 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59 | -44.1 | 177.1 | 177.8 | -168.9 | 68.3 | 0 | 0 | 111.8 | R118 I122 F123 L182 Y183 V184 A190 A221 | R118-M186 HydrophobicContact CB-SD 4.12Å; I122-M186 HydrophobicContact CD1-CG 3.87Å; I122-M186 HydrophobicContact CD1-SD 3.61Å; F123-M186 HydrophobicContact CE2-CB 4.35Å; F123-M186 HydrophobicContact CE2-CG 4.09Å; L182-M186 WeakPolarHBondContact O-CB 3.38Å; L182-M186 PolarHBondContact O-N 3.36Å; Y183-M186 HydrophobicContact CD1-CE 3.61Å; Y183-M186 HydrophobicContact CE1-CE 4.24Å; Y183-M186 PolarHBondContact O-N 3.12Å; V184-M186 PolarHBondContact O-N 3.42Å; M186-A190 WeakPolarHBondContact O-CB 3.29Å; M186-A190 PolarHBondContact O-N 2.87Å; M186-A221 HydrophobicContact CE-CB 3.53Å; M186-A221 HydrophobicContact SD-CB 4.04Å |
| 187 | F | 84.5 | Confident | 83.8 | Confident | 54 Ų | 54 | 64.4 Ų | 64.4 | 24% | 0.237 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -67.4 | -45.2 | 176.5 | -78.8 | -68.8 | 0 | 0 | 0 | 112.5 | Y183 V184 Y185 A190 R191 M218 T225 | Y183-F187 WeakPolarHBondContact O-CD2 3.39Å; Y183-F187 PolarHBondContact O-N 3.24Å; V184-F187 PolarHBondContact O-N 2.88Å; Y185-F187 PolarHBondContact O-N 3.26Å; F187-A190 PolarHBondContact O-N 2.85Å; F187-R191 WeakPolarHBondContact O-CG 3.49Å; F187-R191 PolarHBondContact O-N 2.89Å; F187-M218 HydrophobicContact CD1-SD 3.88Å; F187-M218 HydrophobicContact CE1-SD 3.69Å; F187-T225 HydrophobicContact CE2-CG2 4Å; F187-T225 WeakPolarHBondContact CE2-OG1 3.47Å; F187-T225 HydrophobicContact CZ-CG2 4.46Å; F187-T225 WeakPolarHBondContact CZ-OG1 3.49Å |
| 188 | M | 85.7 | Confident | 82.9 | Confident | 103 Ų | 103 | 65.4 Ų | 65.4 | 51% | 0.507 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.1 | -51.7 | 178.7 | -74.4 | -165.9 | -57.1 | 0 | 0 | 110.9 | V184 Y185 A190 R191 I192 | V184-M188 HydrophobicContact CG1-CE 3.96Å; V184-M188 HydrophobicContact CG1-CG 4.33Å; V184-M188 HydrophobicContact CG1-SD 4.24Å; V184-M188 WeakPolarHBondContact O-CB 3.37Å; V184-M188 VanDerWaalsContact O-CG 3.32Å; V184-M188 WeakPolarHBondContact O-CG 3.48Å; V184-M188 PolarHBondContact O-N 3.3Å; Y185-M188 PolarHBondContact O-N 3.4Å; M188-A190 VanDerWaalsContact C-N 3.33Å; M188-A190 PolarHBondContact O-N 3.45Å; M188-R191 WeakPolarHBondContact O-CB 3.34Å; M188-R191 PolarHBondContact O-N 2.73Å; M188-R191 VanDerWaalsContact O-N 3.12Å; M188-I192 WeakPolarHBondContact O-CG1 3.48Å; M188-I192 PolarHBondContact O-N 2.97Å |
| 189 | M | 80.6 | Confident | 82.2 | Confident | 48 Ų | 48 | 67.5 Ų | 67.5 | 24% | 0.236 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -63.2 | -39.8 | 179.5 | -72 | -64.7 | -79.2 | 0 | 0 | 111.6 | F123 Y185 R191 I192 H193 | F123-M189 HydrophobicContact CE1-CB 3.41Å; F123-M189 VanDerWaalsContact CE1-CB 3.41Å; F123-M189 HydrophobicContact CE1-CG 4.47Å; F123-M189 HydrophobicContact CZ-CB 3.39Å; F123-M189 HydrophobicContact CZ-CG 4.43Å; Y185-M189 HydrophobicContact CD1-CG 4.49Å; Y185-M189 HydrophobicContact CD2-CG 3.94Å; Y185-M189 HydrophobicContact CE1-CG 4.15Å; Y185-M189 HydrophobicContact CE2-CG 3.51Å; Y185-M189 HydrophobicContact CE2-SD 4.11Å; Y185-M189 HydrophobicContact CG-CG 4.4Å; Y185-M189 WeakPolarHBondContact O-CB 3.42Å; Y185-M189 WeakPolarHBondContact O-CG 3.32Å; Y185-M189 PolarHBondContact O-N 3.45Å; M189-R191 VanDerWaalsContact C-N 3.31Å; M189-R191 PolarHBondContact O-N 3.43Å; M189-I192 PolarHBondContact O-N 3.47Å; M189-I192 HydrophobicContact SD-CD1 4.1Å; M189-H193 PolarHBondContact O-CD2 2.72Å; M189-H193 PolarHBondContact O-N 3.12Å |
| 190 | A | 77.6 | Confident | 81.6 | Confident | 2 Ų | 2 | 72.5 Ų | 72.5 | 2% | 0.017 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -63 | -36.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | M186 F187 M188 A194 W214 M218 | M186-A190 WeakPolarHBondContact O-CB 3.29Å; M186-A190 PolarHBondContact O-N 2.87Å; F187-A190 PolarHBondContact O-N 2.85Å; M188-A190 VanDerWaalsContact C-N 3.33Å; M188-A190 PolarHBondContact O-N 3.45Å; A190-A194 WeakPolarHBondContact O-CB 3.33Å; A190-A194 PolarHBondContact O-N 3.12Å; A190-W214 VanDerWaalsContact O-CZ2 3.31Å; A190-W214 WeakPolarHBondContact O-CZ2 3.38Å; A190-M218 HydrophobicContact CB-CE 3.32Å |
| 191 | R | 82.1 | Confident | 80.4 | Confident | 172 Ų | 172 | 75.7 Ų | 75.7 | 65% | 0.649 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -67.8 | -39.3 | 173.9 | -66.5 | -75.1 | -75.6 | -172.5 | -3.5 | 111.9 | F187 M188 M189 A194 K195 | F187-R191 WeakPolarHBondContact O-CG 3.49Å; F187-R191 PolarHBondContact O-N 2.89Å; M188-R191 WeakPolarHBondContact O-CB 3.34Å; M188-R191 PolarHBondContact O-N 2.73Å; M188-R191 VanDerWaalsContact O-N 3.12Å; M189-R191 VanDerWaalsContact C-N 3.31Å; M189-R191 PolarHBondContact O-N 3.43Å; R191-A194 PolarHBondContact O-N 2.74Å; R191-K195 WeakPolarHBondContact O-CG 3.46Å; R191-K195 PolarHBondContact O-N 2.97Å; R191-K195 VanDerWaalsContact O-N 3.15Å |
| 192 | I | 80.7 | Confident | 79.1 | Confident | 83 Ų | 83 | 71.5 Ų | 71.5 | 43% | 0.426 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -62.5 | -52 | 177 | -68.9 | 165.8 | 0 | 0 | 0 | 110.3 | M188 M189 A194 K195 N196 | M188-I192 WeakPolarHBondContact O-CG1 3.48Å; M188-I192 PolarHBondContact O-N 2.97Å; M189-I192 PolarHBondContact O-N 3.47Å; M189-I192 HydrophobicContact SD-CD1 4.1Å; I192-A194 VanDerWaalsContact C-N 3.26Å; I192-A194 PolarHBondContact O-N 3.2Å; I192-K195 PolarHBondContact O-N 3.41Å; I192-N196 PolarHBondContact O-N 2.94Å |
| 193 | H | 77.4 | Confident | 78 | Confident | 72 Ų | 72 | 72.4 Ų | 72.4 | 33% | 0.333 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61 | -38.2 | 178.2 | -68.7 | -70.9 | 0 | 0 | 0 | 111.1 | F123 M189 K195 N196 I197 W214 | F123-H193 AromaticContact CD1-NE2 3.71Å; F123-H193 AromaticContact CE1-CD2 3.66Å; F123-H193 AromaticContact CE1-NE2 3.73Å; M189-H193 PolarHBondContact O-CD2 2.72Å; M189-H193 PolarHBondContact O-N 3.12Å; H193-K195 VanDerWaalsContact C-N 3.29Å; H193-K195 PolarHBondContact O-N 3.07Å; H193-N196 PolarHBondContact O-N 2.89Å; H193-I197 PolarHBondContact O-N 3.32Å; H193-W214 HydrophobicContact CB-CH2 3.37Å; H193-W214 HydrophobicContact CB-CZ2 3.5Å; H193-W214 WeakPolarHBondContact O-CH2 3.16Å |
| 194 | A | 76.8 | Confident | 77.1 | Confident | 43 Ų | 43 | 74.9 Ų | 74.9 | 36% | 0.355 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.4 | -38.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | A190 R191 I192 A198 W214 | A190-A194 WeakPolarHBondContact O-CB 3.33Å; A190-A194 PolarHBondContact O-N 3.12Å; R191-A194 PolarHBondContact O-N 2.74Å; I192-A194 VanDerWaalsContact C-N 3.26Å; I192-A194 PolarHBondContact O-N 3.2Å; A194-A198 WeakPolarHBondContact O-CB 3.31Å; A194-A198 PolarHBondContact O-N 2.96Å; A194-A198 VanDerWaalsContact O-N 3.13Å; A194-W214 HydrophobicContact CB-CH2 3.93Å; A194-W214 HydrophobicContact CB-CZ2 3.94Å; A194-W214 HydrophobicContact CB-CZ3 4.27Å |
| 195 | K | 80.3 | Confident | 76.1 | Confident | 148 Ų | 148 | 82 Ų | 82 | 64% | 0.643 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -65.1 | -45.3 | 172.8 | -72.5 | -179.7 | 173.2 | -172.7 | 0 | 111.9 | R191 I192 H193 I197 A198 A199 | R191-K195 WeakPolarHBondContact O-CG 3.46Å; R191-K195 PolarHBondContact O-N 2.97Å; R191-K195 VanDerWaalsContact O-N 3.15Å; I192-K195 PolarHBondContact O-N 3.41Å; H193-K195 VanDerWaalsContact C-N 3.29Å; H193-K195 PolarHBondContact O-N 3.07Å; K195-I197 VanDerWaalsContact C-N 3.33Å; K195-I197 PolarHBondContact O-N 2.87Å; K195-A198 PolarHBondContact O-N 2.91Å; K195-A199 PolarHBondContact O-N 3.45Å; K195-A199 VanDerWaalsContact O-N 3.14Å |
| 196 | N | 79.1 | Confident | 75.3 | Confident | 94 Ų | 94 | 84.5 Ų | 84.5 | 50% | 0.503 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.7 | -36.8 | -178.8 | -67.9 | -8.1 | 0 | 0 | 0 | 112.4 | I192 H193 A199 L200 | I192-N196 PolarHBondContact O-N 2.94Å; H193-N196 PolarHBondContact O-N 2.89Å; N196-A199 PolarHBondContact O-N 2.83Å; N196-L200 PolarHBondContact O-N 3.44Å |
| 197 | I | 72.4 | Confident | 74.5 | Confident | 40 Ų | 40 | 87.4 Ų | 87.4 | 21% | 0.205 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -73.8 | -33.2 | 177.4 | -72.7 | 172.8 | 0 | 0 | 0 | 111.9 | H193 K195 A199 H210 W214 | H193-I197 PolarHBondContact O-N 3.32Å; K195-I197 VanDerWaalsContact C-N 3.33Å; K195-I197 PolarHBondContact O-N 2.87Å; I197-A199 PolarHBondContact O-N 2.97Å; I197-H210 VanDerWaalsContact CD1-CE1 3.45Å; I197-H210 WeakPolarHBondContact CD1-CE1 3.42Å; I197-W214 HydrophobicContact CB-CZ3 3.93Å; I197-W214 HydrophobicContact CD1-CE3 4.27Å; I197-W214 HydrophobicContact CD1-CH2 3.64Å; I197-W214 HydrophobicContact CD1-CZ3 3.26Å; I197-W214 HydrophobicContact CG1-CH2 4.41Å; I197-W214 HydrophobicContact CG1-CZ3 4.04Å; I197-W214 HydrophobicContact CG2-CZ3 4.29Å |
| 198 | A | 73.1 | Confident | 73.8 | Confident | 80 Ų | 80 | 87.5 Ų | 87.5 | 66% | 0.661 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.6 | -28.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A194 K195 | A194-A198 WeakPolarHBondContact O-CB 3.31Å; A194-A198 PolarHBondContact O-N 2.96Å; A194-A198 VanDerWaalsContact O-N 3.13Å; K195-A198 PolarHBondContact O-N 2.91Å |
| 199 | A | 76.3 | Confident | 73.2 | Confident | 83 Ų | 83 | 89.2 Ų | 89.2 | 69% | 0.686 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -82.3 | -19 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | K195 N196 I197 | K195-A199 PolarHBondContact O-N 3.45Å; K195-A199 VanDerWaalsContact O-N 3.14Å; N196-A199 PolarHBondContact O-N 2.83Å; I197-A199 PolarHBondContact O-N 2.97Å |
| 200 | L | 76.3 | Confident | 72.8 | Confident | 107 Ų | 107 | 91.6 Ų | 91.6 | 56% | 0.56 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -73.8 | 130.5 | -179.4 | -82.2 | 157.5 | 0 | 0 | 0 | 111.4 | N196 K207 | N196-L200 PolarHBondContact O-N 3.44Å; L200-K207 WeakPolarHBondContact O-CE 3.46Å; L200-K207 PolarHBondContact O-NZ 3.44Å |
| 201 | P | 64.1 | Low | 72.6 | Confident | 126 Ų | 126 | 97.8 Ų | 97.8 | 82% | 0.818 | 55% | 0.546 | S | S | * | . | trans | -74 | 125.3 | 168 | 30.1 | -31.2 | 0 | 0 | 0 | 108.9 | ||||
| 202 | G | 62.7 | Low | 72.2 | Confident | 45 Ų | 45 | 99.1 Ų | 99.1 | 46% | 0.464 | 55% | 0.551 | S | S | . | * | trans | -175.7 | 148.4 | -173 | 0 | 0 | 0 | 0 | 0 | 112.4 | K207 | G202-K207 VanDerWaalsContact N-NZ 3.16Å; G202-K207 VanDerWaalsContact O-CD 3.27Å; G202-K207 WeakPolarHBondContact O-CD 3.14Å; G202-K207 WeakPolarHBondContact O-CE 3.2Å; G202-K207 PolarHBondContact O-NZ 3.41Å | ||
| 203 | G | 63.7 | Low | 71.8 | Confident | 61 Ų | 61 | 102.1 Ų | 102.1 | 63% | 0.629 | 56% | 0.557 | S | S | * | * | trans | -57.6 | 139.1 | -171.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | R205 | G203-R205 VanDerWaalsContact C-N 3.28Å; G203-R205 PolarHBondContact O-N 2.8Å; G203-R205 VanDerWaalsContact O-N 3.13Å | ||
| 204 | G | 66.8 | Low | 71.4 | Confident | 60 Ų | 60 | 100.6 Ų | 100.6 | 62% | 0.619 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -60.4 | -25.5 | -167.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | S208 | G204-S208 VanDerWaalsContact O-CB 3.31Å; G204-S208 WeakPolarHBondContact O-CB 3.41Å; G204-S208 PolarHBondContact O-N 3.38Å; G204-S208 VanDerWaalsContact O-N 3.14Å; G204-S208 PolarHBondContact O-OG 3Å |
| 205 | R | 66.8 | Low | 71.3 | Confident | 221 Ų | 221 | 100.1 Ų | 100.1 | 83% | 0.834 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -71.6 | -53.7 | -178.1 | -86.2 | 173.2 | 77.1 | 144.7 | -2.8 | 113 | G203 K207 S208 Q209 | G203-R205 VanDerWaalsContact C-N 3.28Å; G203-R205 PolarHBondContact O-N 2.8Å; G203-R205 VanDerWaalsContact O-N 3.13Å; R205-K207 VanDerWaalsContact C-N 3.34Å; R205-K207 PolarHBondContact O-N 2.93Å; R205-S208 PolarHBondContact O-N 2.96Å; R205-S208 PolarHBondContact O-OG 3.13Å; R205-Q209 PolarHBondContact O-N 3.41Å; R205-Q209 VanDerWaalsContact O-N 3.15Å |
| 206 | D | 68.8 | Low | 71 | Confident | 128 Ų | 128 | 96.9 Ų | 96.9 | 68% | 0.684 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -65.8 | -36.6 | -179.4 | -80.4 | -21.1 | 0 | 0 | 0 | 112.5 | Q209 H210 | D206-Q209 PolarHBondContact O-N 2.95Å; D206-H210 WeakPolarHBondContact O-CB 3.28Å; D206-H210 PolarHBondContact O-N 2.93Å |
| 207 | K | 69.1 | Low | 70.8 | Confident | 66 Ų | 66 | 94.5 Ų | 94.5 | 29% | 0.287 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.8 | -45.4 | 172.7 | -74.3 | -174.8 | 174.2 | 173 | 0 | 112.2 | L200 G202 R205 Q209 H210 Q211 | L200-K207 WeakPolarHBondContact O-CE 3.46Å; L200-K207 PolarHBondContact O-NZ 3.44Å; G202-K207 VanDerWaalsContact N-NZ 3.16Å; G202-K207 VanDerWaalsContact O-CD 3.27Å; G202-K207 WeakPolarHBondContact O-CD 3.14Å; G202-K207 WeakPolarHBondContact O-CE 3.2Å; G202-K207 PolarHBondContact O-NZ 3.41Å; R205-K207 VanDerWaalsContact C-N 3.34Å; R205-K207 PolarHBondContact O-N 2.93Å; K207-Q209 PolarHBondContact O-N 3.47Å; K207-H210 PolarHBondContact O-N 3.3Å; K207-Q211 WeakPolarHBondContact O-CB 3.37Å; K207-Q211 PolarHBondContact O-N 2.82Å |
| 208 | S | 69.7 | Low | 71.1 | Confident | 55 Ų | 55 | 94.9 Ų | 94.9 | 39% | 0.385 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.5 | -38.6 | -179.2 | 74.8 | 0 | 0 | 0 | 0 | 112.6 | G204 R205 R212 | G204-S208 VanDerWaalsContact O-CB 3.31Å; G204-S208 WeakPolarHBondContact O-CB 3.41Å; G204-S208 PolarHBondContact O-N 3.38Å; G204-S208 VanDerWaalsContact O-N 3.14Å; G204-S208 PolarHBondContact O-OG 3Å; R205-S208 PolarHBondContact O-N 2.96Å; R205-S208 PolarHBondContact O-OG 3.13Å; S208-R212 WeakPolarHBondContact O-CB 3.35Å; S208-R212 VanDerWaalsContact O-CG 3.28Å; S208-R212 WeakPolarHBondContact O-CG 3.38Å; S208-R212 PolarHBondContact O-N 3.11Å |
| 209 | Q | 73.4 | Confident | 71.5 | Confident | 139 Ų | 139 | 100.3 Ų | 100.3 | 65% | 0.65 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -71.4 | -43.8 | 178.6 | -174.7 | 172.7 | -9.5 | 0 | 0 | 111.6 | R205 D206 K207 Q211 R212 R213 | R205-Q209 PolarHBondContact O-N 3.41Å; R205-Q209 VanDerWaalsContact O-N 3.15Å; D206-Q209 PolarHBondContact O-N 2.95Å; K207-Q209 PolarHBondContact O-N 3.47Å; Q209-Q211 VanDerWaalsContact C-N 3.34Å; Q209-Q211 PolarHBondContact O-N 2.92Å; Q209-R212 PolarHBondContact O-N 3.05Å; Q209-R213 PolarHBondContact O-N 2.82Å |
| 210 | H | 70.9 | Confident | 71.6 | Confident | 99 Ų | 99 | 97.3 Ų | 97.3 | 46% | 0.458 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.8 | -45.1 | 174.7 | -165.3 | 166.4 | 0 | 0 | 0 | 110.8 | I197 D206 K207 R212 R213 W214 | I197-H210 VanDerWaalsContact CD1-CE1 3.45Å; I197-H210 WeakPolarHBondContact CD1-CE1 3.42Å; D206-H210 WeakPolarHBondContact O-CB 3.28Å; D206-H210 PolarHBondContact O-N 2.93Å; K207-H210 PolarHBondContact O-N 3.3Å; H210-R212 PolarHBondContact O-N 3.47Å; H210-R213 PolarHBondContact O-N 3.06Å; H210-W214 WeakPolarHBondContact O-CB 3.35Å; H210-W214 PolarHBondContact O-N 3.4Å |
| 211 | Q | 74.3 | Confident | 71.8 | Confident | 132 Ų | 132 | 92.2 Ų | 92.2 | 62% | 0.617 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.2 | -35.4 | -179.7 | -167.3 | 149 | -8.2 | 0 | 0 | 113 | K207 Q209 G215 | K207-Q211 WeakPolarHBondContact O-CB 3.37Å; K207-Q211 PolarHBondContact O-N 2.82Å; Q209-Q211 VanDerWaalsContact C-N 3.34Å; Q209-Q211 PolarHBondContact O-N 2.92Å; Q211-G215 PolarHBondContact O-N 3.37Å |
| 212 | R | 72.8 | Confident | 72.8 | Confident | 200 Ų | 200 | 90.1 Ų | 90.1 | 76% | 0.755 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -65.2 | -48.4 | 171.9 | -76.2 | 176.1 | -176.2 | -167.7 | 2.3 | 112.3 | S208 Q209 H210 W214 G215 S216 | S208-R212 WeakPolarHBondContact O-CB 3.35Å; S208-R212 VanDerWaalsContact O-CG 3.28Å; S208-R212 WeakPolarHBondContact O-CG 3.38Å; S208-R212 PolarHBondContact O-N 3.11Å; Q209-R212 PolarHBondContact O-N 3.05Å; H210-R212 PolarHBondContact O-N 3.47Å; R212-W214 VanDerWaalsContact C-N 3.25Å; R212-W214 PolarHBondContact O-N 3.42Å; R212-G215 PolarHBondContact O-N 2.96Å; R212-S216 PolarHBondContact O-N 3.21Å |
| 213 | R | 72.4 | Confident | 74 | Confident | 145 Ų | 145 | 88.1 Ų | 88.1 | 55% | 0.547 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.7 | -40.1 | 178.1 | -169.7 | 175 | -177.7 | -177.4 | -0.8 | 111 | Q209 H210 S216 N217 | Q209-R213 PolarHBondContact O-N 2.82Å; H210-R213 PolarHBondContact O-N 3.06Å; R213-S216 PolarHBondContact O-N 3.43Å; R213-N217 PolarHBondContact O-N 3.23Å; R213-N217 PolarHBondContact O-OD1 3.26Å |
| 214 | W | 70.3 | Confident | 74.9 | Confident | 40 Ų | 40 | 85.2 Ų | 85.2 | 15% | 0.152 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -67.3 | -45.3 | 176 | -163.1 | -7.5 | 0 | 0 | 0 | 113.4 | A190 H193 A194 I197 H210 R212 S216 N217 M218 | A190-W214 VanDerWaalsContact O-CZ2 3.31Å; A190-W214 WeakPolarHBondContact O-CZ2 3.38Å; H193-W214 HydrophobicContact CB-CH2 3.37Å; H193-W214 HydrophobicContact CB-CZ2 3.5Å; H193-W214 WeakPolarHBondContact O-CH2 3.16Å; A194-W214 HydrophobicContact CB-CH2 3.93Å; A194-W214 HydrophobicContact CB-CZ2 3.94Å; A194-W214 HydrophobicContact CB-CZ3 4.27Å; I197-W214 HydrophobicContact CB-CZ3 3.93Å; I197-W214 HydrophobicContact CD1-CE3 4.27Å; I197-W214 HydrophobicContact CD1-CH2 3.64Å; I197-W214 HydrophobicContact CD1-CZ3 3.26Å; I197-W214 HydrophobicContact CG1-CH2 4.41Å; I197-W214 HydrophobicContact CG1-CZ3 4.04Å; I197-W214 HydrophobicContact CG2-CZ3 4.29Å; H210-W214 WeakPolarHBondContact O-CB 3.35Å; H210-W214 PolarHBondContact O-N 3.4Å; R212-W214 VanDerWaalsContact C-N 3.25Å; R212-W214 PolarHBondContact O-N 3.42Å; W214-S216 PolarHBondContact O-N 2.84Å; W214-N217 PolarHBondContact O-N 2.91Å; W214-N217 VanDerWaalsContact O-N 3.16Å; W214-M218 WeakPolarHBondContact O-CB 3.28Å; W214-M218 PolarHBondContact O-N 3.33Å |
| 215 | G | 74.3 | Confident | 75.8 | Confident | 33 Ų | 33 | 84.4 Ų | 84.4 | 34% | 0.34 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -56 | -39.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q211 R212 R219 | Q211-G215 PolarHBondContact O-N 3.37Å; R212-G215 PolarHBondContact O-N 2.96Å; G215-R219 WeakPolarHBondContact O-CG 3.45Å; G215-R219 PolarHBondContact O-N 3.28Å; G215-R219 VanDerWaalsContact O-N 3.08Å |
| 216 | S | 74.4 | Confident | 76.9 | Confident | 80 Ų | 80 | 77.2 Ų | 77.2 | 56% | 0.559 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -64.2 | -50.6 | 174 | -164.7 | 0 | 0 | 0 | 0 | 112.4 | R212 R213 W214 M218 R219 G220 | R212-S216 PolarHBondContact O-N 3.21Å; R213-S216 PolarHBondContact O-N 3.43Å; W214-S216 PolarHBondContact O-N 2.84Å; S216-M218 VanDerWaalsContact C-N 3.29Å; S216-M218 PolarHBondContact O-N 3.48Å; S216-R219 PolarHBondContact O-N 3.05Å; S216-G220 PolarHBondContact O-N 2.87Å; S216-G220 VanDerWaalsContact O-N 3.14Å |
| 217 | N | 75.1 | Confident | 77.9 | Confident | 44 Ų | 44 | 71.1 Ų | 71.1 | 24% | 0.235 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61.2 | -37.8 | 179.6 | -71.3 | 1.5 | 0 | 0 | 0 | 112.2 | I122 R213 W214 G220 A221 | I122-N217 HydrophobicContact CG1-CB 4.3Å; R213-N217 PolarHBondContact O-N 3.23Å; R213-N217 PolarHBondContact O-OD1 3.26Å; W214-N217 PolarHBondContact O-N 2.91Å; W214-N217 VanDerWaalsContact O-N 3.16Å; N217-G220 PolarHBondContact O-N 2.99Å; N217-A221 PolarHBondContact O-N 3.05Å |
| 218 | M | 78.7 | Confident | 78.8 | Confident | 49 Ų | 49 | 68.8 Ų | 68.8 | 24% | 0.241 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -68.4 | -38.3 | 177.1 | -178.5 | 59.9 | 75.3 | 0 | 0 | 112.4 | F187 A190 W214 S216 G220 A221 L222 | F187-M218 HydrophobicContact CD1-SD 3.88Å; F187-M218 HydrophobicContact CE1-SD 3.69Å; A190-M218 HydrophobicContact CB-CE 3.32Å; W214-M218 WeakPolarHBondContact O-CB 3.28Å; W214-M218 PolarHBondContact O-N 3.33Å; S216-M218 VanDerWaalsContact C-N 3.29Å; S216-M218 PolarHBondContact O-N 3.48Å; M218-G220 VanDerWaalsContact C-N 3.27Å; M218-G220 PolarHBondContact O-N 2.85Å; M218-A221 WeakPolarHBondContact O-CB 3.38Å; M218-A221 PolarHBondContact O-N 3.14Å; M218-A221 HydrophobicContact SD-CB 4.45Å; M218-L222 PolarHBondContact O-N 3.42Å |
| 219 | R | 80.9 | Confident | 79.8 | Confident | 193 Ų | 193 | 67.8 Ų | 67.8 | 73% | 0.728 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -60.9 | -39.7 | 172.8 | -76 | 173.6 | 179.1 | -174 | -0.2 | 111.4 | G215 S216 L222 T223 | G215-R219 WeakPolarHBondContact O-CG 3.45Å; G215-R219 PolarHBondContact O-N 3.28Å; G215-R219 VanDerWaalsContact O-N 3.08Å; S216-R219 PolarHBondContact O-N 3.05Å; R219-L222 PolarHBondContact O-N 3.31Å; R219-T223 PolarHBondContact O-N 3.44Å; R219-T223 VanDerWaalsContact O-N 3.13Å; R219-T223 PolarHBondContact O-OG1 3.3Å |
| 220 | G | 78.9 | Confident | 80.7 | Confident | 21 Ų | 21 | 62 Ų | 62 | 22% | 0.216 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.2 | -49.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S216 N217 M218 L222 T223 L224 | S216-G220 PolarHBondContact O-N 2.87Å; S216-G220 VanDerWaalsContact O-N 3.14Å; N217-G220 PolarHBondContact O-N 2.99Å; M218-G220 VanDerWaalsContact C-N 3.27Å; M218-G220 PolarHBondContact O-N 2.85Å; G220-L222 PolarHBondContact O-N 3.35Å; G220-T223 WeakPolarHBondContact O-CB 3.34Å; G220-T223 PolarHBondContact O-N 3.31Å; G220-L224 WeakPolarHBondContact O-CG 3.46Å; G220-L224 PolarHBondContact O-N 3.16Å |
| 221 | A | 80.6 | Confident | 81.6 | Confident | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.2 | -46.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | I122 M186 N217 M218 T223 L224 T225 | I122-A221 HydrophobicContact CD1-CB 4.17Å; M186-A221 HydrophobicContact CE-CB 3.53Å; M186-A221 HydrophobicContact SD-CB 4.04Å; N217-A221 PolarHBondContact O-N 3.05Å; M218-A221 WeakPolarHBondContact O-CB 3.38Å; M218-A221 PolarHBondContact O-N 3.14Å; M218-A221 HydrophobicContact SD-CB 4.45Å; A221-T223 VanDerWaalsContact C-N 3.32Å; A221-T223 PolarHBondContact O-N 2.99Å; A221-L224 WeakPolarHBondContact O-CB 3.18Å; A221-L224 PolarHBondContact O-N 3.09Å; A221-L224 VanDerWaalsContact O-N 3.12Å; A221-T225 PolarHBondContact O-N 2.93Å; A221-T225 VanDerWaalsContact O-N 3.09Å; A221-T225 PolarHBondContact O-OG1 3.29Å; A221-T225 VanDerWaalsContact O-OG1 3.05Å |
| 222 | L | 85.3 | Confident | 82.5 | Confident | 82 Ų | 82 | 53.1 Ų | 53.1 | 43% | 0.429 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.6 | -42.2 | 177.8 | -178.6 | 67 | 0 | 0 | 0 | 112.2 | M218 R219 G220 L224 T225 I226 R282 | M218-L222 PolarHBondContact O-N 3.42Å; R219-L222 PolarHBondContact O-N 3.31Å; G220-L222 PolarHBondContact O-N 3.35Å; L222-L224 PolarHBondContact O-N 3.13Å; L222-T225 WeakPolarHBondContact O-CB 3.3Å; L222-T225 PolarHBondContact O-N 3.37Å; L222-I226 HydrophobicContact CG-CD1 4.46Å; L222-I226 WeakPolarHBondContact O-CG1 3.24Å; L222-I226 PolarHBondContact O-N 2.91Å; L222-I226 VanDerWaalsContact O-N 3.13Å; L222-R282 VanDerWaalsContact CD2-NH2 3.31Å; L222-R282 VanDerWaalsContact CG-NH2 3.33Å |
| 223 | T | 86.1 | Confident | 83.4 | Confident | 3 Ų | 3 | 48.2 Ų | 48.2 | 2% | 0.018 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60 | -39.1 | 177.2 | -60 | 0 | 0 | 0 | 0 | 111.4 | R219 G220 A221 I226 L227 I278 R282 M283 | R219-T223 PolarHBondContact O-N 3.44Å; R219-T223 VanDerWaalsContact O-N 3.13Å; R219-T223 PolarHBondContact O-OG1 3.3Å; G220-T223 WeakPolarHBondContact O-CB 3.34Å; G220-T223 PolarHBondContact O-N 3.31Å; A221-T223 VanDerWaalsContact C-N 3.32Å; A221-T223 PolarHBondContact O-N 2.99Å; T223-I226 PolarHBondContact O-N 3.34Å; T223-L227 WeakPolarHBondContact O-CG 3.22Å; T223-L227 PolarHBondContact O-N 3.26Å; T223-I278 HydrophobicContact CG2-CG2 3.73Å; T223-R282 HydrophobicContact CG2-CB 3.43Å; T223-R282 VanDerWaalsContact CG2-CB 3.43Å; T223-R282 HydrophobicContact CG2-CG 3.95Å; T223-R282 WeakPolarHBondContact OG1-CB 3.45Å; T223-R282 PolarHBondContact OG1-NE 2.85Å; T223-R282 VanDerWaalsContact OG1-NE 3.16Å; T223-R282 PolarHBondContact OG1-NH2 3.06Å; T223-M283 HydrophobicContact CG2-CE 3.66Å |
| 224 | L | 83.3 | Confident | 84.4 | Confident | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -70.9 | -32.2 | 178.5 | -63.5 | 172.9 | 0 | 0 | 0 | 113.7 | M53 I114 R118 Y183 G220 A221 L222 I226 L227 F228 | M53-L224 HydrophobicContact CE-CD2 3.74Å; I114-L224 HydrophobicContact CG2-CD1 3.54Å; I114-L224 HydrophobicContact CG2-CD2 3.43Å; I114-L224 VanDerWaalsContact CG2-CD2 3.43Å; I114-L224 HydrophobicContact CG2-CG 4.07Å; R118-L224 HydrophobicContact CB-CD1 4.39Å; R118-L224 HydrophobicContact CG-CD1 3.16Å; R118-L224 VanDerWaalsContact NE-CD1 3.26Å; Y183-L224 HydrophobicContact CE1-CB 4.08Å; G220-L224 WeakPolarHBondContact O-CG 3.46Å; G220-L224 PolarHBondContact O-N 3.16Å; A221-L224 WeakPolarHBondContact O-CB 3.18Å; A221-L224 PolarHBondContact O-N 3.09Å; A221-L224 VanDerWaalsContact O-N 3.12Å; L222-L224 PolarHBondContact O-N 3.13Å; L224-I226 VanDerWaalsContact C-N 3.29Å; L224-L227 HydrophobicContact CD2-CD1 3.65Å; L224-L227 PolarHBondContact O-N 3.44Å; L224-F228 WeakPolarHBondContact O-CB 3.34Å; L224-F228 PolarHBondContact O-N 3.35Å |
| 225 | T | 86.9 | Confident | 85.4 | Confident | 43 Ų | 43 | 40.6 Ų | 40.6 | 26% | 0.264 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.9 | -36.9 | 172 | -47.8 | 0 | 0 | 0 | 0 | 111.7 | F187 A221 L222 G229 | F187-T225 HydrophobicContact CE2-CG2 4Å; F187-T225 WeakPolarHBondContact CE2-OG1 3.47Å; F187-T225 HydrophobicContact CZ-CG2 4.46Å; F187-T225 WeakPolarHBondContact CZ-OG1 3.49Å; A221-T225 PolarHBondContact O-N 2.93Å; A221-T225 VanDerWaalsContact O-N 3.09Å; A221-T225 PolarHBondContact O-OG1 3.29Å; A221-T225 VanDerWaalsContact O-OG1 3.05Å; L222-T225 WeakPolarHBondContact O-CB 3.3Å; L222-T225 PolarHBondContact O-N 3.37Å; T225-G229 PolarHBondContact O-N 2.88Å |
| 226 | I | 89.6 | Confident | 86.3 | Confident | 70 Ų | 70 | 40.6 Ų | 40.6 | 36% | 0.359 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.5 | -45.3 | 174.7 | -62.8 | 167.4 | 0 | 0 | 0 | 110.2 | L222 T223 L224 F228 G229 A230 I278 | L222-I226 HydrophobicContact CG-CD1 4.46Å; L222-I226 WeakPolarHBondContact O-CG1 3.24Å; L222-I226 PolarHBondContact O-N 2.91Å; L222-I226 VanDerWaalsContact O-N 3.13Å; T223-I226 PolarHBondContact O-N 3.34Å; L224-I226 VanDerWaalsContact C-N 3.29Å; I226-F228 PolarHBondContact O-N 3.14Å; I226-G229 PolarHBondContact O-N 2.81Å; I226-A230 PolarHBondContact O-N 3.41Å; I226-I278 HydrophobicContact CG2-CD1 3.84Å; I226-I278 HydrophobicContact CG2-CG1 4.42Å |
| 227 | L | 89.3 | Confident | 87.2 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -58.1 | -48.7 | 176 | -65.2 | 164.8 | 0 | 0 | 0 | 111.5 | F111 T223 L224 G229 A230 F231 D275 I278 Y279 | F111-L227 HydrophobicContact CE1-CB 3.73Å; F111-L227 HydrophobicContact CZ-CB 4.23Å; T223-L227 WeakPolarHBondContact O-CG 3.22Å; T223-L227 PolarHBondContact O-N 3.26Å; L224-L227 HydrophobicContact CD2-CD1 3.65Å; L224-L227 PolarHBondContact O-N 3.44Å; L227-G229 PolarHBondContact O-N 3.41Å; L227-A230 WeakPolarHBondContact O-CB 3.23Å; L227-A230 PolarHBondContact O-N 2.93Å; L227-F231 PolarHBondContact O-N 3.16Å; L227-D275 HydrophobicContact CD2-CB 4.31Å; L227-D275 WeakPolarHBondContact CD2-OD1 3.32Å; L227-I278 HydrophobicContact CD2-CB 3.62Å; L227-I278 HydrophobicContact CD2-CD1 3.71Å; L227-I278 HydrophobicContact CD2-CG1 4.28Å; L227-I278 HydrophobicContact CD2-CG2 3.54Å; L227-I278 HydrophobicContact CG-CB 4.46Å; L227-I278 HydrophobicContact CG-CD1 4.36Å; L227-I278 HydrophobicContact CG-CG2 3.85Å; L227-Y279 HydrophobicContact CD1-CD1 4.21Å; L227-Y279 HydrophobicContact CD1-CE1 3.38Å; L227-Y279 HydrophobicContact CD2-CD1 4.35Å; L227-Y279 HydrophobicContact CD2-CE1 3.85Å; L227-Y279 HydrophobicContact CG-CE1 4.29Å |
| 228 | F | 87.7 | Confident | 87.9 | Confident | 17 Ų | 17 | 37.8 Ų | 37.8 | 8% | 0.075 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.8 | -38.5 | 178.4 | 176.4 | -112.5 | 0 | 0 | 0 | 112.8 | L176 I179 C180 Y183 L224 I226 A230 F231 V232 | L176-F228 HydrophobicContact CD2-CE2 3.67Å; L176-F228 HydrophobicContact CD2-CZ 3.82Å; I179-F228 HydrophobicContact CB-CD2 4.32Å; I179-F228 HydrophobicContact CB-CE1 4.5Å; I179-F228 HydrophobicContact CB-CE2 3.71Å; I179-F228 HydrophobicContact CB-CZ 3.8Å; I179-F228 HydrophobicContact CD1-CE2 4Å; I179-F228 HydrophobicContact CG1-CE2 4.47Å; I179-F228 HydrophobicContact CG2-CD1 4.1Å; I179-F228 HydrophobicContact CG2-CD2 3.49Å; I179-F228 VanDerWaalsContact CG2-CD2 3.49Å; I179-F228 HydrophobicContact CG2-CE1 4Å; I179-F228 HydrophobicContact CG2-CE2 3.38Å; I179-F228 HydrophobicContact CG2-CG 3.85Å; I179-F228 HydrophobicContact CG2-CZ 3.64Å; C180-F228 HydrophobicContact CB-CE1 4.18Å; C180-F228 HydrophobicContact CB-CZ 4.49Å; Y183-F228 HydrophobicContact CD2-CB 4.21Å; Y183-F228 AromaticContact CD2-CD1 3.75Å; Y183-F228 HydrophobicContact CD2-CD1 3.75Å; Y183-F228 HydrophobicContact CD2-CE1 4.37Å; Y183-F228 HydrophobicContact CD2-CG 4.06Å; Y183-F228 HydrophobicContact CE2-CB 3.49Å; Y183-F228 VanDerWaalsContact CE2-CB 3.49Å; Y183-F228 AromaticContact CE2-CD1 3.83Å; Y183-F228 HydrophobicContact CE2-CD1 3.83Å; Y183-F228 HydrophobicContact CE2-CD2 4.36Å; Y183-F228 AromaticContact CE2-CG 3.63Å; Y183-F228 HydrophobicContact CE2-CG 3.63Å; L224-F228 WeakPolarHBondContact O-CB 3.34Å; L224-F228 PolarHBondContact O-N 3.35Å; I226-F228 PolarHBondContact O-N 3.14Å; F228-A230 VanDerWaalsContact C-N 3.33Å; F228-A230 PolarHBondContact O-N 3.05Å; F228-F231 HydrophobicContact CD2-CD1 4.48Å; F228-F231 HydrophobicContact CE2-CD1 4.47Å; F228-F231 WeakPolarHBondContact O-CB 3.38Å; F228-F231 PolarHBondContact O-N 3.42Å; F228-V232 HydrophobicContact CD2-CG2 4.45Å; F228-V232 HydrophobicContact CE1-CG2 4.05Å; F228-V232 HydrophobicContact CE2-CG2 3.99Å; F228-V232 HydrophobicContact CZ-CG2 3.77Å; F228-V232 WeakPolarHBondContact O-CG2 3.44Å; F228-V232 PolarHBondContact O-N 2.97Å |
| 229 | G | 90.5 | Very high | 88.6 | Confident | 33 Ų | 33 | 35.8 Ų | 35.8 | 34% | 0.34 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -60.5 | -43.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T225 I226 L227 V232 V233 | T225-G229 PolarHBondContact O-N 2.88Å; I226-G229 PolarHBondContact O-N 2.81Å; L227-G229 PolarHBondContact O-N 3.41Å; G229-V232 PolarHBondContact O-N 3.27Å; G229-V233 WeakPolarHBondContact O-CG2 3.36Å; G229-V233 PolarHBondContact O-N 3.13Å |
| 230 | A | 92.1 | Very high | 89.1 | Confident | 18 Ų | 18 | 29.7 Ų | 29.7 | 15% | 0.149 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62.6 | -43.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | I226 L227 F228 V232 V233 C234 I274 | I226-A230 PolarHBondContact O-N 3.41Å; L227-A230 WeakPolarHBondContact O-CB 3.23Å; L227-A230 PolarHBondContact O-N 2.93Å; F228-A230 VanDerWaalsContact C-N 3.33Å; F228-A230 PolarHBondContact O-N 3.05Å; A230-V232 PolarHBondContact O-N 3.19Å; A230-V233 PolarHBondContact O-N 3.3Å; A230-C234 WeakPolarHBondContact O-CB 3.43Å; A230-C234 PolarHBondContact O-N 3.2Å; A230-C234 PolarHBondContact O-SG 2.93Å; A230-I274 HydrophobicContact CB-CG2 3.62Å |
| 231 | F | 91.1 | Very high | 89.7 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -54.3 | -49.8 | 172.4 | 177.8 | -93.9 | 0 | 0 | 0 | 112.1 | F104 I108 F111 F172 L176 L227 F228 V233 C234 W235 H271 | F104-F231 HydrophobicContact CD2-CE2 4.46Å; F104-F231 HydrophobicContact CD2-CZ 4.18Å; F104-F231 HydrophobicContact CE2-CE2 4.43Å; F104-F231 AromaticContact CE2-CZ 3.73Å; F104-F231 HydrophobicContact CE2-CZ 3.73Å; I108-F231 HydrophobicContact CD1-CE1 4.34Å; I108-F231 HydrophobicContact CD1-CZ 3.98Å; I108-F231 HydrophobicContact CG1-CE1 3.85Å; I108-F231 HydrophobicContact CG1-CE2 4.3Å; I108-F231 HydrophobicContact CG1-CZ 3.39Å; F111-F231 HydrophobicContact CD2-CB 4.49Å; F111-F231 HydrophobicContact CD2-CD2 4.15Å; F111-F231 HydrophobicContact CD2-CG 4.19Å; F111-F231 HydrophobicContact CE2-CB 3.79Å; F111-F231 AromaticContact CE2-CD2 3.66Å; F111-F231 HydrophobicContact CE2-CD2 3.66Å; F111-F231 HydrophobicContact CE2-CE2 4.45Å; F111-F231 AromaticContact CE2-CG 3.8Å; F111-F231 HydrophobicContact CE2-CG 3.8Å; F111-F231 HydrophobicContact CZ-CB 4.16Å; F172-F231 HydrophobicContact CE2-CE1 4.06Å; F172-F231 HydrophobicContact CE2-CZ 4.47Å; L176-F231 HydrophobicContact CD2-CD1 4.17Å; L176-F231 HydrophobicContact CD2-CE1 3.95Å; L227-F231 PolarHBondContact O-N 3.16Å; F228-F231 HydrophobicContact CD2-CD1 4.48Å; F228-F231 HydrophobicContact CE2-CD1 4.47Å; F228-F231 WeakPolarHBondContact O-CB 3.38Å; F228-F231 PolarHBondContact O-N 3.42Å; F231-V233 PolarHBondContact O-N 3.2Å; F231-C234 PolarHBondContact O-N 3.42Å; F231-W235 AromaticContact CD2-CD1 3.28Å; F231-W235 HydrophobicContact CD2-CG 4.18Å; F231-W235 AromaticContact CD2-NE1 3.45Å; F231-W235 AromaticContact CE2-CD1 3.28Å; F231-W235 HydrophobicContact CE2-CD2 4.18Å; F231-W235 AromaticContact CE2-CE2 3.89Å; F231-W235 AromaticContact CE2-CG 3.83Å; F231-W235 HydrophobicContact CE2-CG 3.83Å; F231-W235 AromaticContact CE2-NE1 3.3Å; F231-W235 VanDerWaalsContact CE2-NE1 3.3Å; F231-W235 AromaticContact CG-CD1 3.89Å; F231-W235 HydrophobicContact CZ-CB 4.46Å; F231-W235 AromaticContact CZ-CD1 3.89Å; F231-W235 HydrophobicContact CZ-CD2 4.46Å; F231-W235 HydrophobicContact CZ-CG 4.02Å; F231-W235 WeakPolarHBondContact O-CB 3.35Å; F231-W235 VanDerWaalsContact O-CD1 3.22Å; F231-W235 PolarHBondContact O-N 2.86Å; F231-H271 VanDerWaalsContact CA-CD2 3.42Å; F231-H271 WeakPolarHBondContact CA-CD2 3.12Å; F231-H271 WeakPolarHBondContact CB-NE2 3.27Å; F231-H271 AromaticContact CD2-CD2 3.93Å; F231-H271 AromaticContact CD2-CE1 3.68Å; F231-H271 AromaticContact CD2-NE2 3.42Å; F231-H271 WeakPolarHBondContact CD2-NE2 3.31Å; F231-H271 AromaticContact CG-NE2 3.93Å |
| 232 | V | 91.6 | Very high | 90.1 | Very high | 44 Ų | 44 | 29.7 Ų | 29.7 | 27% | 0.267 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -60.9 | -47.1 | 179.4 | 174.2 | 0 | 0 | 0 | 0 | 111.5 | L176 F228 G229 A230 C234 W235 A236 | L176-V232 HydrophobicContact CD1-CG2 4.39Å; L176-V232 HydrophobicContact CD2-CG2 3.72Å; F228-V232 HydrophobicContact CD2-CG2 4.45Å; F228-V232 HydrophobicContact CE1-CG2 4.05Å; F228-V232 HydrophobicContact CE2-CG2 3.99Å; F228-V232 HydrophobicContact CZ-CG2 3.77Å; F228-V232 WeakPolarHBondContact O-CG2 3.44Å; F228-V232 PolarHBondContact O-N 2.97Å; G229-V232 PolarHBondContact O-N 3.27Å; A230-V232 PolarHBondContact O-N 3.19Å; V232-C234 VanDerWaalsContact C-N 3.31Å; V232-C234 PolarHBondContact O-N 2.87Å; V232-W235 PolarHBondContact O-N 3.38Å; V232-A236 WeakPolarHBondContact O-CB 3.46Å; V232-A236 PolarHBondContact O-N 3.4Å |
| 233 | V | 93 | Very high | 90.5 | Very high | 98 Ų | 98 | 28.6 Ų | 28.6 | 59% | 0.594 | 17% | 0.174 | S | C | * | . | H | α-helix | trans | -62.3 | -39.9 | -179.3 | 170.8 | 0 | 0 | 0 | 0 | 111.4 | G229 A230 F231 P237 | G229-V233 WeakPolarHBondContact O-CG2 3.36Å; G229-V233 PolarHBondContact O-N 3.13Å; A230-V233 PolarHBondContact O-N 3.3Å; F231-V233 PolarHBondContact O-N 3.2Å; V233-P237 VanDerWaalsContact O-CD 3.25Å; V233-P237 WeakPolarHBondContact O-CD 3.35Å |
| 234 | C | 93.3 | Very high | 90.7 | Very high | 3 Ų | 3 | 29.5 Ų | 29.5 | 2% | 0.02 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -76.7 | -34.7 | -177.3 | -67 | 0 | 0 | 0 | 0 | 113.6 | A230 F231 V232 L267 H271 | A230-C234 WeakPolarHBondContact O-CB 3.43Å; A230-C234 PolarHBondContact O-N 3.2Å; A230-C234 PolarHBondContact O-SG 2.93Å; F231-C234 PolarHBondContact O-N 3.42Å; V232-C234 VanDerWaalsContact C-N 3.31Å; V232-C234 PolarHBondContact O-N 2.87Å; C234-L267 WeakPolarHBondContact CB-O 3.48Å; C234-H271 HydrophobicContact CB-CB 3.74Å |
| 235 | W | 91.8 | Very high | 90.9 | Very high | 22 Ų | 22 | 32.9 Ų | 32.9 | 8% | 0.083 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -94.6 | -30.5 | -174.6 | -74.8 | 89.2 | 0 | 0 | 0 | 114.2 | F104 F172 F231 V232 P237 F238 F239 M268 H271 | F104-W235 HydrophobicContact CB-CH2 3.6Å; F104-W235 HydrophobicContact CB-CZ2 4.31Å; F104-W235 HydrophobicContact CB-CZ3 3.82Å; F104-W235 AromaticContact CD2-CD2 3.62Å; F104-W235 HydrophobicContact CD2-CD2 3.62Å; F104-W235 AromaticContact CD2-CE2 3.91Å; F104-W235 AromaticContact CD2-CE3 3.24Å; F104-W235 HydrophobicContact CD2-CE3 3.24Å; F104-W235 AromaticContact CD2-CH2 3.54Å; F104-W235 HydrophobicContact CD2-CH2 3.54Å; F104-W235 AromaticContact CD2-CZ2 3.89Å; F104-W235 HydrophobicContact CD2-CZ2 3.89Å; F104-W235 AromaticContact CD2-CZ3 3.2Å; F104-W235 HydrophobicContact CD2-CZ3 3.2Å; F104-W235 AromaticContact CE2-CD2 3.85Å; F104-W235 HydrophobicContact CE2-CD2 3.85Å; F104-W235 AromaticContact CE2-CE3 3.54Å; F104-W235 HydrophobicContact CE2-CE3 3.54Å; F104-W235 HydrophobicContact CE2-CG 4.35Å; F104-W235 AromaticContact CE2-CZ3 3.96Å; F104-W235 HydrophobicContact CE2-CZ3 3.96Å; F104-W235 HydrophobicContact CG-CE3 4.19Å; F104-W235 AromaticContact CG-CH2 3.96Å; F104-W235 HydrophobicContact CG-CH2 3.96Å; F104-W235 AromaticContact CG-CZ3 3.72Å; F104-W235 HydrophobicContact CG-CZ3 3.72Å; F172-W235 HydrophobicContact CE2-CB 4.33Å; F172-W235 HydrophobicContact CZ-CB 4.31Å; F231-W235 AromaticContact CD2-CD1 3.28Å; F231-W235 HydrophobicContact CD2-CG 4.18Å; F231-W235 AromaticContact CD2-NE1 3.45Å; F231-W235 AromaticContact CE2-CD1 3.28Å; F231-W235 HydrophobicContact CE2-CD2 4.18Å; F231-W235 AromaticContact CE2-CE2 3.89Å; F231-W235 AromaticContact CE2-CG 3.83Å; F231-W235 HydrophobicContact CE2-CG 3.83Å; F231-W235 AromaticContact CE2-NE1 3.3Å; F231-W235 VanDerWaalsContact CE2-NE1 3.3Å; F231-W235 AromaticContact CG-CD1 3.89Å; F231-W235 HydrophobicContact CZ-CB 4.46Å; F231-W235 AromaticContact CZ-CD1 3.89Å; F231-W235 HydrophobicContact CZ-CD2 4.46Å; F231-W235 HydrophobicContact CZ-CG 4.02Å; F231-W235 WeakPolarHBondContact O-CB 3.35Å; F231-W235 VanDerWaalsContact O-CD1 3.22Å; F231-W235 PolarHBondContact O-N 2.86Å; V232-W235 PolarHBondContact O-N 3.38Å; W235-P237 VanDerWaalsContact C-CD 3.49Å; W235-F238 PolarHBondContact O-N 3.4Å; W235-F238 VanDerWaalsContact O-N 3.17Å; W235-F239 HydrophobicContact CE3-CE2 4.17Å; W235-F239 WeakPolarHBondContact O-CD2 3.37Å; W235-F239 PolarHBondContact O-N 2.87Å; W235-M268 HydrophobicContact CD2-CG 3.92Å; W235-M268 HydrophobicContact CE3-CG 3.68Å; W235-M268 HydrophobicContact CE3-SD 3.86Å; W235-M268 HydrophobicContact CH2-CG 3.62Å; W235-M268 HydrophobicContact CH2-SD 3.71Å; W235-M268 HydrophobicContact CZ2-CG 3.86Å; W235-M268 HydrophobicContact CZ3-CG 3.53Å; W235-M268 HydrophobicContact CZ3-SD 3.31Å; W235-M268 WeakPolarHBondContact CZ3-SD 3.46Å; W235-H271 AromaticContact CD1-CG 3.95Å; W235-H271 AromaticContact NE1-CG 3.42Å; W235-H271 AromaticContact NE1-ND1 3.55Å |
| 236 | A | 91.7 | Very high | 90.9 | Very high | 32 Ų | 32 | 31.8 Ų | 31.8 | 26% | 0.264 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -55.5 | -41.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | V232 F238 F239 V240 | V232-A236 WeakPolarHBondContact O-CB 3.46Å; V232-A236 PolarHBondContact O-N 3.4Å; A236-F238 VanDerWaalsContact C-N 3.3Å; A236-F238 PolarHBondContact O-N 2.91Å; A236-F239 PolarHBondContact O-N 3.44Å; A236-F239 VanDerWaalsContact O-N 3.14Å; A236-V240 WeakPolarHBondContact O-CG2 3.48Å; A236-V240 PolarHBondContact O-N 2.91Å |
| 237 | P | 93.6 | Very high | 90.9 | Very high | 26 Ų | 26 | 34 Ų | 34 | 17% | 0.169 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.8 | -34.5 | -179.7 | -27.2 | 39.6 | 0 | 0 | 0 | 113.7 | V233 W235 V240 H241 Y257 H264 L267 | V233-P237 VanDerWaalsContact O-CD 3.25Å; V233-P237 WeakPolarHBondContact O-CD 3.35Å; W235-P237 VanDerWaalsContact C-CD 3.49Å; P237-V240 PolarHBondContact O-N 3.27Å; P237-H241 PolarHBondContact O-N 3.45Å; P237-Y257 VanDerWaalsContact CA-OH 3.29Å; P237-Y257 WeakPolarHBondContact CA-OH 3.18Å; P237-Y257 PolarHBondContact O-OH 3.5Å; P237-H264 HydrophobicContact CB-CB 4.41Å; P237-H264 WeakPolarHBondContact CB-CD2 3.5Å; P237-L267 HydrophobicContact CB-CD2 4.46Å; P237-L267 HydrophobicContact CG-CD2 3.79Å |
| 238 | F | 91.1 | Very high | 90.8 | Very high | 39 Ų | 39 | 35 Ų | 35 | 17% | 0.171 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -67.2 | -41.6 | 173.8 | -177.7 | -98.6 | 0 | 0 | 0 | 111.8 | W235 A236 V240 H241 L242 F261 M268 | W235-F238 PolarHBondContact O-N 3.4Å; W235-F238 VanDerWaalsContact O-N 3.17Å; A236-F238 VanDerWaalsContact C-N 3.3Å; A236-F238 PolarHBondContact O-N 2.91Å; F238-V240 PolarHBondContact O-N 2.89Å; F238-H241 WeakPolarHBondContact O-CA 3.47Å; F238-H241 WeakPolarHBondContact O-CB 3.45Å; F238-H241 PolarHBondContact O-N 2.92Å; F238-H241 VanDerWaalsContact O-N 3.08Å; F238-L242 HydrophobicContact CD1-CD1 4.11Å; F238-L242 HydrophobicContact CD1-CG 4.37Å; F238-L242 HydrophobicContact CE1-CD1 3.73Å; F238-L242 HydrophobicContact CE1-CD2 4.37Å; F238-L242 HydrophobicContact CE1-CG 4.03Å; F238-L242 HydrophobicContact CZ-CD2 4.41Å; F238-L242 HydrophobicContact CZ-CG 4.47Å; F238-L242 PolarHBondContact O-N 3.36Å; F238-F261 HydrophobicContact CE2-CE2 4.16Å; F238-M268 HydrophobicContact CD1-SD 4.33Å; F238-M268 HydrophobicContact CD2-SD 4.25Å; F238-M268 HydrophobicContact CG-SD 4.12Å |
| 239 | F | 91.6 | Very high | 90.5 | Very high | 7 Ų | 7 | 37.1 Ų | 37.1 | 3% | 0.031 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -67 | -35.7 | 175.5 | -84.6 | -84.6 | 0 | 0 | 0 | 113.3 | F104 F168 I169 F172 W235 A236 H241 L242 V243 | F104-F239 HydrophobicContact CD1-CZ 4.31Å; F104-F239 HydrophobicContact CD2-CE2 4.31Å; F104-F239 HydrophobicContact CE1-CE1 4.44Å; F104-F239 AromaticContact CE1-CE2 3.99Å; F104-F239 HydrophobicContact CE1-CE2 3.99Å; F104-F239 AromaticContact CE1-CZ 3.42Å; F104-F239 HydrophobicContact CE1-CZ 3.42Å; F104-F239 VanDerWaalsContact CE1-CZ 3.42Å; F104-F239 AromaticContact CE2-CE2 3.39Å; F104-F239 HydrophobicContact CE2-CE2 3.39Å; F104-F239 AromaticContact CE2-CZ 3.76Å; F104-F239 HydrophobicContact CE2-CZ 3.76Å; F104-F239 HydrophobicContact CZ-CD2 4.41Å; F104-F239 HydrophobicContact CZ-CE1 4.19Å; F104-F239 AromaticContact CZ-CE2 3.18Å; F104-F239 HydrophobicContact CZ-CE2 3.18Å; F104-F239 AromaticContact CZ-CZ 3.05Å; F104-F239 HydrophobicContact CZ-CZ 3.05Å; F168-F239 AromaticContact CD1-CE1 3.88Å; F168-F239 HydrophobicContact CD1-CE1 3.88Å; F168-F239 HydrophobicContact CD1-CZ 4.28Å; F168-F239 AromaticContact CE1-CE1 3.67Å; F168-F239 HydrophobicContact CE1-CE1 3.67Å; F168-F239 AromaticContact CE1-CZ 3.61Å; F168-F239 HydrophobicContact CE1-CZ 3.61Å; F168-F239 HydrophobicContact CE2-CZ 4.39Å; F168-F239 HydrophobicContact CG-CE1 4.46Å; F168-F239 HydrophobicContact CZ-CE1 4.1Å; F168-F239 AromaticContact CZ-CZ 3.68Å; F168-F239 HydrophobicContact CZ-CZ 3.68Å; I169-F239 HydrophobicContact CG1-CD1 4.49Å; F172-F239 HydrophobicContact CB-CD1 3.72Å; F172-F239 HydrophobicContact CB-CE1 3.41Å; F172-F239 VanDerWaalsContact CB-CE1 3.41Å; F172-F239 HydrophobicContact CB-CE2 4.34Å; F172-F239 HydrophobicContact CB-CG 4.32Å; F172-F239 HydrophobicContact CB-CZ 3.79Å; F172-F239 HydrophobicContact CD1-CB 3.72Å; F172-F239 AromaticContact CD1-CD1 3.42Å; F172-F239 HydrophobicContact CD1-CD1 3.42Å; F172-F239 VanDerWaalsContact CD1-CD1 3.42Å; F172-F239 AromaticContact CD1-CD2 3.6Å; F172-F239 HydrophobicContact CD1-CD2 3.6Å; F172-F239 AromaticContact CD1-CE1 3.97Å; F172-F239 HydrophobicContact CD1-CE1 3.97Å; F172-F239 HydrophobicContact CD1-CE2 4.13Å; F172-F239 AromaticContact CD1-CG 3.23Å; F172-F239 HydrophobicContact CD1-CG 3.23Å; F172-F239 HydrophobicContact CD1-CZ 4.31Å; F172-F239 AromaticContact CD2-CD2 3.93Å; F172-F239 HydrophobicContact CD2-CD2 3.93Å; F172-F239 HydrophobicContact CD2-CE1 4.36Å; F172-F239 AromaticContact CD2-CE2 3.75Å; F172-F239 HydrophobicContact CD2-CE2 3.75Å; F172-F239 HydrophobicContact CD2-CG 4.35Å; F172-F239 HydrophobicContact CD2-CZ 4Å; F172-F239 HydrophobicContact CE1-CB 3.54Å; F172-F239 HydrophobicContact CE1-CD1 4.08Å; F172-F239 AromaticContact CE1-CD2 3.47Å; F172-F239 HydrophobicContact CE1-CD2 3.47Å; F172-F239 VanDerWaalsContact CE1-CD2 3.47Å; F172-F239 HydrophobicContact CE1-CE2 4.27Å; F172-F239 AromaticContact CE1-CG 3.37Å; F172-F239 HydrophobicContact CE1-CG 3.37Å; F172-F239 AromaticContact CE2-CD2 3.77Å; F172-F239 HydrophobicContact CE2-CD2 3.77Å; F172-F239 AromaticContact CE2-CE2 3.86Å; F172-F239 HydrophobicContact CE2-CE2 3.86Å; F172-F239 HydrophobicContact CE2-CG 4.42Å; F172-F239 AromaticContact CG-CD1 3.66Å; F172-F239 HydrophobicContact CG-CD1 3.66Å; F172-F239 AromaticContact CG-CD2 3.79Å; F172-F239 HydrophobicContact CG-CD2 3.79Å; F172-F239 AromaticContact CG-CE1 3.68Å; F172-F239 HydrophobicContact CG-CE1 3.68Å; F172-F239 AromaticContact CG-CE2 3.82Å; F172-F239 HydrophobicContact CG-CE2 3.82Å; F172-F239 AromaticContact CG-CG 3.73Å; F172-F239 HydrophobicContact CG-CG 3.73Å; F172-F239 AromaticContact CG-CZ 3.79Å; F172-F239 HydrophobicContact CG-CZ 3.79Å; F172-F239 HydrophobicContact CZ-CB 4.33Å; F172-F239 AromaticContact CZ-CD2 3.51Å; F172-F239 HydrophobicContact CZ-CD2 3.51Å; F172-F239 HydrophobicContact CZ-CE2 4.09Å; F172-F239 AromaticContact CZ-CG 3.95Å; F172-F239 HydrophobicContact CZ-CG 3.95Å; W235-F239 HydrophobicContact CE3-CE2 4.17Å; W235-F239 WeakPolarHBondContact O-CD2 3.37Å; W235-F239 PolarHBondContact O-N 2.87Å; A236-F239 PolarHBondContact O-N 3.44Å; A236-F239 VanDerWaalsContact O-N 3.14Å; F239-H241 PolarHBondContact O-N 3.45Å; F239-L242 HydrophobicContact CD1-CD1 4.01Å; F239-L242 HydrophobicContact CE1-CD1 3.99Å; F239-L242 WeakPolarHBondContact O-CB 3.12Å; F239-L242 PolarHBondContact O-N 3.01Å; F239-V243 WeakPolarHBondContact O-CG2 3.34Å; F239-V243 PolarHBondContact O-N 2.92Å |
| 240 | V | 92.4 | Very high | 90.1 | Very high | 66 Ų | 66 | 43.8 Ų | 43.8 | 40% | 0.4 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.5 | -37 | 170.7 | 172.6 | 0 | 0 | 0 | 0 | 110.4 | A236 P237 F238 V243 I244 Y257 | A236-V240 WeakPolarHBondContact O-CG2 3.48Å; A236-V240 PolarHBondContact O-N 2.91Å; P237-V240 PolarHBondContact O-N 3.27Å; F238-V240 PolarHBondContact O-N 2.89Å; V240-V243 PolarHBondContact O-N 3.48Å; V240-I244 HydrophobicContact CG1-CD1 3.91Å; V240-I244 WeakPolarHBondContact O-CB 3.49Å; V240-I244 WeakPolarHBondContact O-CG1 3.21Å; V240-I244 PolarHBondContact O-N 3.49Å; V240-Y257 HydrophobicContact CB-CE1 4.24Å; V240-Y257 WeakPolarHBondContact CB-OH 3.44Å; V240-Y257 HydrophobicContact CG1-CE1 3.78Å; V240-Y257 HydrophobicContact CG1-CE2 3.98Å; V240-Y257 VanDerWaalsContact CG1-CZ 3.46Å; V240-Y257 WeakPolarHBondContact CG1-OH 3.24Å |
| 241 | H | 91.4 | Very high | 89.7 | Confident | 10 Ų | 10 | 46 Ų | 46 | 5% | 0.046 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 173.6 | -161.2 | 96.7 | 0 | 0 | 0 | 111.9 | P237 F238 F239 V243 I244 I245 Y257 R258 F261 | P237-H241 PolarHBondContact O-N 3.45Å; F238-H241 WeakPolarHBondContact O-CA 3.47Å; F238-H241 WeakPolarHBondContact O-CB 3.45Å; F238-H241 PolarHBondContact O-N 2.92Å; F238-H241 VanDerWaalsContact O-N 3.08Å; F239-H241 PolarHBondContact O-N 3.45Å; H241-V243 PolarHBondContact O-N 3.06Å; H241-I244 PolarHBondContact O-N 3.41Å; H241-I245 WeakPolarHBondContact CD2-CD1 3.37Å; H241-I245 WeakPolarHBondContact O-CG1 3.41Å; H241-I245 PolarHBondContact O-N 2.99Å; H241-Y257 HydrophobicContact CB-CE1 3.89Å; H241-Y257 AromaticContact ND1-CD1 3.99Å; H241-R258 PolarHBondContact CE1-O 3.3Å; H241-F261 AromaticContact CD2-CD2 3.81Å; H241-F261 AromaticContact CE1-CD2 3.7Å; H241-F261 AromaticContact NE2-CD2 3.42Å; H241-F261 WeakPolarHBondContact NE2-CD2 3.39Å |
| 242 | L | 89.8 | Confident | 89.2 | Confident | 11 Ų | 11 | 48.3 Ų | 48.3 | 6% | 0.058 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.5 | -41.8 | 174.3 | -68.8 | 176.6 | 0 | 0 | 0 | 112.5 | F159 M165 F168 I169 F238 F239 I244 T246 | F159-L242 HydrophobicContact CE2-CD2 4.39Å; F159-L242 HydrophobicContact CZ-CD2 4.23Å; M165-L242 HydrophobicContact CE-CD2 4.26Å; F168-L242 HydrophobicContact CD1-CD1 3.84Å; F168-L242 HydrophobicContact CE1-CD1 3.82Å; I169-L242 HydrophobicContact CD1-CB 4.22Å; I169-L242 HydrophobicContact CG1-CB 4.26Å; F238-L242 HydrophobicContact CD1-CD1 4.11Å; F238-L242 HydrophobicContact CD1-CG 4.37Å; F238-L242 HydrophobicContact CE1-CD1 3.73Å; F238-L242 HydrophobicContact CE1-CD2 4.37Å; F238-L242 HydrophobicContact CE1-CG 4.03Å; F238-L242 HydrophobicContact CZ-CD2 4.41Å; F238-L242 HydrophobicContact CZ-CG 4.47Å; F238-L242 PolarHBondContact O-N 3.36Å; F239-L242 HydrophobicContact CD1-CD1 4.01Å; F239-L242 HydrophobicContact CE1-CD1 3.99Å; F239-L242 WeakPolarHBondContact O-CB 3.12Å; F239-L242 PolarHBondContact O-N 3.01Å; L242-I244 VanDerWaalsContact C-N 3.35Å; L242-T246 WeakPolarHBondContact O-CB 3.47Å; L242-T246 PolarHBondContact O-N 2.9Å; L242-T246 VanDerWaalsContact O-N 3.08Å; L242-T246 PolarHBondContact O-OG1 3.12Å |
| 243 | V | 92.1 | Very high | 88.6 | Confident | 58 Ų | 58 | 55.8 Ų | 55.8 | 35% | 0.352 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -60.6 | -45.9 | 174.8 | 170.8 | 0 | 0 | 0 | 0 | 110.5 | I169 F239 V240 H241 T246 V247 | I169-V243 HydrophobicContact CD1-CG2 3.87Å; I169-V243 HydrophobicContact CG1-CG2 4.3Å; I169-V243 HydrophobicContact CG2-CG2 3.85Å; F239-V243 WeakPolarHBondContact O-CG2 3.34Å; F239-V243 PolarHBondContact O-N 2.92Å; V240-V243 PolarHBondContact O-N 3.48Å; H241-V243 PolarHBondContact O-N 3.06Å; V243-T246 PolarHBondContact O-N 3.49Å; V243-V247 HydrophobicContact CG1-CG2 4.22Å; V243-V247 WeakPolarHBondContact O-CB 3.36Å; V243-V247 WeakPolarHBondContact O-CG2 3.46Å; V243-V247 PolarHBondContact O-N 2.91Å |
| 244 | I | 91.1 | Very high | 88.3 | Confident | 22 Ų | 22 | 52 Ų | 52 | 11% | 0.113 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -62.4 | -46.1 | -179.6 | -80 | 167 | 0 | 0 | 0 | 111.7 | V240 H241 L242 T246 V247 C248 C254 Y257 R258 | V240-I244 HydrophobicContact CG1-CD1 3.91Å; V240-I244 WeakPolarHBondContact O-CB 3.49Å; V240-I244 WeakPolarHBondContact O-CG1 3.21Å; V240-I244 PolarHBondContact O-N 3.49Å; H241-I244 PolarHBondContact O-N 3.41Å; L242-I244 VanDerWaalsContact C-N 3.35Å; I244-T246 PolarHBondContact O-N 3.35Å; I244-V247 PolarHBondContact O-N 3.1Å; I244-C248 CarbonylContact O-C 3.38Å; I244-C248 WeakPolarHBondContact O-CA 3.45Å; I244-C248 PolarHBondContact O-N 3.26Å; I244-C248 PolarHBondContact O-SG 3.21Å; I244-C254 HydrophobicContact CG2-CB 3.82Å; I244-Y257 HydrophobicContact CD1-CD1 3.21Å; I244-Y257 HydrophobicContact CD1-CD2 4.22Å; I244-Y257 HydrophobicContact CD1-CE1 3.8Å; I244-Y257 HydrophobicContact CD1-CG 3.45Å; I244-Y257 VanDerWaalsContact CD1-CG 3.45Å; I244-R258 HydrophobicContact CG2-CG 3.82Å |
| 245 | I | 87.3 | Confident | 88 | Confident | 71 Ų | 71 | 55.6 Ų | 55.6 | 36% | 0.364 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -60.9 | -37.1 | 176.2 | -68.9 | 174.9 | 0 | 0 | 0 | 111 | M165 H241 | M165-I245 HydrophobicContact CE-CG2 4.23Å; H241-I245 WeakPolarHBondContact CD2-CD1 3.37Å; H241-I245 WeakPolarHBondContact O-CG1 3.41Å; H241-I245 PolarHBondContact O-N 2.99Å |
| 246 | T | 87.4 | Confident | 87.8 | Confident | 21 Ų | 21 | 57.7 Ų | 57.7 | 13% | 0.129 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -73.6 | -42.9 | -178 | -54.5 | 0 | 0 | 0 | 0 | 112.5 | M165 I166 L242 V243 I244 | M165-T246 WeakPolarHBondContact CE-OG1 3.3Å; I166-T246 HydrophobicContact CD1-CG2 4.47Å; I166-T246 HydrophobicContact CG1-CG2 4.02Å; L242-T246 WeakPolarHBondContact O-CB 3.47Å; L242-T246 PolarHBondContact O-N 2.9Å; L242-T246 VanDerWaalsContact O-N 3.08Å; L242-T246 PolarHBondContact O-OG1 3.12Å; V243-T246 PolarHBondContact O-N 3.49Å; I244-T246 PolarHBondContact O-N 3.35Å |
| 247 | V | 88.8 | Confident | 87.7 | Confident | 115 Ų | 115 | 58.9 Ų | 58.9 | 70% | 0.697 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -97.1 | -36.3 | -168.8 | 178.5 | 0 | 0 | 0 | 0 | 112.8 | V243 I244 | V243-V247 HydrophobicContact CG1-CG2 4.22Å; V243-V247 WeakPolarHBondContact O-CB 3.36Å; V243-V247 WeakPolarHBondContact O-CG2 3.46Å; V243-V247 PolarHBondContact O-N 2.91Å; I244-V247 PolarHBondContact O-N 3.1Å |
| 248 | C | 87.7 | Confident | 87.4 | Confident | 22 Ų | 22 | 61.7 Ų | 61.7 | 15% | 0.149 | 32% | 0.319 | C | S | . | . | trans | -133.8 | 57.1 | -173.4 | 61.3 | 0 | 0 | 0 | 0 | 114 | I244 M250 N251 C254 | I244-C248 CarbonylContact O-C 3.38Å; I244-C248 WeakPolarHBondContact O-CA 3.45Å; I244-C248 PolarHBondContact O-N 3.26Å; I244-C248 PolarHBondContact O-SG 3.21Å; C248-M250 VanDerWaalsContact C-N 3.32Å; C248-M250 PolarHBondContact O-N 3.06Å; C248-N251 HydrophobicContact CB-CB 3.89Å; C248-C254 HydrophobicContact CB-CB 4.03Å; C248-C254 WeakPolarHBondContact CB-SG 3.32Å; C248-C254 WeakPolarHBondContact SG-CB 3.3Å; C248-C254 CovalentContact SG-SG 2.05Å; C248-C254 PolarHBondContact SG-SG 2.03Å | ||
| 249 | P | 82.2 | Confident | 87.4 | Confident | 62 Ų | 62 | 60.7 Ų | 60.7 | 40% | 0.403 | 32% | 0.317 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.4 | -33.4 | -176.3 | 25.1 | -34.5 | 0 | 0 | 0 | 114 | ||
| 250 | M | 81.4 | Confident | 87.3 | Confident | 173 Ų | 173 | 62.6 Ų | 62.6 | 85% | 0.852 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.7 | 6.4 | -173.6 | -59.4 | -59.2 | -68.3 | 0 | 0 | 113.8 | C248 | C248-M250 VanDerWaalsContact C-N 3.32Å; C248-M250 PolarHBondContact O-N 3.06Å |
| 251 | N | 82.8 | Confident | 87.3 | Confident | 65 Ų | 65 | 64 Ų | 64 | 35% | 0.348 | 33% | 0.328 | S | S | . | . | trans | -87.4 | 125.5 | -175 | -167.7 | -37.2 | 0 | 0 | 0 | 110.7 | C248 Y253 C254 | C248-N251 HydrophobicContact CB-CB 3.89Å; N251-Y253 VanDerWaalsContact C-N 3.25Å; N251-Y253 PolarHBondContact O-N 3.25Å; N251-Y253 WeakPolarHBondContact OD1-CB 3.18Å; N251-Y253 WeakPolarHBondContact OD1-CD2 3.32Å; N251-Y253 PolarHBondContact OD1-N 3.06Å; N251-C254 HydrophobicContact CB-CB 4.46Å; N251-C254 PolarHBondContact O-N 3.47Å | ||
| 252 | P | 80.4 | Confident | 87.2 | Confident | 48 Ų | 48 | 65.9 Ų | 65.9 | 31% | 0.312 | 34% | 0.337 | S | S | . | . | G | 310 helix | trans | -60.2 | -32.1 | 179.1 | 23.8 | -34.4 | 0 | 0 | 0 | 113 | T9 C254 E255 | T9-P252 HydrophobicContact CG2-CB 4.04Å; T9-P252 WeakPolarHBondContact OG1-CB 3.24Å; P252-C254 PolarHBondContact O-N 3.43Å; P252-E255 WeakPolarHBondContact O-CB 3.4Å; P252-E255 PolarHBondContact O-N 3.42Å |
| 253 | Y | 80.5 | Confident | 87.3 | Confident | 200 Ų | 200 | 69.2 Ų | 69.2 | 78% | 0.784 | 35% | 0.354 | S | S | * | . | G | 310 helix | trans | -64.2 | -25.1 | 177.1 | -63.2 | -69.3 | 0 | 0 | 0 | 113.2 | N251 | N251-Y253 VanDerWaalsContact C-N 3.25Å; N251-Y253 PolarHBondContact O-N 3.25Å; N251-Y253 WeakPolarHBondContact OD1-CB 3.18Å; N251-Y253 WeakPolarHBondContact OD1-CD2 3.32Å; N251-Y253 PolarHBondContact OD1-N 3.06Å |
| 254 | C | 86.9 | Confident | 87.4 | Confident | 20 Ų | 20 | 67.1 Ų | 67.1 | 14% | 0.135 | 34% | 0.341 | C | S | . | . | G | 310 helix | trans | -88 | -10 | 177.3 | -69 | 0 | 0 | 0 | 0 | 113 | I244 C248 N251 P252 Y257 R258 | I244-C254 HydrophobicContact CG2-CB 3.82Å; C248-C254 HydrophobicContact CB-CB 4.03Å; C248-C254 WeakPolarHBondContact CB-SG 3.32Å; C248-C254 WeakPolarHBondContact SG-CB 3.3Å; C248-C254 CovalentContact SG-SG 2.05Å; C248-C254 PolarHBondContact SG-SG 2.03Å; N251-C254 HydrophobicContact CB-CB 4.46Å; N251-C254 PolarHBondContact O-N 3.47Å; P252-C254 PolarHBondContact O-N 3.43Å; C254-Y257 PolarHBondContact O-N 3.04Å; C254-R258 WeakPolarHBondContact O-CG 3.43Å; C254-R258 PolarHBondContact O-N 3.2Å |
| 255 | E | 85.6 | Confident | 87.3 | Confident | 77 Ų | 77 | 66.5 Ų | 66.5 | 36% | 0.36 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65.2 | -41.1 | -177.9 | -169.2 | 173.4 | -165.6 | 0 | 0 | 112.3 | T9 P252 Y257 R258 S259 | T9-E255 WeakPolarHBondContact CB-OE2 3.35Å; T9-E255 PolarHBondContact OG1-OE2 3.08Å; P252-E255 WeakPolarHBondContact O-CB 3.4Å; P252-E255 PolarHBondContact O-N 3.42Å; E255-Y257 VanDerWaalsContact C-N 3.31Å; E255-Y257 PolarHBondContact O-N 3.36Å; E255-R258 PolarHBondContact O-N 2.87Å; E255-R258 VanDerWaalsContact O-N 3.11Å; E255-S259 PolarHBondContact O-N 3.4Å |
| 256 | C | 87.4 | Confident | 87.6 | Confident | 66 Ų | 66 | 63.9 Ų | 63.9 | 45% | 0.446 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -58.2 | -43.3 | 178.3 | -168.6 | 0 | 0 | 0 | 0 | 112.5 | C11 R258 S259 | C11-C256 HydrophobicContact CB-CB 4.16Å; C11-C256 VanDerWaalsContact SG-CA 3.56Å; C11-C256 WeakPolarHBondContact SG-CB 3.37Å; C256-R258 VanDerWaalsContact C-N 3.34Å; C256-S259 PolarHBondContact O-N 2.79Å |
| 257 | Y | 89.6 | Confident | 87.8 | Confident | 57 Ų | 57 | 65.7 Ų | 65.7 | 22% | 0.224 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -71.9 | -32.2 | 179.7 | -167.8 | -84.2 | 0 | 0 | 0 | 111.8 | P237 V240 H241 I244 C254 E255 S259 L260 H264 | P237-Y257 VanDerWaalsContact CA-OH 3.29Å; P237-Y257 WeakPolarHBondContact CA-OH 3.18Å; P237-Y257 PolarHBondContact O-OH 3.5Å; V240-Y257 HydrophobicContact CB-CE1 4.24Å; V240-Y257 WeakPolarHBondContact CB-OH 3.44Å; V240-Y257 HydrophobicContact CG1-CE1 3.78Å; V240-Y257 HydrophobicContact CG1-CE2 3.98Å; V240-Y257 VanDerWaalsContact CG1-CZ 3.46Å; V240-Y257 WeakPolarHBondContact CG1-OH 3.24Å; H241-Y257 HydrophobicContact CB-CE1 3.89Å; H241-Y257 AromaticContact ND1-CD1 3.99Å; I244-Y257 HydrophobicContact CD1-CD1 3.21Å; I244-Y257 HydrophobicContact CD1-CD2 4.22Å; I244-Y257 HydrophobicContact CD1-CE1 3.8Å; I244-Y257 HydrophobicContact CD1-CG 3.45Å; I244-Y257 VanDerWaalsContact CD1-CG 3.45Å; C254-Y257 PolarHBondContact O-N 3.04Å; E255-Y257 VanDerWaalsContact C-N 3.31Å; E255-Y257 PolarHBondContact O-N 3.36Å; Y257-S259 VanDerWaalsContact C-N 3.32Å; Y257-L260 PolarHBondContact O-N 3.38Å; Y257-H264 AromaticContact CE1-CE1 3.43Å; Y257-H264 VanDerWaalsContact CE1-CE1 3.43Å; Y257-H264 WeakPolarHBondContact CE1-CE1 3.49Å; Y257-H264 AromaticContact CE1-ND1 3.96Å; Y257-H264 AromaticContact CE2-CE1 3.8Å; Y257-H264 AromaticContact CZ-CE1 3.3Å; Y257-H264 AromaticContact CZ-NE2 3.71Å; Y257-H264 PolarHBondContact OH-CE1 3.08Å |
| 258 | R | 88.8 | Confident | 88 | Confident | 85 Ų | 85 | 61 Ų | 61 | 32% | 0.321 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66 | -34.9 | 175.4 | -73.8 | -173.9 | -63.5 | 131.5 | 0.3 | 112.3 | H241 I244 C254 E255 C256 L260 F261 | H241-R258 PolarHBondContact CE1-O 3.3Å; I244-R258 HydrophobicContact CG2-CG 3.82Å; C254-R258 WeakPolarHBondContact O-CG 3.43Å; C254-R258 PolarHBondContact O-N 3.2Å; E255-R258 PolarHBondContact O-N 2.87Å; E255-R258 VanDerWaalsContact O-N 3.11Å; C256-R258 VanDerWaalsContact C-N 3.34Å; R258-L260 PolarHBondContact O-N 3.47Å; R258-L260 VanDerWaalsContact O-N 3.17Å; R258-F261 WeakPolarHBondContact O-CB 3.39Å; R258-F261 PolarHBondContact O-N 2.98Å |
| 259 | S | 89.3 | Confident | 88.1 | Confident | 19 Ų | 19 | 60.8 Ų | 60.8 | 13% | 0.133 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -59.6 | -23.5 | 174.9 | 142.3 | 0 | 0 | 0 | 0 | 113.6 | P12 E13 V14 E255 C256 Y257 F261 | P12-S259 PolarHBondContact O-OG 3.36Å; E13-S259 WeakPolarHBondContact CA-OG 3.43Å; V14-S259 PolarHBondContact N-O 3.14Å; V14-S259 PolarHBondContact N-OG 2.63Å; E255-S259 PolarHBondContact O-N 3.4Å; C256-S259 PolarHBondContact O-N 2.79Å; Y257-S259 VanDerWaalsContact C-N 3.32Å; S259-F261 PolarHBondContact O-N 3.2Å |
| 260 | L | 91.6 | Very high | 88.5 | Confident | 47 Ų | 47 | 59 Ų | 59 | 25% | 0.246 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | 11.9 | -179.9 | -60 | 175.6 | 0 | 0 | 0 | 113.9 | V14 Y257 R258 E262 L263 H264 | V14-L260 HydrophobicContact CB-CD2 4.07Å; V14-L260 HydrophobicContact CG2-CD2 3.67Å; Y257-L260 PolarHBondContact O-N 3.38Å; R258-L260 PolarHBondContact O-N 3.47Å; R258-L260 VanDerWaalsContact O-N 3.17Å; L260-E262 PolarHBondContact O-N 3Å; L260-L263 HydrophobicContact CD2-CD2 4.32Å; L260-L263 WeakPolarHBondContact O-CB 3.31Å; L260-L263 PolarHBondContact O-N 3.46Å; L260-H264 VanDerWaalsContact CB-CE1 3.41Å; L260-H264 WeakPolarHBondContact CB-CE1 3.42Å; L260-H264 PolarHBondContact O-N 3.39Å; L260-H264 PolarHBondContact O-ND1 3.45Å; L260-H264 VanDerWaalsContact O-ND1 3.13Å |
| 261 | F | 90.4 | Very high | 89 | Confident | 95 Ų | 95 | 50.9 Ų | 50.9 | 42% | 0.417 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -53.7 | -52.9 | -174.3 | 179.6 | -106.9 | 0 | 0 | 0 | 113.2 | F238 H241 R258 S259 L263 H264 V265 | F238-F261 HydrophobicContact CE2-CE2 4.16Å; H241-F261 AromaticContact CD2-CD2 3.81Å; H241-F261 AromaticContact CE1-CD2 3.7Å; H241-F261 AromaticContact NE2-CD2 3.42Å; H241-F261 WeakPolarHBondContact NE2-CD2 3.39Å; R258-F261 WeakPolarHBondContact O-CB 3.39Å; R258-F261 PolarHBondContact O-N 2.98Å; S259-F261 PolarHBondContact O-N 3.2Å; F261-L263 VanDerWaalsContact C-N 3.29Å; F261-L263 PolarHBondContact O-N 2.9Å; F261-H264 PolarHBondContact O-N 3.42Å; F261-H264 VanDerWaalsContact O-N 3.11Å; F261-V265 HydrophobicContact CD1-CG2 4.26Å; F261-V265 HydrophobicContact CD2-CG2 4.4Å; F261-V265 HydrophobicContact CE1-CG2 3.88Å; F261-V265 HydrophobicContact CE2-CG2 4.05Å; F261-V265 HydrophobicContact CZ-CG2 3.77Å; F261-V265 WeakPolarHBondContact O-CG2 3.37Å; F261-V265 PolarHBondContact O-N 3.15Å |
| 262 | E | 90.3 | Very high | 89.3 | Confident | 50 Ų | 50 | 48 Ų | 48 | 23% | 0.234 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60.2 | -40.1 | -178.8 | -68.5 | -172.5 | -161 | 0 | 0 | 112 | K15 V16 F21 L260 H264 V265 V266 | K15-E262 VanDerWaalsContact CA-OE2 3.23Å; K15-E262 WeakPolarHBondContact CA-OE2 3.17Å; V16-E262 HydrophobicContact CB-CB 4.49Å; V16-E262 HydrophobicContact CG2-CB 4.15Å; V16-E262 PolarHBondContact N-OE2 3.2Å; F21-E262 HydrophobicContact CZ-CB 4.22Å; L260-E262 PolarHBondContact O-N 3Å; E262-H264 PolarHBondContact O-N 3.49Å; E262-V265 PolarHBondContact O-N 2.74Å; E262-V266 VanDerWaalsContact O-CG2 3.28Å; E262-V266 WeakPolarHBondContact O-CG2 3.08Å; E262-V266 PolarHBondContact O-N 3.02Å |
| 263 | L | 91.9 | Very high | 89.8 | Confident | 81 Ų | 81 | 47.5 Ų | 47.5 | 42% | 0.424 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -61.3 | -44.4 | 175.7 | -179.3 | 68.4 | 0 | 0 | 0 | 111.8 | V16 L260 F261 V265 V266 L267 | V16-L263 HydrophobicContact CG2-CB 4.45Å; L260-L263 HydrophobicContact CD2-CD2 4.32Å; L260-L263 WeakPolarHBondContact O-CB 3.31Å; L260-L263 PolarHBondContact O-N 3.46Å; F261-L263 VanDerWaalsContact C-N 3.29Å; F261-L263 PolarHBondContact O-N 2.9Å; L263-V265 VanDerWaalsContact C-N 3.32Å; L263-V265 PolarHBondContact O-N 3.04Å; L263-V266 PolarHBondContact O-N 3.3Å; L263-L267 WeakPolarHBondContact O-CB 3.29Å; L263-L267 PolarHBondContact O-N 3.37Å |
| 264 | H | 93.4 | Very high | 90.2 | Very high | 14 Ų | 14 | 40.6 Ų | 40.6 | 7% | 0.065 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -65.3 | -36.2 | 177.1 | -61.8 | 140.4 | 0 | 0 | 0 | 112.2 | P237 Y257 L260 F261 E262 L267 M268 | P237-H264 HydrophobicContact CB-CB 4.41Å; P237-H264 WeakPolarHBondContact CB-CD2 3.5Å; Y257-H264 AromaticContact CE1-CE1 3.43Å; Y257-H264 VanDerWaalsContact CE1-CE1 3.43Å; Y257-H264 WeakPolarHBondContact CE1-CE1 3.49Å; Y257-H264 AromaticContact CE1-ND1 3.96Å; Y257-H264 AromaticContact CE2-CE1 3.8Å; Y257-H264 AromaticContact CZ-CE1 3.3Å; Y257-H264 AromaticContact CZ-NE2 3.71Å; Y257-H264 PolarHBondContact OH-CE1 3.08Å; L260-H264 VanDerWaalsContact CB-CE1 3.41Å; L260-H264 WeakPolarHBondContact CB-CE1 3.42Å; L260-H264 PolarHBondContact O-N 3.39Å; L260-H264 PolarHBondContact O-ND1 3.45Å; L260-H264 VanDerWaalsContact O-ND1 3.13Å; F261-H264 PolarHBondContact O-N 3.42Å; F261-H264 VanDerWaalsContact O-N 3.11Å; E262-H264 PolarHBondContact O-N 3.49Å; H264-L267 PolarHBondContact O-N 2.93Å; H264-M268 WeakPolarHBondContact O-CB 3.42Å; H264-M268 PolarHBondContact O-N 3.38Å |
| 265 | V | 90.6 | Very high | 90.3 | Very high | 9 Ų | 9 | 39.6 Ų | 39.6 | 6% | 0.055 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.3 | -43.5 | 174.5 | 174.8 | 0 | 0 | 0 | 0 | 110.9 | F21 K67 F261 E262 L263 L267 M268 M269 | F21-V265 HydrophobicContact CE1-CG1 4.06Å; K67-V265 HydrophobicContact CD-CG1 4.47Å; F261-V265 HydrophobicContact CD1-CG2 4.26Å; F261-V265 HydrophobicContact CD2-CG2 4.4Å; F261-V265 HydrophobicContact CE1-CG2 3.88Å; F261-V265 HydrophobicContact CE2-CG2 4.05Å; F261-V265 HydrophobicContact CZ-CG2 3.77Å; F261-V265 WeakPolarHBondContact O-CG2 3.37Å; F261-V265 PolarHBondContact O-N 3.15Å; E262-V265 PolarHBondContact O-N 2.74Å; L263-V265 VanDerWaalsContact C-N 3.32Å; L263-V265 PolarHBondContact O-N 3.04Å; V265-L267 VanDerWaalsContact C-N 3.34Å; V265-L267 PolarHBondContact O-N 3.43Å; V265-M268 HydrophobicContact CG1-CE 4.18Å; V265-M268 WeakPolarHBondContact O-CB 3.31Å; V265-M268 PolarHBondContact O-N 3.13Å; V265-M269 HydrophobicContact CG1-SD 4.28Å; V265-M269 WeakPolarHBondContact O-CG 3.4Å; V265-M269 PolarHBondContact O-N 3.07Å |
| 266 | V | 92.4 | Very high | 90.4 | Very high | 16 Ų | 16 | 36.3 Ų | 36.3 | 10% | 0.097 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.8 | -42.2 | 176.2 | 175.3 | 0 | 0 | 0 | 0 | 111.4 | V16 V20 F21 E262 L263 M268 M269 S270 | V16-V266 HydrophobicContact CB-CG2 3.98Å; V16-V266 HydrophobicContact CG1-CG2 3.78Å; V16-V266 HydrophobicContact CG2-CG2 3.98Å; V20-V266 HydrophobicContact CG1-CG1 4.15Å; F21-V266 HydrophobicContact CD1-CG2 3.71Å; F21-V266 HydrophobicContact CD2-CG2 4.47Å; F21-V266 HydrophobicContact CE1-CB 4.36Å; F21-V266 HydrophobicContact CE1-CG2 3.17Å; F21-V266 HydrophobicContact CE2-CG2 4.03Å; F21-V266 HydrophobicContact CG-CG2 4.34Å; F21-V266 HydrophobicContact CZ-CG2 3.35Å; E262-V266 VanDerWaalsContact O-CG2 3.28Å; E262-V266 WeakPolarHBondContact O-CG2 3.08Å; E262-V266 PolarHBondContact O-N 3.02Å; L263-V266 PolarHBondContact O-N 3.3Å; V266-M268 VanDerWaalsContact C-N 3.35Å; V266-M269 PolarHBondContact O-N 3.05Å; V266-S270 WeakPolarHBondContact O-CB 3.08Å; V266-S270 PolarHBondContact O-N 2.64Å; V266-S270 PolarHBondContact O-OG 2.73Å |
| 267 | L | 92.8 | Very high | 90.4 | Very high | 58 Ų | 58 | 34.8 Ų | 34.8 | 30% | 0.304 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -64 | -42.3 | 177.9 | -176.5 | 64.9 | 0 | 0 | 0 | 111.2 | C234 P237 L263 H264 V265 S270 H271 | C234-L267 WeakPolarHBondContact CB-O 3.48Å; P237-L267 HydrophobicContact CB-CD2 4.46Å; P237-L267 HydrophobicContact CG-CD2 3.79Å; L263-L267 WeakPolarHBondContact O-CB 3.29Å; L263-L267 PolarHBondContact O-N 3.37Å; H264-L267 PolarHBondContact O-N 2.93Å; V265-L267 VanDerWaalsContact C-N 3.34Å; V265-L267 PolarHBondContact O-N 3.43Å; L267-S270 WeakPolarHBondContact O-CB 3.46Å; L267-S270 PolarHBondContact O-N 3.35Å; L267-H271 PolarHBondContact O-N 2.88Å |
| 268 | M | 91.8 | Very high | 90.2 | Very high | 17 Ų | 17 | 33 Ų | 33 | 8% | 0.084 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -59.1 | -45.5 | 172.4 | 177.3 | -172.9 | 72.2 | 0 | 0 | 111.5 | W235 F238 H264 V265 V266 S270 H271 | W235-M268 HydrophobicContact CD2-CG 3.92Å; W235-M268 HydrophobicContact CE3-CG 3.68Å; W235-M268 HydrophobicContact CE3-SD 3.86Å; W235-M268 HydrophobicContact CH2-CG 3.62Å; W235-M268 HydrophobicContact CH2-SD 3.71Å; W235-M268 HydrophobicContact CZ2-CG 3.86Å; W235-M268 HydrophobicContact CZ3-CG 3.53Å; W235-M268 HydrophobicContact CZ3-SD 3.31Å; W235-M268 WeakPolarHBondContact CZ3-SD 3.46Å; F238-M268 HydrophobicContact CD1-SD 4.33Å; F238-M268 HydrophobicContact CD2-SD 4.25Å; F238-M268 HydrophobicContact CG-SD 4.12Å; H264-M268 WeakPolarHBondContact O-CB 3.42Å; H264-M268 PolarHBondContact O-N 3.38Å; V265-M268 HydrophobicContact CG1-CE 4.18Å; V265-M268 WeakPolarHBondContact O-CB 3.31Å; V265-M268 PolarHBondContact O-N 3.13Å; V266-M268 VanDerWaalsContact C-N 3.35Å; M268-S270 VanDerWaalsContact C-N 3.29Å; M268-S270 PolarHBondContact O-N 2.95Å; M268-H271 WeakPolarHBondContact O-CB 3.28Å; M268-H271 PolarHBondContact O-N 3.43Å |
| 269 | M | 90.3 | Very high | 90.1 | Very high | 17 Ų | 17 | 29 Ų | 29 | 8% | 0.084 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -63.1 | -36.1 | 175.7 | -70.3 | 176.9 | 67.5 | 0 | 0 | 112.3 | F21 V24 K67 V265 V266 H271 A272 | F21-M269 HydrophobicContact CD1-CE 4.5Å; F21-M269 HydrophobicContact CD1-SD 3.74Å; F21-M269 HydrophobicContact CE1-SD 4.17Å; V24-M269 HydrophobicContact CG1-CB 3.79Å; K67-M269 HydrophobicContact CB-CE 3.54Å; K67-M269 HydrophobicContact CB-CG 4.25Å; K67-M269 HydrophobicContact CB-SD 3.77Å; K67-M269 HydrophobicContact CD-SD 4.37Å; K67-M269 HydrophobicContact CG-CE 4.3Å; K67-M269 HydrophobicContact CG-CG 3.99Å; K67-M269 HydrophobicContact CG-SD 3.89Å; V265-M269 HydrophobicContact CG1-SD 4.28Å; V265-M269 WeakPolarHBondContact O-CG 3.4Å; V265-M269 PolarHBondContact O-N 3.07Å; V266-M269 PolarHBondContact O-N 3.05Å; M269-H271 PolarHBondContact O-N 3.19Å; M269-A272 PolarHBondContact O-N 3.23Å |
| 270 | S | 91.3 | Very high | 89.9 | Confident | 25 Ų | 25 | 29.5 Ų | 29.5 | 18% | 0.175 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -64.5 | -19.7 | 179.7 | -58.3 | 0 | 0 | 0 | 0 | 112.9 | V266 L267 M268 A272 L273 I274 | V266-S270 WeakPolarHBondContact O-CB 3.08Å; V266-S270 PolarHBondContact O-N 2.64Å; V266-S270 PolarHBondContact O-OG 2.73Å; L267-S270 WeakPolarHBondContact O-CB 3.46Å; L267-S270 PolarHBondContact O-N 3.35Å; M268-S270 VanDerWaalsContact C-N 3.29Å; M268-S270 PolarHBondContact O-N 2.95Å; S270-A272 PolarHBondContact O-N 3.11Å; S270-L273 WeakPolarHBondContact O-CB 3.13Å; S270-L273 PolarHBondContact O-N 3.3Å; S270-L273 VanDerWaalsContact O-N 3.17Å; S270-I274 WeakPolarHBondContact O-CG1 3.31Å; S270-I274 PolarHBondContact O-N 3.38Å |
| 271 | H | 90.3 | Very high | 89.5 | Confident | 2 Ų | 2 | 35.2 Ų | 35.2 | 1% | 0.009 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -50.4 | -46.7 | 171.1 | 174.8 | -104.2 | 0 | 0 | 0 | 112.2 | F111 F231 C234 W235 L267 M268 M269 L273 I274 D275 | F111-H271 AromaticContact CE2-NE2 3.92Å; F231-H271 VanDerWaalsContact CA-CD2 3.42Å; F231-H271 WeakPolarHBondContact CA-CD2 3.12Å; F231-H271 WeakPolarHBondContact CB-NE2 3.27Å; F231-H271 AromaticContact CD2-CD2 3.93Å; F231-H271 AromaticContact CD2-CE1 3.68Å; F231-H271 AromaticContact CD2-NE2 3.42Å; F231-H271 WeakPolarHBondContact CD2-NE2 3.31Å; F231-H271 AromaticContact CG-NE2 3.93Å; C234-H271 HydrophobicContact CB-CB 3.74Å; W235-H271 AromaticContact CD1-CG 3.95Å; W235-H271 AromaticContact NE1-CG 3.42Å; W235-H271 AromaticContact NE1-ND1 3.55Å; L267-H271 PolarHBondContact O-N 2.88Å; M268-H271 WeakPolarHBondContact O-CB 3.28Å; M268-H271 PolarHBondContact O-N 3.43Å; M269-H271 PolarHBondContact O-N 3.19Å; H271-L273 PolarHBondContact O-N 3.42Å; H271-I274 PolarHBondContact O-N 2.74Å; H271-D275 IonicContact CE1-OD2 3.16Å; H271-D275 PolarHBondContact CE1-OD2 2.99Å; H271-D275 IonicContact ND1-OD2 3.94Å; H271-D275 IonicContact NE2-OD1 3.71Å; H271-D275 IonicContact NE2-OD2 3.6Å |
| 272 | A | 89.8 | Confident | 89.1 | Confident | 5 Ų | 5 | 35.6 Ų | 35.6 | 4% | 0.041 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -69.6 | -19.9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | S28 N32 N60 M269 S270 P276 | S28-A272 WeakPolarHBondContact OG-CB 3.49Å; N32-A272 PolarHBondContact ND2-O 2.85Å; N60-A272 HydrophobicContact CB-CB 3.82Å; M269-A272 PolarHBondContact O-N 3.23Å; S270-A272 PolarHBondContact O-N 3.11Å; A272-P276 WeakPolarHBondContact O-CD 3.26Å |
| 273 | L | 90 | Very high | 88.8 | Confident | 37 Ų | 37 | 33.9 Ų | 33.9 | 19% | 0.194 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -75.5 | -33.5 | 170.4 | -65.1 | 173 | 0 | 0 | 0 | 112.7 | V24 V27 S270 H271 | V24-L273 HydrophobicContact CB-CD1 4.23Å; V24-L273 HydrophobicContact CG1-CD1 3.8Å; V24-L273 HydrophobicContact CG1-CG 4.36Å; V24-L273 HydrophobicContact CG2-CD1 4.11Å; V27-L273 HydrophobicContact CB-CD2 3.65Å; V27-L273 HydrophobicContact CG1-CD2 3.45Å; V27-L273 VanDerWaalsContact CG1-CD2 3.45Å; S270-L273 WeakPolarHBondContact O-CB 3.13Å; S270-L273 PolarHBondContact O-N 3.3Å; S270-L273 VanDerWaalsContact O-N 3.17Å; H271-L273 PolarHBondContact O-N 3.42Å |
| 274 | I | 89.6 | Confident | 88.3 | Confident | 55 Ų | 55 | 32.4 Ų | 32.4 | 28% | 0.282 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -74.5 | -34 | -170.3 | -66 | 163.5 | 0 | 0 | 0 | 110.6 | A230 S270 H271 I278 | A230-I274 HydrophobicContact CB-CG2 3.62Å; S270-I274 WeakPolarHBondContact O-CG1 3.31Å; S270-I274 PolarHBondContact O-N 3.38Å; H271-I274 PolarHBondContact O-N 2.74Å; I274-I278 HydrophobicContact CG2-CD1 3.37Å; I274-I278 HydrophobicContact CG2-CG1 4.11Å; I274-I278 VanDerWaalsContact O-CG1 3.28Å; I274-I278 WeakPolarHBondContact O-CG1 3.27Å; I274-I278 PolarHBondContact O-N 3.49Å |
| 275 | D | 88.6 | Confident | 87.9 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.9 | -56.9 | -177.3 | -68.5 | -30.5 | 0 | 0 | 0 | 113 | N60 L227 H271 A277 I278 Y279 | N60-D275 PolarHBondContact ND2-OD2 2.93Å; L227-D275 HydrophobicContact CD2-CB 4.31Å; L227-D275 WeakPolarHBondContact CD2-OD1 3.32Å; H271-D275 IonicContact CE1-OD2 3.16Å; H271-D275 PolarHBondContact CE1-OD2 2.99Å; H271-D275 IonicContact ND1-OD2 3.94Å; H271-D275 IonicContact NE2-OD1 3.71Å; H271-D275 IonicContact NE2-OD2 3.6Å; D275-A277 VanDerWaalsContact C-N 3.33Å; D275-A277 PolarHBondContact O-N 3.37Å; D275-I278 PolarHBondContact O-N 3.15Å; D275-Y279 HydrophobicContact CB-CE2 3.97Å; D275-Y279 VanDerWaalsContact O-CD2 3.24Å; D275-Y279 WeakPolarHBondContact O-CD2 3.36Å; D275-Y279 VanDerWaalsContact O-CG 3.27Å; D275-Y279 PolarHBondContact O-N 2.96Å |
| 276 | P | 88.4 | Confident | 87.5 | Confident | 7 Ų | 7 | 36.6 Ų | 36.6 | 5% | 0.045 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62.9 | -37 | -179.8 | -22.7 | 36.9 | 0 | 0 | 0 | 113.3 | E31 V35 A272 Y279 A280 | E31-P276 HydrophobicContact CB-CB 3.82Å; E31-P276 HydrophobicContact CB-CG 3.82Å; V35-P276 HydrophobicContact CG2-CB 3.86Å; V35-P276 HydrophobicContact CG2-CG 4.04Å; A272-P276 WeakPolarHBondContact O-CD 3.26Å; P276-Y279 WeakPolarHBondContact O-CB 3.08Å; P276-Y279 PolarHBondContact O-N 3.5Å; P276-A280 WeakPolarHBondContact O-CB 3.31Å; P276-A280 PolarHBondContact O-N 2.78Å |
| 277 | A | 86.6 | Confident | 87.2 | Confident | 34 Ų | 34 | 41.2 Ų | 41.2 | 28% | 0.281 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -58.6 | -49.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | D275 Y279 A280 F281 | D275-A277 VanDerWaalsContact C-N 3.33Å; D275-A277 PolarHBondContact O-N 3.37Å; A277-Y279 VanDerWaalsContact C-N 3.33Å; A277-Y279 PolarHBondContact O-N 2.91Å; A277-A280 PolarHBondContact O-N 3.31Å; A277-F281 WeakPolarHBondContact O-CD2 3.49Å; A277-F281 PolarHBondContact O-N 3.07Å |
| 278 | I | 87.1 | Confident | 86.8 | Confident | 21 Ų | 21 | 43.7 Ų | 43.7 | 11% | 0.108 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61 | -42.7 | 177.1 | -70 | 166.2 | 0 | 0 | 0 | 110.9 | T223 I226 L227 I274 D275 A280 F281 R282 | T223-I278 HydrophobicContact CG2-CG2 3.73Å; I226-I278 HydrophobicContact CG2-CD1 3.84Å; I226-I278 HydrophobicContact CG2-CG1 4.42Å; L227-I278 HydrophobicContact CD2-CB 3.62Å; L227-I278 HydrophobicContact CD2-CD1 3.71Å; L227-I278 HydrophobicContact CD2-CG1 4.28Å; L227-I278 HydrophobicContact CD2-CG2 3.54Å; L227-I278 HydrophobicContact CG-CB 4.46Å; L227-I278 HydrophobicContact CG-CD1 4.36Å; L227-I278 HydrophobicContact CG-CG2 3.85Å; I274-I278 HydrophobicContact CG2-CD1 3.37Å; I274-I278 HydrophobicContact CG2-CG1 4.11Å; I274-I278 VanDerWaalsContact O-CG1 3.28Å; I274-I278 WeakPolarHBondContact O-CG1 3.27Å; I274-I278 PolarHBondContact O-N 3.49Å; D275-I278 PolarHBondContact O-N 3.15Å; I278-A280 PolarHBondContact O-N 3.33Å; I278-F281 PolarHBondContact O-N 3.35Å; I278-R282 HydrophobicContact CG2-CG 4.12Å; I278-R282 WeakPolarHBondContact O-CB 3.35Å; I278-R282 VanDerWaalsContact O-CG 3.3Å; I278-R282 WeakPolarHBondContact O-CG 3.44Å; I278-R282 PolarHBondContact O-N 3.06Å |
| 279 | Y | 85.7 | Confident | 86.4 | Confident | 1 Ų | 1 | 43.5 Ų | 43.5 | 0% | 0.004 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -58 | -47.6 | 175.5 | -60.1 | -35.1 | 0 | 0 | 0 | 112 | V35 M53 L56 L227 D275 P276 A277 F281 R282 M283 L286 | V35-Y279 HydrophobicContact CG2-CD2 4.34Å; M53-Y279 HydrophobicContact CE-CE1 4.05Å; M53-Y279 HydrophobicContact CG-CE1 4.36Å; M53-Y279 HydrophobicContact SD-CE1 4.13Å; L56-Y279 WeakPolarHBondContact CD2-OH 3.49Å; L227-Y279 HydrophobicContact CD1-CD1 4.21Å; L227-Y279 HydrophobicContact CD1-CE1 3.38Å; L227-Y279 HydrophobicContact CD2-CD1 4.35Å; L227-Y279 HydrophobicContact CD2-CE1 3.85Å; L227-Y279 HydrophobicContact CG-CE1 4.29Å; D275-Y279 HydrophobicContact CB-CE2 3.97Å; D275-Y279 VanDerWaalsContact O-CD2 3.24Å; D275-Y279 WeakPolarHBondContact O-CD2 3.36Å; D275-Y279 VanDerWaalsContact O-CG 3.27Å; D275-Y279 PolarHBondContact O-N 2.96Å; P276-Y279 WeakPolarHBondContact O-CB 3.08Å; P276-Y279 PolarHBondContact O-N 3.5Å; A277-Y279 VanDerWaalsContact C-N 3.33Å; A277-Y279 PolarHBondContact O-N 2.91Å; Y279-F281 VanDerWaalsContact C-N 3.33Å; Y279-F281 PolarHBondContact O-N 2.89Å; Y279-R282 PolarHBondContact O-N 3.49Å; Y279-M283 HydrophobicContact CD1-CE 3.41Å; Y279-M283 VanDerWaalsContact CD1-CE 3.41Å; Y279-M283 HydrophobicContact CD1-SD 3.82Å; Y279-M283 HydrophobicContact CE1-CE 3.78Å; Y279-M283 WeakPolarHBondContact O-CB 3.09Å; Y279-M283 PolarHBondContact O-N 3.24Å; Y279-L286 HydrophobicContact CG-CD1 4.29Å |
| 280 | A | 84.3 | Confident | 86.2 | Confident | 29 Ų | 29 | 43.4 Ų | 43.4 | 24% | 0.24 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.8 | -36.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | P276 A277 I278 R287 F290 | P276-A280 WeakPolarHBondContact O-CB 3.31Å; P276-A280 PolarHBondContact O-N 2.78Å; A277-A280 PolarHBondContact O-N 3.31Å; I278-A280 PolarHBondContact O-N 3.33Å; A280-R287 WeakPolarHBondContact O-CB 3.18Å; A280-R287 VanDerWaalsContact O-CD 3.28Å; A280-R287 WeakPolarHBondContact O-CD 3.28Å; A280-R287 WeakPolarHBondContact O-CG 3.45Å; A280-F290 HydrophobicContact CB-CD2 4.11Å; A280-F290 HydrophobicContact CB-CE2 4.2Å |
| 281 | F | 84.1 | Confident | 85.8 | Confident | 166 Ų | 166 | 49.4 Ų | 49.4 | 73% | 0.728 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -81.1 | -31.8 | 179.2 | -71.3 | -64.6 | 0 | 0 | 0 | 113.6 | A277 I278 Y279 | A277-F281 WeakPolarHBondContact O-CD2 3.49Å; A277-F281 PolarHBondContact O-N 3.07Å; I278-F281 PolarHBondContact O-N 3.35Å; Y279-F281 VanDerWaalsContact C-N 3.33Å; Y279-F281 PolarHBondContact O-N 2.89Å |
| 282 | R | 83 | Confident | 85.4 | Confident | 104 Ų | 104 | 52.6 Ų | 52.6 | 39% | 0.392 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -108.9 | -18.9 | -165.7 | -60.3 | -70.8 | -69.2 | -120.3 | -11 | 114.6 | L222 T223 I278 Y279 | L222-R282 VanDerWaalsContact CD2-NH2 3.31Å; L222-R282 VanDerWaalsContact CG-NH2 3.33Å; T223-R282 HydrophobicContact CG2-CB 3.43Å; T223-R282 VanDerWaalsContact CG2-CB 3.43Å; T223-R282 HydrophobicContact CG2-CG 3.95Å; T223-R282 WeakPolarHBondContact OG1-CB 3.45Å; T223-R282 PolarHBondContact OG1-NE 2.85Å; T223-R282 VanDerWaalsContact OG1-NE 3.16Å; T223-R282 PolarHBondContact OG1-NH2 3.06Å; I278-R282 HydrophobicContact CG2-CG 4.12Å; I278-R282 WeakPolarHBondContact O-CB 3.35Å; I278-R282 VanDerWaalsContact O-CG 3.3Å; I278-R282 WeakPolarHBondContact O-CG 3.44Å; I278-R282 PolarHBondContact O-N 3.06Å; Y279-R282 PolarHBondContact O-N 3.49Å |
| 283 | M | 83.3 | Confident | 85 | Confident | 14 Ų | 14 | 52.6 Ų | 52.6 | 7% | 0.069 | 25% | 0.25 | C | C | . | . | trans | -114 | 107.5 | -178.4 | -56.8 | -173.4 | -168.2 | 0 | 0 | 109.9 | M49 M53 T223 Y279 E285 L286 R287 | M49-M283 HydrophobicContact CE-CE 4.2Å; M49-M283 HydrophobicContact CE-SD 4.06Å; M53-M283 HydrophobicContact CE-CE 3.33Å; M53-M283 HydrophobicContact CE-SD 3.87Å; M53-M283 HydrophobicContact SD-CE 4.04Å; M53-M283 HydrophobicContact SD-SD 3.83Å; T223-M283 HydrophobicContact CG2-CE 3.66Å; Y279-M283 HydrophobicContact CD1-CE 3.41Å; Y279-M283 VanDerWaalsContact CD1-CE 3.41Å; Y279-M283 HydrophobicContact CD1-SD 3.82Å; Y279-M283 HydrophobicContact CE1-CE 3.78Å; Y279-M283 WeakPolarHBondContact O-CB 3.09Å; Y279-M283 PolarHBondContact O-N 3.24Å; M283-E285 VanDerWaalsContact C-N 3.3Å; M283-E285 PolarHBondContact O-N 2.72Å; M283-L286 HydrophobicContact CB-CB 4.11Å; M283-L286 HydrophobicContact CB-CD1 4.14Å; M283-L286 PolarHBondContact O-N 2.96Å; M283-L286 HydrophobicContact SD-CD1 3.67Å; M283-R287 WeakPolarHBondContact O-CB 3.2Å; M283-R287 PolarHBondContact O-N 2.69Å | ||
| 284 | A | 82.1 | Confident | 84.5 | Confident | 49 Ų | 49 | 56.6 Ų | 56.6 | 41% | 0.405 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64 | -37.2 | -173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | H288 | A284-H288 WeakPolarHBondContact O-CB 3.19Å; A284-H288 PolarHBondContact O-N 3.42Å |
| 285 | E | 83.4 | Confident | 84 | Confident | 111 Ų | 111 | 61 Ų | 61 | 52% | 0.519 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -66.6 | -43.9 | -179.6 | -61.9 | 77.5 | -169.8 | 0 | 0 | 111.8 | L45 M283 T289 | L45-E285 HydrophobicContact CD2-CB 4.07Å; M283-E285 VanDerWaalsContact C-N 3.3Å; M283-E285 PolarHBondContact O-N 2.72Å; E285-T289 WeakPolarHBondContact O-CB 3.33Å; E285-T289 PolarHBondContact O-N 3.23Å; E285-T289 VanDerWaalsContact O-N 3.08Å; E285-T289 PolarHBondContact O-OG1 3.13Å |
| 286 | L | 82.7 | Confident | 83 | Confident | 1 Ų | 1 | 63.7 Ų | 63.7 | 1% | 0.005 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -68.2 | -45.5 | 175.4 | -83.6 | 166.6 | 0 | 0 | 0 | 111 | L45 Y50 Y279 M283 H288 T289 F290 | L45-L286 HydrophobicContact CD1-CD2 3.68Å; L45-L286 HydrophobicContact CD1-CG 4.49Å; L45-L286 HydrophobicContact CD2-CG 4.48Å; Y50-L286 HydrophobicContact CD1-CD1 4.16Å; Y50-L286 HydrophobicContact CD1-CG 4.38Å; Y50-L286 HydrophobicContact CE1-CD1 3.94Å; Y50-L286 HydrophobicContact CE1-CG 4.03Å; Y279-L286 HydrophobicContact CG-CD1 4.29Å; M283-L286 HydrophobicContact CB-CB 4.11Å; M283-L286 HydrophobicContact CB-CD1 4.14Å; M283-L286 PolarHBondContact O-N 2.96Å; M283-L286 HydrophobicContact SD-CD1 3.67Å; L286-H288 VanDerWaalsContact C-N 3.28Å; L286-H288 PolarHBondContact O-N 3.13Å; L286-T289 CarbonylContact O-C 3.59Å; L286-T289 WeakPolarHBondContact O-CA 3.38Å; L286-T289 WeakPolarHBondContact O-CB 3.36Å; L286-T289 PolarHBondContact O-N 3.46Å; L286-F290 HydrophobicContact CB-CE2 4.46Å; L286-F290 HydrophobicContact CD2-CE1 4.34Å; L286-F290 HydrophobicContact CD2-CZ 4.18Å; L286-F290 WeakPolarHBondContact O-CG 3.33Å; L286-F290 PolarHBondContact O-N 2.83Å |
| 287 | R | 86.5 | Confident | 81.6 | Confident | 113 Ų | 113 | 67.7 Ų | 67.7 | 43% | 0.426 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -55.5 | -43.6 | 175.7 | -173.9 | 177.7 | 61.4 | -174.5 | -1.3 | 112.4 | A280 M283 T289 R291 | A280-R287 WeakPolarHBondContact O-CB 3.18Å; A280-R287 VanDerWaalsContact O-CD 3.28Å; A280-R287 WeakPolarHBondContact O-CD 3.28Å; A280-R287 WeakPolarHBondContact O-CG 3.45Å; M283-R287 WeakPolarHBondContact O-CB 3.2Å; M283-R287 PolarHBondContact O-N 2.69Å; R287-T289 VanDerWaalsContact C-N 3.34Å; R287-R291 WeakPolarHBondContact O-CG 3.25Å; R287-R291 PolarHBondContact O-N 3.28Å |
| 288 | H | 84.9 | Confident | 80.2 | Confident | 110 Ų | 110 | 69.3 Ų | 69.3 | 51% | 0.509 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 177 | -173.2 | 61.6 | 0 | 0 | 0 | 111.6 | A284 L286 R291 K292 | A284-H288 WeakPolarHBondContact O-CB 3.19Å; A284-H288 PolarHBondContact O-N 3.42Å; L286-H288 VanDerWaalsContact C-N 3.28Å; L286-H288 PolarHBondContact O-N 3.13Å; H288-R291 PolarHBondContact O-N 3.06Å; H288-K292 WeakPolarHBondContact NE2-CE 3.42Å; H288-K292 PolarHBondContact O-N 3.09Å |
| 289 | T | 83.8 | Confident | 78.5 | Confident | 12 Ų | 12 | 80 Ų | 80 | 7% | 0.074 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -64.9 | -44.6 | 177.8 | -56.4 | 0 | 0 | 0 | 0 | 111.6 | A38 L45 E285 L286 R287 R291 K292 M293 | A38-T289 HydrophobicContact CB-CG2 4.07Å; L45-T289 HydrophobicContact CD1-CG2 4.07Å; E285-T289 WeakPolarHBondContact O-CB 3.33Å; E285-T289 PolarHBondContact O-N 3.23Å; E285-T289 VanDerWaalsContact O-N 3.08Å; E285-T289 PolarHBondContact O-OG1 3.13Å; L286-T289 CarbonylContact O-C 3.59Å; L286-T289 WeakPolarHBondContact O-CA 3.38Å; L286-T289 WeakPolarHBondContact O-CB 3.36Å; L286-T289 PolarHBondContact O-N 3.46Å; R287-T289 VanDerWaalsContact C-N 3.34Å; T289-R291 PolarHBondContact O-N 3.21Å; T289-K292 PolarHBondContact O-N 3.22Å; T289-M293 HydrophobicContact CG2-CE 3.34Å; T289-M293 HydrophobicContact CG2-SD 4.14Å; T289-M293 WeakPolarHBondContact O-CG 3.5Å; T289-M293 PolarHBondContact O-N 2.9Å |
| 290 | F | 85.3 | Confident | 77 | Confident | 16 Ų | 16 | 88 Ų | 88 | 7% | 0.07 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -60.9 | -43.4 | 175.1 | -66.1 | -22.6 | 0 | 0 | 0 | 112.4 | L34 V35 A38 A280 L286 K292 M293 L294 | L34-F290 HydrophobicContact CD1-CD1 4.43Å; L34-F290 HydrophobicContact CD2-CD1 4.03Å; L34-F290 HydrophobicContact CD2-CE1 4.34Å; L34-F290 HydrophobicContact CD2-CG 4.3Å; L34-F290 HydrophobicContact CG-CD1 3.93Å; L34-F290 HydrophobicContact CG-CE1 3.99Å; V35-F290 HydrophobicContact CG2-CE1 4.43Å; V35-F290 HydrophobicContact CG2-CZ 3.77Å; A38-F290 HydrophobicContact CB-CD1 4.02Å; A38-F290 HydrophobicContact CB-CE1 3.66Å; A280-F290 HydrophobicContact CB-CD2 4.11Å; A280-F290 HydrophobicContact CB-CE2 4.2Å; L286-F290 HydrophobicContact CB-CE2 4.46Å; L286-F290 HydrophobicContact CD2-CE1 4.34Å; L286-F290 HydrophobicContact CD2-CZ 4.18Å; L286-F290 WeakPolarHBondContact O-CG 3.33Å; L286-F290 PolarHBondContact O-N 2.83Å; F290-K292 VanDerWaalsContact C-N 3.33Å; F290-K292 PolarHBondContact O-N 3.05Å; F290-M293 PolarHBondContact O-N 2.88Å; F290-L294 WeakPolarHBondContact O-CB 3.27Å; F290-L294 WeakPolarHBondContact O-CG 3.38Å; F290-L294 PolarHBondContact O-N 3.38Å |
| 291 | R | 83.6 | Confident | 75.6 | Confident | 151 Ų | 151 | 88.6 Ų | 88.6 | 57% | 0.57 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -59.8 | -43.7 | 174.8 | -74.8 | -175.9 | -174.8 | -150.2 | 0.1 | 111.7 | R287 H288 T289 M293 L294 F295 | R287-R291 WeakPolarHBondContact O-CG 3.25Å; R287-R291 PolarHBondContact O-N 3.28Å; H288-R291 PolarHBondContact O-N 3.06Å; T289-R291 PolarHBondContact O-N 3.21Å; R291-M293 VanDerWaalsContact C-N 3.31Å; R291-M293 PolarHBondContact O-N 3.06Å; R291-L294 PolarHBondContact O-N 2.82Å; R291-F295 HydrophobicContact CB-CD2 4.16Å; R291-F295 HydrophobicContact CB-CE2 4.47Å; R291-F295 HydrophobicContact CG-CD2 4.49Å; R291-F295 HydrophobicContact CG-CE2 4.3Å; R291-F295 WeakPolarHBondContact O-CB 3.22Å; R291-F295 VanDerWaalsContact O-CD2 3.23Å; R291-F295 WeakPolarHBondContact O-CD2 3.38Å; R291-F295 PolarHBondContact O-N 2.86Å |
| 292 | K | 81.6 | Confident | 74 | Confident | 69 Ų | 69 | 83 Ų | 83 | 30% | 0.3 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.1 | -39.3 | 177.6 | -77.9 | -173.1 | 167.1 | -161.3 | 0 | 113 | H288 T289 F290 C296 S297 | H288-K292 WeakPolarHBondContact NE2-CE 3.42Å; H288-K292 PolarHBondContact O-N 3.09Å; T289-K292 PolarHBondContact O-N 3.22Å; F290-K292 VanDerWaalsContact C-N 3.33Å; F290-K292 PolarHBondContact O-N 3.05Å; K292-C296 PolarHBondContact O-N 3.48Å; K292-S297 PolarHBondContact O-N 3.44Å |
| 293 | M | 80.6 | Confident | 72.5 | Confident | 5 Ų | 5 | 85.6 Ų | 85.6 | 3% | 0.025 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -71.1 | -46.4 | 178.8 | -69.8 | 171.2 | -173 | 0 | 0 | 111.7 | L34 A38 R41 T289 F290 R291 F301 | L34-M293 HydrophobicContact CD1-CB 4.49Å; L34-M293 HydrophobicContact CD1-SD 4.3Å; A38-M293 HydrophobicContact CB-CE 3.75Å; A38-M293 HydrophobicContact CB-SD 3.62Å; R41-M293 HydrophobicContact CB-CE 4.34Å; T289-M293 HydrophobicContact CG2-CE 3.34Å; T289-M293 HydrophobicContact CG2-SD 4.14Å; T289-M293 WeakPolarHBondContact O-CG 3.5Å; T289-M293 PolarHBondContact O-N 2.9Å; F290-M293 PolarHBondContact O-N 2.88Å; R291-M293 VanDerWaalsContact C-N 3.31Å; R291-M293 PolarHBondContact O-N 3.06Å; M293-F301 HydrophobicContact CE-CD1 3.38Å; M293-F301 HydrophobicContact CE-CE1 3.7Å; M293-F301 HydrophobicContact CG-CB 4.32Å; M293-F301 HydrophobicContact CG-CD1 4.26Å |
| 294 | L | 79.9 | Confident | 72 | Confident | 120 Ų | 120 | 89.2 Ų | 89.2 | 63% | 0.628 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -70.1 | -37.3 | -178 | -69.3 | 171.4 | 0 | 0 | 0 | 113.3 | F290 R291 | F290-L294 WeakPolarHBondContact O-CB 3.27Å; F290-L294 WeakPolarHBondContact O-CG 3.38Å; F290-L294 PolarHBondContact O-N 3.38Å; R291-L294 PolarHBondContact O-N 2.82Å |
| 295 | F | 79.1 | Confident | 71.4 | Confident | 149 Ų | 149 | 91.3 Ų | 91.3 | 65% | 0.654 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.3 | 9.9 | -179.2 | -64.1 | -68.2 | 0 | 0 | 0 | 113.4 | R291 S297 | R291-F295 HydrophobicContact CB-CD2 4.16Å; R291-F295 HydrophobicContact CB-CE2 4.47Å; R291-F295 HydrophobicContact CG-CD2 4.49Å; R291-F295 HydrophobicContact CG-CE2 4.3Å; R291-F295 WeakPolarHBondContact O-CB 3.22Å; R291-F295 VanDerWaalsContact O-CD2 3.23Å; R291-F295 WeakPolarHBondContact O-CD2 3.38Å; R291-F295 PolarHBondContact O-N 2.86Å; F295-S297 PolarHBondContact O-N 2.89Å; F295-S297 PolarHBondContact O-OG 3.41Å |
| 296 | C | 67.1 | Low | 70.8 | Confident | 55 Ų | 55 | 90.2 Ų | 90.2 | 37% | 0.372 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 39.1 | 40.1 | -178.6 | -66 | 0 | 0 | 0 | 0 | 114.4 | K292 D298 C302 | K292-C296 PolarHBondContact O-N 3.48Å; C296-D298 PolarHBondContact O-N 3.27Å; C296-D298 VanDerWaalsContact O-N 3.1Å; C296-C302 HydrophobicContact CB-CB 3.82Å; C296-C302 WeakPolarHBondContact CB-SG 3.38Å; C296-C302 WeakPolarHBondContact SG-CA 3.32Å; C296-C302 WeakPolarHBondContact SG-CB 3.43Å; C296-C302 CovalentContact SG-SG 2.03Å; C296-C302 PolarHBondContact SG-SG 3.46Å |
| 297 | S | 58.7 | Low | 70.1 | Confident | 92 Ų | 92 | 95.5 Ų | 95.5 | 64% | 0.643 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -71.7 | -5.1 | -177.9 | -48.6 | 0 | 0 | 0 | 0 | 112.7 | K292 F295 | K292-S297 PolarHBondContact O-N 3.44Å; F295-S297 PolarHBondContact O-N 2.89Å; F295-S297 PolarHBondContact O-OG 3.41Å |
| 298 | D | 57 | Low | 69.1 | Low | 68 Ų | 68 | 94.4 Ų | 94.4 | 36% | 0.364 | 45% | 0.451 | S | S | . | . | S | Bend | trans | -141.3 | 114.4 | 175.3 | -130.7 | -35.5 | 0 | 0 | 0 | 107.3 | C296 K300 F301 C302 | C296-D298 PolarHBondContact O-N 3.27Å; C296-D298 VanDerWaalsContact O-N 3.1Å; D298-K300 PolarHBondContact O-N 2.92Å; D298-F301 HydrophobicContact CB-CB 4.35Å; D298-F301 HydrophobicContact CB-CD2 4.22Å; D298-F301 PolarHBondContact O-N 2.84Å; D298-C302 PolarHBondContact O-N 2.87Å |
| 299 | W | 51.6 | Low | 68 | Low | 246 Ų | 246 | 93.3 Ų | 93.3 | 93% | 0.932 | 45% | 0.447 | S | S | * | . | G | 310 helix | trans | -58.8 | -26.5 | -174.8 | -150 | -58.3 | 0 | 0 | 0 | 112.3 | F301 | W299-F301 PolarHBondContact O-N 2.96Š|
| 300 | K | 55.4 | Low | 66.9 | Low | 169 Ų | 169 | 99.1 Ų | 99.1 | 74% | 0.735 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -72 | -2.4 | 174.4 | -69.6 | -177.2 | -178.9 | 176.1 | 0 | 114.3 | R41 D298 | R41-K300 PolarHBondContact NE-O 3.24Å; R41-K300 PolarHBondContact NH2-O 3.01Å; D298-K300 PolarHBondContact O-N 2.92Å |
| 301 | F | 54.3 | Low | 65.5 | Low | 40 Ų | 40 | 105.5 Ų | 105.5 | 18% | 0.175 | 51% | 0.505 | C | S | . | . | G | 310 helix | trans | -128.1 | -1.3 | -177.4 | -82.6 | -83.8 | 0 | 0 | 0 | 115 | R41 M293 D298 W299 L303 | R41-F301 VanDerWaalsContact C-CE1 3.49Å; R41-F301 HydrophobicContact CB-CD1 4.06Å; R41-F301 HydrophobicContact CB-CE1 3.64Å; R41-F301 HydrophobicContact CG-CD1 3.65Å; R41-F301 HydrophobicContact CG-CE1 3.47Å; R41-F301 VanDerWaalsContact CG-CE1 3.47Å; R41-F301 HydrophobicContact CG-CZ 4.18Å; R41-F301 VanDerWaalsContact CZ-CA 3.41Å; R41-F301 WeakPolarHBondContact O-CE1 3.42Å; R41-F301 WeakPolarHBondContact O-CZ 3.33Å; M293-F301 HydrophobicContact CE-CD1 3.38Å; M293-F301 HydrophobicContact CE-CE1 3.7Å; M293-F301 HydrophobicContact CG-CB 4.32Å; M293-F301 HydrophobicContact CG-CD1 4.26Å; D298-F301 HydrophobicContact CB-CB 4.35Å; D298-F301 HydrophobicContact CB-CD2 4.22Å; D298-F301 PolarHBondContact O-N 2.84Å; W299-F301 PolarHBondContact O-N 2.96Å; F301-L303 PolarHBondContact O-N 3.44Å |
| 302 | C | 50.5 | Low | 63.9 | Low | 48 Ų | 48 | 101.8 Ų | 101.8 | 32% | 0.324 | 50% | 0.499 | S | S | . | . | trans | -65.8 | 131.2 | 178.3 | -155.6 | 0 | 0 | 0 | 0 | 109.8 | R41 C296 D298 | R41-C302 PolarHBondContact NH1-O 3.23Å; R41-C302 PolarHBondContact NH2-O 2.95Å; C296-C302 HydrophobicContact CB-CB 3.82Å; C296-C302 WeakPolarHBondContact CB-SG 3.38Å; C296-C302 WeakPolarHBondContact SG-CA 3.32Å; C296-C302 WeakPolarHBondContact SG-CB 3.43Å; C296-C302 CovalentContact SG-SG 2.03Å; C296-C302 PolarHBondContact SG-SG 3.46Å; D298-C302 PolarHBondContact O-N 2.87Å | ||
| 303 | L | 51.5 | Low | 62.3 | Low | 160 Ų | 160 | 104.7 Ų | 104.7 | 84% | 0.838 | 52% | 0.517 | S | S | * | . | trans | -85.7 | 0 | 177.5 | -148.9 | 115.2 | 0 | 0 | 0 | 109.5 | L34 V37 F301 | L34-L303 HydrophobicContact CD1-CD1 4.39Å; V37-L303 HydrophobicContact CB-CD1 4.33Å; V37-L303 HydrophobicContact CG1-CD1 3.79Å; F301-L303 PolarHBondContact O-N 3.44Å |
Retrieved 303 of 303 residues in 469.5 ms
(Link to these results)