| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.1 | Very low | 40.6 | Very low | 246 Ų | 246 | 145.6 Ų | 145.6 | 100% | 1.212 | 83% | 0.829 | S | S | * | * | 0 | 102.6 | 0 | -72.6 | 173.4 | 178.7 | 0 | 0 | 107.3 | |||||
| 2 | I | 36.1 | Very low | 41.5 | Very low | 164 Ų | 164 | 148.5 Ų | 148.5 | 84% | 0.841 | 83% | 0.83 | S | S | * | * | trans | -89 | 112.2 | -177.7 | -61.8 | 170.8 | 0 | 0 | 0 | 106.5 | S4 | I2-S4 PolarHBondContact O-N 3.21Š| ||
| 3 | N | 36.2 | Very low | 42.6 | Very low | 157 Ų | 157 | 145.5 Ų | 145.5 | 84% | 0.84 | 83% | 0.825 | S | S | * | * | trans | -86.8 | 94 | -180 | -143.1 | 18.5 | 0 | 0 | 0 | 108.2 | T5 | N3-T5 PolarHBondContact O-N 3.26Š| ||
| 4 | S | 38.5 | Very low | 44.7 | Very low | 103 Ų | 103 | 138.3 Ų | 138.3 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | trans | -83.3 | 83.3 | 176.5 | -52.3 | 0 | 0 | 0 | 0 | 109.7 | I2 S6 | I2-S4 PolarHBondContact O-N 3.21Å; S4-S6 VanDerWaalsContact C-N 3.35Å; S4-S6 PolarHBondContact O-N 3.35Å | ||
| 5 | T | 42.1 | Very low | 46.7 | Very low | 121 Ų | 121 | 135.7 Ų | 135.7 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | trans | -70.4 | 93.4 | 162.6 | 6.9 | 0 | 0 | 0 | 0 | 108.2 | N3 T7 | N3-T5 PolarHBondContact O-N 3.26Å; T5-T7 VanDerWaalsContact C-N 3.31Å; T5-T7 PolarHBondContact O-N 3.33Å | ||
| 6 | S | 39.9 | Very low | 48.7 | Very low | 109 Ų | 109 | 133.8 Ų | 133.8 | 76% | 0.762 | 76% | 0.761 | S | S | * | * | trans | -72.4 | 92 | 164.7 | 62.9 | 0 | 0 | 0 | 0 | 108.2 | S4 Q8 | S4-S6 VanDerWaalsContact C-N 3.35Å; S4-S6 PolarHBondContact O-N 3.35Å; S6-Q8 PolarHBondContact O-N 3.46Å | ||
| 7 | T | 40.1 | Very low | 50.8 | Low | 130 Ų | 130 | 130 Ų | 130 | 80% | 0.798 | 74% | 0.738 | S | S | * | * | trans | -58.8 | 105.1 | 160 | 28.5 | 0 | 0 | 0 | 0 | 107.7 | T5 | T5-T7 VanDerWaalsContact C-N 3.31Å; T5-T7 PolarHBondContact O-N 3.33Å | ||
| 8 | Q | 41.6 | Very low | 52.8 | Low | 178 Ų | 178 | 128.1 Ų | 128.1 | 83% | 0.832 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 130.5 | 163.2 | -77.5 | -173.5 | -57.6 | 0 | 0 | 107.5 | S6 | S6-Q8 PolarHBondContact O-N 3.46Š|
| 9 | P | 41.6 | Very low | 54.7 | Low | 110 Ų | 110 | 126.4 Ų | 126.4 | 71% | 0.714 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 144.1 | 172.7 | 26.1 | -30.3 | 0 | 0 | 0 | 108.5 | D11 | P9-D11 PolarHBondContact O-N 2.96Š|
| 10 | P | 45.5 | Very low | 56.5 | Low | 120 Ų | 120 | 121.8 Ų | 121.8 | 78% | 0.779 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 133.2 | -179.4 | 24.1 | -32 | 0 | 0 | 0 | 109.2 | E12 | P10-E12 PolarHBondContact O-N 2.96Š|
| 11 | D | 48.5 | Very low | 57.9 | Low | 164 Ų | 164 | 116.8 Ų | 116.8 | 88% | 0.877 | 66% | 0.659 | S | S | * | * | trans | -47.8 | 106.4 | 171.2 | -82.2 | -42.3 | 0 | 0 | 0 | 108.6 | P9 S13 | P9-D11 PolarHBondContact O-N 2.96Å; D11-S13 PolarHBondContact O-N 3.47Å | ||
| 12 | E | 50.6 | Low | 60.5 | Low | 180 Ų | 180 | 108.8 Ų | 108.8 | 84% | 0.841 | 62% | 0.618 | S | S | * | * | trans | -54.7 | 114 | 167.7 | -91 | -171.1 | 157.7 | 0 | 0 | 106.5 | P10 C14 | P10-E12 PolarHBondContact O-N 2.96Å; E12-C14 VanDerWaalsContact C-N 3.29Å; E12-C14 PolarHBondContact O-N 3.42Å | ||
| 13 | S | 56.3 | Low | 63.2 | Low | 110 Ų | 110 | 106.3 Ų | 106.3 | 77% | 0.769 | 60% | 0.603 | S | S | * | * | trans | -58.3 | 95.6 | 175.3 | 60.4 | 0 | 0 | 0 | 0 | 108 | D11 S15 | D11-S13 PolarHBondContact O-N 3.47Å; S13-S15 VanDerWaalsContact C-N 3.34Å; S13-S15 PolarHBondContact O-N 3.48Å | ||
| 14 | C | 71.9 | Confident | 66.1 | Low | 44 Ų | 44 | 102.1 Ų | 102.1 | 30% | 0.297 | 58% | 0.58 | S | S | . | * | trans | -73.6 | 97.9 | -178.1 | 119.9 | 0 | 0 | 0 | 0 | 107.8 | E12 C267 | E12-C14 VanDerWaalsContact C-N 3.29Å; E12-C14 PolarHBondContact O-N 3.42Å; C14-C267 HydrophobicContact CB-CB 3.63Å; C14-C267 WeakPolarHBondContact CB-SG 3.27Å; C14-C267 WeakPolarHBondContact SG-CB 3.39Å; C14-C267 PolarHBondContact SG-O 3.13Å; C14-C267 VanDerWaalsContact SG-O 3.37Å; C14-C267 CovalentContact SG-SG 2.05Å; C14-C267 PolarHBondContact SG-SG 3.22Å | ||
| 15 | S | 74.4 | Confident | 68.8 | Low | 100 Ų | 100 | 97.3 Ų | 97.3 | 70% | 0.699 | 55% | 0.546 | S | S | * | . | trans | -77.4 | 138.4 | -174 | 169.1 | 0 | 0 | 0 | 0 | 110.2 | S13 N17 | S13-S15 VanDerWaalsContact C-N 3.34Å; S13-S15 PolarHBondContact O-N 3.48Å; S15-N17 PolarHBondContact O-N 3.24Å | ||
| 16 | K | 78.8 | Confident | 71.4 | Confident | 104 Ų | 104 | 91.8 Ų | 91.8 | 45% | 0.452 | 51% | 0.513 | S | S | . | . | trans | -68 | 127.1 | 172.7 | -67.6 | 179.3 | -178.1 | 169.5 | 0 | 109.5 | L18 E271 | K16-L18 PolarHBondContact O-N 3.13Å; K16-E271 VanDerWaalsContact CA-OE1 3.22Å; K16-E271 WeakPolarHBondContact CA-OE1 3.49Å; K16-E271 WeakPolarHBondContact CG-OE1 3.48Å | ||
| 17 | N | 85.1 | Confident | 74.1 | Confident | 70 Ų | 70 | 91.2 Ų | 91.2 | 37% | 0.374 | 50% | 0.504 | S | S | . | . | trans | -74.3 | 94.9 | 174.3 | -165.1 | -43.1 | 0 | 0 | 0 | 109 | S15 L19 I20 T21 Y275 | S15-N17 PolarHBondContact O-N 3.24Å; N17-L19 VanDerWaalsContact C-N 3.26Å; N17-L19 PolarHBondContact O-N 2.99Å; N17-L19 VanDerWaalsContact OD1-CB 3.23Å; N17-L19 WeakPolarHBondContact OD1-CB 3.45Å; N17-L19 PolarHBondContact OD1-N 2.79Å; N17-I20 HydrophobicContact CB-CB 4.4Å; N17-I20 HydrophobicContact CB-CD1 4Å; N17-I20 HydrophobicContact CB-CG1 4.21Å; N17-I20 PolarHBondContact O-N 3.38Å; N17-I20 PolarHBondContact OD1-N 3.33Å; N17-T21 PolarHBondContact O-N 2.96Å; N17-T21 PolarHBondContact O-OG1 3.49Å; N17-Y275 WeakPolarHBondContact CA-OH 3.47Å; N17-Y275 WeakPolarHBondContact CB-OH 3.5Å; N17-Y275 PolarHBondContact N-OH 3.46Å | ||
| 18 | L | 85.8 | Confident | 76.8 | Confident | 96 Ų | 96 | 88.3 Ų | 88.3 | 50% | 0.503 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.6 | -30.7 | -178.8 | -62.5 | 177.6 | 0 | 0 | 0 | 111.7 | K16 I20 T21 Q22 | K16-L18 PolarHBondContact O-N 3.13Å; L18-I20 VanDerWaalsContact C-N 3.35Å; L18-I20 PolarHBondContact O-N 3.16Å; L18-T21 PolarHBondContact O-N 2.95Å; L18-Q22 HydrophobicContact CB-CG 4.46Å; L18-Q22 HydrophobicContact CD2-CG 4.27Å; L18-Q22 WeakPolarHBondContact O-CA 3.47Å; L18-Q22 VanDerWaalsContact O-CB 3.28Å; L18-Q22 WeakPolarHBondContact O-CB 3.44Å; L18-Q22 PolarHBondContact O-N 3.44Å |
| 19 | L | 89.4 | Confident | 79.5 | Confident | 95 Ų | 95 | 79.9 Ų | 79.9 | 50% | 0.497 | 44% | 0.444 | S | S | . | . | I | π-helix | trans | -57.8 | -48.5 | 173.8 | -172.8 | 96.8 | 0 | 0 | 0 | 110.7 | N17 Q23 I24 | N17-L19 VanDerWaalsContact C-N 3.26Å; N17-L19 PolarHBondContact O-N 2.99Å; N17-L19 VanDerWaalsContact OD1-CB 3.23Å; N17-L19 WeakPolarHBondContact OD1-CB 3.45Å; N17-L19 PolarHBondContact OD1-N 2.79Å; L19-Q23 WeakPolarHBondContact O-CA 3.28Å; L19-Q23 VanDerWaalsContact O-CB 3.3Å; L19-Q23 WeakPolarHBondContact O-CB 3.46Å; L19-Q23 PolarHBondContact O-N 3.13Å; L19-Q23 VanDerWaalsContact O-N 3.16Å; L19-I24 HydrophobicContact CD2-CD1 3.94Å; L19-I24 HydrophobicContact CG-CD1 4.31Å; L19-I24 PolarHBondContact O-N 3.35Å |
| 20 | I | 90 | Very high | 82.2 | Confident | 34 Ų | 34 | 76.9 Ų | 76.9 | 17% | 0.174 | 43% | 0.425 | C | S | . | . | I | π-helix | trans | -64.6 | -45.8 | -179.6 | -63.9 | 175.8 | 0 | 0 | 0 | 110.8 | N17 L18 I24 I25 Y275 F279 | N17-I20 HydrophobicContact CB-CB 4.4Å; N17-I20 HydrophobicContact CB-CD1 4Å; N17-I20 HydrophobicContact CB-CG1 4.21Å; N17-I20 PolarHBondContact O-N 3.38Å; N17-I20 PolarHBondContact OD1-N 3.33Å; L18-I20 VanDerWaalsContact C-N 3.35Å; L18-I20 PolarHBondContact O-N 3.16Å; I20-I24 HydrophobicContact CG1-CD1 4.28Å; I20-I25 HydrophobicContact CG2-CD1 4Å; I20-I25 HydrophobicContact CG2-CG1 4.49Å; I20-I25 WeakPolarHBondContact O-CG1 3.41Å; I20-I25 PolarHBondContact O-N 2.87Å; I20-Y275 HydrophobicContact CB-CE1 4.24Å; I20-Y275 HydrophobicContact CD1-CE1 4.47Å; I20-Y275 HydrophobicContact CD1-CE2 4.32Å; I20-Y275 HydrophobicContact CG2-CD1 3.81Å; I20-Y275 HydrophobicContact CG2-CE1 4.01Å; I20-Y275 HydrophobicContact CG2-CG 4.46Å; I20-F279 HydrophobicContact CG2-CE2 3.9Å; I20-F279 HydrophobicContact CG2-CZ 4.09Å |
| 21 | T | 87.4 | Confident | 84.7 | Confident | 18 Ų | 18 | 74 Ų | 74 | 11% | 0.11 | 41% | 0.411 | C | S | . | . | I | π-helix | trans | -88.9 | -30.9 | -166.7 | 48.2 | 0 | 0 | 0 | 0 | 114.8 | N17 L18 I25 P26 Y275 | N17-T21 PolarHBondContact O-N 2.96Å; N17-T21 PolarHBondContact O-OG1 3.49Å; L18-T21 PolarHBondContact O-N 2.95Å; T21-I25 HydrophobicContact CG2-CD1 4.42Å; T21-P26 WeakPolarHBondContact O-CD 3.19Å; T21-Y275 HydrophobicContact CG2-CD1 4.13Å; T21-Y275 HydrophobicContact CG2-CE1 3.67Å |
| 22 | Q | 91.8 | Very high | 87 | Confident | 77 Ų | 77 | 67.1 Ų | 67.1 | 36% | 0.36 | 38% | 0.375 | S | S | . | . | I | π-helix | trans | -104.2 | -13.1 | -178.7 | -53.5 | -169.8 | -49.7 | 0 | 0 | 113.3 | L18 D81 S82 | L18-Q22 HydrophobicContact CB-CG 4.46Å; L18-Q22 HydrophobicContact CD2-CG 4.27Å; L18-Q22 WeakPolarHBondContact O-CA 3.47Å; L18-Q22 VanDerWaalsContact O-CB 3.28Å; L18-Q22 WeakPolarHBondContact O-CB 3.44Å; L18-Q22 PolarHBondContact O-N 3.44Å; Q22-D81 WeakPolarHBondContact CA-O 3.38Å; Q22-D81 WeakPolarHBondContact CG-O 3.07Å; Q22-S82 WeakPolarHBondContact O-CA 3.48Å |
| 23 | Q | 92.7 | Very high | 89.3 | Confident | 113 Ų | 113 | 61.2 Ų | 61.2 | 53% | 0.528 | 35% | 0.347 | S | S | . | . | I | π-helix | trans | -121.6 | -62.9 | 179 | -55.6 | -178.1 | -13 | 0 | 0 | 112.4 | L19 P26 V27 | L19-Q23 WeakPolarHBondContact O-CA 3.28Å; L19-Q23 VanDerWaalsContact O-CB 3.3Å; L19-Q23 WeakPolarHBondContact O-CB 3.46Å; L19-Q23 PolarHBondContact O-N 3.13Å; L19-Q23 VanDerWaalsContact O-N 3.16Å; Q23-P26 WeakPolarHBondContact O-CD 3.24Å; Q23-V27 WeakPolarHBondContact O-CB 3.36Å; Q23-V27 WeakPolarHBondContact O-CG2 3.42Å; Q23-V27 PolarHBondContact O-N 3.28Å |
| 24 | I | 95.7 | Very high | 91.2 | Very high | 68 Ų | 68 | 60.9 Ų | 60.9 | 35% | 0.349 | 34% | 0.335 | S | S | . | . | I | π-helix | trans | -61.9 | -53.9 | -172.1 | -62.9 | 176 | 0 | 0 | 0 | 111.4 | L19 I20 V27 L28 F279 | L19-I24 HydrophobicContact CD2-CD1 3.94Å; L19-I24 HydrophobicContact CG-CD1 4.31Å; L19-I24 PolarHBondContact O-N 3.35Å; I20-I24 HydrophobicContact CG1-CD1 4.28Å; I24-V27 PolarHBondContact O-N 3.03Å; I24-L28 HydrophobicContact CG2-CD1 3.94Å; I24-L28 VanDerWaalsContact O-CG 3.31Å; I24-L28 WeakPolarHBondContact O-CG 3.34Å; I24-L28 PolarHBondContact O-N 3.17Å; I24-F279 HydrophobicContact CG2-CE1 4.39Å; I24-F279 HydrophobicContact CG2-CZ 4.33Å |
| 25 | I | 95.2 | Very high | 92.4 | Very high | 2 Ų | 2 | 60.5 Ų | 60.5 | 1% | 0.01 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.2 | -49.7 | -179 | -71.7 | 161.5 | 0 | 0 | 0 | 111.4 | I20 T21 V27 L28 Y29 E278 F279 | I20-I25 HydrophobicContact CG2-CD1 4Å; I20-I25 HydrophobicContact CG2-CG1 4.49Å; I20-I25 WeakPolarHBondContact O-CG1 3.41Å; I20-I25 PolarHBondContact O-N 2.87Å; T21-I25 HydrophobicContact CG2-CD1 4.42Å; I25-V27 PolarHBondContact O-N 3Å; I25-L28 PolarHBondContact O-N 3.43Å; I25-Y29 HydrophobicContact CG2-CD2 3.76Å; I25-Y29 HydrophobicContact CG2-CE2 3.93Å; I25-Y29 WeakPolarHBondContact O-CD2 3.31Å; I25-Y29 PolarHBondContact O-N 3.39Å; I25-E278 HydrophobicContact CD1-CB 3.61Å; I25-E278 HydrophobicContact CD1-CG 4.26Å; I25-F279 HydrophobicContact CG1-CE1 4.42Å; I25-F279 HydrophobicContact CG1-CZ 4.41Å |
| 26 | P | 96.3 | Very high | 93.4 | Very high | 6 Ų | 6 | 55.7 Ų | 55.7 | 4% | 0.039 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -57.3 | -43.6 | 175.6 | -30.5 | 38.7 | 0 | 0 | 0 | 114.2 | T21 Q23 L28 Y29 C30 I78 D81 | T21-P26 WeakPolarHBondContact O-CD 3.19Å; Q23-P26 WeakPolarHBondContact O-CD 3.24Å; P26-L28 VanDerWaalsContact C-N 3.33Å; P26-L28 PolarHBondContact O-N 3.02Å; P26-Y29 CarbonylContact O-C 3.59Å; P26-Y29 PolarHBondContact O-N 3.39Å; P26-C30 PolarHBondContact O-N 2.91Å; P26-C30 PolarHBondContact O-SG 3.43Å; P26-C30 VanDerWaalsContact O-SG 3.36Å; P26-I78 HydrophobicContact CB-CG2 4.19Å; P26-D81 HydrophobicContact CG-CB 3.96Å |
| 27 | V | 97.4 | Very high | 94.2 | Very high | 97 Ų | 97 | 53.2 Ų | 53.2 | 59% | 0.588 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -61.7 | -41.6 | 177.8 | 167.8 | 0 | 0 | 0 | 0 | 111.4 | Q23 I24 I25 C30 A31 | Q23-V27 WeakPolarHBondContact O-CB 3.36Å; Q23-V27 WeakPolarHBondContact O-CG2 3.42Å; Q23-V27 PolarHBondContact O-N 3.28Å; I24-V27 PolarHBondContact O-N 3.03Å; I25-V27 PolarHBondContact O-N 3Å; V27-C30 WeakPolarHBondContact O-CB 3.34Å; V27-C30 PolarHBondContact O-N 3.18Å; V27-A31 PolarHBondContact O-N 3.19Å; V27-A31 VanDerWaalsContact O-N 3.1Å |
| 28 | L | 97.7 | Very high | 94.7 | Very high | 69 Ų | 69 | 55.2 Ų | 55.2 | 36% | 0.361 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -66.2 | -40.4 | 175.6 | -66.4 | 171.6 | 0 | 0 | 0 | 111.8 | I24 I25 P26 C30 A31 V32 F279 L282 | I24-L28 HydrophobicContact CG2-CD1 3.94Å; I24-L28 VanDerWaalsContact O-CG 3.31Å; I24-L28 WeakPolarHBondContact O-CG 3.34Å; I24-L28 PolarHBondContact O-N 3.17Å; I25-L28 PolarHBondContact O-N 3.43Å; P26-L28 VanDerWaalsContact C-N 3.33Å; P26-L28 PolarHBondContact O-N 3.02Å; L28-C30 VanDerWaalsContact C-N 3.31Å; L28-C30 PolarHBondContact O-N 3.47Å; L28-A31 PolarHBondContact O-N 3.32Å; L28-V32 WeakPolarHBondContact O-CG2 3.31Å; L28-V32 PolarHBondContact O-N 3.03Å; L28-F279 HydrophobicContact CD1-CE1 4.1Å; L28-L282 HydrophobicContact CB-CD1 4.05Å; L28-L282 HydrophobicContact CB-CD2 3.52Å; L28-L282 HydrophobicContact CB-CG 4.42Å; L28-L282 HydrophobicContact CD1-CD2 3.55Å; L28-L282 HydrophobicContact CG-CD2 4.15Å |
| 29 | Y | 97.5 | Very high | 95.1 | Very high | 1 Ų | 1 | 54 Ų | 54 | 0% | 0.004 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.4 | -35.9 | 172.4 | -95.2 | -80.7 | 0 | 0 | 0 | 112.3 | I25 P26 V32 F33 F74 K77 F101 L282 A285 | I25-Y29 HydrophobicContact CG2-CD2 3.76Å; I25-Y29 HydrophobicContact CG2-CE2 3.93Å; I25-Y29 WeakPolarHBondContact O-CD2 3.31Å; I25-Y29 PolarHBondContact O-N 3.39Å; P26-Y29 CarbonylContact O-C 3.59Å; P26-Y29 PolarHBondContact O-N 3.39Å; Y29-V32 PolarHBondContact O-N 3.3Å; Y29-F33 VanDerWaalsContact O-CB 3.28Å; Y29-F33 WeakPolarHBondContact O-CB 3.49Å; Y29-F33 PolarHBondContact O-N 3Å; Y29-F74 HydrophobicContact CD1-CB 4.42Å; Y29-F74 HydrophobicContact CD1-CD1 4.34Å; Y29-F74 HydrophobicContact CD1-CG 4.18Å; Y29-F74 HydrophobicContact CE1-CD1 4.3Å; Y29-K77 HydrophobicContact CE1-CD 4.1Å; Y29-K77 HydrophobicContact CE2-CD 4.18Å; Y29-K77 WeakPolarHBondContact OH-CE 3.46Å; Y29-F101 HydrophobicContact CE1-CE2 4.43Å; Y29-L282 HydrophobicContact CD1-CD1 4.15Å; Y29-L282 HydrophobicContact CD2-CB 4.47Å; Y29-L282 HydrophobicContact CD2-CD1 3.48Å; Y29-L282 VanDerWaalsContact CD2-CD1 3.48Å; Y29-L282 HydrophobicContact CE1-CD1 4.29Å; Y29-L282 HydrophobicContact CE2-CB 3.81Å; Y29-L282 HydrophobicContact CE2-CD1 3.6Å; Y29-L282 HydrophobicContact CE2-CG 4.3Å; Y29-L282 HydrophobicContact CG-CD1 3.75Å; Y29-A285 HydrophobicContact CE1-CB 3.65Å |
| 30 | C | 97.8 | Very high | 95.3 | Very high | 47 Ų | 47 | 49.5 Ų | 49.5 | 32% | 0.318 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -59.8 | -46.3 | 172.6 | -71.8 | 0 | 0 | 0 | 0 | 111.4 | P26 V27 L28 V32 F33 I34 I78 | P26-C30 PolarHBondContact O-N 2.91Å; P26-C30 PolarHBondContact O-SG 3.43Å; P26-C30 VanDerWaalsContact O-SG 3.36Å; V27-C30 WeakPolarHBondContact O-CB 3.34Å; V27-C30 PolarHBondContact O-N 3.18Å; L28-C30 VanDerWaalsContact C-N 3.31Å; L28-C30 PolarHBondContact O-N 3.47Å; C30-V32 PolarHBondContact O-N 3.4Å; C30-F33 PolarHBondContact O-N 3.38Å; C30-I34 WeakPolarHBondContact O-CG1 3.34Å; C30-I34 PolarHBondContact O-N 3.06Å; C30-I78 HydrophobicContact CB-CD1 4.41Å; C30-I78 WeakPolarHBondContact SG-CG2 3.4Å |
| 31 | A | 97.9 | Very high | 95.5 | Very high | 59 Ų | 59 | 49.3 Ų | 49.3 | 49% | 0.488 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -61.8 | -44.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | V27 L28 F33 I34 A35 | V27-A31 PolarHBondContact O-N 3.19Å; V27-A31 VanDerWaalsContact O-N 3.1Å; L28-A31 PolarHBondContact O-N 3.32Å; A31-F33 VanDerWaalsContact C-N 3.34Å; A31-F33 PolarHBondContact O-N 2.63Å; A31-I34 PolarHBondContact O-N 3.33Å; A31-A35 WeakPolarHBondContact O-CB 3.06Å; A31-A35 PolarHBondContact O-N 2.9Å |
| 32 | V | 97.8 | Very high | 95.8 | Very high | 19 Ų | 19 | 51.2 Ų | 51.2 | 12% | 0.115 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.2 | -39.5 | 175.5 | 173.4 | 0 | 0 | 0 | 0 | 111.4 | L28 Y29 C30 G36 F74 L282 A286 V288 C289 | L28-V32 WeakPolarHBondContact O-CG2 3.31Å; L28-V32 PolarHBondContact O-N 3.03Å; Y29-V32 PolarHBondContact O-N 3.3Å; C30-V32 PolarHBondContact O-N 3.4Å; V32-G36 WeakPolarHBondContact O-CA 3.42Å; V32-G36 PolarHBondContact O-N 3.27Å; V32-F74 HydrophobicContact CG1-CD2 4.32Å; V32-F74 HydrophobicContact CG1-CE2 3.75Å; V32-L282 HydrophobicContact CG2-CD1 4.11Å; V32-A286 HydrophobicContact CG1-CB 4.49Å; V32-A286 HydrophobicContact CG2-CB 4.19Å; V32-V288 HydrophobicContact CG1-CG2 4.13Å; V32-C289 PolarHBondContact O-SG 3.46Å |
| 33 | F | 97.9 | Very high | 95.9 | Very high | 57 Ų | 57 | 47.7 Ų | 47.7 | 25% | 0.25 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.8 | -50.4 | 177.1 | 171.8 | -111.3 | 0 | 0 | 0 | 112.2 | Y29 C30 A31 G36 I37 S71 F74 P75 I78 | Y29-F33 VanDerWaalsContact O-CB 3.28Å; Y29-F33 WeakPolarHBondContact O-CB 3.49Å; Y29-F33 PolarHBondContact O-N 3Å; C30-F33 PolarHBondContact O-N 3.38Å; A31-F33 VanDerWaalsContact C-N 3.34Å; A31-F33 PolarHBondContact O-N 2.63Å; F33-G36 PolarHBondContact O-N 3.33Å; F33-I37 HydrophobicContact CD2-CG1 3.8Å; F33-I37 HydrophobicContact CE2-CD1 3.98Å; F33-I37 HydrophobicContact CE2-CG1 3.43Å; F33-I37 VanDerWaalsContact CE2-CG1 3.43Å; F33-I37 HydrophobicContact CZ-CG1 3.93Å; F33-I37 WeakPolarHBondContact O-CB 3.36Å; F33-I37 WeakPolarHBondContact O-CG1 3.18Å; F33-I37 PolarHBondContact O-N 3.4Å; F33-S71 VanDerWaalsContact CD2-O 3.25Å; F33-S71 WeakPolarHBondContact CD2-O 3.49Å; F33-S71 WeakPolarHBondContact CE2-O 3.48Å; F33-F74 HydrophobicContact CB-CB 4.08Å; F33-F74 HydrophobicContact CB-CD2 3.98Å; F33-F74 HydrophobicContact CD2-CB 4.08Å; F33-F74 HydrophobicContact CD2-CD2 4.33Å; F33-F74 HydrophobicContact CG-CB 4.4Å; F33-P75 HydrophobicContact CD1-CG 4.4Å; F33-P75 HydrophobicContact CD2-CG 3.96Å; F33-P75 HydrophobicContact CE1-CG 4.02Å; F33-P75 HydrophobicContact CE2-CG 3.53Å; F33-P75 HydrophobicContact CG-CG 4.37Å; F33-P75 HydrophobicContact CZ-CG 3.56Å; F33-I78 HydrophobicContact CB-CD1 4.42Å |
| 34 | I | 97.7 | Very high | 95.9 | Very high | 102 Ų | 102 | 42.7 Ų | 42.7 | 52% | 0.523 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -61.3 | -50.8 | -179.9 | -66.3 | 166.8 | 0 | 0 | 0 | 109.9 | C30 A31 G36 L38 | C30-I34 WeakPolarHBondContact O-CG1 3.34Å; C30-I34 PolarHBondContact O-N 3.06Å; A31-I34 PolarHBondContact O-N 3.33Å; I34-G36 PolarHBondContact O-N 3.4Å; I34-L38 HydrophobicContact CG2-CD1 3.97Å; I34-L38 WeakPolarHBondContact O-CB 3.46Å; I34-L38 VanDerWaalsContact O-CG 3.23Å; I34-L38 WeakPolarHBondContact O-CG 3.07Å; I34-L38 PolarHBondContact O-N 3.1Å; I34-L38 VanDerWaalsContact O-N 3.14Å |
| 35 | A | 96.3 | Very high | 95.9 | Very high | 36 Ų | 36 | 45.5 Ų | 45.5 | 30% | 0.298 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.4 | -43.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | A31 L38 L39 | A31-A35 WeakPolarHBondContact O-CB 3.06Å; A31-A35 PolarHBondContact O-N 2.9Å; A35-L38 PolarHBondContact O-N 3.23Å; A35-L39 HydrophobicContact CB-CD1 4.47Å; A35-L39 VanDerWaalsContact O-CB 3.29Å; A35-L39 WeakPolarHBondContact O-CB 3.42Å; A35-L39 WeakPolarHBondContact O-CG 3.47Å; A35-L39 PolarHBondContact O-N 3.15Å |
| 36 | G | 95.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.3 | -47.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | V32 F33 I34 N40 | V32-G36 WeakPolarHBondContact O-CA 3.42Å; V32-G36 PolarHBondContact O-N 3.27Å; F33-G36 PolarHBondContact O-N 3.33Å; I34-G36 PolarHBondContact O-N 3.4Å; G36-N40 VanDerWaalsContact O-CB 3.25Å; G36-N40 WeakPolarHBondContact O-CB 3.49Å; G36-N40 PolarHBondContact O-N 3.37Å; G36-N40 PolarHBondContact O-ND2 3.01Å |
| 37 | I | 95.8 | Very high | 95.7 | Very high | 52 Ų | 52 | 45.5 Ų | 45.5 | 27% | 0.267 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -64.5 | -42.4 | 177.3 | -70.2 | -65.3 | 0 | 0 | 0 | 111.3 | F33 G41 L72 | F33-I37 HydrophobicContact CD2-CG1 3.8Å; F33-I37 HydrophobicContact CE2-CD1 3.98Å; F33-I37 HydrophobicContact CE2-CG1 3.43Å; F33-I37 VanDerWaalsContact CE2-CG1 3.43Å; F33-I37 HydrophobicContact CZ-CG1 3.93Å; F33-I37 WeakPolarHBondContact O-CB 3.36Å; F33-I37 WeakPolarHBondContact O-CG1 3.18Å; F33-I37 PolarHBondContact O-N 3.4Å; I37-G41 WeakPolarHBondContact O-CA 3.4Å; I37-G41 PolarHBondContact O-N 3.05Å; I37-L72 HydrophobicContact CD1-CD2 4.28Å |
| 38 | L | 95.4 | Very high | 95.4 | Very high | 112 Ų | 112 | 49.3 Ų | 49.3 | 59% | 0.586 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -65.4 | -50.4 | 178.7 | -69.6 | 173.1 | 0 | 0 | 0 | 111.5 | I34 A35 G41 V42 | I34-L38 HydrophobicContact CG2-CD1 3.97Å; I34-L38 WeakPolarHBondContact O-CB 3.46Å; I34-L38 VanDerWaalsContact O-CG 3.23Å; I34-L38 WeakPolarHBondContact O-CG 3.07Å; I34-L38 PolarHBondContact O-N 3.1Å; I34-L38 VanDerWaalsContact O-N 3.14Å; A35-L38 PolarHBondContact O-N 3.23Å; L38-G41 PolarHBondContact O-N 3.39Å; L38-V42 WeakPolarHBondContact O-CG2 3.3Å; L38-V42 PolarHBondContact O-N 3.47Å |
| 39 | L | 94.2 | Very high | 95.1 | Very high | 71 Ų | 71 | 51.6 Ų | 51.6 | 37% | 0.372 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -71.1 | -42.1 | -175 | -65.5 | 168.2 | 0 | 0 | 0 | 112.5 | A35 S43 C289 P292 | A35-L39 HydrophobicContact CB-CD1 4.47Å; A35-L39 VanDerWaalsContact O-CB 3.29Å; A35-L39 WeakPolarHBondContact O-CB 3.42Å; A35-L39 WeakPolarHBondContact O-CG 3.47Å; A35-L39 PolarHBondContact O-N 3.15Å; L39-S43 WeakPolarHBondContact O-CB 3.38Å; L39-S43 PolarHBondContact O-N 2.96Å; L39-S43 PolarHBondContact O-OG 2.88Å; L39-C289 HydrophobicContact CD1-CB 4.16Å; L39-P292 HydrophobicContact CB-CB 4.36Å; L39-P292 HydrophobicContact CB-CG 3.68Å |
| 40 | N | 93.9 | Very high | 94.7 | Very high | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -70.8 | -35.8 | 173.1 | -70.4 | -66.3 | 0 | 0 | 0 | 111.1 | G36 V42 S43 G44 F68 V288 | G36-N40 VanDerWaalsContact O-CB 3.25Å; G36-N40 WeakPolarHBondContact O-CB 3.49Å; G36-N40 PolarHBondContact O-N 3.37Å; G36-N40 PolarHBondContact O-ND2 3.01Å; N40-V42 PolarHBondContact O-N 3.43Å; N40-S43 CarbonylContact O-C 3.6Å; N40-S43 PolarHBondContact O-N 3.28Å; N40-G44 PolarHBondContact O-N 2.98Å; N40-F68 HydrophobicContact CB-CD1 4.09Å; N40-F68 HydrophobicContact CB-CD2 4.26Å; N40-F68 HydrophobicContact CB-CE1 3.94Å; N40-F68 HydrophobicContact CB-CE2 4.11Å; N40-F68 HydrophobicContact CB-CG 4.27Å; N40-F68 HydrophobicContact CB-CZ 3.99Å; N40-F68 VanDerWaalsContact O-CE2 3.23Å; N40-F68 WeakPolarHBondContact O-CE2 3.44Å; N40-F68 WeakPolarHBondContact O-CZ 2.96Å; N40-V288 PolarHBondContact ND2-O 3.21Å |
| 41 | G | 94.1 | Very high | 94.3 | Very high | 30 Ų | 30 | 53.3 Ų | 53.3 | 31% | 0.309 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -44 | -61.3 | 168.7 | 0 | 0 | 0 | 0 | 0 | 112 | I37 L38 S43 W45 F68 | I37-G41 WeakPolarHBondContact O-CA 3.4Å; I37-G41 PolarHBondContact O-N 3.05Å; L38-G41 PolarHBondContact O-N 3.39Å; G41-S43 PolarHBondContact O-N 3.3Å; G41-W45 WeakPolarHBondContact O-CB 3.04Å; G41-W45 PolarHBondContact O-N 3.07Å; G41-F68 VanDerWaalsContact N-CE1 3.34Å |
| 42 | V | 93.5 | Very high | 93.9 | Very high | 57 Ų | 57 | 52.6 Ų | 52.6 | 35% | 0.345 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.9 | -44.4 | 176.3 | 173.9 | 0 | 0 | 0 | 0 | 111 | L38 N40 G44 W45 I46 L306 | L38-V42 WeakPolarHBondContact O-CG2 3.3Å; L38-V42 PolarHBondContact O-N 3.47Å; N40-V42 PolarHBondContact O-N 3.43Å; V42-G44 PolarHBondContact O-N 3.46Å; V42-W45 WeakPolarHBondContact O-CB 3.4Å; V42-W45 PolarHBondContact O-N 3.46Å; V42-I46 HydrophobicContact CG1-CG1 4.32Å; V42-I46 WeakPolarHBondContact O-CG1 3.35Å; V42-I46 PolarHBondContact O-N 3.22Å; V42-L306 HydrophobicContact CG1-CD1 3.76Å |
| 43 | S | 93.4 | Very high | 93.3 | Very high | 3 Ų | 3 | 55.1 Ų | 55.1 | 2% | 0.021 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.4 | -47.8 | -178 | -60.6 | 0 | 0 | 0 | 0 | 112.3 | L39 N40 G41 W45 I46 F47 Y295 | L39-S43 WeakPolarHBondContact O-CB 3.38Å; L39-S43 PolarHBondContact O-N 2.96Å; L39-S43 PolarHBondContact O-OG 2.88Å; N40-S43 CarbonylContact O-C 3.6Å; N40-S43 PolarHBondContact O-N 3.28Å; G41-S43 PolarHBondContact O-N 3.3Å; S43-W45 PolarHBondContact O-N 3Å; S43-I46 PolarHBondContact O-N 3.12Å; S43-F47 WeakPolarHBondContact O-CB 3.32Å; S43-F47 WeakPolarHBondContact O-CD2 3.32Å; S43-F47 PolarHBondContact O-N 3.46Å; S43-Y295 WeakPolarHBondContact OG-CD2 3.39Å |
| 44 | G | 94.1 | Very high | 92.8 | Very high | 9 Ų | 9 | 56.9 Ų | 56.9 | 9% | 0.093 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58.1 | -47.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | N40 V42 I46 F47 F48 | N40-G44 PolarHBondContact O-N 2.98Å; V42-G44 PolarHBondContact O-N 3.46Å; G44-I46 VanDerWaalsContact C-N 3.34Å; G44-I46 PolarHBondContact O-N 3.36Å; G44-F47 PolarHBondContact O-N 2.7Å; G44-F47 VanDerWaalsContact O-N 3.15Å; G44-F48 WeakPolarHBondContact O-CD2 3.49Å; G44-F48 PolarHBondContact O-N 3.36Å; G44-F48 VanDerWaalsContact O-N 3.1Å |
| 45 | W | 94.5 | Very high | 92.4 | Very high | 126 Ų | 126 | 52.2 Ų | 52.2 | 48% | 0.477 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -54.8 | -47.8 | 176.1 | -176.8 | 30.4 | 0 | 0 | 0 | 112.5 | G41 V42 S43 F48 Y49 | G41-W45 WeakPolarHBondContact O-CB 3.04Å; G41-W45 PolarHBondContact O-N 3.07Å; V42-W45 WeakPolarHBondContact O-CB 3.4Å; V42-W45 PolarHBondContact O-N 3.46Å; S43-W45 PolarHBondContact O-N 3Å; W45-F48 WeakPolarHBondContact O-CB 3.45Å; W45-F48 PolarHBondContact O-N 3.25Å; W45-Y49 AromaticContact CD1-CE2 3.68Å; W45-Y49 AromaticContact NE1-CE2 3.44Å; W45-Y49 AromaticContact NE1-CZ 3.97Å; W45-Y49 VanDerWaalsContact O-CD2 3.31Å; W45-Y49 WeakPolarHBondContact O-CD2 3.47Å |
| 46 | I | 93.6 | Very high | 92.1 | Very high | 1 Ų | 1 | 50.9 Ų | 50.9 | 1% | 0.005 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.5 | -41.2 | 177.6 | -62.3 | -60.4 | 0 | 0 | 0 | 111.4 | V42 S43 G44 F48 Y49 V50 F302 I305 L306 K309 | V42-I46 HydrophobicContact CG1-CG1 4.32Å; V42-I46 WeakPolarHBondContact O-CG1 3.35Å; V42-I46 PolarHBondContact O-N 3.22Å; S43-I46 PolarHBondContact O-N 3.12Å; G44-I46 VanDerWaalsContact C-N 3.34Å; G44-I46 PolarHBondContact O-N 3.36Å; I46-F48 PolarHBondContact O-N 3.2Å; I46-Y49 PolarHBondContact O-N 2.74Å; I46-V50 HydrophobicContact CG2-CG2 4.16Å; I46-V50 WeakPolarHBondContact O-CG2 3.41Å; I46-V50 PolarHBondContact O-N 3.34Å; I46-F302 HydrophobicContact CB-CD2 3.92Å; I46-F302 HydrophobicContact CB-CE2 3.65Å; I46-F302 HydrophobicContact CB-CZ 4.32Å; I46-F302 HydrophobicContact CG1-CE2 4.43Å; I46-F302 HydrophobicContact CG2-CB 4.46Å; I46-F302 HydrophobicContact CG2-CD2 3.39Å; I46-F302 HydrophobicContact CG2-CE2 3.65Å; I46-F302 HydrophobicContact CG2-CG 3.91Å; I46-F302 HydrophobicContact CG2-CZ 4.36Å; I46-I305 HydrophobicContact CD1-CG2 4.12Å; I46-I305 HydrophobicContact CG2-CB 4.16Å; I46-I305 HydrophobicContact CG2-CG2 4.03Å; I46-L306 HydrophobicContact CD1-CB 4.36Å; I46-L306 HydrophobicContact CD1-CD1 4.09Å; I46-L306 HydrophobicContact CG1-CB 4.34Å; I46-L306 HydrophobicContact CG1-CD1 3.87Å; I46-K309 HydrophobicContact CD1-CB 4.37Å; I46-K309 HydrophobicContact CD1-CG 4.34Å |
| 47 | F | 93.2 | Very high | 91.9 | Very high | 7 Ų | 7 | 50.9 Ų | 50.9 | 3% | 0.031 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.4 | -19.7 | 179.9 | -85.3 | -61.6 | 0 | 0 | 0 | 114.2 | S43 G44 Y49 V50 I57 L60 K61 V64 Y295 F302 | S43-F47 WeakPolarHBondContact O-CB 3.32Å; S43-F47 WeakPolarHBondContact O-CD2 3.32Å; S43-F47 PolarHBondContact O-N 3.46Å; G44-F47 PolarHBondContact O-N 2.7Å; G44-F47 VanDerWaalsContact O-N 3.15Å; F47-Y49 VanDerWaalsContact C-N 3.26Å; F47-Y49 PolarHBondContact O-N 2.92Å; F47-V50 HydrophobicContact CD1-CB 4.08Å; F47-V50 HydrophobicContact CD1-CG1 4.35Å; F47-V50 HydrophobicContact CD1-CG2 4.25Å; F47-V50 PolarHBondContact O-N 3.01Å; F47-I57 HydrophobicContact CE1-CG2 4.48Å; F47-L60 HydrophobicContact CE1-CB 4.17Å; F47-L60 HydrophobicContact CE1-CD1 4.44Å; F47-L60 HydrophobicContact CZ-CB 3.78Å; F47-L60 HydrophobicContact CZ-CD1 4.08Å; F47-K61 HydrophobicContact CB-CG 4.12Å; F47-K61 HydrophobicContact CD1-CG 3.88Å; F47-K61 HydrophobicContact CG-CG 4.06Å; F47-K61 WeakPolarHBondContact O-CE 3.24Å; F47-K61 PolarHBondContact O-NZ 3.41Å; F47-K61 VanDerWaalsContact O-NZ 3.16Å; F47-V64 HydrophobicContact CD2-CG2 3.75Å; F47-V64 HydrophobicContact CE2-CG2 3.72Å; F47-Y295 HydrophobicContact CE2-CD1 4.27Å; F47-Y295 AromaticContact CE2-CD2 3.74Å; F47-Y295 HydrophobicContact CE2-CD2 3.74Å; F47-Y295 HydrophobicContact CE2-CE2 4.12Å; F47-Y295 AromaticContact CE2-CG 3.85Å; F47-Y295 HydrophobicContact CE2-CG 3.85Å; F47-Y295 HydrophobicContact CZ-CD1 4.28Å; F47-Y295 HydrophobicContact CZ-CD2 4.41Å; F47-Y295 HydrophobicContact CZ-CG 4.06Å; F47-F302 HydrophobicContact CD1-CD2 4.17Å; F47-F302 AromaticContact CD2-CD2 3.91Å; F47-F302 HydrophobicContact CD2-CD2 3.91Å; F47-F302 AromaticContact CD2-CE2 3.8Å; F47-F302 HydrophobicContact CD2-CE2 3.8Å; F47-F302 AromaticContact CE1-CD2 3.94Å; F47-F302 HydrophobicContact CE1-CD2 3.94Å; F47-F302 AromaticContact CE2-CD2 3.67Å; F47-F302 HydrophobicContact CE2-CD2 3.67Å; F47-F302 AromaticContact CE2-CE2 3.64Å; F47-F302 HydrophobicContact CE2-CE2 3.64Å; F47-F302 HydrophobicContact CG-CD2 4.15Å; F47-F302 HydrophobicContact CG-CE2 4.4Å; F47-F302 AromaticContact CZ-CD2 3.67Å; F47-F302 HydrophobicContact CZ-CD2 3.67Å; F47-F302 HydrophobicContact CZ-CE2 4.12Å; F47-F302 HydrophobicContact CZ-CG 4.36Å |
| 48 | F | 91.6 | Very high | 91.9 | Very high | 177 Ų | 177 | 49 Ų | 49 | 78% | 0.776 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -62.3 | -33.9 | 168.1 | -76.9 | -70.6 | 0 | 0 | 0 | 112.4 | G44 W45 I46 | G44-F48 WeakPolarHBondContact O-CD2 3.49Å; G44-F48 PolarHBondContact O-N 3.36Å; G44-F48 VanDerWaalsContact O-N 3.1Å; W45-F48 WeakPolarHBondContact O-CB 3.45Å; W45-F48 PolarHBondContact O-N 3.25Å; I46-F48 PolarHBondContact O-N 3.2Å |
| 49 | Y | 90.8 | Very high | 91.9 | Very high | 118 Ų | 118 | 43.8 Ų | 43.8 | 46% | 0.463 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -90.5 | -14.5 | 178.1 | -57.7 | -74.8 | 0 | 0 | 0 | 113.5 | W45 I46 F47 P51 | W45-Y49 AromaticContact CD1-CE2 3.68Å; W45-Y49 AromaticContact NE1-CE2 3.44Å; W45-Y49 AromaticContact NE1-CZ 3.97Å; W45-Y49 VanDerWaalsContact O-CD2 3.31Å; W45-Y49 WeakPolarHBondContact O-CD2 3.47Å; I46-Y49 PolarHBondContact O-N 2.74Å; F47-Y49 VanDerWaalsContact C-N 3.26Å; F47-Y49 PolarHBondContact O-N 2.92Å; Y49-P51 WeakPolarHBondContact O-CD 3.47Å |
| 50 | V | 90.4 | Very high | 91.9 | Very high | 2 Ų | 2 | 40.4 Ų | 40.4 | 1% | 0.012 | 21% | 0.21 | C | C | . | . | S | Bend | trans | -80.8 | 118.1 | 177.8 | 176.5 | 0 | 0 | 0 | 0 | 109.6 | I46 F47 I57 K61 P301 F302 I305 | I46-V50 HydrophobicContact CG2-CG2 4.16Å; I46-V50 WeakPolarHBondContact O-CG2 3.41Å; I46-V50 PolarHBondContact O-N 3.34Å; F47-V50 HydrophobicContact CD1-CB 4.08Å; F47-V50 HydrophobicContact CD1-CG1 4.35Å; F47-V50 HydrophobicContact CD1-CG2 4.25Å; F47-V50 PolarHBondContact O-N 3.01Å; V50-I57 HydrophobicContact CG1-CD1 4.26Å; V50-I57 HydrophobicContact CG1-CG2 3.97Å; V50-K61 WeakPolarHBondContact O-CE 3.45Å; V50-K61 PolarHBondContact O-NZ 3.18Å; V50-P301 HydrophobicContact CG1-CB 4.08Å; V50-F302 HydrophobicContact CG2-CB 4.16Å; V50-I305 HydrophobicContact CG2-CD1 3.75Å |
| 51 | P | 88.7 | Confident | 92 | Very high | 81 Ų | 81 | 42.7 Ų | 42.7 | 53% | 0.526 | 22% | 0.22 | S | C | . | . | trans | -67.8 | 140.9 | 177.5 | 27.8 | -34 | 0 | 0 | 0 | 110.9 | Y49 S53 | Y49-P51 WeakPolarHBondContact O-CD 3.47Å; P51-S53 PolarHBondContact O-N 3.4Å | ||
| 52 | S | 89.5 | Confident | 92.1 | Very high | 45 Ų | 45 | 42.3 Ų | 42.3 | 32% | 0.315 | 21% | 0.211 | S | C | . | . | trans | -78.4 | 56.2 | 178.2 | -58.6 | 0 | 0 | 0 | 0 | 111.9 | K61 V135 | S52-K61 PolarHBondContact OG-NZ 3.34Å; S52-V135 WeakPolarHBondContact O-CG1 3.41Å | ||
| 53 | S | 85.8 | Confident | 92.3 | Very high | 72 Ų | 72 | 39.6 Ų | 39.6 | 50% | 0.503 | 20% | 0.195 | S | C | . | . | trans | -84.3 | -11.4 | -174.1 | 58.1 | 0 | 0 | 0 | 0 | 114.5 | P51 | P51-S53 PolarHBondContact O-N 3.4Š| ||
| 54 | K | 87.5 | Confident | 92.4 | Very high | 94 Ų | 94 | 39.7 Ų | 39.7 | 41% | 0.409 | 20% | 0.195 | S | C | . | . | S | Bend | trans | -133.5 | 141.4 | -178.1 | -60.1 | 177 | -175 | 166.4 | 0 | 109.9 | F56 I57 | K54-F56 HydrophobicContact CB-CD1 3.82Å; K54-F56 HydrophobicContact CB-CE1 3.75Å; K54-F56 HydrophobicContact CD-CD1 4.44Å; K54-F56 HydrophobicContact CD-CE1 3.61Å; K54-F56 HydrophobicContact CD-CZ 4.4Å; K54-F56 HydrophobicContact CG-CE1 4.29Å; K54-F56 PolarHBondContact O-N 2.67Å; K54-I57 HydrophobicContact CB-CD1 4.01Å; K54-I57 HydrophobicContact CB-CG1 4.16Å; K54-I57 HydrophobicContact CD-CD1 4.49Å; K54-I57 HydrophobicContact CG-CD1 4.37Å; K54-I57 WeakPolarHBondContact O-CB 3.49Å; K54-I57 PolarHBondContact O-N 2.84Å |
| 55 | S | 89.6 | Confident | 92.5 | Very high | 3 Ų | 3 | 43.4 Ų | 43.4 | 2% | 0.021 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -41.1 | -56.1 | 174.4 | 45.8 | 0 | 0 | 0 | 0 | 113.5 | I57 I58 Y59 D118 Q133 S138 | S55-I57 PolarHBondContact O-N 2.81Å; S55-I58 WeakPolarHBondContact O-CB 3.48Å; S55-I58 PolarHBondContact O-N 3.45Å; S55-Y59 PolarHBondContact O-N 3.17Å; S55-D118 WeakPolarHBondContact CB-OD1 2.93Å; S55-D118 PolarHBondContact OG-OD1 3.37Å; S55-Q133 WeakPolarHBondContact CB-O 2.94Å; S55-S138 VanDerWaalsContact CA-OG 3.3Å; S55-S138 WeakPolarHBondContact CA-OG 3.46Å; S55-S138 WeakPolarHBondContact CB-OG 3.34Å |
| 56 | F | 88.9 | Confident | 92.7 | Very high | 9 Ų | 9 | 37.4 Ų | 37.4 | 4% | 0.039 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63.2 | -26.1 | -176.9 | 83.5 | -89 | 0 | 0 | 0 | 113.9 | K54 I58 Y59 L60 R119 L298 C299 | K54-F56 HydrophobicContact CB-CD1 3.82Å; K54-F56 HydrophobicContact CB-CE1 3.75Å; K54-F56 HydrophobicContact CD-CD1 4.44Å; K54-F56 HydrophobicContact CD-CE1 3.61Å; K54-F56 HydrophobicContact CD-CZ 4.4Å; K54-F56 HydrophobicContact CG-CE1 4.29Å; K54-F56 PolarHBondContact O-N 2.67Å; F56-I58 VanDerWaalsContact C-N 3.27Å; F56-I58 PolarHBondContact O-N 3.48Å; F56-Y59 PolarHBondContact O-N 3Å; F56-L60 HydrophobicContact CD2-CD1 3.76Å; F56-L60 HydrophobicContact CD2-CG 4.24Å; F56-L60 HydrophobicContact CE2-CD1 3.82Å; F56-L60 WeakPolarHBondContact O-CG 3.44Å; F56-L60 PolarHBondContact O-N 3.32Å; F56-R119 VanDerWaalsContact CD1-NH2 3.34Å; F56-L298 HydrophobicContact CD2-CD2 3.98Å; F56-L298 HydrophobicContact CD2-CG 4.24Å; F56-L298 HydrophobicContact CE2-CD2 4.31Å; F56-L298 HydrophobicContact CE2-CG 4.12Å; F56-C299 HydrophobicContact CE2-CB 4.24Å |
| 57 | I | 92.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -66.6 | -35.4 | 176.9 | -64.6 | 174.3 | 0 | 0 | 0 | 109.8 | F47 V50 K54 S55 L60 K61 | F47-I57 HydrophobicContact CE1-CG2 4.48Å; V50-I57 HydrophobicContact CG1-CD1 4.26Å; V50-I57 HydrophobicContact CG1-CG2 3.97Å; K54-I57 HydrophobicContact CB-CD1 4.01Å; K54-I57 HydrophobicContact CB-CG1 4.16Å; K54-I57 HydrophobicContact CD-CD1 4.49Å; K54-I57 HydrophobicContact CG-CD1 4.37Å; K54-I57 WeakPolarHBondContact O-CB 3.49Å; K54-I57 PolarHBondContact O-N 2.84Å; S55-I57 PolarHBondContact O-N 2.81Å; I57-L60 PolarHBondContact O-N 3.29Å; I57-K61 WeakPolarHBondContact O-CG 3.33Å; I57-K61 PolarHBondContact O-N 3.46Å |
| 58 | I | 95.3 | Very high | 93 | Very high | 11 Ų | 11 | 39.7 Ų | 39.7 | 6% | 0.056 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.8 | -46.2 | 174.8 | -63.7 | 164.5 | 0 | 0 | 0 | 109.8 | S55 F56 L60 K61 N62 V135 K139 | S55-I58 WeakPolarHBondContact O-CB 3.48Å; S55-I58 PolarHBondContact O-N 3.45Å; F56-I58 VanDerWaalsContact C-N 3.27Å; F56-I58 PolarHBondContact O-N 3.48Å; I58-L60 PolarHBondContact O-N 3.03Å; I58-K61 PolarHBondContact O-N 2.98Å; I58-N62 PolarHBondContact O-N 3.06Å; I58-N62 VanDerWaalsContact O-N 3.09Å; I58-N62 PolarHBondContact O-ND2 2.92Å; I58-V135 HydrophobicContact CD1-CB 4.17Å; I58-V135 HydrophobicContact CD1-CG1 3.56Å; I58-V135 WeakPolarHBondContact CD1-O 3.33Å; I58-K139 HydrophobicContact CD1-CG 3.8Å; I58-K139 HydrophobicContact CG2-CG 4.48Å |
| 59 | Y | 95.3 | Very high | 93.2 | Very high | 3 Ų | 3 | 33.7 Ų | 33.7 | 1% | 0.012 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.9 | -42.7 | 178.2 | -54.3 | -33 | 0 | 0 | 0 | 111.8 | S55 F56 K61 N62 I63 F111 L114 I115 D118 S138 | S55-Y59 PolarHBondContact O-N 3.17Å; F56-Y59 PolarHBondContact O-N 3Å; Y59-K61 PolarHBondContact O-N 2.91Å; Y59-N62 PolarHBondContact O-N 3.38Å; Y59-N62 VanDerWaalsContact O-N 3.16Å; Y59-I63 WeakPolarHBondContact O-CG1 3.11Å; Y59-I63 PolarHBondContact O-N 3.14Å; Y59-F111 AromaticContact CD1-CD1 3.73Å; Y59-F111 HydrophobicContact CD1-CD1 3.73Å; Y59-F111 AromaticContact CD1-CE1 3.81Å; Y59-F111 HydrophobicContact CD1-CE1 3.81Å; Y59-F111 HydrophobicContact CG-CD1 4.08Å; Y59-L114 HydrophobicContact CD1-CB 4.46Å; Y59-L114 HydrophobicContact CD1-CD1 4.33Å; Y59-L114 HydrophobicContact CD2-CB 4.01Å; Y59-L114 HydrophobicContact CE1-CB 4.37Å; Y59-L114 HydrophobicContact CE1-CD1 4.06Å; Y59-L114 HydrophobicContact CE2-CB 3.92Å; Y59-L114 HydrophobicContact CG-CB 4.3Å; Y59-I115 HydrophobicContact CD2-CG1 3.96Å; Y59-I115 HydrophobicContact CG-CG1 4.26Å; Y59-D118 HydrophobicContact CE2-CB 4.42Å; Y59-S138 VanDerWaalsContact CZ-OG 3.31Å; Y59-S138 PolarHBondContact OH-OG 3.29Å |
| 60 | L | 94.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -60 | -42.3 | 175.1 | -68 | -179.8 | 0 | 0 | 0 | 112.7 | F47 F56 I57 I58 N62 I63 V64 I115 I294 Y295 L298 C299 | F47-L60 HydrophobicContact CE1-CB 4.17Å; F47-L60 HydrophobicContact CE1-CD1 4.44Å; F47-L60 HydrophobicContact CZ-CB 3.78Å; F47-L60 HydrophobicContact CZ-CD1 4.08Å; F56-L60 HydrophobicContact CD2-CD1 3.76Å; F56-L60 HydrophobicContact CD2-CG 4.24Å; F56-L60 HydrophobicContact CE2-CD1 3.82Å; F56-L60 WeakPolarHBondContact O-CG 3.44Å; F56-L60 PolarHBondContact O-N 3.32Å; I57-L60 PolarHBondContact O-N 3.29Å; I58-L60 PolarHBondContact O-N 3.03Å; L60-N62 VanDerWaalsContact C-N 3.29Å; L60-N62 PolarHBondContact O-N 3Å; L60-I63 PolarHBondContact O-N 2.75Å; L60-V64 WeakPolarHBondContact O-CG2 3.1Å; L60-V64 PolarHBondContact O-N 3.12Å; L60-I115 HydrophobicContact CD2-CD1 3.71Å; L60-I115 HydrophobicContact CG-CD1 4.4Å; L60-I294 HydrophobicContact CD2-CG2 4.39Å; L60-Y295 HydrophobicContact CD1-CD1 4.4Å; L60-Y295 HydrophobicContact CD2-CD1 3.75Å; L60-Y295 HydrophobicContact CD2-CE1 3.83Å; L60-Y295 HydrophobicContact CG-CD1 4.45Å; L60-L298 HydrophobicContact CD1-CD2 4.27Å; L60-L298 HydrophobicContact CD2-CD2 4.22Å; L60-C299 HydrophobicContact CD1-CB 3.97Å |
| 61 | K | 95.6 | Very high | 93.9 | Very high | 49 Ų | 49 | 28 Ų | 28 | 21% | 0.213 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.7 | -37.8 | 175.9 | -72.9 | -176.6 | 179 | -173.3 | 0 | 112.1 | F47 V50 S52 I57 I58 Y59 V64 I65 | F47-K61 HydrophobicContact CB-CG 4.12Å; F47-K61 HydrophobicContact CD1-CG 3.88Å; F47-K61 HydrophobicContact CG-CG 4.06Å; F47-K61 WeakPolarHBondContact O-CE 3.24Å; F47-K61 PolarHBondContact O-NZ 3.41Å; F47-K61 VanDerWaalsContact O-NZ 3.16Å; V50-K61 WeakPolarHBondContact O-CE 3.45Å; V50-K61 PolarHBondContact O-NZ 3.18Å; S52-K61 PolarHBondContact OG-NZ 3.34Å; I57-K61 WeakPolarHBondContact O-CG 3.33Å; I57-K61 PolarHBondContact O-N 3.46Å; I58-K61 PolarHBondContact O-N 2.98Å; Y59-K61 PolarHBondContact O-N 2.91Å; K61-V64 PolarHBondContact O-N 3.25Å; K61-I65 WeakPolarHBondContact O-CG1 3.48Å; K61-I65 PolarHBondContact O-N 3.28Å; K61-I65 VanDerWaalsContact O-N 3.12Å |
| 62 | N | 97.3 | Very high | 94.3 | Very high | 21 Ų | 21 | 29.1 Ų | 29.1 | 11% | 0.112 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -69.4 | -37.3 | 176 | -75.6 | -87.8 | 0 | 0 | 0 | 112.6 | I58 Y59 L60 V64 I65 A66 F111 S142 W146 | I58-N62 PolarHBondContact O-N 3.06Å; I58-N62 VanDerWaalsContact O-N 3.09Å; I58-N62 PolarHBondContact O-ND2 2.92Å; Y59-N62 PolarHBondContact O-N 3.38Å; Y59-N62 VanDerWaalsContact O-N 3.16Å; L60-N62 VanDerWaalsContact C-N 3.29Å; L60-N62 PolarHBondContact O-N 3Å; N62-V64 VanDerWaalsContact C-N 3.35Å; N62-I65 PolarHBondContact O-N 3.43Å; N62-A66 WeakPolarHBondContact O-CB 3.45Å; N62-A66 PolarHBondContact O-N 2.97Å; N62-F111 HydrophobicContact CB-CD1 4.23Å; N62-F111 HydrophobicContact CB-CD2 3.77Å; N62-F111 HydrophobicContact CB-CE1 3.82Å; N62-F111 HydrophobicContact CB-CE2 3.31Å; N62-F111 HydrophobicContact CB-CG 4.23Å; N62-F111 HydrophobicContact CB-CZ 3.34Å; N62-F111 VanDerWaalsContact CG-CZ 3.47Å; N62-S142 PolarHBondContact ND2-OG 2.88Å; N62-W146 PolarHBondContact OD1-NE1 2.54Å |
| 63 | I | 96.4 | Very high | 94.7 | Very high | 1 Ų | 1 | 27.3 Ų | 27.3 | 1% | 0.005 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.2 | -47.9 | 172.7 | -68.1 | 174.5 | 0 | 0 | 0 | 109.9 | Y59 L60 I65 A66 D67 F111 F112 I115 D291 Y295 | Y59-I63 WeakPolarHBondContact O-CG1 3.11Å; Y59-I63 PolarHBondContact O-N 3.14Å; L60-I63 PolarHBondContact O-N 2.75Å; I63-I65 VanDerWaalsContact C-N 3.3Å; I63-I65 PolarHBondContact O-N 3.08Å; I63-A66 CarbonylContact O-C 3.17Å; I63-A66 WeakPolarHBondContact O-CB 3.42Å; I63-A66 PolarHBondContact O-N 3.1Å; I63-D67 WeakPolarHBondContact CG2-OD2 3.49Å; I63-D67 WeakPolarHBondContact O-CB 3.44Å; I63-D67 VanDerWaalsContact O-CG 3.31Å; I63-D67 PolarHBondContact O-N 2.93Å; I63-F111 HydrophobicContact CD1-CB 3.92Å; I63-F111 HydrophobicContact CG1-CB 3.56Å; I63-F111 HydrophobicContact CG1-CG 4.31Å; I63-F112 HydrophobicContact CD1-CE2 4.48Å; I63-I115 HydrophobicContact CD1-CD1 3.52Å; I63-D291 HydrophobicContact CG2-CB 4.3Å; I63-D291 WeakPolarHBondContact CG2-OD2 3.43Å; I63-Y295 WeakPolarHBondContact CG2-OH 3.3Å |
| 64 | V | 96.3 | Very high | 95.3 | Very high | 5 Ų | 5 | 23.9 Ų | 23.9 | 3% | 0.03 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -56.1 | -45.4 | 176.9 | 171 | 0 | 0 | 0 | 0 | 111.6 | F47 L60 K61 N62 A66 D67 F68 Y295 | F47-V64 HydrophobicContact CD2-CG2 3.75Å; F47-V64 HydrophobicContact CE2-CG2 3.72Å; L60-V64 WeakPolarHBondContact O-CG2 3.1Å; L60-V64 PolarHBondContact O-N 3.12Å; K61-V64 PolarHBondContact O-N 3.25Å; N62-V64 VanDerWaalsContact C-N 3.35Å; V64-A66 PolarHBondContact O-N 3.12Å; V64-D67 PolarHBondContact O-N 3.39Å; V64-F68 HydrophobicContact CG1-CD2 3.59Å; V64-F68 HydrophobicContact CG1-CE2 3.4Å; V64-F68 VanDerWaalsContact CG1-CE2 3.4Å; V64-F68 WeakPolarHBondContact O-CD2 3.36Å; V64-F68 PolarHBondContact O-N 3.3Å; V64-Y295 HydrophobicContact CG2-CD2 4.36Å; V64-Y295 HydrophobicContact CG2-CE1 4.4Å; V64-Y295 HydrophobicContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CZ 3.47Å; V64-Y295 VanDerWaalsContact CG2-OH 3.25Å; V64-Y295 WeakPolarHBondContact CG2-OH 3.25Å |
| 65 | I | 96.9 | Very high | 95.8 | Very high | 86 Ų | 86 | 21.2 Ų | 21.2 | 44% | 0.441 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -60.2 | -47.2 | 176.4 | -66.6 | 164.3 | 0 | 0 | 0 | 110.6 | K61 N62 I63 D67 F68 V69 W146 | K61-I65 WeakPolarHBondContact O-CG1 3.48Å; K61-I65 PolarHBondContact O-N 3.28Å; K61-I65 VanDerWaalsContact O-N 3.12Å; N62-I65 PolarHBondContact O-N 3.43Å; I63-I65 VanDerWaalsContact C-N 3.3Å; I63-I65 PolarHBondContact O-N 3.08Å; I65-D67 PolarHBondContact O-N 3Å; I65-F68 PolarHBondContact O-N 2.94Å; I65-V69 WeakPolarHBondContact O-CG2 3.23Å; I65-V69 PolarHBondContact O-N 2.74Å; I65-W146 HydrophobicContact CG2-CH2 4.39Å; I65-W146 HydrophobicContact CG2-CZ2 4.07Å |
| 66 | A | 97.6 | Very high | 96.1 | Very high | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61.7 | -44.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | N62 I63 V64 F68 V69 M70 N104 V107 W146 | N62-A66 WeakPolarHBondContact O-CB 3.45Å; N62-A66 PolarHBondContact O-N 2.97Å; I63-A66 CarbonylContact O-C 3.17Å; I63-A66 WeakPolarHBondContact O-CB 3.42Å; I63-A66 PolarHBondContact O-N 3.1Å; V64-A66 PolarHBondContact O-N 3.12Å; A66-F68 PolarHBondContact O-N 3.5Å; A66-V69 PolarHBondContact O-N 3.49Å; A66-M70 VanDerWaalsContact O-CB 3.27Å; A66-M70 WeakPolarHBondContact O-CB 3.29Å; A66-M70 PolarHBondContact O-N 3.06Å; A66-N104 WeakPolarHBondContact CA-OD1 3.37Å; A66-N104 HydrophobicContact CB-CB 4.25Å; A66-N104 WeakPolarHBondContact O-CB 3.47Å; A66-V107 HydrophobicContact CB-CB 4.2Å; A66-V107 HydrophobicContact CB-CG1 3.75Å; A66-W146 HydrophobicContact CB-CH2 4.18Å; A66-W146 HydrophobicContact CB-CZ2 4.37Å |
| 67 | D | 97 | Very high | 96.4 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -66.5 | -36.5 | 179.7 | -69.6 | -16.1 | 0 | 0 | 0 | 112 | I63 V64 I65 S71 S108 N287 V288 D291 | I63-D67 WeakPolarHBondContact CG2-OD2 3.49Å; I63-D67 WeakPolarHBondContact O-CB 3.44Å; I63-D67 VanDerWaalsContact O-CG 3.31Å; I63-D67 PolarHBondContact O-N 2.93Å; V64-D67 PolarHBondContact O-N 3.39Å; I65-D67 PolarHBondContact O-N 3Å; D67-S71 VanDerWaalsContact O-CB 3.25Å; D67-S71 WeakPolarHBondContact O-CB 3.33Å; D67-S71 PolarHBondContact O-N 2.95Å; D67-S71 PolarHBondContact O-OG 3.13Å; D67-S108 PolarHBondContact OD1-OG 2.75Å; D67-N287 PolarHBondContact OD1-ND2 3.09Å; D67-V288 HydrophobicContact CB-CB 4.08Å; D67-V288 HydrophobicContact CB-CG1 3.81Å; D67-D291 VanDerWaalsContact OD2-OD2 3.05Å |
| 68 | F | 96.2 | Very high | 96.7 | Very high | 57 Ų | 57 | 26.6 Ų | 26.6 | 25% | 0.25 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -62.3 | -52.8 | 170.9 | -86.9 | -65.1 | 0 | 0 | 0 | 111.7 | N40 G41 V64 I65 A66 M70 S71 L72 | N40-F68 HydrophobicContact CB-CD1 4.09Å; N40-F68 HydrophobicContact CB-CD2 4.26Å; N40-F68 HydrophobicContact CB-CE1 3.94Å; N40-F68 HydrophobicContact CB-CE2 4.11Å; N40-F68 HydrophobicContact CB-CG 4.27Å; N40-F68 HydrophobicContact CB-CZ 3.99Å; N40-F68 VanDerWaalsContact O-CE2 3.23Å; N40-F68 WeakPolarHBondContact O-CE2 3.44Å; N40-F68 WeakPolarHBondContact O-CZ 2.96Å; G41-F68 VanDerWaalsContact N-CE1 3.34Å; V64-F68 HydrophobicContact CG1-CD2 3.59Å; V64-F68 HydrophobicContact CG1-CE2 3.4Å; V64-F68 VanDerWaalsContact CG1-CE2 3.4Å; V64-F68 WeakPolarHBondContact O-CD2 3.36Å; V64-F68 PolarHBondContact O-N 3.3Å; I65-F68 PolarHBondContact O-N 2.94Å; A66-F68 PolarHBondContact O-N 3.5Å; F68-M70 PolarHBondContact O-N 3.27Å; F68-S71 PolarHBondContact O-N 3.03Å; F68-S71 VanDerWaalsContact O-N 3.16Å; F68-L72 WeakPolarHBondContact O-CG 3.29Å; F68-L72 PolarHBondContact O-N 3.48Å |
| 69 | V | 96.6 | Very high | 96.7 | Very high | 50 Ų | 50 | 29.7 Ų | 29.7 | 30% | 0.303 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -60.5 | -40.5 | -179.4 | 178.6 | 0 | 0 | 0 | 0 | 110 | I65 A66 L72 T73 N104 | I65-V69 WeakPolarHBondContact O-CG2 3.23Å; I65-V69 PolarHBondContact O-N 2.74Å; A66-V69 PolarHBondContact O-N 3.49Å; V69-L72 PolarHBondContact O-N 2.88Å; V69-T73 WeakPolarHBondContact O-CG2 3.44Å; V69-N104 WeakPolarHBondContact CG1-ND2 3.24Å |
| 70 | M | 97.6 | Very high | 96.6 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.5 | -47.3 | 174.7 | -160.2 | -171.8 | -38.5 | 0 | 0 | 111.8 | A66 F68 L72 T73 F74 F101 N104 M105 V288 | A66-M70 VanDerWaalsContact O-CB 3.27Å; A66-M70 WeakPolarHBondContact O-CB 3.29Å; A66-M70 PolarHBondContact O-N 3.06Å; F68-M70 PolarHBondContact O-N 3.27Å; M70-L72 VanDerWaalsContact C-N 3.28Å; M70-L72 PolarHBondContact O-N 3.35Å; M70-T73 WeakPolarHBondContact O-CB 3.46Å; M70-T73 PolarHBondContact O-N 3.35Å; M70-T73 PolarHBondContact O-OG1 2.95Å; M70-F74 HydrophobicContact CG-CE1 3.91Å; M70-F74 HydrophobicContact CG-CZ 4.23Å; M70-F74 WeakPolarHBondContact O-CD1 3.26Å; M70-F74 VanDerWaalsContact O-CE1 3.26Å; M70-F74 WeakPolarHBondContact O-CE1 3.23Å; M70-F74 HydrophobicContact SD-CE1 4.49Å; M70-F74 HydrophobicContact SD-CZ 4.47Å; M70-F101 HydrophobicContact CG-CD2 3.95Å; M70-F101 HydrophobicContact CG-CE2 4.27Å; M70-F101 HydrophobicContact CG-CG 4.46Å; M70-F101 HydrophobicContact SD-CD2 4.48Å; M70-F101 HydrophobicContact SD-CE2 4.27Å; M70-N104 HydrophobicContact CB-CB 3.86Å; M70-N104 HydrophobicContact CE-CB 4Å; M70-N104 HydrophobicContact CG-CB 4.28Å; M70-M105 HydrophobicContact CE-CB 4.23Å; M70-M105 HydrophobicContact SD-CB 4.39Å; M70-V288 HydrophobicContact CE-CG1 4.44Å; M70-V288 HydrophobicContact SD-CG1 4.23Å |
| 71 | S | 97.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.4 | -37.2 | 179.8 | -61.3 | 0 | 0 | 0 | 0 | 112.3 | F33 D67 F68 T73 F74 | F33-S71 VanDerWaalsContact CD2-O 3.25Å; F33-S71 WeakPolarHBondContact CD2-O 3.49Å; F33-S71 WeakPolarHBondContact CE2-O 3.48Å; D67-S71 VanDerWaalsContact O-CB 3.25Å; D67-S71 WeakPolarHBondContact O-CB 3.33Å; D67-S71 PolarHBondContact O-N 2.95Å; D67-S71 PolarHBondContact O-OG 3.13Å; F68-S71 PolarHBondContact O-N 3.03Å; F68-S71 VanDerWaalsContact O-N 3.16Å; S71-T73 PolarHBondContact O-N 3.44Å; S71-T73 VanDerWaalsContact O-N 3.16Å; S71-F74 WeakPolarHBondContact O-CB 3.45Å; S71-F74 PolarHBondContact O-N 3.44Å; S71-F74 VanDerWaalsContact O-N 3.1Å |
| 72 | L | 96.8 | Very high | 96.4 | Very high | 106 Ų | 106 | 32 Ų | 32 | 56% | 0.555 | 17% | 0.167 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -17.8 | 175.3 | -68.5 | 175.2 | 0 | 0 | 0 | 113.2 | I37 F68 V69 M70 F76 | I37-L72 HydrophobicContact CD1-CD2 4.28Å; F68-L72 WeakPolarHBondContact O-CG 3.29Å; F68-L72 PolarHBondContact O-N 3.48Å; V69-L72 PolarHBondContact O-N 2.88Å; M70-L72 VanDerWaalsContact C-N 3.28Å; M70-L72 PolarHBondContact O-N 3.35Å; L72-F76 WeakPolarHBondContact O-CE2 3.37Å |
| 73 | T | 97.9 | Very high | 96 | Very high | 6 Ų | 6 | 33.3 Ų | 33.3 | 4% | 0.037 | 19% | 0.186 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | -19.5 | 175.6 | 73.1 | 0 | 0 | 0 | 0 | 113.7 | V69 M70 S71 F76 K77 S97 L100 | V69-T73 WeakPolarHBondContact O-CG2 3.44Å; M70-T73 WeakPolarHBondContact O-CB 3.46Å; M70-T73 PolarHBondContact O-N 3.35Å; M70-T73 PolarHBondContact O-OG1 2.95Å; S71-T73 PolarHBondContact O-N 3.44Å; S71-T73 VanDerWaalsContact O-N 3.16Å; T73-F76 PolarHBondContact O-N 3.45Å; T73-K77 PolarHBondContact O-N 3.29Å; T73-S97 WeakPolarHBondContact CB-OG 3.23Å; T73-S97 PolarHBondContact O-OG 3.2Å; T73-L100 HydrophobicContact CG2-CB 3.79Å |
| 74 | F | 98 | Very high | 95.7 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.3 | -41.5 | -171.9 | -59.7 | -11.1 | 0 | 0 | 0 | 113.7 | Y29 V32 F33 M70 S71 F76 K77 I78 F101 A285 V288 | Y29-F74 HydrophobicContact CD1-CB 4.42Å; Y29-F74 HydrophobicContact CD1-CD1 4.34Å; Y29-F74 HydrophobicContact CD1-CG 4.18Å; Y29-F74 HydrophobicContact CE1-CD1 4.3Å; V32-F74 HydrophobicContact CG1-CD2 4.32Å; V32-F74 HydrophobicContact CG1-CE2 3.75Å; F33-F74 HydrophobicContact CB-CB 4.08Å; F33-F74 HydrophobicContact CB-CD2 3.98Å; F33-F74 HydrophobicContact CD2-CB 4.08Å; F33-F74 HydrophobicContact CD2-CD2 4.33Å; F33-F74 HydrophobicContact CG-CB 4.4Å; M70-F74 HydrophobicContact CG-CE1 3.91Å; M70-F74 HydrophobicContact CG-CZ 4.23Å; M70-F74 WeakPolarHBondContact O-CD1 3.26Å; M70-F74 VanDerWaalsContact O-CE1 3.26Å; M70-F74 WeakPolarHBondContact O-CE1 3.23Å; M70-F74 HydrophobicContact SD-CE1 4.49Å; M70-F74 HydrophobicContact SD-CZ 4.47Å; S71-F74 WeakPolarHBondContact O-CB 3.45Å; S71-F74 PolarHBondContact O-N 3.44Å; S71-F74 VanDerWaalsContact O-N 3.1Å; F74-F76 PolarHBondContact O-N 2.92Å; F74-K77 PolarHBondContact O-N 3.12Å; F74-I78 HydrophobicContact CB-CD1 4.31Å; F74-I78 WeakPolarHBondContact O-CD1 3.29Å; F74-I78 VanDerWaalsContact O-CG1 3.25Å; F74-I78 WeakPolarHBondContact O-CG1 3.29Å; F74-I78 PolarHBondContact O-N 2.84Å; F74-F101 HydrophobicContact CD1-CD2 4.08Å; F74-F101 HydrophobicContact CD1-CE2 4.18Å; F74-F101 AromaticContact CE1-CD2 3.65Å; F74-F101 HydrophobicContact CE1-CD2 3.65Å; F74-F101 AromaticContact CE1-CE2 3.51Å; F74-F101 HydrophobicContact CE1-CE2 3.51Å; F74-F101 HydrophobicContact CZ-CE2 4.41Å; F74-A285 HydrophobicContact CE1-CB 4.17Å; F74-A285 HydrophobicContact CZ-CB 3.92Å; F74-V288 HydrophobicContact CE2-CG2 3.94Å; F74-V288 HydrophobicContact CZ-CG1 4.2Å; F74-V288 HydrophobicContact CZ-CG2 4.3Å |
| 75 | P | 97.6 | Very high | 95.3 | Very high | 38 Ų | 38 | 40.8 Ų | 40.8 | 25% | 0.247 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -54.9 | -39.8 | 177.8 | -28 | 37.1 | 0 | 0 | 0 | 113.1 | F33 I78 L79 | F33-P75 HydrophobicContact CD1-CG 4.4Å; F33-P75 HydrophobicContact CD2-CG 3.96Å; F33-P75 HydrophobicContact CE1-CG 4.02Å; F33-P75 HydrophobicContact CE2-CG 3.53Å; F33-P75 HydrophobicContact CG-CG 4.37Å; F33-P75 HydrophobicContact CZ-CG 3.56Å; P75-I78 PolarHBondContact O-N 3.31Å; P75-L79 WeakPolarHBondContact O-CB 3.4Å; P75-L79 WeakPolarHBondContact O-CG 3.37Å; P75-L79 PolarHBondContact O-N 3.03Å |
| 76 | F | 97.4 | Very high | 94.9 | Very high | 74 Ų | 74 | 40.7 Ų | 40.7 | 33% | 0.325 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -68.3 | -38.6 | 179 | -52 | -68.1 | 0 | 0 | 0 | 112 | L72 T73 F74 N80 L89 F92 V93 S97 | L72-F76 WeakPolarHBondContact O-CE2 3.37Å; T73-F76 PolarHBondContact O-N 3.45Å; F74-F76 PolarHBondContact O-N 2.92Å; F76-N80 WeakPolarHBondContact O-CB 3.31Å; F76-N80 PolarHBondContact O-N 3.08Å; F76-L89 HydrophobicContact CB-CD1 4.15Å; F76-L89 HydrophobicContact CD1-CD1 3.74Å; F76-L89 HydrophobicContact CG-CD1 4.41Å; F76-F92 HydrophobicContact CB-CE1 4.47Å; F76-F92 HydrophobicContact CD1-CD1 4.06Å; F76-F92 AromaticContact CD1-CE1 3.78Å; F76-F92 HydrophobicContact CD1-CE1 3.78Å; F76-F92 AromaticContact CD2-CE1 3.81Å; F76-F92 HydrophobicContact CD2-CE1 3.81Å; F76-F92 HydrophobicContact CE1-CD1 4.41Å; F76-F92 AromaticContact CE1-CE1 3.83Å; F76-F92 HydrophobicContact CE1-CE1 3.83Å; F76-F92 AromaticContact CE2-CE1 3.88Å; F76-F92 HydrophobicContact CE2-CE1 3.88Å; F76-F92 HydrophobicContact CE2-CZ 4.42Å; F76-F92 HydrophobicContact CG-CD1 4.17Å; F76-F92 AromaticContact CG-CE1 3.75Å; F76-F92 HydrophobicContact CG-CE1 3.75Å; F76-F92 AromaticContact CZ-CE1 3.89Å; F76-F92 HydrophobicContact CZ-CE1 3.89Å; F76-F92 HydrophobicContact CZ-CZ 4.35Å; F76-V93 HydrophobicContact CB-CG2 3.79Å; F76-S97 WeakPolarHBondContact CD2-OG 3.1Å |
| 77 | K | 95.7 | Very high | 94.4 | Very high | 33 Ų | 33 | 45.7 Ų | 45.7 | 14% | 0.143 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.3 | -44.9 | 173.4 | 178.4 | 167.4 | 168.2 | 53.7 | 0 | 111.4 | Y29 T73 F74 N80 D81 E278 | Y29-K77 HydrophobicContact CE1-CD 4.1Å; Y29-K77 HydrophobicContact CE2-CD 4.18Å; Y29-K77 WeakPolarHBondContact OH-CE 3.46Å; T73-K77 PolarHBondContact O-N 3.29Å; F74-K77 PolarHBondContact O-N 3.12Å; K77-N80 PolarHBondContact O-N 3.46Å; K77-D81 WeakPolarHBondContact CG-OD2 3.49Å; K77-D81 IonicContact NZ-OD2 3.59Å; K77-D81 PolarHBondContact NZ-OD2 3.41Å; K77-D81 VanDerWaalsContact O-CB 3.27Å; K77-D81 WeakPolarHBondContact O-CB 3.43Å; K77-D81 PolarHBondContact O-N 3.24Å; K77-E278 IonicContact NZ-OE2 2.7Å; K77-E278 PolarHBondContact NZ-OE2 3.31Å |
| 78 | I | 97 | Very high | 94.1 | Very high | 19 Ų | 19 | 50.2 Ų | 50.2 | 10% | 0.097 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -57.8 | -52 | 178.3 | -68.2 | 157.7 | 0 | 0 | 0 | 110.7 | P26 C30 F33 F74 P75 N80 D81 S82 | P26-I78 HydrophobicContact CB-CG2 4.19Å; C30-I78 HydrophobicContact CB-CD1 4.41Å; C30-I78 WeakPolarHBondContact SG-CG2 3.4Å; F33-I78 HydrophobicContact CB-CD1 4.42Å; F74-I78 HydrophobicContact CB-CD1 4.31Å; F74-I78 WeakPolarHBondContact O-CD1 3.29Å; F74-I78 VanDerWaalsContact O-CG1 3.25Å; F74-I78 WeakPolarHBondContact O-CG1 3.29Å; F74-I78 PolarHBondContact O-N 2.84Å; P75-I78 PolarHBondContact O-N 3.31Å; I78-N80 PolarHBondContact O-N 3.03Å; I78-D81 PolarHBondContact O-N 2.98Å; I78-S82 VanDerWaalsContact O-CB 3.27Å; I78-S82 WeakPolarHBondContact O-CB 3.44Å; I78-S82 PolarHBondContact O-N 2.91Å; I78-S82 PolarHBondContact O-OG 3.16Å |
| 79 | L | 95.8 | Very high | 93.9 | Very high | 75 Ų | 75 | 48.6 Ų | 48.6 | 39% | 0.393 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.6 | -38.5 | -178.9 | -72.9 | 172.9 | 0 | 0 | 0 | 112.3 | P75 S82 L84 G85 L89 | P75-L79 WeakPolarHBondContact O-CB 3.4Å; P75-L79 WeakPolarHBondContact O-CG 3.37Å; P75-L79 PolarHBondContact O-N 3.03Å; L79-S82 WeakPolarHBondContact CA-OG 3.45Å; L79-S82 PolarHBondContact O-OG 3.09Å; L79-L84 HydrophobicContact CD2-CB 4.46Å; L79-L84 PolarHBondContact O-N 2.75Å; L79-G85 PolarHBondContact O-N 3.04Å; L79-L89 HydrophobicContact CB-CD2 3.44Å; L79-L89 VanDerWaalsContact CB-CD2 3.44Å; L79-L89 HydrophobicContact CD1-CD2 4.38Å |
| 80 | N | 93.3 | Very high | 93.6 | Very high | 37 Ų | 37 | 47.7 Ų | 47.7 | 20% | 0.198 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.9 | -48.1 | 175.9 | 175.7 | 81.5 | 0 | 0 | 0 | 111.9 | F76 K77 I78 G83 L89 N90 V93 | F76-N80 WeakPolarHBondContact O-CB 3.31Å; F76-N80 PolarHBondContact O-N 3.08Å; K77-N80 PolarHBondContact O-N 3.46Å; I78-N80 PolarHBondContact O-N 3.03Å; N80-G83 PolarHBondContact O-N 3.43Å; N80-L89 HydrophobicContact CB-CD2 4.4Å; N80-N90 VanDerWaalsContact OD1-CA 3.31Å; N80-N90 WeakPolarHBondContact OD1-CA 3.37Å; N80-N90 VanDerWaalsContact OD1-CB 3.29Å; N80-N90 WeakPolarHBondContact OD1-CB 3.39Å; N80-N90 PolarHBondContact OD1-ND2 3.46Å; N80-V93 HydrophobicContact CB-CG2 4.06Å |
| 81 | D | 92.2 | Very high | 93.3 | Very high | 39 Ų | 39 | 48.5 Ų | 48.5 | 21% | 0.209 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -73.3 | -31.4 | -174 | -68.9 | -0.1 | 0 | 0 | 0 | 112.1 | Q22 P26 K77 I78 G83 | Q22-D81 WeakPolarHBondContact CA-O 3.38Å; Q22-D81 WeakPolarHBondContact CG-O 3.07Å; P26-D81 HydrophobicContact CG-CB 3.96Å; K77-D81 WeakPolarHBondContact CG-OD2 3.49Å; K77-D81 IonicContact NZ-OD2 3.59Å; K77-D81 PolarHBondContact NZ-OD2 3.41Å; K77-D81 VanDerWaalsContact O-CB 3.27Å; K77-D81 WeakPolarHBondContact O-CB 3.43Å; K77-D81 PolarHBondContact O-N 3.24Å; I78-D81 PolarHBondContact O-N 2.98Å; D81-G83 PolarHBondContact O-N 3.25Å |
| 82 | S | 93.1 | Very high | 93.1 | Very high | 24 Ų | 24 | 52.4 Ų | 52.4 | 17% | 0.168 | 29% | 0.285 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.3 | -9.7 | 173.5 | 56.5 | 0 | 0 | 0 | 0 | 114.2 | Q22 I78 L79 L84 | Q22-S82 WeakPolarHBondContact O-CA 3.48Å; I78-S82 VanDerWaalsContact O-CB 3.27Å; I78-S82 WeakPolarHBondContact O-CB 3.44Å; I78-S82 PolarHBondContact O-N 2.91Å; I78-S82 PolarHBondContact O-OG 3.16Å; L79-S82 WeakPolarHBondContact CA-OG 3.45Å; L79-S82 PolarHBondContact O-OG 3.09Å; S82-L84 PolarHBondContact O-N 2.95Å |
| 83 | G | 89.1 | Confident | 93.1 | Very high | 50 Ų | 50 | 48 Ų | 48 | 52% | 0.515 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.6 | 9.2 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | N80 D81 | N80-G83 PolarHBondContact O-N 3.43Å; D81-G83 PolarHBondContact O-N 3.25Å |
| 84 | L | 90.3 | Very high | 92.8 | Very high | 139 Ų | 139 | 48 Ų | 48 | 73% | 0.728 | 26% | 0.263 | S | S | * | . | trans | -82.8 | -21.2 | 177.5 | -62.8 | 176.2 | 0 | 0 | 0 | 112.6 | L79 S82 | L79-L84 HydrophobicContact CD2-CB 4.46Å; L79-L84 PolarHBondContact O-N 2.75Å; S82-L84 PolarHBondContact O-N 2.95Å | ||
| 85 | G | 87.3 | Confident | 92.6 | Very high | 24 Ų | 24 | 51.8 Ų | 51.8 | 25% | 0.247 | 28% | 0.277 | C | S | . | . | S | Bend | trans | -77.8 | 147.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L79 | L79-G85 PolarHBondContact O-N 3.04Š|
| 86 | P | 89.5 | Confident | 92.6 | Very high | 83 Ų | 83 | 52 Ų | 52 | 54% | 0.539 | 28% | 0.278 | S | S | . | . | trans | -70.2 | 164.1 | 172.7 | 34.2 | -38.3 | 0 | 0 | 0 | 110.9 | Q88 L89 | P86-Q88 PolarHBondContact O-N 3.2Å; P86-Q88 VanDerWaalsContact O-N 3.14Å; P86-L89 HydrophobicContact CG-CB 4.26Å; P86-L89 VanDerWaalsContact O-CB 3.25Å; P86-L89 WeakPolarHBondContact O-CB 3.34Å; P86-L89 PolarHBondContact O-N 3.31Å | ||
| 87 | W | 87 | Confident | 92.6 | Very high | 105 Ų | 105 | 48.7 Ų | 48.7 | 40% | 0.398 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -59.6 | -30 | -177 | 65.6 | -99.6 | 0 | 0 | 0 | 113.2 | L89 N90 V91 E166 | W87-L89 PolarHBondContact O-N 3.13Å; W87-N90 WeakPolarHBondContact O-CB 3.39Å; W87-N90 PolarHBondContact O-N 3.15Å; W87-V91 HydrophobicContact CE3-CG2 4.24Å; W87-V91 HydrophobicContact CZ3-CG2 4.4Å; W87-V91 PolarHBondContact O-N 2.99Å; W87-E166 HydrophobicContact CZ2-CG 4.47Å |
| 88 | Q | 89.8 | Confident | 92.6 | Very high | 96 Ų | 96 | 48.5 Ų | 48.5 | 45% | 0.449 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -62.7 | -32.7 | 175.2 | -62.2 | 85.2 | -17.9 | 0 | 0 | 111.6 | P86 V91 F92 | P86-Q88 PolarHBondContact O-N 3.2Å; P86-Q88 VanDerWaalsContact O-N 3.14Å; Q88-V91 PolarHBondContact O-N 2.68Å; Q88-F92 PolarHBondContact O-N 2.88Å |
| 89 | L | 92.1 | Very high | 92.6 | Very high | 23 Ų | 23 | 48.4 Ų | 48.4 | 12% | 0.12 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -65.3 | -41.3 | 176.1 | 179.7 | 65.9 | 0 | 0 | 0 | 110.9 | F76 L79 N80 P86 W87 V91 F92 V93 | F76-L89 HydrophobicContact CB-CD1 4.15Å; F76-L89 HydrophobicContact CD1-CD1 3.74Å; F76-L89 HydrophobicContact CG-CD1 4.41Å; L79-L89 HydrophobicContact CB-CD2 3.44Å; L79-L89 VanDerWaalsContact CB-CD2 3.44Å; L79-L89 HydrophobicContact CD1-CD2 4.38Å; N80-L89 HydrophobicContact CB-CD2 4.4Å; P86-L89 HydrophobicContact CG-CB 4.26Å; P86-L89 VanDerWaalsContact O-CB 3.25Å; P86-L89 WeakPolarHBondContact O-CB 3.34Å; P86-L89 PolarHBondContact O-N 3.31Å; W87-L89 PolarHBondContact O-N 3.13Å; L89-V91 VanDerWaalsContact C-N 3.29Å; L89-V91 PolarHBondContact O-N 3.36Å; L89-F92 HydrophobicContact CD1-CD1 4.32Å; L89-F92 WeakPolarHBondContact O-CB 3.36Å; L89-F92 PolarHBondContact O-N 2.82Å; L89-F92 VanDerWaalsContact O-N 3.17Å; L89-V93 HydrophobicContact CD1-CG2 4.4Å; L89-V93 HydrophobicContact CG-CG2 4.37Å; L89-V93 WeakPolarHBondContact O-CG2 3.48Å; L89-V93 PolarHBondContact O-N 3.47Å |
| 90 | N | 90.5 | Very high | 92.7 | Very high | 30 Ų | 30 | 47.6 Ų | 47.6 | 16% | 0.16 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58 | -44.4 | 175.6 | -176.8 | -76.3 | 0 | 0 | 0 | 111.1 | N80 W87 F92 V93 C94 I170 | N80-N90 VanDerWaalsContact OD1-CA 3.31Å; N80-N90 WeakPolarHBondContact OD1-CA 3.37Å; N80-N90 VanDerWaalsContact OD1-CB 3.29Å; N80-N90 WeakPolarHBondContact OD1-CB 3.39Å; N80-N90 PolarHBondContact OD1-ND2 3.46Å; W87-N90 WeakPolarHBondContact O-CB 3.39Å; W87-N90 PolarHBondContact O-N 3.15Å; N90-F92 PolarHBondContact O-N 2.92Å; N90-V93 PolarHBondContact O-N 2.86Å; N90-C94 PolarHBondContact O-N 3.28Å; N90-C94 PolarHBondContact O-SG 2.97Å; N90-I170 PolarHBondContact OD1-O 3.37Å |
| 91 | V | 91.8 | Very high | 92.9 | Very high | 18 Ų | 18 | 46.2 Ų | 46.2 | 11% | 0.109 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61 | -45 | 175.6 | 178.5 | 0 | 0 | 0 | 0 | 111.3 | W87 Q88 L89 V93 C94 R95 L175 | W87-V91 HydrophobicContact CE3-CG2 4.24Å; W87-V91 HydrophobicContact CZ3-CG2 4.4Å; W87-V91 PolarHBondContact O-N 2.99Å; Q88-V91 PolarHBondContact O-N 2.68Å; L89-V91 VanDerWaalsContact C-N 3.29Å; L89-V91 PolarHBondContact O-N 3.36Å; V91-V93 PolarHBondContact O-N 3.46Å; V91-C94 PolarHBondContact O-N 3.37Å; V91-R95 HydrophobicContact CG1-CG 4.33Å; V91-R95 WeakPolarHBondContact O-CB 3.19Å; V91-R95 WeakPolarHBondContact O-CG 3.23Å; V91-R95 PolarHBondContact O-N 3.27Å; V91-L175 HydrophobicContact CG2-CD1 4.39Å; V91-L175 HydrophobicContact CG2-CD2 4.42Å |
| 92 | F | 93.9 | Very high | 93.2 | Very high | 81 Ų | 81 | 47.1 Ų | 47.1 | 36% | 0.355 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.2 | -42.5 | 175.4 | 175.6 | -99.7 | 0 | 0 | 0 | 112.2 | F76 Q88 L89 N90 C94 R95 V96 S97 | F76-F92 HydrophobicContact CB-CE1 4.47Å; F76-F92 HydrophobicContact CD1-CD1 4.06Å; F76-F92 AromaticContact CD1-CE1 3.78Å; F76-F92 HydrophobicContact CD1-CE1 3.78Å; F76-F92 AromaticContact CD2-CE1 3.81Å; F76-F92 HydrophobicContact CD2-CE1 3.81Å; F76-F92 HydrophobicContact CE1-CD1 4.41Å; F76-F92 AromaticContact CE1-CE1 3.83Å; F76-F92 HydrophobicContact CE1-CE1 3.83Å; F76-F92 AromaticContact CE2-CE1 3.88Å; F76-F92 HydrophobicContact CE2-CE1 3.88Å; F76-F92 HydrophobicContact CE2-CZ 4.42Å; F76-F92 HydrophobicContact CG-CD1 4.17Å; F76-F92 AromaticContact CG-CE1 3.75Å; F76-F92 HydrophobicContact CG-CE1 3.75Å; F76-F92 AromaticContact CZ-CE1 3.89Å; F76-F92 HydrophobicContact CZ-CE1 3.89Å; F76-F92 HydrophobicContact CZ-CZ 4.35Å; Q88-F92 PolarHBondContact O-N 2.88Å; L89-F92 HydrophobicContact CD1-CD1 4.32Å; L89-F92 WeakPolarHBondContact O-CB 3.36Å; L89-F92 PolarHBondContact O-N 2.82Å; L89-F92 VanDerWaalsContact O-N 3.17Å; N90-F92 PolarHBondContact O-N 2.92Å; F92-C94 PolarHBondContact O-N 3.38Å; F92-R95 PolarHBondContact O-N 2.87Å; F92-V96 HydrophobicContact CD2-CB 4.2Å; F92-V96 HydrophobicContact CD2-CG2 4.24Å; F92-V96 HydrophobicContact CE2-CB 3.85Å; F92-V96 HydrophobicContact CE2-CG1 4.07Å; F92-V96 HydrophobicContact CE2-CG2 4.09Å; F92-V96 HydrophobicContact CZ-CB 4.18Å; F92-V96 HydrophobicContact CZ-CG1 4.16Å; F92-V96 PolarHBondContact O-N 3.26Å; F92-S97 PolarHBondContact O-N 3.4Å |
| 93 | V | 94.9 | Very high | 93.4 | Very high | 14 Ų | 14 | 46.2 Ų | 46.2 | 9% | 0.085 | 25% | 0.251 | C | S | . | . | I | π-helix | trans | -59.6 | -48.2 | 176.4 | 168.7 | 0 | 0 | 0 | 0 | 110.6 | F76 N80 L89 N90 V91 S97 A98 | F76-V93 HydrophobicContact CB-CG2 3.79Å; N80-V93 HydrophobicContact CB-CG2 4.06Å; L89-V93 HydrophobicContact CD1-CG2 4.4Å; L89-V93 HydrophobicContact CG-CG2 4.37Å; L89-V93 WeakPolarHBondContact O-CG2 3.48Å; L89-V93 PolarHBondContact O-N 3.47Å; N90-V93 PolarHBondContact O-N 2.86Å; V91-V93 PolarHBondContact O-N 3.46Å; V93-S97 PolarHBondContact O-N 3.46Å; V93-A98 HydrophobicContact CG1-CB 4.35Å; V93-A98 VanDerWaalsContact O-CB 3.22Å; V93-A98 WeakPolarHBondContact O-CB 3.35Å; V93-A98 PolarHBondContact O-N 2.9Å |
| 94 | C | 93.4 | Very high | 93.8 | Very high | 5 Ų | 5 | 44 Ų | 44 | 3% | 0.034 | 23% | 0.227 | C | C | . | . | I | π-helix | trans | -66 | -38.2 | -179.9 | -68.2 | 0 | 0 | 0 | 0 | 113.7 | N90 V91 F92 C172 L175 | N90-C94 PolarHBondContact O-N 3.28Å; N90-C94 PolarHBondContact O-SG 2.97Å; V91-C94 PolarHBondContact O-N 3.37Å; F92-C94 PolarHBondContact O-N 3.38Å; C94-C172 WeakPolarHBondContact CA-SG 3.25Å; C94-C172 HydrophobicContact CB-CB 3.54Å; C94-C172 WeakPolarHBondContact CB-SG 3.42Å; C94-C172 WeakPolarHBondContact SG-CA 3.34Å; C94-C172 WeakPolarHBondContact SG-CB 3.16Å; C94-C172 CovalentContact SG-SG 2.03Å; C94-C172 PolarHBondContact SG-SG 3.33Å; C94-L175 HydrophobicContact CB-CD1 3.59Å |
| 95 | R | 93.9 | Very high | 94.2 | Very high | 81 Ų | 81 | 37.3 Ų | 37.3 | 31% | 0.306 | 19% | 0.192 | S | C | . | . | I | π-helix | trans | -79.5 | -40.1 | -177.2 | -73.3 | -178.5 | 176 | 174.9 | 2.1 | 112.7 | V91 F92 I157 T160 Q162 | V91-R95 HydrophobicContact CG1-CG 4.33Å; V91-R95 WeakPolarHBondContact O-CB 3.19Å; V91-R95 WeakPolarHBondContact O-CG 3.23Å; V91-R95 PolarHBondContact O-N 3.27Å; F92-R95 PolarHBondContact O-N 2.87Å; R95-I157 WeakPolarHBondContact O-CG1 3.34Å; R95-T160 HydrophobicContact CG-CG2 3.57Å; R95-T160 PolarHBondContact NE-O 3.01Å; R95-Q162 PolarHBondContact NH2-O 3.11Å; R95-Q162 VanDerWaalsContact NH2-O 3.08Å |
| 96 | V | 95.8 | Very high | 94.7 | Very high | 42 Ų | 42 | 36.2 Ų | 36.2 | 26% | 0.255 | 18% | 0.181 | S | C | . | . | I | π-helix | trans | -126.4 | -62.9 | -166.4 | -175.8 | 0 | 0 | 0 | 0 | 111.4 | F92 A98 V99 L100 I157 | F92-V96 HydrophobicContact CD2-CB 4.2Å; F92-V96 HydrophobicContact CD2-CG2 4.24Å; F92-V96 HydrophobicContact CE2-CB 3.85Å; F92-V96 HydrophobicContact CE2-CG1 4.07Å; F92-V96 HydrophobicContact CE2-CG2 4.09Å; F92-V96 HydrophobicContact CZ-CB 4.18Å; F92-V96 HydrophobicContact CZ-CG1 4.16Å; F92-V96 PolarHBondContact O-N 3.26Å; V96-A98 PolarHBondContact O-N 3.45Å; V96-V99 PolarHBondContact O-N 3.31Å; V96-V99 VanDerWaalsContact O-N 3.11Å; V96-L100 HydrophobicContact CG1-CD1 3.82Å; V96-L100 HydrophobicContact CG1-CG 4.3Å; V96-L100 PolarHBondContact O-N 2.96Å; V96-I157 HydrophobicContact CG2-CG2 4.45Å |
| 97 | S | 97.6 | Very high | 95.1 | Very high | 4 Ų | 4 | 32.3 Ų | 32.3 | 3% | 0.028 | 16% | 0.155 | C | C | . | . | I | π-helix | trans | -59.2 | -47.5 | -167.2 | -158.6 | 0 | 0 | 0 | 0 | 113 | T73 F76 F92 V93 V99 L100 F101 | T73-S97 WeakPolarHBondContact CB-OG 3.23Å; T73-S97 PolarHBondContact O-OG 3.2Å; F76-S97 WeakPolarHBondContact CD2-OG 3.1Å; F92-S97 PolarHBondContact O-N 3.4Å; V93-S97 PolarHBondContact O-N 3.46Å; S97-V99 PolarHBondContact O-N 3.42Å; S97-L100 PolarHBondContact O-N 3.16Å; S97-F101 WeakPolarHBondContact O-CB 3.33Å; S97-F101 PolarHBondContact O-N 3.13Å |
| 98 | A | 96.5 | Very high | 95.6 | Very high | 29 Ų | 29 | 27.3 Ų | 27.3 | 24% | 0.24 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -67.6 | -36.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V93 V96 F101 Y102 | V93-A98 HydrophobicContact CG1-CB 4.35Å; V93-A98 VanDerWaalsContact O-CB 3.22Å; V93-A98 WeakPolarHBondContact O-CB 3.35Å; V93-A98 PolarHBondContact O-N 2.9Å; V96-A98 PolarHBondContact O-N 3.45Å; A98-F101 WeakPolarHBondContact O-CB 3.46Å; A98-F101 PolarHBondContact O-N 2.93Å; A98-Y102 WeakPolarHBondContact O-CD2 3.48Å; A98-Y102 PolarHBondContact O-N 2.9Å; A98-Y102 VanDerWaalsContact O-N 3.08Å |
| 99 | V | 97 | Very high | 96 | Very high | 17 Ų | 17 | 22.7 Ų | 22.7 | 10% | 0.103 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -64.6 | -47.4 | 176.7 | -176.6 | 0 | 0 | 0 | 0 | 109.8 | V96 S97 F101 Y102 V103 A153 N156 I157 | V96-V99 PolarHBondContact O-N 3.31Å; V96-V99 VanDerWaalsContact O-N 3.11Å; S97-V99 PolarHBondContact O-N 3.42Å; V99-F101 VanDerWaalsContact C-N 3.35Å; V99-F101 PolarHBondContact O-N 3.14Å; V99-Y102 PolarHBondContact O-N 3.19Å; V99-V103 HydrophobicContact CG1-CG2 4.11Å; V99-V103 WeakPolarHBondContact O-CB 3.49Å; V99-V103 WeakPolarHBondContact O-CG2 3.38Å; V99-V103 PolarHBondContact O-N 3.49Å; V99-A153 HydrophobicContact CG1-CB 4.06Å; V99-N156 HydrophobicContact CG1-CB 4.25Å; V99-N156 HydrophobicContact CG2-CB 4.32Å; V99-I157 HydrophobicContact CB-CG1 4.08Å; V99-I157 HydrophobicContact CG1-CD1 4.27Å; V99-I157 HydrophobicContact CG1-CG1 3.84Å; V99-I157 HydrophobicContact CG2-CG1 4.2Å |
| 100 | L | 97.9 | Very high | 96.3 | Very high | 59 Ų | 59 | 22.7 Ų | 22.7 | 31% | 0.309 | 12% | 0.116 | S | C | . | . | H | α-helix | trans | -60.8 | -42.4 | 175.9 | -69.9 | 179.7 | 0 | 0 | 0 | 112 | T73 V96 S97 Y102 V103 N104 | T73-L100 HydrophobicContact CG2-CB 3.79Å; V96-L100 HydrophobicContact CG1-CD1 3.82Å; V96-L100 HydrophobicContact CG1-CG 4.3Å; V96-L100 PolarHBondContact O-N 2.96Å; S97-L100 PolarHBondContact O-N 3.16Å; L100-Y102 PolarHBondContact O-N 3.12Å; L100-V103 PolarHBondContact O-N 3.3Å; L100-N104 WeakPolarHBondContact O-CB 3.47Å; L100-N104 PolarHBondContact O-N 3.38Å; L100-N104 PolarHBondContact O-ND2 3.31Å |
| 101 | F | 98.3 | Very high | 96.6 | Very high | 8 Ų | 8 | 21.3 Ų | 21.3 | 4% | 0.035 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -53.7 | -56 | 175.3 | 175 | -80.8 | 0 | 0 | 0 | 111 | Y29 M70 F74 S97 A98 V99 V103 N104 M105 L281 A285 | Y29-F101 HydrophobicContact CE1-CE2 4.43Å; M70-F101 HydrophobicContact CG-CD2 3.95Å; M70-F101 HydrophobicContact CG-CE2 4.27Å; M70-F101 HydrophobicContact CG-CG 4.46Å; M70-F101 HydrophobicContact SD-CD2 4.48Å; M70-F101 HydrophobicContact SD-CE2 4.27Å; F74-F101 HydrophobicContact CD1-CD2 4.08Å; F74-F101 HydrophobicContact CD1-CE2 4.18Å; F74-F101 AromaticContact CE1-CD2 3.65Å; F74-F101 HydrophobicContact CE1-CD2 3.65Å; F74-F101 AromaticContact CE1-CE2 3.51Å; F74-F101 HydrophobicContact CE1-CE2 3.51Å; F74-F101 HydrophobicContact CZ-CE2 4.41Å; S97-F101 WeakPolarHBondContact O-CB 3.33Å; S97-F101 PolarHBondContact O-N 3.13Å; A98-F101 WeakPolarHBondContact O-CB 3.46Å; A98-F101 PolarHBondContact O-N 2.93Å; V99-F101 VanDerWaalsContact C-N 3.35Å; V99-F101 PolarHBondContact O-N 3.14Å; F101-V103 PolarHBondContact O-N 2.82Å; F101-N104 PolarHBondContact O-N 3.44Å; F101-M105 HydrophobicContact CE1-SD 4.42Å; F101-M105 PolarHBondContact O-N 3.03Å; F101-L281 HydrophobicContact CE1-CD1 3.49Å; F101-L281 VanDerWaalsContact CE1-CD1 3.49Å; F101-L281 HydrophobicContact CE1-CG 4.29Å; F101-L281 HydrophobicContact CZ-CD1 3.77Å; F101-L281 HydrophobicContact CZ-CG 4.23Å; F101-A285 HydrophobicContact CE2-CB 3.77Å; F101-A285 HydrophobicContact CZ-CB 3.9Å |
| 102 | Y | 97.4 | Very high | 96.8 | Very high | 57 Ų | 57 | 20.5 Ų | 20.5 | 22% | 0.224 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -67.1 | -41.5 | -175.2 | -77 | -62.4 | 0 | 0 | 0 | 111.9 | A98 V99 L100 N104 M105 Y106 Y249 L281 | A98-Y102 WeakPolarHBondContact O-CD2 3.48Å; A98-Y102 PolarHBondContact O-N 2.9Å; A98-Y102 VanDerWaalsContact O-N 3.08Å; V99-Y102 PolarHBondContact O-N 3.19Å; L100-Y102 PolarHBondContact O-N 3.12Å; Y102-N104 VanDerWaalsContact C-N 3.35Å; Y102-N104 PolarHBondContact O-N 2.99Å; Y102-M105 HydrophobicContact CD1-CE 3.96Å; Y102-M105 HydrophobicContact CD1-SD 4.5Å; Y102-M105 WeakPolarHBondContact O-CB 3.27Å; Y102-M105 PolarHBondContact O-N 3Å; Y102-Y106 WeakPolarHBondContact O-CD2 3.45Å; Y102-Y106 PolarHBondContact O-N 3.23Å; Y102-Y249 HydrophobicContact CE1-CE1 4.36Å; Y102-Y249 AromaticContact CE1-CZ 3.95Å; Y102-Y249 VanDerWaalsContact CE1-OH 3.24Å; Y102-Y249 WeakPolarHBondContact CE1-OH 3.45Å; Y102-L281 HydrophobicContact CE1-CD1 3.88Å; Y102-L281 WeakPolarHBondContact OH-CD2 3.45Å |
| 103 | V | 97.5 | Very high | 96.8 | Very high | 5 Ų | 5 | 17.1 Ų | 17.1 | 3% | 0.03 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -61.2 | -45.8 | 179.9 | 170.2 | 0 | 0 | 0 | 0 | 110.7 | V99 L100 F101 M105 Y106 V107 M149 A153 F191 | V99-V103 HydrophobicContact CG1-CG2 4.11Å; V99-V103 WeakPolarHBondContact O-CB 3.49Å; V99-V103 WeakPolarHBondContact O-CG2 3.38Å; V99-V103 PolarHBondContact O-N 3.49Å; L100-V103 PolarHBondContact O-N 3.3Å; F101-V103 PolarHBondContact O-N 2.82Å; V103-M105 PolarHBondContact O-N 3.25Å; V103-Y106 PolarHBondContact O-N 3.3Å; V103-V107 HydrophobicContact CG1-CG2 4.47Å; V103-V107 VanDerWaalsContact O-CG2 3.26Å; V103-V107 WeakPolarHBondContact O-CG2 3.48Å; V103-V107 PolarHBondContact O-N 2.8Å; V103-M149 HydrophobicContact CG1-CB 4.02Å; V103-A153 HydrophobicContact CB-CB 4.36Å; V103-A153 HydrophobicContact CG1-CB 4.21Å; V103-A153 HydrophobicContact CG2-CB 3.35Å; V103-F191 HydrophobicContact CG2-CZ 4.18Å |
| 104 | N | 97.9 | Very high | 96.9 | Very high | 3 Ų | 3 | 17.6 Ų | 17.6 | 2% | 0.016 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -67.9 | -35.2 | 177.8 | -73.7 | -73.5 | 0 | 0 | 0 | 112.3 | A66 V69 M70 L100 F101 Y102 Y106 V107 S108 W146 | A66-N104 WeakPolarHBondContact CA-OD1 3.37Å; A66-N104 HydrophobicContact CB-CB 4.25Å; A66-N104 WeakPolarHBondContact O-CB 3.47Å; V69-N104 WeakPolarHBondContact CG1-ND2 3.24Å; M70-N104 HydrophobicContact CB-CB 3.86Å; M70-N104 HydrophobicContact CE-CB 4Å; M70-N104 HydrophobicContact CG-CB 4.28Å; L100-N104 WeakPolarHBondContact O-CB 3.47Å; L100-N104 PolarHBondContact O-N 3.38Å; L100-N104 PolarHBondContact O-ND2 3.31Å; F101-N104 PolarHBondContact O-N 3.44Å; Y102-N104 VanDerWaalsContact C-N 3.35Å; Y102-N104 PolarHBondContact O-N 2.99Å; N104-Y106 VanDerWaalsContact C-N 3.3Å; N104-Y106 PolarHBondContact O-N 2.9Å; N104-V107 WeakPolarHBondContact O-CB 3.4Å; N104-V107 PolarHBondContact O-N 2.75Å; N104-S108 PolarHBondContact O-N 2.69Å; N104-S108 PolarHBondContact O-OG 3.07Å; N104-W146 WeakPolarHBondContact OD1-CH2 3.36Å |
| 105 | M | 97.7 | Very high | 96.9 | Very high | 0 Ų | 0 | 17.4 Ų | 17.4 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -57.5 | -44.8 | 171.9 | -177.8 | -167.4 | 75.2 | 0 | 0 | 111.1 | M70 F101 Y102 V103 S108 I109 F246 Y249 S284 | M70-M105 HydrophobicContact CE-CB 4.23Å; M70-M105 HydrophobicContact SD-CB 4.39Å; F101-M105 HydrophobicContact CE1-SD 4.42Å; F101-M105 PolarHBondContact O-N 3.03Å; Y102-M105 HydrophobicContact CD1-CE 3.96Å; Y102-M105 HydrophobicContact CD1-SD 4.5Å; Y102-M105 WeakPolarHBondContact O-CB 3.27Å; Y102-M105 PolarHBondContact O-N 3Å; V103-M105 PolarHBondContact O-N 3.25Å; M105-S108 PolarHBondContact O-N 2.83Å; M105-I109 HydrophobicContact CE-CD1 4.41Å; M105-I109 HydrophobicContact CG-CD1 4.14Å; M105-I109 WeakPolarHBondContact O-CD1 3.38Å; M105-I109 VanDerWaalsContact O-CG1 3.3Å; M105-I109 WeakPolarHBondContact O-CG1 3.19Å; M105-I109 PolarHBondContact O-N 3.16Å; M105-F246 HydrophobicContact CG-CD1 4.12Å; M105-F246 HydrophobicContact CG-CE1 3.93Å; M105-Y249 HydrophobicContact CE-CD1 4.3Å; M105-Y249 HydrophobicContact CE-CE1 3.9Å; M105-Y249 HydrophobicContact SD-CD1 4.15Å; M105-Y249 HydrophobicContact SD-CE1 4.14Å; M105-S284 PolarHBondContact SD-OG 3.16Å; M105-S284 VanDerWaalsContact SD-OG 3.32Å |
| 106 | Y | 98.3 | Very high | 96.8 | Very high | 1 Ų | 1 | 13.5 Ų | 13.5 | 0% | 0.004 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -71.8 | -33.7 | 177.3 | -76 | -70.1 | 0 | 0 | 0 | 113.6 | Y102 V103 N104 I109 V110 F191 F195 H250 R253 | Y102-Y106 WeakPolarHBondContact O-CD2 3.45Å; Y102-Y106 PolarHBondContact O-N 3.23Å; V103-Y106 PolarHBondContact O-N 3.3Å; N104-Y106 VanDerWaalsContact C-N 3.3Å; N104-Y106 PolarHBondContact O-N 2.9Å; Y106-I109 HydrophobicContact CD1-CD1 3.94Å; Y106-I109 HydrophobicContact CE1-CD1 4.12Å; Y106-I109 PolarHBondContact O-N 3.14Å; Y106-V110 WeakPolarHBondContact O-CG2 3.4Å; Y106-V110 PolarHBondContact O-N 3.4Å; Y106-F191 HydrophobicContact CD1-CB 4.33Å; Y106-F191 AromaticContact CD1-CD1 3.83Å; Y106-F191 HydrophobicContact CD1-CD1 3.83Å; Y106-F191 HydrophobicContact CD1-CG 4.48Å; Y106-F191 HydrophobicContact CD2-CB 3.96Å; Y106-F191 AromaticContact CD2-CD1 3.15Å; Y106-F191 HydrophobicContact CD2-CD1 3.15Å; Y106-F191 HydrophobicContact CD2-CD2 4.35Å; Y106-F191 AromaticContact CD2-CE1 3.64Å; Y106-F191 HydrophobicContact CD2-CE1 3.64Å; Y106-F191 AromaticContact CD2-CG 3.58Å; Y106-F191 HydrophobicContact CD2-CG 3.58Å; Y106-F191 HydrophobicContact CD2-CZ 4.42Å; Y106-F191 HydrophobicContact CE1-CB 3.91Å; Y106-F191 HydrophobicContact CE1-CD1 4.27Å; Y106-F191 HydrophobicContact CE1-CG 4.48Å; Y106-F191 WeakPolarHBondContact CE1-O 3.25Å; Y106-F191 HydrophobicContact CE2-CB 3.51Å; Y106-F191 AromaticContact CE2-CD1 3.68Å; Y106-F191 HydrophobicContact CE2-CD1 3.68Å; Y106-F191 HydrophobicContact CE2-CD2 4.33Å; Y106-F191 HydrophobicContact CE2-CE1 4.47Å; Y106-F191 AromaticContact CE2-CG 3.6Å; Y106-F191 HydrophobicContact CE2-CG 3.6Å; Y106-F191 HydrophobicContact CG-CB 4.38Å; Y106-F191 AromaticContact CG-CD1 3.28Å; Y106-F191 HydrophobicContact CG-CD1 3.28Å; Y106-F191 AromaticContact CG-CE1 3.79Å; Y106-F191 HydrophobicContact CG-CE1 3.79Å; Y106-F191 HydrophobicContact CG-CG 4.08Å; Y106-F191 VanDerWaalsContact CZ-CB 3.5Å; Y106-F195 HydrophobicContact CE1-CB 4.1Å; Y106-H250 AromaticContact CE1-NE2 3.5Å; Y106-H250 WeakPolarHBondContact CE1-NE2 3.25Å; Y106-H250 AromaticContact CZ-NE2 3.52Å; Y106-H250 PolarHBondContact OH-NE2 3.35Å; Y106-R253 PolarHBondContact OH-NH1 3.45Å |
| 107 | V | 98.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -57.5 | -50.5 | 169.7 | 170.6 | 0 | 0 | 0 | 0 | 109.9 | A66 V103 N104 I109 V110 F111 W146 M149 | A66-V107 HydrophobicContact CB-CB 4.2Å; A66-V107 HydrophobicContact CB-CG1 3.75Å; V103-V107 HydrophobicContact CG1-CG2 4.47Å; V103-V107 VanDerWaalsContact O-CG2 3.26Å; V103-V107 WeakPolarHBondContact O-CG2 3.48Å; V103-V107 PolarHBondContact O-N 2.8Å; N104-V107 WeakPolarHBondContact O-CB 3.4Å; N104-V107 PolarHBondContact O-N 2.75Å; V107-I109 PolarHBondContact O-N 2.94Å; V107-V110 PolarHBondContact O-N 3.48Å; V107-F111 HydrophobicContact CG1-CD2 3.55Å; V107-F111 HydrophobicContact CG1-CE2 3.47Å; V107-F111 VanDerWaalsContact CG1-CE2 3.47Å; V107-F111 VanDerWaalsContact O-CD2 3.23Å; V107-F111 WeakPolarHBondContact O-CD2 3.33Å; V107-F111 PolarHBondContact O-N 3.38Å; V107-W146 HydrophobicContact CG1-CH2 3.93Å; V107-W146 HydrophobicContact CG1-CZ2 3.79Å; V107-W146 HydrophobicContact CG1-CZ3 4.35Å; V107-W146 HydrophobicContact CG2-CE3 4.07Å; V107-W146 HydrophobicContact CG2-CH2 4.24Å; V107-W146 HydrophobicContact CG2-CZ3 3.89Å; V107-M149 HydrophobicContact CG2-CB 3.81Å; V107-M149 HydrophobicContact CG2-CG 3.6Å; V107-M149 HydrophobicContact CG2-SD 4.42Å |
| 108 | S | 97.2 | Very high | 96.3 | Very high | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -59.8 | -46 | 177.4 | -62 | 0 | 0 | 0 | 0 | 111.5 | D67 N104 M105 V110 F111 F112 | D67-S108 PolarHBondContact OD1-OG 2.75Å; N104-S108 PolarHBondContact O-N 2.69Å; N104-S108 PolarHBondContact O-OG 3.07Å; M105-S108 PolarHBondContact O-N 2.83Å; S108-V110 PolarHBondContact O-N 3.4Å; S108-F111 PolarHBondContact O-N 3.5Å; S108-F112 WeakPolarHBondContact O-CD2 3.23Å; S108-F112 PolarHBondContact O-N 3.25Å |
| 109 | I | 97.8 | Very high | 95.9 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -55 | -48.5 | 175.2 | -73.5 | 162.2 | 0 | 0 | 0 | 111.7 | M105 Y106 V107 F112 G113 F195 V198 F242 F246 | M105-I109 HydrophobicContact CE-CD1 4.41Å; M105-I109 HydrophobicContact CG-CD1 4.14Å; M105-I109 WeakPolarHBondContact O-CD1 3.38Å; M105-I109 VanDerWaalsContact O-CG1 3.3Å; M105-I109 WeakPolarHBondContact O-CG1 3.19Å; M105-I109 PolarHBondContact O-N 3.16Å; Y106-I109 HydrophobicContact CD1-CD1 3.94Å; Y106-I109 HydrophobicContact CE1-CD1 4.12Å; Y106-I109 PolarHBondContact O-N 3.14Å; V107-I109 PolarHBondContact O-N 2.94Å; I109-F112 WeakPolarHBondContact O-CB 3.26Å; I109-F112 PolarHBondContact O-N 3.46Å; I109-G113 PolarHBondContact O-N 2.76Å; I109-F195 HydrophobicContact CD1-CD2 4.12Å; I109-F195 HydrophobicContact CG2-CD2 4.43Å; I109-V198 HydrophobicContact CG2-CB 4.07Å; I109-V198 HydrophobicContact CG2-CG1 3.93Å; I109-V198 HydrophobicContact CG2-CG2 4.23Å; I109-V198 WeakPolarHBondContact O-CG1 3.42Å; I109-F242 HydrophobicContact CB-CE2 4.44Å; I109-F242 HydrophobicContact CG1-CE2 4.31Å; I109-F242 HydrophobicContact CG2-CE2 4.03Å; I109-F242 HydrophobicContact CG2-CZ 4.36Å; I109-F246 HydrophobicContact CD1-CB 4.39Å; I109-F246 HydrophobicContact CD1-CD1 3.81Å; I109-F246 HydrophobicContact CD1-CE1 4.31Å; I109-F246 HydrophobicContact CD1-CG 4.08Å; I109-F246 HydrophobicContact CG1-CB 4.37Å; I109-F246 HydrophobicContact CG1-CD1 3.73Å; I109-F246 HydrophobicContact CG1-CD2 3.98Å; I109-F246 HydrophobicContact CG1-CE1 3.96Å; I109-F246 HydrophobicContact CG1-CE2 4.2Å; I109-F246 HydrophobicContact CG1-CG 3.76Å; I109-F246 HydrophobicContact CG1-CZ 4.18Å |
| 110 | V | 98.3 | Very high | 95.6 | Very high | 23 Ų | 23 | 14.6 Ų | 14.6 | 14% | 0.139 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -65.8 | -42.7 | -179.8 | 172 | 0 | 0 | 0 | 0 | 111 | Y106 V107 S108 F112 G113 L114 V145 M149 I194 V198 | Y106-V110 WeakPolarHBondContact O-CG2 3.4Å; Y106-V110 PolarHBondContact O-N 3.4Å; V107-V110 PolarHBondContact O-N 3.48Å; S108-V110 PolarHBondContact O-N 3.4Å; V110-F112 VanDerWaalsContact C-N 3.29Å; V110-F112 PolarHBondContact O-N 3.45Å; V110-G113 WeakPolarHBondContact O-CA 3.45Å; V110-G113 PolarHBondContact O-N 2.81Å; V110-G113 VanDerWaalsContact O-N 3.07Å; V110-L114 HydrophobicContact CG1-CD1 4.45Å; V110-L114 HydrophobicContact CG1-CG 4.44Å; V110-L114 WeakPolarHBondContact O-CG 3.15Å; V110-L114 PolarHBondContact O-N 3.2Å; V110-V145 HydrophobicContact CB-CG1 4.24Å; V110-V145 HydrophobicContact CG1-CB 4.46Å; V110-V145 HydrophobicContact CG1-CG1 3.9Å; V110-V145 HydrophobicContact CG1-CG2 3.62Å; V110-M149 HydrophobicContact CB-CE 4.32Å; V110-M149 HydrophobicContact CG2-CE 3.49Å; V110-M149 VanDerWaalsContact CG2-CE 3.49Å; V110-I194 HydrophobicContact CG2-CG2 3.58Å; V110-V198 HydrophobicContact CG2-CG2 4.44Å |
| 111 | F | 97.3 | Very high | 95.1 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -64.4 | -33.1 | 175.8 | -79.6 | -61.4 | 0 | 0 | 0 | 113 | Y59 N62 I63 V107 S108 L114 I115 S142 V145 | Y59-F111 AromaticContact CD1-CD1 3.73Å; Y59-F111 HydrophobicContact CD1-CD1 3.73Å; Y59-F111 AromaticContact CD1-CE1 3.81Å; Y59-F111 HydrophobicContact CD1-CE1 3.81Å; Y59-F111 HydrophobicContact CG-CD1 4.08Å; N62-F111 HydrophobicContact CB-CD1 4.23Å; N62-F111 HydrophobicContact CB-CD2 3.77Å; N62-F111 HydrophobicContact CB-CE1 3.82Å; N62-F111 HydrophobicContact CB-CE2 3.31Å; N62-F111 HydrophobicContact CB-CG 4.23Å; N62-F111 HydrophobicContact CB-CZ 3.34Å; N62-F111 VanDerWaalsContact CG-CZ 3.47Å; I63-F111 HydrophobicContact CD1-CB 3.92Å; I63-F111 HydrophobicContact CG1-CB 3.56Å; I63-F111 HydrophobicContact CG1-CG 4.31Å; V107-F111 HydrophobicContact CG1-CD2 3.55Å; V107-F111 HydrophobicContact CG1-CE2 3.47Å; V107-F111 VanDerWaalsContact CG1-CE2 3.47Å; V107-F111 VanDerWaalsContact O-CD2 3.23Å; V107-F111 WeakPolarHBondContact O-CD2 3.33Å; V107-F111 PolarHBondContact O-N 3.38Å; S108-F111 PolarHBondContact O-N 3.5Å; F111-L114 HydrophobicContact CD1-CD1 3.93Å; F111-L114 HydrophobicContact CE1-CD1 4.11Å; F111-L114 PolarHBondContact O-N 3.04Å; F111-I115 VanDerWaalsContact O-CG1 3.26Å; F111-I115 WeakPolarHBondContact O-CG1 3.11Å; F111-I115 PolarHBondContact O-N 3.42Å; F111-S142 WeakPolarHBondContact CE1-OG 3.4Å; F111-V145 HydrophobicContact CE2-CG1 4.05Å; F111-V145 HydrophobicContact CZ-CB 4.29Å; F111-V145 HydrophobicContact CZ-CG1 4.2Å |
| 112 | F | 94.9 | Very high | 94.5 | Very high | 1 Ų | 1 | 18.8 Ų | 18.8 | 0% | 0.004 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -58.2 | -48.4 | 168.1 | -88 | -63 | 0 | 0 | 0 | 111.8 | I63 S108 I109 V110 L114 I115 S116 I238 V241 F242 F246 D291 I294 | I63-F112 HydrophobicContact CD1-CE2 4.48Å; S108-F112 WeakPolarHBondContact O-CD2 3.23Å; S108-F112 PolarHBondContact O-N 3.25Å; I109-F112 WeakPolarHBondContact O-CB 3.26Å; I109-F112 PolarHBondContact O-N 3.46Å; V110-F112 VanDerWaalsContact C-N 3.29Å; V110-F112 PolarHBondContact O-N 3.45Å; F112-L114 VanDerWaalsContact C-N 3.31Å; F112-L114 PolarHBondContact O-N 2.8Å; F112-I115 PolarHBondContact O-N 3.09Å; F112-S116 PolarHBondContact O-N 2.89Å; F112-S116 PolarHBondContact O-OG 3.42Å; F112-I238 HydrophobicContact CD1-CG2 3.67Å; F112-I238 HydrophobicContact CE1-CG2 3.99Å; F112-V241 HydrophobicContact CZ-CG1 4.26Å; F112-F242 HydrophobicContact CB-CD2 3.83Å; F112-F242 HydrophobicContact CB-CE2 4.29Å; F112-F242 HydrophobicContact CD2-CD2 4.36Å; F112-F242 HydrophobicContact CG-CD2 4.11Å; F112-F246 AromaticContact CD2-CE2 3.72Å; F112-F246 HydrophobicContact CD2-CE2 3.72Å; F112-F246 HydrophobicContact CD2-CZ 4.34Å; F112-F246 AromaticContact CE2-CE2 3.73Å; F112-F246 HydrophobicContact CE2-CE2 3.73Å; F112-F246 HydrophobicContact CE2-CZ 4.18Å; F112-D291 WeakPolarHBondContact CZ-OD1 3.39Å; F112-I294 HydrophobicContact CE1-CD1 3.35Å; F112-I294 HydrophobicContact CZ-CD1 3.43Å; F112-I294 VanDerWaalsContact CZ-CD1 3.43Å |
| 113 | G | 95.8 | Very high | 93.9 | Very high | 10 Ų | 10 | 17.8 Ų | 17.8 | 10% | 0.103 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -55.9 | -43.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | I109 V110 S116 F117 | I109-G113 PolarHBondContact O-N 2.76Å; V110-G113 WeakPolarHBondContact O-CA 3.45Å; V110-G113 PolarHBondContact O-N 2.81Å; V110-G113 VanDerWaalsContact O-N 3.07Å; G113-S116 PolarHBondContact O-N 2.77Å; G113-F117 WeakPolarHBondContact O-CB 3.47Å; G113-F117 PolarHBondContact O-N 3.49Å |
| 114 | L | 95.6 | Very high | 93.4 | Very high | 25 Ų | 25 | 18.8 Ų | 18.8 | 13% | 0.131 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -67.1 | -38.5 | 178.4 | -66.1 | -177.5 | 0 | 0 | 0 | 113.2 | Y59 V110 F111 F112 S116 F117 D118 L141 V145 | Y59-L114 HydrophobicContact CD1-CB 4.46Å; Y59-L114 HydrophobicContact CD1-CD1 4.33Å; Y59-L114 HydrophobicContact CD2-CB 4.01Å; Y59-L114 HydrophobicContact CE1-CB 4.37Å; Y59-L114 HydrophobicContact CE1-CD1 4.06Å; Y59-L114 HydrophobicContact CE2-CB 3.92Å; Y59-L114 HydrophobicContact CG-CB 4.3Å; V110-L114 HydrophobicContact CG1-CD1 4.45Å; V110-L114 HydrophobicContact CG1-CG 4.44Å; V110-L114 WeakPolarHBondContact O-CG 3.15Å; V110-L114 PolarHBondContact O-N 3.2Å; F111-L114 HydrophobicContact CD1-CD1 3.93Å; F111-L114 HydrophobicContact CE1-CD1 4.11Å; F111-L114 PolarHBondContact O-N 3.04Å; F112-L114 VanDerWaalsContact C-N 3.31Å; F112-L114 PolarHBondContact O-N 2.8Å; L114-S116 VanDerWaalsContact C-N 3.31Å; L114-F117 PolarHBondContact O-N 3.07Å; L114-D118 WeakPolarHBondContact O-CB 3.12Å; L114-D118 PolarHBondContact O-N 3.15Å; L114-L141 HydrophobicContact CD1-CD2 3.79Å; L114-L141 HydrophobicContact CD1-CG 3.87Å; L114-L141 HydrophobicContact CD2-CD2 3.44Å; L114-L141 VanDerWaalsContact CD2-CD2 3.44Å; L114-L141 HydrophobicContact CD2-CG 4.21Å; L114-L141 HydrophobicContact CG-CD2 4.22Å; L114-V145 HydrophobicContact CD1-CG2 4.1Å |
| 115 | I | 93.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -63.2 | -41.9 | 173.4 | -69.6 | 165.6 | 0 | 0 | 0 | 110 | Y59 L60 I63 F111 F112 D118 R119 I238 L298 | Y59-I115 HydrophobicContact CD2-CG1 3.96Å; Y59-I115 HydrophobicContact CG-CG1 4.26Å; L60-I115 HydrophobicContact CD2-CD1 3.71Å; L60-I115 HydrophobicContact CG-CD1 4.4Å; I63-I115 HydrophobicContact CD1-CD1 3.52Å; F111-I115 VanDerWaalsContact O-CG1 3.26Å; F111-I115 WeakPolarHBondContact O-CG1 3.11Å; F111-I115 PolarHBondContact O-N 3.42Å; F112-I115 PolarHBondContact O-N 3.09Å; I115-D118 WeakPolarHBondContact O-CB 3.45Å; I115-D118 PolarHBondContact O-N 3.34Å; I115-R119 VanDerWaalsContact O-CG 3.29Å; I115-R119 WeakPolarHBondContact O-CG 3.01Å; I115-R119 PolarHBondContact O-N 3.49Å; I115-I238 HydrophobicContact CG2-CD1 3.72Å; I115-L298 HydrophobicContact CG2-CD2 4.01Å |
| 116 | S | 92.2 | Very high | 91.8 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -70.2 | -36.9 | 179.6 | -57.1 | 0 | 0 | 0 | 0 | 112.5 | F112 G113 L114 R119 Y120 L202 Y206 | F112-S116 PolarHBondContact O-N 2.89Å; F112-S116 PolarHBondContact O-OG 3.42Å; G113-S116 PolarHBondContact O-N 2.77Å; L114-S116 VanDerWaalsContact C-N 3.31Å; S116-R119 PolarHBondContact O-N 3.23Å; S116-Y120 WeakPolarHBondContact O-CB 3.31Å; S116-Y120 PolarHBondContact O-N 3.34Å; S116-L202 WeakPolarHBondContact OG-CD2 3.19Å; S116-Y206 WeakPolarHBondContact OG-CE2 3.16Å; S116-Y206 PolarHBondContact OG-OH 3.47Å |
| 117 | F | 92.4 | Very high | 90.6 | Very high | 52 Ų | 52 | 35.4 Ų | 35.4 | 23% | 0.228 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.3 | -47.1 | 169.2 | 178.6 | -98.3 | 0 | 0 | 0 | 111.6 | G113 L114 R119 Y120 Y121 I132 F205 | G113-F117 WeakPolarHBondContact O-CB 3.47Å; G113-F117 PolarHBondContact O-N 3.49Å; L114-F117 PolarHBondContact O-N 3.07Å; F117-R119 VanDerWaalsContact C-N 3.34Å; F117-R119 PolarHBondContact O-N 2.87Å; F117-Y120 PolarHBondContact O-N 3.4Å; F117-Y121 HydrophobicContact CD1-CD2 4.35Å; F117-Y121 HydrophobicContact CD2-CD2 4.09Å; F117-Y121 AromaticContact CD2-CE2 3.78Å; F117-Y121 HydrophobicContact CD2-CE2 3.78Å; F117-Y121 HydrophobicContact CE1-CD2 4.07Å; F117-Y121 HydrophobicContact CE1-CE2 4.11Å; F117-Y121 AromaticContact CE2-CD2 3.82Å; F117-Y121 HydrophobicContact CE2-CD2 3.82Å; F117-Y121 AromaticContact CE2-CE2 3.17Å; F117-Y121 HydrophobicContact CE2-CE2 3.17Å; F117-Y121 HydrophobicContact CG-CD2 4.37Å; F117-Y121 HydrophobicContact CG-CE2 4.47Å; F117-Y121 AromaticContact CZ-CD2 3.78Å; F117-Y121 HydrophobicContact CZ-CD2 3.78Å; F117-Y121 AromaticContact CZ-CE2 3.34Å; F117-Y121 HydrophobicContact CZ-CE2 3.34Å; F117-Y121 WeakPolarHBondContact O-CD2 3.4Å; F117-Y121 PolarHBondContact O-N 3.27Å; F117-Y121 VanDerWaalsContact O-N 3.14Å; F117-I132 HydrophobicContact CD1-CG2 4.32Å; F117-I132 HydrophobicContact CE1-CG2 3.42Å; F117-I132 VanDerWaalsContact CE1-CG2 3.42Å; F117-I132 HydrophobicContact CZ-CG2 4.06Å; F117-F205 HydrophobicContact CB-CD2 4.4Å; F117-F205 HydrophobicContact CB-CE2 3.81Å; F117-F205 HydrophobicContact CB-CZ 4.42Å; F117-F205 AromaticContact CD2-CE2 3.96Å; F117-F205 HydrophobicContact CD2-CE2 3.96Å; F117-F205 AromaticContact CD2-CZ 3.69Å; F117-F205 HydrophobicContact CD2-CZ 3.69Å; F117-F205 HydrophobicContact CG-CE2 4.41Å |
| 118 | D | 90.1 | Very high | 89.4 | Confident | 3 Ų | 3 | 43.9 Ų | 43.9 | 2% | 0.016 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -55.3 | -48.4 | 174 | -179.4 | 86 | 0 | 0 | 0 | 111.3 | S55 Y59 L114 I115 Y120 Y121 K122 Q133 | S55-D118 WeakPolarHBondContact CB-OD1 2.93Å; S55-D118 PolarHBondContact OG-OD1 3.37Å; Y59-D118 HydrophobicContact CE2-CB 4.42Å; L114-D118 WeakPolarHBondContact O-CB 3.12Å; L114-D118 PolarHBondContact O-N 3.15Å; I115-D118 WeakPolarHBondContact O-CB 3.45Å; I115-D118 PolarHBondContact O-N 3.34Å; D118-Y120 VanDerWaalsContact C-N 3.35Å; D118-Y120 PolarHBondContact O-N 3.46Å; D118-Y121 PolarHBondContact O-N 3.44Å; D118-K122 PolarHBondContact O-N 3.01Å; D118-K122 VanDerWaalsContact O-N 3.16Å; D118-Q133 PolarHBondContact O-NE2 3.17Å; D118-Q133 VanDerWaalsContact OD1-CD 3.3Å; D118-Q133 WeakPolarHBondContact OD1-CG 3.11Å; D118-Q133 PolarHBondContact OD1-NE2 2.95Å; D118-Q133 VanDerWaalsContact OD1-NE2 3.14Å |
| 119 | R | 89.1 | Confident | 88.2 | Confident | 20 Ų | 20 | 45.1 Ų | 45.1 | 8% | 0.075 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.3 | -38.5 | 179.4 | -65.7 | -65.1 | 172.5 | -137.8 | 2.9 | 112.9 | F56 I115 S116 F117 K122 I123 I209 L298 | F56-R119 VanDerWaalsContact CD1-NH2 3.34Å; I115-R119 VanDerWaalsContact O-CG 3.29Å; I115-R119 WeakPolarHBondContact O-CG 3.01Å; I115-R119 PolarHBondContact O-N 3.49Å; S116-R119 PolarHBondContact O-N 3.23Å; F117-R119 VanDerWaalsContact C-N 3.34Å; F117-R119 PolarHBondContact O-N 2.87Å; R119-K122 PolarHBondContact O-N 3.27Å; R119-I123 WeakPolarHBondContact O-CG1 3.27Å; R119-I123 PolarHBondContact O-N 2.92Å; R119-I209 HydrophobicContact CB-CD1 4.2Å; R119-L298 VanDerWaalsContact NH2-CD1 3.34Å |
| 120 | Y | 90.2 | Very high | 86.9 | Confident | 40 Ų | 40 | 50.7 Ų | 50.7 | 16% | 0.157 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.8 | -52.6 | 177.7 | 169.9 | -95.8 | 0 | 0 | 0 | 111.6 | S116 F117 D118 K122 I123 V124 K125 F205 A208 I209 | S116-Y120 WeakPolarHBondContact O-CB 3.31Å; S116-Y120 PolarHBondContact O-N 3.34Å; F117-Y120 PolarHBondContact O-N 3.4Å; D118-Y120 VanDerWaalsContact C-N 3.35Å; D118-Y120 PolarHBondContact O-N 3.46Å; Y120-K122 VanDerWaalsContact C-N 3.33Å; Y120-K122 PolarHBondContact O-N 2.96Å; Y120-I123 PolarHBondContact O-N 3.4Å; Y120-V124 HydrophobicContact CD2-CB 3.99Å; Y120-V124 HydrophobicContact CD2-CG1 4.49Å; Y120-V124 HydrophobicContact CD2-CG2 3.73Å; Y120-V124 HydrophobicContact CE2-CB 3.76Å; Y120-V124 HydrophobicContact CE2-CG1 3.78Å; Y120-V124 HydrophobicContact CE2-CG2 3.83Å; Y120-V124 WeakPolarHBondContact O-CB 3.41Å; Y120-V124 PolarHBondContact O-N 3.26Å; Y120-K125 HydrophobicContact CE1-CG 4.19Å; Y120-F205 HydrophobicContact CD1-CD1 4.19Å; Y120-F205 HydrophobicContact CD1-CE1 4.39Å; Y120-F205 HydrophobicContact CD2-CB 4.33Å; Y120-F205 AromaticContact CD2-CD1 3.94Å; Y120-F205 HydrophobicContact CD2-CD1 3.94Å; Y120-F205 HydrophobicContact CD2-CG 4.44Å; Y120-F205 HydrophobicContact CE2-CD1 4.46Å; Y120-F205 HydrophobicContact CG-CB 4.4Å; Y120-F205 AromaticContact CG-CD1 3.79Å; Y120-F205 HydrophobicContact CG-CD1 3.79Å; Y120-F205 HydrophobicContact CG-CE1 4.43Å; Y120-F205 HydrophobicContact CG-CG 4.21Å; Y120-A208 HydrophobicContact CD2-CB 4.05Å; Y120-A208 HydrophobicContact CE2-CB 3.62Å; Y120-I209 HydrophobicContact CD2-CG1 4.48Å |
| 121 | Y | 88.5 | Confident | 85.7 | Confident | 51 Ų | 51 | 57 Ų | 57 | 20% | 0.2 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.7 | -41.5 | -178.8 | -86.3 | -91.5 | 0 | 0 | 0 | 111.9 | F117 D118 I123 K125 W128 I132 | F117-Y121 HydrophobicContact CD1-CD2 4.35Å; F117-Y121 HydrophobicContact CD2-CD2 4.09Å; F117-Y121 AromaticContact CD2-CE2 3.78Å; F117-Y121 HydrophobicContact CD2-CE2 3.78Å; F117-Y121 HydrophobicContact CE1-CD2 4.07Å; F117-Y121 HydrophobicContact CE1-CE2 4.11Å; F117-Y121 AromaticContact CE2-CD2 3.82Å; F117-Y121 HydrophobicContact CE2-CD2 3.82Å; F117-Y121 AromaticContact CE2-CE2 3.17Å; F117-Y121 HydrophobicContact CE2-CE2 3.17Å; F117-Y121 HydrophobicContact CG-CD2 4.37Å; F117-Y121 HydrophobicContact CG-CE2 4.47Å; F117-Y121 AromaticContact CZ-CD2 3.78Å; F117-Y121 HydrophobicContact CZ-CD2 3.78Å; F117-Y121 AromaticContact CZ-CE2 3.34Å; F117-Y121 HydrophobicContact CZ-CE2 3.34Å; F117-Y121 WeakPolarHBondContact O-CD2 3.4Å; F117-Y121 PolarHBondContact O-N 3.27Å; F117-Y121 VanDerWaalsContact O-N 3.14Å; D118-Y121 PolarHBondContact O-N 3.44Å; Y121-I123 VanDerWaalsContact C-N 3.3Å; Y121-I123 PolarHBondContact O-N 3.46Å; Y121-K125 HydrophobicContact CD1-CB 4.08Å; Y121-K125 HydrophobicContact CE1-CB 4.49Å; Y121-K125 CarbonylContact O-C 3.6Å; Y121-K125 WeakPolarHBondContact O-CA 3.22Å; Y121-K125 PolarHBondContact O-N 2.86Å; Y121-K125 VanDerWaalsContact O-N 3.12Å; Y121-K125 VanDerWaalsContact O-O 3.11Å; Y121-W128 HydrophobicContact CD1-CB 3.97Å; Y121-W128 HydrophobicContact CE1-CB 4.15Å; Y121-I132 HydrophobicContact CD1-CD1 3.65Å; Y121-I132 HydrophobicContact CE1-CD1 3.44Å; Y121-I132 VanDerWaalsContact CE1-CD1 3.44Å; Y121-I132 HydrophobicContact CG-CD1 4.25Å; Y121-I132 HydrophobicContact CG-CG2 4.5Å |
| 122 | K | 85.9 | Confident | 84.8 | Confident | 103 Ų | 103 | 58.1 Ų | 58.1 | 45% | 0.448 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -57.9 | -39.4 | 177.6 | -168.3 | 168.1 | -179.1 | 169.3 | 0 | 113.8 | D118 R119 Y120 | D118-K122 PolarHBondContact O-N 3.01Å; D118-K122 VanDerWaalsContact O-N 3.16Å; R119-K122 PolarHBondContact O-N 3.27Å; Y120-K122 VanDerWaalsContact C-N 3.33Å; Y120-K122 PolarHBondContact O-N 2.96Å |
| 123 | I | 84.7 | Confident | 84.2 | Confident | 36 Ų | 36 | 59.7 Ų | 59.7 | 19% | 0.185 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -97.8 | -42.1 | -169.7 | -63.5 | 170.3 | 0 | 0 | 0 | 111.6 | R119 Y120 Y121 I209 K212 I213 I235 | R119-I123 WeakPolarHBondContact O-CG1 3.27Å; R119-I123 PolarHBondContact O-N 2.92Å; Y120-I123 PolarHBondContact O-N 3.4Å; Y121-I123 VanDerWaalsContact C-N 3.3Å; Y121-I123 PolarHBondContact O-N 3.46Å; I123-I209 HydrophobicContact CD1-CG2 4.08Å; I123-K212 HydrophobicContact CG2-CG 4.26Å; I123-I213 HydrophobicContact CG2-CG1 4.45Å; I123-I235 HydrophobicContact CD1-CD1 3.38Å |
| 124 | V | 86 | Confident | 83.9 | Confident | 26 Ų | 26 | 61.2 Ų | 61.2 | 16% | 0.158 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -93.8 | -36.6 | -171.1 | -174.6 | 0 | 0 | 0 | 0 | 111.5 | Y120 A208 I209 K212 | Y120-V124 HydrophobicContact CD2-CB 3.99Å; Y120-V124 HydrophobicContact CD2-CG1 4.49Å; Y120-V124 HydrophobicContact CD2-CG2 3.73Å; Y120-V124 HydrophobicContact CE2-CB 3.76Å; Y120-V124 HydrophobicContact CE2-CG1 3.78Å; Y120-V124 HydrophobicContact CE2-CG2 3.83Å; Y120-V124 WeakPolarHBondContact O-CB 3.41Å; Y120-V124 PolarHBondContact O-N 3.26Å; V124-A208 HydrophobicContact CG2-CB 4.44Å; V124-I209 HydrophobicContact CG2-CG1 4.02Å; V124-K212 HydrophobicContact CG2-CB 4.18Å; V124-K212 HydrophobicContact CG2-CG 4.49Å |
| 125 | K | 83.6 | Confident | 83.7 | Confident | 107 Ų | 107 | 61.8 Ų | 61.8 | 47% | 0.465 | 31% | 0.307 | S | S | . | . | trans | -129.1 | 61.2 | -173.3 | -63.4 | -67.3 | -172.1 | 168.3 | 0 | 112.3 | Y120 Y121 L127 W128 | Y120-K125 HydrophobicContact CE1-CG 4.19Å; Y121-K125 HydrophobicContact CD1-CB 4.08Å; Y121-K125 HydrophobicContact CE1-CB 4.49Å; Y121-K125 CarbonylContact O-C 3.6Å; Y121-K125 WeakPolarHBondContact O-CA 3.22Å; Y121-K125 PolarHBondContact O-N 2.86Å; Y121-K125 VanDerWaalsContact O-N 3.12Å; Y121-K125 VanDerWaalsContact O-O 3.11Å; K125-L127 PolarHBondContact O-N 3.43Å; K125-W128 PolarHBondContact O-N 3.25Å; K125-W128 VanDerWaalsContact O-N 3.12Å | ||
| 126 | P | 77.7 | Confident | 83.6 | Confident | 79 Ų | 79 | 65.9 Ų | 65.9 | 51% | 0.513 | 34% | 0.336 | S | S | . | . | G | 310 helix | trans | -60.8 | -24.9 | -170.6 | 24.6 | -35.1 | 0 | 0 | 0 | 114.6 | W128 T129 | P126-W128 VanDerWaalsContact C-N 3.26Å; P126-W128 PolarHBondContact O-N 3.4Å; P126-T129 VanDerWaalsContact CA-OG1 3.24Å; P126-T129 WeakPolarHBondContact CA-OG1 3.35Å; P126-T129 WeakPolarHBondContact O-CB 3.44Å; P126-T129 PolarHBondContact O-N 3.34Å; P126-T129 PolarHBondContact O-OG1 3.16Å |
| 127 | L | 73.9 | Confident | 83.6 | Confident | 167 Ų | 167 | 70 Ų | 70 | 87% | 0.874 | 35% | 0.352 | S | S | * | . | G | 310 helix | trans | -68.5 | -21.1 | -179.8 | -60.6 | 175 | 0 | 0 | 0 | 113.7 | K125 | K125-L127 PolarHBondContact O-N 3.43Š|
| 128 | W | 72.9 | Confident | 83.6 | Confident | 178 Ų | 178 | 67.5 Ų | 67.5 | 67% | 0.674 | 34% | 0.341 | S | S | * | . | G | 310 helix | trans | -99.9 | 4.2 | -177.6 | -71.7 | 58.1 | 0 | 0 | 0 | 112.7 | Y121 K125 P126 S130 I132 | Y121-W128 HydrophobicContact CD1-CB 3.97Å; Y121-W128 HydrophobicContact CE1-CB 4.15Å; K125-W128 PolarHBondContact O-N 3.25Å; K125-W128 VanDerWaalsContact O-N 3.12Å; P126-W128 VanDerWaalsContact C-N 3.26Å; P126-W128 PolarHBondContact O-N 3.4Å; W128-S130 PolarHBondContact O-N 3.12Å; W128-I132 HydrophobicContact CB-CD1 4.38Å; W128-I132 HydrophobicContact CE3-CD1 4.5Å |
| 129 | T | 72.9 | Confident | 83.9 | Confident | 27 Ų | 27 | 72.9 Ų | 72.9 | 17% | 0.166 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -68.8 | -35.5 | -168.4 | -47.9 | 0 | 0 | 0 | 0 | 113.1 | P126 F131 Q133 | P126-T129 VanDerWaalsContact CA-OG1 3.24Å; P126-T129 WeakPolarHBondContact CA-OG1 3.35Å; P126-T129 WeakPolarHBondContact O-CB 3.44Å; P126-T129 PolarHBondContact O-N 3.34Å; P126-T129 PolarHBondContact O-OG1 3.16Å; T129-F131 PolarHBondContact O-N 2.95Å; T129-Q133 HydrophobicContact CG2-CB 4.25Å; T129-Q133 HydrophobicContact CG2-CG 3.72Å; T129-Q133 VanDerWaalsContact O-CB 3.28Å; T129-Q133 WeakPolarHBondContact O-CB 3.46Å; T129-Q133 WeakPolarHBondContact O-CG 3.41Å; T129-Q133 PolarHBondContact O-N 3.02Å |
| 130 | S | 70.3 | Confident | 84.2 | Confident | 117 Ų | 117 | 76.8 Ų | 76.8 | 82% | 0.818 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -63.1 | -41.7 | -168 | 179.6 | 0 | 0 | 0 | 0 | 113.6 | W128 | W128-S130 PolarHBondContact O-N 3.12Å |
| 131 | F | 73.1 | Confident | 84.5 | Confident | 156 Ų | 156 | 76.5 Ų | 76.5 | 68% | 0.684 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -79.8 | -49.9 | 178.9 | -178.9 | -104.5 | 0 | 0 | 0 | 112.2 | T129 Q133 S134 | T129-F131 PolarHBondContact O-N 2.95Å; F131-Q133 VanDerWaalsContact C-N 3.3Å; F131-Q133 PolarHBondContact O-N 3.31Å; F131-S134 VanDerWaalsContact O-CB 3.27Å; F131-S134 WeakPolarHBondContact O-CB 3.46Å; F131-S134 PolarHBondContact O-N 3.05Å |
| 132 | I | 77.5 | Confident | 84.9 | Confident | 23 Ų | 23 | 74.3 Ų | 74.3 | 12% | 0.118 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -67.9 | -28.8 | -172.4 | -66.5 | 172.5 | 0 | 0 | 0 | 112.4 | F117 Y121 W128 Y137 | F117-I132 HydrophobicContact CD1-CG2 4.32Å; F117-I132 HydrophobicContact CE1-CG2 3.42Å; F117-I132 VanDerWaalsContact CE1-CG2 3.42Å; F117-I132 HydrophobicContact CZ-CG2 4.06Å; Y121-I132 HydrophobicContact CD1-CD1 3.65Å; Y121-I132 HydrophobicContact CE1-CD1 3.44Å; Y121-I132 VanDerWaalsContact CE1-CD1 3.44Å; Y121-I132 HydrophobicContact CG-CD1 4.25Å; Y121-I132 HydrophobicContact CG-CG2 4.5Å; W128-I132 HydrophobicContact CB-CD1 4.38Å; W128-I132 HydrophobicContact CE3-CD1 4.5Å; I132-Y137 WeakPolarHBondContact O-CD1 3.37Å |
| 133 | Q | 83 | Confident | 85.5 | Confident | 34 Ų | 34 | 73.5 Ų | 73.5 | 16% | 0.159 | 38% | 0.383 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.7 | 15.2 | 178.8 | -56.6 | -161 | -22.2 | 0 | 0 | 113.6 | S55 D118 T129 F131 V135 | S55-Q133 WeakPolarHBondContact CB-O 2.94Å; D118-Q133 PolarHBondContact O-NE2 3.17Å; D118-Q133 VanDerWaalsContact OD1-CD 3.3Å; D118-Q133 WeakPolarHBondContact OD1-CG 3.11Å; D118-Q133 PolarHBondContact OD1-NE2 2.95Å; D118-Q133 VanDerWaalsContact OD1-NE2 3.14Å; T129-Q133 HydrophobicContact CG2-CB 4.25Å; T129-Q133 HydrophobicContact CG2-CG 3.72Å; T129-Q133 VanDerWaalsContact O-CB 3.28Å; T129-Q133 WeakPolarHBondContact O-CB 3.46Å; T129-Q133 WeakPolarHBondContact O-CG 3.41Å; T129-Q133 PolarHBondContact O-N 3.02Å; F131-Q133 VanDerWaalsContact C-N 3.3Å; F131-Q133 PolarHBondContact O-N 3.31Å; Q133-V135 PolarHBondContact O-N 2.98Å |
| 134 | S | 89.3 | Confident | 86.2 | Confident | 42 Ų | 42 | 76 Ų | 76 | 29% | 0.294 | 40% | 0.396 | S | S | . | . | trans | -60.9 | 135.1 | 172.7 | 171.9 | 0 | 0 | 0 | 0 | 111 | F131 S136 Y137 S138 | F131-S134 VanDerWaalsContact O-CB 3.27Å; F131-S134 WeakPolarHBondContact O-CB 3.46Å; F131-S134 PolarHBondContact O-N 3.05Å; S134-S136 PolarHBondContact O-N 3.39Å; S134-S136 PolarHBondContact OG-N 3.07Å; S134-Y137 PolarHBondContact O-N 3.07Å; S134-S138 PolarHBondContact O-N 3.29Å; S134-S138 PolarHBondContact O-OG 3.3Å | ||
| 135 | V | 91 | Very high | 86.7 | Confident | 37 Ų | 37 | 75.3 Ų | 75.3 | 22% | 0.224 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -57.7 | -40.2 | 175.3 | 172.3 | 0 | 0 | 0 | 0 | 110.8 | S52 I58 Q133 S138 K139 | S52-V135 WeakPolarHBondContact O-CG1 3.41Å; I58-V135 HydrophobicContact CD1-CB 4.17Å; I58-V135 HydrophobicContact CD1-CG1 3.56Å; I58-V135 WeakPolarHBondContact CD1-O 3.33Å; Q133-V135 PolarHBondContact O-N 2.98Å; V135-S138 PolarHBondContact O-N 3.34Å; V135-K139 WeakPolarHBondContact O-CG 3.3Å; V135-K139 PolarHBondContact O-N 2.94Å |
| 136 | S | 91.4 | Very high | 87.4 | Confident | 86 Ų | 86 | 72.7 Ų | 72.7 | 60% | 0.601 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -65.3 | -41.4 | 178.4 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | S134 K139 L140 | S134-S136 PolarHBondContact O-N 3.39Å; S134-S136 PolarHBondContact OG-N 3.07Å; S136-K139 PolarHBondContact O-N 3.03Å; S136-L140 PolarHBondContact O-N 3.33Å |
| 137 | Y | 91.8 | Very high | 88.4 | Confident | 85 Ų | 85 | 74.7 Ų | 74.7 | 33% | 0.333 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.3 | -44.5 | 176.2 | -175.5 | -100.2 | 0 | 0 | 0 | 111.4 | I132 S134 K139 L140 L141 | I132-Y137 WeakPolarHBondContact O-CD1 3.37Å; S134-Y137 PolarHBondContact O-N 3.07Å; Y137-K139 VanDerWaalsContact C-N 3.33Å; Y137-K139 PolarHBondContact O-N 2.86Å; Y137-L140 PolarHBondContact O-N 2.67Å; Y137-L141 HydrophobicContact CE1-CD2 4.17Å; Y137-L141 WeakPolarHBondContact O-CB 3.45Å; Y137-L141 PolarHBondContact O-N 3.4Å |
| 138 | S | 94 | Very high | 89.6 | Confident | 0 Ų | 0 | 70.8 Ų | 70.8 | 0% | 0 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -63 | -35.3 | 176.1 | -66.3 | 0 | 0 | 0 | 0 | 113.5 | S55 Y59 S134 V135 S142 | S55-S138 VanDerWaalsContact CA-OG 3.3Å; S55-S138 WeakPolarHBondContact CA-OG 3.46Å; S55-S138 WeakPolarHBondContact CB-OG 3.34Å; Y59-S138 VanDerWaalsContact CZ-OG 3.31Å; Y59-S138 PolarHBondContact OH-OG 3.29Å; S134-S138 PolarHBondContact O-N 3.29Å; S134-S138 PolarHBondContact O-OG 3.3Å; V135-S138 PolarHBondContact O-N 3.34Å; S138-S142 WeakPolarHBondContact O-CB 3.35Å; S138-S142 PolarHBondContact O-N 3.5Å; S138-S142 PolarHBondContact O-OG 3.29Å |
| 139 | K | 95.4 | Very high | 90.7 | Very high | 116 Ų | 116 | 62.3 Ų | 62.3 | 50% | 0.504 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64.6 | -49.7 | 173.1 | -73.3 | 177 | -178.3 | 179 | 0 | 111.3 | I58 V135 S136 Y137 L141 S142 V143 | I58-K139 HydrophobicContact CD1-CG 3.8Å; I58-K139 HydrophobicContact CG2-CG 4.48Å; V135-K139 WeakPolarHBondContact O-CG 3.3Å; V135-K139 PolarHBondContact O-N 2.94Å; S136-K139 PolarHBondContact O-N 3.03Å; Y137-K139 VanDerWaalsContact C-N 3.33Å; Y137-K139 PolarHBondContact O-N 2.86Å; K139-L141 VanDerWaalsContact C-N 3.33Å; K139-L141 PolarHBondContact O-N 3.28Å; K139-S142 WeakPolarHBondContact O-CB 3.17Å; K139-S142 PolarHBondContact O-N 2.99Å; K139-V143 WeakPolarHBondContact O-CG2 3.36Å; K139-V143 PolarHBondContact O-N 2.87Å |
| 140 | L | 95.7 | Very high | 91.8 | Very high | 103 Ų | 103 | 64.6 Ų | 64.6 | 54% | 0.539 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -56.8 | -48.3 | 177.9 | 176.6 | 62.1 | 0 | 0 | 0 | 111.1 | S136 Y137 S142 V143 I144 | S136-L140 PolarHBondContact O-N 3.33Å; Y137-L140 PolarHBondContact O-N 2.67Å; L140-S142 VanDerWaalsContact C-N 3.3Å; L140-S142 PolarHBondContact O-N 3.47Å; L140-V143 PolarHBondContact O-N 3.38Å; L140-I144 HydrophobicContact CD1-CD1 4.24Å; L140-I144 HydrophobicContact CG-CD1 4.04Å; L140-I144 WeakPolarHBondContact O-CG1 3.26Å; L140-I144 PolarHBondContact O-N 2.95Å |
| 141 | L | 96.3 | Very high | 93.1 | Very high | 33 Ų | 33 | 64.4 Ų | 64.4 | 17% | 0.173 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.9 | -37.9 | 179.3 | -167.8 | 58.7 | 0 | 0 | 0 | 112 | L114 Y137 K139 I144 V145 | L114-L141 HydrophobicContact CD1-CD2 3.79Å; L114-L141 HydrophobicContact CD1-CG 3.87Å; L114-L141 HydrophobicContact CD2-CD2 3.44Å; L114-L141 VanDerWaalsContact CD2-CD2 3.44Å; L114-L141 HydrophobicContact CD2-CG 4.21Å; L114-L141 HydrophobicContact CG-CD2 4.22Å; Y137-L141 HydrophobicContact CE1-CD2 4.17Å; Y137-L141 WeakPolarHBondContact O-CB 3.45Å; Y137-L141 PolarHBondContact O-N 3.4Å; K139-L141 VanDerWaalsContact C-N 3.33Å; K139-L141 PolarHBondContact O-N 3.28Å; L141-I144 PolarHBondContact O-N 3.28Å; L141-V145 VanDerWaalsContact O-CG2 3.32Å; L141-V145 WeakPolarHBondContact O-CG2 3.12Å; L141-V145 PolarHBondContact O-N 3.21Å |
| 142 | S | 97.8 | Very high | 94.2 | Very high | 5 Ų | 5 | 57.5 Ų | 57.5 | 4% | 0.035 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.5 | -43.1 | 175 | -55.9 | 0 | 0 | 0 | 0 | 111.8 | N62 F111 S138 K139 L140 V145 W146 | N62-S142 PolarHBondContact ND2-OG 2.88Å; F111-S142 WeakPolarHBondContact CE1-OG 3.4Å; S138-S142 WeakPolarHBondContact O-CB 3.35Å; S138-S142 PolarHBondContact O-N 3.5Å; S138-S142 PolarHBondContact O-OG 3.29Å; K139-S142 WeakPolarHBondContact O-CB 3.17Å; K139-S142 PolarHBondContact O-N 2.99Å; L140-S142 VanDerWaalsContact C-N 3.3Å; L140-S142 PolarHBondContact O-N 3.47Å; S142-V145 PolarHBondContact O-N 3.3Å; S142-W146 PolarHBondContact O-N 2.85Å |
| 143 | V | 98 | Very high | 95 | Very high | 87 Ų | 87 | 56.6 Ų | 56.6 | 53% | 0.527 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.7 | -45.2 | 175.7 | 172.8 | 0 | 0 | 0 | 0 | 110.7 | K139 L140 V145 W146 M147 | K139-V143 WeakPolarHBondContact O-CG2 3.36Å; K139-V143 PolarHBondContact O-N 2.87Å; L140-V143 PolarHBondContact O-N 3.38Å; V143-V145 VanDerWaalsContact C-N 3.33Å; V143-V145 PolarHBondContact O-N 2.89Å; V143-W146 PolarHBondContact O-N 2.86Å; V143-M147 HydrophobicContact CG1-CG 4.21Å; V143-M147 VanDerWaalsContact O-CG 3.32Å; V143-M147 WeakPolarHBondContact O-CG 3.45Å; V143-M147 PolarHBondContact O-N 3.49Å |
| 144 | I | 98.1 | Very high | 95.6 | Very high | 89 Ų | 89 | 58 Ų | 58 | 46% | 0.456 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -58.9 | -44.9 | 177.6 | -67.9 | 167.3 | 0 | 0 | 0 | 111 | L140 L141 M147 L148 | L140-I144 HydrophobicContact CD1-CD1 4.24Å; L140-I144 HydrophobicContact CG-CD1 4.04Å; L140-I144 WeakPolarHBondContact O-CG1 3.26Å; L140-I144 PolarHBondContact O-N 2.95Å; L141-I144 PolarHBondContact O-N 3.28Å; I144-M147 PolarHBondContact O-N 3.31Å; I144-L148 WeakPolarHBondContact O-CB 3.4Å; I144-L148 PolarHBondContact O-N 3.43Å |
| 145 | V | 98.3 | Very high | 95.9 | Very high | 10 Ų | 10 | 57.6 Ų | 57.6 | 6% | 0.061 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.8 | -49.8 | 177.2 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | V110 F111 L114 L141 S142 V143 M147 L148 M149 | V110-V145 HydrophobicContact CB-CG1 4.24Å; V110-V145 HydrophobicContact CG1-CB 4.46Å; V110-V145 HydrophobicContact CG1-CG1 3.9Å; V110-V145 HydrophobicContact CG1-CG2 3.62Å; F111-V145 HydrophobicContact CE2-CG1 4.05Å; F111-V145 HydrophobicContact CZ-CB 4.29Å; F111-V145 HydrophobicContact CZ-CG1 4.2Å; L114-V145 HydrophobicContact CD1-CG2 4.1Å; L141-V145 VanDerWaalsContact O-CG2 3.32Å; L141-V145 WeakPolarHBondContact O-CG2 3.12Å; L141-V145 PolarHBondContact O-N 3.21Å; S142-V145 PolarHBondContact O-N 3.3Å; V143-V145 VanDerWaalsContact C-N 3.33Å; V143-V145 PolarHBondContact O-N 2.89Å; V145-M147 PolarHBondContact O-N 3.2Å; V145-L148 PolarHBondContact O-N 3Å; V145-M149 HydrophobicContact CG1-CG 4.28Å; V145-M149 WeakPolarHBondContact O-CB 3.37Å; V145-M149 WeakPolarHBondContact O-CG 3.49Å; V145-M149 PolarHBondContact O-N 3.47Å |
| 146 | W | 98.2 | Very high | 96.1 | Very high | 53 Ų | 53 | 56.2 Ų | 56.2 | 20% | 0.201 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.6 | -45.4 | 178.3 | -80.7 | 111.2 | 0 | 0 | 0 | 112.6 | N62 I65 A66 N104 V107 S142 V143 L148 M149 L150 | N62-W146 PolarHBondContact OD1-NE1 2.54Å; I65-W146 HydrophobicContact CG2-CH2 4.39Å; I65-W146 HydrophobicContact CG2-CZ2 4.07Å; A66-W146 HydrophobicContact CB-CH2 4.18Å; A66-W146 HydrophobicContact CB-CZ2 4.37Å; N104-W146 WeakPolarHBondContact OD1-CH2 3.36Å; V107-W146 HydrophobicContact CG1-CH2 3.93Å; V107-W146 HydrophobicContact CG1-CZ2 3.79Å; V107-W146 HydrophobicContact CG1-CZ3 4.35Å; V107-W146 HydrophobicContact CG2-CE3 4.07Å; V107-W146 HydrophobicContact CG2-CH2 4.24Å; V107-W146 HydrophobicContact CG2-CZ3 3.89Å; S142-W146 PolarHBondContact O-N 2.85Å; V143-W146 PolarHBondContact O-N 2.86Å; W146-L148 PolarHBondContact O-N 2.9Å; W146-M149 PolarHBondContact O-N 3.48Å; W146-L150 WeakPolarHBondContact O-CB 3.46Å; W146-L150 VanDerWaalsContact O-CG 3.24Å; W146-L150 WeakPolarHBondContact O-CG 3.4Å; W146-L150 PolarHBondContact O-N 2.95Å |
| 147 | M | 98.2 | Very high | 96.3 | Very high | 121 Ų | 121 | 54.6 Ų | 54.6 | 60% | 0.596 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -62.3 | -43.1 | 179.1 | -69.4 | -55.6 | -63.8 | 0 | 0 | 112.1 | V143 I144 V145 L150 L151 | V143-M147 HydrophobicContact CG1-CG 4.21Å; V143-M147 VanDerWaalsContact O-CG 3.32Å; V143-M147 WeakPolarHBondContact O-CG 3.45Å; V143-M147 PolarHBondContact O-N 3.49Å; I144-M147 PolarHBondContact O-N 3.31Å; V145-M147 PolarHBondContact O-N 3.2Å; M147-L150 PolarHBondContact O-N 3.3Å; M147-L151 VanDerWaalsContact O-CB 3.31Å; M147-L151 WeakPolarHBondContact O-CB 3.28Å; M147-L151 PolarHBondContact O-N 3.07Å |
| 148 | L | 97.8 | Very high | 96.4 | Very high | 84 Ų | 84 | 55.9 Ų | 55.9 | 44% | 0.44 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 176.4 | -178.9 | 66.1 | 0 | 0 | 0 | 111.5 | I144 V145 W146 L151 L152 | I144-L148 WeakPolarHBondContact O-CB 3.4Å; I144-L148 PolarHBondContact O-N 3.43Å; V145-L148 PolarHBondContact O-N 3Å; W146-L148 PolarHBondContact O-N 2.9Å; L148-L151 WeakPolarHBondContact O-CB 3.43Å; L148-L151 PolarHBondContact O-N 2.88Å; L148-L152 WeakPolarHBondContact O-CG 3.23Å; L148-L152 PolarHBondContact O-N 2.95Å; L148-L152 VanDerWaalsContact O-N 3.13Å |
| 149 | M | 97.5 | Very high | 96.5 | Very high | 1 Ų | 1 | 57.4 Ų | 57.4 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -66 | -42.1 | -179.9 | -69.1 | -66.9 | 168 | 0 | 0 | 111.4 | V103 V107 V110 V145 W146 L152 A153 F191 I194 | V103-M149 HydrophobicContact CG1-CB 4.02Å; V107-M149 HydrophobicContact CG2-CB 3.81Å; V107-M149 HydrophobicContact CG2-CG 3.6Å; V107-M149 HydrophobicContact CG2-SD 4.42Å; V110-M149 HydrophobicContact CB-CE 4.32Å; V110-M149 HydrophobicContact CG2-CE 3.49Å; V110-M149 VanDerWaalsContact CG2-CE 3.49Å; V145-M149 HydrophobicContact CG1-CG 4.28Å; V145-M149 WeakPolarHBondContact O-CB 3.37Å; V145-M149 WeakPolarHBondContact O-CG 3.49Å; V145-M149 PolarHBondContact O-N 3.47Å; W146-M149 PolarHBondContact O-N 3.48Å; M149-L152 PolarHBondContact O-N 3.07Å; M149-A153 VanDerWaalsContact O-CB 3.27Å; M149-A153 WeakPolarHBondContact O-CB 3.25Å; M149-A153 PolarHBondContact O-N 3.4Å; M149-F191 HydrophobicContact SD-CE1 3.72Å; M149-I194 HydrophobicContact CE-CD1 4.22Å |
| 150 | L | 96.3 | Very high | 96.3 | Very high | 75 Ų | 75 | 52 Ų | 52 | 39% | 0.393 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.9 | -39.4 | 173.9 | -70.6 | 172.1 | 0 | 0 | 0 | 112 | W146 M147 L152 A153 V154 | W146-L150 WeakPolarHBondContact O-CB 3.46Å; W146-L150 VanDerWaalsContact O-CG 3.24Å; W146-L150 WeakPolarHBondContact O-CG 3.4Å; W146-L150 PolarHBondContact O-N 2.95Å; M147-L150 PolarHBondContact O-N 3.3Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 3.08Å; L150-A153 PolarHBondContact O-N 2.98Å; L150-A153 VanDerWaalsContact O-N 3.13Å; L150-V154 WeakPolarHBondContact O-CB 3.36Å; L150-V154 VanDerWaalsContact O-CG2 3.29Å; L150-V154 WeakPolarHBondContact O-CG2 3.19Å; L150-V154 PolarHBondContact O-N 3.45Å |
| 151 | L | 96.9 | Very high | 96 | Very high | 113 Ų | 113 | 51.5 Ų | 51.5 | 59% | 0.592 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -60.5 | -36.9 | 176.1 | -179.5 | 64.2 | 0 | 0 | 0 | 112.2 | M147 L148 P155 | M147-L151 VanDerWaalsContact O-CB 3.31Å; M147-L151 WeakPolarHBondContact O-CB 3.28Å; M147-L151 PolarHBondContact O-N 3.07Å; L148-L151 WeakPolarHBondContact O-CB 3.43Å; L148-L151 PolarHBondContact O-N 2.88Å; L151-P155 WeakPolarHBondContact O-CD 3.47Å; L151-P155 WeakPolarHBondContact O-CG 3.44Å |
| 152 | L | 95.6 | Very high | 95.7 | Very high | 10 Ų | 10 | 54.1 Ų | 54.1 | 5% | 0.052 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -75.5 | -33.5 | 174.8 | -64.8 | 172.5 | 0 | 0 | 0 | 112.4 | L148 M149 L150 N156 W183 I190 F191 I194 | L148-L152 WeakPolarHBondContact O-CG 3.23Å; L148-L152 PolarHBondContact O-N 2.95Å; L148-L152 VanDerWaalsContact O-N 3.13Å; M149-L152 PolarHBondContact O-N 3.07Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 3.08Å; L152-N156 PolarHBondContact O-ND2 3.17Å; L152-W183 HydrophobicContact CD2-CZ2 4.39Å; L152-W183 PolarHBondContact O-NE1 3.14Å; L152-I190 HydrophobicContact CD1-CG2 3.83Å; L152-I190 HydrophobicContact CD2-CD1 4Å; L152-I190 HydrophobicContact CD2-CG2 4.14Å; L152-F191 HydrophobicContact CB-CE1 4.46Å; L152-F191 HydrophobicContact CB-CE2 4.07Å; L152-F191 HydrophobicContact CB-CZ 3.72Å; L152-F191 HydrophobicContact CD1-CD1 4.42Å; L152-F191 HydrophobicContact CD1-CE1 3.96Å; L152-F191 HydrophobicContact CD1-CZ 4.03Å; L152-I194 HydrophobicContact CD1-CD1 4.25Å |
| 153 | A | 95 | Very high | 94.8 | Very high | 4 Ų | 4 | 59.2 Ų | 59.2 | 3% | 0.033 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -76 | -52.2 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | V99 V103 M149 L150 N156 I157 | V99-A153 HydrophobicContact CG1-CB 4.06Å; V103-A153 HydrophobicContact CB-CB 4.36Å; V103-A153 HydrophobicContact CG1-CB 4.21Å; V103-A153 HydrophobicContact CG2-CB 3.35Å; M149-A153 VanDerWaalsContact O-CB 3.27Å; M149-A153 WeakPolarHBondContact O-CB 3.25Å; M149-A153 PolarHBondContact O-N 3.4Å; L150-A153 PolarHBondContact O-N 2.98Å; L150-A153 VanDerWaalsContact O-N 3.13Å; A153-N156 WeakPolarHBondContact O-CA 3.46Å; A153-N156 VanDerWaalsContact O-CB 3.22Å; A153-N156 WeakPolarHBondContact O-CB 3.25Å; A153-N156 PolarHBondContact O-N 2.91Å; A153-I157 PolarHBondContact O-N 2.92Å |
| 154 | V | 96.2 | Very high | 93.6 | Very high | 64 Ų | 64 | 57.6 Ų | 57.6 | 39% | 0.388 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.9 | -44.4 | -167.8 | 168 | 0 | 0 | 0 | 0 | 112.2 | L150 N156 I157 I158 | L150-V154 WeakPolarHBondContact O-CB 3.36Å; L150-V154 VanDerWaalsContact O-CG2 3.29Å; L150-V154 WeakPolarHBondContact O-CG2 3.19Å; L150-V154 PolarHBondContact O-N 3.45Å; V154-N156 VanDerWaalsContact C-N 3.25Å; V154-N156 PolarHBondContact O-N 3.48Å; V154-I157 WeakPolarHBondContact O-CB 3.26Å; V154-I157 PolarHBondContact O-N 3.36Å; V154-I158 HydrophobicContact CG1-CD1 3.53Å; V154-I158 HydrophobicContact CG1-CG1 4.19Å; V154-I158 WeakPolarHBondContact O-CG1 3.4Å; V154-I158 PolarHBondContact O-N 2.73Å |
| 155 | P | 95.7 | Very high | 91.9 | Very high | 33 Ų | 33 | 64 Ų | 64 | 21% | 0.214 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -66 | -29.1 | 176.1 | -16.9 | 29.9 | 0 | 0 | 0 | 112.4 | L151 I157 L159 W183 | L151-P155 WeakPolarHBondContact O-CD 3.47Å; L151-P155 WeakPolarHBondContact O-CG 3.44Å; P155-I157 VanDerWaalsContact C-N 3.27Å; P155-I157 PolarHBondContact O-N 2.76Å; P155-L159 HydrophobicContact CB-CD1 4.22Å; P155-L159 WeakPolarHBondContact O-CB 3.29Å; P155-L159 WeakPolarHBondContact O-CG 3.32Å; P155-L159 PolarHBondContact O-N 2.88Å; P155-W183 HydrophobicContact CB-CD2 4.26Å; P155-W183 HydrophobicContact CB-CG 4.29Å; P155-W183 HydrophobicContact CB-CZ2 4.28Å; P155-W183 HydrophobicContact CG-CZ2 3.86Å |
| 156 | N | 93.8 | Very high | 90.2 | Very high | 8 Ų | 8 | 71.5 Ų | 71.5 | 4% | 0.043 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64 | -33.2 | 172.1 | -91.3 | -73.6 | 0 | 0 | 0 | 112.2 | V99 L152 A153 V154 T160 K176 W183 H184 S187 | V99-N156 HydrophobicContact CG1-CB 4.25Å; V99-N156 HydrophobicContact CG2-CB 4.32Å; L152-N156 PolarHBondContact O-ND2 3.17Å; A153-N156 WeakPolarHBondContact O-CA 3.46Å; A153-N156 VanDerWaalsContact O-CB 3.22Å; A153-N156 WeakPolarHBondContact O-CB 3.25Å; A153-N156 PolarHBondContact O-N 2.91Å; V154-N156 VanDerWaalsContact C-N 3.25Å; V154-N156 PolarHBondContact O-N 3.48Å; N156-T160 PolarHBondContact O-OG1 3.14Å; N156-K176 PolarHBondContact O-NZ 2.87Å; N156-K176 PolarHBondContact OD1-NZ 3.32Å; N156-W183 PolarHBondContact ND2-NE1 3.16Å; N156-H184 WeakPolarHBondContact OD1-CA 3.33Å; N156-H184 PolarHBondContact OD1-ND1 3.46Å; N156-H184 VanDerWaalsContact OD1-ND1 3.08Å; N156-S187 PolarHBondContact ND2-OG 2.95Å |
| 157 | I | 95.3 | Very high | 88.7 | Confident | 53 Ų | 53 | 72.8 Ų | 72.8 | 27% | 0.272 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -72.5 | -55.8 | 175.1 | -57.5 | 179 | 0 | 0 | 0 | 109.4 | R95 V96 V99 A153 V154 P155 L159 T160 | R95-I157 WeakPolarHBondContact O-CG1 3.34Å; V96-I157 HydrophobicContact CG2-CG2 4.45Å; V99-I157 HydrophobicContact CB-CG1 4.08Å; V99-I157 HydrophobicContact CG1-CD1 4.27Å; V99-I157 HydrophobicContact CG1-CG1 3.84Å; V99-I157 HydrophobicContact CG2-CG1 4.2Å; A153-I157 PolarHBondContact O-N 2.92Å; V154-I157 WeakPolarHBondContact O-CB 3.26Å; V154-I157 PolarHBondContact O-N 3.36Å; P155-I157 VanDerWaalsContact C-N 3.27Å; P155-I157 PolarHBondContact O-N 2.76Å; I157-L159 PolarHBondContact O-N 3.1Å; I157-T160 PolarHBondContact O-N 2.59Å |
| 158 | I | 95.7 | Very high | 87 | Confident | 112 Ų | 112 | 73.4 Ų | 73.4 | 57% | 0.574 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -61.4 | -42.2 | -174.1 | -64.4 | 172.9 | 0 | 0 | 0 | 111.9 | V154 T160 | V154-I158 HydrophobicContact CG1-CD1 3.53Å; V154-I158 HydrophobicContact CG1-CG1 4.19Å; V154-I158 WeakPolarHBondContact O-CG1 3.4Å; V154-I158 PolarHBondContact O-N 2.73Å; I158-T160 PolarHBondContact O-N 3.38Å |
| 159 | L | 94.9 | Very high | 85.5 | Confident | 31 Ų | 31 | 75.8 Ų | 75.8 | 16% | 0.162 | 40% | 0.4 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | 0.5 | -176.1 | -61 | 171.6 | 0 | 0 | 0 | 113.8 | P155 I157 N161 S177 L179 G180 W183 | P155-L159 HydrophobicContact CB-CD1 4.22Å; P155-L159 WeakPolarHBondContact O-CB 3.29Å; P155-L159 WeakPolarHBondContact O-CG 3.32Å; P155-L159 PolarHBondContact O-N 2.88Å; I157-L159 PolarHBondContact O-N 3.1Å; L159-N161 PolarHBondContact O-N 3.34Å; L159-N161 PolarHBondContact O-OD1 2.93Å; L159-S177 PolarHBondContact O-N 3.01Å; L159-S177 PolarHBondContact O-OG 3.05Å; L159-S177 VanDerWaalsContact O-OG 3.1Å; L159-L179 HydrophobicContact CD1-CD2 4.36Å; L159-L179 HydrophobicContact CD1-CG 4.15Å; L159-L179 HydrophobicContact CD2-CD2 4.09Å; L159-L179 HydrophobicContact CD2-CG 4.47Å; L159-G180 VanDerWaalsContact CB-CA 3.42Å; L159-W183 HydrophobicContact CD1-CB 4.01Å; L159-W183 HydrophobicContact CD1-CG 4.33Å |
| 160 | T | 91.6 | Very high | 84.5 | Confident | 2 Ų | 2 | 76.3 Ų | 76.3 | 1% | 0.012 | 40% | 0.403 | C | S | . | . | trans | -89.5 | 57.3 | 171.1 | -50.3 | 0 | 0 | 0 | 0 | 110.2 | R95 N156 I157 I158 L175 K176 | R95-T160 HydrophobicContact CG-CG2 3.57Å; R95-T160 PolarHBondContact NE-O 3.01Å; N156-T160 PolarHBondContact O-OG1 3.14Å; I157-T160 PolarHBondContact O-N 2.59Å; I158-T160 PolarHBondContact O-N 3.38Å; T160-L175 CarbonylContact C-O 3.6Å; T160-L175 WeakPolarHBondContact CA-O 3.49Å; T160-L175 HydrophobicContact CG2-CB 3.55Å; T160-K176 HydrophobicContact CG2-CG 4.07Å; T160-K176 WeakPolarHBondContact OG1-CG 3.43Å; T160-K176 PolarHBondContact OG1-NZ 3.23Å | ||
| 161 | N | 89.9 | Confident | 84 | Confident | 94 Ų | 94 | 79.1 Ų | 79.1 | 50% | 0.503 | 41% | 0.412 | S | S | . | . | trans | -108.6 | 3 | -166.7 | 63.7 | -11.2 | 0 | 0 | 0 | 115.1 | L159 L175 S177 | L159-N161 PolarHBondContact O-N 3.34Å; L159-N161 PolarHBondContact O-OD1 2.93Å; N161-L175 PolarHBondContact N-O 3.33Å; N161-S177 WeakPolarHBondContact OD1-CB 3.15Å | ||
| 162 | Q | 88.2 | Confident | 83.6 | Confident | 88 Ų | 88 | 76.2 Ų | 76.2 | 41% | 0.411 | 40% | 0.401 | S | S | . | . | trans | -71.4 | 141.7 | 179.6 | -63.6 | -66.3 | -42 | 0 | 0 | 110.7 | R95 L175 | R95-Q162 PolarHBondContact NH2-O 3.11Å; R95-Q162 VanDerWaalsContact NH2-O 3.08Å; Q162-L175 WeakPolarHBondContact CB-O 3.31Å; Q162-L175 PolarHBondContact N-O 3.49Å | ||
| 163 | S | 80.1 | Confident | 83.3 | Confident | 111 Ų | 111 | 79.1 Ų | 79.1 | 78% | 0.776 | 42% | 0.415 | S | S | * | . | trans | -84.2 | 148.4 | 173.4 | 57 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 164 | V | 71.6 | Confident | 83 | Confident | 54 Ų | 54 | 83.4 Ų | 83.4 | 33% | 0.327 | 44% | 0.435 | S | S | . | . | trans | -123.9 | 138.9 | 175.5 | -166.5 | 0 | 0 | 0 | 0 | 108.9 | I170 L175 | V164-I170 HydrophobicContact CB-CD1 3.78Å; V164-I170 HydrophobicContact CG1-CD1 3.44Å; V164-I170 VanDerWaalsContact CG1-CD1 3.44Å; V164-I170 HydrophobicContact CG1-CG1 3.73Å; V164-I170 HydrophobicContact CG1-CG2 4.47Å; V164-I170 HydrophobicContact CG2-CD1 4.1Å; V164-I170 HydrophobicContact CG2-CG2 4.14Å; V164-L175 HydrophobicContact CG2-CD2 3.25Å; V164-L175 HydrophobicContact CG2-CG 4.25Å | ||
| 165 | R | 63.8 | Low | 82.7 | Confident | 224 Ų | 224 | 80.4 Ų | 80.4 | 85% | 0.845 | 42% | 0.417 | S | S | * | . | trans | -70.6 | 153.3 | 165.8 | -69.6 | -177.6 | 171.4 | -172.1 | -3.5 | 108.3 | V167 | R165-V167 VanDerWaalsContact C-N 3.31Å; R165-V167 WeakPolarHBondContact O-CG2 3.46Å; R165-V167 PolarHBondContact O-N 2.87Å | ||
| 166 | E | 62.8 | Low | 82.5 | Confident | 166 Ų | 166 | 79.2 Ų | 79.2 | 78% | 0.776 | 41% | 0.408 | S | S | * | . | S | Bend | trans | -56.7 | 88.9 | -177.3 | -67.2 | -176.5 | 153.7 | 0 | 0 | 112 | W87 | W87-E166 HydrophobicContact CZ2-CG 4.47Š|
| 167 | V | 66.6 | Low | 82.5 | Confident | 81 Ų | 81 | 79.6 Ų | 79.6 | 49% | 0.491 | 41% | 0.411 | S | S | . | . | trans | -124.9 | 125.1 | 178.5 | -177.1 | 0 | 0 | 0 | 0 | 107.3 | R165 N169 I170 | R165-V167 VanDerWaalsContact C-N 3.31Å; R165-V167 WeakPolarHBondContact O-CG2 3.46Å; R165-V167 PolarHBondContact O-N 2.87Å; V167-N169 PolarHBondContact O-N 3.48Å; V167-I170 WeakPolarHBondContact O-CG1 3.49Å | ||
| 168 | T | 61.5 | Low | 82.5 | Confident | 133 Ų | 133 | 83.6 Ų | 83.6 | 82% | 0.816 | 43% | 0.429 | S | S | * | . | S | Bend | trans | -68.8 | 125.5 | 168.5 | 49.5 | 0 | 0 | 0 | 0 | 108.2 | ||
| 169 | N | 66.6 | Low | 82.5 | Confident | 134 Ų | 134 | 83.6 Ų | 83.6 | 72% | 0.717 | 43% | 0.429 | S | S | * | . | S | Bend | trans | 92.7 | 51.8 | 175.1 | -140.7 | -11.7 | 0 | 0 | 0 | 117 | V167 | V167-N169 PolarHBondContact O-N 3.48Š|
| 170 | I | 77.4 | Confident | 82.5 | Confident | 13 Ų | 13 | 82.1 Ų | 82.1 | 7% | 0.067 | 42% | 0.422 | C | S | . | . | trans | -78.1 | 132.5 | 176.8 | -56.7 | 164.2 | 0 | 0 | 0 | 110.6 | N90 V164 V167 L175 | N90-I170 PolarHBondContact OD1-O 3.37Å; V164-I170 HydrophobicContact CB-CD1 3.78Å; V164-I170 HydrophobicContact CG1-CD1 3.44Å; V164-I170 VanDerWaalsContact CG1-CD1 3.44Å; V164-I170 HydrophobicContact CG1-CG1 3.73Å; V164-I170 HydrophobicContact CG1-CG2 4.47Å; V164-I170 HydrophobicContact CG2-CD1 4.1Å; V164-I170 HydrophobicContact CG2-CG2 4.14Å; V167-I170 WeakPolarHBondContact O-CG1 3.49Å; I170-L175 HydrophobicContact CG2-CD1 4.08Å; I170-L175 HydrophobicContact CG2-CD2 4.29Å; I170-L175 HydrophobicContact CG2-CG 3.87Å | ||
| 171 | K | 84.8 | Confident | 82.6 | Confident | 133 Ų | 133 | 87.5 Ų | 87.5 | 58% | 0.578 | 44% | 0.442 | S | S | * | . | trans | -86.5 | 137.7 | 171.2 | -63.8 | 177.9 | -176.3 | 168.3 | 0 | 110.5 | I173 E174 | K171-I173 HydrophobicContact CB-CG2 4.2Å; K171-I173 PolarHBondContact O-N 3.4Å; K171-E174 HydrophobicContact CB-CG 4.18Å; K171-E174 PolarHBondContact N-OE2 3.41Å; K171-E174 VanDerWaalsContact N-OE2 3.15Å; K171-E174 WeakPolarHBondContact O-CB 3.35Å; K171-E174 PolarHBondContact O-N 2.92Å | ||
| 172 | C | 89.2 | Confident | 82.9 | Confident | 53 Ų | 53 | 89.1 Ų | 89.1 | 36% | 0.358 | 44% | 0.444 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.2 | -28 | 179.9 | -60.5 | 0 | 0 | 0 | 0 | 114.9 | C94 E174 L175 | C94-C172 WeakPolarHBondContact CA-SG 3.25Å; C94-C172 HydrophobicContact CB-CB 3.54Å; C94-C172 WeakPolarHBondContact CB-SG 3.42Å; C94-C172 WeakPolarHBondContact SG-CA 3.34Å; C94-C172 WeakPolarHBondContact SG-CB 3.16Å; C94-C172 CovalentContact SG-SG 2.03Å; C94-C172 PolarHBondContact SG-SG 3.33Å; C172-E174 VanDerWaalsContact C-N 3.3Å; C172-L175 PolarHBondContact O-N 3.46Å |
| 173 | I | 88.5 | Confident | 83.3 | Confident | 70 Ų | 70 | 88.9 Ų | 88.9 | 36% | 0.359 | 44% | 0.44 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.8 | -27.1 | 178.3 | -163.4 | 63.3 | 0 | 0 | 0 | 112.5 | K171 L175 K176 R181 | K171-I173 HydrophobicContact CB-CG2 4.2Å; K171-I173 PolarHBondContact O-N 3.4Å; I173-L175 VanDerWaalsContact C-N 3.31Å; I173-K176 HydrophobicContact CD1-CD 4.21Å; I173-K176 PolarHBondContact O-N 3.35Å; I173-R181 HydrophobicContact CD1-CB 4.37Å; I173-R181 HydrophobicContact CD1-CG 3.93Å; I173-R181 HydrophobicContact CG1-CG 4.27Å; I173-R181 PolarHBondContact O-NE 3.41Å |
| 174 | E | 87.9 | Confident | 83.9 | Confident | 95 Ų | 95 | 86.6 Ų | 86.6 | 44% | 0.444 | 42% | 0.417 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.8 | -29.5 | 178.7 | -66.1 | 163 | -179.7 | 0 | 0 | 110.9 | K171 C172 K176 | K171-E174 HydrophobicContact CB-CG 4.18Å; K171-E174 PolarHBondContact N-OE2 3.41Å; K171-E174 VanDerWaalsContact N-OE2 3.15Å; K171-E174 WeakPolarHBondContact O-CB 3.35Å; K171-E174 PolarHBondContact O-N 2.92Å; C172-E174 VanDerWaalsContact C-N 3.3Å; E174-K176 PolarHBondContact O-N 2.97Å |
| 175 | L | 90.3 | Very high | 84.9 | Confident | 1 Ų | 1 | 87.5 Ų | 87.5 | 1% | 0.005 | 42% | 0.422 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -10.3 | 174.6 | -69.9 | 167.2 | 0 | 0 | 0 | 114 | V91 C94 T160 N161 Q162 V164 I170 C172 I173 | V91-L175 HydrophobicContact CG2-CD1 4.39Å; V91-L175 HydrophobicContact CG2-CD2 4.42Å; C94-L175 HydrophobicContact CB-CD1 3.59Å; T160-L175 CarbonylContact C-O 3.6Å; T160-L175 WeakPolarHBondContact CA-O 3.49Å; T160-L175 HydrophobicContact CG2-CB 3.55Å; N161-L175 PolarHBondContact N-O 3.33Å; Q162-L175 WeakPolarHBondContact CB-O 3.31Å; Q162-L175 PolarHBondContact N-O 3.49Å; V164-L175 HydrophobicContact CG2-CD2 3.25Å; V164-L175 HydrophobicContact CG2-CG 4.25Å; I170-L175 HydrophobicContact CG2-CD1 4.08Å; I170-L175 HydrophobicContact CG2-CD2 4.29Å; I170-L175 HydrophobicContact CG2-CG 3.87Å; C172-L175 PolarHBondContact O-N 3.46Å; I173-L175 VanDerWaalsContact C-N 3.31Å |
| 176 | K | 92.8 | Very high | 86.4 | Confident | 8 Ų | 8 | 78.9 Ų | 78.9 | 4% | 0.035 | 40% | 0.399 | C | S | . | . | S | Bend | trans | -92.5 | 135.1 | -179.2 | -68.8 | -178.5 | -177.7 | -69.9 | 0 | 111.5 | N156 T160 I173 E174 R181 H184 | N156-K176 PolarHBondContact O-NZ 2.87Å; N156-K176 PolarHBondContact OD1-NZ 3.32Å; T160-K176 HydrophobicContact CG2-CG 4.07Å; T160-K176 WeakPolarHBondContact OG1-CG 3.43Å; T160-K176 PolarHBondContact OG1-NZ 3.23Å; I173-K176 HydrophobicContact CD1-CD 4.21Å; I173-K176 PolarHBondContact O-N 3.35Å; E174-K176 PolarHBondContact O-N 2.97Å; K176-R181 HydrophobicContact CB-CG 3.89Å; K176-R181 PolarHBondContact O-NE 3.35Å; K176-H184 HydrophobicContact CD-CB 3.85Å |
| 177 | S | 93.8 | Very high | 88 | Confident | 16 Ų | 16 | 71.1 Ų | 71.1 | 11% | 0.112 | 36% | 0.363 | C | S | . | . | trans | -57.7 | 165.3 | 166 | 58.1 | 0 | 0 | 0 | 0 | 111.4 | L159 N161 L179 G180 R181 | L159-S177 PolarHBondContact O-N 3.01Å; L159-S177 PolarHBondContact O-OG 3.05Å; L159-S177 VanDerWaalsContact O-OG 3.1Å; N161-S177 WeakPolarHBondContact OD1-CB 3.15Å; S177-L179 VanDerWaalsContact C-N 3.31Å; S177-L179 PolarHBondContact O-N 3.24Å; S177-G180 CarbonylContact O-C 3.57Å; S177-G180 WeakPolarHBondContact O-CA 3.11Å; S177-G180 PolarHBondContact O-N 2.81Å; S177-G180 PolarHBondContact OG-N 2.89Å; S177-G180 VanDerWaalsContact OG-N 3.09Å; S177-R181 WeakPolarHBondContact O-CG 3.33Å; S177-R181 PolarHBondContact O-N 3.38Å | ||
| 178 | E | 93.9 | Very high | 89.3 | Confident | 136 Ų | 136 | 68.8 Ų | 68.8 | 64% | 0.636 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -56 | -46.6 | 177.5 | -166 | -163.8 | 149.1 | 0 | 0 | 111.8 | G180 R181 K182 | E178-G180 VanDerWaalsContact C-N 3.29Å; E178-G180 PolarHBondContact O-N 3.2Å; E178-R181 PolarHBondContact O-N 3.38Å; E178-K182 PolarHBondContact O-N 3.49Å; E178-K182 VanDerWaalsContact O-N 3.12Å; E178-K182 VanDerWaalsContact OE1-CE 3.3Å; E178-K182 WeakPolarHBondContact OE1-CE 3.37Å; E178-K182 IonicContact OE1-NZ 2.75Å; E178-K182 PolarHBondContact OE1-NZ 3.2Å |
| 179 | L | 95.5 | Very high | 90.8 | Very high | 112 Ų | 112 | 70.2 Ų | 70.2 | 59% | 0.586 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -61.4 | -40 | 173.7 | -173.2 | 65.2 | 0 | 0 | 0 | 111.2 | L159 S177 R181 K182 W183 | L159-L179 HydrophobicContact CD1-CD2 4.36Å; L159-L179 HydrophobicContact CD1-CG 4.15Å; L159-L179 HydrophobicContact CD2-CD2 4.09Å; L159-L179 HydrophobicContact CD2-CG 4.47Å; S177-L179 VanDerWaalsContact C-N 3.31Å; S177-L179 PolarHBondContact O-N 3.24Å; L179-R181 VanDerWaalsContact C-N 3.34Å; L179-R181 PolarHBondContact O-N 3.38Å; L179-K182 PolarHBondContact O-N 3.43Å; L179-W183 WeakPolarHBondContact O-CB 3.07Å; L179-W183 PolarHBondContact O-N 3.2Å |
| 180 | G | 95.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 67.6 Ų | 67.6 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -60.6 | -38 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | L159 S177 E178 H184 | L159-G180 VanDerWaalsContact CB-CA 3.42Å; S177-G180 CarbonylContact O-C 3.57Å; S177-G180 WeakPolarHBondContact O-CA 3.11Å; S177-G180 PolarHBondContact O-N 2.81Å; S177-G180 PolarHBondContact OG-N 2.89Å; S177-G180 VanDerWaalsContact OG-N 3.09Å; E178-G180 VanDerWaalsContact C-N 3.29Å; E178-G180 PolarHBondContact O-N 3.2Å; G180-H184 WeakPolarHBondContact O-CB 3.09Å; G180-H184 PolarHBondContact O-N 3.03Å |
| 181 | R | 94.4 | Very high | 93.1 | Very high | 116 Ų | 116 | 67.6 Ų | 67.6 | 44% | 0.438 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -68 | -45.6 | 175.6 | -65.4 | 177 | -167.9 | -176 | 2.6 | 110.9 | I173 K176 S177 E178 L179 H184 T185 | I173-R181 HydrophobicContact CD1-CB 4.37Å; I173-R181 HydrophobicContact CD1-CG 3.93Å; I173-R181 HydrophobicContact CG1-CG 4.27Å; I173-R181 PolarHBondContact O-NE 3.41Å; K176-R181 HydrophobicContact CB-CG 3.89Å; K176-R181 PolarHBondContact O-NE 3.35Å; S177-R181 WeakPolarHBondContact O-CG 3.33Å; S177-R181 PolarHBondContact O-N 3.38Å; E178-R181 PolarHBondContact O-N 3.38Å; L179-R181 VanDerWaalsContact C-N 3.34Å; L179-R181 PolarHBondContact O-N 3.38Å; R181-H184 PolarHBondContact O-N 3.48Å; R181-T185 PolarHBondContact O-N 3.01Å; R181-T185 PolarHBondContact O-OG1 3.49Å; R181-T185 VanDerWaalsContact O-OG1 3.12Å |
| 182 | K | 95.5 | Very high | 93.6 | Very high | 127 Ų | 127 | 62.6 Ų | 62.6 | 55% | 0.552 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -60.6 | -47.5 | 175.8 | -67.8 | 177.9 | -172.6 | 168.2 | 0 | 111.3 | E178 L179 T185 A186 | E178-K182 PolarHBondContact O-N 3.49Å; E178-K182 VanDerWaalsContact O-N 3.12Å; E178-K182 VanDerWaalsContact OE1-CE 3.3Å; E178-K182 WeakPolarHBondContact OE1-CE 3.37Å; E178-K182 IonicContact OE1-NZ 2.75Å; E178-K182 PolarHBondContact OE1-NZ 3.2Å; L179-K182 PolarHBondContact O-N 3.43Å; K182-T185 PolarHBondContact O-N 2.99Å; K182-A186 PolarHBondContact O-N 3.02Å |
| 183 | W | 96.2 | Very high | 93.9 | Very high | 84 Ų | 84 | 61.5 Ų | 61.5 | 32% | 0.318 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63 | -42.2 | 175.9 | -177.2 | -97.3 | 0 | 0 | 0 | 112.4 | L152 P155 N156 L159 L179 T185 A186 S187 | L152-W183 HydrophobicContact CD2-CZ2 4.39Å; L152-W183 PolarHBondContact O-NE1 3.14Å; P155-W183 HydrophobicContact CB-CD2 4.26Å; P155-W183 HydrophobicContact CB-CG 4.29Å; P155-W183 HydrophobicContact CB-CZ2 4.28Å; P155-W183 HydrophobicContact CG-CZ2 3.86Å; N156-W183 PolarHBondContact ND2-NE1 3.16Å; L159-W183 HydrophobicContact CD1-CB 4.01Å; L159-W183 HydrophobicContact CD1-CG 4.33Å; L179-W183 WeakPolarHBondContact O-CB 3.07Å; L179-W183 PolarHBondContact O-N 3.2Å; W183-T185 VanDerWaalsContact C-N 3.33Å; W183-T185 PolarHBondContact O-N 2.96Å; W183-A186 PolarHBondContact O-N 3.35Å; W183-S187 VanDerWaalsContact O-CB 3.31Å; W183-S187 WeakPolarHBondContact O-CB 3.4Å; W183-S187 PolarHBondContact O-N 3.08Å; W183-S187 PolarHBondContact O-OG 3.24Å |
| 184 | H | 94.1 | Very high | 94.4 | Very high | 63 Ų | 63 | 59.4 Ų | 59.4 | 29% | 0.292 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -59.1 | -45.9 | 176.9 | -177.6 | 72.2 | 0 | 0 | 0 | 111.3 | N156 K176 G180 R181 S187 N188 | N156-H184 WeakPolarHBondContact OD1-CA 3.33Å; N156-H184 PolarHBondContact OD1-ND1 3.46Å; N156-H184 VanDerWaalsContact OD1-ND1 3.08Å; K176-H184 HydrophobicContact CD-CB 3.85Å; G180-H184 WeakPolarHBondContact O-CB 3.09Å; G180-H184 PolarHBondContact O-N 3.03Å; R181-H184 PolarHBondContact O-N 3.48Å; H184-S187 WeakPolarHBondContact CA-OG 3.41Å; H184-S187 PolarHBondContact O-OG 3.43Å; H184-S187 VanDerWaalsContact O-OG 3.05Å; H184-N188 WeakPolarHBondContact O-CB 3.31Å; H184-N188 PolarHBondContact O-N 3.35Å |
| 185 | T | 92.7 | Very high | 94.9 | Very high | 72 Ų | 72 | 54.9 Ų | 54.9 | 44% | 0.442 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.9 | -49.1 | 174.9 | -61 | 0 | 0 | 0 | 0 | 111.6 | R181 K182 W183 N188 Y189 | R181-T185 PolarHBondContact O-N 3.01Å; R181-T185 PolarHBondContact O-OG1 3.49Å; R181-T185 VanDerWaalsContact O-OG1 3.12Å; K182-T185 PolarHBondContact O-N 2.99Å; W183-T185 VanDerWaalsContact C-N 3.33Å; W183-T185 PolarHBondContact O-N 2.96Å; T185-N188 WeakPolarHBondContact O-CB 3.36Å; T185-N188 PolarHBondContact O-N 3.38Å; T185-Y189 HydrophobicContact CG2-CD2 3.87Å; T185-Y189 HydrophobicContact CG2-CE2 3.56Å; T185-Y189 WeakPolarHBondContact O-CD2 3.45Å; T185-Y189 PolarHBondContact O-N 3.02Å |
| 186 | A | 95.3 | Very high | 95.2 | Very high | 44 Ų | 44 | 58.6 Ų | 58.6 | 36% | 0.364 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.1 | -51 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | K182 W183 N188 Y189 I190 | K182-A186 PolarHBondContact O-N 3.02Å; W183-A186 PolarHBondContact O-N 3.35Å; A186-N188 VanDerWaalsContact C-N 3.3Å; A186-N188 PolarHBondContact O-N 3.46Å; A186-Y189 PolarHBondContact O-N 3.45Å; A186-I190 WeakPolarHBondContact O-CG1 3.34Å; A186-I190 PolarHBondContact O-N 3.33Å |
| 187 | S | 95.6 | Very high | 95.4 | Very high | 2 Ų | 2 | 63.3 Ų | 63.3 | 1% | 0.014 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.6 | -37.8 | 177.3 | 56.1 | 0 | 0 | 0 | 0 | 112.3 | N156 W183 H184 I190 F191 | N156-S187 PolarHBondContact ND2-OG 2.95Å; W183-S187 VanDerWaalsContact O-CB 3.31Å; W183-S187 WeakPolarHBondContact O-CB 3.4Å; W183-S187 PolarHBondContact O-N 3.08Å; W183-S187 PolarHBondContact O-OG 3.24Å; H184-S187 WeakPolarHBondContact CA-OG 3.41Å; H184-S187 PolarHBondContact O-OG 3.43Å; H184-S187 VanDerWaalsContact O-OG 3.05Å; S187-I190 PolarHBondContact O-N 3.5Å; S187-F191 WeakPolarHBondContact O-CB 3.48Å; S187-F191 WeakPolarHBondContact O-CD2 3.21Å; S187-F191 WeakPolarHBondContact O-CG 3.3Å; S187-F191 PolarHBondContact O-N 3.29Å |
| 188 | N | 93.1 | Very high | 95.6 | Very high | 33 Ų | 33 | 63.1 Ų | 63.1 | 18% | 0.176 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.2 | -46.4 | 174.3 | -176.5 | -37.1 | 0 | 0 | 0 | 111.8 | H184 T185 A186 F191 V192 R253 | H184-N188 WeakPolarHBondContact O-CB 3.31Å; H184-N188 PolarHBondContact O-N 3.35Å; T185-N188 WeakPolarHBondContact O-CB 3.36Å; T185-N188 PolarHBondContact O-N 3.38Å; A186-N188 VanDerWaalsContact C-N 3.3Å; A186-N188 PolarHBondContact O-N 3.46Å; N188-F191 PolarHBondContact O-N 3.42Å; N188-V192 WeakPolarHBondContact O-CG2 3.18Å; N188-V192 PolarHBondContact O-N 3.28Å; N188-R253 PolarHBondContact ND2-NH2 2.88Å; N188-R253 VanDerWaalsContact OD1-CZ 3.3Å; N188-R253 PolarHBondContact OD1-NH2 2.89Å |
| 189 | Y | 94.3 | Very high | 95.7 | Very high | 163 Ų | 163 | 57.9 Ų | 57.9 | 64% | 0.639 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -62.3 | -41.8 | 173.6 | -78.8 | -64.3 | 0 | 0 | 0 | 112.7 | T185 A186 F191 V192 G193 | T185-Y189 HydrophobicContact CG2-CD2 3.87Å; T185-Y189 HydrophobicContact CG2-CE2 3.56Å; T185-Y189 WeakPolarHBondContact O-CD2 3.45Å; T185-Y189 PolarHBondContact O-N 3.02Å; A186-Y189 PolarHBondContact O-N 3.45Å; Y189-F191 PolarHBondContact O-N 3.24Å; Y189-V192 PolarHBondContact O-N 2.62Å; Y189-G193 PolarHBondContact O-N 2.81Å |
| 190 | I | 96.8 | Very high | 95.8 | Very high | 79 Ų | 79 | 57.6 Ų | 57.6 | 41% | 0.405 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59 | -48.4 | 175.7 | -69 | 166.1 | 0 | 0 | 0 | 110.2 | L152 A186 S187 V192 G193 I194 | L152-I190 HydrophobicContact CD1-CG2 3.83Å; L152-I190 HydrophobicContact CD2-CD1 4Å; L152-I190 HydrophobicContact CD2-CG2 4.14Å; A186-I190 WeakPolarHBondContact O-CG1 3.34Å; A186-I190 PolarHBondContact O-N 3.33Å; S187-I190 PolarHBondContact O-N 3.5Å; I190-V192 PolarHBondContact O-N 3.5Å; I190-G193 CarbonylContact O-C 3.01Å; I190-G193 WeakPolarHBondContact O-CA 3.48Å; I190-G193 PolarHBondContact O-N 2.86Å; I190-G193 VanDerWaalsContact O-N 3.16Å; I190-I194 HydrophobicContact CG2-CD1 3.94Å; I190-I194 HydrophobicContact CG2-CG1 4.43Å; I190-I194 WeakPolarHBondContact O-CG1 3.03Å; I190-I194 PolarHBondContact O-N 3.16Å |
| 191 | F | 96.1 | Very high | 95.8 | Very high | 13 Ų | 13 | 61.2 Ų | 61.2 | 6% | 0.057 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.5 | -45.3 | 178.2 | -85.2 | -50.3 | 0 | 0 | 0 | 112.8 | V103 Y106 M149 L152 S187 N188 Y189 G193 I194 F195 | V103-F191 HydrophobicContact CG2-CZ 4.18Å; Y106-F191 HydrophobicContact CD1-CB 4.33Å; Y106-F191 AromaticContact CD1-CD1 3.83Å; Y106-F191 HydrophobicContact CD1-CD1 3.83Å; Y106-F191 HydrophobicContact CD1-CG 4.48Å; Y106-F191 HydrophobicContact CD2-CB 3.96Å; Y106-F191 AromaticContact CD2-CD1 3.15Å; Y106-F191 HydrophobicContact CD2-CD1 3.15Å; Y106-F191 HydrophobicContact CD2-CD2 4.35Å; Y106-F191 AromaticContact CD2-CE1 3.64Å; Y106-F191 HydrophobicContact CD2-CE1 3.64Å; Y106-F191 AromaticContact CD2-CG 3.58Å; Y106-F191 HydrophobicContact CD2-CG 3.58Å; Y106-F191 HydrophobicContact CD2-CZ 4.42Å; Y106-F191 HydrophobicContact CE1-CB 3.91Å; Y106-F191 HydrophobicContact CE1-CD1 4.27Å; Y106-F191 HydrophobicContact CE1-CG 4.48Å; Y106-F191 WeakPolarHBondContact CE1-O 3.25Å; Y106-F191 HydrophobicContact CE2-CB 3.51Å; Y106-F191 AromaticContact CE2-CD1 3.68Å; Y106-F191 HydrophobicContact CE2-CD1 3.68Å; Y106-F191 HydrophobicContact CE2-CD2 4.33Å; Y106-F191 HydrophobicContact CE2-CE1 4.47Å; Y106-F191 AromaticContact CE2-CG 3.6Å; Y106-F191 HydrophobicContact CE2-CG 3.6Å; Y106-F191 HydrophobicContact CG-CB 4.38Å; Y106-F191 AromaticContact CG-CD1 3.28Å; Y106-F191 HydrophobicContact CG-CD1 3.28Å; Y106-F191 AromaticContact CG-CE1 3.79Å; Y106-F191 HydrophobicContact CG-CE1 3.79Å; Y106-F191 HydrophobicContact CG-CG 4.08Å; Y106-F191 VanDerWaalsContact CZ-CB 3.5Å; M149-F191 HydrophobicContact SD-CE1 3.72Å; L152-F191 HydrophobicContact CB-CE1 4.46Å; L152-F191 HydrophobicContact CB-CE2 4.07Å; L152-F191 HydrophobicContact CB-CZ 3.72Å; L152-F191 HydrophobicContact CD1-CD1 4.42Å; L152-F191 HydrophobicContact CD1-CE1 3.96Å; L152-F191 HydrophobicContact CD1-CZ 4.03Å; S187-F191 WeakPolarHBondContact O-CB 3.48Å; S187-F191 WeakPolarHBondContact O-CD2 3.21Å; S187-F191 WeakPolarHBondContact O-CG 3.3Å; S187-F191 PolarHBondContact O-N 3.29Å; N188-F191 PolarHBondContact O-N 3.42Å; Y189-F191 PolarHBondContact O-N 3.24Å; F191-G193 VanDerWaalsContact C-N 3.31Å; F191-G193 PolarHBondContact O-N 3.26Å; F191-I194 HydrophobicContact CD1-CD1 4.38Å; F191-I194 PolarHBondContact O-N 3.1Å; F191-F195 PolarHBondContact O-N 3.42Å |
| 192 | V | 94.3 | Very high | 95.8 | Very high | 28 Ų | 28 | 55.9 Ų | 55.9 | 17% | 0.17 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.7 | -42.6 | 173.6 | 171.1 | 0 | 0 | 0 | 0 | 110.8 | N188 Y189 I190 F195 W196 | N188-V192 WeakPolarHBondContact O-CG2 3.18Å; N188-V192 PolarHBondContact O-N 3.28Å; Y189-V192 PolarHBondContact O-N 2.62Å; I190-V192 PolarHBondContact O-N 3.5Å; V192-F195 PolarHBondContact O-N 3.08Å; V192-W196 PolarHBondContact O-N 2.89Å; V192-W196 VanDerWaalsContact O-N 3.1Å |
| 193 | G | 96.6 | Very high | 95.8 | Very high | 29 Ų | 29 | 53.1 Ų | 53.1 | 30% | 0.299 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.7 | -45.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y189 I190 F191 F195 W196 I197 | Y189-G193 PolarHBondContact O-N 2.81Å; I190-G193 CarbonylContact O-C 3.01Å; I190-G193 WeakPolarHBondContact O-CA 3.48Å; I190-G193 PolarHBondContact O-N 2.86Å; I190-G193 VanDerWaalsContact O-N 3.16Å; F191-G193 VanDerWaalsContact C-N 3.31Å; F191-G193 PolarHBondContact O-N 3.26Å; G193-F195 VanDerWaalsContact C-N 3.31Å; G193-F195 PolarHBondContact O-N 3.33Å; G193-W196 PolarHBondContact O-N 3.09Å; G193-I197 WeakPolarHBondContact O-CB 3.49Å; G193-I197 VanDerWaalsContact O-CG1 3.27Å; G193-I197 WeakPolarHBondContact O-CG1 3.31Å; G193-I197 PolarHBondContact O-N 3.04Å |
| 194 | I | 97.8 | Very high | 95.7 | Very high | 27 Ų | 27 | 53.2 Ų | 53.2 | 14% | 0.138 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -55.6 | -47.3 | 175.1 | -71 | 166.9 | 0 | 0 | 0 | 110.2 | V110 M149 L152 I190 F191 W196 I197 V198 | V110-I194 HydrophobicContact CG2-CG2 3.58Å; M149-I194 HydrophobicContact CE-CD1 4.22Å; L152-I194 HydrophobicContact CD1-CD1 4.25Å; I190-I194 HydrophobicContact CG2-CD1 3.94Å; I190-I194 HydrophobicContact CG2-CG1 4.43Å; I190-I194 WeakPolarHBondContact O-CG1 3.03Å; I190-I194 PolarHBondContact O-N 3.16Å; F191-I194 HydrophobicContact CD1-CD1 4.38Å; F191-I194 PolarHBondContact O-N 3.1Å; I194-W196 PolarHBondContact O-N 3.43Å; I194-I197 PolarHBondContact O-N 2.91Å; I194-V198 HydrophobicContact CG2-CG2 4.4Å; I194-V198 WeakPolarHBondContact O-CB 3.5Å; I194-V198 VanDerWaalsContact O-CG2 3.3Å; I194-V198 WeakPolarHBondContact O-CG2 3.06Å; I194-V198 PolarHBondContact O-N 3.02Å |
| 195 | F | 97.8 | Very high | 95.7 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -58.7 | -49.8 | 177.9 | 167.2 | -94.4 | 0 | 0 | 0 | 112.2 | Y106 I109 F191 V192 G193 I197 V198 F199 F242 F246 V247 H250 | Y106-F195 HydrophobicContact CE1-CB 4.1Å; I109-F195 HydrophobicContact CD1-CD2 4.12Å; I109-F195 HydrophobicContact CG2-CD2 4.43Å; F191-F195 PolarHBondContact O-N 3.42Å; V192-F195 PolarHBondContact O-N 3.08Å; G193-F195 VanDerWaalsContact C-N 3.31Å; G193-F195 PolarHBondContact O-N 3.33Å; F195-I197 VanDerWaalsContact C-N 3.35Å; F195-I197 PolarHBondContact O-N 3.41Å; F195-V198 PolarHBondContact O-N 3.44Å; F195-F199 HydrophobicContact CE1-CB 4.4Å; F195-F199 HydrophobicContact CZ-CB 4.33Å; F195-F199 HydrophobicContact CZ-CG 4.48Å; F195-F199 VanDerWaalsContact O-CB 3.27Å; F195-F199 WeakPolarHBondContact O-CB 3.19Å; F195-F199 PolarHBondContact O-N 2.84Å; F195-F242 HydrophobicContact CD2-CZ 4.1Å; F195-F242 AromaticContact CE2-CE1 3.87Å; F195-F242 HydrophobicContact CE2-CE1 3.87Å; F195-F242 AromaticContact CE2-CZ 3.75Å; F195-F242 HydrophobicContact CE2-CZ 3.75Å; F195-F242 HydrophobicContact CZ-CE1 4.46Å; F195-F246 HydrophobicContact CD2-CB 4.41Å; F195-F246 HydrophobicContact CE2-CB 3.81Å; F195-V247 HydrophobicContact CE2-CG2 4.47Å; F195-V247 HydrophobicContact CZ-CB 4.4Å; F195-V247 HydrophobicContact CZ-CG2 3.99Å; F195-H250 HydrophobicContact CD1-CB 3.51Å; F195-H250 AromaticContact CD1-CD2 3.47Å; F195-H250 VanDerWaalsContact CD1-CD2 3.47Å; F195-H250 WeakPolarHBondContact CD1-CD2 3.45Å; F195-H250 AromaticContact CD1-CG 3.4Å; F195-H250 VanDerWaalsContact CD1-CG 3.4Å; F195-H250 HydrophobicContact CD2-CB 4.39Å; F195-H250 AromaticContact CD2-CD2 3.78Å; F195-H250 AromaticContact CD2-CE1 3.47Å; F195-H250 VanDerWaalsContact CD2-CE1 3.47Å; F195-H250 WeakPolarHBondContact CD2-CE1 3.09Å; F195-H250 AromaticContact CD2-CG 3.62Å; F195-H250 AromaticContact CD2-ND1 3.42Å; F195-H250 WeakPolarHBondContact CD2-ND1 3.13Å; F195-H250 AromaticContact CD2-NE2 3.72Å; F195-H250 HydrophobicContact CE1-CB 3.29Å; F195-H250 AromaticContact CE1-CG 3.6Å; F195-H250 HydrophobicContact CE2-CB 4.2Å; F195-H250 AromaticContact CE2-CE1 3.99Å; F195-H250 AromaticContact CE2-CG 3.79Å; F195-H250 AromaticContact CE2-ND1 3.5Å; F195-H250 HydrophobicContact CG-CB 4.08Å; F195-H250 AromaticContact CG-CD2 3.26Å; F195-H250 WeakPolarHBondContact CG-CD2 3.47Å; F195-H250 AromaticContact CG-CE1 3.77Å; F195-H250 AromaticContact CG-CG 3.42Å; F195-H250 VanDerWaalsContact CG-CG 3.42Å; F195-H250 AromaticContact CG-ND1 3.73Å; F195-H250 AromaticContact CG-NE2 3.52Å; F195-H250 HydrophobicContact CZ-CB 3.67Å; F195-H250 AromaticContact CZ-CG 3.79Å; F195-H250 AromaticContact CZ-ND1 3.9Å |
| 196 | W | 96.7 | Very high | 95.6 | Very high | 79 Ų | 79 | 48.7 Ų | 48.7 | 30% | 0.299 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -66.1 | -37.6 | -178 | -71 | 113.9 | 0 | 0 | 0 | 112.4 | V192 G193 I194 F199 L200 I251 I254 | V192-W196 PolarHBondContact O-N 2.89Å; V192-W196 VanDerWaalsContact O-N 3.1Å; G193-W196 PolarHBondContact O-N 3.09Å; I194-W196 PolarHBondContact O-N 3.43Å; W196-F199 AromaticContact CE3-CD1 3.83Å; W196-F199 HydrophobicContact CE3-CD1 3.83Å; W196-F199 HydrophobicContact CE3-CE1 4.43Å; W196-F199 AromaticContact CZ3-CD1 3.87Å; W196-F199 HydrophobicContact CZ3-CD1 3.87Å; W196-F199 HydrophobicContact CZ3-CE1 4.03Å; W196-F199 PolarHBondContact O-N 3.32Å; W196-L200 WeakPolarHBondContact O-CB 3.34Å; W196-L200 VanDerWaalsContact O-CG 3.23Å; W196-L200 WeakPolarHBondContact O-CG 3.4Å; W196-L200 PolarHBondContact O-N 3.29Å; W196-I251 HydrophobicContact CH2-CG1 4.16Å; W196-I254 HydrophobicContact CZ2-CD1 3.83Å |
| 197 | I | 97.8 | Very high | 95.4 | Very high | 106 Ų | 106 | 49.5 Ų | 49.5 | 54% | 0.544 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60.8 | -50.7 | 173.5 | -69.6 | 166.2 | 0 | 0 | 0 | 110.1 | G193 I194 F195 F199 L200 L201 | G193-I197 WeakPolarHBondContact O-CB 3.49Å; G193-I197 VanDerWaalsContact O-CG1 3.27Å; G193-I197 WeakPolarHBondContact O-CG1 3.31Å; G193-I197 PolarHBondContact O-N 3.04Å; I194-I197 PolarHBondContact O-N 2.91Å; F195-I197 VanDerWaalsContact C-N 3.35Å; F195-I197 PolarHBondContact O-N 3.41Å; I197-F199 VanDerWaalsContact C-N 3.34Å; I197-F199 PolarHBondContact O-N 2.83Å; I197-L200 PolarHBondContact O-N 2.72Å; I197-L201 HydrophobicContact CG2-CD1 4.01Å; I197-L201 WeakPolarHBondContact O-CB 3.35Å; I197-L201 VanDerWaalsContact O-CG 3.28Å; I197-L201 WeakPolarHBondContact O-CG 3.27Å; I197-L201 PolarHBondContact O-N 2.97Å |
| 198 | V | 97.7 | Very high | 95.2 | Very high | 13 Ų | 13 | 50.7 Ų | 50.7 | 8% | 0.079 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 178.1 | 169.9 | 0 | 0 | 0 | 0 | 110.9 | I109 V110 I194 F195 L200 L201 L202 F242 | I109-V198 HydrophobicContact CG2-CB 4.07Å; I109-V198 HydrophobicContact CG2-CG1 3.93Å; I109-V198 HydrophobicContact CG2-CG2 4.23Å; I109-V198 WeakPolarHBondContact O-CG1 3.42Å; V110-V198 HydrophobicContact CG2-CG2 4.44Å; I194-V198 HydrophobicContact CG2-CG2 4.4Å; I194-V198 WeakPolarHBondContact O-CB 3.5Å; I194-V198 VanDerWaalsContact O-CG2 3.3Å; I194-V198 WeakPolarHBondContact O-CG2 3.06Å; I194-V198 PolarHBondContact O-N 3.02Å; F195-V198 PolarHBondContact O-N 3.44Å; V198-L200 PolarHBondContact O-N 2.8Å; V198-L201 PolarHBondContact O-N 3.32Å; V198-L202 HydrophobicContact CG1-CD1 3.83Å; V198-L202 HydrophobicContact CG1-CG 4.24Å; V198-L202 WeakPolarHBondContact O-CB 3.19Å; V198-L202 WeakPolarHBondContact O-CG 3.46Å; V198-L202 PolarHBondContact O-N 3.34Å; V198-F242 HydrophobicContact CG1-CE2 3.95Å; V198-F242 HydrophobicContact CG1-CZ 4.08Å |
| 199 | F | 97.4 | Very high | 95 | Very high | 26 Ų | 26 | 49.1 Ų | 49.1 | 11% | 0.114 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -59.9 | -46.6 | 178.6 | 177.7 | -113.8 | 0 | 0 | 0 | 112.7 | F195 W196 I197 L202 I203 F242 F243 V247 | F195-F199 HydrophobicContact CE1-CB 4.4Å; F195-F199 HydrophobicContact CZ-CB 4.33Å; F195-F199 HydrophobicContact CZ-CG 4.48Å; F195-F199 VanDerWaalsContact O-CB 3.27Å; F195-F199 WeakPolarHBondContact O-CB 3.19Å; F195-F199 PolarHBondContact O-N 2.84Å; W196-F199 AromaticContact CE3-CD1 3.83Å; W196-F199 HydrophobicContact CE3-CD1 3.83Å; W196-F199 HydrophobicContact CE3-CE1 4.43Å; W196-F199 AromaticContact CZ3-CD1 3.87Å; W196-F199 HydrophobicContact CZ3-CD1 3.87Å; W196-F199 HydrophobicContact CZ3-CE1 4.03Å; W196-F199 PolarHBondContact O-N 3.32Å; I197-F199 VanDerWaalsContact C-N 3.34Å; I197-F199 PolarHBondContact O-N 2.83Å; F199-L202 WeakPolarHBondContact O-CB 3.41Å; F199-L202 PolarHBondContact O-N 3.49Å; F199-I203 HydrophobicContact CD1-CD1 4.05Å; F199-I203 HydrophobicContact CE1-CD1 3.55Å; F199-I203 HydrophobicContact CE2-CD1 4.13Å; F199-I203 HydrophobicContact CZ-CD1 3.62Å; F199-I203 HydrophobicContact CZ-CG1 4.44Å; F199-I203 WeakPolarHBondContact O-CG1 3.44Å; F199-I203 PolarHBondContact O-N 3.45Å; F199-F242 HydrophobicContact CB-CE1 4.33Å; F199-F242 HydrophobicContact CD2-CD1 4.47Å; F199-F242 AromaticContact CD2-CE1 3.81Å; F199-F242 HydrophobicContact CD2-CE1 3.81Å; F199-F243 HydrophobicContact CD2-CZ 4.28Å; F199-F243 HydrophobicContact CE2-CD1 4.11Å; F199-F243 AromaticContact CE2-CE1 3.44Å; F199-F243 HydrophobicContact CE2-CE1 3.44Å; F199-F243 VanDerWaalsContact CE2-CE1 3.44Å; F199-F243 HydrophobicContact CE2-CE2 4.04Å; F199-F243 AromaticContact CE2-CZ 3.41Å; F199-F243 HydrophobicContact CE2-CZ 3.41Å; F199-F243 VanDerWaalsContact CE2-CZ 3.41Å; F199-F243 AromaticContact CZ-CE1 3.87Å; F199-F243 HydrophobicContact CZ-CE1 3.87Å; F199-F243 HydrophobicContact CZ-CZ 4.05Å; F199-V247 HydrophobicContact CD2-CG2 3.88Å; F199-V247 HydrophobicContact CE2-CG1 4.48Å; F199-V247 HydrophobicContact CE2-CG2 3.57Å; F199-V247 HydrophobicContact CZ-CG2 4.41Å |
| 200 | L | 96.9 | Very high | 94.6 | Very high | 105 Ų | 105 | 45.5 Ų | 45.5 | 55% | 0.55 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -64.1 | -43.2 | 177.1 | -70.4 | 171.7 | 0 | 0 | 0 | 111.5 | W196 I197 V198 L202 I203 V204 | W196-L200 WeakPolarHBondContact O-CB 3.34Å; W196-L200 VanDerWaalsContact O-CG 3.23Å; W196-L200 WeakPolarHBondContact O-CG 3.4Å; W196-L200 PolarHBondContact O-N 3.29Å; I197-L200 PolarHBondContact O-N 2.72Å; V198-L200 PolarHBondContact O-N 2.8Å; L200-L202 VanDerWaalsContact C-N 3.32Å; L200-L202 PolarHBondContact O-N 3.5Å; L200-I203 PolarHBondContact O-N 2.83Å; L200-V204 WeakPolarHBondContact O-CG2 3.44Å; L200-V204 PolarHBondContact O-N 3.05Å |
| 201 | L | 95.8 | Very high | 94.2 | Very high | 77 Ų | 77 | 48.7 Ų | 48.7 | 40% | 0.403 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -60.6 | -42.1 | 175 | -72.4 | 175.9 | 0 | 0 | 0 | 111.7 | I197 V198 V204 F205 | I197-L201 HydrophobicContact CG2-CD1 4.01Å; I197-L201 WeakPolarHBondContact O-CB 3.35Å; I197-L201 VanDerWaalsContact O-CG 3.28Å; I197-L201 WeakPolarHBondContact O-CG 3.27Å; I197-L201 PolarHBondContact O-N 2.97Å; V198-L201 PolarHBondContact O-N 3.32Å; L201-V204 PolarHBondContact O-N 3.3Å; L201-F205 HydrophobicContact CB-CD2 4.38Å; L201-F205 HydrophobicContact CB-CE2 3.9Å; L201-F205 HydrophobicContact CB-CZ 4.2Å; L201-F205 HydrophobicContact CD2-CE1 4.46Å; L201-F205 HydrophobicContact CD2-CE2 4.49Å; L201-F205 HydrophobicContact CD2-CZ 3.95Å; L201-F205 WeakPolarHBondContact O-CB 3.48Å; L201-F205 VanDerWaalsContact O-CD2 3.26Å; L201-F205 WeakPolarHBondContact O-CD2 3.18Å; L201-F205 WeakPolarHBondContact O-CG 3.45Å; L201-F205 PolarHBondContact O-N 2.86Å |
| 202 | L | 94.5 | Very high | 93.7 | Very high | 4 Ų | 4 | 52.8 Ų | 52.8 | 2% | 0.021 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -57.4 | -50.9 | 174.2 | -72.8 | 167.3 | 0 | 0 | 0 | 110.8 | S116 V198 F199 L200 V204 F205 Y206 F242 | S116-L202 WeakPolarHBondContact OG-CD2 3.19Å; V198-L202 HydrophobicContact CG1-CD1 3.83Å; V198-L202 HydrophobicContact CG1-CG 4.24Å; V198-L202 WeakPolarHBondContact O-CB 3.19Å; V198-L202 WeakPolarHBondContact O-CG 3.46Å; V198-L202 PolarHBondContact O-N 3.34Å; F199-L202 WeakPolarHBondContact O-CB 3.41Å; F199-L202 PolarHBondContact O-N 3.49Å; L200-L202 VanDerWaalsContact C-N 3.32Å; L200-L202 PolarHBondContact O-N 3.5Å; L202-V204 VanDerWaalsContact C-N 3.32Å; L202-V204 PolarHBondContact O-N 3.16Å; L202-F205 PolarHBondContact O-N 3.24Å; L202-Y206 HydrophobicContact CB-CD2 4.35Å; L202-Y206 HydrophobicContact CD2-CD2 4.16Å; L202-Y206 HydrophobicContact CD2-CE2 3.58Å; L202-Y206 WeakPolarHBondContact O-CB 3.35Å; L202-Y206 WeakPolarHBondContact O-CD2 3.27Å; L202-Y206 PolarHBondContact O-N 3.06Å; L202-F242 HydrophobicContact CD1-CB 4.49Å; L202-F242 HydrophobicContact CD1-CD1 3.53Å; L202-F242 HydrophobicContact CD1-CD2 3.49Å; L202-F242 VanDerWaalsContact CD1-CD2 3.49Å; L202-F242 HydrophobicContact CD1-CE1 3.49Å; L202-F242 VanDerWaalsContact CD1-CE1 3.49Å; L202-F242 HydrophobicContact CD1-CE2 3.41Å; L202-F242 VanDerWaalsContact CD1-CE2 3.41Å; L202-F242 HydrophobicContact CD1-CG 3.55Å; L202-F242 HydrophobicContact CD1-CZ 3.42Å; L202-F242 VanDerWaalsContact CD1-CZ 3.42Å |
| 203 | I | 94.5 | Very high | 93.2 | Very high | 68 Ų | 68 | 52.9 Ų | 52.9 | 35% | 0.349 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -55.8 | -48.2 | 178 | -69.4 | 171.8 | 0 | 0 | 0 | 110.8 | F199 L200 T207 F243 | F199-I203 HydrophobicContact CD1-CD1 4.05Å; F199-I203 HydrophobicContact CE1-CD1 3.55Å; F199-I203 HydrophobicContact CE2-CD1 4.13Å; F199-I203 HydrophobicContact CZ-CD1 3.62Å; F199-I203 HydrophobicContact CZ-CG1 4.44Å; F199-I203 WeakPolarHBondContact O-CG1 3.44Å; F199-I203 PolarHBondContact O-N 3.45Å; L200-I203 PolarHBondContact O-N 2.83Å; I203-T207 WeakPolarHBondContact O-CB 3.47Å; I203-T207 PolarHBondContact O-N 3.5Å; I203-T207 PolarHBondContact O-OG1 3.1Å; I203-F243 HydrophobicContact CG1-CZ 4.21Å |
| 204 | V | 95 | Very high | 92.5 | Very high | 87 Ų | 87 | 58.1 Ų | 58.1 | 53% | 0.527 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.1 | -50.6 | 179.8 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | L200 L201 L202 T207 A208 | L200-V204 WeakPolarHBondContact O-CG2 3.44Å; L200-V204 PolarHBondContact O-N 3.05Å; L201-V204 PolarHBondContact O-N 3.3Å; L202-V204 VanDerWaalsContact C-N 3.32Å; L202-V204 PolarHBondContact O-N 3.16Å; V204-T207 PolarHBondContact O-N 3.27Å; V204-A208 WeakPolarHBondContact O-CB 3.46Å; V204-A208 PolarHBondContact O-N 3.43Å |
| 205 | F | 93.6 | Very high | 91.9 | Very high | 22 Ų | 22 | 63 Ų | 63 | 10% | 0.096 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.6 | -49.1 | -177.9 | -65.9 | -21.1 | 0 | 0 | 0 | 111.9 | F117 Y120 L201 L202 A208 I209 | F117-F205 HydrophobicContact CB-CD2 4.4Å; F117-F205 HydrophobicContact CB-CE2 3.81Å; F117-F205 HydrophobicContact CB-CZ 4.42Å; F117-F205 AromaticContact CD2-CE2 3.96Å; F117-F205 HydrophobicContact CD2-CE2 3.96Å; F117-F205 AromaticContact CD2-CZ 3.69Å; F117-F205 HydrophobicContact CD2-CZ 3.69Å; F117-F205 HydrophobicContact CG-CE2 4.41Å; Y120-F205 HydrophobicContact CD1-CD1 4.19Å; Y120-F205 HydrophobicContact CD1-CE1 4.39Å; Y120-F205 HydrophobicContact CD2-CB 4.33Å; Y120-F205 AromaticContact CD2-CD1 3.94Å; Y120-F205 HydrophobicContact CD2-CD1 3.94Å; Y120-F205 HydrophobicContact CD2-CG 4.44Å; Y120-F205 HydrophobicContact CE2-CD1 4.46Å; Y120-F205 HydrophobicContact CG-CB 4.4Å; Y120-F205 AromaticContact CG-CD1 3.79Å; Y120-F205 HydrophobicContact CG-CD1 3.79Å; Y120-F205 HydrophobicContact CG-CE1 4.43Å; Y120-F205 HydrophobicContact CG-CG 4.21Å; L201-F205 HydrophobicContact CB-CD2 4.38Å; L201-F205 HydrophobicContact CB-CE2 3.9Å; L201-F205 HydrophobicContact CB-CZ 4.2Å; L201-F205 HydrophobicContact CD2-CE1 4.46Å; L201-F205 HydrophobicContact CD2-CE2 4.49Å; L201-F205 HydrophobicContact CD2-CZ 3.95Å; L201-F205 WeakPolarHBondContact O-CB 3.48Å; L201-F205 VanDerWaalsContact O-CD2 3.26Å; L201-F205 WeakPolarHBondContact O-CD2 3.18Å; L201-F205 WeakPolarHBondContact O-CG 3.45Å; L201-F205 PolarHBondContact O-N 2.86Å; L202-F205 PolarHBondContact O-N 3.24Å; F205-A208 PolarHBondContact O-N 2.94Å; F205-I209 WeakPolarHBondContact O-CB 3.48Å; F205-I209 WeakPolarHBondContact O-CD1 3.42Å; F205-I209 WeakPolarHBondContact O-CG1 3.23Å; F205-I209 PolarHBondContact O-N 2.8Å |
| 206 | Y | 90.5 | Very high | 90.9 | Very high | 17 Ų | 17 | 64.8 Ų | 64.8 | 7% | 0.067 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -71.2 | -32.4 | -178.4 | -76.6 | -78.3 | 0 | 0 | 0 | 112.9 | S116 L202 I209 T210 I235 I238 V239 | S116-Y206 WeakPolarHBondContact OG-CE2 3.16Å; S116-Y206 PolarHBondContact OG-OH 3.47Å; L202-Y206 HydrophobicContact CB-CD2 4.35Å; L202-Y206 HydrophobicContact CD2-CD2 4.16Å; L202-Y206 HydrophobicContact CD2-CE2 3.58Å; L202-Y206 WeakPolarHBondContact O-CB 3.35Å; L202-Y206 WeakPolarHBondContact O-CD2 3.27Å; L202-Y206 PolarHBondContact O-N 3.06Å; Y206-I209 HydrophobicContact CD1-CD1 4.3Å; Y206-T210 VanDerWaalsContact O-CB 3.27Å; Y206-T210 WeakPolarHBondContact O-CB 3.45Å; Y206-T210 PolarHBondContact O-N 3.41Å; Y206-T210 PolarHBondContact O-OG1 3.46Å; Y206-I235 HydrophobicContact CD1-CG2 3.38Å; Y206-I235 HydrophobicContact CE1-CB 4.15Å; Y206-I235 HydrophobicContact CE1-CG2 3.27Å; Y206-I235 WeakPolarHBondContact CE1-O 3.22Å; Y206-I238 VanDerWaalsContact OH-CB 3.31Å; Y206-I238 WeakPolarHBondContact OH-CB 3.04Å; Y206-I238 WeakPolarHBondContact OH-CG2 3.24Å; Y206-V239 HydrophobicContact CD1-CG2 3.28Å; Y206-V239 HydrophobicContact CD2-CG2 3.44Å; Y206-V239 VanDerWaalsContact CD2-CG2 3.44Å; Y206-V239 HydrophobicContact CE1-CG2 3.31Å; Y206-V239 HydrophobicContact CE2-CG2 3.49Å; Y206-V239 VanDerWaalsContact CE2-CG2 3.49Å; Y206-V239 HydrophobicContact CG-CG2 3.35Å; Y206-V239 VanDerWaalsContact CZ-CG2 3.45Å |
| 207 | T | 91.2 | Very high | 89.9 | Confident | 62 Ų | 62 | 64.7 Ų | 64.7 | 38% | 0.38 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 170.6 | -60.4 | 0 | 0 | 0 | 0 | 110.8 | I203 V204 T210 K211 | I203-T207 WeakPolarHBondContact O-CB 3.47Å; I203-T207 PolarHBondContact O-N 3.5Å; I203-T207 PolarHBondContact O-OG1 3.1Å; V204-T207 PolarHBondContact O-N 3.27Å; T207-T210 PolarHBondContact O-N 3.28Å; T207-K211 HydrophobicContact CG2-CD 4.23Å; T207-K211 WeakPolarHBondContact O-CB 3.38Å; T207-K211 WeakPolarHBondContact O-CG 3.34Å; T207-K211 PolarHBondContact O-N 3.39Å |
| 208 | A | 91.3 | Very high | 88.9 | Confident | 27 Ų | 27 | 65.7 Ų | 65.7 | 22% | 0.223 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.3 | -41.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y120 V124 V204 F205 K211 K212 | Y120-A208 HydrophobicContact CD2-CB 4.05Å; Y120-A208 HydrophobicContact CE2-CB 3.62Å; V124-A208 HydrophobicContact CG2-CB 4.44Å; V204-A208 WeakPolarHBondContact O-CB 3.46Å; V204-A208 PolarHBondContact O-N 3.43Å; F205-A208 PolarHBondContact O-N 2.94Å; A208-K211 PolarHBondContact O-N 3.3Å; A208-K212 WeakPolarHBondContact O-CB 3.27Å; A208-K212 PolarHBondContact O-N 3.46Å |
| 209 | I | 88.3 | Confident | 87.8 | Confident | 0 Ų | 0 | 73.1 Ų | 73.1 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -58.3 | -49.8 | 173.4 | -72.3 | 165.5 | 0 | 0 | 0 | 110 | R119 Y120 I123 V124 F205 Y206 K211 K212 I213 I235 | R119-I209 HydrophobicContact CB-CD1 4.2Å; Y120-I209 HydrophobicContact CD2-CG1 4.48Å; I123-I209 HydrophobicContact CD1-CG2 4.08Å; V124-I209 HydrophobicContact CG2-CG1 4.02Å; F205-I209 WeakPolarHBondContact O-CB 3.48Å; F205-I209 WeakPolarHBondContact O-CD1 3.42Å; F205-I209 WeakPolarHBondContact O-CG1 3.23Å; F205-I209 PolarHBondContact O-N 2.8Å; Y206-I209 HydrophobicContact CD1-CD1 4.3Å; I209-K211 PolarHBondContact O-N 3.44Å; I209-K212 PolarHBondContact O-N 3.45Å; I209-I213 HydrophobicContact CG2-CD1 3.74Å; I209-I213 HydrophobicContact CG2-CG1 4.47Å; I209-I213 WeakPolarHBondContact O-CG1 3.34Å; I209-I213 PolarHBondContact O-N 3.38Å; I209-I235 HydrophobicContact CG2-CD1 3.83Å; I209-I235 HydrophobicContact CG2-CG2 4.07Å |
| 210 | T | 86.9 | Confident | 86.1 | Confident | 86 Ų | 86 | 74.2 Ų | 74.2 | 53% | 0.528 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62.8 | -45.1 | -178.1 | -57.6 | 0 | 0 | 0 | 0 | 111.2 | Y206 T207 K212 I213 F214 | Y206-T210 VanDerWaalsContact O-CB 3.27Å; Y206-T210 WeakPolarHBondContact O-CB 3.45Å; Y206-T210 PolarHBondContact O-N 3.41Å; Y206-T210 PolarHBondContact O-OG1 3.46Å; T207-T210 PolarHBondContact O-N 3.28Å; T210-K212 VanDerWaalsContact C-N 3.35Å; T210-K212 PolarHBondContact O-N 3.49Å; T210-I213 PolarHBondContact O-N 2.92Å; T210-F214 WeakPolarHBondContact O-CB 3.39Å; T210-F214 PolarHBondContact O-N 3.01Å |
| 211 | K | 88 | Confident | 84.2 | Confident | 147 Ų | 147 | 72.2 Ų | 72.2 | 64% | 0.639 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -59 | -43.3 | 174.1 | -75.4 | 178.9 | 178.1 | -179.4 | 0 | 112.2 | T207 A208 I209 F214 K215 | T207-K211 HydrophobicContact CG2-CD 4.23Å; T207-K211 WeakPolarHBondContact O-CB 3.38Å; T207-K211 WeakPolarHBondContact O-CG 3.34Å; T207-K211 PolarHBondContact O-N 3.39Å; A208-K211 PolarHBondContact O-N 3.3Å; I209-K211 PolarHBondContact O-N 3.44Å; K211-F214 PolarHBondContact O-N 3.29Å; K211-K215 WeakPolarHBondContact O-CB 3.36Å; K211-K215 PolarHBondContact O-N 2.84Å |
| 212 | K | 85.9 | Confident | 82.1 | Confident | 99 Ų | 99 | 79.3 Ų | 79.3 | 43% | 0.43 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -63.9 | -45.1 | 178.1 | -176.6 | 70 | 175.3 | -166.3 | 0 | 111.4 | I123 V124 A208 I209 T210 S216 | I123-K212 HydrophobicContact CG2-CG 4.26Å; V124-K212 HydrophobicContact CG2-CB 4.18Å; V124-K212 HydrophobicContact CG2-CG 4.49Å; A208-K212 WeakPolarHBondContact O-CB 3.27Å; A208-K212 PolarHBondContact O-N 3.46Å; I209-K212 PolarHBondContact O-N 3.45Å; T210-K212 VanDerWaalsContact C-N 3.35Å; T210-K212 PolarHBondContact O-N 3.49Å; K212-S216 WeakPolarHBondContact O-CB 3.39Å; K212-S216 PolarHBondContact O-N 2.94Å |
| 213 | I | 83.1 | Confident | 79.9 | Confident | 29 Ų | 29 | 86.5 Ų | 86.5 | 15% | 0.149 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -61.2 | -50.4 | 176.9 | -69.6 | 171.3 | 0 | 0 | 0 | 109.6 | I123 I209 T210 K215 S216 H217 I235 | I123-I213 HydrophobicContact CG2-CG1 4.45Å; I209-I213 HydrophobicContact CG2-CD1 3.74Å; I209-I213 HydrophobicContact CG2-CG1 4.47Å; I209-I213 WeakPolarHBondContact O-CG1 3.34Å; I209-I213 PolarHBondContact O-N 3.38Å; T210-I213 PolarHBondContact O-N 2.92Å; I213-K215 PolarHBondContact O-N 2.69Å; I213-S216 CarbonylContact O-C 3.59Å; I213-S216 WeakPolarHBondContact O-CB 3.28Å; I213-S216 PolarHBondContact O-N 3.25Å; I213-S216 VanDerWaalsContact O-N 3.08Å; I213-S216 PolarHBondContact O-OG 2.72Å; I213-H217 PolarHBondContact O-CD2 2.92Å; I213-H217 PolarHBondContact O-N 2.95Å; I213-I235 HydrophobicContact CD1-CD1 4.29Å |
| 214 | F | 82.6 | Confident | 77.8 | Confident | 140 Ų | 140 | 85.8 Ų | 85.8 | 61% | 0.614 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -58.6 | -48.2 | 179.7 | -173.2 | -104.8 | 0 | 0 | 0 | 112.5 | T210 K211 S216 H217 L218 | T210-F214 WeakPolarHBondContact O-CB 3.39Å; T210-F214 PolarHBondContact O-N 3.01Å; K211-F214 PolarHBondContact O-N 3.29Å; F214-S216 VanDerWaalsContact C-N 3.27Å; F214-S216 PolarHBondContact O-N 3.35Å; F214-H217 WeakPolarHBondContact O-CB 3.36Å; F214-H217 PolarHBondContact O-N 3.48Å; F214-L218 HydrophobicContact CD1-CD1 3.65Å; F214-L218 HydrophobicContact CE1-CD1 3.34Å; F214-L218 HydrophobicContact CE1-CG 4.41Å; F214-L218 HydrophobicContact CG-CD1 4.46Å; F214-L218 HydrophobicContact CZ-CD1 3.92Å; F214-L218 PolarHBondContact O-N 3.31Å; F214-L218 VanDerWaalsContact O-N 3.07Å |
| 215 | K | 83.6 | Confident | 75.8 | Confident | 128 Ų | 128 | 84.1 Ų | 84.1 | 56% | 0.557 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -59.6 | -37.1 | 175 | -172.4 | 173.6 | -175.5 | 171.2 | 0 | 112.3 | K211 I213 H217 K219 | K211-K215 WeakPolarHBondContact O-CB 3.36Å; K211-K215 PolarHBondContact O-N 2.84Å; I213-K215 PolarHBondContact O-N 2.69Å; K215-H217 VanDerWaalsContact C-N 3.34Å; K215-K219 WeakPolarHBondContact O-CG 3.42Å; K215-K219 PolarHBondContact O-N 2.85Å; K215-K219 VanDerWaalsContact O-N 3.17Å |
| 216 | S | 78.1 | Confident | 73.6 | Confident | 39 Ų | 39 | 85 Ų | 85 | 27% | 0.273 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -72.2 | -25.9 | 177.1 | 82.1 | 0 | 0 | 0 | 0 | 113.5 | K212 I213 F214 S220 K228 | K212-S216 WeakPolarHBondContact O-CB 3.39Å; K212-S216 PolarHBondContact O-N 2.94Å; I213-S216 CarbonylContact O-C 3.59Å; I213-S216 WeakPolarHBondContact O-CB 3.28Å; I213-S216 PolarHBondContact O-N 3.25Å; I213-S216 VanDerWaalsContact O-N 3.08Å; I213-S216 PolarHBondContact O-OG 2.72Å; F214-S216 VanDerWaalsContact C-N 3.27Å; F214-S216 PolarHBondContact O-N 3.35Å; S216-S220 WeakPolarHBondContact O-CB 3.49Å; S216-S220 PolarHBondContact O-N 2.97Å; S216-K228 PolarHBondContact O-NZ 3.03Å |
| 217 | H | 74.2 | Confident | 71.6 | Confident | 77 Ų | 77 | 89.2 Ų | 89.2 | 36% | 0.356 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -74.3 | -42 | 174.1 | -91.7 | -85.7 | 0 | 0 | 0 | 111.2 | I213 F214 K215 K219 S220 | I213-H217 PolarHBondContact O-CD2 2.92Å; I213-H217 PolarHBondContact O-N 2.95Å; F214-H217 WeakPolarHBondContact O-CB 3.36Å; F214-H217 PolarHBondContact O-N 3.48Å; K215-H217 VanDerWaalsContact C-N 3.34Å; H217-K219 PolarHBondContact O-N 3.2Å; H217-S220 PolarHBondContact O-N 2.93Å |
| 218 | L | 77.5 | Confident | 69.7 | Low | 126 Ų | 126 | 88.6 Ų | 88.6 | 66% | 0.66 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -62.4 | -40.1 | 174.9 | -78.8 | 154.6 | 0 | 0 | 0 | 112.8 | F214 | F214-L218 HydrophobicContact CD1-CD1 3.65Å; F214-L218 HydrophobicContact CE1-CD1 3.34Å; F214-L218 HydrophobicContact CE1-CG 4.41Å; F214-L218 HydrophobicContact CG-CD1 4.46Å; F214-L218 HydrophobicContact CZ-CD1 3.92Å; F214-L218 PolarHBondContact O-N 3.31Å; F214-L218 VanDerWaalsContact O-N 3.07Å |
| 219 | K | 74.4 | Confident | 67.8 | Low | 170 Ų | 170 | 94.2 Ų | 94.2 | 74% | 0.739 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -79.7 | -18.7 | -178.8 | -73.9 | -169.2 | 172.6 | -155.3 | 0 | 115 | K215 H217 | K215-K219 WeakPolarHBondContact O-CG 3.42Å; K215-K219 PolarHBondContact O-N 2.85Å; K215-K219 VanDerWaalsContact O-N 3.17Å; H217-K219 PolarHBondContact O-N 3.2Å |
| 220 | S | 62.7 | Low | 66.1 | Low | 49 Ų | 49 | 97 Ų | 97 | 34% | 0.343 | 49% | 0.491 | S | S | . | . | S | Bend | trans | -117.7 | 86 | -171.1 | -171 | 0 | 0 | 0 | 0 | 107.7 | S216 H217 R222 K228 | S216-S220 WeakPolarHBondContact O-CB 3.49Å; S216-S220 PolarHBondContact O-N 2.97Å; H217-S220 PolarHBondContact O-N 2.93Å; S220-R222 PolarHBondContact O-N 3Å; S220-K228 PolarHBondContact OG-NZ 3.49Å; S220-K228 VanDerWaalsContact OG-NZ 3.12Å |
| 221 | G | 55.5 | Low | 64.6 | Low | 63 Ų | 63 | 95.2 Ų | 95.2 | 65% | 0.649 | 48% | 0.483 | S | S | * | . | trans | -48.8 | 123.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | N223 | G221-N223 PolarHBondContact O-N 2.96Š| ||
| 222 | R | 53.4 | Low | 63.2 | Low | 225 Ų | 225 | 90.9 Ų | 90.9 | 85% | 0.849 | 47% | 0.471 | S | S | * | . | S | Bend | trans | 29.2 | -5.6 | 170 | -134.4 | 141 | 98.8 | 133.6 | -0.6 | 123.3 | S220 | S220-R222 PolarHBondContact O-N 3Š|
| 223 | N | 47.3 | Very low | 62.3 | Low | 156 Ų | 156 | 92 Ų | 92 | 83% | 0.834 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -105.8 | 9.9 | -163.3 | -72.5 | -6.1 | 0 | 0 | 0 | 116.4 | G221 | G221-N223 PolarHBondContact O-N 2.96Š|
| 224 | S | 51 | Low | 61.7 | Low | 52 Ų | 52 | 91.6 Ų | 91.6 | 36% | 0.364 | 47% | 0.471 | S | S | . | . | trans | -138.6 | 54.3 | 170.4 | -169.2 | 0 | 0 | 0 | 0 | 112 | K228 | S224-K228 WeakPolarHBondContact O-CB 3.35Å; S224-K228 VanDerWaalsContact O-CD 3.29Å; S224-K228 WeakPolarHBondContact O-CD 3.25Å; S224-K228 VanDerWaalsContact O-CG 3.23Å; S224-K228 WeakPolarHBondContact O-CG 3.2Å | ||
| 225 | T | 51.9 | Low | 61.4 | Low | 52 Ų | 52 | 85.3 Ų | 85.3 | 32% | 0.319 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -80.5 | -30.8 | -173.5 | 46.3 | 0 | 0 | 0 | 0 | 113.7 | K229 | T225-K229 VanDerWaalsContact O-CB 3.23Å; T225-K229 WeakPolarHBondContact O-CB 3.25Å; T225-K229 WeakPolarHBondContact O-CD 3.34Å; T225-K229 WeakPolarHBondContact O-CG 3.45Å; T225-K229 PolarHBondContact O-N 2.97Å; T225-K229 VanDerWaalsContact O-N 3.12Å |
| 226 | S | 48.4 | Very low | 61.4 | Low | 41 Ų | 41 | 85.9 Ų | 85.9 | 29% | 0.287 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -80 | -43.4 | -171.3 | 71.1 | 0 | 0 | 0 | 0 | 114.6 | K230 R324 | S226-K230 PolarHBondContact O-N 3.38Å; S226-K230 VanDerWaalsContact O-N 3.15Å; S226-R324 PolarHBondContact OG-NH1 2.79Å |
| 227 | V | 48.6 | Very low | 61.7 | Low | 105 Ų | 105 | 84.7 Ų | 84.7 | 64% | 0.636 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -70.9 | -38.4 | 177.9 | -178.2 | 0 | 0 | 0 | 0 | 111 | K230 S231 | V227-K230 PolarHBondContact O-N 3.5Å; V227-S231 PolarHBondContact O-N 3.38Å |
| 228 | K | 51.3 | Low | 62.3 | Low | 50 Ų | 50 | 81 Ų | 81 | 22% | 0.217 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -66.2 | -41 | 175.4 | -65.7 | -176.9 | -173.6 | 175.9 | 0 | 112.5 | S216 S220 S224 S232 | S216-K228 PolarHBondContact O-NZ 3.03Å; S220-K228 PolarHBondContact OG-NZ 3.49Å; S220-K228 VanDerWaalsContact OG-NZ 3.12Å; S224-K228 WeakPolarHBondContact O-CB 3.35Å; S224-K228 VanDerWaalsContact O-CD 3.29Å; S224-K228 WeakPolarHBondContact O-CD 3.25Å; S224-K228 VanDerWaalsContact O-CG 3.23Å; S224-K228 WeakPolarHBondContact O-CG 3.2Å; K228-S232 PolarHBondContact O-N 3.5Å; K228-S232 VanDerWaalsContact O-N 3.16Å |
| 229 | K | 50.9 | Low | 62.9 | Low | 145 Ų | 145 | 76.5 Ų | 76.5 | 63% | 0.63 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -64.7 | -39.6 | 175 | -79.5 | 177.3 | 178.9 | -171.9 | 0 | 112.9 | T225 S232 R233 | T225-K229 VanDerWaalsContact O-CB 3.23Å; T225-K229 WeakPolarHBondContact O-CB 3.25Å; T225-K229 WeakPolarHBondContact O-CD 3.34Å; T225-K229 WeakPolarHBondContact O-CG 3.45Å; T225-K229 PolarHBondContact O-N 2.97Å; T225-K229 VanDerWaalsContact O-N 3.12Å; K229-S232 PolarHBondContact O-N 3.49Å; K229-R233 PolarHBondContact O-N 3.26Å; K229-R233 VanDerWaalsContact O-N 3.15Å |
| 230 | K | 52.3 | Low | 63.6 | Low | 57 Ų | 57 | 73.3 Ų | 73.3 | 25% | 0.248 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 178.6 | -170.3 | 173.5 | 177.8 | -179.9 | 0 | 112.3 | S226 V227 N234 | S226-K230 PolarHBondContact O-N 3.38Å; S226-K230 VanDerWaalsContact O-N 3.15Å; V227-K230 PolarHBondContact O-N 3.5Å; K230-N234 PolarHBondContact O-OD1 2.91Å |
| 231 | S | 55.3 | Low | 65.1 | Low | 50 Ų | 50 | 71 Ų | 71 | 35% | 0.35 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -66.3 | -36.8 | 174.8 | -168.5 | 0 | 0 | 0 | 0 | 112.4 | V227 I235 | V227-S231 PolarHBondContact O-N 3.38Å; S231-I235 WeakPolarHBondContact O-CD1 3.38Å; S231-I235 WeakPolarHBondContact O-CG1 3.43Å; S231-I235 PolarHBondContact O-N 3.36Å |
| 232 | S | 59.7 | Low | 66.9 | Low | 55 Ų | 55 | 68 Ų | 68 | 39% | 0.385 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -66.7 | -42.9 | 179.7 | -168.1 | 0 | 0 | 0 | 0 | 112.9 | K228 K229 N234 I235 F236 | K228-S232 PolarHBondContact O-N 3.5Å; K228-S232 VanDerWaalsContact O-N 3.16Å; K229-S232 PolarHBondContact O-N 3.49Å; S232-N234 PolarHBondContact O-N 2.82Å; S232-I235 PolarHBondContact O-N 2.97Å; S232-F236 PolarHBondContact O-N 3.33Å; S232-F236 VanDerWaalsContact O-N 3.16Å |
| 233 | R | 65.8 | Low | 68.8 | Low | 123 Ų | 123 | 61 Ų | 61 | 46% | 0.464 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -60.8 | -43.3 | 179.2 | -173.7 | 171.4 | 64.4 | -167.5 | 2 | 112.6 | K229 I235 F236 S237 F297 | K229-R233 PolarHBondContact O-N 3.26Å; K229-R233 VanDerWaalsContact O-N 3.15Å; R233-I235 VanDerWaalsContact C-N 3.32Å; R233-I235 PolarHBondContact O-N 2.97Å; R233-F236 PolarHBondContact O-N 3.17Å; R233-S237 PolarHBondContact O-N 3.4Å; R233-S237 PolarHBondContact O-OG 3.37Å; R233-F297 HydrophobicContact CG-CD1 4.46Å |
| 234 | N | 72 | Confident | 71.1 | Confident | 20 Ų | 20 | 55.8 Ų | 55.8 | 11% | 0.107 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -67.3 | -33.5 | -178 | -65.1 | 2.3 | 0 | 0 | 0 | 113.1 | K230 S232 F297 L298 | K230-N234 PolarHBondContact O-OD1 2.91Å; S232-N234 PolarHBondContact O-N 2.82Å; N234-F297 VanDerWaalsContact CG-C 3.46Å; N234-F297 PolarHBondContact ND2-O 3.26Å; N234-F297 VanDerWaalsContact OD1-C 3.31Å; N234-F297 PolarHBondContact OD1-O 2.9Å; N234-L298 HydrophobicContact CB-CD1 3.81Å |
| 235 | I | 76.6 | Confident | 73.3 | Confident | 9 Ų | 9 | 53.3 Ų | 53.3 | 5% | 0.046 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -69.8 | -44 | 178.7 | -74 | 167.9 | 0 | 0 | 0 | 109.6 | I123 Y206 I209 I213 S231 S232 R233 S237 I238 V239 | I123-I235 HydrophobicContact CD1-CD1 3.38Å; Y206-I235 HydrophobicContact CD1-CG2 3.38Å; Y206-I235 HydrophobicContact CE1-CB 4.15Å; Y206-I235 HydrophobicContact CE1-CG2 3.27Å; Y206-I235 WeakPolarHBondContact CE1-O 3.22Å; I209-I235 HydrophobicContact CG2-CD1 3.83Å; I209-I235 HydrophobicContact CG2-CG2 4.07Å; I213-I235 HydrophobicContact CD1-CD1 4.29Å; S231-I235 WeakPolarHBondContact O-CD1 3.38Å; S231-I235 WeakPolarHBondContact O-CG1 3.43Å; S231-I235 PolarHBondContact O-N 3.36Å; S232-I235 PolarHBondContact O-N 2.97Å; R233-I235 VanDerWaalsContact C-N 3.32Å; R233-I235 PolarHBondContact O-N 2.97Å; I235-S237 PolarHBondContact O-N 3.06Å; I235-I238 PolarHBondContact O-N 2.88Å; I235-V239 PolarHBondContact O-N 2.94Å |
| 236 | F | 81.6 | Confident | 75.5 | Confident | 140 Ų | 140 | 50.8 Ų | 50.8 | 61% | 0.614 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -64.8 | -38 | 178.6 | -170.6 | -100.2 | 0 | 0 | 0 | 112.8 | S232 R233 I238 V239 F240 | S232-F236 PolarHBondContact O-N 3.33Å; S232-F236 VanDerWaalsContact O-N 3.16Å; R233-F236 PolarHBondContact O-N 3.17Å; F236-I238 VanDerWaalsContact C-N 3.31Å; F236-I238 PolarHBondContact O-N 3.22Å; F236-V239 PolarHBondContact O-N 3.34Å; F236-F240 HydrophobicContact CE1-CB 4.44Å; F236-F240 VanDerWaalsContact O-CB 3.31Å; F236-F240 WeakPolarHBondContact O-CB 3.46Å; F236-F240 PolarHBondContact O-N 3.02Å |
| 237 | S | 85.6 | Confident | 77.8 | Confident | 14 Ų | 14 | 49.5 Ų | 49.5 | 10% | 0.098 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -58.1 | -41.1 | 176.8 | -58.3 | 0 | 0 | 0 | 0 | 112.9 | R233 I235 F240 V241 | R233-S237 PolarHBondContact O-N 3.4Å; R233-S237 PolarHBondContact O-OG 3.37Å; I235-S237 PolarHBondContact O-N 3.06Å; S237-F240 PolarHBondContact O-N 3.41Å; S237-V241 WeakPolarHBondContact O-CG2 3.28Å; S237-V241 PolarHBondContact O-N 3.22Å |
| 238 | I | 86.8 | Confident | 80.1 | Confident | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.3 | -47.5 | 178.9 | -63.2 | 160.3 | 0 | 0 | 0 | 110.9 | F112 I115 Y206 I235 F236 F240 V241 F242 I294 L298 | F112-I238 HydrophobicContact CD1-CG2 3.67Å; F112-I238 HydrophobicContact CE1-CG2 3.99Å; I115-I238 HydrophobicContact CG2-CD1 3.72Å; Y206-I238 VanDerWaalsContact OH-CB 3.31Å; Y206-I238 WeakPolarHBondContact OH-CB 3.04Å; Y206-I238 WeakPolarHBondContact OH-CG2 3.24Å; I235-I238 PolarHBondContact O-N 2.88Å; F236-I238 VanDerWaalsContact C-N 3.31Å; F236-I238 PolarHBondContact O-N 3.22Å; I238-F240 VanDerWaalsContact C-N 3.34Å; I238-V241 PolarHBondContact O-N 3.47Å; I238-F242 WeakPolarHBondContact O-CB 3.47Å; I238-F242 PolarHBondContact O-N 3.3Å; I238-I294 HydrophobicContact CG1-CG2 3.82Å; I238-L298 HydrophobicContact CD1-CD1 3.88Å; I238-L298 HydrophobicContact CD1-CD2 3.93Å; I238-L298 HydrophobicContact CG1-CD2 4.49Å |
| 239 | V | 89.3 | Confident | 82.4 | Confident | 30 Ų | 30 | 44.1 Ų | 44.1 | 18% | 0.182 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.9 | -47.7 | 178.2 | -179.3 | 0 | 0 | 0 | 0 | 110 | Y206 I235 F236 V241 F242 F243 | Y206-V239 HydrophobicContact CD1-CG2 3.28Å; Y206-V239 HydrophobicContact CD2-CG2 3.44Å; Y206-V239 VanDerWaalsContact CD2-CG2 3.44Å; Y206-V239 HydrophobicContact CE1-CG2 3.31Å; Y206-V239 HydrophobicContact CE2-CG2 3.49Å; Y206-V239 VanDerWaalsContact CE2-CG2 3.49Å; Y206-V239 HydrophobicContact CG-CG2 3.35Å; Y206-V239 VanDerWaalsContact CZ-CG2 3.45Å; I235-V239 PolarHBondContact O-N 2.94Å; F236-V239 PolarHBondContact O-N 3.34Å; V239-V241 PolarHBondContact O-N 3.49Å; V239-F242 PolarHBondContact O-N 2.94Å; V239-F243 HydrophobicContact CG1-CD2 3.51Å; V239-F243 HydrophobicContact CG1-CE2 3.58Å; V239-F243 HydrophobicContact CG1-CG 4.48Å; V239-F243 WeakPolarHBondContact O-CB 3.34Å; V239-F243 VanDerWaalsContact O-CD2 3.23Å; V239-F243 WeakPolarHBondContact O-CD2 3.29Å; V239-F243 PolarHBondContact O-N 2.83Å |
| 240 | F | 90.7 | Very high | 84.6 | Confident | 104 Ų | 104 | 37.4 Ų | 37.4 | 46% | 0.456 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -56.1 | -52.8 | -180 | 175.4 | -96.7 | 0 | 0 | 0 | 111.7 | F236 S237 I238 F242 F243 V244 | F236-F240 HydrophobicContact CE1-CB 4.44Å; F236-F240 VanDerWaalsContact O-CB 3.31Å; F236-F240 WeakPolarHBondContact O-CB 3.46Å; F236-F240 PolarHBondContact O-N 3.02Å; S237-F240 PolarHBondContact O-N 3.41Å; I238-F240 VanDerWaalsContact C-N 3.34Å; F240-F242 PolarHBondContact O-N 3.23Å; F240-F243 PolarHBondContact O-N 3.49Å; F240-V244 HydrophobicContact CD2-CG2 4.02Å; F240-V244 HydrophobicContact CE1-CG2 4.22Å; F240-V244 HydrophobicContact CE2-CG2 3.69Å; F240-V244 HydrophobicContact CG-CG2 4.42Å; F240-V244 HydrophobicContact CZ-CG2 3.8Å; F240-V244 WeakPolarHBondContact O-CB 3.1Å; F240-V244 VanDerWaalsContact O-CG2 3.28Å; F240-V244 WeakPolarHBondContact O-CG2 3.33Å; F240-V244 PolarHBondContact O-N 3.33Å |
| 241 | V | 92.5 | Very high | 86.7 | Confident | 1 Ų | 1 | 39.1 Ų | 39.1 | 1% | 0.006 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63 | -43.9 | -179.2 | 175.2 | 0 | 0 | 0 | 0 | 111.1 | F112 S237 I238 V239 F243 V244 C245 L290 D291 I294 | F112-V241 HydrophobicContact CZ-CG1 4.26Å; S237-V241 WeakPolarHBondContact O-CG2 3.28Å; S237-V241 PolarHBondContact O-N 3.22Å; I238-V241 PolarHBondContact O-N 3.47Å; V239-V241 PolarHBondContact O-N 3.49Å; V241-F243 PolarHBondContact O-N 2.89Å; V241-V244 PolarHBondContact O-N 3.12Å; V241-C245 WeakPolarHBondContact O-CB 3.46Å; V241-C245 PolarHBondContact O-N 3.12Å; V241-C245 PolarHBondContact O-SG 3.29Å; V241-L290 HydrophobicContact CG1-CB 3.92Å; V241-L290 HydrophobicContact CG2-CB 4.05Å; V241-D291 VanDerWaalsContact CG1-OD1 3.31Å; V241-D291 WeakPolarHBondContact CG1-OD1 3.31Å; V241-I294 HydrophobicContact CB-CD1 3.69Å; V241-I294 HydrophobicContact CB-CG1 4.39Å; V241-I294 HydrophobicContact CG1-CD1 3.85Å; V241-I294 HydrophobicContact CG2-CD1 3.77Å; V241-I294 HydrophobicContact CG2-CG1 3.98Å |
| 242 | F | 93.8 | Very high | 88.6 | Confident | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -59.6 | -48.4 | 178.2 | -174.6 | -81.8 | 0 | 0 | 0 | 112.2 | I109 F112 F195 V198 F199 L202 I238 V239 F240 F246 V247 | I109-F242 HydrophobicContact CB-CE2 4.44Å; I109-F242 HydrophobicContact CG1-CE2 4.31Å; I109-F242 HydrophobicContact CG2-CE2 4.03Å; I109-F242 HydrophobicContact CG2-CZ 4.36Å; F112-F242 HydrophobicContact CB-CD2 3.83Å; F112-F242 HydrophobicContact CB-CE2 4.29Å; F112-F242 HydrophobicContact CD2-CD2 4.36Å; F112-F242 HydrophobicContact CG-CD2 4.11Å; F195-F242 HydrophobicContact CD2-CZ 4.1Å; F195-F242 AromaticContact CE2-CE1 3.87Å; F195-F242 HydrophobicContact CE2-CE1 3.87Å; F195-F242 AromaticContact CE2-CZ 3.75Å; F195-F242 HydrophobicContact CE2-CZ 3.75Å; F195-F242 HydrophobicContact CZ-CE1 4.46Å; V198-F242 HydrophobicContact CG1-CE2 3.95Å; V198-F242 HydrophobicContact CG1-CZ 4.08Å; F199-F242 HydrophobicContact CB-CE1 4.33Å; F199-F242 HydrophobicContact CD2-CD1 4.47Å; F199-F242 AromaticContact CD2-CE1 3.81Å; F199-F242 HydrophobicContact CD2-CE1 3.81Å; L202-F242 HydrophobicContact CD1-CB 4.49Å; L202-F242 HydrophobicContact CD1-CD1 3.53Å; L202-F242 HydrophobicContact CD1-CD2 3.49Å; L202-F242 VanDerWaalsContact CD1-CD2 3.49Å; L202-F242 HydrophobicContact CD1-CE1 3.49Å; L202-F242 VanDerWaalsContact CD1-CE1 3.49Å; L202-F242 HydrophobicContact CD1-CE2 3.41Å; L202-F242 VanDerWaalsContact CD1-CE2 3.41Å; L202-F242 HydrophobicContact CD1-CG 3.55Å; L202-F242 HydrophobicContact CD1-CZ 3.42Å; L202-F242 VanDerWaalsContact CD1-CZ 3.42Å; I238-F242 WeakPolarHBondContact O-CB 3.47Å; I238-F242 PolarHBondContact O-N 3.3Å; V239-F242 PolarHBondContact O-N 2.94Å; F240-F242 PolarHBondContact O-N 3.23Å; F242-F246 HydrophobicContact CB-CD2 4.44Å; F242-F246 AromaticContact CD2-CD2 3.65Å; F242-F246 HydrophobicContact CD2-CD2 3.65Å; F242-F246 HydrophobicContact CD2-CE2 4.18Å; F242-F246 AromaticContact CE2-CD2 3.97Å; F242-F246 HydrophobicContact CE2-CD2 3.97Å; F242-F246 HydrophobicContact CG-CD2 4.05Å; F242-F246 PolarHBondContact O-N 3.15Å; F242-V247 HydrophobicContact CD1-CG2 4.26Å; F242-V247 HydrophobicContact CE1-CG2 4.11Å |
| 243 | F | 94.5 | Very high | 90.2 | Very high | 77 Ų | 77 | 36 Ų | 36 | 34% | 0.338 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -67.4 | -42.9 | -178.1 | -89 | -103.7 | 0 | 0 | 0 | 111.9 | F199 I203 V239 F240 V241 V247 P248 | F199-F243 HydrophobicContact CD2-CZ 4.28Å; F199-F243 HydrophobicContact CE2-CD1 4.11Å; F199-F243 AromaticContact CE2-CE1 3.44Å; F199-F243 HydrophobicContact CE2-CE1 3.44Å; F199-F243 VanDerWaalsContact CE2-CE1 3.44Å; F199-F243 HydrophobicContact CE2-CE2 4.04Å; F199-F243 AromaticContact CE2-CZ 3.41Å; F199-F243 HydrophobicContact CE2-CZ 3.41Å; F199-F243 VanDerWaalsContact CE2-CZ 3.41Å; F199-F243 AromaticContact CZ-CE1 3.87Å; F199-F243 HydrophobicContact CZ-CE1 3.87Å; F199-F243 HydrophobicContact CZ-CZ 4.05Å; I203-F243 HydrophobicContact CG1-CZ 4.21Å; V239-F243 HydrophobicContact CG1-CD2 3.51Å; V239-F243 HydrophobicContact CG1-CE2 3.58Å; V239-F243 HydrophobicContact CG1-CG 4.48Å; V239-F243 WeakPolarHBondContact O-CB 3.34Å; V239-F243 VanDerWaalsContact O-CD2 3.23Å; V239-F243 WeakPolarHBondContact O-CD2 3.29Å; V239-F243 PolarHBondContact O-N 2.83Å; F240-F243 PolarHBondContact O-N 3.49Å; V241-F243 PolarHBondContact O-N 2.89Å; F243-V247 HydrophobicContact CB-CG2 4.47Å; F243-V247 HydrophobicContact CD1-CG2 4.11Å; F243-V247 HydrophobicContact CG-CG2 4.25Å; F243-V247 WeakPolarHBondContact O-CB 3.36Å; F243-P248 WeakPolarHBondContact O-CD 3.23Å |
| 244 | V | 95.4 | Very high | 91.4 | Very high | 46 Ų | 46 | 33.8 Ų | 33.8 | 28% | 0.279 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -68.7 | -43.2 | -179.2 | 170.8 | 0 | 0 | 0 | 0 | 111.1 | F240 V241 P248 L283 | F240-V244 HydrophobicContact CD2-CG2 4.02Å; F240-V244 HydrophobicContact CE1-CG2 4.22Å; F240-V244 HydrophobicContact CE2-CG2 3.69Å; F240-V244 HydrophobicContact CG-CG2 4.42Å; F240-V244 HydrophobicContact CZ-CG2 3.8Å; F240-V244 WeakPolarHBondContact O-CB 3.1Å; F240-V244 VanDerWaalsContact O-CG2 3.28Å; F240-V244 WeakPolarHBondContact O-CG2 3.33Å; F240-V244 PolarHBondContact O-N 3.33Å; V241-V244 PolarHBondContact O-N 3.12Å; V244-P248 WeakPolarHBondContact O-CD 3.38Å; V244-P248 WeakPolarHBondContact O-CG 3.26Å; V244-L283 HydrophobicContact CG1-CD1 4.12Å; V244-L283 WeakPolarHBondContact O-CD2 3.22Å; V244-L283 WeakPolarHBondContact O-CG 3.48Å |
| 245 | C | 96.5 | Very high | 92.4 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -82.4 | -49.8 | -172.9 | -54.9 | 0 | 0 | 0 | 0 | 112.4 | V241 S284 N287 L290 | V241-C245 WeakPolarHBondContact O-CB 3.46Å; V241-C245 PolarHBondContact O-N 3.12Å; V241-C245 PolarHBondContact O-SG 3.29Å; C245-S284 WeakPolarHBondContact O-CA 3.27Å; C245-S284 VanDerWaalsContact O-CB 3.29Å; C245-S284 WeakPolarHBondContact O-CB 3.39Å; C245-S284 PolarHBondContact O-N 2.86Å; C245-N287 HydrophobicContact CB-CB 3.89Å; C245-L290 VanDerWaalsContact SG-CD1 3.54Å |
| 246 | F | 97.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -96.4 | -35.3 | -164.9 | -56.5 | -62.9 | 0 | 0 | 0 | 113.8 | M105 I109 F112 F195 F242 Y249 H250 S284 N287 | M105-F246 HydrophobicContact CG-CD1 4.12Å; M105-F246 HydrophobicContact CG-CE1 3.93Å; I109-F246 HydrophobicContact CD1-CB 4.39Å; I109-F246 HydrophobicContact CD1-CD1 3.81Å; I109-F246 HydrophobicContact CD1-CE1 4.31Å; I109-F246 HydrophobicContact CD1-CG 4.08Å; I109-F246 HydrophobicContact CG1-CB 4.37Å; I109-F246 HydrophobicContact CG1-CD1 3.73Å; I109-F246 HydrophobicContact CG1-CD2 3.98Å; I109-F246 HydrophobicContact CG1-CE1 3.96Å; I109-F246 HydrophobicContact CG1-CE2 4.2Å; I109-F246 HydrophobicContact CG1-CG 3.76Å; I109-F246 HydrophobicContact CG1-CZ 4.18Å; F112-F246 AromaticContact CD2-CE2 3.72Å; F112-F246 HydrophobicContact CD2-CE2 3.72Å; F112-F246 HydrophobicContact CD2-CZ 4.34Å; F112-F246 AromaticContact CE2-CE2 3.73Å; F112-F246 HydrophobicContact CE2-CE2 3.73Å; F112-F246 HydrophobicContact CE2-CZ 4.18Å; F195-F246 HydrophobicContact CD2-CB 4.41Å; F195-F246 HydrophobicContact CE2-CB 3.81Å; F242-F246 HydrophobicContact CB-CD2 4.44Å; F242-F246 AromaticContact CD2-CD2 3.65Å; F242-F246 HydrophobicContact CD2-CD2 3.65Å; F242-F246 HydrophobicContact CD2-CE2 4.18Å; F242-F246 AromaticContact CE2-CD2 3.97Å; F242-F246 HydrophobicContact CE2-CD2 3.97Å; F242-F246 HydrophobicContact CG-CD2 4.05Å; F242-F246 PolarHBondContact O-N 3.15Å; F246-Y249 PolarHBondContact O-N 3.08Å; F246-H250 PolarHBondContact O-N 3.32Å; F246-H250 PolarHBondContact O-ND1 3.46Å; F246-S284 WeakPolarHBondContact CD1-OG 3.27Å; F246-N287 HydrophobicContact CE1-CB 4.14Å; F246-N287 HydrophobicContact CZ-CB 3.75Å |
| 247 | V | 97.4 | Very high | 93.4 | Very high | 14 Ų | 14 | 32.7 Ų | 32.7 | 9% | 0.085 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.2 | -46.4 | -173.5 | 179.3 | 0 | 0 | 0 | 0 | 112.8 | F195 F199 F242 F243 Y249 H250 I251 | F195-V247 HydrophobicContact CE2-CG2 4.47Å; F195-V247 HydrophobicContact CZ-CB 4.4Å; F195-V247 HydrophobicContact CZ-CG2 3.99Å; F199-V247 HydrophobicContact CD2-CG2 3.88Å; F199-V247 HydrophobicContact CE2-CG1 4.48Å; F199-V247 HydrophobicContact CE2-CG2 3.57Å; F199-V247 HydrophobicContact CZ-CG2 4.41Å; F242-V247 HydrophobicContact CD1-CG2 4.26Å; F242-V247 HydrophobicContact CE1-CG2 4.11Å; F243-V247 HydrophobicContact CB-CG2 4.47Å; F243-V247 HydrophobicContact CD1-CG2 4.11Å; F243-V247 HydrophobicContact CG-CG2 4.25Å; F243-V247 WeakPolarHBondContact O-CB 3.36Å; V247-Y249 VanDerWaalsContact C-N 3.29Å; V247-Y249 PolarHBondContact O-N 3.47Å; V247-H250 PolarHBondContact O-N 2.89Å; V247-I251 HydrophobicContact CG1-CD1 3.55Å; V247-I251 HydrophobicContact CG1-CG1 4.16Å; V247-I251 WeakPolarHBondContact O-CG1 3.47Å; V247-I251 PolarHBondContact O-N 3Å |
| 248 | P | 97.8 | Very high | 93.6 | Very high | 40 Ų | 40 | 36.9 Ų | 36.9 | 26% | 0.26 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -57.7 | -42.1 | 179.7 | -27.7 | 36.5 | 0 | 0 | 0 | 112.6 | F243 V244 I251 A252 T280 L283 | F243-P248 WeakPolarHBondContact O-CD 3.23Å; V244-P248 WeakPolarHBondContact O-CD 3.38Å; V244-P248 WeakPolarHBondContact O-CG 3.26Å; P248-I251 PolarHBondContact O-N 3.35Å; P248-A252 VanDerWaalsContact O-CB 3.27Å; P248-A252 WeakPolarHBondContact O-CB 3.42Å; P248-A252 PolarHBondContact O-N 2.95Å; P248-T280 HydrophobicContact CB-CG2 3.72Å; P248-L283 HydrophobicContact CB-CD2 4.38Å; P248-L283 HydrophobicContact CG-CD2 4.08Å |
| 249 | Y | 97.8 | Very high | 93.7 | Very high | 2 Ų | 2 | 36.9 Ų | 36.9 | 1% | 0.008 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.8 | -48.6 | 179.2 | 171.2 | -112.5 | 0 | 0 | 0 | 112 | Y102 M105 F246 V247 I251 A252 R253 K277 L281 | Y102-Y249 HydrophobicContact CE1-CE1 4.36Å; Y102-Y249 AromaticContact CE1-CZ 3.95Å; Y102-Y249 VanDerWaalsContact CE1-OH 3.24Å; Y102-Y249 WeakPolarHBondContact CE1-OH 3.45Å; M105-Y249 HydrophobicContact CE-CD1 4.3Å; M105-Y249 HydrophobicContact CE-CE1 3.9Å; M105-Y249 HydrophobicContact SD-CD1 4.15Å; M105-Y249 HydrophobicContact SD-CE1 4.14Å; F246-Y249 PolarHBondContact O-N 3.08Å; V247-Y249 VanDerWaalsContact C-N 3.29Å; V247-Y249 PolarHBondContact O-N 3.47Å; Y249-I251 VanDerWaalsContact C-N 3.31Å; Y249-I251 PolarHBondContact O-N 2.9Å; Y249-A252 PolarHBondContact O-N 3.45Å; Y249-R253 HydrophobicContact CE2-CB 4.43Å; Y249-R253 VanDerWaalsContact O-CB 3.22Å; Y249-R253 WeakPolarHBondContact O-CB 3.3Å; Y249-R253 PolarHBondContact O-N 3.36Å; Y249-R253 WeakPolarHBondContact OH-CD 3.2Å; Y249-K277 HydrophobicContact CE2-CG 4.2Å; Y249-L281 HydrophobicContact CD2-CB 3.75Å; Y249-L281 HydrophobicContact CD2-CD1 3.91Å; Y249-L281 HydrophobicContact CD2-CG 4.44Å; Y249-L281 HydrophobicContact CE1-CD1 4.29Å; Y249-L281 HydrophobicContact CE2-CB 3.91Å; Y249-L281 HydrophobicContact CE2-CD1 3.64Å; Y249-L281 HydrophobicContact CE2-CG 4.25Å; Y249-L281 HydrophobicContact CG-CD1 4.36Å |
| 250 | H | 97.1 | Very high | 93.4 | Very high | 3 Ų | 3 | 40.4 Ų | 40.4 | 1% | 0.014 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -68.6 | -32.2 | -177.4 | -71.4 | 83.3 | 0 | 0 | 0 | 112.4 | Y106 F195 F246 V247 | Y106-H250 AromaticContact CE1-NE2 3.5Å; Y106-H250 WeakPolarHBondContact CE1-NE2 3.25Å; Y106-H250 AromaticContact CZ-NE2 3.52Å; Y106-H250 PolarHBondContact OH-NE2 3.35Å; F195-H250 HydrophobicContact CD1-CB 3.51Å; F195-H250 AromaticContact CD1-CD2 3.47Å; F195-H250 VanDerWaalsContact CD1-CD2 3.47Å; F195-H250 WeakPolarHBondContact CD1-CD2 3.45Å; F195-H250 AromaticContact CD1-CG 3.4Å; F195-H250 VanDerWaalsContact CD1-CG 3.4Å; F195-H250 HydrophobicContact CD2-CB 4.39Å; F195-H250 AromaticContact CD2-CD2 3.78Å; F195-H250 AromaticContact CD2-CE1 3.47Å; F195-H250 VanDerWaalsContact CD2-CE1 3.47Å; F195-H250 WeakPolarHBondContact CD2-CE1 3.09Å; F195-H250 AromaticContact CD2-CG 3.62Å; F195-H250 AromaticContact CD2-ND1 3.42Å; F195-H250 WeakPolarHBondContact CD2-ND1 3.13Å; F195-H250 AromaticContact CD2-NE2 3.72Å; F195-H250 HydrophobicContact CE1-CB 3.29Å; F195-H250 AromaticContact CE1-CG 3.6Å; F195-H250 HydrophobicContact CE2-CB 4.2Å; F195-H250 AromaticContact CE2-CE1 3.99Å; F195-H250 AromaticContact CE2-CG 3.79Å; F195-H250 AromaticContact CE2-ND1 3.5Å; F195-H250 HydrophobicContact CG-CB 4.08Å; F195-H250 AromaticContact CG-CD2 3.26Å; F195-H250 WeakPolarHBondContact CG-CD2 3.47Å; F195-H250 AromaticContact CG-CE1 3.77Å; F195-H250 AromaticContact CG-CG 3.42Å; F195-H250 VanDerWaalsContact CG-CG 3.42Å; F195-H250 AromaticContact CG-ND1 3.73Å; F195-H250 AromaticContact CG-NE2 3.52Å; F195-H250 HydrophobicContact CZ-CB 3.67Å; F195-H250 AromaticContact CZ-CG 3.79Å; F195-H250 AromaticContact CZ-ND1 3.9Å; F246-H250 PolarHBondContact O-N 3.32Å; F246-H250 PolarHBondContact O-ND1 3.46Å; V247-H250 PolarHBondContact O-N 2.89Å |
| 251 | I | 96.3 | Very high | 93 | Very high | 94 Ų | 94 | 40.7 Ų | 40.7 | 48% | 0.482 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -67.7 | -50.5 | 171.4 | -67.6 | 175.5 | 0 | 0 | 0 | 110.6 | W196 V247 P248 Y249 R253 I254 P255 | W196-I251 HydrophobicContact CH2-CG1 4.16Å; V247-I251 HydrophobicContact CG1-CD1 3.55Å; V247-I251 HydrophobicContact CG1-CG1 4.16Å; V247-I251 WeakPolarHBondContact O-CG1 3.47Å; V247-I251 PolarHBondContact O-N 3Å; P248-I251 PolarHBondContact O-N 3.35Å; Y249-I251 VanDerWaalsContact C-N 3.31Å; Y249-I251 PolarHBondContact O-N 2.9Å; I251-R253 VanDerWaalsContact C-N 3.28Å; I251-R253 PolarHBondContact O-N 3.31Å; I251-I254 PolarHBondContact O-N 2.92Å; I251-P255 WeakPolarHBondContact O-CD 3.48Å |
| 252 | A | 95.6 | Very high | 92.6 | Very high | 15 Ų | 15 | 43.9 Ų | 43.9 | 12% | 0.124 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.1 | -29.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | P248 Y249 I254 P255 Y256 T280 | P248-A252 VanDerWaalsContact O-CB 3.27Å; P248-A252 WeakPolarHBondContact O-CB 3.42Å; P248-A252 PolarHBondContact O-N 2.95Å; Y249-A252 PolarHBondContact O-N 3.45Å; A252-I254 VanDerWaalsContact C-N 3.32Å; A252-I254 PolarHBondContact O-N 3.05Å; A252-P255 WeakPolarHBondContact O-CD 3.37Å; A252-P255 WeakPolarHBondContact O-CG 3.49Å; A252-Y256 WeakPolarHBondContact O-CB 3.5Å; A252-Y256 PolarHBondContact O-N 3.32Å; A252-T280 HydrophobicContact CB-CG2 4.09Å |
| 253 | R | 93.2 | Very high | 92 | Very high | 24 Ų | 24 | 48.8 Ų | 48.8 | 9% | 0.091 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.8 | -32.7 | 179.2 | -173.4 | -175.7 | -175.9 | -177.2 | 6.5 | 113.2 | Y106 N188 Y249 I251 T257 | Y106-R253 PolarHBondContact OH-NH1 3.45Å; N188-R253 PolarHBondContact ND2-NH2 2.88Å; N188-R253 VanDerWaalsContact OD1-CZ 3.3Å; N188-R253 PolarHBondContact OD1-NH2 2.89Å; Y249-R253 HydrophobicContact CE2-CB 4.43Å; Y249-R253 VanDerWaalsContact O-CB 3.22Å; Y249-R253 WeakPolarHBondContact O-CB 3.3Å; Y249-R253 PolarHBondContact O-N 3.36Å; Y249-R253 WeakPolarHBondContact OH-CD 3.2Å; I251-R253 VanDerWaalsContact C-N 3.28Å; I251-R253 PolarHBondContact O-N 3.31Å; R253-T257 WeakPolarHBondContact O-CB 3.35Å; R253-T257 PolarHBondContact O-N 2.84Å; R253-T257 PolarHBondContact O-OG1 3.12Å |
| 254 | I | 91.4 | Very high | 91.7 | Very high | 76 Ų | 76 | 51.4 Ų | 51.4 | 39% | 0.39 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.6 | -60.3 | -178.2 | -65.3 | 165.9 | 0 | 0 | 0 | 111.5 | W196 I251 A252 Y256 T257 K258 | W196-I254 HydrophobicContact CZ2-CD1 3.83Å; I251-I254 PolarHBondContact O-N 2.92Å; A252-I254 VanDerWaalsContact C-N 3.32Å; A252-I254 PolarHBondContact O-N 3.05Å; I254-Y256 VanDerWaalsContact C-N 3.3Å; I254-Y256 PolarHBondContact O-N 2.97Å; I254-T257 PolarHBondContact O-N 3.21Å; I254-K258 PolarHBondContact O-N 2.93Å; I254-K258 VanDerWaalsContact O-N 3.11Å |
| 255 | P | 92.7 | Very high | 91.4 | Very high | 44 Ų | 44 | 51.7 Ų | 51.7 | 29% | 0.286 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -65.9 | -32.8 | 179 | 27.6 | -35 | 0 | 0 | 0 | 111.9 | I251 A252 K258 S259 L273 | I251-P255 WeakPolarHBondContact O-CD 3.48Å; A252-P255 WeakPolarHBondContact O-CD 3.37Å; A252-P255 WeakPolarHBondContact O-CG 3.49Å; P255-K258 PolarHBondContact O-N 3.33Å; P255-S259 WeakPolarHBondContact O-CB 3.37Å; P255-S259 PolarHBondContact O-N 3.37Å; P255-L273 HydrophobicContact CB-CD1 4.41Å; P255-L273 HydrophobicContact CB-CD2 3.8Å; P255-L273 HydrophobicContact CG-CD2 3.89Å |
| 256 | Y | 92 | Very high | 91.1 | Very high | 49 Ų | 49 | 54.7 Ų | 54.7 | 19% | 0.192 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59.4 | -46.5 | 172.3 | 172.6 | -103.4 | 0 | 0 | 0 | 112.2 | A252 I254 K258 S259 Q260 L273 R274 K277 | A252-Y256 WeakPolarHBondContact O-CB 3.5Å; A252-Y256 PolarHBondContact O-N 3.32Å; I254-Y256 VanDerWaalsContact C-N 3.3Å; I254-Y256 PolarHBondContact O-N 2.97Å; Y256-K258 PolarHBondContact O-N 2.79Å; Y256-S259 PolarHBondContact O-N 3.25Å; Y256-S259 PolarHBondContact O-OG 3.49Å; Y256-Q260 HydrophobicContact CE1-CG 4.29Å; Y256-Q260 HydrophobicContact CE2-CG 4.22Å; Y256-Q260 WeakPolarHBondContact O-CG 3.48Å; Y256-Q260 PolarHBondContact O-N 3.36Å; Y256-L273 HydrophobicContact CD2-CB 4.27Å; Y256-R274 HydrophobicContact CD2-CB 4.4Å; Y256-R274 HydrophobicContact CE2-CB 3.96Å; Y256-R274 HydrophobicContact CE2-CG 4.2Å; Y256-K277 HydrophobicContact CD1-CB 4.26Å; Y256-K277 HydrophobicContact CD1-CD 4.22Å; Y256-K277 HydrophobicContact CD1-CG 3.88Å; Y256-K277 HydrophobicContact CD2-CB 4.24Å; Y256-K277 HydrophobicContact CE1-CD 4.13Å; Y256-K277 HydrophobicContact CE1-CG 4.31Å; Y256-K277 HydrophobicContact CG-CB 3.92Å; Y256-K277 HydrophobicContact CG-CG 4.06Å |
| 257 | T | 88.3 | Confident | 90.6 | Very high | 54 Ų | 54 | 58 Ų | 58 | 33% | 0.331 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.2 | -44 | -180 | -55.1 | 0 | 0 | 0 | 0 | 110.9 | R253 I254 S259 Q260 T261 | R253-T257 WeakPolarHBondContact O-CB 3.35Å; R253-T257 PolarHBondContact O-N 2.84Å; R253-T257 PolarHBondContact O-OG1 3.12Å; I254-T257 PolarHBondContact O-N 3.21Å; T257-S259 VanDerWaalsContact C-N 3.31Å; T257-S259 PolarHBondContact O-N 3.23Å; T257-Q260 PolarHBondContact O-N 2.97Å; T257-Q260 VanDerWaalsContact O-N 3.13Å; T257-T261 PolarHBondContact O-N 3.37Å; T257-T261 PolarHBondContact O-OG1 3.36Å |
| 258 | K | 88.3 | Confident | 90.3 | Very high | 102 Ų | 102 | 63.6 Ų | 63.6 | 44% | 0.443 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -58.8 | -42 | 174.9 | -71.4 | -170.3 | 173 | -166.3 | 0 | 112.3 | I254 P255 Y256 Q260 T261 E262 Y265 | I254-K258 PolarHBondContact O-N 2.93Å; I254-K258 VanDerWaalsContact O-N 3.11Å; P255-K258 PolarHBondContact O-N 3.33Å; Y256-K258 PolarHBondContact O-N 2.79Å; K258-Q260 PolarHBondContact O-N 2.94Å; K258-T261 PolarHBondContact O-N 2.7Å; K258-T261 PolarHBondContact O-OG1 3.12Å; K258-E262 WeakPolarHBondContact O-CB 3.39Å; K258-E262 PolarHBondContact O-N 2.96Å; K258-Y265 HydrophobicContact CB-CE2 4.16Å |
| 259 | S | 90 | Very high | 89.9 | Confident | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -67.3 | -18.4 | 179.5 | 80 | 0 | 0 | 0 | 0 | 114.2 | P255 Y256 T257 Y265 K270 | P255-S259 WeakPolarHBondContact O-CB 3.37Å; P255-S259 PolarHBondContact O-N 3.37Å; Y256-S259 PolarHBondContact O-N 3.25Å; Y256-S259 PolarHBondContact O-OG 3.49Å; T257-S259 VanDerWaalsContact C-N 3.31Å; T257-S259 PolarHBondContact O-N 3.23Å; S259-Y265 VanDerWaalsContact CA-CD2 3.44Å; S259-K270 WeakPolarHBondContact O-CE 3.27Å |
| 260 | Q | 83.1 | Confident | 89.6 | Confident | 104 Ų | 104 | 67.3 Ų | 67.3 | 49% | 0.486 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -83.4 | -23.3 | 172.8 | -59 | -47.1 | -75.6 | 0 | 0 | 113.2 | Y256 T257 K258 | Y256-Q260 HydrophobicContact CE1-CG 4.29Å; Y256-Q260 HydrophobicContact CE2-CG 4.22Å; Y256-Q260 WeakPolarHBondContact O-CG 3.48Å; Y256-Q260 PolarHBondContact O-N 3.36Å; T257-Q260 PolarHBondContact O-N 2.97Å; T257-Q260 VanDerWaalsContact O-N 3.13Å; K258-Q260 PolarHBondContact O-N 2.94Å |
| 261 | T | 82.1 | Confident | 89.2 | Confident | 110 Ų | 110 | 68.2 Ų | 68.2 | 68% | 0.675 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -105.1 | -27 | -175.3 | 53 | 0 | 0 | 0 | 0 | 113.7 | T257 K258 | T257-T261 PolarHBondContact O-N 3.37Å; T257-T261 PolarHBondContact O-OG1 3.36Å; K258-T261 PolarHBondContact O-N 2.7Å; K258-T261 PolarHBondContact O-OG1 3.12Å |
| 262 | E | 84.6 | Confident | 89.1 | Confident | 68 Ų | 68 | 67.7 Ų | 67.7 | 32% | 0.318 | 37% | 0.366 | S | S | . | . | trans | -101.6 | 137.9 | -173.6 | -61.4 | 177.4 | -151.5 | 0 | 0 | 111.6 | K258 H264 Y265 | K258-E262 WeakPolarHBondContact O-CB 3.39Å; K258-E262 PolarHBondContact O-N 2.96Å; E262-H264 PolarHBondContact O-N 3.05Å; E262-H264 IonicContact OE2-CE1 2.95Å; E262-H264 PolarHBondContact OE2-CE1 3.36Å; E262-H264 IonicContact OE2-ND1 3.37Å; E262-H264 PolarHBondContact OE2-ND1 3Å; E262-Y265 HydrophobicContact CB-CD2 4.13Å; E262-Y265 HydrophobicContact CB-CE2 4.12Å | ||
| 263 | A | 80.9 | Confident | 89 | Confident | 102 Ų | 102 | 68.3 Ų | 68.3 | 84% | 0.843 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.5 | -19 | -172.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y265 | A263-Y265 VanDerWaalsContact C-N 3.31Å; A263-Y265 PolarHBondContact O-N 2.85Å |
| 264 | H | 88.2 | Confident | 88.9 | Confident | 133 Ų | 133 | 69.4 Ų | 69.4 | 62% | 0.616 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.2 | -10.1 | -170.5 | 75.4 | -99.2 | 0 | 0 | 0 | 114.6 | E262 | E262-H264 PolarHBondContact O-N 3.05Å; E262-H264 IonicContact OE2-CE1 2.95Å; E262-H264 PolarHBondContact OE2-CE1 3.36Å; E262-H264 IonicContact OE2-ND1 3.37Å; E262-H264 PolarHBondContact OE2-ND1 3Å |
| 265 | Y | 88.8 | Confident | 89 | Confident | 52 Ų | 52 | 67.4 Ų | 67.4 | 20% | 0.204 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -78.5 | 125.9 | 179.5 | -73.9 | -91 | 0 | 0 | 0 | 111.3 | K258 S259 E262 A263 K270 L273 | K258-Y265 HydrophobicContact CB-CE2 4.16Å; S259-Y265 VanDerWaalsContact CA-CD2 3.44Å; E262-Y265 HydrophobicContact CB-CD2 4.13Å; E262-Y265 HydrophobicContact CB-CE2 4.12Å; A263-Y265 VanDerWaalsContact C-N 3.31Å; A263-Y265 PolarHBondContact O-N 2.85Å; Y265-K270 VanDerWaalsContact O-CE 3.24Å; Y265-K270 WeakPolarHBondContact O-CE 3.29Å; Y265-L273 HydrophobicContact CD1-CD1 4.14Å; Y265-L273 HydrophobicContact CE1-CD1 3.99Å |
| 266 | S | 89.8 | Confident | 89.2 | Confident | 62 Ų | 62 | 70.6 Ų | 70.6 | 43% | 0.434 | 37% | 0.372 | S | S | . | . | trans | -62.9 | 157.4 | 171.6 | 70.7 | 0 | 0 | 0 | 0 | 112 | Q268 S269 K270 | S266-Q268 VanDerWaalsContact C-N 3.31Å; S266-Q268 PolarHBondContact O-N 3.2Å; S266-S269 WeakPolarHBondContact O-CB 3.44Å; S266-S269 PolarHBondContact O-N 3.43Å; S266-S269 VanDerWaalsContact O-N 3.15Å; S266-S269 PolarHBondContact OG-N 3.1Å; S266-S269 PolarHBondContact OG-OG 3.23Å; S266-K270 PolarHBondContact O-N 3.14Å | ||
| 267 | C | 88 | Confident | 89.3 | Confident | 70 Ų | 70 | 69.3 Ų | 69.3 | 47% | 0.473 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -55.5 | -46.9 | 177.9 | -176.2 | 0 | 0 | 0 | 0 | 111.7 | C14 S269 K270 E271 | C14-C267 HydrophobicContact CB-CB 3.63Å; C14-C267 WeakPolarHBondContact CB-SG 3.27Å; C14-C267 WeakPolarHBondContact SG-CB 3.39Å; C14-C267 PolarHBondContact SG-O 3.13Å; C14-C267 VanDerWaalsContact SG-O 3.37Å; C14-C267 CovalentContact SG-SG 2.05Å; C14-C267 PolarHBondContact SG-SG 3.22Å; C267-S269 VanDerWaalsContact C-N 3.3Å; C267-S269 PolarHBondContact O-N 3.45Å; C267-K270 WeakPolarHBondContact O-CB 3.44Å; C267-K270 PolarHBondContact O-N 3.24Å; C267-K270 VanDerWaalsContact O-N 3.16Å; C267-E271 PolarHBondContact O-N 3.19Å |
| 268 | Q | 89.6 | Confident | 89.7 | Confident | 131 Ų | 131 | 67.9 Ų | 67.9 | 61% | 0.612 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -58.5 | -41.2 | 178.6 | -170.1 | -177.5 | 13.9 | 0 | 0 | 112.1 | S266 E271 I272 | S266-Q268 VanDerWaalsContact C-N 3.31Å; S266-Q268 PolarHBondContact O-N 3.2Å; Q268-E271 PolarHBondContact O-N 3.46Å; Q268-I272 HydrophobicContact CG-CD1 4.08Å; Q268-I272 WeakPolarHBondContact O-CG1 3.39Å; Q268-I272 PolarHBondContact O-N 2.97Å |
| 269 | S | 90.8 | Very high | 90.1 | Very high | 46 Ų | 46 | 66.8 Ų | 66.8 | 32% | 0.322 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -64.5 | -43.9 | 176.9 | -58.6 | 0 | 0 | 0 | 0 | 112 | S266 C267 E271 I272 L273 | S266-S269 WeakPolarHBondContact O-CB 3.44Å; S266-S269 PolarHBondContact O-N 3.43Å; S266-S269 VanDerWaalsContact O-N 3.15Å; S266-S269 PolarHBondContact OG-N 3.1Å; S266-S269 PolarHBondContact OG-OG 3.23Å; C267-S269 VanDerWaalsContact C-N 3.3Å; C267-S269 PolarHBondContact O-N 3.45Å; S269-E271 PolarHBondContact O-N 2.85Å; S269-I272 PolarHBondContact O-N 2.94Å; S269-L273 WeakPolarHBondContact O-CB 3.44Å; S269-L273 VanDerWaalsContact O-CG 3.24Å; S269-L273 WeakPolarHBondContact O-CG 3.46Å; S269-L273 PolarHBondContact O-N 2.94Å |
| 270 | K | 90.2 | Very high | 90.5 | Very high | 74 Ų | 74 | 67.8 Ų | 67.8 | 32% | 0.322 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -58.4 | -39 | 175.5 | -69 | 178.9 | -176.6 | 178.7 | 0 | 110.9 | S259 Y265 S266 C267 R274 | S259-K270 WeakPolarHBondContact O-CE 3.27Å; Y265-K270 VanDerWaalsContact O-CE 3.24Å; Y265-K270 WeakPolarHBondContact O-CE 3.29Å; S266-K270 PolarHBondContact O-N 3.14Å; C267-K270 WeakPolarHBondContact O-CB 3.44Å; C267-K270 PolarHBondContact O-N 3.24Å; C267-K270 VanDerWaalsContact O-N 3.16Å; K270-R274 WeakPolarHBondContact O-CB 3.4Å; K270-R274 PolarHBondContact O-N 3.31Å |
| 271 | E | 90.4 | Very high | 91.2 | Very high | 22 Ų | 22 | 63 Ų | 63 | 10% | 0.103 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -73.1 | -44.2 | -178 | -168 | 67.7 | 167.9 | 0 | 0 | 113.2 | K16 C267 Q268 S269 L273 R274 Y275 | K16-E271 VanDerWaalsContact CA-OE1 3.22Å; K16-E271 WeakPolarHBondContact CA-OE1 3.49Å; K16-E271 WeakPolarHBondContact CG-OE1 3.48Å; C267-E271 PolarHBondContact O-N 3.19Å; Q268-E271 PolarHBondContact O-N 3.46Å; S269-E271 PolarHBondContact O-N 2.85Å; E271-L273 VanDerWaalsContact C-N 3.32Å; E271-L273 PolarHBondContact O-N 3.5Å; E271-R274 VanDerWaalsContact CD-NH2 3.33Å; E271-R274 WeakPolarHBondContact O-CB 3.39Å; E271-R274 PolarHBondContact O-N 3.38Å; E271-R274 VanDerWaalsContact O-N 3.15Å; E271-R274 IonicContact OE1-CZ 2.63Å; E271-R274 IonicContact OE1-NE 3.51Å; E271-R274 IonicContact OE1-NH2 2.98Å; E271-R274 PolarHBondContact OE1-NH2 2.94Å; E271-R274 IonicContact OE2-CZ 3.35Å; E271-R274 IonicContact OE2-NE 3.47Å; E271-R274 PolarHBondContact OE2-NE 2.98Å; E271-R274 IonicContact OE2-NH2 2.65Å; E271-R274 PolarHBondContact OE2-NH2 3.32Å; E271-Y275 HydrophobicContact CG-CD2 4.45Å; E271-Y275 HydrophobicContact CG-CE2 3.63Å; E271-Y275 WeakPolarHBondContact O-CD2 3.31Å; E271-Y275 PolarHBondContact O-N 3.42Å; E271-Y275 PolarHBondContact OE1-OH 2.87Å |
| 272 | I | 92.1 | Very high | 91.9 | Very high | 83 Ų | 83 | 58.6 Ų | 58.6 | 43% | 0.426 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -58.9 | -46.2 | 173.1 | -69.3 | 167 | 0 | 0 | 0 | 110.4 | Q268 S269 R274 Y275 M276 | Q268-I272 HydrophobicContact CG-CD1 4.08Å; Q268-I272 WeakPolarHBondContact O-CG1 3.39Å; Q268-I272 PolarHBondContact O-N 2.97Å; S269-I272 PolarHBondContact O-N 2.94Å; I272-R274 VanDerWaalsContact C-N 3.26Å; I272-R274 PolarHBondContact O-N 2.71Å; I272-Y275 PolarHBondContact O-N 3.36Å; I272-M276 HydrophobicContact CG2-CG 4.33Å; I272-M276 WeakPolarHBondContact O-CG 3.38Å; I272-M276 PolarHBondContact O-N 3.42Å |
| 273 | L | 94.1 | Very high | 92.5 | Very high | 29 Ų | 29 | 58.5 Ų | 58.5 | 15% | 0.152 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.9 | -34.3 | 178.2 | -71.8 | 170.9 | 0 | 0 | 0 | 112.1 | P255 Y256 Y265 S269 E271 K277 | P255-L273 HydrophobicContact CB-CD1 4.41Å; P255-L273 HydrophobicContact CB-CD2 3.8Å; P255-L273 HydrophobicContact CG-CD2 3.89Å; Y256-L273 HydrophobicContact CD2-CB 4.27Å; Y265-L273 HydrophobicContact CD1-CD1 4.14Å; Y265-L273 HydrophobicContact CE1-CD1 3.99Å; S269-L273 WeakPolarHBondContact O-CB 3.44Å; S269-L273 VanDerWaalsContact O-CG 3.24Å; S269-L273 WeakPolarHBondContact O-CG 3.46Å; S269-L273 PolarHBondContact O-N 2.94Å; E271-L273 VanDerWaalsContact C-N 3.32Å; E271-L273 PolarHBondContact O-N 3.5Å; L273-K277 VanDerWaalsContact O-CB 3.28Å; L273-K277 WeakPolarHBondContact O-CB 3.3Å; L273-K277 PolarHBondContact O-N 3.22Å |
| 274 | R | 92.1 | Very high | 93.3 | Very high | 46 Ų | 46 | 53.6 Ų | 53.6 | 17% | 0.174 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.2 | -47.9 | 173.5 | -173.3 | 176.4 | 73.3 | 93.9 | -5.1 | 111.3 | Y256 K270 E271 I272 K277 E278 | Y256-R274 HydrophobicContact CD2-CB 4.4Å; Y256-R274 HydrophobicContact CE2-CB 3.96Å; Y256-R274 HydrophobicContact CE2-CG 4.2Å; K270-R274 WeakPolarHBondContact O-CB 3.4Å; K270-R274 PolarHBondContact O-N 3.31Å; E271-R274 VanDerWaalsContact CD-NH2 3.33Å; E271-R274 WeakPolarHBondContact O-CB 3.39Å; E271-R274 PolarHBondContact O-N 3.38Å; E271-R274 VanDerWaalsContact O-N 3.15Å; E271-R274 IonicContact OE1-CZ 2.63Å; E271-R274 IonicContact OE1-NE 3.51Å; E271-R274 IonicContact OE1-NH2 2.98Å; E271-R274 PolarHBondContact OE1-NH2 2.94Å; E271-R274 IonicContact OE2-CZ 3.35Å; E271-R274 IonicContact OE2-NE 3.47Å; E271-R274 PolarHBondContact OE2-NE 2.98Å; E271-R274 IonicContact OE2-NH2 2.65Å; E271-R274 PolarHBondContact OE2-NH2 3.32Å; I272-R274 VanDerWaalsContact C-N 3.26Å; I272-R274 PolarHBondContact O-N 2.71Å; R274-K277 PolarHBondContact O-N 2.65Å; R274-E278 PolarHBondContact O-N 2.03Å |
| 275 | Y | 93.7 | Very high | 93.8 | Very high | 35 Ų | 35 | 47.3 Ų | 47.3 | 14% | 0.137 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63 | -46.2 | 176.9 | -60.2 | -41.4 | 0 | 0 | 0 | 112.1 | N17 I20 T21 E271 I272 K277 E278 F279 | N17-Y275 WeakPolarHBondContact CA-OH 3.47Å; N17-Y275 WeakPolarHBondContact CB-OH 3.5Å; N17-Y275 PolarHBondContact N-OH 3.46Å; I20-Y275 HydrophobicContact CB-CE1 4.24Å; I20-Y275 HydrophobicContact CD1-CE1 4.47Å; I20-Y275 HydrophobicContact CD1-CE2 4.32Å; I20-Y275 HydrophobicContact CG2-CD1 3.81Å; I20-Y275 HydrophobicContact CG2-CE1 4.01Å; I20-Y275 HydrophobicContact CG2-CG 4.46Å; T21-Y275 HydrophobicContact CG2-CD1 4.13Å; T21-Y275 HydrophobicContact CG2-CE1 3.67Å; E271-Y275 HydrophobicContact CG-CD2 4.45Å; E271-Y275 HydrophobicContact CG-CE2 3.63Å; E271-Y275 WeakPolarHBondContact O-CD2 3.31Å; E271-Y275 PolarHBondContact O-N 3.42Å; E271-Y275 PolarHBondContact OE1-OH 2.87Å; I272-Y275 PolarHBondContact O-N 3.36Å; Y275-K277 VanDerWaalsContact C-N 3.29Å; Y275-K277 PolarHBondContact O-N 2.92Å; Y275-E278 PolarHBondContact O-N 2.89Å; Y275-E278 VanDerWaalsContact O-N 3.1Å; Y275-F279 VanDerWaalsContact O-CD2 3.29Å; Y275-F279 WeakPolarHBondContact O-CD2 3.36Å; Y275-F279 PolarHBondContact O-N 3.25Å |
| 276 | M | 95.4 | Very high | 94.2 | Very high | 110 Ų | 110 | 45.7 Ų | 45.7 | 54% | 0.542 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -56.9 | -45 | 176.7 | -70.7 | -64.2 | 175.3 | 0 | 0 | 111.1 | I272 T280 | I272-M276 HydrophobicContact CG2-CG 4.33Å; I272-M276 WeakPolarHBondContact O-CG 3.38Å; I272-M276 PolarHBondContact O-N 3.42Å; M276-T280 WeakPolarHBondContact O-CB 3.03Å; M276-T280 VanDerWaalsContact O-CG2 3.28Å; M276-T280 WeakPolarHBondContact O-CG2 3.4Å; M276-T280 PolarHBondContact O-N 3.26Å; M276-T280 PolarHBondContact O-OG1 2.86Å |
| 277 | K | 95.2 | Very high | 94.4 | Very high | 22 Ų | 22 | 42.7 Ų | 42.7 | 10% | 0.096 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.7 | -41.1 | 175.5 | 177.7 | -96.1 | 163.2 | 176.5 | 0 | 112.4 | Y249 Y256 L273 R274 Y275 T280 L281 | Y249-K277 HydrophobicContact CE2-CG 4.2Å; Y256-K277 HydrophobicContact CD1-CB 4.26Å; Y256-K277 HydrophobicContact CD1-CD 4.22Å; Y256-K277 HydrophobicContact CD1-CG 3.88Å; Y256-K277 HydrophobicContact CD2-CB 4.24Å; Y256-K277 HydrophobicContact CE1-CD 4.13Å; Y256-K277 HydrophobicContact CE1-CG 4.31Å; Y256-K277 HydrophobicContact CG-CB 3.92Å; Y256-K277 HydrophobicContact CG-CG 4.06Å; L273-K277 VanDerWaalsContact O-CB 3.28Å; L273-K277 WeakPolarHBondContact O-CB 3.3Å; L273-K277 PolarHBondContact O-N 3.22Å; R274-K277 PolarHBondContact O-N 2.65Å; Y275-K277 VanDerWaalsContact C-N 3.29Å; Y275-K277 PolarHBondContact O-N 2.92Å; K277-T280 PolarHBondContact O-OG1 3.01Å; K277-L281 WeakPolarHBondContact O-CB 3.11Å; K277-L281 PolarHBondContact O-N 3.31Å |
| 278 | E | 95.5 | Very high | 94.8 | Very high | 25 Ų | 25 | 39.4 Ų | 39.4 | 12% | 0.117 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -70.7 | -42.8 | 179.4 | -71.9 | -57.9 | 130.1 | 0 | 0 | 112.7 | I25 K77 R274 Y275 L281 L282 | I25-E278 HydrophobicContact CD1-CB 3.61Å; I25-E278 HydrophobicContact CD1-CG 4.26Å; K77-E278 IonicContact NZ-OE2 2.7Å; K77-E278 PolarHBondContact NZ-OE2 3.31Å; R274-E278 PolarHBondContact O-N 2.03Å; Y275-E278 PolarHBondContact O-N 2.89Å; Y275-E278 VanDerWaalsContact O-N 3.1Å; E278-L281 PolarHBondContact O-N 2.94Å; E278-L282 WeakPolarHBondContact O-CB 3.45Å; E278-L282 PolarHBondContact O-N 3.3Å |
| 279 | F | 97.1 | Very high | 95.1 | Very high | 78 Ų | 78 | 34.2 Ų | 34.2 | 34% | 0.342 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -66 | -41.6 | 177 | -82.7 | -69.4 | 0 | 0 | 0 | 112.2 | I20 I24 I25 L28 Y275 L281 L282 L283 | I20-F279 HydrophobicContact CG2-CE2 3.9Å; I20-F279 HydrophobicContact CG2-CZ 4.09Å; I24-F279 HydrophobicContact CG2-CE1 4.39Å; I24-F279 HydrophobicContact CG2-CZ 4.33Å; I25-F279 HydrophobicContact CG1-CE1 4.42Å; I25-F279 HydrophobicContact CG1-CZ 4.41Å; L28-F279 HydrophobicContact CD1-CE1 4.1Å; Y275-F279 VanDerWaalsContact O-CD2 3.29Å; Y275-F279 WeakPolarHBondContact O-CD2 3.36Å; Y275-F279 PolarHBondContact O-N 3.25Å; F279-L281 VanDerWaalsContact C-N 3.35Å; F279-L282 WeakPolarHBondContact O-CB 3.18Å; F279-L282 PolarHBondContact O-N 2.9Å; F279-L283 PolarHBondContact O-N 3.01Å |
| 280 | T | 97.9 | Very high | 95.1 | Very high | 22 Ų | 22 | 34 Ų | 34 | 14% | 0.135 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -70.7 | -31.9 | 175.9 | 55.5 | 0 | 0 | 0 | 0 | 112.2 | P248 A252 M276 K277 L283 S284 | P248-T280 HydrophobicContact CB-CG2 3.72Å; A252-T280 HydrophobicContact CB-CG2 4.09Å; M276-T280 WeakPolarHBondContact O-CB 3.03Å; M276-T280 VanDerWaalsContact O-CG2 3.28Å; M276-T280 WeakPolarHBondContact O-CG2 3.4Å; M276-T280 PolarHBondContact O-N 3.26Å; M276-T280 PolarHBondContact O-OG1 2.86Å; K277-T280 PolarHBondContact O-OG1 3.01Å; T280-L283 WeakPolarHBondContact O-CB 3.42Å; T280-L283 PolarHBondContact O-N 2.73Å; T280-S284 PolarHBondContact O-N 3.32Å |
| 281 | L | 97.9 | Very high | 95.2 | Very high | 4 Ų | 4 | 30.5 Ų | 30.5 | 2% | 0.021 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.1 | -40.5 | 171.2 | -178 | 62.5 | 0 | 0 | 0 | 111.9 | F101 Y102 Y249 K277 E278 F279 L283 S284 A285 | F101-L281 HydrophobicContact CE1-CD1 3.49Å; F101-L281 VanDerWaalsContact CE1-CD1 3.49Å; F101-L281 HydrophobicContact CE1-CG 4.29Å; F101-L281 HydrophobicContact CZ-CD1 3.77Å; F101-L281 HydrophobicContact CZ-CG 4.23Å; Y102-L281 HydrophobicContact CE1-CD1 3.88Å; Y102-L281 WeakPolarHBondContact OH-CD2 3.45Å; Y249-L281 HydrophobicContact CD2-CB 3.75Å; Y249-L281 HydrophobicContact CD2-CD1 3.91Å; Y249-L281 HydrophobicContact CD2-CG 4.44Å; Y249-L281 HydrophobicContact CE1-CD1 4.29Å; Y249-L281 HydrophobicContact CE2-CB 3.91Å; Y249-L281 HydrophobicContact CE2-CD1 3.64Å; Y249-L281 HydrophobicContact CE2-CG 4.25Å; Y249-L281 HydrophobicContact CG-CD1 4.36Å; K277-L281 WeakPolarHBondContact O-CB 3.11Å; K277-L281 PolarHBondContact O-N 3.31Å; E278-L281 PolarHBondContact O-N 2.94Å; F279-L281 VanDerWaalsContact C-N 3.35Å; L281-L283 VanDerWaalsContact C-N 3.33Å; L281-S284 CarbonylContact O-C 3.49Å; L281-S284 WeakPolarHBondContact O-CB 3.18Å; L281-S284 PolarHBondContact O-N 3.42Å; L281-A285 PolarHBondContact O-N 2.72Å |
| 282 | L | 97.8 | Very high | 95 | Very high | 17 Ų | 17 | 30.3 Ų | 30.3 | 9% | 0.089 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.6 | -44.1 | 171 | 170.3 | 74.1 | 0 | 0 | 0 | 111 | L28 Y29 V32 E278 F279 S284 A285 A286 | L28-L282 HydrophobicContact CB-CD1 4.05Å; L28-L282 HydrophobicContact CB-CD2 3.52Å; L28-L282 HydrophobicContact CB-CG 4.42Å; L28-L282 HydrophobicContact CD1-CD2 3.55Å; L28-L282 HydrophobicContact CG-CD2 4.15Å; Y29-L282 HydrophobicContact CD1-CD1 4.15Å; Y29-L282 HydrophobicContact CD2-CB 4.47Å; Y29-L282 HydrophobicContact CD2-CD1 3.48Å; Y29-L282 VanDerWaalsContact CD2-CD1 3.48Å; Y29-L282 HydrophobicContact CE1-CD1 4.29Å; Y29-L282 HydrophobicContact CE2-CB 3.81Å; Y29-L282 HydrophobicContact CE2-CD1 3.6Å; Y29-L282 HydrophobicContact CE2-CG 4.3Å; Y29-L282 HydrophobicContact CG-CD1 3.75Å; V32-L282 HydrophobicContact CG2-CD1 4.11Å; E278-L282 WeakPolarHBondContact O-CB 3.45Å; E278-L282 PolarHBondContact O-N 3.3Å; F279-L282 WeakPolarHBondContact O-CB 3.18Å; F279-L282 PolarHBondContact O-N 2.9Å; L282-S284 VanDerWaalsContact C-N 3.28Å; L282-S284 PolarHBondContact O-N 3.47Å; L282-A285 CarbonylContact O-C 3.6Å; L282-A285 WeakPolarHBondContact O-CB 3.42Å; L282-A285 PolarHBondContact O-N 2.95Å; L282-A285 VanDerWaalsContact O-N 3.12Å; L282-A286 PolarHBondContact O-N 3.38Å |
| 283 | L | 97.6 | Very high | 94.6 | Very high | 65 Ų | 65 | 29.8 Ų | 29.8 | 34% | 0.34 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -62.4 | -37.2 | 175.5 | -174.9 | 60.6 | 0 | 0 | 0 | 111.8 | V244 P248 F279 T280 L281 A286 | V244-L283 HydrophobicContact CG1-CD1 4.12Å; V244-L283 WeakPolarHBondContact O-CD2 3.22Å; V244-L283 WeakPolarHBondContact O-CG 3.48Å; P248-L283 HydrophobicContact CB-CD2 4.38Å; P248-L283 HydrophobicContact CG-CD2 4.08Å; F279-L283 PolarHBondContact O-N 3.01Å; T280-L283 WeakPolarHBondContact O-CB 3.42Å; T280-L283 PolarHBondContact O-N 2.73Å; L281-L283 VanDerWaalsContact C-N 3.33Å; L283-A286 WeakPolarHBondContact O-CB 3.2Å; L283-A286 PolarHBondContact O-N 3.26Å |
| 284 | S | 97.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -65.2 | -39.4 | 171.7 | -173.2 | 0 | 0 | 0 | 0 | 112.4 | M105 C245 F246 T280 L281 L282 A286 N287 | M105-S284 PolarHBondContact SD-OG 3.16Å; M105-S284 VanDerWaalsContact SD-OG 3.32Å; C245-S284 WeakPolarHBondContact O-CA 3.27Å; C245-S284 VanDerWaalsContact O-CB 3.29Å; C245-S284 WeakPolarHBondContact O-CB 3.39Å; C245-S284 PolarHBondContact O-N 2.86Å; F246-S284 WeakPolarHBondContact CD1-OG 3.27Å; T280-S284 PolarHBondContact O-N 3.32Å; L281-S284 CarbonylContact O-C 3.49Å; L281-S284 WeakPolarHBondContact O-CB 3.18Å; L281-S284 PolarHBondContact O-N 3.42Å; L282-S284 VanDerWaalsContact C-N 3.28Å; L282-S284 PolarHBondContact O-N 3.47Å; S284-A286 VanDerWaalsContact C-N 3.28Å; S284-A286 PolarHBondContact O-N 3.04Å; S284-N287 WeakPolarHBondContact O-CB 3.35Å; S284-N287 PolarHBondContact O-N 3.33Å; S284-N287 PolarHBondContact O-OD1 3.31Å |
| 285 | A | 97.5 | Very high | 93.8 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -67.8 | -29.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y29 F74 F101 L281 L282 N287 V288 | Y29-A285 HydrophobicContact CE1-CB 3.65Å; F74-A285 HydrophobicContact CE1-CB 4.17Å; F74-A285 HydrophobicContact CZ-CB 3.92Å; F101-A285 HydrophobicContact CE2-CB 3.77Å; F101-A285 HydrophobicContact CZ-CB 3.9Å; L281-A285 PolarHBondContact O-N 2.72Å; L282-A285 CarbonylContact O-C 3.6Å; L282-A285 WeakPolarHBondContact O-CB 3.42Å; L282-A285 PolarHBondContact O-N 2.95Å; L282-A285 VanDerWaalsContact O-N 3.12Å; A285-N287 PolarHBondContact O-N 3.43Å; A285-N287 VanDerWaalsContact O-N 3.12Å; A285-N287 PolarHBondContact O-OD1 3Å; A285-V288 WeakPolarHBondContact O-CG2 3.44Å; A285-V288 PolarHBondContact O-N 3.47Å |
| 286 | A | 96.8 | Very high | 93.3 | Very high | 18 Ų | 18 | 28.2 Ų | 28.2 | 15% | 0.149 | 14% | 0.144 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.9 | -5.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V32 L282 L283 S284 V288 C289 L290 | V32-A286 HydrophobicContact CG1-CB 4.49Å; V32-A286 HydrophobicContact CG2-CB 4.19Å; L282-A286 PolarHBondContact O-N 3.38Å; L283-A286 WeakPolarHBondContact O-CB 3.2Å; L283-A286 PolarHBondContact O-N 3.26Å; S284-A286 VanDerWaalsContact C-N 3.28Å; S284-A286 PolarHBondContact O-N 3.04Å; A286-V288 PolarHBondContact O-N 3.33Å; A286-C289 WeakPolarHBondContact O-CB 3.39Å; A286-C289 PolarHBondContact O-N 2.88Å; A286-L290 PolarHBondContact O-N 2.94Å |
| 287 | N | 95.7 | Very high | 92.5 | Very high | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -53.5 | -37.5 | 170.6 | 83.5 | -62.1 | 0 | 0 | 0 | 111.5 | D67 C245 F246 S284 A285 C289 L290 D291 | D67-N287 PolarHBondContact OD1-ND2 3.09Å; C245-N287 HydrophobicContact CB-CB 3.89Å; F246-N287 HydrophobicContact CE1-CB 4.14Å; F246-N287 HydrophobicContact CZ-CB 3.75Å; S284-N287 WeakPolarHBondContact O-CB 3.35Å; S284-N287 PolarHBondContact O-N 3.33Å; S284-N287 PolarHBondContact O-OD1 3.31Å; A285-N287 PolarHBondContact O-N 3.43Å; A285-N287 VanDerWaalsContact O-N 3.12Å; A285-N287 PolarHBondContact O-OD1 3Å; N287-C289 PolarHBondContact O-N 3.15Å; N287-L290 PolarHBondContact O-N 3.1Å; N287-D291 PolarHBondContact ND2-OD2 3.22Å; N287-D291 VanDerWaalsContact O-CG 3.27Å; N287-D291 PolarHBondContact O-N 3.24Å |
| 288 | V | 96.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -58.9 | -26.1 | -180 | -52 | 0 | 0 | 0 | 0 | 111.9 | V32 N40 D67 M70 F74 A285 A286 P292 | V32-V288 HydrophobicContact CG1-CG2 4.13Å; N40-V288 PolarHBondContact ND2-O 3.21Å; D67-V288 HydrophobicContact CB-CB 4.08Å; D67-V288 HydrophobicContact CB-CG1 3.81Å; M70-V288 HydrophobicContact CE-CG1 4.44Å; M70-V288 HydrophobicContact SD-CG1 4.23Å; F74-V288 HydrophobicContact CE2-CG2 3.94Å; F74-V288 HydrophobicContact CZ-CG1 4.2Å; F74-V288 HydrophobicContact CZ-CG2 4.3Å; A285-V288 WeakPolarHBondContact O-CG2 3.44Å; A285-V288 PolarHBondContact O-N 3.47Å; A286-V288 PolarHBondContact O-N 3.33Å; V288-P292 WeakPolarHBondContact O-CD 3.28Å |
| 289 | C | 94.8 | Very high | 91 | Very high | 22 Ų | 22 | 23.7 Ų | 23.7 | 15% | 0.149 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -86.5 | -25.7 | 176.1 | -58.5 | 0 | 0 | 0 | 0 | 112.9 | V32 L39 A286 N287 | V32-C289 PolarHBondContact O-SG 3.46Å; L39-C289 HydrophobicContact CD1-CB 4.16Å; A286-C289 WeakPolarHBondContact O-CB 3.39Å; A286-C289 PolarHBondContact O-N 2.88Å; N287-C289 PolarHBondContact O-N 3.15Å |
| 290 | L | 92.1 | Very high | 90.3 | Very high | 43 Ų | 43 | 24.1 Ų | 24.1 | 23% | 0.225 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -94.7 | -25 | -173.5 | -64.1 | 178.4 | 0 | 0 | 0 | 112.9 | V241 C245 A286 N287 I293 | V241-L290 HydrophobicContact CG1-CB 3.92Å; V241-L290 HydrophobicContact CG2-CB 4.05Å; C245-L290 VanDerWaalsContact SG-CD1 3.54Å; A286-L290 PolarHBondContact O-N 2.94Å; N287-L290 PolarHBondContact O-N 3.1Å; L290-I293 HydrophobicContact CD2-CD1 3.72Å; L290-I293 WeakPolarHBondContact O-CB 3.34Å; L290-I293 WeakPolarHBondContact O-CG1 3.41Å; L290-I293 PolarHBondContact O-N 2.98Å |
| 291 | D | 90.9 | Very high | 89.6 | Confident | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.3 | -35.8 | 177.6 | -69.3 | 0.7 | 0 | 0 | 0 | 114 | I63 D67 F112 V241 N287 I293 I294 Y295 | I63-D291 HydrophobicContact CG2-CB 4.3Å; I63-D291 WeakPolarHBondContact CG2-OD2 3.43Å; D67-D291 VanDerWaalsContact OD2-OD2 3.05Å; F112-D291 WeakPolarHBondContact CZ-OD1 3.39Å; V241-D291 VanDerWaalsContact CG1-OD1 3.31Å; V241-D291 WeakPolarHBondContact CG1-OD1 3.31Å; N287-D291 PolarHBondContact ND2-OD2 3.22Å; N287-D291 VanDerWaalsContact O-CG 3.27Å; N287-D291 PolarHBondContact O-N 3.24Å; D291-I293 PolarHBondContact O-N 3.35Å; D291-I293 VanDerWaalsContact O-N 3.14Å; D291-I294 WeakPolarHBondContact O-CA 3.39Å; D291-I294 VanDerWaalsContact O-CB 3.25Å; D291-I294 WeakPolarHBondContact O-CB 3.33Å; D291-I294 PolarHBondContact O-N 3.35Å; D291-Y295 HydrophobicContact CB-CE1 4.12Å; D291-Y295 WeakPolarHBondContact CB-OH 3.48Å; D291-Y295 VanDerWaalsContact O-CD1 3.25Å; D291-Y295 WeakPolarHBondContact O-CD1 3.37Å; D291-Y295 WeakPolarHBondContact O-CE1 3.08Å; D291-Y295 PolarHBondContact O-N 3.42Å; D291-Y295 VanDerWaalsContact O-N 3.09Å |
| 292 | P | 87.2 | Confident | 89.1 | Confident | 18 Ų | 18 | 24.6 Ų | 24.6 | 12% | 0.117 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -52.2 | -31.9 | 168.3 | -29.1 | 34.7 | 0 | 0 | 0 | 115.1 | L39 V288 I294 Y295 F296 | L39-P292 HydrophobicContact CB-CB 4.36Å; L39-P292 HydrophobicContact CB-CG 3.68Å; V288-P292 WeakPolarHBondContact O-CD 3.28Å; P292-I294 VanDerWaalsContact C-N 3.32Å; P292-Y295 VanDerWaalsContact CA-CD2 3.48Å; P292-Y295 HydrophobicContact CB-CD2 4.37Å; P292-Y295 HydrophobicContact CG-CE2 4.34Å; P292-Y295 PolarHBondContact O-N 3.35Å; P292-F296 PolarHBondContact O-N 2.68Å |
| 293 | I | 83 | Confident | 88.6 | Confident | 71 Ų | 71 | 25 Ų | 25 | 36% | 0.364 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -63.8 | -43.2 | 174.5 | -57.2 | 175.8 | 0 | 0 | 0 | 109.6 | L290 D291 Y295 F296 F297 | L290-I293 HydrophobicContact CD2-CD1 3.72Å; L290-I293 WeakPolarHBondContact O-CB 3.34Å; L290-I293 WeakPolarHBondContact O-CG1 3.41Å; L290-I293 PolarHBondContact O-N 2.98Å; D291-I293 PolarHBondContact O-N 3.35Å; D291-I293 VanDerWaalsContact O-N 3.14Å; I293-Y295 VanDerWaalsContact C-N 3.31Å; I293-Y295 PolarHBondContact O-N 2.94Å; I293-F296 PolarHBondContact O-N 3.06Å; I293-F297 HydrophobicContact CG2-CD2 3.64Å; I293-F297 HydrophobicContact CG2-CE2 3.56Å; I293-F297 WeakPolarHBondContact O-CD2 3.28Å; I293-F297 PolarHBondContact O-N 3.4Å; I293-F297 VanDerWaalsContact O-N 3.14Å |
| 294 | I | 84.6 | Confident | 88.1 | Confident | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.005 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -62.3 | -41.9 | 176.3 | -63.1 | 157.1 | 0 | 0 | 0 | 109.8 | L60 F112 I238 V241 D291 P292 F296 F297 L298 | L60-I294 HydrophobicContact CD2-CG2 4.39Å; F112-I294 HydrophobicContact CE1-CD1 3.35Å; F112-I294 HydrophobicContact CZ-CD1 3.43Å; F112-I294 VanDerWaalsContact CZ-CD1 3.43Å; I238-I294 HydrophobicContact CG1-CG2 3.82Å; V241-I294 HydrophobicContact CB-CD1 3.69Å; V241-I294 HydrophobicContact CB-CG1 4.39Å; V241-I294 HydrophobicContact CG1-CD1 3.85Å; V241-I294 HydrophobicContact CG2-CD1 3.77Å; V241-I294 HydrophobicContact CG2-CG1 3.98Å; D291-I294 WeakPolarHBondContact O-CA 3.39Å; D291-I294 VanDerWaalsContact O-CB 3.25Å; D291-I294 WeakPolarHBondContact O-CB 3.33Å; D291-I294 PolarHBondContact O-N 3.35Å; P292-I294 VanDerWaalsContact C-N 3.32Å; I294-F296 PolarHBondContact O-N 3.13Å; I294-F297 PolarHBondContact O-N 3.41Å; I294-L298 HydrophobicContact CG2-CB 4.14Å; I294-L298 HydrophobicContact CG2-CD2 3.99Å; I294-L298 WeakPolarHBondContact O-CA 3.28Å; I294-L298 WeakPolarHBondContact O-CB 3.44Å; I294-L298 PolarHBondContact O-N 3.26Å |
| 295 | Y | 84.9 | Confident | 87.7 | Confident | 1 Ų | 1 | 27.9 Ų | 27.9 | 0% | 0.004 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -62.5 | -45.6 | -179.3 | -49.1 | -22.1 | 0 | 0 | 0 | 111.6 | S43 F47 L60 I63 V64 D291 P292 I293 F297 C299 F302 | S43-Y295 WeakPolarHBondContact OG-CD2 3.39Å; F47-Y295 HydrophobicContact CE2-CD1 4.27Å; F47-Y295 AromaticContact CE2-CD2 3.74Å; F47-Y295 HydrophobicContact CE2-CD2 3.74Å; F47-Y295 HydrophobicContact CE2-CE2 4.12Å; F47-Y295 AromaticContact CE2-CG 3.85Å; F47-Y295 HydrophobicContact CE2-CG 3.85Å; F47-Y295 HydrophobicContact CZ-CD1 4.28Å; F47-Y295 HydrophobicContact CZ-CD2 4.41Å; F47-Y295 HydrophobicContact CZ-CG 4.06Å; L60-Y295 HydrophobicContact CD1-CD1 4.4Å; L60-Y295 HydrophobicContact CD2-CD1 3.75Å; L60-Y295 HydrophobicContact CD2-CE1 3.83Å; L60-Y295 HydrophobicContact CG-CD1 4.45Å; I63-Y295 WeakPolarHBondContact CG2-OH 3.3Å; V64-Y295 HydrophobicContact CG2-CD2 4.36Å; V64-Y295 HydrophobicContact CG2-CE1 4.4Å; V64-Y295 HydrophobicContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CE2 3.45Å; V64-Y295 VanDerWaalsContact CG2-CZ 3.47Å; V64-Y295 VanDerWaalsContact CG2-OH 3.25Å; V64-Y295 WeakPolarHBondContact CG2-OH 3.25Å; D291-Y295 HydrophobicContact CB-CE1 4.12Å; D291-Y295 WeakPolarHBondContact CB-OH 3.48Å; D291-Y295 VanDerWaalsContact O-CD1 3.25Å; D291-Y295 WeakPolarHBondContact O-CD1 3.37Å; D291-Y295 WeakPolarHBondContact O-CE1 3.08Å; D291-Y295 PolarHBondContact O-N 3.42Å; D291-Y295 VanDerWaalsContact O-N 3.09Å; P292-Y295 VanDerWaalsContact CA-CD2 3.48Å; P292-Y295 HydrophobicContact CB-CD2 4.37Å; P292-Y295 HydrophobicContact CG-CE2 4.34Å; P292-Y295 PolarHBondContact O-N 3.35Å; I293-Y295 VanDerWaalsContact C-N 3.31Å; I293-Y295 PolarHBondContact O-N 2.94Å; Y295-F297 PolarHBondContact O-N 3.31Å; Y295-C299 WeakPolarHBondContact O-CA 3.44Å; Y295-C299 VanDerWaalsContact O-CB 3.29Å; Y295-C299 WeakPolarHBondContact O-CB 3.41Å; Y295-C299 PolarHBondContact O-N 3.42Å; Y295-F302 HydrophobicContact CD2-CE2 4.38Å; Y295-F302 HydrophobicContact CD2-CZ 4.19Å |
| 296 | F | 82.9 | Confident | 87.3 | Confident | 75 Ų | 75 | 29 Ų | 29 | 33% | 0.329 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -62.7 | -40.3 | 179.9 | -175.8 | -93.2 | 0 | 0 | 0 | 113.1 | P292 I293 I294 R303 L306 | P292-F296 PolarHBondContact O-N 2.68Å; I293-F296 PolarHBondContact O-N 3.06Å; I294-F296 PolarHBondContact O-N 3.13Å; F296-R303 HydrophobicContact CD2-CB 4.38Å; F296-R303 HydrophobicContact CD2-CG 3.85Å; F296-R303 HydrophobicContact CE2-CG 3.54Å; F296-R303 VanDerWaalsContact CZ-CD 3.47Å; F296-R303 HydrophobicContact CZ-CG 3.96Å; F296-R303 PolarHBondContact O-NH1 3.41Å; F296-R303 VanDerWaalsContact O-NH1 3.08Å; F296-L306 HydrophobicContact CD2-CD2 4.13Å |
| 297 | F | 78.6 | Confident | 86.9 | Confident | 52 Ų | 52 | 28.6 Ų | 28.6 | 23% | 0.228 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -78.7 | -50.4 | 178.5 | -73 | -60.4 | 0 | 0 | 0 | 111.6 | R233 N234 I293 I294 Y295 | R233-F297 HydrophobicContact CG-CD1 4.46Å; N234-F297 VanDerWaalsContact CG-C 3.46Å; N234-F297 PolarHBondContact ND2-O 3.26Å; N234-F297 VanDerWaalsContact OD1-C 3.31Å; N234-F297 PolarHBondContact OD1-O 2.9Å; I293-F297 HydrophobicContact CG2-CD2 3.64Å; I293-F297 HydrophobicContact CG2-CE2 3.56Å; I293-F297 WeakPolarHBondContact O-CD2 3.28Å; I293-F297 PolarHBondContact O-N 3.4Å; I293-F297 VanDerWaalsContact O-N 3.14Å; I294-F297 PolarHBondContact O-N 3.41Å; Y295-F297 PolarHBondContact O-N 3.31Å |
| 298 | L | 77.1 | Confident | 86.6 | Confident | 10 Ų | 10 | 36.9 Ų | 36.9 | 5% | 0.052 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -76 | -37.1 | -170.6 | -164.4 | 68.7 | 0 | 0 | 0 | 114.1 | F56 L60 I115 R119 N234 I238 I294 | F56-L298 HydrophobicContact CD2-CD2 3.98Å; F56-L298 HydrophobicContact CD2-CG 4.24Å; F56-L298 HydrophobicContact CE2-CD2 4.31Å; F56-L298 HydrophobicContact CE2-CG 4.12Å; L60-L298 HydrophobicContact CD1-CD2 4.27Å; L60-L298 HydrophobicContact CD2-CD2 4.22Å; I115-L298 HydrophobicContact CG2-CD2 4.01Å; R119-L298 VanDerWaalsContact NH2-CD1 3.34Å; N234-L298 HydrophobicContact CB-CD1 3.81Å; I238-L298 HydrophobicContact CD1-CD1 3.88Å; I238-L298 HydrophobicContact CD1-CD2 3.93Å; I238-L298 HydrophobicContact CG1-CD2 4.49Å; I294-L298 HydrophobicContact CG2-CB 4.14Å; I294-L298 HydrophobicContact CG2-CD2 3.99Å; I294-L298 WeakPolarHBondContact O-CA 3.28Å; I294-L298 WeakPolarHBondContact O-CB 3.44Å; I294-L298 PolarHBondContact O-N 3.26Å |
| 299 | C | 82.1 | Confident | 86.3 | Confident | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 20% | 0.198 | C | C | . | . | trans | -107.5 | 95.3 | -171.1 | -169.5 | 0 | 0 | 0 | 0 | 111.1 | F56 L60 Y295 F302 R303 | F56-C299 HydrophobicContact CE2-CB 4.24Å; L60-C299 HydrophobicContact CD1-CB 3.97Å; Y295-C299 WeakPolarHBondContact O-CA 3.44Å; Y295-C299 VanDerWaalsContact O-CB 3.29Å; Y295-C299 WeakPolarHBondContact O-CB 3.41Å; Y295-C299 PolarHBondContact O-N 3.42Å; C299-F302 HydrophobicContact CB-CB 3.64Å; C299-F302 WeakPolarHBondContact O-CB 3.29Å; C299-F302 PolarHBondContact O-N 3.11Å; C299-F302 WeakPolarHBondContact SG-CB 3.41Å; C299-R303 PolarHBondContact O-N 3.22Å | ||
| 300 | Q | 84.1 | Confident | 86 | Confident | 88 Ų | 88 | 44.6 Ų | 44.6 | 41% | 0.411 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -57.5 | -46.3 | 177.5 | 174.3 | 171.6 | -6.2 | 0 | 0 | 113.4 | F302 R303 E304 | Q300-F302 VanDerWaalsContact C-N 3.3Å; Q300-F302 PolarHBondContact O-N 3.43Å; Q300-R303 PolarHBondContact O-N 3.5Å; Q300-E304 HydrophobicContact CG-CG 4.36Å; Q300-E304 WeakPolarHBondContact CG-OE1 3.34Å; Q300-E304 PolarHBondContact NE2-OE1 2.79Å; Q300-E304 WeakPolarHBondContact O-CG 3.44Å; Q300-E304 PolarHBondContact O-N 3.37Å |
| 301 | P | 82.8 | Confident | 85.7 | Confident | 30 Ų | 30 | 50.6 Ų | 50.6 | 20% | 0.195 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.2 | -39.5 | 176.3 | -25.7 | 35.3 | 0 | 0 | 0 | 113.2 | V50 E304 I305 | V50-P301 HydrophobicContact CG1-CB 4.08Å; P301-E304 PolarHBondContact O-N 3.16Å; P301-I305 WeakPolarHBondContact O-CD1 3.34Å; P301-I305 WeakPolarHBondContact O-CG1 3.32Å; P301-I305 PolarHBondContact O-N 3.34Å |
| 302 | F | 87.2 | Confident | 85.4 | Confident | 5 Ų | 5 | 54.8 Ų | 54.8 | 2% | 0.022 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.6 | -49.9 | 175.4 | 176.5 | -86.1 | 0 | 0 | 0 | 111 | I46 F47 V50 Y295 C299 Q300 E304 I305 L306 | I46-F302 HydrophobicContact CB-CD2 3.92Å; I46-F302 HydrophobicContact CB-CE2 3.65Å; I46-F302 HydrophobicContact CB-CZ 4.32Å; I46-F302 HydrophobicContact CG1-CE2 4.43Å; I46-F302 HydrophobicContact CG2-CB 4.46Å; I46-F302 HydrophobicContact CG2-CD2 3.39Å; I46-F302 HydrophobicContact CG2-CE2 3.65Å; I46-F302 HydrophobicContact CG2-CG 3.91Å; I46-F302 HydrophobicContact CG2-CZ 4.36Å; F47-F302 HydrophobicContact CD1-CD2 4.17Å; F47-F302 AromaticContact CD2-CD2 3.91Å; F47-F302 HydrophobicContact CD2-CD2 3.91Å; F47-F302 AromaticContact CD2-CE2 3.8Å; F47-F302 HydrophobicContact CD2-CE2 3.8Å; F47-F302 AromaticContact CE1-CD2 3.94Å; F47-F302 HydrophobicContact CE1-CD2 3.94Å; F47-F302 AromaticContact CE2-CD2 3.67Å; F47-F302 HydrophobicContact CE2-CD2 3.67Å; F47-F302 AromaticContact CE2-CE2 3.64Å; F47-F302 HydrophobicContact CE2-CE2 3.64Å; F47-F302 HydrophobicContact CG-CD2 4.15Å; F47-F302 HydrophobicContact CG-CE2 4.4Å; F47-F302 AromaticContact CZ-CD2 3.67Å; F47-F302 HydrophobicContact CZ-CD2 3.67Å; F47-F302 HydrophobicContact CZ-CE2 4.12Å; F47-F302 HydrophobicContact CZ-CG 4.36Å; V50-F302 HydrophobicContact CG2-CB 4.16Å; Y295-F302 HydrophobicContact CD2-CE2 4.38Å; Y295-F302 HydrophobicContact CD2-CZ 4.19Å; C299-F302 HydrophobicContact CB-CB 3.64Å; C299-F302 WeakPolarHBondContact O-CB 3.29Å; C299-F302 PolarHBondContact O-N 3.11Å; C299-F302 WeakPolarHBondContact SG-CB 3.41Å; Q300-F302 VanDerWaalsContact C-N 3.3Å; Q300-F302 PolarHBondContact O-N 3.43Å; F302-E304 VanDerWaalsContact C-N 3.35Å; F302-E304 PolarHBondContact O-N 3.16Å; F302-I305 PolarHBondContact O-N 3.21Å; F302-L306 HydrophobicContact CE1-CD2 4.02Å; F302-L306 VanDerWaalsContact O-CB 3.24Å; F302-L306 WeakPolarHBondContact O-CB 3.24Å; F302-L306 PolarHBondContact O-N 3.44Å |
| 303 | R | 87.6 | Confident | 84.6 | Confident | 25 Ų | 25 | 58.6 Ų | 58.6 | 9% | 0.094 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 179.1 | -177.8 | 173.8 | 67.6 | -125.2 | -6.1 | 112.3 | F296 C299 Q300 L306 C307 | F296-R303 HydrophobicContact CD2-CB 4.38Å; F296-R303 HydrophobicContact CD2-CG 3.85Å; F296-R303 HydrophobicContact CE2-CG 3.54Å; F296-R303 VanDerWaalsContact CZ-CD 3.47Å; F296-R303 HydrophobicContact CZ-CG 3.96Å; F296-R303 PolarHBondContact O-NH1 3.41Å; F296-R303 VanDerWaalsContact O-NH1 3.08Å; C299-R303 PolarHBondContact O-N 3.22Å; Q300-R303 PolarHBondContact O-N 3.5Å; R303-L306 PolarHBondContact O-N 2.94Å; R303-C307 WeakPolarHBondContact O-CB 3.39Å; R303-C307 PolarHBondContact O-N 3.26Å; R303-C307 PolarHBondContact O-SG 2.87Å; R303-C307 VanDerWaalsContact O-SG 3.35Å |
| 304 | E | 86.9 | Confident | 83.6 | Confident | 88 Ų | 88 | 58.9 Ų | 58.9 | 41% | 0.411 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.9 | -46.4 | 179.6 | -74.6 | 166.9 | -174.8 | 0 | 0 | 111.8 | Q300 P301 F302 K308 | Q300-E304 HydrophobicContact CG-CG 4.36Å; Q300-E304 WeakPolarHBondContact CG-OE1 3.34Å; Q300-E304 PolarHBondContact NE2-OE1 2.79Å; Q300-E304 WeakPolarHBondContact O-CG 3.44Å; Q300-E304 PolarHBondContact O-N 3.37Å; P301-E304 PolarHBondContact O-N 3.16Å; F302-E304 VanDerWaalsContact C-N 3.35Å; F302-E304 PolarHBondContact O-N 3.16Å; E304-K308 VanDerWaalsContact O-CB 3.31Å; E304-K308 WeakPolarHBondContact O-CB 3.16Å; E304-K308 PolarHBondContact O-N 3.27Å |
| 305 | I | 88.1 | Confident | 82 | Confident | 38 Ų | 38 | 67.1 Ų | 67.1 | 20% | 0.195 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.4 | -42.4 | 177.8 | -67 | 163.2 | 0 | 0 | 0 | 110.8 | I46 V50 P301 F302 K308 K309 | I46-I305 HydrophobicContact CD1-CG2 4.12Å; I46-I305 HydrophobicContact CG2-CB 4.16Å; I46-I305 HydrophobicContact CG2-CG2 4.03Å; V50-I305 HydrophobicContact CG2-CD1 3.75Å; P301-I305 WeakPolarHBondContact O-CD1 3.34Å; P301-I305 WeakPolarHBondContact O-CG1 3.32Å; P301-I305 PolarHBondContact O-N 3.34Å; F302-I305 PolarHBondContact O-N 3.21Å; I305-K308 PolarHBondContact O-N 3.35Å; I305-K309 HydrophobicContact CG2-CG 4.22Å; I305-K309 WeakPolarHBondContact O-CB 3.45Å; I305-K309 WeakPolarHBondContact O-CG 3.37Å; I305-K309 PolarHBondContact O-N 2.94Å |
| 306 | L | 89.6 | Confident | 80.1 | Confident | 23 Ų | 23 | 71.5 Ų | 71.5 | 12% | 0.12 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -58.6 | -52.6 | 177.4 | 179 | 69.5 | 0 | 0 | 0 | 111.4 | V42 I46 F296 F302 R303 K308 K309 L310 | V42-L306 HydrophobicContact CG1-CD1 3.76Å; I46-L306 HydrophobicContact CD1-CB 4.36Å; I46-L306 HydrophobicContact CD1-CD1 4.09Å; I46-L306 HydrophobicContact CG1-CB 4.34Å; I46-L306 HydrophobicContact CG1-CD1 3.87Å; F296-L306 HydrophobicContact CD2-CD2 4.13Å; F302-L306 HydrophobicContact CE1-CD2 4.02Å; F302-L306 VanDerWaalsContact O-CB 3.24Å; F302-L306 WeakPolarHBondContact O-CB 3.24Å; F302-L306 PolarHBondContact O-N 3.44Å; R303-L306 PolarHBondContact O-N 2.94Å; L306-K308 VanDerWaalsContact C-N 3.31Å; L306-K308 PolarHBondContact O-N 2.63Å; L306-K309 PolarHBondContact O-N 2.75Å; L306-L310 HydrophobicContact CD1-CD1 3.51Å; L306-L310 HydrophobicContact CD1-CG 4.07Å; L306-L310 HydrophobicContact CG-CD1 3.96Å; L306-L310 WeakPolarHBondContact O-CB 3.23Å; L306-L310 WeakPolarHBondContact O-CG 3.45Å; L306-L310 PolarHBondContact O-N 3.02Å |
| 307 | C | 89 | Confident | 78.3 | Confident | 11 Ų | 11 | 71.6 Ų | 71.6 | 7% | 0.074 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.6 | -40.5 | 178.9 | -69.9 | 0 | 0 | 0 | 0 | 111.7 | R303 H311 I312 L314 | R303-C307 WeakPolarHBondContact O-CB 3.39Å; R303-C307 PolarHBondContact O-N 3.26Å; R303-C307 PolarHBondContact O-SG 2.87Å; R303-C307 VanDerWaalsContact O-SG 3.35Å; C307-H311 PolarHBondContact O-N 3.36Å; C307-H311 VanDerWaalsContact O-N 3.1Å; C307-I312 HydrophobicContact CB-CB 4.47Å; C307-I312 PolarHBondContact O-N 2.91Å; C307-L314 HydrophobicContact CB-CD1 3.53Å; C307-L314 HydrophobicContact CB-CG 3.88Å |
| 308 | K | 90.1 | Very high | 76.5 | Confident | 173 Ų | 173 | 73.8 Ų | 73.8 | 75% | 0.752 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -61.6 | -44.8 | 176.2 | -176.9 | 177.9 | 179.7 | 178 | 0 | 112.1 | E304 I305 L306 | E304-K308 VanDerWaalsContact O-CB 3.31Å; E304-K308 WeakPolarHBondContact O-CB 3.16Å; E304-K308 PolarHBondContact O-N 3.27Å; I305-K308 PolarHBondContact O-N 3.35Å; L306-K308 VanDerWaalsContact C-N 3.31Å; L306-K308 PolarHBondContact O-N 2.63Å |
| 309 | K | 89.6 | Confident | 74.7 | Confident | 96 Ų | 96 | 78.8 Ų | 78.8 | 42% | 0.417 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -72.8 | -35.3 | -178.2 | -74.1 | -72 | -172.8 | 175.7 | 0 | 112.9 | I46 I305 L306 H311 | I46-K309 HydrophobicContact CD1-CB 4.37Å; I46-K309 HydrophobicContact CD1-CG 4.34Å; I305-K309 HydrophobicContact CG2-CG 4.22Å; I305-K309 WeakPolarHBondContact O-CB 3.45Å; I305-K309 WeakPolarHBondContact O-CG 3.37Å; I305-K309 PolarHBondContact O-N 2.94Å; L306-K309 PolarHBondContact O-N 2.75Å; K309-H311 VanDerWaalsContact C-N 3.29Å; K309-H311 PolarHBondContact O-ND1 3.21Å |
| 310 | L | 88.1 | Confident | 72.8 | Confident | 89 Ų | 89 | 83.6 Ų | 83.6 | 47% | 0.466 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | 4.2 | 178.2 | -64.3 | -178.3 | 0 | 0 | 0 | 113.6 | L306 I312 | L306-L310 HydrophobicContact CD1-CD1 3.51Å; L306-L310 HydrophobicContact CD1-CG 4.07Å; L306-L310 HydrophobicContact CG-CD1 3.96Å; L306-L310 WeakPolarHBondContact O-CB 3.23Å; L306-L310 WeakPolarHBondContact O-CG 3.45Å; L306-L310 PolarHBondContact O-N 3.02Å; L310-I312 HydrophobicContact CB-CD1 3.73Å; L310-I312 HydrophobicContact CB-CG1 3.78Å; L310-I312 HydrophobicContact CD1-CD1 3.87Å; L310-I312 HydrophobicContact CG-CD1 4.48Å; L310-I312 PolarHBondContact O-N 3.15Å; L310-I312 VanDerWaalsContact O-N 3.08Å |
| 311 | H | 86.3 | Confident | 70.8 | Confident | 168 Ų | 168 | 83.4 Ų | 83.4 | 78% | 0.778 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.1 | 29.3 | -175.6 | -58.3 | 85.6 | 0 | 0 | 0 | 113.4 | C307 K309 P313 | C307-H311 PolarHBondContact O-N 3.36Å; C307-H311 VanDerWaalsContact O-N 3.1Å; K309-H311 VanDerWaalsContact C-N 3.29Å; K309-H311 PolarHBondContact O-ND1 3.21Å; H311-P313 WeakPolarHBondContact O-CD 3.22Å |
| 312 | I | 83.5 | Confident | 68.9 | Low | 88 Ų | 88 | 87.1 Ų | 87.1 | 45% | 0.451 | 45% | 0.447 | S | S | . | . | trans | -81.1 | 120.5 | 178.1 | -62.6 | 170.9 | 0 | 0 | 0 | 107.1 | C307 L310 L314 | C307-I312 HydrophobicContact CB-CB 4.47Å; C307-I312 PolarHBondContact O-N 2.91Å; L310-I312 HydrophobicContact CB-CD1 3.73Å; L310-I312 HydrophobicContact CB-CG1 3.78Å; L310-I312 HydrophobicContact CD1-CD1 3.87Å; L310-I312 HydrophobicContact CG-CD1 4.48Å; L310-I312 PolarHBondContact O-N 3.15Å; L310-I312 VanDerWaalsContact O-N 3.08Å; I312-L314 PolarHBondContact O-N 3.43Å; I312-L314 VanDerWaalsContact O-N 3.13Å | ||
| 313 | P | 69.7 | Low | 66.7 | Low | 99 Ų | 99 | 90 Ų | 90 | 64% | 0.643 | 47% | 0.467 | S | S | * | . | trans | -61.4 | 122.8 | 176.5 | 25.1 | -31.8 | 0 | 0 | 0 | 108.5 | H311 K315 | H311-P313 WeakPolarHBondContact O-CD 3.22Å; P313-K315 HydrophobicContact CB-CB 4.39Å; P313-K315 PolarHBondContact O-N 3.01Å | ||
| 314 | L | 62.6 | Low | 64.6 | Low | 77 Ų | 77 | 94.5 Ų | 94.5 | 40% | 0.403 | 48% | 0.484 | S | S | . | . | trans | -72 | 55.3 | 175.2 | -111.6 | 147.1 | 0 | 0 | 0 | 109.8 | C307 I312 A316 | C307-L314 HydrophobicContact CB-CD1 3.53Å; C307-L314 HydrophobicContact CB-CG 3.88Å; I312-L314 PolarHBondContact O-N 3.43Å; I312-L314 VanDerWaalsContact O-N 3.13Å; L314-A316 PolarHBondContact O-N 3Å; L314-A316 VanDerWaalsContact O-N 3.09Å | ||
| 315 | K | 51.1 | Low | 62.7 | Low | 174 Ų | 174 | 94.6 Ų | 94.6 | 76% | 0.757 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.9 | 21.9 | -166.8 | -152.7 | 179.3 | 178.8 | 177.6 | 0 | 114.3 | P313 | P313-K315 HydrophobicContact CB-CB 4.39Å; P313-K315 PolarHBondContact O-N 3.01Å |
| 316 | A | 44.9 | Very low | 60.7 | Low | 92 Ų | 92 | 100.5 Ų | 100.5 | 76% | 0.76 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -123.7 | 6.8 | -172 | 0 | 0 | 0 | 0 | 0 | 115.9 | L314 | L314-A316 PolarHBondContact O-N 3Å; L314-A316 VanDerWaalsContact O-N 3.09Å |
| 317 | Q | 46.6 | Very low | 58.5 | Low | 77 Ų | 77 | 108.8 Ų | 108.8 | 36% | 0.36 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -145.8 | -28.1 | 177.9 | -151.7 | 97.8 | 27 | 0 | 0 | 115.2 | D319 L320 D321 | Q317-D319 VanDerWaalsContact C-N 3.33Å; Q317-D319 PolarHBondContact O-N 3.37Å; Q317-L320 PolarHBondContact O-N 3.21Å; Q317-D321 PolarHBondContact O-N 2.93Å |
| 318 | N | 40.5 | Very low | 56.3 | Low | 99 Ų | 99 | 110 Ų | 110 | 53% | 0.529 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.5 | -30.5 | -176 | -73.8 | 2.3 | 0 | 0 | 0 | 113.6 | L320 D321 I322 | N318-L320 PolarHBondContact O-N 3.46Å; N318-D321 PolarHBondContact O-N 2.86Å; N318-I322 WeakPolarHBondContact O-CG1 3.35Å; N318-I322 PolarHBondContact O-N 2.95Å |
| 319 | D | 38.8 | Very low | 54.1 | Low | 114 Ų | 114 | 106.6 Ų | 106.6 | 61% | 0.61 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -69.7 | -20.8 | 178.2 | -65.2 | -25.5 | 0 | 0 | 0 | 113.1 | Q317 S323 | Q317-D319 VanDerWaalsContact C-N 3.33Å; Q317-D319 PolarHBondContact O-N 3.37Å; D319-S323 WeakPolarHBondContact O-CB 3.05Å; D319-S323 PolarHBondContact O-N 2.86Å; D319-S323 PolarHBondContact O-OG 3.45Å |
| 320 | L | 41.9 | Very low | 52.1 | Low | 101 Ų | 101 | 106.2 Ų | 106.2 | 53% | 0.529 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -88.1 | -24 | 176.7 | -124.5 | 121.4 | 0 | 0 | 0 | 113.1 | Q317 N318 S323 R324 | Q317-L320 PolarHBondContact O-N 3.21Å; N318-L320 PolarHBondContact O-N 3.46Å; L320-S323 WeakPolarHBondContact CA-OG 3.24Å; L320-S323 PolarHBondContact O-OG 2.93Å; L320-R324 WeakPolarHBondContact O-CG 3.5Å; L320-R324 PolarHBondContact O-N 2.99Å |
| 321 | D | 41.3 | Very low | 50 | Low | 84 Ų | 84 | 105.8 Ų | 105.8 | 45% | 0.449 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -82.3 | -39.7 | 172.9 | -75.8 | -23.8 | 0 | 0 | 0 | 110.6 | Q317 N318 S323 R324 T325 | Q317-D321 PolarHBondContact O-N 2.93Å; N318-D321 PolarHBondContact O-N 2.86Å; D321-S323 PolarHBondContact O-N 2.75Å; D321-R324 PolarHBondContact O-N 3.42Å; D321-T325 PolarHBondContact O-N 3.22Å; D321-T325 PolarHBondContact O-OG1 3.33Å |
| 322 | I | 43.5 | Very low | 48 | Very low | 109 Ų | 109 | 103.5 Ų | 103.5 | 56% | 0.559 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -63.8 | -40.9 | 175.4 | -66.1 | 169.3 | 0 | 0 | 0 | 111.4 | N318 R324 K326 | N318-I322 WeakPolarHBondContact O-CG1 3.35Å; N318-I322 PolarHBondContact O-N 2.95Å; I322-R324 VanDerWaalsContact C-N 3.33Å; I322-R324 PolarHBondContact O-N 2.92Å; I322-K326 WeakPolarHBondContact O-CB 3.46Å; I322-K326 PolarHBondContact O-N 3.39Å |
| 323 | S | 40.3 | Very low | 45.9 | Very low | 64 Ų | 64 | 106.3 Ų | 106.3 | 45% | 0.448 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -69.5 | -27 | 176.7 | 55 | 0 | 0 | 0 | 0 | 113.6 | D319 L320 D321 R327 | D319-S323 WeakPolarHBondContact O-CB 3.05Å; D319-S323 PolarHBondContact O-N 2.86Å; D319-S323 PolarHBondContact O-OG 3.45Å; L320-S323 WeakPolarHBondContact CA-OG 3.24Å; L320-S323 PolarHBondContact O-OG 2.93Å; D321-S323 PolarHBondContact O-N 2.75Å; S323-R327 WeakPolarHBondContact O-CB 3.47Å; S323-R327 PolarHBondContact O-N 3.04Å; S323-R327 VanDerWaalsContact O-N 3.12Å |
| 324 | R | 45.3 | Very low | 44.6 | Very low | 120 Ų | 120 | 104.7 Ų | 104.7 | 45% | 0.453 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -77.7 | -39.3 | 174.5 | -87.9 | 179.4 | 165.1 | 157.5 | -0.6 | 113.2 | S226 L320 D321 I322 K326 R327 G328 | S226-R324 PolarHBondContact OG-NH1 2.79Å; L320-R324 WeakPolarHBondContact O-CG 3.5Å; L320-R324 PolarHBondContact O-N 2.99Å; D321-R324 PolarHBondContact O-N 3.42Å; I322-R324 VanDerWaalsContact C-N 3.33Å; I322-R324 PolarHBondContact O-N 2.92Å; R324-K326 VanDerWaalsContact C-N 3.31Å; R324-R327 PolarHBondContact O-N 3.34Å; R324-G328 PolarHBondContact O-N 3.15Å |
| 325 | T | 46.3 | Very low | 43.8 | Very low | 90 Ų | 90 | 107.1 Ų | 107.1 | 55% | 0.552 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -65.2 | -39.2 | 173.6 | -43.6 | 0 | 0 | 0 | 0 | 110.5 | D321 R327 G328 N329 | D321-T325 PolarHBondContact O-N 3.22Å; D321-T325 PolarHBondContact O-OG1 3.33Å; T325-R327 PolarHBondContact O-N 3.33Å; T325-G328 PolarHBondContact O-N 3.25Å; T325-N329 PolarHBondContact O-N 3.16Å; T325-N329 VanDerWaalsContact O-N 3.13Å; T325-N329 PolarHBondContact O-OD1 2.86Å |
| 326 | K | 46.3 | Very low | 43.3 | Very low | 162 Ų | 162 | 105.2 Ų | 105.2 | 70% | 0.704 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -63.6 | -40.6 | 174.6 | -130.1 | 179.7 | -175.7 | -176.4 | 0 | 112.6 | I322 R324 T330 | I322-K326 WeakPolarHBondContact O-CB 3.46Å; I322-K326 PolarHBondContact O-N 3.39Å; R324-K326 VanDerWaalsContact C-N 3.31Å; K326-T330 PolarHBondContact O-N 2.05Å; K326-T330 PolarHBondContact O-OG1 3.37Å |
| 327 | R | 43.9 | Very low | 43.2 | Very low | 198 Ų | 198 | 106.4 Ų | 106.4 | 75% | 0.747 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -73.6 | -30.3 | 179 | -162.4 | 175.1 | -165.5 | 170.8 | 5.3 | 113.4 | S323 R324 T325 T331 | S323-R327 WeakPolarHBondContact O-CB 3.47Å; S323-R327 PolarHBondContact O-N 3.04Å; S323-R327 VanDerWaalsContact O-N 3.12Å; R324-R327 PolarHBondContact O-N 3.34Å; T325-R327 PolarHBondContact O-N 3.33Å; R327-T331 PolarHBondContact O-N 3.36Å; R327-T331 PolarHBondContact O-OG1 2.87Å |
| 328 | G | 42 | Very low | 42.7 | Very low | 35 Ų | 35 | 113.5 Ų | 113.5 | 36% | 0.361 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -69.6 | -39.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | R324 T325 T331 L332 | R324-G328 PolarHBondContact O-N 3.15Å; T325-G328 PolarHBondContact O-N 3.25Å; G328-T331 PolarHBondContact O-N 2.96Å; G328-T331 PolarHBondContact O-OG1 3.35Å; G328-L332 PolarHBondContact O-N 3.04Å |
| 329 | N | 44.5 | Very low | 42.9 | Very low | 102 Ų | 102 | 114.3 Ų | 114.3 | 55% | 0.545 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -71.4 | -34.4 | 177.7 | -71.4 | 9.8 | 0 | 0 | 0 | 112.7 | T325 T331 L332 E333 | T325-N329 PolarHBondContact O-N 3.16Å; T325-N329 VanDerWaalsContact O-N 3.13Å; T325-N329 PolarHBondContact O-OD1 2.86Å; N329-T331 VanDerWaalsContact C-N 3.33Å; N329-T331 PolarHBondContact O-N 2.86Å; N329-L332 PolarHBondContact O-N 3.35Å; N329-E333 PolarHBondContact O-N 2.74Å; N329-E333 VanDerWaalsContact O-N 3.13Å |
| 330 | T | 46 | Very low | 43.1 | Very low | 88 Ų | 88 | 114.3 Ų | 114.3 | 54% | 0.54 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70.2 | -27.8 | 176.5 | 7.8 | 0 | 0 | 0 | 0 | 113.3 | K326 S334 | K326-T330 PolarHBondContact O-N 2.05Å; K326-T330 PolarHBondContact O-OG1 3.37Å; T330-S334 PolarHBondContact O-OG 3.2Å |
| 331 | T | 45.5 | Very low | 43.1 | Very low | 81 Ų | 81 | 115 Ų | 115 | 50% | 0.497 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -79.3 | -19 | 172.9 | 32.2 | 0 | 0 | 0 | 0 | 113.9 | R327 G328 N329 S334 I335 | R327-T331 PolarHBondContact O-N 3.36Å; R327-T331 PolarHBondContact O-OG1 2.87Å; G328-T331 PolarHBondContact O-N 2.96Å; G328-T331 PolarHBondContact O-OG1 3.35Å; N329-T331 VanDerWaalsContact C-N 3.33Å; N329-T331 PolarHBondContact O-N 2.86Å; T331-S334 PolarHBondContact O-OG 3.3Å; T331-S334 VanDerWaalsContact O-OG 3.13Å; T331-I335 WeakPolarHBondContact O-CD1 2.97Å; T331-I335 WeakPolarHBondContact O-CG1 3.11Å |
| 332 | L | 42.8 | Very low | 43.2 | Very low | 119 Ų | 119 | 116.8 Ų | 116.8 | 62% | 0.623 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -82.9 | -41.5 | 175.6 | -149.9 | 82.3 | 0 | 0 | 0 | 110.5 | G328 N329 S334 I335 | G328-L332 PolarHBondContact O-N 3.04Å; N329-L332 PolarHBondContact O-N 3.35Å; L332-S334 PolarHBondContact O-N 3.04Å; L332-I335 PolarHBondContact O-N 3.04Å |
| 333 | E | 40.2 | Very low | 43.2 | Very low | 147 Ų | 147 | 117.3 Ų | 117.3 | 69% | 0.687 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -65.1 | -21.8 | 174.9 | -85.3 | 179.6 | 145.3 | 0 | 0 | 113.9 | N329 | N329-E333 PolarHBondContact O-N 2.74Å; N329-E333 VanDerWaalsContact O-N 3.13Å |
| 334 | S | 42.8 | Very low | 43.4 | Very low | 66 Ų | 66 | 120.9 Ų | 120.9 | 46% | 0.462 | 63% | 0.63 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84.7 | -9.8 | 176.9 | 58.4 | 0 | 0 | 0 | 0 | 114.7 | T330 T331 L332 | T330-S334 PolarHBondContact O-OG 3.2Å; T331-S334 PolarHBondContact O-OG 3.3Å; T331-S334 VanDerWaalsContact O-OG 3.13Å; L332-S334 PolarHBondContact O-N 3.04Å |
| 335 | I | 45.5 | Very low | 43.3 | Very low | 127 Ų | 127 | 120.9 Ų | 120.9 | 65% | 0.651 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | -17 | -179.9 | -65.7 | 174.7 | 0 | 0 | 0 | 111.5 | T331 L332 | T331-I335 WeakPolarHBondContact O-CD1 2.97Å; T331-I335 WeakPolarHBondContact O-CG1 3.11Å; L332-I335 PolarHBondContact O-N 3.04Å |
| 336 | D | 40.1 | Very low | 43.1 | Very low | 135 Ų | 135 | 123.3 Ų | 123.3 | 72% | 0.722 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.3 | 9.9 | 178.9 | -70.8 | -26.3 | 0 | 0 | 0 | 114.2 | ||
| 337 | T | 43.5 | Very low | 42.8 | Very low | 116 Ų | 116 | 120.1 Ų | 120.1 | 71% | 0.712 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.6 | 27 | 178.4 | 51.3 | 0 | 0 | 0 | 0 | 115.2 | ||
| 338 | L | 36.8 | Very low | 42.7 | Very low | 227 Ų | 227 | 113 Ų | 113 | 100% | 1.188 | 64% | 0.635 | S | S | * | * | trans | -133.8 | 0 | 171.1 | -104.2 | 158.4 | 0 | 0 | 0 | 112.7 |
Retrieved 338 of 338 residues in 107.2 ms
(Link to these results)