| 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 | 31.6 | Very low | 40.6 | Very low | 234 Ų | 234 | 106.6 Ų | 106.6 | 100% | 1.153 | 69% | 0.693 | S | S | * | * | 0 | 129.2 | 0 | -67.5 | 178.2 | -156.3 | 0 | 0 | 107.6 | |||||
| 2 | P | 25.4 | Very low | 42.9 | Very low | 121 Ų | 121 | 108.3 Ų | 108.3 | 79% | 0.786 | 70% | 0.699 | S | S | * | * | trans | -62 | 151.4 | 168.9 | 28 | -32.3 | 0 | 0 | 0 | 109.9 | ||||
| 3 | P | 30.6 | Very low | 45.6 | Very low | 98 Ų | 98 | 101.8 Ų | 101.8 | 64% | 0.636 | 66% | 0.658 | S | S | * | * | trans | -66.2 | 138.4 | -178.1 | 26.4 | -31.2 | 0 | 0 | 0 | 110.5 | I5 | P3-I5 PolarHBondContact O-N 3.2Š| ||
| 4 | A | 34 | Very low | 47.7 | Very low | 82 Ų | 82 | 99.8 Ų | 99.8 | 68% | 0.678 | 65% | 0.645 | S | S | * | * | trans | -58.3 | 110.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | G6 | A4-G6 PolarHBondContact O-N 3.38Š| ||
| 5 | I | 36 | Very low | 49.7 | Very low | 180 Ų | 180 | 96 Ų | 96 | 92% | 0.923 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -67.1 | 114.9 | 168.2 | -61.6 | 169.9 | 0 | 0 | 0 | 106.3 | P3 | P3-I5 PolarHBondContact O-N 3.2Š|
| 6 | G | 42.5 | Very low | 51.8 | Low | 54 Ų | 54 | 90.9 Ų | 90.9 | 56% | 0.557 | 59% | 0.586 | S | S | * | * | trans | 135 | 47.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | A4 F140 | A4-G6 PolarHBondContact O-N 3.38Å; G6-F140 WeakPolarHBondContact O-CZ 3.26Å | ||
| 7 | G | 40.7 | Very low | 54 | Low | 45 Ų | 45 | 89.4 Ų | 89.4 | 46% | 0.464 | 59% | 0.591 | S | S | . | * | P | Polyproline II helix | trans | -64.4 | 153.2 | 163.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | V9 | G7-V9 PolarHBondContact O-N 3.24Š|
| 8 | P | 48.3 | Very low | 56.1 | Low | 63 Ų | 63 | 91.6 Ų | 91.6 | 41% | 0.409 | 59% | 0.585 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 123.4 | 179.3 | 13.6 | -19.4 | 0 | 0 | 0 | 111.2 | G10 Y11 P13 | P8-G10 PolarHBondContact O-N 3.17Å; P8-Y11 HydrophobicContact CG-CD1 4.48Å; P8-Y11 WeakPolarHBondContact CG-O 3.36Å; P8-Y11 PolarHBondContact O-N 2.95Å; P8-P13 HydrophobicContact CG-CG 4.43Å |
| 9 | V | 42 | Very low | 57.9 | Low | 157 Ų | 157 | 86.7 Ų | 86.7 | 95% | 0.952 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.6 | 120.7 | 177.6 | -171.4 | 0 | 0 | 0 | 0 | 108.5 | G7 | G7-V9 PolarHBondContact O-N 3.24Š|
| 10 | G | 53.4 | Low | 59.7 | Low | 81 Ų | 81 | 87 Ų | 87 | 84% | 0.835 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 94.2 | -1.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | P8 | P8-G10 PolarHBondContact O-N 3.17Š|
| 11 | Y | 62.5 | Low | 61.4 | Low | 58 Ų | 58 | 84.2 Ų | 84.2 | 23% | 0.227 | 53% | 0.529 | C | S | . | . | trans | -151.6 | 117.4 | 175.7 | 170.4 | -98.9 | 0 | 0 | 0 | 111.6 | P8 P13 P14 K137 I198 | P8-Y11 HydrophobicContact CG-CD1 4.48Å; P8-Y11 WeakPolarHBondContact CG-O 3.36Å; P8-Y11 PolarHBondContact O-N 2.95Å; Y11-P13 HydrophobicContact CD1-CG 4.33Å; Y11-P13 HydrophobicContact CE1-CB 4.24Å; Y11-P13 HydrophobicContact CE1-CG 3.94Å; Y11-P13 WeakPolarHBondContact O-CD 3.49Å; Y11-P14 WeakPolarHBondContact OH-CD 3.38Å; Y11-K137 VanDerWaalsContact CE1-O 3.3Å; Y11-K137 WeakPolarHBondContact CE1-O 3.33Å; Y11-K137 PolarHBondContact OH-O 3.23Å; Y11-I198 HydrophobicContact CE2-CB 4.35Å; Y11-I198 HydrophobicContact CE2-CG1 4.39Å; Y11-I198 WeakPolarHBondContact OH-CD1 3.36Å; Y11-I198 VanDerWaalsContact OH-CG1 3.24Å; Y11-I198 WeakPolarHBondContact OH-CG1 3.16Å | ||
| 12 | T | 68.1 | Low | 64.4 | Low | 126 Ų | 126 | 73 Ų | 73 | 77% | 0.773 | 47% | 0.474 | S | S | * | . | trans | -91 | 115.5 | 172.6 | 50.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 13 | P | 77.2 | Confident | 67.7 | Low | 25 Ų | 25 | 67.7 Ų | 67.7 | 16% | 0.162 | 44% | 0.439 | C | S | . | . | trans | -57 | 137.7 | 174.2 | -24.3 | 35 | 0 | 0 | 0 | 111 | P8 Y11 E15 F140 | P8-P13 HydrophobicContact CG-CG 4.43Å; Y11-P13 HydrophobicContact CD1-CG 4.33Å; Y11-P13 HydrophobicContact CE1-CB 4.24Å; Y11-P13 HydrophobicContact CE1-CG 3.94Å; Y11-P13 WeakPolarHBondContact O-CD 3.49Å; P13-E15 VanDerWaalsContact C-N 3.25Å; P13-E15 PolarHBondContact O-N 3.21Å; P13-F140 HydrophobicContact CB-CB 4.34Å; P13-F140 HydrophobicContact CG-CB 3.83Å | ||
| 14 | P | 76.3 | Confident | 70.8 | Confident | 73 Ų | 73 | 67 Ų | 67 | 47% | 0.474 | 43% | 0.433 | S | S | . | . | trans | -69.5 | -15 | -175 | 23.5 | -32.3 | 0 | 0 | 0 | 114.6 | Y11 G16 Y138 I198 | Y11-P14 WeakPolarHBondContact OH-CD 3.38Å; P14-G16 VanDerWaalsContact C-N 3.27Å; P14-G16 PolarHBondContact O-N 3.39Å; P14-G16 VanDerWaalsContact O-N 3.13Å; P14-Y138 HydrophobicContact CG-CD1 3.76Å; P14-Y138 HydrophobicContact CG-CE1 4.23Å; P14-I198 HydrophobicContact CG-CD1 4.11Å | ||
| 15 | E | 77.6 | Confident | 73.7 | Confident | 43 Ų | 43 | 63 Ų | 63 | 20% | 0.201 | 40% | 0.401 | C | S | . | . | trans | 52.4 | 35.6 | 172.3 | -64.8 | -66.8 | 162.2 | 0 | 0 | 115.6 | P13 Y138 F140 K141 K142 | P13-E15 VanDerWaalsContact C-N 3.25Å; P13-E15 PolarHBondContact O-N 3.21Å; E15-Y138 PolarHBondContact N-O 2.85Å; E15-F140 VanDerWaalsContact OE1-CA 3.3Å; E15-F140 WeakPolarHBondContact OE1-CA 3.34Å; E15-F140 WeakPolarHBondContact OE1-CB 3.47Å; E15-F140 PolarHBondContact OE1-N 2.91Å; E15-K141 PolarHBondContact OE1-N 3.47Å; E15-K142 PolarHBondContact OE2-N 3.15Å; E15-K142 VanDerWaalsContact OE2-N 3.12Å | ||
| 16 | G | 83.1 | Confident | 76.5 | Confident | 14 Ų | 14 | 54.5 Ų | 54.5 | 14% | 0.144 | 36% | 0.357 | C | S | . | . | S | Bend | trans | 155.6 | -157.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | P14 W18 G19 | P14-G16 VanDerWaalsContact C-N 3.27Å; P14-G16 PolarHBondContact O-N 3.39Å; P14-G16 VanDerWaalsContact O-N 3.13Å; G16-W18 PolarHBondContact O-N 2.81Å; G16-G19 PolarHBondContact O-N 3.11Å |
| 17 | G | 89.4 | Confident | 79.1 | Confident | 65 Ų | 65 | 54.7 Ų | 54.7 | 67% | 0.67 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.2 | -122.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | G19 W20 | G17-G19 PolarHBondContact O-N 2.87Å; G17-G19 VanDerWaalsContact O-N 3.09Å; G17-W20 PolarHBondContact O-N 3.13Å |
| 18 | W | 91.8 | Very high | 81.7 | Confident | 129 Ų | 129 | 54.8 Ų | 54.8 | 49% | 0.489 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -60.1 | -18.9 | 177.3 | -159.4 | -91.3 | 0 | 0 | 0 | 113.6 | G16 W20 A21 V22 Y138 L194 | G16-W18 PolarHBondContact O-N 2.81Å; W18-W20 PolarHBondContact O-N 2.72Å; W18-A21 HydrophobicContact CD2-CB 4.25Å; W18-A21 HydrophobicContact CG-CB 4.46Å; W18-A21 WeakPolarHBondContact O-CB 3.46Å; W18-A21 PolarHBondContact O-N 2.89Å; W18-A21 VanDerWaalsContact O-N 3.09Å; W18-V22 PolarHBondContact O-N 3.03Å; W18-Y138 HydrophobicContact CB-CE1 4.25Å; W18-L194 HydrophobicContact CZ2-CD2 4.39Å; W18-L194 PolarHBondContact NE1-O 3.23Å |
| 19 | G | 90.4 | Very high | 83.9 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -56.4 | -34.7 | 172 | 0 | 0 | 0 | 0 | 0 | 112.7 | G16 G17 V22 V23 F139 | G16-G19 PolarHBondContact O-N 3.11Å; G17-G19 PolarHBondContact O-N 2.87Å; G17-G19 VanDerWaalsContact O-N 3.09Å; G19-V22 WeakPolarHBondContact O-CB 3.5Å; G19-V22 PolarHBondContact O-N 3.4Å; G19-V23 WeakPolarHBondContact O-CG2 3.33Å; G19-V23 PolarHBondContact O-N 3.3Å; G19-F139 WeakPolarHBondContact O-CE2 3.42Å |
| 20 | W | 94.1 | Very high | 86.4 | Confident | 91 Ų | 91 | 44.3 Ų | 44.3 | 35% | 0.345 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -71.9 | -34.1 | 176.3 | -65.7 | 116.6 | 0 | 0 | 0 | 112.8 | G17 W18 V22 V23 V24 F139 K142 L145 L149 | G17-W20 PolarHBondContact O-N 3.13Å; W18-W20 PolarHBondContact O-N 2.72Å; W20-V22 VanDerWaalsContact C-N 3.3Å; W20-V22 PolarHBondContact O-N 2.75Å; W20-V23 HydrophobicContact CE3-CB 4.4Å; W20-V23 HydrophobicContact CE3-CG2 4.25Å; W20-V23 WeakPolarHBondContact O-CB 3.47Å; W20-V23 PolarHBondContact O-N 3.32Å; W20-V24 PolarHBondContact O-N 3.01Å; W20-F139 HydrophobicContact CD2-CZ 4.11Å; W20-F139 HydrophobicContact CE3-CZ 4.32Å; W20-F139 HydrophobicContact CZ2-CE1 4.38Å; W20-K142 HydrophobicContact CZ2-CD 4.39Å; W20-L145 HydrophobicContact CH2-CD2 3.96Å; W20-L145 HydrophobicContact CH2-CG 4.41Å; W20-L149 HydrophobicContact CZ3-CD1 3.74Å |
| 21 | A | 95 | Very high | 88.4 | Confident | 29 Ų | 29 | 40.5 Ų | 40.5 | 24% | 0.24 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.2 | -37.7 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | W18 V23 V24 G25 | W18-A21 HydrophobicContact CD2-CB 4.25Å; W18-A21 HydrophobicContact CG-CB 4.46Å; W18-A21 WeakPolarHBondContact O-CB 3.46Å; W18-A21 PolarHBondContact O-N 2.89Å; W18-A21 VanDerWaalsContact O-N 3.09Å; A21-V23 VanDerWaalsContact C-N 3.34Å; A21-V24 PolarHBondContact O-N 3.17Å; A21-G25 PolarHBondContact O-N 3.29Å |
| 22 | V | 93.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -63.1 | -38.3 | 172.1 | 164.1 | 0 | 0 | 0 | 0 | 111.8 | W18 G19 W20 V24 G25 A26 M134 Y138 L194 M195 | W18-V22 PolarHBondContact O-N 3.03Å; G19-V22 WeakPolarHBondContact O-CB 3.5Å; G19-V22 PolarHBondContact O-N 3.4Å; W20-V22 VanDerWaalsContact C-N 3.3Å; W20-V22 PolarHBondContact O-N 2.75Å; V22-V24 VanDerWaalsContact C-N 3.34Å; V22-G25 PolarHBondContact O-N 3.13Å; V22-A26 WeakPolarHBondContact O-CB 3.28Å; V22-A26 PolarHBondContact O-N 3.47Å; V22-M134 HydrophobicContact CG1-CB 4.08Å; V22-Y138 HydrophobicContact CB-CD2 4.35Å; V22-Y138 HydrophobicContact CB-CE2 4.45Å; V22-Y138 HydrophobicContact CG1-CD2 4.1Å; V22-Y138 HydrophobicContact CG1-CE2 4.47Å; V22-Y138 HydrophobicContact CG2-CD2 4.03Å; V22-Y138 HydrophobicContact CG2-CE1 4.4Å; V22-Y138 HydrophobicContact CG2-CE2 3.65Å; V22-L194 WeakPolarHBondContact CG2-O 3.3Å; V22-M195 HydrophobicContact CB-SD 4.37Å; V22-M195 HydrophobicContact CG1-CE 4.35Å; V22-M195 HydrophobicContact CG1-SD 3.7Å; V22-M195 HydrophobicContact CG2-SD 4.28Å |
| 23 | V | 94.4 | Very high | 91.2 | Very high | 8 Ų | 8 | 32.3 Ų | 32.3 | 5% | 0.048 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.1 | -40.3 | 174 | 171.5 | 0 | 0 | 0 | 0 | 111.3 | G19 W20 A21 A26 F27 F139 A146 L149 | G19-V23 WeakPolarHBondContact O-CG2 3.33Å; G19-V23 PolarHBondContact O-N 3.3Å; W20-V23 HydrophobicContact CE3-CB 4.4Å; W20-V23 HydrophobicContact CE3-CG2 4.25Å; W20-V23 WeakPolarHBondContact O-CB 3.47Å; W20-V23 PolarHBondContact O-N 3.32Å; A21-V23 VanDerWaalsContact C-N 3.34Å; V23-A26 PolarHBondContact O-N 3.37Å; V23-F27 WeakPolarHBondContact O-CB 3.42Å; V23-F27 PolarHBondContact O-N 3.14Å; V23-F139 HydrophobicContact CG2-CD2 4.46Å; V23-F139 HydrophobicContact CG2-CE2 3.69Å; V23-F139 HydrophobicContact CG2-CZ 4.36Å; V23-A146 HydrophobicContact CG2-CB 3.75Å; V23-L149 HydrophobicContact CG1-CB 3.92Å; V23-L149 HydrophobicContact CG1-CD1 4.49Å |
| 24 | V | 96.1 | Very high | 91.9 | Very high | 83 Ų | 83 | 33 Ų | 33 | 50% | 0.503 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63.7 | -44.6 | 174.2 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | W20 A21 V22 A26 F27 I28 | W20-V24 PolarHBondContact O-N 3.01Å; A21-V24 PolarHBondContact O-N 3.17Å; V22-V24 VanDerWaalsContact C-N 3.34Å; V24-A26 VanDerWaalsContact C-N 3.31Å; V24-A26 PolarHBondContact O-N 2.99Å; V24-F27 WeakPolarHBondContact O-CB 3.38Å; V24-F27 PolarHBondContact O-N 3.33Å; V24-I28 HydrophobicContact CG1-CD1 4.36Å; V24-I28 WeakPolarHBondContact O-CG1 3.28Å; V24-I28 PolarHBondContact O-N 3.25Å; V24-I28 VanDerWaalsContact O-N 3.14Å |
| 25 | G | 95.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -59.4 | -43.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | A21 V22 I28 S29 | A21-G25 PolarHBondContact O-N 3.29Å; V22-G25 PolarHBondContact O-N 3.13Å; G25-I28 PolarHBondContact O-N 3.45Å; G25-S29 PolarHBondContact O-N 3.46Å; G25-S29 PolarHBondContact O-OG 3.05Å |
| 26 | A | 94.4 | Very high | 93.6 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -67.3 | -36.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V22 V23 V24 I28 S29 I30 A131 I135 A150 M195 | V22-A26 WeakPolarHBondContact O-CB 3.28Å; V22-A26 PolarHBondContact O-N 3.47Å; V23-A26 PolarHBondContact O-N 3.37Å; V24-A26 VanDerWaalsContact C-N 3.31Å; V24-A26 PolarHBondContact O-N 2.99Å; A26-I28 VanDerWaalsContact C-N 3.31Å; A26-I28 PolarHBondContact O-N 3.15Å; A26-S29 PolarHBondContact O-N 2.95Å; A26-I30 HydrophobicContact CB-CD1 4.44Å; A26-I30 WeakPolarHBondContact O-CB 3.12Å; A26-I30 WeakPolarHBondContact O-CG1 3.3Å; A26-I30 PolarHBondContact O-N 3.43Å; A26-A131 HydrophobicContact CB-CB 3.96Å; A26-I135 HydrophobicContact CB-CD1 3.56Å; A26-I135 HydrophobicContact CB-CG1 4.01Å; A26-A150 HydrophobicContact CB-CB 3.91Å; A26-M195 HydrophobicContact CB-CE 4.16Å |
| 27 | F | 95.8 | Very high | 94.1 | Very high | 59 Ų | 59 | 27 Ų | 27 | 26% | 0.259 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -56.7 | -46 | 174 | -178.4 | -84.7 | 0 | 0 | 0 | 111.3 | V23 V24 G31 L149 G153 V156 F157 | V23-F27 WeakPolarHBondContact O-CB 3.42Å; V23-F27 PolarHBondContact O-N 3.14Å; V24-F27 WeakPolarHBondContact O-CB 3.38Å; V24-F27 PolarHBondContact O-N 3.33Å; F27-G31 WeakPolarHBondContact O-CA 3.46Å; F27-G31 PolarHBondContact O-N 3.32Å; F27-L149 VanDerWaalsContact CD2-O 3.23Å; F27-L149 WeakPolarHBondContact CD2-O 3.49Å; F27-G153 VanDerWaalsContact CE2-N 3.28Å; F27-G153 VanDerWaalsContact CZ-CA 3.45Å; F27-V156 HydrophobicContact CE1-CG1 4.47Å; F27-V156 HydrophobicContact CZ-CB 4Å; F27-V156 HydrophobicContact CZ-CG1 4.11Å; F27-V156 HydrophobicContact CZ-CG2 4.09Å; F27-F157 AromaticContact CD1-CE2 3.9Å; F27-F157 HydrophobicContact CD1-CE2 3.9Å; F27-F157 HydrophobicContact CE1-CD2 4.13Å; F27-F157 AromaticContact CE1-CE2 3.68Å; F27-F157 HydrophobicContact CE1-CE2 3.68Å |
| 28 | I | 96.3 | Very high | 94.2 | Very high | 47 Ų | 47 | 24.6 Ų | 24.6 | 24% | 0.241 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -67.6 | -49.5 | 178.5 | -63.3 | 167.4 | 0 | 0 | 0 | 110.7 | V24 G25 A26 G31 F32 F157 A191 | V24-I28 HydrophobicContact CG1-CD1 4.36Å; V24-I28 WeakPolarHBondContact O-CG1 3.28Å; V24-I28 PolarHBondContact O-N 3.25Å; V24-I28 VanDerWaalsContact O-N 3.14Å; G25-I28 PolarHBondContact O-N 3.45Å; A26-I28 VanDerWaalsContact C-N 3.31Å; A26-I28 PolarHBondContact O-N 3.15Å; I28-G31 PolarHBondContact O-N 2.98Å; I28-F32 HydrophobicContact CG2-CD2 3.75Å; I28-F32 HydrophobicContact CG2-CE2 3.76Å; I28-F32 WeakPolarHBondContact O-CD2 3.48Å; I28-F32 PolarHBondContact O-N 3.35Å; I28-F157 HydrophobicContact CB-CZ 4.31Å; I28-F157 HydrophobicContact CG1-CZ 4.23Å; I28-F157 HydrophobicContact CG2-CZ 4.14Å; I28-A191 HydrophobicContact CB-CB 4Å; I28-A191 HydrophobicContact CG2-CB 3.95Å |
| 29 | S | 95.3 | Very high | 94.3 | Very high | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63.4 | -46.8 | -178.5 | -66.9 | 0 | 0 | 0 | 0 | 112.5 | G25 A26 G31 S33 M89 | G25-S29 PolarHBondContact O-N 3.46Å; G25-S29 PolarHBondContact O-OG 3.05Å; A26-S29 PolarHBondContact O-N 2.95Å; S29-G31 VanDerWaalsContact C-N 3.32Å; S29-S33 WeakPolarHBondContact O-CB 3.46Å; S29-S33 PolarHBondContact O-N 3.29Å; S29-S33 PolarHBondContact O-OG 3.02Å; S29-S33 VanDerWaalsContact O-OG 3.05Å; S29-M89 WeakPolarHBondContact OG-CE 3.4Å |
| 30 | I | 93.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 18.5 Ų | 18.5 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -66.7 | -38.7 | 176.7 | -64.4 | 176.7 | 0 | 0 | 0 | 110.4 | A26 S33 Y34 L128 A131 L132 A150 M151 | A26-I30 HydrophobicContact CB-CD1 4.44Å; A26-I30 WeakPolarHBondContact O-CB 3.12Å; A26-I30 WeakPolarHBondContact O-CG1 3.3Å; A26-I30 PolarHBondContact O-N 3.43Å; I30-S33 PolarHBondContact O-N 3.22Å; I30-Y34 HydrophobicContact CG2-CD2 3.72Å; I30-Y34 HydrophobicContact CG2-CE2 4.07Å; I30-Y34 PolarHBondContact O-N 2.96Å; I30-L128 HydrophobicContact CG1-CD1 3.93Å; I30-L128 HydrophobicContact CG2-CD1 4.43Å; I30-A131 HydrophobicContact CG1-CB 4.41Å; I30-L132 HydrophobicContact CD1-CD2 3.81Å; I30-L132 HydrophobicContact CD1-CG 4.33Å; I30-A150 HydrophobicContact CD1-CB 3.81Å; I30-M151 HydrophobicContact CD1-SD 4.3Å; I30-M151 HydrophobicContact CG2-SD 3.87Å |
| 31 | G | 94.9 | Very high | 94.4 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -51.3 | -61.6 | 173 | 0 | 0 | 0 | 0 | 0 | 111.6 | F27 I28 S29 A35 | F27-G31 WeakPolarHBondContact O-CA 3.46Å; F27-G31 PolarHBondContact O-N 3.32Å; I28-G31 PolarHBondContact O-N 2.98Å; S29-G31 VanDerWaalsContact C-N 3.32Å; G31-A35 WeakPolarHBondContact O-CB 3.44Å; G31-A35 PolarHBondContact O-N 2.79Å |
| 32 | F | 95.6 | Very high | 94.3 | Very high | 12 Ų | 12 | 12.8 Ų | 12.8 | 5% | 0.053 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -61.3 | -46.7 | 177.5 | -79.5 | -62.3 | 0 | 0 | 0 | 112.8 | I28 Y34 F36 F157 L161 L184 L185 C188 | I28-F32 HydrophobicContact CG2-CD2 3.75Å; I28-F32 HydrophobicContact CG2-CE2 3.76Å; I28-F32 WeakPolarHBondContact O-CD2 3.48Å; I28-F32 PolarHBondContact O-N 3.35Å; F32-Y34 PolarHBondContact O-N 3.35Å; F32-F36 WeakPolarHBondContact O-CB 3.48Å; F32-F36 PolarHBondContact O-N 2.59Å; F32-F157 AromaticContact CD1-CD1 3.94Å; F32-F157 HydrophobicContact CD1-CD1 3.94Å; F32-F157 HydrophobicContact CD1-CE1 4.07Å; F32-F157 HydrophobicContact CD2-CD1 4.21Å; F32-F157 AromaticContact CD2-CE1 3.64Å; F32-F157 HydrophobicContact CD2-CE1 3.64Å; F32-F157 HydrophobicContact CD2-CZ 4.48Å; F32-F157 HydrophobicContact CE1-CD1 4.01Å; F32-F157 AromaticContact CE1-CE1 3.89Å; F32-F157 HydrophobicContact CE1-CE1 3.89Å; F32-F157 HydrophobicContact CE2-CD1 4.3Å; F32-F157 AromaticContact CE2-CE1 3.47Å; F32-F157 HydrophobicContact CE2-CE1 3.47Å; F32-F157 VanDerWaalsContact CE2-CE1 3.47Å; F32-F157 HydrophobicContact CE2-CZ 4.29Å; F32-F157 HydrophobicContact CG-CD1 4.05Å; F32-F157 AromaticContact CG-CE1 3.96Å; F32-F157 HydrophobicContact CG-CE1 3.96Å; F32-F157 HydrophobicContact CZ-CD1 4.2Å; F32-F157 AromaticContact CZ-CE1 3.6Å; F32-F157 HydrophobicContact CZ-CE1 3.6Å; F32-L161 HydrophobicContact CD1-CD1 4.18Å; F32-L161 HydrophobicContact CE1-CD1 4.24Å; F32-L161 HydrophobicContact CE1-CD2 4.48Å; F32-L184 HydrophobicContact CE1-CB 4.34Å; F32-L184 HydrophobicContact CZ-CB 4.22Å; F32-L185 HydrophobicContact CB-CD2 3.95Å; F32-L185 HydrophobicContact CD1-CD2 3.6Å; F32-L185 HydrophobicContact CE1-CD2 4.2Å; F32-L185 HydrophobicContact CG-CD2 3.85Å; F32-C188 WeakPolarHBondContact CD2-SG 3.4Å |
| 33 | S | 94.2 | Very high | 94.3 | Very high | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -57 | -44.4 | -177.3 | -69.1 | 0 | 0 | 0 | 0 | 113.2 | S29 I30 P37 L124 | S29-S33 WeakPolarHBondContact O-CB 3.46Å; S29-S33 PolarHBondContact O-N 3.29Å; S29-S33 PolarHBondContact O-OG 3.02Å; S29-S33 VanDerWaalsContact O-OG 3.05Å; I30-S33 PolarHBondContact O-N 3.22Å; S33-P37 VanDerWaalsContact O-CD 3.23Å; S33-P37 WeakPolarHBondContact O-CD 3.45Å; S33-L124 PolarHBondContact OG-O 3.21Å |
| 34 | Y | 91.9 | Very high | 94.1 | Very high | 39 Ų | 39 | 12.5 Ų | 12.5 | 15% | 0.153 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -90.8 | -30.3 | -178.9 | -77 | -66.4 | 0 | 0 | 0 | 114.8 | I30 F32 K38 M69 Y70 L128 M151 S154 | I30-Y34 HydrophobicContact CG2-CD2 3.72Å; I30-Y34 HydrophobicContact CG2-CE2 4.07Å; I30-Y34 PolarHBondContact O-N 2.96Å; F32-Y34 PolarHBondContact O-N 3.35Å; Y34-K38 WeakPolarHBondContact O-CD 3.31Å; Y34-M69 HydrophobicContact CD1-CE 3.86Å; Y34-M69 HydrophobicContact CE1-CE 3.84Å; Y34-Y70 HydrophobicContact CE1-CE1 4.09Å; Y34-L128 HydrophobicContact CD2-CD1 4.26Å; Y34-L128 HydrophobicContact CE1-CD2 4.49Å; Y34-L128 HydrophobicContact CE2-CD1 3.61Å; Y34-L128 HydrophobicContact CE2-CD2 4.02Å; Y34-L128 HydrophobicContact CE2-CG 4.49Å; Y34-M151 HydrophobicContact CE2-CE 4.48Å; Y34-M151 HydrophobicContact CE2-SD 4.48Å; Y34-S154 WeakPolarHBondContact CB-OG 3.43Å |
| 35 | A | 94.6 | Very high | 93.8 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -81.6 | -35.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | G31 K38 S39 F157 L158 L161 | G31-A35 WeakPolarHBondContact O-CB 3.44Å; G31-A35 PolarHBondContact O-N 2.79Å; A35-K38 WeakPolarHBondContact O-CB 3.18Å; A35-K38 PolarHBondContact O-N 2.89Å; A35-K38 VanDerWaalsContact O-N 3.09Å; A35-S39 WeakPolarHBondContact O-CB 3.15Å; A35-S39 PolarHBondContact O-N 2.95Å; A35-S39 PolarHBondContact O-OG 3.06Å; A35-F157 HydrophobicContact CB-CB 3.65Å; A35-L158 HydrophobicContact CB-CB 3.9Å; A35-L161 HydrophobicContact CB-CD1 4.27Å |
| 36 | F | 94.9 | Very high | 93.5 | Very high | 2 Ų | 2 | 13 Ų | 13 | 1% | 0.009 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -59.9 | -47.9 | -171.9 | -166 | -90.8 | 0 | 0 | 0 | 112.8 | F32 K38 S39 I40 M65 L100 L124 L181 L185 | F32-F36 WeakPolarHBondContact O-CB 3.48Å; F32-F36 PolarHBondContact O-N 2.59Å; F36-K38 PolarHBondContact O-N 3.06Å; F36-K38 VanDerWaalsContact O-N 3.15Å; F36-S39 WeakPolarHBondContact CA-OG 3.22Å; F36-S39 PolarHBondContact O-N 3.05Å; F36-S39 VanDerWaalsContact O-N 3.16Å; F36-S39 PolarHBondContact O-OG 3.09Å; F36-I40 HydrophobicContact CE1-CD1 4.03Å; F36-I40 HydrophobicContact CZ-CD1 4.34Å; F36-I40 PolarHBondContact O-N 2.98Å; F36-I40 VanDerWaalsContact O-N 3.08Å; F36-M65 HydrophobicContact CD1-CE 4.25Å; F36-M65 HydrophobicContact CD1-SD 3.91Å; F36-M65 HydrophobicContact CE1-SD 4.39Å; F36-L100 HydrophobicContact CE1-CD1 4.05Å; F36-L100 HydrophobicContact CE1-CD2 3.79Å; F36-L100 HydrophobicContact CE1-CG 4.31Å; F36-L100 HydrophobicContact CE2-CD2 3.81Å; F36-L100 HydrophobicContact CZ-CD1 4.31Å; F36-L100 HydrophobicContact CZ-CD2 3.2Å; F36-L100 HydrophobicContact CZ-CG 4.06Å; F36-L124 HydrophobicContact CB-CD1 4.36Å; F36-L181 HydrophobicContact CE2-CB 4.05Å; F36-L181 HydrophobicContact CE2-CD1 4.28Å; F36-L181 HydrophobicContact CE2-CD2 4.03Å; F36-L181 HydrophobicContact CE2-CG 4.35Å; F36-L181 HydrophobicContact CZ-CB 4.28Å; F36-L181 HydrophobicContact CZ-CD1 4.36Å; F36-L185 HydrophobicContact CD1-CD1 4.44Å; F36-L185 HydrophobicContact CD2-CD1 4.41Å; F36-L185 HydrophobicContact CD2-CD2 4.07Å; F36-L185 HydrophobicContact CD2-CG 4.37Å; F36-L185 HydrophobicContact CE1-CD1 4.35Å; F36-L185 HydrophobicContact CE2-CD1 4.32Å; F36-L185 HydrophobicContact CE2-CG 4.36Å; F36-L185 HydrophobicContact CG-CD2 4.36Å; F36-L185 HydrophobicContact CZ-CD1 4.34Å |
| 37 | P | 93.7 | Very high | 93.3 | Very high | 4 Ų | 4 | 13 Ų | 13 | 3% | 0.026 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -59.9 | -27.6 | 176.7 | -23.5 | 34.6 | 0 | 0 | 0 | 115.3 | S33 M65 L66 L124 | S33-P37 VanDerWaalsContact O-CD 3.23Å; S33-P37 WeakPolarHBondContact O-CD 3.45Å; P37-M65 HydrophobicContact CB-CE 3.67Å; P37-M65 HydrophobicContact CB-CG 4.48Å; P37-M65 HydrophobicContact CB-SD 4.35Å; P37-M65 HydrophobicContact CG-CE 3.93Å; P37-M65 HydrophobicContact CG-CG 4.05Å; P37-M65 HydrophobicContact CG-SD 3.94Å; P37-L66 HydrophobicContact CB-CD1 4.3Å; P37-L66 HydrophobicContact CG-CD1 4.22Å; P37-L124 HydrophobicContact CG-CD1 4.28Å |
| 38 | K | 92.7 | Very high | 93.1 | Very high | 14 Ų | 14 | 10.9 Ų | 10.9 | 6% | 0.061 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -85.1 | -37 | 179.4 | -58.7 | 176.7 | -179.8 | -177.5 | 0 | 111.4 | Y34 A35 F36 T41 L158 L282 | Y34-K38 WeakPolarHBondContact O-CD 3.31Å; A35-K38 WeakPolarHBondContact O-CB 3.18Å; A35-K38 PolarHBondContact O-N 2.89Å; A35-K38 VanDerWaalsContact O-N 3.09Å; F36-K38 PolarHBondContact O-N 3.06Å; F36-K38 VanDerWaalsContact O-N 3.15Å; K38-T41 WeakPolarHBondContact O-CG2 3.3Å; K38-T41 PolarHBondContact O-OG1 3.12Å; K38-L158 HydrophobicContact CB-CD1 3.7Å; K38-L158 HydrophobicContact CB-CD2 4.25Å; K38-L158 HydrophobicContact CD-CD2 3.88Å; K38-L282 HydrophobicContact CB-CD2 3.69Å; K38-L282 HydrophobicContact CD-CD1 3.97Å; K38-L282 HydrophobicContact CD-CD2 3.76Å; K38-L282 HydrophobicContact CG-CD2 3.51Å |
| 39 | S | 94 | Very high | 92.8 | Very high | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -74.6 | -27.3 | -178.4 | 71.9 | 0 | 0 | 0 | 0 | 113.2 | A35 F36 T41 V42 N165 | A35-S39 WeakPolarHBondContact O-CB 3.15Å; A35-S39 PolarHBondContact O-N 2.95Å; A35-S39 PolarHBondContact O-OG 3.06Å; F36-S39 WeakPolarHBondContact CA-OG 3.22Å; F36-S39 PolarHBondContact O-N 3.05Å; F36-S39 VanDerWaalsContact O-N 3.16Å; F36-S39 PolarHBondContact O-OG 3.09Å; S39-T41 PolarHBondContact O-N 2.91Å; S39-V42 PolarHBondContact O-N 3.28Å; S39-N165 WeakPolarHBondContact CB-ND2 3.18Å; S39-N165 PolarHBondContact O-ND2 3.1Å; S39-N165 PolarHBondContact OG-ND2 3.39Å |
| 40 | I | 92.7 | Very high | 92.6 | Very high | 1 Ų | 1 | 17.8 Ų | 17.8 | 1% | 0.005 | 9% | 0.089 | C | C | . | . | G | 310 helix | trans | -72 | -15.7 | 179.8 | -153.4 | 175.3 | 0 | 0 | 0 | 112.4 | F36 V42 F43 F44 M65 V116 F178 | F36-I40 HydrophobicContact CE1-CD1 4.03Å; F36-I40 HydrophobicContact CZ-CD1 4.34Å; F36-I40 PolarHBondContact O-N 2.98Å; F36-I40 VanDerWaalsContact O-N 3.08Å; I40-V42 PolarHBondContact O-N 2.94Å; I40-F43 HydrophobicContact CG1-CD2 3.87Å; I40-F43 HydrophobicContact CG1-CE2 4.38Å; I40-F43 WeakPolarHBondContact O-CD2 3.38Å; I40-F43 PolarHBondContact O-N 3.24Å; I40-F43 VanDerWaalsContact O-N 3.1Å; I40-F44 HydrophobicContact CG2-CE1 4.07Å; I40-F44 HydrophobicContact CG2-CZ 4.36Å; I40-M65 HydrophobicContact CG2-CE 3.99Å; I40-V116 HydrophobicContact CD1-CG1 3.59Å; I40-F178 HydrophobicContact CD1-CE1 3.94Å; I40-F178 HydrophobicContact CD1-CZ 3.86Å; I40-F178 HydrophobicContact CG1-CE1 3.95Å; I40-F178 HydrophobicContact CG1-CZ 4.14Å |
| 41 | T | 92.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 19.9 Ų | 19.9 | 0% | 0 | 10% | 0.099 | C | C | . | . | G | 310 helix | trans | -68.4 | -17.5 | 180 | 73.7 | 0 | 0 | 0 | 0 | 112.4 | K38 S39 F43 F44 V283 | K38-T41 WeakPolarHBondContact O-CG2 3.3Å; K38-T41 PolarHBondContact O-OG1 3.12Å; S39-T41 PolarHBondContact O-N 2.91Å; T41-F43 PolarHBondContact O-N 3.26Å; T41-F44 HydrophobicContact CG2-CD2 4.21Å; T41-F44 HydrophobicContact CG2-CE2 3.76Å; T41-F44 HydrophobicContact CG2-CZ 3.96Å; T41-F44 VanDerWaalsContact O-CB 3.31Å; T41-F44 WeakPolarHBondContact O-CB 3.3Å; T41-F44 PolarHBondContact O-N 3.13Å; T41-V283 VanDerWaalsContact CB-O 3.28Å; T41-V283 WeakPolarHBondContact CB-O 3.38Å; T41-V283 HydrophobicContact CG2-CB 4.31Å; T41-V283 HydrophobicContact CG2-CG1 3.92Å; T41-V283 HydrophobicContact CG2-CG2 4.36Å; T41-V283 PolarHBondContact OG1-O 3.03Å |
| 42 | V | 92.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 14% | 0.139 | C | C | . | . | G | 310 helix | trans | -55.3 | -32.9 | 169.9 | 160.9 | 0 | 0 | 0 | 0 | 112.3 | S39 I40 A162 Q166 K290 A300 L303 | S39-V42 PolarHBondContact O-N 3.28Å; I40-V42 PolarHBondContact O-N 2.94Å; V42-A162 HydrophobicContact CG2-CB 4.43Å; V42-Q166 HydrophobicContact CG1-CB 3.91Å; V42-Q166 HydrophobicContact CG1-CG 4.47Å; V42-K290 PolarHBondContact O-NZ 3.26Å; V42-A300 HydrophobicContact CG2-CB 3.92Å; V42-L303 HydrophobicContact CG2-CD1 4.02Å |
| 43 | F | 93.3 | Very high | 92.2 | Very high | 1 Ų | 1 | 27.6 Ų | 27.6 | 0% | 0.004 | 14% | 0.143 | C | C | . | . | G | 310 helix | trans | -83.6 | -8.3 | 179.7 | -58.8 | -80.5 | 0 | 0 | 0 | 113.7 | I40 T41 K45 E46 I47 N165 F169 W174 F178 L181 | I40-F43 HydrophobicContact CG1-CD2 3.87Å; I40-F43 HydrophobicContact CG1-CE2 4.38Å; I40-F43 WeakPolarHBondContact O-CD2 3.38Å; I40-F43 PolarHBondContact O-N 3.24Å; I40-F43 VanDerWaalsContact O-N 3.1Å; T41-F43 PolarHBondContact O-N 3.26Å; F43-K45 PolarHBondContact O-N 2.7Å; F43-E46 PolarHBondContact O-N 3.33Å; F43-I47 HydrophobicContact CB-CD1 4.01Å; F43-I47 HydrophobicContact CB-CG1 4.47Å; F43-I47 VanDerWaalsContact O-CG1 3.29Å; F43-I47 WeakPolarHBondContact O-CG1 3.24Å; F43-I47 PolarHBondContact O-N 3.13Å; F43-N165 HydrophobicContact CE2-CB 3.72Å; F43-N165 HydrophobicContact CZ-CB 3.73Å; F43-N165 WeakPolarHBondContact CZ-O 3.27Å; F43-F169 HydrophobicContact CD1-CB 4.14Å; F43-F169 AromaticContact CD1-CD2 3.76Å; F43-F169 HydrophobicContact CD1-CD2 3.76Å; F43-F169 HydrophobicContact CD1-CG 4.24Å; F43-F169 HydrophobicContact CE1-CB 3.7Å; F43-F169 HydrophobicContact CE1-CD2 4Å; F43-F169 HydrophobicContact CE1-CG 4.26Å; F43-W174 HydrophobicContact CD1-CB 4.41Å; F43-F178 AromaticContact CD2-CE1 3.85Å; F43-F178 HydrophobicContact CD2-CE1 3.85Å; F43-F178 HydrophobicContact CE2-CE1 4.06Å; F43-F178 HydrophobicContact CG-CE1 4.12Å; F43-F178 HydrophobicContact CZ-CE1 4.49Å; F43-L181 HydrophobicContact CE2-CD1 3.97Å; F43-L181 HydrophobicContact CZ-CD1 4.1Å |
| 44 | F | 91.7 | Very high | 92.2 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -65.5 | -43.4 | -167.5 | -77.8 | 6.5 | 0 | 0 | 0 | 112.5 | I40 T41 E46 I47 E48 V58 I61 S62 V283 N287 | I40-F44 HydrophobicContact CG2-CE1 4.07Å; I40-F44 HydrophobicContact CG2-CZ 4.36Å; T41-F44 HydrophobicContact CG2-CD2 4.21Å; T41-F44 HydrophobicContact CG2-CE2 3.76Å; T41-F44 HydrophobicContact CG2-CZ 3.96Å; T41-F44 VanDerWaalsContact O-CB 3.31Å; T41-F44 WeakPolarHBondContact O-CB 3.3Å; T41-F44 PolarHBondContact O-N 3.13Å; F44-E46 PolarHBondContact O-N 2.77Å; F44-I47 PolarHBondContact O-N 3.46Å; F44-E48 VanDerWaalsContact O-CG 3.31Å; F44-E48 WeakPolarHBondContact O-CG 3.21Å; F44-E48 PolarHBondContact O-N 2.75Å; F44-V58 HydrophobicContact CB-CG1 3.64Å; F44-V58 HydrophobicContact CD1-CG1 3.62Å; F44-V58 HydrophobicContact CD2-CG1 4Å; F44-V58 HydrophobicContact CE1-CG1 4.19Å; F44-V58 HydrophobicContact CG-CG1 3.49Å; F44-V58 VanDerWaalsContact CG-CG1 3.49Å; F44-I61 HydrophobicContact CE1-CB 4.38Å; F44-I61 HydrophobicContact CZ-CB 4.33Å; F44-S62 WeakPolarHBondContact CE2-OG 3.44Å; F44-S62 WeakPolarHBondContact CZ-OG 3.48Å; F44-V283 HydrophobicContact CD2-CG1 4.15Å; F44-V283 HydrophobicContact CE2-CG1 3.7Å; F44-N287 WeakPolarHBondContact CB-ND2 3.22Å |
| 45 | K | 88.9 | Confident | 92.1 | Very high | 72 Ų | 72 | 28 Ų | 28 | 31% | 0.313 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -59 | -36.8 | 178.9 | -172.8 | 68.7 | -143.8 | 155.4 | 0 | 111.9 | F43 E48 V49 N287 K290 | F43-K45 PolarHBondContact O-N 2.7Å; K45-E48 IonicContact NZ-OE2 3.89Å; K45-E48 PolarHBondContact NZ-OE2 2.92Å; K45-E48 WeakPolarHBondContact O-CB 3.3Å; K45-V49 WeakPolarHBondContact O-CG2 3.46Å; K45-V49 PolarHBondContact O-N 3.46Å; K45-N287 PolarHBondContact N-OD1 2.97Å; K45-K290 HydrophobicContact CB-CD 3.98Å; K45-K290 HydrophobicContact CG-CD 4.27Å |
| 46 | E | 88.8 | Confident | 92 | Very high | 22 Ų | 22 | 28.9 Ų | 28.9 | 10% | 0.103 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -78.5 | -37.3 | -179.4 | -63.8 | 85.7 | 176.9 | 0 | 0 | 111.7 | F43 F44 E48 V49 I50 F169 K290 | F43-E46 PolarHBondContact O-N 3.33Å; F44-E46 PolarHBondContact O-N 2.77Å; E46-E48 VanDerWaalsContact C-N 3.33Å; E46-E48 PolarHBondContact O-N 2.77Å; E46-V49 PolarHBondContact O-N 3.21Å; E46-I50 WeakPolarHBondContact O-CB 2.82Å; E46-I50 VanDerWaalsContact O-CG1 3.26Å; E46-I50 WeakPolarHBondContact O-CG1 3.45Å; E46-I50 PolarHBondContact O-N 3.19Å; E46-F169 HydrophobicContact CB-CE1 4.48Å; E46-F169 HydrophobicContact CB-CE2 3.94Å; E46-F169 HydrophobicContact CB-CZ 3.72Å; E46-F169 HydrophobicContact CG-CE1 3.75Å; E46-F169 HydrophobicContact CG-CE2 4.1Å; E46-F169 HydrophobicContact CG-CZ 3.46Å; E46-F169 VanDerWaalsContact CG-CZ 3.46Å; E46-K290 IonicContact OE1-NZ 2.9Å; E46-K290 PolarHBondContact OE1-NZ 3.18Å; E46-K290 IonicContact OE2-NZ 3.37Å; E46-K290 PolarHBondContact OE2-NZ 3.11Å |
| 47 | I | 91.4 | Very high | 92 | Very high | 1 Ų | 1 | 33.8 Ų | 33.8 | 1% | 0.005 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.8 | -40.7 | 171.4 | -69.8 | 171.5 | 0 | 0 | 0 | 110.8 | F43 F44 V49 I50 F51 V58 F178 | F43-I47 HydrophobicContact CB-CD1 4.01Å; F43-I47 HydrophobicContact CB-CG1 4.47Å; F43-I47 VanDerWaalsContact O-CG1 3.29Å; F43-I47 WeakPolarHBondContact O-CG1 3.24Å; F43-I47 PolarHBondContact O-N 3.13Å; F44-I47 PolarHBondContact O-N 3.46Å; I47-V49 VanDerWaalsContact C-N 3.29Å; I47-V49 PolarHBondContact O-N 2.94Å; I47-I50 PolarHBondContact O-N 2.93Å; I47-F51 HydrophobicContact CB-CD2 4.46Å; I47-F51 HydrophobicContact CG2-CD2 3.71Å; I47-F51 HydrophobicContact CG2-CE2 4.2Å; I47-F51 WeakPolarHBondContact O-CD2 3.49Å; I47-F51 PolarHBondContact O-N 2.92Å; I47-V58 HydrophobicContact CB-CG1 4.21Å; I47-V58 HydrophobicContact CG2-CG1 3.93Å; I47-V58 HydrophobicContact CG2-CG2 3.85Å; I47-F178 HydrophobicContact CD1-CZ 4.24Å |
| 48 | E | 90.6 | Very high | 92 | Very high | 13 Ų | 13 | 33.6 Ų | 33.6 | 6% | 0.061 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -55 | -46 | 173.2 | -73.2 | 170.8 | -172.8 | 0 | 0 | 111.2 | F44 K45 E46 N52 A53 S55 V58 | F44-E48 VanDerWaalsContact O-CG 3.31Å; F44-E48 WeakPolarHBondContact O-CG 3.21Å; F44-E48 PolarHBondContact O-N 2.75Å; K45-E48 IonicContact NZ-OE2 3.89Å; K45-E48 PolarHBondContact NZ-OE2 2.92Å; K45-E48 WeakPolarHBondContact O-CB 3.3Å; E46-E48 VanDerWaalsContact C-N 3.33Å; E46-E48 PolarHBondContact O-N 2.77Å; E48-N52 CarbonylContact O-C 3.52Å; E48-N52 WeakPolarHBondContact O-CA 3.38Å; E48-N52 PolarHBondContact O-N 2.76Å; E48-A53 WeakPolarHBondContact CB-O 3.29Å; E48-A53 PolarHBondContact O-N 3.06Å; E48-S55 VanDerWaalsContact CD-OG 3.27Å; E48-S55 VanDerWaalsContact OE1-CA 3.24Å; E48-S55 WeakPolarHBondContact OE1-CA 3.34Å; E48-S55 VanDerWaalsContact OE1-CB 3.23Å; E48-S55 WeakPolarHBondContact OE1-CB 3.43Å; E48-S55 PolarHBondContact OE1-OG 2.99Å; E48-V58 HydrophobicContact CB-CG2 4.42Å; E48-V58 HydrophobicContact CG-CB 4.17Å; E48-V58 HydrophobicContact CG-CG2 3.65Å |
| 49 | V | 90.4 | Very high | 92.1 | Very high | 108 Ų | 108 | 33 Ų | 33 | 66% | 0.655 | 18% | 0.175 | S | C | * | . | H | α-helix | trans | -70.7 | -45.5 | -178.9 | 173.9 | 0 | 0 | 0 | 0 | 111.6 | K45 E46 I47 N52 | K45-V49 WeakPolarHBondContact O-CG2 3.46Å; K45-V49 PolarHBondContact O-N 3.46Å; E46-V49 PolarHBondContact O-N 3.21Å; I47-V49 VanDerWaalsContact C-N 3.29Å; I47-V49 PolarHBondContact O-N 2.94Å; V49-N52 PolarHBondContact O-N 3.09Å |
| 50 | I | 91.7 | Very high | 92.2 | Very high | 84 Ų | 84 | 36.6 Ų | 36.6 | 43% | 0.431 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -67.3 | -43 | -175.6 | -70 | 169.2 | 0 | 0 | 0 | 111.6 | E46 I47 W174 | E46-I50 WeakPolarHBondContact O-CB 2.82Å; E46-I50 VanDerWaalsContact O-CG1 3.26Å; E46-I50 WeakPolarHBondContact O-CG1 3.45Å; E46-I50 PolarHBondContact O-N 3.19Å; I47-I50 PolarHBondContact O-N 2.93Å; I50-W174 VanDerWaalsContact CD1-CD1 3.44Å; I50-W174 HydrophobicContact CD1-CG 4.38Å |
| 51 | F | 92.4 | Very high | 92.3 | Very high | 45 Ų | 45 | 36.7 Ų | 36.7 | 20% | 0.197 | 19% | 0.189 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.9 | 4.9 | -177.9 | -66.3 | -72.4 | 0 | 0 | 0 | 113.4 | I47 A53 N107 V109 L112 W174 | I47-F51 HydrophobicContact CB-CD2 4.46Å; I47-F51 HydrophobicContact CG2-CD2 3.71Å; I47-F51 HydrophobicContact CG2-CE2 4.2Å; I47-F51 WeakPolarHBondContact O-CD2 3.49Å; I47-F51 PolarHBondContact O-N 2.92Å; F51-A53 HydrophobicContact CB-CB 4.3Å; F51-A53 PolarHBondContact O-N 3.19Å; F51-N107 VanDerWaalsContact CE1-C 3.47Å; F51-N107 VanDerWaalsContact CE1-O 3.24Å; F51-N107 WeakPolarHBondContact CE1-O 3.12Å; F51-V109 HydrophobicContact CB-CG2 3.58Å; F51-V109 HydrophobicContact CD1-CG2 4.39Å; F51-V109 HydrophobicContact CD2-CG2 4.15Å; F51-V109 HydrophobicContact CG-CG2 3.79Å; F51-L112 HydrophobicContact CE2-CD1 4.04Å; F51-L112 HydrophobicContact CZ-CD1 4.48Å; F51-W174 HydrophobicContact CE2-CH2 4.1Å; F51-W174 AromaticContact CE2-CZ2 3.93Å; F51-W174 HydrophobicContact CE2-CZ2 3.93Å; F51-W174 AromaticContact CZ-CH2 3.75Å; F51-W174 HydrophobicContact CZ-CH2 3.75Å; F51-W174 AromaticContact CZ-CZ2 3.6Å; F51-W174 HydrophobicContact CZ-CZ2 3.6Å |
| 52 | N | 91.6 | Very high | 92.4 | Very high | 157 Ų | 157 | 36.9 Ų | 36.9 | 84% | 0.84 | 19% | 0.19 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 46.7 | 47.2 | -173.9 | -166.9 | 33.7 | 0 | 0 | 0 | 111.9 | E48 V49 | E48-N52 CarbonylContact O-C 3.52Å; E48-N52 WeakPolarHBondContact O-CA 3.38Å; E48-N52 PolarHBondContact O-N 2.76Å; V49-N52 PolarHBondContact O-N 3.09Å |
| 53 | A | 92.1 | Very high | 92.5 | Very high | 16 Ų | 16 | 37 Ų | 37 | 13% | 0.132 | 19% | 0.192 | C | C | . | . | trans | -109.1 | 150.4 | -173.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | E48 F51 K57 V58 V109 | E48-A53 WeakPolarHBondContact CB-O 3.29Å; E48-A53 PolarHBondContact O-N 3.06Å; F51-A53 HydrophobicContact CB-CB 4.3Å; F51-A53 PolarHBondContact O-N 3.19Å; A53-K57 HydrophobicContact CB-CB 4.3Å; A53-V58 HydrophobicContact CB-CG2 4.01Å; A53-V109 HydrophobicContact CB-CG2 4.1Å | ||
| 54 | S | 93.4 | Very high | 92.7 | Very high | 44 Ų | 44 | 38.3 Ų | 38.3 | 31% | 0.308 | 20% | 0.198 | S | C | . | . | trans | -75.9 | 160.4 | 177.9 | 87.7 | 0 | 0 | 0 | 0 | 111.9 | S56 K57 V58 D415 | S54-S56 PolarHBondContact O-N 3.49Å; S54-K57 PolarHBondContact O-N 2.96Å; S54-K57 PolarHBondContact OG-N 2.96Å; S54-V58 PolarHBondContact O-N 2.62Å; S54-V58 VanDerWaalsContact O-N 3.08Å; S54-D415 VanDerWaalsContact CB-CG 3.47Å; S54-D415 WeakPolarHBondContact CB-OD2 3.35Å; S54-D415 PolarHBondContact OG-OD2 3.26Å | ||
| 55 | S | 90.2 | Very high | 92.9 | Very high | 5 Ų | 5 | 38.3 Ų | 38.3 | 4% | 0.035 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62.5 | -33.1 | 179.1 | -62.1 | 0 | 0 | 0 | 0 | 111.9 | E48 S59 N414 D415 Y420 | E48-S55 VanDerWaalsContact CD-OG 3.27Å; E48-S55 VanDerWaalsContact OE1-CA 3.24Å; E48-S55 WeakPolarHBondContact OE1-CA 3.34Å; E48-S55 VanDerWaalsContact OE1-CB 3.23Å; E48-S55 WeakPolarHBondContact OE1-CB 3.43Å; E48-S55 PolarHBondContact OE1-OG 2.99Å; S55-S59 WeakPolarHBondContact O-CB 3.42Å; S55-S59 PolarHBondContact O-N 3.32Å; S55-S59 PolarHBondContact O-OG 2.84Å; S55-N414 PolarHBondContact OG-ND2 3.29Å; S55-D415 VanDerWaalsContact CB-OD1 3.3Å; S55-D415 WeakPolarHBondContact CB-OD1 3.45Å; S55-D415 PolarHBondContact N-OD1 3.45Å; S55-Y420 PolarHBondContact OG-OH 2.98Å |
| 56 | S | 92.3 | Very high | 93.1 | Very high | 18 Ų | 18 | 35.5 Ų | 35.5 | 13% | 0.126 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.2 | -44 | 171.8 | -176.7 | 0 | 0 | 0 | 0 | 112.3 | S54 S59 P408 D415 | S54-S56 PolarHBondContact O-N 3.49Å; S56-S59 PolarHBondContact O-OG 3.16Å; S56-S59 VanDerWaalsContact O-OG 3.04Å; S56-P408 WeakPolarHBondContact CB-O 3.45Å; S56-P408 PolarHBondContact OG-O 3.29Å; S56-D415 WeakPolarHBondContact CB-OD2 3.13Å; S56-D415 PolarHBondContact N-OD2 3.17Å |
| 57 | K | 93.8 | Very high | 93.4 | Very high | 105 Ų | 105 | 34.7 Ų | 34.7 | 46% | 0.457 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -62 | -49.7 | 177.2 | -75.2 | -168.6 | 175.8 | -170 | 0 | 110.9 | A53 S54 S59 W60 Y113 | A53-K57 HydrophobicContact CB-CB 4.3Å; S54-K57 PolarHBondContact O-N 2.96Å; S54-K57 PolarHBondContact OG-N 2.96Å; K57-S59 VanDerWaalsContact C-N 3.33Å; K57-S59 PolarHBondContact O-N 3.32Å; K57-W60 WeakPolarHBondContact O-CB 3.38Å; K57-W60 PolarHBondContact O-N 3.2Å; K57-Y113 WeakPolarHBondContact O-CE1 3.35Å; K57-Y113 PolarHBondContact O-OH 3.26Å |
| 58 | V | 94 | Very high | 93.6 | Very high | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.4 | -34.4 | -176.5 | -180 | 0 | 0 | 0 | 0 | 112.4 | F44 I47 E48 A53 S54 W60 I61 | F44-V58 HydrophobicContact CB-CG1 3.64Å; F44-V58 HydrophobicContact CD1-CG1 3.62Å; F44-V58 HydrophobicContact CD2-CG1 4Å; F44-V58 HydrophobicContact CE1-CG1 4.19Å; F44-V58 HydrophobicContact CG-CG1 3.49Å; F44-V58 VanDerWaalsContact CG-CG1 3.49Å; I47-V58 HydrophobicContact CB-CG1 4.21Å; I47-V58 HydrophobicContact CG2-CG1 3.93Å; I47-V58 HydrophobicContact CG2-CG2 3.85Å; E48-V58 HydrophobicContact CB-CG2 4.42Å; E48-V58 HydrophobicContact CG-CB 4.17Å; E48-V58 HydrophobicContact CG-CG2 3.65Å; A53-V58 HydrophobicContact CB-CG2 4.01Å; S54-V58 PolarHBondContact O-N 2.62Å; S54-V58 VanDerWaalsContact O-N 3.08Å; V58-W60 PolarHBondContact O-N 3.33Å; V58-I61 HydrophobicContact CG1-CD1 4.28Å; V58-I61 WeakPolarHBondContact O-CB 3.42Å; V58-I61 WeakPolarHBondContact O-CG1 3.43Å; V58-I61 PolarHBondContact O-N 3.08Å; V58-I61 VanDerWaalsContact O-N 3.12Å |
| 59 | S | 94.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -66.7 | -22.9 | -179.8 | 72.1 | 0 | 0 | 0 | 0 | 114.3 | S55 S56 K57 I61 S62 S63 F284 P407 P408 | S55-S59 WeakPolarHBondContact O-CB 3.42Å; S55-S59 PolarHBondContact O-N 3.32Å; S55-S59 PolarHBondContact O-OG 2.84Å; S56-S59 PolarHBondContact O-OG 3.16Å; S56-S59 VanDerWaalsContact O-OG 3.04Å; K57-S59 VanDerWaalsContact C-N 3.33Å; K57-S59 PolarHBondContact O-N 3.32Å; S59-I61 PolarHBondContact O-N 3.07Å; S59-I61 VanDerWaalsContact O-N 3.17Å; S59-S62 PolarHBondContact O-N 2.62Å; S59-S62 PolarHBondContact O-OG 3.33Å; S59-S62 VanDerWaalsContact O-OG 3.05Å; S59-S63 PolarHBondContact O-N 3Å; S59-S63 VanDerWaalsContact O-N 3.12Å; S59-F284 VanDerWaalsContact CB-CZ 3.48Å; S59-P407 VanDerWaalsContact OG-C 3.32Å; S59-P407 PolarHBondContact OG-O 3.36Å; S59-P408 WeakPolarHBondContact OG-CA 3.27Å |
| 60 | W | 96.3 | Very high | 93.7 | Very high | 76 Ų | 76 | 32.1 Ų | 32.1 | 29% | 0.288 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -55.1 | -30.8 | 171.2 | -81.1 | 103.4 | 0 | 0 | 0 | 112.5 | K57 V58 S62 S63 I64 Y113 L404 L405 P408 | K57-W60 WeakPolarHBondContact O-CB 3.38Å; K57-W60 PolarHBondContact O-N 3.2Å; V58-W60 PolarHBondContact O-N 3.33Å; W60-S62 PolarHBondContact O-N 3.24Å; W60-S63 PolarHBondContact O-N 3.48Å; W60-I64 HydrophobicContact CB-CD1 4.18Å; W60-I64 HydrophobicContact CE3-CD1 4.13Å; W60-I64 HydrophobicContact CE3-CG1 3.99Å; W60-I64 VanDerWaalsContact O-CB 3.28Å; W60-I64 WeakPolarHBondContact O-CB 3.36Å; W60-I64 WeakPolarHBondContact O-CD1 3.14Å; W60-I64 WeakPolarHBondContact O-CG1 3.29Å; W60-I64 PolarHBondContact O-N 3.38Å; W60-Y113 HydrophobicContact CB-CD1 4.04Å; W60-Y113 HydrophobicContact CB-CE1 3.49Å; W60-Y113 VanDerWaalsContact CB-CE1 3.49Å; W60-L404 HydrophobicContact CE3-CD1 3.96Å; W60-L404 HydrophobicContact CZ3-CD1 3.65Å; W60-L404 HydrophobicContact CZ3-CD2 4.41Å; W60-L404 HydrophobicContact CZ3-CG 3.75Å; W60-L405 HydrophobicContact CH2-CD2 3.82Å; W60-P408 HydrophobicContact CB-CG 4.45Å; W60-P408 HydrophobicContact CD2-CB 3.9Å; W60-P408 HydrophobicContact CD2-CG 3.47Å; W60-P408 VanDerWaalsContact CD2-CG 3.47Å; W60-P408 VanDerWaalsContact CE2-CB 3.41Å; W60-P408 HydrophobicContact CE3-CG 3.95Å; W60-P408 HydrophobicContact CG-CB 4.12Å; W60-P408 HydrophobicContact CG-CG 3.69Å; W60-P408 HydrophobicContact CH2-CG 4.49Å; W60-P408 HydrophobicContact CZ2-CB 3.8Å; W60-P408 HydrophobicContact CZ2-CG 4.06Å; W60-P408 HydrophobicContact CZ3-CG 4.44Å |
| 61 | I | 95.6 | Very high | 93.6 | Very high | 3 Ų | 3 | 30.3 Ų | 30.3 | 2% | 0.015 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -57.9 | -54.3 | 178.8 | -59.7 | 171.1 | 0 | 0 | 0 | 110.6 | F44 V58 S59 M65 V109 L112 Y113 V116 | F44-I61 HydrophobicContact CE1-CB 4.38Å; F44-I61 HydrophobicContact CZ-CB 4.33Å; V58-I61 HydrophobicContact CG1-CD1 4.28Å; V58-I61 WeakPolarHBondContact O-CB 3.42Å; V58-I61 WeakPolarHBondContact O-CG1 3.43Å; V58-I61 PolarHBondContact O-N 3.08Å; V58-I61 VanDerWaalsContact O-N 3.12Å; S59-I61 PolarHBondContact O-N 3.07Å; S59-I61 VanDerWaalsContact O-N 3.17Å; I61-M65 WeakPolarHBondContact O-CB 3.24Å; I61-M65 PolarHBondContact O-N 3.19Å; I61-M65 VanDerWaalsContact O-N 3.16Å; I61-V109 HydrophobicContact CD1-CG1 4.45Å; I61-L112 HydrophobicContact CD1-CB 4.08Å; I61-L112 HydrophobicContact CD1-CD1 4.19Å; I61-L112 HydrophobicContact CG1-CB 4.41Å; I61-Y113 HydrophobicContact CB-CD1 4.49Å; I61-Y113 HydrophobicContact CG1-CD1 3.64Å; I61-Y113 HydrophobicContact CG1-CE1 3.73Å; I61-V116 HydrophobicContact CG2-CB 3.95Å; I61-V116 HydrophobicContact CG2-CG1 3.73Å |
| 62 | S | 94.4 | Very high | 93.4 | Very high | 4 Ų | 4 | 28.3 Ų | 28.3 | 3% | 0.028 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -70 | -36.5 | 179.5 | 51.7 | 0 | 0 | 0 | 0 | 112.6 | F44 S59 W60 M65 L66 | F44-S62 WeakPolarHBondContact CE2-OG 3.44Å; F44-S62 WeakPolarHBondContact CZ-OG 3.48Å; S59-S62 PolarHBondContact O-N 2.62Å; S59-S62 PolarHBondContact O-OG 3.33Å; S59-S62 VanDerWaalsContact O-OG 3.05Å; W60-S62 PolarHBondContact O-N 3.24Å; S62-M65 PolarHBondContact O-N 3.39Å; S62-L66 PolarHBondContact O-N 2.97Å |
| 63 | S | 95.5 | Very high | 93.1 | Very high | 4 Ų | 4 | 21.2 Ų | 21.2 | 3% | 0.028 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -67.3 | -44.1 | -179.6 | -79.9 | 0 | 0 | 0 | 0 | 112.5 | S59 W60 M65 L66 A67 V403 L404 P407 P408 | S59-S63 PolarHBondContact O-N 3Å; S59-S63 VanDerWaalsContact O-N 3.12Å; W60-S63 PolarHBondContact O-N 3.48Å; S63-M65 VanDerWaalsContact C-N 3.34Å; S63-L66 PolarHBondContact O-N 3.46Å; S63-A67 WeakPolarHBondContact O-CB 3.48Å; S63-A67 PolarHBondContact O-N 2.96Å; S63-V403 PolarHBondContact OG-O 3.43Å; S63-L404 WeakPolarHBondContact CB-O 3.46Å; S63-P407 WeakPolarHBondContact OG-CB 3.35Å; S63-P407 VanDerWaalsContact OG-CD 3.32Å; S63-P407 WeakPolarHBondContact OG-CD 3.39Å; S63-P407 WeakPolarHBondContact OG-CG 3.32Å; S63-P408 WeakPolarHBondContact OG-CD 3.48Å |
| 64 | I | 96.8 | Very high | 92.7 | Very high | 27 Ų | 27 | 22.3 Ų | 22.3 | 14% | 0.138 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62.3 | -45.1 | 173.9 | -66.9 | 166.2 | 0 | 0 | 0 | 109.5 | W60 L66 A67 V68 Y113 V118 L404 | W60-I64 HydrophobicContact CB-CD1 4.18Å; W60-I64 HydrophobicContact CE3-CD1 4.13Å; W60-I64 HydrophobicContact CE3-CG1 3.99Å; W60-I64 VanDerWaalsContact O-CB 3.28Å; W60-I64 WeakPolarHBondContact O-CB 3.36Å; W60-I64 WeakPolarHBondContact O-CD1 3.14Å; W60-I64 WeakPolarHBondContact O-CG1 3.29Å; W60-I64 PolarHBondContact O-N 3.38Å; I64-L66 PolarHBondContact O-N 3.33Å; I64-A67 PolarHBondContact O-N 3.49Å; I64-V68 HydrophobicContact CG2-CG2 4.01Å; I64-V68 WeakPolarHBondContact O-CB 3.41Å; I64-V68 VanDerWaalsContact O-CG2 3.23Å; I64-V68 WeakPolarHBondContact O-CG2 3.42Å; I64-V68 PolarHBondContact O-N 2.96Å; I64-Y113 HydrophobicContact CD1-CD1 4.14Å; I64-Y113 HydrophobicContact CD1-CD2 4.4Å; I64-Y113 HydrophobicContact CD1-CG 3.87Å; I64-V118 HydrophobicContact CG2-CG2 3.9Å; I64-L404 HydrophobicContact CB-CD1 4.36Å; I64-L404 HydrophobicContact CG1-CD1 3.68Å |
| 65 | M | 96.1 | Very high | 92.4 | Very high | 1 Ų | 1 | 24.4 Ų | 24.4 | 1% | 0.005 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -58.6 | -47.2 | 178.9 | -172.4 | 169.2 | 28.4 | 0 | 0 | 112.4 | F36 P37 I40 I61 S62 S63 M69 V116 G117 L124 | F36-M65 HydrophobicContact CD1-CE 4.25Å; F36-M65 HydrophobicContact CD1-SD 3.91Å; F36-M65 HydrophobicContact CE1-SD 4.39Å; P37-M65 HydrophobicContact CB-CE 3.67Å; P37-M65 HydrophobicContact CB-CG 4.48Å; P37-M65 HydrophobicContact CB-SD 4.35Å; P37-M65 HydrophobicContact CG-CE 3.93Å; P37-M65 HydrophobicContact CG-CG 4.05Å; P37-M65 HydrophobicContact CG-SD 3.94Å; I40-M65 HydrophobicContact CG2-CE 3.99Å; I61-M65 WeakPolarHBondContact O-CB 3.24Å; I61-M65 PolarHBondContact O-N 3.19Å; I61-M65 VanDerWaalsContact O-N 3.16Å; S62-M65 PolarHBondContact O-N 3.39Å; S63-M65 VanDerWaalsContact C-N 3.34Å; M65-M69 VanDerWaalsContact O-CB 3.28Å; M65-M69 WeakPolarHBondContact O-CB 3.43Å; M65-M69 PolarHBondContact O-N 2.9Å; M65-V116 HydrophobicContact CE-CG1 4.02Å; M65-V116 HydrophobicContact SD-CG1 4.24Å; M65-G117 WeakPolarHBondContact CA-O 3.43Å; M65-L124 HydrophobicContact CG-CD1 4.32Å; M65-L124 HydrophobicContact SD-CD1 3.94Å |
| 66 | L | 93.6 | Very high | 92.3 | Very high | 12 Ų | 12 | 24.1 Ų | 24.1 | 6% | 0.063 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -69.6 | -40.7 | -179.5 | -158.8 | 69.5 | 0 | 0 | 0 | 111.7 | P37 S62 S63 I64 M69 Y70 F279 V403 | P37-L66 HydrophobicContact CB-CD1 4.3Å; P37-L66 HydrophobicContact CG-CD1 4.22Å; S62-L66 PolarHBondContact O-N 2.97Å; S63-L66 PolarHBondContact O-N 3.46Å; I64-L66 PolarHBondContact O-N 3.33Å; L66-M69 HydrophobicContact CD1-CE 3.62Å; L66-M69 WeakPolarHBondContact O-CB 3.46Å; L66-M69 PolarHBondContact O-N 3.37Å; L66-Y70 HydrophobicContact CD1-CE1 3.92Å; L66-Y70 HydrophobicContact CG-CD1 4.37Å; L66-Y70 HydrophobicContact CG-CE1 3.99Å; L66-Y70 VanDerWaalsContact O-CD1 3.27Å; L66-Y70 WeakPolarHBondContact O-CD1 3.3Å; L66-Y70 PolarHBondContact O-N 2.85Å; L66-F279 HydrophobicContact CD2-CD1 3.96Å; L66-F279 HydrophobicContact CD2-CD2 4.01Å; L66-F279 HydrophobicContact CD2-CE1 3.81Å; L66-F279 HydrophobicContact CD2-CE2 3.82Å; L66-F279 HydrophobicContact CD2-CG 4.06Å; L66-F279 HydrophobicContact CD2-CZ 3.74Å; L66-V403 HydrophobicContact CB-CG1 3.79Å; L66-V403 HydrophobicContact CD2-CG1 3.63Å; L66-V403 HydrophobicContact CG-CG1 3.85Å |
| 67 | A | 94.6 | Very high | 91.8 | Very high | 6 Ų | 6 | 25.6 Ų | 25.6 | 5% | 0.05 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -64.2 | -45.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S63 I64 M69 Y70 A71 L404 | S63-A67 WeakPolarHBondContact O-CB 3.48Å; S63-A67 PolarHBondContact O-N 2.96Å; I64-A67 PolarHBondContact O-N 3.49Å; A67-M69 VanDerWaalsContact C-N 3.31Å; A67-M69 PolarHBondContact O-N 3.49Å; A67-Y70 PolarHBondContact O-N 3.35Å; A67-A71 VanDerWaalsContact O-CB 3.26Å; A67-A71 WeakPolarHBondContact O-CB 3.4Å; A67-A71 PolarHBondContact O-N 3.17Å; A67-L404 HydrophobicContact CB-CB 3.79Å; A67-L404 HydrophobicContact CB-CD1 4.01Å; A67-L404 HydrophobicContact CB-CG 4.37Å |
| 68 | V | 95.3 | Very high | 91.2 | Very high | 33 Ų | 33 | 24.9 Ų | 24.9 | 20% | 0.2 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.5 | -37.5 | 175.9 | 175.1 | 0 | 0 | 0 | 0 | 110.6 | I64 Y70 G72 L122 | I64-V68 HydrophobicContact CG2-CG2 4.01Å; I64-V68 WeakPolarHBondContact O-CB 3.41Å; I64-V68 VanDerWaalsContact O-CG2 3.23Å; I64-V68 WeakPolarHBondContact O-CG2 3.42Å; I64-V68 PolarHBondContact O-N 2.96Å; V68-Y70 VanDerWaalsContact C-N 3.32Å; V68-Y70 PolarHBondContact O-N 2.83Å; V68-G72 WeakPolarHBondContact O-CA 3.44Å; V68-G72 PolarHBondContact O-N 2.92Å; V68-L122 HydrophobicContact CG1-CB 4.06Å |
| 69 | M | 93.9 | Very high | 90.8 | Very high | 1 Ų | 1 | 27.1 Ų | 27.1 | 1% | 0.005 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60 | -43.2 | 175.2 | -173.6 | -179 | 77 | 0 | 0 | 112.1 | Y34 M65 L66 A67 G121 L124 A125 L128 | Y34-M69 HydrophobicContact CD1-CE 3.86Å; Y34-M69 HydrophobicContact CE1-CE 3.84Å; M65-M69 VanDerWaalsContact O-CB 3.28Å; M65-M69 WeakPolarHBondContact O-CB 3.43Å; M65-M69 PolarHBondContact O-N 2.9Å; L66-M69 HydrophobicContact CD1-CE 3.62Å; L66-M69 WeakPolarHBondContact O-CB 3.46Å; L66-M69 PolarHBondContact O-N 3.37Å; A67-M69 VanDerWaalsContact C-N 3.31Å; A67-M69 PolarHBondContact O-N 3.49Å; M69-G121 WeakPolarHBondContact CA-O 3.38Å; M69-L124 HydrophobicContact CG-CB 4.19Å; M69-L124 HydrophobicContact SD-CB 4.01Å; M69-A125 HydrophobicContact CG-CB 4.47Å; M69-A125 WeakPolarHBondContact O-CB 3.36Å; M69-L128 HydrophobicContact CE-CD2 4.19Å; M69-L128 HydrophobicContact CG-CD2 4.41Å; M69-L128 HydrophobicContact SD-CD2 4.27Å |
| 70 | Y | 89.3 | Confident | 90.2 | Very high | 33 Ų | 33 | 27.5 Ų | 27.5 | 13% | 0.129 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -73.3 | -47.1 | -179.5 | -78.9 | 31.9 | 0 | 0 | 0 | 111 | Y34 L66 A67 V68 G72 G73 C400 | Y34-Y70 HydrophobicContact CE1-CE1 4.09Å; L66-Y70 HydrophobicContact CD1-CE1 3.92Å; L66-Y70 HydrophobicContact CG-CD1 4.37Å; L66-Y70 HydrophobicContact CG-CE1 3.99Å; L66-Y70 VanDerWaalsContact O-CD1 3.27Å; L66-Y70 WeakPolarHBondContact O-CD1 3.3Å; L66-Y70 PolarHBondContact O-N 2.85Å; A67-Y70 PolarHBondContact O-N 3.35Å; V68-Y70 VanDerWaalsContact C-N 3.32Å; V68-Y70 PolarHBondContact O-N 2.83Å; Y70-G72 PolarHBondContact O-N 2.79Å; Y70-G73 PolarHBondContact O-N 3.25Å; Y70-G73 VanDerWaalsContact O-N 3.15Å; Y70-C400 WeakPolarHBondContact CB-SG 3.47Å |
| 71 | A | 89.4 | Confident | 89.5 | Confident | 47 Ų | 47 | 27.9 Ų | 27.9 | 39% | 0.388 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -65.3 | -26.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | A67 G73 P74 C400 | A67-A71 VanDerWaalsContact O-CB 3.26Å; A67-A71 WeakPolarHBondContact O-CB 3.4Å; A67-A71 PolarHBondContact O-N 3.17Å; A71-G73 PolarHBondContact O-N 3.02Å; A71-P74 WeakPolarHBondContact O-CD 3.16Å; A71-C400 PolarHBondContact N-SG 3.17Å |
| 72 | G | 88.2 | Confident | 88.9 | Confident | 2 Ų | 2 | 34.6 Ų | 34.6 | 2% | 0.021 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -71.3 | -8.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | V68 Y70 I75 S76 | V68-G72 WeakPolarHBondContact O-CA 3.44Å; V68-G72 PolarHBondContact O-N 2.92Å; Y70-G72 PolarHBondContact O-N 2.79Å; G72-I75 PolarHBondContact O-N 3.09Å; G72-S76 WeakPolarHBondContact O-CB 3.32Å; G72-S76 PolarHBondContact O-N 3.03Å |
| 73 | G | 85.6 | Confident | 88.5 | Confident | 9 Ų | 9 | 40.4 Ų | 40.4 | 9% | 0.093 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -56.5 | -58 | -179 | 0 | 0 | 0 | 0 | 0 | 115.2 | Y70 A71 I75 S76 S77 N129 | Y70-G73 PolarHBondContact O-N 3.25Å; Y70-G73 VanDerWaalsContact O-N 3.15Å; A71-G73 PolarHBondContact O-N 3.02Å; G73-I75 VanDerWaalsContact C-N 3.29Å; G73-I75 PolarHBondContact O-N 2.9Å; G73-S76 WeakPolarHBondContact O-CB 3.37Å; G73-S76 PolarHBondContact O-N 3.34Å; G73-S77 PolarHBondContact O-N 3.3Å; G73-N129 WeakPolarHBondContact CA-ND2 3.4Å |
| 74 | P | 82.8 | Confident | 88 | Confident | 39 Ų | 39 | 41.5 Ų | 41.5 | 25% | 0.253 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -57.4 | -40.6 | 175.9 | -25.1 | 32.7 | 0 | 0 | 0 | 113.1 | A71 S77 I78 I397 | A71-P74 WeakPolarHBondContact O-CD 3.16Å; P74-S77 PolarHBondContact O-N 3.23Å; P74-I78 WeakPolarHBondContact O-CG1 3.04Å; P74-I78 PolarHBondContact O-N 2.83Å; P74-I397 HydrophobicContact CG-CD1 3.74Å; P74-I397 HydrophobicContact CG-CG1 4.03Å |
| 75 | I | 87.3 | Confident | 87.7 | Confident | 87 Ų | 87 | 40.5 Ų | 40.5 | 45% | 0.446 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.2 | -48.7 | 178.2 | -58 | 175.7 | 0 | 0 | 0 | 109.7 | G72 G73 S77 I78 L79 F126 | G72-I75 PolarHBondContact O-N 3.09Å; G73-I75 VanDerWaalsContact C-N 3.29Å; G73-I75 PolarHBondContact O-N 2.9Å; I75-S77 VanDerWaalsContact C-N 3.31Å; I75-S77 PolarHBondContact O-N 3.43Å; I75-I78 PolarHBondContact O-N 3.31Å; I75-L79 HydrophobicContact CG2-CD1 3.99Å; I75-L79 WeakPolarHBondContact O-CG 3.13Å; I75-L79 PolarHBondContact O-N 3.14Å; I75-F126 HydrophobicContact CG2-CE1 4.01Å; I75-F126 HydrophobicContact CG2-CZ 4.18Å |
| 76 | S | 88.2 | Confident | 87.5 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -58.4 | -43.4 | 176.3 | -170.5 | 0 | 0 | 0 | 0 | 111.4 | G72 G73 L79 V80 | G72-S76 WeakPolarHBondContact O-CB 3.32Å; G72-S76 PolarHBondContact O-N 3.03Å; G73-S76 WeakPolarHBondContact O-CB 3.37Å; G73-S76 PolarHBondContact O-N 3.34Å; S76-L79 PolarHBondContact O-N 2.95Å; S76-V80 WeakPolarHBondContact O-CB 3.47Å; S76-V80 WeakPolarHBondContact O-CG2 3.5Å; S76-V80 PolarHBondContact O-N 3.25Å |
| 77 | S | 82.6 | Confident | 87.6 | Confident | 48 Ų | 48 | 48.8 Ų | 48.8 | 34% | 0.336 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.8 | -45.6 | 179.7 | -177.3 | 0 | 0 | 0 | 0 | 112.2 | G73 P74 I75 L79 V80 N81 | G73-S77 PolarHBondContact O-N 3.3Å; P74-S77 PolarHBondContact O-N 3.23Å; I75-S77 VanDerWaalsContact C-N 3.31Å; I75-S77 PolarHBondContact O-N 3.43Å; S77-L79 PolarHBondContact O-N 3.42Å; S77-V80 PolarHBondContact O-N 2.78Å; S77-N81 WeakPolarHBondContact O-CB 3.39Å; S77-N81 VanDerWaalsContact O-CG 3.28Å; S77-N81 PolarHBondContact O-N 2.92Å; S77-N81 PolarHBondContact O-ND2 3.31Å; S77-N81 VanDerWaalsContact O-ND2 3.09Å |
| 78 | I | 81.8 | Confident | 87.6 | Confident | 91 Ų | 91 | 49.2 Ų | 49.2 | 47% | 0.467 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.7 | -45 | 176.9 | -66.8 | 166.1 | 0 | 0 | 0 | 110.8 | P74 I75 N81 K82 | P74-I78 WeakPolarHBondContact O-CG1 3.04Å; P74-I78 PolarHBondContact O-N 2.83Å; I75-I78 PolarHBondContact O-N 3.31Å; I78-N81 PolarHBondContact O-N 3.29Å; I78-K82 PolarHBondContact O-N 3.06Å |
| 79 | L | 84.1 | Confident | 87.6 | Confident | 47 Ų | 47 | 47.7 Ų | 47.7 | 25% | 0.246 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.6 | -41.5 | 179.9 | -71.6 | 175 | 0 | 0 | 0 | 112.2 | I75 S76 S77 N81 K82 Y83 I88 F126 | I75-L79 HydrophobicContact CG2-CD1 3.99Å; I75-L79 WeakPolarHBondContact O-CG 3.13Å; I75-L79 PolarHBondContact O-N 3.14Å; S76-L79 PolarHBondContact O-N 2.95Å; S77-L79 PolarHBondContact O-N 3.42Å; L79-N81 VanDerWaalsContact C-N 3.32Å; L79-N81 PolarHBondContact O-N 3.4Å; L79-K82 PolarHBondContact O-N 3.39Å; L79-Y83 HydrophobicContact CD2-CD2 4.04Å; L79-Y83 HydrophobicContact CD2-CE2 3.84Å; L79-Y83 PolarHBondContact O-N 2.83Å; L79-I88 HydrophobicContact CB-CD1 3.75Å; L79-I88 HydrophobicContact CB-CG1 4.15Å; L79-F126 HydrophobicContact CD1-CE1 3.9Å; L79-F126 HydrophobicContact CD1-CE2 4.16Å; L79-F126 HydrophobicContact CD1-CZ 3.57Å |
| 80 | V | 83.4 | Confident | 87.7 | Confident | 7 Ų | 7 | 50.3 Ų | 50.3 | 4% | 0.042 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62 | -40.8 | 175.2 | 168.4 | 0 | 0 | 0 | 0 | 111.4 | S76 S77 K82 G84 S85 I88 P130 | S76-V80 WeakPolarHBondContact O-CB 3.47Å; S76-V80 WeakPolarHBondContact O-CG2 3.5Å; S76-V80 PolarHBondContact O-N 3.25Å; S77-V80 PolarHBondContact O-N 2.78Å; V80-K82 PolarHBondContact O-N 3.05Å; V80-G84 CarbonylContact O-C 3.6Å; V80-G84 WeakPolarHBondContact O-CA 3.38Å; V80-G84 PolarHBondContact O-N 3.42Å; V80-S85 WeakPolarHBondContact CG1-OG 3.31Å; V80-I88 HydrophobicContact CG2-CB 4.17Å; V80-I88 HydrophobicContact CG2-CG1 4.24Å; V80-I88 HydrophobicContact CG2-CG2 4.12Å; V80-P130 HydrophobicContact CG2-CB 3.67Å; V80-P130 HydrophobicContact CG2-CG 3.48Å; V80-P130 VanDerWaalsContact CG2-CG 3.48Å |
| 81 | N | 80.3 | Confident | 88.1 | Confident | 84 Ų | 84 | 51.2 Ų | 51.2 | 45% | 0.449 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.4 | -28.9 | 177.6 | -73.9 | -34 | 0 | 0 | 0 | 112.7 | S77 I78 L79 | S77-N81 WeakPolarHBondContact O-CB 3.39Å; S77-N81 VanDerWaalsContact O-CG 3.28Å; S77-N81 PolarHBondContact O-N 2.92Å; S77-N81 PolarHBondContact O-ND2 3.31Å; S77-N81 VanDerWaalsContact O-ND2 3.09Å; I78-N81 PolarHBondContact O-N 3.29Å; L79-N81 VanDerWaalsContact C-N 3.32Å; L79-N81 PolarHBondContact O-N 3.4Å |
| 82 | K | 83.2 | Confident | 88.4 | Confident | 144 Ų | 144 | 49 Ų | 49 | 63% | 0.626 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -88.6 | -44.5 | -179.6 | -169.4 | 177.7 | 179.4 | -163.8 | 0 | 113.3 | I78 L79 V80 | I78-K82 PolarHBondContact O-N 3.06Å; L79-K82 PolarHBondContact O-N 3.39Å; V80-K82 PolarHBondContact O-N 3.05Å |
| 83 | Y | 86 | Confident | 88.8 | Confident | 127 Ų | 127 | 48.9 Ų | 48.9 | 50% | 0.498 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -112.8 | -6.5 | -170 | -58.5 | -65.8 | 0 | 0 | 0 | 113.9 | L79 I88 | L79-Y83 HydrophobicContact CD2-CD2 4.04Å; L79-Y83 HydrophobicContact CD2-CE2 3.84Å; L79-Y83 PolarHBondContact O-N 2.83Å; Y83-I88 HydrophobicContact CD2-CD1 4.27Å |
| 84 | G | 86.5 | Confident | 89.4 | Confident | 26 Ų | 26 | 51 Ų | 51 | 27% | 0.268 | 27% | 0.273 | S | S | . | . | trans | 86.7 | 163.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | V80 I88 | V80-G84 CarbonylContact O-C 3.6Å; V80-G84 WeakPolarHBondContact O-CA 3.38Å; V80-G84 PolarHBondContact O-N 3.42Å; G84-I88 VanDerWaalsContact O-CG1 3.29Å; G84-I88 WeakPolarHBondContact O-CG1 3.49Å | ||
| 85 | S | 88.6 | Confident | 90 | Very high | 7 Ų | 7 | 51.9 Ų | 51.9 | 5% | 0.049 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -71.8 | -40.6 | -173.8 | -51.5 | 0 | 0 | 0 | 0 | 113.9 | V80 I88 M89 M134 | V80-S85 WeakPolarHBondContact CG1-OG 3.31Å; S85-I88 PolarHBondContact O-N 2.97Å; S85-M89 WeakPolarHBondContact O-CG 3.33Å; S85-M89 PolarHBondContact O-N 3.29Å; S85-M89 VanDerWaalsContact O-N 3.08Å; S85-M134 VanDerWaalsContact CB-SD 3.56Å; S85-M134 PolarHBondContact OG-SD 2.93Å |
| 86 | R | 93.6 | Very high | 90.4 | Very high | 117 Ų | 117 | 47.8 Ų | 47.8 | 44% | 0.442 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -62.9 | -50.4 | -174.2 | 174.9 | 174.6 | 178.3 | -175 | 3.6 | 113.7 | I88 M89 I90 M195 | R86-I88 VanDerWaalsContact C-N 3.29Å; R86-I88 PolarHBondContact O-N 3.1Å; R86-M89 PolarHBondContact O-N 3.5Å; R86-I90 HydrophobicContact CG-CD1 3.91Å; R86-I90 WeakPolarHBondContact O-CG1 3.5Å; R86-I90 PolarHBondContact O-N 3.5Å; R86-I90 VanDerWaalsContact O-N 3.13Å; R86-M195 HydrophobicContact CB-CB 4.43Å |
| 87 | P | 94.5 | Very high | 90.9 | Very high | 70 Ų | 70 | 47.8 Ų | 47.8 | 46% | 0.455 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -62.7 | -36.4 | 179 | -23.6 | 35.7 | 0 | 0 | 0 | 112.7 | I90 A91 | P87-I90 PolarHBondContact O-N 3.44Å; P87-A91 WeakPolarHBondContact O-CB 3.45Å; P87-A91 PolarHBondContact O-N 3.41Å |
| 88 | I | 95.1 | Very high | 91.5 | Very high | 15 Ų | 15 | 49 Ų | 49 | 8% | 0.077 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -67.7 | -41.7 | -179.6 | -60.7 | -54.5 | 0 | 0 | 0 | 111.5 | L79 V80 Y83 G84 S85 R86 A91 G92 F126 P130 | L79-I88 HydrophobicContact CB-CD1 3.75Å; L79-I88 HydrophobicContact CB-CG1 4.15Å; V80-I88 HydrophobicContact CG2-CB 4.17Å; V80-I88 HydrophobicContact CG2-CG1 4.24Å; V80-I88 HydrophobicContact CG2-CG2 4.12Å; Y83-I88 HydrophobicContact CD2-CD1 4.27Å; G84-I88 VanDerWaalsContact O-CG1 3.29Å; G84-I88 WeakPolarHBondContact O-CG1 3.49Å; S85-I88 PolarHBondContact O-N 2.97Å; R86-I88 VanDerWaalsContact C-N 3.29Å; R86-I88 PolarHBondContact O-N 3.1Å; I88-A91 PolarHBondContact O-N 3.44Å; I88-G92 PolarHBondContact O-N 3.31Å; I88-F126 HydrophobicContact CG2-CB 3.96Å; I88-F126 HydrophobicContact CG2-CD1 4.49Å; I88-F126 HydrophobicContact CG2-CG 4.11Å; I88-P130 HydrophobicContact CG2-CG 4.1Å |
| 89 | M | 95.5 | Very high | 92.2 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -66.6 | -40.8 | 175.8 | -70.1 | -174.3 | 65 | 0 | 0 | 112.6 | S29 S85 R86 G92 G93 F126 N127 P130 A131 M195 | S29-M89 WeakPolarHBondContact OG-CE 3.4Å; S85-M89 WeakPolarHBondContact O-CG 3.33Å; S85-M89 PolarHBondContact O-N 3.29Å; S85-M89 VanDerWaalsContact O-N 3.08Å; R86-M89 PolarHBondContact O-N 3.5Å; M89-G92 PolarHBondContact O-N 2.87Å; M89-G93 PolarHBondContact O-N 3.17Å; M89-F126 WeakPolarHBondContact CG-O 3.16Å; M89-N127 PolarHBondContact O-OD1 3.27Å; M89-P130 HydrophobicContact CG-CB 3.64Å; M89-P130 HydrophobicContact CG-CG 3.74Å; M89-P130 HydrophobicContact SD-CB 3.86Å; M89-P130 HydrophobicContact SD-CG 4.5Å; M89-A131 HydrophobicContact CE-CB 4.08Å; M89-A131 HydrophobicContact SD-CB 4.4Å; M89-M195 HydrophobicContact CE-CE 3.99Å; M89-M195 HydrophobicContact CE-CG 4.26Å; M89-M195 HydrophobicContact SD-CE 4.19Å; M89-M195 HydrophobicContact SD-CG 3.56Å; M89-M195 VanDerWaalsContact SD-CG 3.56Å; M89-M195 HydrophobicContact SD-SD 4.33Å |
| 90 | I | 96.7 | Very high | 92.8 | Very high | 57 Ų | 57 | 42.6 Ų | 42.6 | 29% | 0.292 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -62.1 | -47.8 | 175.5 | -66.6 | 168.8 | 0 | 0 | 0 | 110.2 | R86 P87 G92 G93 C94 C189 | R86-I90 HydrophobicContact CG-CD1 3.91Å; R86-I90 WeakPolarHBondContact O-CG1 3.5Å; R86-I90 PolarHBondContact O-N 3.5Å; R86-I90 VanDerWaalsContact O-N 3.13Å; P87-I90 PolarHBondContact O-N 3.44Å; I90-G92 VanDerWaalsContact C-N 3.29Å; I90-G92 PolarHBondContact O-N 3.29Å; I90-G93 PolarHBondContact O-N 3.06Å; I90-C94 PolarHBondContact O-N 3.21Å; I90-C94 PolarHBondContact O-SG 3.13Å; I90-C94 VanDerWaalsContact O-SG 3.42Å; I90-C189 HydrophobicContact CG2-CB 4.32Å; I90-C189 PolarHBondContact O-SG 3.23Å; I90-C189 VanDerWaalsContact O-SG 3.39Å |
| 91 | A | 96.5 | Very high | 93.5 | Very high | 51 Ų | 51 | 44.8 Ų | 44.8 | 42% | 0.421 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60 | -40.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | P87 I88 C94 L95 | P87-A91 WeakPolarHBondContact O-CB 3.45Å; P87-A91 PolarHBondContact O-N 3.41Å; I88-A91 PolarHBondContact O-N 3.44Å; A91-C94 PolarHBondContact O-N 3.47Å; A91-L95 VanDerWaalsContact O-CB 3.24Å; A91-L95 WeakPolarHBondContact O-CB 3.47Å; A91-L95 PolarHBondContact O-N 3.48Å |
| 92 | G | 96.2 | Very high | 94.3 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.4 | -43 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | I88 M89 I90 L95 S96 G123 | I88-G92 PolarHBondContact O-N 3.31Å; M89-G92 PolarHBondContact O-N 2.87Å; I90-G92 VanDerWaalsContact C-N 3.29Å; I90-G92 PolarHBondContact O-N 3.29Å; G92-L95 PolarHBondContact O-N 3.22Å; G92-S96 PolarHBondContact O-N 3.38Å; G92-S96 PolarHBondContact O-OG 3.08Å; G92-G123 CarbonylContact C-O 3.56Å; G92-G123 WeakPolarHBondContact CA-O 3.23Å; G92-G123 CarbonylContact O-C 3.53Å; G92-G123 WeakPolarHBondContact O-CA 3.35Å |
| 93 | G | 96.5 | Very high | 94.9 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.5 | -41.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | M89 I90 L95 S96 G97 N127 C189 | M89-G93 PolarHBondContact O-N 3.17Å; I90-G93 PolarHBondContact O-N 3.06Å; G93-L95 VanDerWaalsContact C-N 3.33Å; G93-S96 PolarHBondContact O-OG 2.92Å; G93-G97 PolarHBondContact O-N 3.41Å; G93-N127 PolarHBondContact N-ND2 2.89Å; G93-N127 VanDerWaalsContact N-ND2 3.11Å; G93-C189 VanDerWaalsContact C-SG 3.51Å |
| 94 | C | 97.3 | Very high | 95.4 | Very high | 55 Ų | 55 | 30.3 Ų | 30.3 | 37% | 0.372 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -61.1 | -44.3 | 172.4 | -68.6 | 0 | 0 | 0 | 0 | 111.2 | I90 A91 G97 C98 C189 | I90-C94 PolarHBondContact O-N 3.21Å; I90-C94 PolarHBondContact O-SG 3.13Å; I90-C94 VanDerWaalsContact O-SG 3.42Å; A91-C94 PolarHBondContact O-N 3.47Å; C94-G97 PolarHBondContact O-N 2.9Å; C94-C98 VanDerWaalsContact O-CB 3.27Å; C94-C98 WeakPolarHBondContact O-CB 3.37Å; C94-C98 PolarHBondContact O-N 2.94Å; C94-C98 PolarHBondContact O-SG 2.95Å; C94-C189 PolarHBondContact N-SG 3.25Å |
| 95 | L | 96.9 | Very high | 95.8 | Very high | 57 Ų | 57 | 35.9 Ų | 35.9 | 30% | 0.298 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -62.8 | -48.2 | -178.9 | -171.8 | 66.9 | 0 | 0 | 0 | 111.6 | A91 G92 G93 G99 V119 L122 | A91-L95 VanDerWaalsContact O-CB 3.24Å; A91-L95 WeakPolarHBondContact O-CB 3.47Å; A91-L95 PolarHBondContact O-N 3.48Å; G92-L95 PolarHBondContact O-N 3.22Å; G93-L95 VanDerWaalsContact C-N 3.33Å; L95-G99 PolarHBondContact O-N 3.45Å; L95-V119 HydrophobicContact CD1-CG1 3.72Å; L95-V119 HydrophobicContact CG-CG1 3.86Å; L95-V119 WeakPolarHBondContact O-CG1 3.36Å; L95-L122 HydrophobicContact CD2-CB 4.06Å; L95-L122 HydrophobicContact CD2-CD2 3.9Å; L95-L122 HydrophobicContact CD2-CG 4.06Å |
| 96 | S | 96.1 | Very high | 96.1 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -69.3 | -38.5 | 179.6 | 62.5 | 0 | 0 | 0 | 0 | 112.6 | G92 G93 G99 L100 | G92-S96 PolarHBondContact O-N 3.38Å; G92-S96 PolarHBondContact O-OG 3.08Å; G93-S96 PolarHBondContact O-OG 2.92Å; S96-G99 PolarHBondContact O-N 3.4Å; S96-L100 PolarHBondContact O-N 3.14Å; S96-L100 VanDerWaalsContact O-N 3.16Å |
| 97 | G | 96.7 | Very high | 96.1 | Very high | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.7 | -51 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | G93 C94 G99 L100 I101 G182 | G93-G97 PolarHBondContact O-N 3.41Å; C94-G97 PolarHBondContact O-N 2.9Å; G97-G99 VanDerWaalsContact C-N 3.31Å; G97-G99 PolarHBondContact O-N 3.3Å; G97-L100 PolarHBondContact O-N 3Å; G97-I101 VanDerWaalsContact O-CG1 3.27Å; G97-I101 WeakPolarHBondContact O-CG1 3.4Å; G97-I101 PolarHBondContact O-N 3.38Å; G97-G182 WeakPolarHBondContact CA-O 3.13Å |
| 98 | C | 96.8 | Very high | 96.1 | Very high | 75 Ų | 75 | 34.5 Ų | 34.5 | 51% | 0.507 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -61.9 | -37.8 | 176.6 | -70.7 | 0 | 0 | 0 | 0 | 112.4 | C94 L100 I101 A102 | C94-C98 VanDerWaalsContact O-CB 3.27Å; C94-C98 WeakPolarHBondContact O-CB 3.37Å; C94-C98 PolarHBondContact O-N 2.94Å; C94-C98 PolarHBondContact O-SG 2.95Å; C98-L100 VanDerWaalsContact C-N 3.33Å; C98-L100 PolarHBondContact O-N 2.91Å; C98-I101 PolarHBondContact O-N 3.46Å; C98-A102 VanDerWaalsContact O-CB 3.3Å; C98-A102 WeakPolarHBondContact O-CB 3.19Å; C98-A102 PolarHBondContact O-N 3.09Å |
| 99 | G | 96.8 | Very high | 95.9 | Very high | 2 Ų | 2 | 34.1 Ų | 34.1 | 2% | 0.021 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -58.4 | -43.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L95 S96 G97 A103 C115 | L95-G99 PolarHBondContact O-N 3.45Å; S96-G99 PolarHBondContact O-N 3.4Å; G97-G99 VanDerWaalsContact C-N 3.31Å; G97-G99 PolarHBondContact O-N 3.3Å; G99-A103 WeakPolarHBondContact O-CB 3.16Å; G99-A103 PolarHBondContact O-N 2.91Å; G99-C115 WeakPolarHBondContact O-CB 3.16Å |
| 100 | L | 96.1 | Very high | 95.8 | Very high | 1 Ų | 1 | 39.1 Ų | 39.1 | 1% | 0.005 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -73 | -39.1 | 177.3 | -94.7 | 57.9 | 0 | 0 | 0 | 113.6 | F36 S96 G97 C98 A102 A103 S104 L181 L185 | F36-L100 HydrophobicContact CE1-CD1 4.05Å; F36-L100 HydrophobicContact CE1-CD2 3.79Å; F36-L100 HydrophobicContact CE1-CG 4.31Å; F36-L100 HydrophobicContact CE2-CD2 3.81Å; F36-L100 HydrophobicContact CZ-CD1 4.31Å; F36-L100 HydrophobicContact CZ-CD2 3.2Å; F36-L100 HydrophobicContact CZ-CG 4.06Å; S96-L100 PolarHBondContact O-N 3.14Å; S96-L100 VanDerWaalsContact O-N 3.16Å; G97-L100 PolarHBondContact O-N 3Å; C98-L100 VanDerWaalsContact C-N 3.33Å; C98-L100 PolarHBondContact O-N 2.91Å; L100-A102 VanDerWaalsContact C-N 3.31Å; L100-A102 PolarHBondContact O-N 3.44Å; L100-A103 WeakPolarHBondContact O-CB 3.29Å; L100-A103 PolarHBondContact O-N 3.01Å; L100-A103 VanDerWaalsContact O-N 3.16Å; L100-S104 PolarHBondContact O-N 3.34Å; L100-S104 VanDerWaalsContact O-N 3.13Å; L100-L181 HydrophobicContact CD2-CB 3.85Å; L100-L185 HydrophobicContact CD1-CD1 3.95Å; L100-L185 HydrophobicContact CD2-CD1 3.34Å; L100-L185 HydrophobicContact CD2-CG 3.98Å; L100-L185 HydrophobicContact CG-CD1 4.22Å |
| 101 | I | 97.1 | Very high | 95.8 | Very high | 53 Ų | 53 | 40.2 Ų | 40.2 | 27% | 0.272 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61 | -45.6 | 174.9 | -66.2 | 167.2 | 0 | 0 | 0 | 109.3 | G97 C98 A103 S104 F105 L179 L186 | G97-I101 VanDerWaalsContact O-CG1 3.27Å; G97-I101 WeakPolarHBondContact O-CG1 3.4Å; G97-I101 PolarHBondContact O-N 3.38Å; C98-I101 PolarHBondContact O-N 3.46Å; I101-A103 VanDerWaalsContact C-N 3.32Å; I101-A103 PolarHBondContact O-N 3.4Å; I101-S104 WeakPolarHBondContact O-CB 3.27Å; I101-S104 PolarHBondContact O-N 2.88Å; I101-S104 PolarHBondContact O-OG 3.47Å; I101-F105 HydrophobicContact CG2-CE2 4.32Å; I101-F105 VanDerWaalsContact O-CD2 3.24Å; I101-F105 WeakPolarHBondContact O-CD2 3.35Å; I101-F105 WeakPolarHBondContact O-CE2 3.45Å; I101-L179 HydrophobicContact CB-CD1 4.38Å; I101-L179 HydrophobicContact CG1-CD1 4.15Å; I101-L179 HydrophobicContact CG2-CD1 3.83Å; I101-L186 HydrophobicContact CD1-CD1 4.5Å |
| 102 | A | 96.8 | Very high | 95.8 | Very high | 44 Ų | 44 | 37.9 Ų | 37.9 | 36% | 0.364 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -60.4 | -41.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | C98 L100 S104 F105 C106 | C98-A102 VanDerWaalsContact O-CB 3.3Å; C98-A102 WeakPolarHBondContact O-CB 3.19Å; C98-A102 PolarHBondContact O-N 3.09Å; L100-A102 VanDerWaalsContact C-N 3.31Å; L100-A102 PolarHBondContact O-N 3.44Å; A102-S104 PolarHBondContact O-N 3.33Å; A102-S104 VanDerWaalsContact O-N 3.16Å; A102-F105 PolarHBondContact O-N 3.4Å; A102-C106 PolarHBondContact O-SG 3.46Å |
| 103 | A | 96.4 | Very high | 95.8 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -58.3 | -28.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | G99 L100 I101 F105 C106 L112 C115 V116 F178 | G99-A103 WeakPolarHBondContact O-CB 3.16Å; G99-A103 PolarHBondContact O-N 2.91Å; L100-A103 WeakPolarHBondContact O-CB 3.29Å; L100-A103 PolarHBondContact O-N 3.01Å; L100-A103 VanDerWaalsContact O-N 3.16Å; I101-A103 VanDerWaalsContact C-N 3.32Å; I101-A103 PolarHBondContact O-N 3.4Å; A103-F105 PolarHBondContact O-N 3.37Å; A103-C106 VanDerWaalsContact CA-SG 3.6Å; A103-C106 WeakPolarHBondContact O-CB 3.44Å; A103-C106 PolarHBondContact O-N 3.03Å; A103-L112 HydrophobicContact CB-CD2 3.9Å; A103-C115 HydrophobicContact CB-CB 3.93Å; A103-V116 HydrophobicContact CB-CG2 3.48Å; A103-V116 VanDerWaalsContact CB-CG2 3.48Å; A103-F178 HydrophobicContact CB-CD2 3.89Å; A103-F178 HydrophobicContact CB-CE2 4.44Å |
| 104 | S | 96.4 | Very high | 95.8 | Very high | 7 Ų | 7 | 45.7 Ų | 45.7 | 5% | 0.049 | 24% | 0.241 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -19.8 | 177 | 75.6 | 0 | 0 | 0 | 0 | 113.8 | L100 I101 A102 R175 | L100-S104 PolarHBondContact O-N 3.34Å; L100-S104 VanDerWaalsContact O-N 3.13Å; I101-S104 WeakPolarHBondContact O-CB 3.27Å; I101-S104 PolarHBondContact O-N 2.88Å; I101-S104 PolarHBondContact O-OG 3.47Å; A102-S104 PolarHBondContact O-N 3.33Å; A102-S104 VanDerWaalsContact O-N 3.16Å; S104-R175 VanDerWaalsContact CB-O 3.25Å; S104-R175 WeakPolarHBondContact CB-O 3.35Å; S104-R175 WeakPolarHBondContact O-CD 3.44Å; S104-R175 WeakPolarHBondContact O-CG 2.98Å; S104-R175 PolarHBondContact O-NE 3.46Å |
| 105 | F | 95.6 | Very high | 95.8 | Very high | 143 Ų | 143 | 43.9 Ų | 43.9 | 63% | 0.627 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -101.1 | -2.8 | 178.8 | -60 | -78.4 | 0 | 0 | 0 | 113.3 | I101 A102 A103 N107 | I101-F105 HydrophobicContact CG2-CE2 4.32Å; I101-F105 VanDerWaalsContact O-CD2 3.24Å; I101-F105 WeakPolarHBondContact O-CD2 3.35Å; I101-F105 WeakPolarHBondContact O-CE2 3.45Å; A102-F105 PolarHBondContact O-N 3.4Å; A103-F105 PolarHBondContact O-N 3.37Å; F105-N107 PolarHBondContact O-ND2 2.86Å |
| 106 | C | 94.8 | Very high | 95.8 | Very high | 7 Ų | 7 | 41.1 Ų | 41.1 | 5% | 0.047 | 22% | 0.215 | C | C | . | . | trans | -67.9 | 147.8 | -178.9 | -67.1 | 0 | 0 | 0 | 0 | 112.3 | A102 A103 E111 L112 W174 R175 | A102-C106 PolarHBondContact O-SG 3.46Å; A103-C106 VanDerWaalsContact CA-SG 3.6Å; A103-C106 WeakPolarHBondContact O-CB 3.44Å; A103-C106 PolarHBondContact O-N 3.03Å; C106-E111 VanDerWaalsContact CA-OE2 3.22Å; C106-E111 WeakPolarHBondContact CA-OE2 3.42Å; C106-E111 HydrophobicContact CB-CB 3.85Å; C106-E111 WeakPolarHBondContact CB-OE2 3.5Å; C106-L112 HydrophobicContact CB-CD2 3.78Å; C106-L112 HydrophobicContact CB-CG 4.2Å; C106-W174 WeakPolarHBondContact O-CH2 3.18Å; C106-R175 PolarHBondContact O-NH2 3.25Å | ||
| 107 | N | 93.4 | Very high | 95.7 | Very high | 104 Ų | 104 | 41.1 Ų | 41.1 | 56% | 0.556 | 22% | 0.215 | S | C | * | . | trans | -124 | 0.6 | -179.4 | -61 | -54.6 | 0 | 0 | 0 | 113 | F51 F105 E111 R175 | F51-N107 VanDerWaalsContact CE1-C 3.47Å; F51-N107 VanDerWaalsContact CE1-O 3.24Å; F51-N107 WeakPolarHBondContact CE1-O 3.12Å; F105-N107 PolarHBondContact O-ND2 2.86Å; N107-E111 PolarHBondContact N-OE2 2.6Å; N107-R175 PolarHBondContact OD1-NH2 3.06Å | ||
| 108 | T | 93.5 | Very high | 95.8 | Very high | 53 Ų | 53 | 43.9 Ų | 43.9 | 33% | 0.325 | 23% | 0.231 | S | C | . | . | S | Bend | trans | -134.4 | 157.7 | 174.3 | 62.8 | 0 | 0 | 0 | 0 | 111.2 | E110 E111 L112 | T108-E110 VanDerWaalsContact C-N 3.28Å; T108-E111 PolarHBondContact N-OE2 2.82Å; T108-E111 PolarHBondContact O-N 3.33Å; T108-E111 WeakPolarHBondContact OG1-CG 3.46Å; T108-E111 PolarHBondContact OG1-N 3.19Å; T108-E111 PolarHBondContact OG1-OE1 2.7Å; T108-L112 PolarHBondContact O-N 3.39Å |
| 109 | V | 92.6 | Very high | 95.8 | Very high | 8 Ų | 8 | 41.7 Ų | 41.7 | 5% | 0.048 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -71.3 | -30.9 | -179.8 | -175.1 | 0 | 0 | 0 | 0 | 110.5 | F51 A53 I61 L112 Y113 | F51-V109 HydrophobicContact CB-CG2 3.58Å; F51-V109 HydrophobicContact CD1-CG2 4.39Å; F51-V109 HydrophobicContact CD2-CG2 4.15Å; F51-V109 HydrophobicContact CG-CG2 3.79Å; A53-V109 HydrophobicContact CB-CG2 4.1Å; I61-V109 HydrophobicContact CD1-CG1 4.45Å; V109-L112 WeakPolarHBondContact O-CA 3.25Å; V109-L112 WeakPolarHBondContact O-CB 3.34Å; V109-L112 PolarHBondContact O-N 3.01Å; V109-L112 VanDerWaalsContact O-N 3.11Å; V109-Y113 HydrophobicContact CG1-CD1 4.37Å; V109-Y113 HydrophobicContact CG1-CE1 3.55Å; V109-Y113 WeakPolarHBondContact CG1-OH 3.23Å; V109-Y113 WeakPolarHBondContact O-CD1 3.36Å; V109-Y113 PolarHBondContact O-N 3.48Å |
| 110 | E | 93.5 | Very high | 95.8 | Very high | 105 Ų | 105 | 41.6 Ų | 41.6 | 49% | 0.491 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -65.3 | -39.7 | 178 | -64.8 | 72.7 | -164.9 | 0 | 0 | 111.6 | T108 L112 Y113 F114 | T108-E110 VanDerWaalsContact C-N 3.28Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 3.43Å; E110-Y113 HydrophobicContact CG-CE2 4.41Å; E110-Y113 WeakPolarHBondContact O-CB 3.46Å; E110-Y113 PolarHBondContact O-N 3.29Å; E110-F114 PolarHBondContact O-N 2.76Å |
| 111 | E | 95.9 | Very high | 95.8 | Very high | 80 Ų | 80 | 41.6 Ų | 41.6 | 37% | 0.374 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -62.5 | -38.6 | 170.7 | -73.4 | 163.9 | -164.2 | 0 | 0 | 111.6 | C106 N107 T108 Y113 F114 C115 | C106-E111 VanDerWaalsContact CA-OE2 3.22Å; C106-E111 WeakPolarHBondContact CA-OE2 3.42Å; C106-E111 HydrophobicContact CB-CB 3.85Å; C106-E111 WeakPolarHBondContact CB-OE2 3.5Å; N107-E111 PolarHBondContact N-OE2 2.6Å; T108-E111 PolarHBondContact N-OE2 2.82Å; T108-E111 PolarHBondContact O-N 3.33Å; T108-E111 WeakPolarHBondContact OG1-CG 3.46Å; T108-E111 PolarHBondContact OG1-N 3.19Å; T108-E111 PolarHBondContact OG1-OE1 2.7Å; E111-Y113 VanDerWaalsContact C-N 3.34Å; E111-Y113 PolarHBondContact O-N 3.02Å; E111-F114 PolarHBondContact O-N 2.87Å; E111-C115 WeakPolarHBondContact O-CB 3.46Å; E111-C115 PolarHBondContact O-N 3.26Å |
| 112 | L | 95.8 | Very high | 95.7 | Very high | 1 Ų | 1 | 41.5 Ų | 41.5 | 1% | 0.005 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -65.1 | -35.2 | 175.8 | -65.8 | 177.4 | 0 | 0 | 0 | 112.3 | F51 I61 A103 C106 T108 V109 E110 F114 V116 G117 W174 F178 | F51-L112 HydrophobicContact CE2-CD1 4.04Å; F51-L112 HydrophobicContact CZ-CD1 4.48Å; I61-L112 HydrophobicContact CD1-CB 4.08Å; I61-L112 HydrophobicContact CD1-CD1 4.19Å; I61-L112 HydrophobicContact CG1-CB 4.41Å; A103-L112 HydrophobicContact CB-CD2 3.9Å; C106-L112 HydrophobicContact CB-CD2 3.78Å; C106-L112 HydrophobicContact CB-CG 4.2Å; T108-L112 PolarHBondContact O-N 3.39Å; V109-L112 WeakPolarHBondContact O-CA 3.25Å; V109-L112 WeakPolarHBondContact O-CB 3.34Å; V109-L112 PolarHBondContact O-N 3.01Å; V109-L112 VanDerWaalsContact O-N 3.11Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 3.43Å; L112-F114 VanDerWaalsContact C-N 3.26Å; L112-F114 PolarHBondContact O-N 3.36Å; L112-V116 HydrophobicContact CD2-CG2 4.36Å; L112-V116 WeakPolarHBondContact O-CB 3.33Å; L112-V116 PolarHBondContact O-N 3.19Å; L112-G117 PolarHBondContact O-N 2.87Å; L112-W174 HydrophobicContact CD2-CZ3 4.19Å; L112-F178 HydrophobicContact CD2-CE2 4.12Å |
| 113 | Y | 96.4 | Very high | 95.7 | Very high | 39 Ų | 39 | 39.4 Ų | 39.4 | 15% | 0.153 | 20% | 0.197 | C | C | . | . | I | π-helix | trans | -58.7 | -41.1 | 172.7 | -60.5 | -24.5 | 0 | 0 | 0 | 111.7 | K57 W60 I61 I64 V109 E110 E111 G117 V118 | K57-Y113 WeakPolarHBondContact O-CE1 3.35Å; K57-Y113 PolarHBondContact O-OH 3.26Å; W60-Y113 HydrophobicContact CB-CD1 4.04Å; W60-Y113 HydrophobicContact CB-CE1 3.49Å; W60-Y113 VanDerWaalsContact CB-CE1 3.49Å; I61-Y113 HydrophobicContact CB-CD1 4.49Å; I61-Y113 HydrophobicContact CG1-CD1 3.64Å; I61-Y113 HydrophobicContact CG1-CE1 3.73Å; I64-Y113 HydrophobicContact CD1-CD1 4.14Å; I64-Y113 HydrophobicContact CD1-CD2 4.4Å; I64-Y113 HydrophobicContact CD1-CG 3.87Å; V109-Y113 HydrophobicContact CG1-CD1 4.37Å; V109-Y113 HydrophobicContact CG1-CE1 3.55Å; V109-Y113 WeakPolarHBondContact CG1-OH 3.23Å; V109-Y113 WeakPolarHBondContact O-CD1 3.36Å; V109-Y113 PolarHBondContact O-N 3.48Å; E110-Y113 HydrophobicContact CG-CE2 4.41Å; E110-Y113 WeakPolarHBondContact O-CB 3.46Å; E110-Y113 PolarHBondContact O-N 3.29Å; E111-Y113 VanDerWaalsContact C-N 3.34Å; E111-Y113 PolarHBondContact O-N 3.02Å; Y113-G117 CarbonylContact O-C 3.52Å; Y113-G117 WeakPolarHBondContact O-CA 3.47Å; Y113-G117 PolarHBondContact O-N 3.25Å; Y113-G117 VanDerWaalsContact O-N 3.09Å; Y113-V118 PolarHBondContact O-N 3.22Å |
| 114 | F | 97.1 | Very high | 95.7 | Very high | 125 Ų | 125 | 39.5 Ų | 39.5 | 55% | 0.548 | 20% | 0.198 | S | C | . | . | I | π-helix | trans | -73.4 | -53.5 | 179.9 | -176.4 | -103 | 0 | 0 | 0 | 111.7 | E110 E111 L112 V118 V119 | E110-F114 PolarHBondContact O-N 2.76Å; E111-F114 PolarHBondContact O-N 2.87Å; L112-F114 VanDerWaalsContact C-N 3.26Å; L112-F114 PolarHBondContact O-N 3.36Å; F114-V118 HydrophobicContact CD2-CB 4.31Å; F114-V118 HydrophobicContact CD2-CG2 4.48Å; F114-V118 WeakPolarHBondContact O-CB 3.47Å; F114-V118 PolarHBondContact O-N 3.41Å; F114-V118 VanDerWaalsContact O-N 3.14Å; F114-V119 HydrophobicContact CD1-CG2 4.31Å; F114-V119 HydrophobicContact CE1-CG2 3.92Å; F114-V119 HydrophobicContact CZ-CG2 4.12Å; F114-V119 PolarHBondContact O-N 3.41Å |
| 115 | C | 97.3 | Very high | 95.6 | Very high | 17 Ų | 17 | 39.1 Ų | 39.1 | 12% | 0.115 | 20% | 0.195 | C | C | . | . | I | π-helix | trans | -68.6 | -50.4 | -174.5 | -72.6 | 0 | 0 | 0 | 0 | 113 | G99 A103 E111 V119 G120 | G99-C115 WeakPolarHBondContact O-CB 3.16Å; A103-C115 HydrophobicContact CB-CB 3.93Å; E111-C115 WeakPolarHBondContact O-CB 3.46Å; E111-C115 PolarHBondContact O-N 3.26Å; C115-V119 WeakPolarHBondContact O-CB 3.24Å; C115-G120 PolarHBondContact O-N 2.9Å; C115-G120 VanDerWaalsContact O-N 3.14Å |
| 116 | V | 96.1 | Very high | 95.6 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.17 | C | C | . | . | I | π-helix | trans | -83.9 | -45.8 | -179 | -179 | 0 | 0 | 0 | 0 | 110.7 | I40 I61 M65 A103 L112 G120 F178 | I40-V116 HydrophobicContact CD1-CG1 3.59Å; I61-V116 HydrophobicContact CG2-CB 3.95Å; I61-V116 HydrophobicContact CG2-CG1 3.73Å; M65-V116 HydrophobicContact CE-CG1 4.02Å; M65-V116 HydrophobicContact SD-CG1 4.24Å; A103-V116 HydrophobicContact CB-CG2 3.48Å; A103-V116 VanDerWaalsContact CB-CG2 3.48Å; L112-V116 HydrophobicContact CD2-CG2 4.36Å; L112-V116 WeakPolarHBondContact O-CB 3.33Å; L112-V116 PolarHBondContact O-N 3.19Å; V116-G120 VanDerWaalsContact O-CA 3.31Å; V116-G120 WeakPolarHBondContact O-CA 3.43Å; V116-G120 PolarHBondContact O-N 2.99Å; V116-F178 HydrophobicContact CG2-CE2 4.35Å |
| 117 | G | 95.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.168 | C | C | . | . | I | π-helix | trans | -69.7 | -66.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | M65 L112 Y113 G121 | M65-G117 WeakPolarHBondContact CA-O 3.43Å; L112-G117 PolarHBondContact O-N 2.87Å; Y113-G117 CarbonylContact O-C 3.52Å; Y113-G117 WeakPolarHBondContact O-CA 3.47Å; Y113-G117 PolarHBondContact O-N 3.25Å; Y113-G117 VanDerWaalsContact O-N 3.09Å; G117-G121 VanDerWaalsContact O-CA 3.3Å; G117-G121 WeakPolarHBondContact O-CA 3.47Å; G117-G121 PolarHBondContact O-N 3.5Å |
| 118 | V | 97 | Very high | 95.5 | Very high | 58 Ų | 58 | 28.4 Ų | 28.4 | 35% | 0.352 | 14% | 0.143 | S | C | . | . | I | π-helix | trans | -75.3 | -56.3 | -172.2 | -178.5 | 0 | 0 | 0 | 0 | 111.9 | I64 Y113 F114 L122 | I64-V118 HydrophobicContact CG2-CG2 3.9Å; Y113-V118 PolarHBondContact O-N 3.22Å; F114-V118 HydrophobicContact CD2-CB 4.31Å; F114-V118 HydrophobicContact CD2-CG2 4.48Å; F114-V118 WeakPolarHBondContact O-CB 3.47Å; F114-V118 PolarHBondContact O-N 3.41Å; F114-V118 VanDerWaalsContact O-N 3.14Å; V118-L122 WeakPolarHBondContact O-CB 3.34Å; V118-L122 PolarHBondContact O-N 3.29Å |
| 119 | V | 97.5 | Very high | 95.2 | Very high | 28 Ų | 28 | 27.8 Ų | 27.8 | 17% | 0.17 | 14% | 0.138 | C | C | . | . | I | π-helix | trans | -67.8 | -47.9 | -176.1 | 176.5 | 0 | 0 | 0 | 0 | 110.4 | L95 F114 C115 G123 | L95-V119 HydrophobicContact CD1-CG1 3.72Å; L95-V119 HydrophobicContact CG-CG1 3.86Å; L95-V119 WeakPolarHBondContact O-CG1 3.36Å; F114-V119 HydrophobicContact CD1-CG2 4.31Å; F114-V119 HydrophobicContact CE1-CG2 3.92Å; F114-V119 HydrophobicContact CZ-CG2 4.12Å; F114-V119 PolarHBondContact O-N 3.41Å; C115-V119 WeakPolarHBondContact O-CB 3.24Å; V119-G123 PolarHBondContact O-N 2.94Å; V119-G123 VanDerWaalsContact O-N 3.08Å |
| 120 | G | 96.5 | Very high | 95.1 | Very high | 1 Ų | 1 | 27.4 Ų | 27.4 | 1% | 0.01 | 14% | 0.135 | C | C | . | . | I | π-helix | trans | -58.5 | -51.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | C115 V116 L122 G123 L124 | C115-G120 PolarHBondContact O-N 2.9Å; C115-G120 VanDerWaalsContact O-N 3.14Å; V116-G120 VanDerWaalsContact O-CA 3.31Å; V116-G120 WeakPolarHBondContact O-CA 3.43Å; V116-G120 PolarHBondContact O-N 2.99Å; G120-L122 PolarHBondContact O-N 2.92Å; G120-G123 PolarHBondContact O-N 2.92Å; G120-L124 WeakPolarHBondContact O-CG 3.14Å; G120-L124 PolarHBondContact O-N 3.41Å |
| 121 | G | 96.3 | Very high | 95 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -58.9 | -42.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | M69 G117 L124 A125 | M69-G121 WeakPolarHBondContact CA-O 3.38Å; G117-G121 VanDerWaalsContact O-CA 3.3Å; G117-G121 WeakPolarHBondContact O-CA 3.47Å; G117-G121 PolarHBondContact O-N 3.5Å; G121-L124 PolarHBondContact O-N 3.23Å; G121-A125 PolarHBondContact O-N 3.39Å |
| 122 | L | 96.1 | Very high | 94.5 | Very high | 52 Ų | 52 | 21.1 Ų | 21.1 | 27% | 0.272 | 11% | 0.107 | S | C | . | . | H | α-helix | trans | -66.3 | -41.3 | 177.4 | -170.2 | 69.4 | 0 | 0 | 0 | 111.2 | V68 L95 V118 G120 L124 A125 F126 | V68-L122 HydrophobicContact CG1-CB 4.06Å; L95-L122 HydrophobicContact CD2-CB 4.06Å; L95-L122 HydrophobicContact CD2-CD2 3.9Å; L95-L122 HydrophobicContact CD2-CG 4.06Å; V118-L122 WeakPolarHBondContact O-CB 3.34Å; V118-L122 PolarHBondContact O-N 3.29Å; G120-L122 PolarHBondContact O-N 2.92Å; L122-L124 VanDerWaalsContact C-N 3.34Å; L122-L124 PolarHBondContact O-N 3.33Å; L122-A125 WeakPolarHBondContact O-CB 3.48Å; L122-A125 PolarHBondContact O-N 3.42Å; L122-F126 HydrophobicContact CD1-CE1 3.87Å; L122-F126 HydrophobicContact CD1-CE2 4.5Å; L122-F126 HydrophobicContact CD1-CZ 3.79Å; L122-F126 HydrophobicContact CD2-CE2 4.24Å; L122-F126 HydrophobicContact CD2-CZ 4.13Å; L122-F126 HydrophobicContact CG-CE1 4.21Å; L122-F126 HydrophobicContact CG-CE2 4.02Å; L122-F126 HydrophobicContact CG-CZ 3.81Å; L122-F126 WeakPolarHBondContact O-CG 3.45Å; L122-F126 PolarHBondContact O-N 3.45Å |
| 123 | G | 96.5 | Very high | 94 | Very high | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.3 | -39.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | G92 V119 G120 F126 N127 | G92-G123 CarbonylContact C-O 3.56Å; G92-G123 WeakPolarHBondContact CA-O 3.23Å; G92-G123 CarbonylContact O-C 3.53Å; G92-G123 WeakPolarHBondContact O-CA 3.35Å; V119-G123 PolarHBondContact O-N 2.94Å; V119-G123 VanDerWaalsContact O-N 3.08Å; G120-G123 PolarHBondContact O-N 2.92Å; G123-F126 PolarHBondContact O-N 3.18Å; G123-N127 PolarHBondContact O-N 3.38Å; G123-N127 PolarHBondContact O-ND2 2.91Å |
| 124 | L | 96 | Very high | 93.6 | Very high | 1 Ų | 1 | 21.9 Ų | 21.9 | 1% | 0.005 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -68.9 | -34.2 | 174.4 | -65.4 | -179.7 | 0 | 0 | 0 | 112.4 | S33 F36 P37 M65 M69 G120 G121 L122 F126 N127 L128 L185 | S33-L124 PolarHBondContact OG-O 3.21Å; F36-L124 HydrophobicContact CB-CD1 4.36Å; P37-L124 HydrophobicContact CG-CD1 4.28Å; M65-L124 HydrophobicContact CG-CD1 4.32Å; M65-L124 HydrophobicContact SD-CD1 3.94Å; M69-L124 HydrophobicContact CG-CB 4.19Å; M69-L124 HydrophobicContact SD-CB 4.01Å; G120-L124 WeakPolarHBondContact O-CG 3.14Å; G120-L124 PolarHBondContact O-N 3.41Å; G121-L124 PolarHBondContact O-N 3.23Å; L122-L124 VanDerWaalsContact C-N 3.34Å; L122-L124 PolarHBondContact O-N 3.33Å; L124-F126 VanDerWaalsContact C-N 3.35Å; L124-N127 PolarHBondContact O-N 3.27Å; L124-L128 WeakPolarHBondContact O-CB 3.4Å; L124-L128 PolarHBondContact O-N 3.4Å; L124-L185 HydrophobicContact CD2-CD2 4.23Å |
| 125 | A | 94.5 | Very high | 93.1 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -62.3 | -42.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | M69 G121 L122 N127 L128 N129 | M69-A125 HydrophobicContact CG-CB 4.47Å; M69-A125 WeakPolarHBondContact O-CB 3.36Å; G121-A125 PolarHBondContact O-N 3.39Å; L122-A125 WeakPolarHBondContact O-CB 3.48Å; L122-A125 PolarHBondContact O-N 3.42Å; A125-N127 PolarHBondContact O-N 3.11Å; A125-L128 PolarHBondContact O-N 2.96Å; A125-N129 PolarHBondContact O-N 3.35Å; A125-N129 PolarHBondContact O-ND2 3Å |
| 126 | F | 95 | Very high | 92.3 | Very high | 22 Ų | 22 | 16.2 Ų | 16.2 | 10% | 0.096 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -71.4 | -13 | 177.8 | -68.5 | -4.3 | 0 | 0 | 0 | 113.1 | I75 L79 I88 M89 L122 G123 L124 P130 | I75-F126 HydrophobicContact CG2-CE1 4.01Å; I75-F126 HydrophobicContact CG2-CZ 4.18Å; L79-F126 HydrophobicContact CD1-CE1 3.9Å; L79-F126 HydrophobicContact CD1-CE2 4.16Å; L79-F126 HydrophobicContact CD1-CZ 3.57Å; I88-F126 HydrophobicContact CG2-CB 3.96Å; I88-F126 HydrophobicContact CG2-CD1 4.49Å; I88-F126 HydrophobicContact CG2-CG 4.11Å; M89-F126 WeakPolarHBondContact CG-O 3.16Å; L122-F126 HydrophobicContact CD1-CE1 3.87Å; L122-F126 HydrophobicContact CD1-CE2 4.5Å; L122-F126 HydrophobicContact CD1-CZ 3.79Å; L122-F126 HydrophobicContact CD2-CE2 4.24Å; L122-F126 HydrophobicContact CD2-CZ 4.13Å; L122-F126 HydrophobicContact CG-CE1 4.21Å; L122-F126 HydrophobicContact CG-CE2 4.02Å; L122-F126 HydrophobicContact CG-CZ 3.81Å; L122-F126 WeakPolarHBondContact O-CG 3.45Å; L122-F126 PolarHBondContact O-N 3.45Å; G123-F126 PolarHBondContact O-N 3.18Å; L124-F126 VanDerWaalsContact C-N 3.35Å; F126-P130 VanDerWaalsContact O-CD 3.25Å; F126-P130 WeakPolarHBondContact O-CD 3.3Å; F126-P130 WeakPolarHBondContact O-CG 3.4Å |
| 127 | N | 94.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 20.2 Ų | 20.2 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -90.8 | -43 | 169.7 | -84.8 | -74 | 0 | 0 | 0 | 112.5 | M89 G93 G123 L124 A125 A131 C188 | M89-N127 PolarHBondContact O-OD1 3.27Å; G93-N127 PolarHBondContact N-ND2 2.89Å; G93-N127 VanDerWaalsContact N-ND2 3.11Å; G123-N127 PolarHBondContact O-N 3.38Å; G123-N127 PolarHBondContact O-ND2 2.91Å; L124-N127 PolarHBondContact O-N 3.27Å; A125-N127 PolarHBondContact O-N 3.11Å; N127-A131 WeakPolarHBondContact O-CB 3.33Å; N127-A131 PolarHBondContact O-N 3.21Å; N127-C188 WeakPolarHBondContact OD1-CB 3.25Å |
| 128 | L | 91.6 | Very high | 91.2 | Very high | 7 Ų | 7 | 20.5 Ų | 20.5 | 4% | 0.037 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -66.1 | -54.3 | -173.6 | 176 | 58 | 0 | 0 | 0 | 113 | I30 Y34 M69 L124 A125 A131 L132 | I30-L128 HydrophobicContact CG1-CD1 3.93Å; I30-L128 HydrophobicContact CG2-CD1 4.43Å; Y34-L128 HydrophobicContact CD2-CD1 4.26Å; Y34-L128 HydrophobicContact CE1-CD2 4.49Å; Y34-L128 HydrophobicContact CE2-CD1 3.61Å; Y34-L128 HydrophobicContact CE2-CD2 4.02Å; Y34-L128 HydrophobicContact CE2-CG 4.49Å; M69-L128 HydrophobicContact CE-CD2 4.19Å; M69-L128 HydrophobicContact CG-CD2 4.41Å; M69-L128 HydrophobicContact SD-CD2 4.27Å; L124-L128 WeakPolarHBondContact O-CB 3.4Å; L124-L128 PolarHBondContact O-N 3.4Å; A125-L128 PolarHBondContact O-N 2.96Å; L128-A131 PolarHBondContact O-N 3.22Å; L128-L132 HydrophobicContact CD1-CD1 4.21Å; L128-L132 PolarHBondContact O-N 3.31Å |
| 129 | N | 87.8 | Confident | 90.5 | Very high | 40 Ų | 40 | 17.7 Ų | 17.7 | 21% | 0.214 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -68.2 | -43.5 | -171.1 | -65.4 | -75.9 | 0 | 0 | 0 | 113.8 | G73 A125 A131 L132 T133 | G73-N129 WeakPolarHBondContact CA-ND2 3.4Å; A125-N129 PolarHBondContact O-N 3.35Å; A125-N129 PolarHBondContact O-ND2 3Å; N129-A131 VanDerWaalsContact C-N 3.3Å; N129-A131 PolarHBondContact O-N 3.28Å; N129-L132 PolarHBondContact O-N 3.32Å; N129-T133 PolarHBondContact O-N 3.26Å; N129-T133 PolarHBondContact O-OG1 3.2Å |
| 130 | P | 89.7 | Confident | 89.6 | Confident | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -69.3 | -30.5 | 179.2 | -11.8 | 26.7 | 0 | 0 | 0 | 111.8 | V80 I88 M89 F126 T133 M134 | V80-P130 HydrophobicContact CG2-CB 3.67Å; V80-P130 HydrophobicContact CG2-CG 3.48Å; V80-P130 VanDerWaalsContact CG2-CG 3.48Å; I88-P130 HydrophobicContact CG2-CG 4.1Å; M89-P130 HydrophobicContact CG-CB 3.64Å; M89-P130 HydrophobicContact CG-CG 3.74Å; M89-P130 HydrophobicContact SD-CB 3.86Å; M89-P130 HydrophobicContact SD-CG 4.5Å; F126-P130 VanDerWaalsContact O-CD 3.25Å; F126-P130 WeakPolarHBondContact O-CD 3.3Å; F126-P130 WeakPolarHBondContact O-CG 3.4Å; P130-T133 PolarHBondContact O-N 3.4Å; P130-M134 WeakPolarHBondContact O-CB 3.48Å; P130-M134 VanDerWaalsContact O-CG 3.24Å; P130-M134 WeakPolarHBondContact O-CG 3Å; P130-M134 PolarHBondContact O-N 3Å |
| 131 | A | 91.6 | Very high | 88.6 | Confident | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.4 | -49 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | A26 I30 M89 N127 L128 N129 T133 M134 I135 M195 | A26-A131 HydrophobicContact CB-CB 3.96Å; I30-A131 HydrophobicContact CG1-CB 4.41Å; M89-A131 HydrophobicContact CE-CB 4.08Å; M89-A131 HydrophobicContact SD-CB 4.4Å; N127-A131 WeakPolarHBondContact O-CB 3.33Å; N127-A131 PolarHBondContact O-N 3.21Å; L128-A131 PolarHBondContact O-N 3.22Å; N129-A131 VanDerWaalsContact C-N 3.3Å; N129-A131 PolarHBondContact O-N 3.28Å; A131-T133 VanDerWaalsContact C-N 3.33Å; A131-T133 PolarHBondContact O-N 2.92Å; A131-M134 PolarHBondContact O-N 3.24Å; A131-I135 WeakPolarHBondContact O-CG1 3.48Å; A131-I135 PolarHBondContact O-N 2.87Å; A131-I135 VanDerWaalsContact O-N 3.1Å; A131-M195 HydrophobicContact CB-CE 4.41Å |
| 132 | L | 86.4 | Confident | 87.9 | Confident | 53 Ų | 53 | 32.9 Ų | 32.9 | 28% | 0.277 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -62.1 | -40.4 | 175.6 | -69.1 | 173.1 | 0 | 0 | 0 | 112.3 | I30 L128 N129 M134 I135 G136 | I30-L132 HydrophobicContact CD1-CD2 3.81Å; I30-L132 HydrophobicContact CD1-CG 4.33Å; L128-L132 HydrophobicContact CD1-CD1 4.21Å; L128-L132 PolarHBondContact O-N 3.31Å; N129-L132 PolarHBondContact O-N 3.32Å; L132-M134 PolarHBondContact O-N 3.49Å; L132-I135 PolarHBondContact O-N 2.84Å; L132-G136 PolarHBondContact O-N 3.39Å |
| 133 | T | 85.2 | Confident | 87 | Confident | 55 Ų | 55 | 35.9 Ų | 35.9 | 34% | 0.337 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -63.3 | -42.2 | 177.5 | -57.1 | 0 | 0 | 0 | 0 | 111.4 | N129 P130 A131 G136 K137 | N129-T133 PolarHBondContact O-N 3.26Å; N129-T133 PolarHBondContact O-OG1 3.2Å; P130-T133 PolarHBondContact O-N 3.4Å; A131-T133 VanDerWaalsContact C-N 3.33Å; A131-T133 PolarHBondContact O-N 2.92Å; T133-G136 PolarHBondContact O-N 3.27Å; T133-K137 PolarHBondContact O-N 3.36Å |
| 134 | M | 87.2 | Confident | 86 | Confident | 1 Ų | 1 | 40.7 Ų | 40.7 | 1% | 0.005 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -68.4 | -40.1 | -179.5 | -72.8 | -56.7 | -61.4 | 0 | 0 | 112.3 | V22 S85 P130 A131 L132 G136 K137 Y138 M195 R196 | V22-M134 HydrophobicContact CG1-CB 4.08Å; S85-M134 VanDerWaalsContact CB-SD 3.56Å; S85-M134 PolarHBondContact OG-SD 2.93Å; P130-M134 WeakPolarHBondContact O-CB 3.48Å; P130-M134 VanDerWaalsContact O-CG 3.24Å; P130-M134 WeakPolarHBondContact O-CG 3Å; P130-M134 PolarHBondContact O-N 3Å; A131-M134 PolarHBondContact O-N 3.24Å; L132-M134 PolarHBondContact O-N 3.49Å; M134-G136 VanDerWaalsContact C-N 3.27Å; M134-G136 PolarHBondContact O-N 2.89Å; M134-K137 PolarHBondContact O-N 3.41Å; M134-K137 VanDerWaalsContact O-N 3.07Å; M134-K137 HydrophobicContact SD-CD 4.28Å; M134-Y138 HydrophobicContact CE-CD2 4.08Å; M134-Y138 HydrophobicContact CE-CE2 3.55Å; M134-Y138 WeakPolarHBondContact O-CD2 3.22Å; M134-Y138 PolarHBondContact O-N 3.37Å; M134-Y138 VanDerWaalsContact O-N 3.08Å; M134-M195 HydrophobicContact CB-SD 3.68Å; M134-M195 HydrophobicContact CE-CB 4.45Å; M134-M195 HydrophobicContact CG-CB 4.17Å; M134-M195 HydrophobicContact CG-CG 4.37Å; M134-M195 HydrophobicContact CG-SD 3.87Å; M134-R196 WeakPolarHBondContact CE-O 3.36Å |
| 135 | I | 85.8 | Confident | 85.5 | Confident | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -56.1 | -45.9 | 172.5 | -66.8 | 165 | 0 | 0 | 0 | 110.4 | A26 A131 L132 K137 Y138 F139 A146 N147 A150 | A26-I135 HydrophobicContact CB-CD1 3.56Å; A26-I135 HydrophobicContact CB-CG1 4.01Å; A131-I135 WeakPolarHBondContact O-CG1 3.48Å; A131-I135 PolarHBondContact O-N 2.87Å; A131-I135 VanDerWaalsContact O-N 3.1Å; L132-I135 PolarHBondContact O-N 2.84Å; I135-K137 PolarHBondContact O-N 2.87Å; I135-Y138 PolarHBondContact O-N 2.92Å; I135-F139 HydrophobicContact CG2-CD2 4.36Å; I135-F139 PolarHBondContact O-N 3.35Å; I135-A146 HydrophobicContact CG2-CB 3.65Å; I135-N147 VanDerWaalsContact CG2-OD1 3.3Å; I135-N147 WeakPolarHBondContact CG2-OD1 3.47Å; I135-A150 HydrophobicContact CD1-CB 3.55Å |
| 136 | G | 80.9 | Confident | 85 | Confident | 23 Ų | 23 | 45.4 Ų | 45.4 | 24% | 0.237 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -64.2 | -22.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | L132 T133 M134 | L132-G136 PolarHBondContact O-N 3.39Å; T133-G136 PolarHBondContact O-N 3.27Å; M134-G136 VanDerWaalsContact C-N 3.27Å; M134-G136 PolarHBondContact O-N 2.89Å |
| 137 | K | 83.8 | Confident | 84.6 | Confident | 84 Ų | 84 | 46.5 Ų | 46.5 | 37% | 0.365 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -83.8 | -31.6 | 174.1 | -71.3 | -176.6 | 178 | -175.2 | 0 | 113.1 | Y11 T133 M134 I135 I198 | Y11-K137 VanDerWaalsContact CE1-O 3.3Å; Y11-K137 WeakPolarHBondContact CE1-O 3.33Å; Y11-K137 PolarHBondContact OH-O 3.23Å; T133-K137 PolarHBondContact O-N 3.36Å; M134-K137 PolarHBondContact O-N 3.41Å; M134-K137 VanDerWaalsContact O-N 3.07Å; M134-K137 HydrophobicContact SD-CD 4.28Å; I135-K137 PolarHBondContact O-N 2.87Å; K137-I198 HydrophobicContact CB-CD1 4.44Å; K137-I198 HydrophobicContact CB-CG1 4.32Å |
| 138 | Y | 86.1 | Confident | 84 | Confident | 5 Ų | 5 | 48.6 Ų | 48.6 | 2% | 0.02 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -84.4 | -31.1 | -179.1 | -89.4 | -91.5 | 0 | 0 | 0 | 113.1 | P14 E15 W18 V22 M134 I135 R196 I198 | P14-Y138 HydrophobicContact CG-CD1 3.76Å; P14-Y138 HydrophobicContact CG-CE1 4.23Å; E15-Y138 PolarHBondContact N-O 2.85Å; W18-Y138 HydrophobicContact CB-CE1 4.25Å; V22-Y138 HydrophobicContact CB-CD2 4.35Å; V22-Y138 HydrophobicContact CB-CE2 4.45Å; V22-Y138 HydrophobicContact CG1-CD2 4.1Å; V22-Y138 HydrophobicContact CG1-CE2 4.47Å; V22-Y138 HydrophobicContact CG2-CD2 4.03Å; V22-Y138 HydrophobicContact CG2-CE1 4.4Å; V22-Y138 HydrophobicContact CG2-CE2 3.65Å; M134-Y138 HydrophobicContact CE-CD2 4.08Å; M134-Y138 HydrophobicContact CE-CE2 3.55Å; M134-Y138 WeakPolarHBondContact O-CD2 3.22Å; M134-Y138 PolarHBondContact O-N 3.37Å; M134-Y138 VanDerWaalsContact O-N 3.08Å; I135-Y138 PolarHBondContact O-N 2.92Å; Y138-R196 WeakPolarHBondContact CE2-O 3.35Å; Y138-R196 WeakPolarHBondContact OH-CB 3.38Å; Y138-R196 PolarHBondContact OH-O 3.42Å; Y138-I198 HydrophobicContact CD1-CD1 3.67Å; Y138-I198 HydrophobicContact CD2-CD1 3.39Å; Y138-I198 HydrophobicContact CD2-CG1 4.27Å; Y138-I198 HydrophobicContact CE1-CD1 3.67Å; Y138-I198 HydrophobicContact CE1-CG2 4.37Å; Y138-I198 HydrophobicContact CE2-CD1 3.37Å; Y138-I198 HydrophobicContact CE2-CG1 3.96Å; Y138-I198 HydrophobicContact CE2-CG2 4.37Å; Y138-I198 HydrophobicContact CG-CD1 3.55Å; Y138-I198 WeakPolarHBondContact OH-CG2 3.5Å |
| 139 | F | 82.1 | Confident | 83.9 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 27% | 0.271 | C | S | . | . | trans | -130.2 | 133.5 | -175.9 | -59.9 | -79.8 | 0 | 0 | 0 | 111.7 | G19 W20 V23 I135 K142 R143 A146 | G19-F139 WeakPolarHBondContact O-CE2 3.42Å; W20-F139 HydrophobicContact CD2-CZ 4.11Å; W20-F139 HydrophobicContact CE3-CZ 4.32Å; W20-F139 HydrophobicContact CZ2-CE1 4.38Å; V23-F139 HydrophobicContact CG2-CD2 4.46Å; V23-F139 HydrophobicContact CG2-CE2 3.69Å; V23-F139 HydrophobicContact CG2-CZ 4.36Å; I135-F139 HydrophobicContact CG2-CD2 4.36Å; I135-F139 PolarHBondContact O-N 3.35Å; F139-K142 HydrophobicContact CD1-CB 3.9Å; F139-K142 HydrophobicContact CE1-CB 4.48Å; F139-R143 HydrophobicContact CB-CB 4.19Å; F139-R143 WeakPolarHBondContact O-CB 3.22Å; F139-A146 HydrophobicContact CB-CB 4.47Å; F139-A146 HydrophobicContact CD2-CB 3.65Å; F139-A146 HydrophobicContact CE2-CB 3.99Å; F139-A146 HydrophobicContact CG-CB 4.07Å | ||
| 140 | F | 78.7 | Confident | 84.1 | Confident | 85 Ų | 85 | 50.1 Ų | 50.1 | 37% | 0.373 | 26% | 0.261 | S | S | . | . | S | Bend | trans | -116.5 | -55.6 | 170.5 | -178.4 | -100.5 | 0 | 0 | 0 | 110.2 | G6 P13 E15 R143 | G6-F140 WeakPolarHBondContact O-CZ 3.26Å; P13-F140 HydrophobicContact CB-CB 4.34Å; P13-F140 HydrophobicContact CG-CB 3.83Å; E15-F140 VanDerWaalsContact OE1-CA 3.3Å; E15-F140 WeakPolarHBondContact OE1-CA 3.34Å; E15-F140 WeakPolarHBondContact OE1-CB 3.47Å; E15-F140 PolarHBondContact OE1-N 2.91Å; F140-R143 WeakPolarHBondContact O-CB 3.25Å |
| 141 | K | 75.7 | Confident | 83.9 | Confident | 164 Ų | 164 | 52.3 Ų | 52.3 | 71% | 0.713 | 27% | 0.272 | S | S | * | . | S | Bend | trans | -71.5 | -48.1 | 177 | -68.1 | -176.2 | 179.1 | 177.8 | 0 | 112.1 | E15 R143 | E15-K141 PolarHBondContact OE1-N 3.47Å; K141-R143 VanDerWaalsContact C-N 3.29Å; K141-R143 PolarHBondContact O-N 3.01Å |
| 142 | K | 80.6 | Confident | 83.7 | Confident | 98 Ų | 98 | 53.8 Ų | 53.8 | 43% | 0.426 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -89.3 | 13.2 | 180 | -62.1 | 177.9 | -178 | 171.6 | 0 | 113.6 | E15 W20 F139 L145 A146 | E15-K142 PolarHBondContact OE2-N 3.15Å; E15-K142 VanDerWaalsContact OE2-N 3.12Å; W20-K142 HydrophobicContact CZ2-CD 4.39Å; F139-K142 HydrophobicContact CD1-CB 3.9Å; F139-K142 HydrophobicContact CE1-CB 4.48Å; K142-L145 PolarHBondContact O-N 3.33Å; K142-A146 PolarHBondContact O-N 3.47Å |
| 143 | R | 77.4 | Confident | 83.9 | Confident | 116 Ų | 116 | 51.2 Ų | 51.2 | 44% | 0.438 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -58.3 | -42.5 | -176.1 | -168.8 | 178.6 | 177.5 | -172.9 | -0.7 | 114 | F139 F140 K141 L145 A146 N147 | F139-R143 HydrophobicContact CB-CB 4.19Å; F139-R143 WeakPolarHBondContact O-CB 3.22Å; F140-R143 WeakPolarHBondContact O-CB 3.25Å; K141-R143 VanDerWaalsContact C-N 3.29Å; K141-R143 PolarHBondContact O-N 3.01Å; R143-L145 VanDerWaalsContact C-N 3.33Å; R143-L145 PolarHBondContact O-N 2.83Å; R143-A146 PolarHBondContact O-N 3.32Å; R143-N147 WeakPolarHBondContact O-CB 3.39Å; R143-N147 PolarHBondContact O-N 2.56Å |
| 144 | P | 76.6 | Confident | 84.2 | Confident | 101 Ų | 101 | 48.8 Ų | 48.8 | 66% | 0.656 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -61.9 | -40.4 | 177.7 | -23.8 | 35.5 | 0 | 0 | 0 | 112.6 | G148 | P144-G148 PolarHBondContact O-N 3.43Å |
| 145 | L | 83.4 | Confident | 84.4 | Confident | 100 Ų | 100 | 48.9 Ų | 48.9 | 52% | 0.524 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -65.3 | -46.2 | 176.6 | 179.1 | 62.8 | 0 | 0 | 0 | 111.5 | W20 K142 R143 G148 L149 | W20-L145 HydrophobicContact CH2-CD2 3.96Å; W20-L145 HydrophobicContact CH2-CG 4.41Å; K142-L145 PolarHBondContact O-N 3.33Å; R143-L145 VanDerWaalsContact C-N 3.33Å; R143-L145 PolarHBondContact O-N 2.83Å; L145-G148 PolarHBondContact O-N 3.01Å; L145-L149 HydrophobicContact CD1-CD1 4.32Å; L145-L149 HydrophobicContact CD1-CG 4.48Å; L145-L149 HydrophobicContact CG-CD1 4.25Å; L145-L149 WeakPolarHBondContact O-CG 3.02Å; L145-L149 PolarHBondContact O-N 3.28Å |
| 146 | A | 85.6 | Confident | 84.7 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.5 | -44.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | V23 I135 F139 K142 R143 A150 | V23-A146 HydrophobicContact CG2-CB 3.75Å; I135-A146 HydrophobicContact CG2-CB 3.65Å; F139-A146 HydrophobicContact CB-CB 4.47Å; F139-A146 HydrophobicContact CD2-CB 3.65Å; F139-A146 HydrophobicContact CE2-CB 3.99Å; F139-A146 HydrophobicContact CG-CB 4.07Å; K142-A146 PolarHBondContact O-N 3.47Å; R143-A146 PolarHBondContact O-N 3.32Å; A146-A150 WeakPolarHBondContact O-CB 3.19Å; A146-A150 PolarHBondContact O-N 3.15Å |
| 147 | N | 85.8 | Confident | 85.4 | Confident | 45 Ų | 45 | 51.7 Ų | 51.7 | 24% | 0.241 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.7 | -43.8 | 173.8 | -82.4 | -15.1 | 0 | 0 | 0 | 111.7 | I135 R143 L149 A150 M151 | I135-N147 VanDerWaalsContact CG2-OD1 3.3Å; I135-N147 WeakPolarHBondContact CG2-OD1 3.47Å; R143-N147 WeakPolarHBondContact O-CB 3.39Å; R143-N147 PolarHBondContact O-N 2.56Å; N147-L149 PolarHBondContact O-N 3.37Å; N147-A150 PolarHBondContact O-N 3.29Å; N147-M151 VanDerWaalsContact O-CB 3.29Å; N147-M151 WeakPolarHBondContact O-CB 3.28Å; N147-M151 WeakPolarHBondContact O-CG 3.4Å; N147-M151 PolarHBondContact O-N 3.46Å |
| 148 | G | 82.8 | Confident | 85.9 | Confident | 44 Ų | 44 | 47.8 Ų | 47.8 | 45% | 0.454 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -58.5 | -47.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | P144 L145 M151 A152 | P144-G148 PolarHBondContact O-N 3.43Å; L145-G148 PolarHBondContact O-N 3.01Å; G148-M151 PolarHBondContact O-N 3.15Å; G148-A152 PolarHBondContact O-N 2.82Å |
| 149 | L | 89.4 | Confident | 86.3 | Confident | 78 Ų | 78 | 49.1 Ų | 49.1 | 41% | 0.408 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.8 | -50.3 | 175.2 | -73.8 | 167.5 | 0 | 0 | 0 | 111.5 | W20 V23 F27 L145 N147 M151 A152 | W20-L149 HydrophobicContact CZ3-CD1 3.74Å; V23-L149 HydrophobicContact CG1-CB 3.92Å; V23-L149 HydrophobicContact CG1-CD1 4.49Å; F27-L149 VanDerWaalsContact CD2-O 3.23Å; F27-L149 WeakPolarHBondContact CD2-O 3.49Å; L145-L149 HydrophobicContact CD1-CD1 4.32Å; L145-L149 HydrophobicContact CD1-CG 4.48Å; L145-L149 HydrophobicContact CG-CD1 4.25Å; L145-L149 WeakPolarHBondContact O-CG 3.02Å; L145-L149 PolarHBondContact O-N 3.28Å; N147-L149 PolarHBondContact O-N 3.37Å; L149-M151 VanDerWaalsContact C-N 3.32Å; L149-M151 PolarHBondContact O-N 3.09Å; L149-A152 WeakPolarHBondContact O-CB 3.4Å; L149-A152 PolarHBondContact O-N 2.83Å |
| 150 | A | 90.6 | Very high | 86.8 | Confident | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.8 | -38.5 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A26 I30 I135 A146 N147 A152 G153 | A26-A150 HydrophobicContact CB-CB 3.91Å; I30-A150 HydrophobicContact CD1-CB 3.81Å; I135-A150 HydrophobicContact CD1-CB 3.55Å; A146-A150 WeakPolarHBondContact O-CB 3.19Å; A146-A150 PolarHBondContact O-N 3.15Å; N147-A150 PolarHBondContact O-N 3.29Å; A150-A152 VanDerWaalsContact C-N 3.35Å; A150-G153 PolarHBondContact O-N 3.46Å |
| 151 | M | 87.3 | Confident | 87.6 | Confident | 47 Ų | 47 | 49.4 Ų | 49.4 | 23% | 0.232 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -71.2 | -26.8 | 177.3 | -69.1 | -69.4 | -78.4 | 0 | 0 | 113.3 | I30 Y34 N147 G148 L149 G153 S154 | I30-M151 HydrophobicContact CD1-SD 4.3Å; I30-M151 HydrophobicContact CG2-SD 3.87Å; Y34-M151 HydrophobicContact CE2-CE 4.48Å; Y34-M151 HydrophobicContact CE2-SD 4.48Å; N147-M151 VanDerWaalsContact O-CB 3.29Å; N147-M151 WeakPolarHBondContact O-CB 3.28Å; N147-M151 WeakPolarHBondContact O-CG 3.4Å; N147-M151 PolarHBondContact O-N 3.46Å; G148-M151 PolarHBondContact O-N 3.15Å; L149-M151 VanDerWaalsContact C-N 3.32Å; L149-M151 PolarHBondContact O-N 3.09Å; M151-G153 PolarHBondContact O-N 3.03Å; M151-S154 PolarHBondContact O-N 3.05Å |
| 152 | A | 87.2 | Confident | 88.3 | Confident | 30 Ų | 30 | 41.6 Ų | 41.6 | 25% | 0.248 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -65.3 | -16.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G148 L149 A150 S154 P155 V156 | G148-A152 PolarHBondContact O-N 2.82Å; L149-A152 WeakPolarHBondContact O-CB 3.4Å; L149-A152 PolarHBondContact O-N 2.83Å; A150-A152 VanDerWaalsContact C-N 3.35Å; A152-S154 VanDerWaalsContact C-N 3.25Å; A152-S154 PolarHBondContact O-N 3.5Å; A152-P155 WeakPolarHBondContact O-CD 3.5Å; A152-P155 VanDerWaalsContact O-CG 3.28Å; A152-P155 WeakPolarHBondContact O-CG 3.48Å; A152-V156 WeakPolarHBondContact O-CG2 3.44Å; A152-V156 PolarHBondContact O-N 3.19Å |
| 153 | G | 90.1 | Very high | 88.9 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -59.3 | -34.6 | 172 | 0 | 0 | 0 | 0 | 0 | 113.3 | F27 A150 M151 V156 F157 | F27-G153 VanDerWaalsContact CE2-N 3.28Å; F27-G153 VanDerWaalsContact CZ-CA 3.45Å; A150-G153 PolarHBondContact O-N 3.46Å; M151-G153 PolarHBondContact O-N 3.03Å; G153-V156 PolarHBondContact O-N 3.18Å; G153-F157 WeakPolarHBondContact O-CB 3.35Å; G153-F157 VanDerWaalsContact O-CD2 3.26Å; G153-F157 WeakPolarHBondContact O-CD2 3.43Å; G153-F157 PolarHBondContact O-N 3.37Å |
| 154 | S | 91.6 | Very high | 89.7 | Confident | 4 Ų | 4 | 35.4 Ų | 35.4 | 3% | 0.028 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.2 | -55.8 | 179.9 | 174.4 | 0 | 0 | 0 | 0 | 113.6 | Y34 M151 A152 L158 | Y34-S154 WeakPolarHBondContact CB-OG 3.43Å; M151-S154 PolarHBondContact O-N 3.05Å; A152-S154 VanDerWaalsContact C-N 3.25Å; A152-S154 PolarHBondContact O-N 3.5Å; S154-L158 WeakPolarHBondContact O-CB 3.39Å; S154-L158 PolarHBondContact O-N 3.37Å |
| 155 | P | 90.8 | Very high | 90.5 | Very high | 2 Ų | 2 | 30.6 Ų | 30.6 | 1% | 0.013 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -66.4 | -36.5 | 178 | 21.9 | -32.1 | 0 | 0 | 0 | 113.3 | A152 F157 L158 S159 A307 M311 | A152-P155 WeakPolarHBondContact O-CD 3.5Å; A152-P155 VanDerWaalsContact O-CG 3.28Å; A152-P155 WeakPolarHBondContact O-CG 3.48Å; P155-F157 PolarHBondContact O-N 3.34Å; P155-L158 PolarHBondContact O-N 2.94Å; P155-S159 PolarHBondContact O-N 3.38Å; P155-S159 PolarHBondContact O-OG 2.98Å; P155-A307 HydrophobicContact CB-CB 4.18Å; P155-A307 WeakPolarHBondContact CB-O 3.42Å; P155-A307 WeakPolarHBondContact O-CB 3.47Å; P155-M311 HydrophobicContact CB-CB 3.9Å; P155-M311 HydrophobicContact CG-CB 3.81Å; P155-M311 HydrophobicContact CG-CG 4.06Å |
| 156 | V | 93.3 | Very high | 90.9 | Very high | 46 Ų | 46 | 26 Ų | 26 | 28% | 0.279 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -62.3 | -44.2 | 177.9 | 173.6 | 0 | 0 | 0 | 0 | 111.6 | F27 A152 G153 S159 T160 M311 | F27-V156 HydrophobicContact CE1-CG1 4.47Å; F27-V156 HydrophobicContact CZ-CB 4Å; F27-V156 HydrophobicContact CZ-CG1 4.11Å; F27-V156 HydrophobicContact CZ-CG2 4.09Å; A152-V156 WeakPolarHBondContact O-CG2 3.44Å; A152-V156 PolarHBondContact O-N 3.19Å; G153-V156 PolarHBondContact O-N 3.18Å; V156-S159 PolarHBondContact O-OG 3.45Å; V156-T160 PolarHBondContact O-N 3.45Å; V156-T160 PolarHBondContact O-OG1 3.45Å; V156-M311 HydrophobicContact CG2-SD 3.57Å; V156-M311 VanDerWaalsContact CG2-SD 3.57Å |
| 157 | F | 95.6 | Very high | 91.2 | Very high | 37 Ų | 37 | 30.2 Ų | 30.2 | 16% | 0.162 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -67.4 | -38.5 | 176.3 | -87.7 | -113.5 | 0 | 0 | 0 | 111.2 | F27 I28 F32 A35 G153 P155 T160 L161 | F27-F157 AromaticContact CD1-CE2 3.9Å; F27-F157 HydrophobicContact CD1-CE2 3.9Å; F27-F157 HydrophobicContact CE1-CD2 4.13Å; F27-F157 AromaticContact CE1-CE2 3.68Å; F27-F157 HydrophobicContact CE1-CE2 3.68Å; I28-F157 HydrophobicContact CB-CZ 4.31Å; I28-F157 HydrophobicContact CG1-CZ 4.23Å; I28-F157 HydrophobicContact CG2-CZ 4.14Å; F32-F157 AromaticContact CD1-CD1 3.94Å; F32-F157 HydrophobicContact CD1-CD1 3.94Å; F32-F157 HydrophobicContact CD1-CE1 4.07Å; F32-F157 HydrophobicContact CD2-CD1 4.21Å; F32-F157 AromaticContact CD2-CE1 3.64Å; F32-F157 HydrophobicContact CD2-CE1 3.64Å; F32-F157 HydrophobicContact CD2-CZ 4.48Å; F32-F157 HydrophobicContact CE1-CD1 4.01Å; F32-F157 AromaticContact CE1-CE1 3.89Å; F32-F157 HydrophobicContact CE1-CE1 3.89Å; F32-F157 HydrophobicContact CE2-CD1 4.3Å; F32-F157 AromaticContact CE2-CE1 3.47Å; F32-F157 HydrophobicContact CE2-CE1 3.47Å; F32-F157 VanDerWaalsContact CE2-CE1 3.47Å; F32-F157 HydrophobicContact CE2-CZ 4.29Å; F32-F157 HydrophobicContact CG-CD1 4.05Å; F32-F157 AromaticContact CG-CE1 3.96Å; F32-F157 HydrophobicContact CG-CE1 3.96Å; F32-F157 HydrophobicContact CZ-CD1 4.2Å; F32-F157 AromaticContact CZ-CE1 3.6Å; F32-F157 HydrophobicContact CZ-CE1 3.6Å; A35-F157 HydrophobicContact CB-CB 3.65Å; G153-F157 WeakPolarHBondContact O-CB 3.35Å; G153-F157 VanDerWaalsContact O-CD2 3.26Å; G153-F157 WeakPolarHBondContact O-CD2 3.43Å; G153-F157 PolarHBondContact O-N 3.37Å; P155-F157 PolarHBondContact O-N 3.34Å; F157-T160 PolarHBondContact O-N 3.09Å; F157-L161 HydrophobicContact CB-CD1 4.24Å; F157-L161 HydrophobicContact CD1-CD1 4.19Å; F157-L161 WeakPolarHBondContact O-CB 3.43Å; F157-L161 VanDerWaalsContact O-CG 3.22Å; F157-L161 WeakPolarHBondContact O-CG 3.43Å; F157-L161 PolarHBondContact O-N 2.72Å |
| 158 | L | 93.8 | Very high | 91.6 | Very high | 2 Ų | 2 | 29.7 Ų | 29.7 | 1% | 0.01 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -65 | -44 | 178.2 | -178.4 | 56.8 | 0 | 0 | 0 | 112.1 | A35 K38 S154 P155 T160 A162 A307 | A35-L158 HydrophobicContact CB-CB 3.9Å; K38-L158 HydrophobicContact CB-CD1 3.7Å; K38-L158 HydrophobicContact CB-CD2 4.25Å; K38-L158 HydrophobicContact CD-CD2 3.88Å; S154-L158 WeakPolarHBondContact O-CB 3.39Å; S154-L158 PolarHBondContact O-N 3.37Å; P155-L158 PolarHBondContact O-N 2.94Å; L158-T160 PolarHBondContact O-N 3.22Å; L158-A162 WeakPolarHBondContact O-CB 3.33Å; L158-A162 PolarHBondContact O-N 3.05Å; L158-A162 VanDerWaalsContact O-N 3.14Å; L158-A307 HydrophobicContact CB-CB 3.97Å; L158-A307 HydrophobicContact CD2-CB 4Å; L158-A307 HydrophobicContact CG-CB 3.98Å |
| 159 | S | 93.5 | Very high | 92 | Very high | 33 Ų | 33 | 29.7 Ų | 29.7 | 23% | 0.231 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.4 | -26.9 | 178.5 | 65.5 | 0 | 0 | 0 | 0 | 113.5 | P155 V156 P163 S304 | P155-S159 PolarHBondContact O-N 3.38Å; P155-S159 PolarHBondContact O-OG 2.98Å; V156-S159 PolarHBondContact O-OG 3.45Å; S159-P163 WeakPolarHBondContact O-CD 3.25Å; S159-S304 PolarHBondContact O-OG 3.34Å |
| 160 | T | 94 | Very high | 92 | Very high | 79 Ų | 79 | 28.9 Ų | 28.9 | 49% | 0.485 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -87.8 | -45.3 | 177.7 | -49.6 | 0 | 0 | 0 | 0 | 111.5 | V156 F157 L158 P163 V164 | V156-T160 PolarHBondContact O-N 3.45Å; V156-T160 PolarHBondContact O-OG1 3.45Å; F157-T160 PolarHBondContact O-N 3.09Å; L158-T160 PolarHBondContact O-N 3.22Å; T160-P163 WeakPolarHBondContact O-CD 3.32Å; T160-V164 HydrophobicContact CG2-CG2 4.37Å; T160-V164 WeakPolarHBondContact O-CB 3.49Å; T160-V164 WeakPolarHBondContact O-CG2 3.5Å; T160-V164 PolarHBondContact O-N 2.85Å |
| 161 | L | 94.1 | Very high | 92.2 | Very high | 12 Ų | 12 | 34.1 Ų | 34.1 | 6% | 0.063 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -69.7 | -35.6 | -175 | -74.5 | 171.1 | 0 | 0 | 0 | 112.8 | F32 A35 F157 V164 N165 L181 | F32-L161 HydrophobicContact CD1-CD1 4.18Å; F32-L161 HydrophobicContact CE1-CD1 4.24Å; F32-L161 HydrophobicContact CE1-CD2 4.48Å; A35-L161 HydrophobicContact CB-CD1 4.27Å; F157-L161 HydrophobicContact CB-CD1 4.24Å; F157-L161 HydrophobicContact CD1-CD1 4.19Å; F157-L161 WeakPolarHBondContact O-CB 3.43Å; F157-L161 VanDerWaalsContact O-CG 3.22Å; F157-L161 WeakPolarHBondContact O-CG 3.43Å; F157-L161 PolarHBondContact O-N 2.72Å; L161-V164 PolarHBondContact O-N 3.26Å; L161-N165 WeakPolarHBondContact O-CB 3.48Å; L161-N165 PolarHBondContact O-N 3.27Å; L161-N165 PolarHBondContact O-ND2 3.19Å; L161-N165 PolarHBondContact O-OD1 2.89Å; L161-L181 HydrophobicContact CD2-CD2 4.38Å |
| 162 | A | 92.1 | Very high | 92.5 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.7 | -52.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | V42 L158 N165 Q166 L303 | V42-A162 HydrophobicContact CG2-CB 4.43Å; L158-A162 WeakPolarHBondContact O-CB 3.33Å; L158-A162 PolarHBondContact O-N 3.05Å; L158-A162 VanDerWaalsContact O-N 3.14Å; A162-N165 PolarHBondContact O-N 3.18Å; A162-Q166 PolarHBondContact O-N 3.1Å; A162-L303 HydrophobicContact CB-CB 3.92Å; A162-L303 HydrophobicContact CB-CD1 4.15Å |
| 163 | P | 92.1 | Very high | 92.8 | Very high | 36 Ų | 36 | 37.2 Ų | 37.2 | 23% | 0.234 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -66.3 | -40.2 | 175.7 | -22.3 | 34.6 | 0 | 0 | 0 | 112.7 | S159 T160 N165 Q166 L167 F301 S304 | S159-P163 WeakPolarHBondContact O-CD 3.25Å; T160-P163 WeakPolarHBondContact O-CD 3.32Å; P163-N165 VanDerWaalsContact C-N 3.32Å; P163-N165 PolarHBondContact O-N 3.44Å; P163-Q166 PolarHBondContact O-N 3.15Å; P163-L167 PolarHBondContact O-N 3.34Å; P163-F301 HydrophobicContact CG-CD2 4.39Å; P163-S304 VanDerWaalsContact CD-OG 3.27Å; P163-S304 WeakPolarHBondContact CD-OG 3.36Å; P163-S304 WeakPolarHBondContact CG-OG 3.48Å |
| 164 | V | 94 | Very high | 92.8 | Very high | 48 Ų | 48 | 37.9 Ų | 37.9 | 29% | 0.291 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.1 | -40.3 | 177.8 | 169.1 | 0 | 0 | 0 | 0 | 111.5 | T160 L161 Q166 L167 F168 | T160-V164 HydrophobicContact CG2-CG2 4.37Å; T160-V164 WeakPolarHBondContact O-CB 3.49Å; T160-V164 WeakPolarHBondContact O-CG2 3.5Å; T160-V164 PolarHBondContact O-N 2.85Å; L161-V164 PolarHBondContact O-N 3.26Å; V164-Q166 VanDerWaalsContact C-N 3.32Å; V164-Q166 PolarHBondContact O-N 2.93Å; V164-L167 PolarHBondContact O-N 3.41Å; V164-F168 HydrophobicContact CG1-CD1 4.29Å; V164-F168 HydrophobicContact CG1-CD2 3.96Å; V164-F168 HydrophobicContact CG1-CE1 3.82Å; V164-F168 HydrophobicContact CG1-CE2 3.46Å; V164-F168 VanDerWaalsContact CG1-CE2 3.46Å; V164-F168 HydrophobicContact CG1-CG 4.35Å; V164-F168 HydrophobicContact CG1-CZ 3.38Å; V164-F168 VanDerWaalsContact O-CG 3.29Å; V164-F168 WeakPolarHBondContact O-CG 3.41Å; V164-F168 PolarHBondContact O-N 3.31Å |
| 165 | N | 93.7 | Very high | 93 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.8 | -40.2 | 175.7 | -75.1 | -4.3 | 0 | 0 | 0 | 111.6 | S39 F43 L161 A162 P163 F168 F169 L181 | S39-N165 WeakPolarHBondContact CB-ND2 3.18Å; S39-N165 PolarHBondContact O-ND2 3.1Å; S39-N165 PolarHBondContact OG-ND2 3.39Å; F43-N165 HydrophobicContact CE2-CB 3.72Å; F43-N165 HydrophobicContact CZ-CB 3.73Å; F43-N165 WeakPolarHBondContact CZ-O 3.27Å; L161-N165 WeakPolarHBondContact O-CB 3.48Å; L161-N165 PolarHBondContact O-N 3.27Å; L161-N165 PolarHBondContact O-ND2 3.19Å; L161-N165 PolarHBondContact O-OD1 2.89Å; A162-N165 PolarHBondContact O-N 3.18Å; P163-N165 VanDerWaalsContact C-N 3.32Å; P163-N165 PolarHBondContact O-N 3.44Å; N165-F168 PolarHBondContact O-N 3.07Å; N165-F169 WeakPolarHBondContact O-CB 3.27Å; N165-F169 PolarHBondContact O-N 3.43Å; N165-L181 WeakPolarHBondContact OD1-CD2 3.39Å |
| 166 | Q | 91.1 | Very high | 93.2 | Very high | 4 Ų | 4 | 43.4 Ų | 43.4 | 2% | 0.019 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -67.5 | -38.1 | 177.4 | -173.2 | 55.5 | 61.6 | 0 | 0 | 111.6 | V42 A162 P163 V164 F169 G170 N296 E297 A300 | V42-Q166 HydrophobicContact CG1-CB 3.91Å; V42-Q166 HydrophobicContact CG1-CG 4.47Å; A162-Q166 PolarHBondContact O-N 3.1Å; P163-Q166 PolarHBondContact O-N 3.15Å; V164-Q166 VanDerWaalsContact C-N 3.32Å; V164-Q166 PolarHBondContact O-N 2.93Å; Q166-F169 WeakPolarHBondContact O-CB 3.37Å; Q166-F169 PolarHBondContact O-N 3.43Å; Q166-G170 PolarHBondContact O-N 2.88Å; Q166-N296 HydrophobicContact CG-CB 4.33Å; Q166-E297 VanDerWaalsContact CG-CD 3.46Å; Q166-E297 HydrophobicContact CG-CG 4.45Å; Q166-E297 WeakPolarHBondContact CG-OE1 3.49Å; Q166-E297 VanDerWaalsContact CG-OE2 3.24Å; Q166-E297 WeakPolarHBondContact CG-OE2 3.27Å; Q166-A300 HydrophobicContact CB-CB 3.79Å; Q166-A300 HydrophobicContact CG-CB 4.1Å |
| 167 | L | 93 | Very high | 93.3 | Very high | 88 Ų | 88 | 41.2 Ų | 41.2 | 46% | 0.461 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -66.1 | -44.8 | 173.2 | -178.2 | 143.6 | 0 | 0 | 0 | 112.1 | P163 V164 F169 G170 I171 | P163-L167 PolarHBondContact O-N 3.34Å; V164-L167 PolarHBondContact O-N 3.41Å; L167-F169 VanDerWaalsContact C-N 3.25Å; L167-F169 PolarHBondContact O-N 3.11Å; L167-G170 PolarHBondContact O-N 2.93Å; L167-I171 HydrophobicContact CD2-CD1 3.65Å; L167-I171 HydrophobicContact CG-CD1 4.01Å; L167-I171 WeakPolarHBondContact O-CG1 3.38Å; L167-I171 PolarHBondContact O-N 2.91Å; L167-I171 VanDerWaalsContact O-N 3.13Å |
| 168 | F | 94 | Very high | 93.3 | Very high | 34 Ų | 34 | 39.6 Ų | 39.6 | 15% | 0.149 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.8 | -39.9 | 174.8 | -69.9 | -14.2 | 0 | 0 | 0 | 111.5 | V164 N165 I171 F172 S177 I180 L181 L184 | V164-F168 HydrophobicContact CG1-CD1 4.29Å; V164-F168 HydrophobicContact CG1-CD2 3.96Å; V164-F168 HydrophobicContact CG1-CE1 3.82Å; V164-F168 HydrophobicContact CG1-CE2 3.46Å; V164-F168 VanDerWaalsContact CG1-CE2 3.46Å; V164-F168 HydrophobicContact CG1-CG 4.35Å; V164-F168 HydrophobicContact CG1-CZ 3.38Å; V164-F168 VanDerWaalsContact O-CG 3.29Å; V164-F168 WeakPolarHBondContact O-CG 3.41Å; V164-F168 PolarHBondContact O-N 3.31Å; N165-F168 PolarHBondContact O-N 3.07Å; F168-I171 PolarHBondContact O-N 3.32Å; F168-F172 WeakPolarHBondContact O-CB 3.27Å; F168-F172 PolarHBondContact O-N 3.45Å; F168-S177 WeakPolarHBondContact CB-OG 3.4Å; F168-S177 PolarHBondContact O-OG 3.06Å; F168-I180 HydrophobicContact CD2-CG2 4.14Å; F168-I180 HydrophobicContact CE2-CB 4.41Å; F168-I180 HydrophobicContact CE2-CG2 3.56Å; F168-I180 HydrophobicContact CZ-CG2 3.78Å; F168-L181 HydrophobicContact CE2-CD2 4.49Å; F168-L184 HydrophobicContact CE2-CD1 4.13Å |
| 169 | F | 90.8 | Very high | 93.5 | Very high | 43 Ų | 43 | 43.4 Ų | 43.4 | 19% | 0.189 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.7 | -47.7 | 175.2 | -178.6 | -100.6 | 0 | 0 | 0 | 111.6 | F43 E46 N165 Q166 L167 I171 G173 W174 S177 | F43-F169 HydrophobicContact CD1-CB 4.14Å; F43-F169 AromaticContact CD1-CD2 3.76Å; F43-F169 HydrophobicContact CD1-CD2 3.76Å; F43-F169 HydrophobicContact CD1-CG 4.24Å; F43-F169 HydrophobicContact CE1-CB 3.7Å; F43-F169 HydrophobicContact CE1-CD2 4Å; F43-F169 HydrophobicContact CE1-CG 4.26Å; E46-F169 HydrophobicContact CB-CE1 4.48Å; E46-F169 HydrophobicContact CB-CE2 3.94Å; E46-F169 HydrophobicContact CB-CZ 3.72Å; E46-F169 HydrophobicContact CG-CE1 3.75Å; E46-F169 HydrophobicContact CG-CE2 4.1Å; E46-F169 HydrophobicContact CG-CZ 3.46Å; E46-F169 VanDerWaalsContact CG-CZ 3.46Å; N165-F169 WeakPolarHBondContact O-CB 3.27Å; N165-F169 PolarHBondContact O-N 3.43Å; Q166-F169 WeakPolarHBondContact O-CB 3.37Å; Q166-F169 PolarHBondContact O-N 3.43Å; L167-F169 VanDerWaalsContact C-N 3.25Å; L167-F169 PolarHBondContact O-N 3.11Å; F169-I171 VanDerWaalsContact C-N 3.3Å; F169-I171 PolarHBondContact O-N 2.95Å; F169-G173 WeakPolarHBondContact O-CA 3.4Å; F169-G173 PolarHBondContact O-N 3.25Å; F169-W174 HydrophobicContact CD2-CB 4.09Å; F169-W174 HydrophobicContact CE2-CB 4.03Å; F169-S177 WeakPolarHBondContact CA-OG 3.32Å; F169-S177 PolarHBondContact N-OG 3.27Å; F169-S177 VanDerWaalsContact N-OG 3.12Å |
| 170 | G | 89.9 | Confident | 93.6 | Very high | 62 Ų | 62 | 44.6 Ų | 44.6 | 64% | 0.639 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -61.9 | -35.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q166 L167 | Q166-G170 PolarHBondContact O-N 2.88Å; L167-G170 PolarHBondContact O-N 2.93Å |
| 171 | I | 94.3 | Very high | 93.7 | Very high | 110 Ų | 110 | 40.9 Ų | 40.9 | 56% | 0.564 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -91.3 | -44.2 | -175.8 | -58.3 | 171.9 | 0 | 0 | 0 | 112.1 | L167 F168 F169 | L167-I171 HydrophobicContact CD2-CD1 3.65Å; L167-I171 HydrophobicContact CG-CD1 4.01Å; L167-I171 WeakPolarHBondContact O-CG1 3.38Å; L167-I171 PolarHBondContact O-N 2.91Å; L167-I171 VanDerWaalsContact O-N 3.13Å; F168-I171 PolarHBondContact O-N 3.32Å; F169-I171 VanDerWaalsContact C-N 3.3Å; F169-I171 PolarHBondContact O-N 2.95Å |
| 172 | F | 93.6 | Very high | 93.7 | Very high | 115 Ų | 115 | 40.3 Ų | 40.3 | 50% | 0.504 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -114.4 | -4.2 | -168.3 | -55.8 | -69.9 | 0 | 0 | 0 | 113.9 | F168 I180 | F168-F172 WeakPolarHBondContact O-CB 3.27Å; F168-F172 PolarHBondContact O-N 3.45Å; F172-I180 HydrophobicContact CD2-CD1 3.68Å; F172-I180 HydrophobicContact CE2-CD1 3.88Å; F172-I180 HydrophobicContact CG-CD1 4.2Å |
| 173 | G | 92.8 | Very high | 93.9 | Very high | 27 Ų | 27 | 42 Ų | 42 | 28% | 0.278 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | 68.1 | 180 | -169.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | F169 R175 S177 | F169-G173 WeakPolarHBondContact O-CA 3.4Å; F169-G173 PolarHBondContact O-N 3.25Å; G173-R175 PolarHBondContact O-N 3.03Å; G173-S177 WeakPolarHBondContact O-CB 3.5Å; G173-S177 PolarHBondContact O-N 3.49Å; G173-S177 PolarHBondContact O-OG 3.42Å |
| 174 | W | 91.6 | Very high | 93.9 | Very high | 13 Ų | 13 | 42.9 Ų | 42.9 | 5% | 0.049 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -67.7 | -36.9 | -174.8 | 73.5 | -86.2 | 0 | 0 | 0 | 113.4 | F43 I50 F51 C106 L112 F169 S177 F178 | F43-W174 HydrophobicContact CD1-CB 4.41Å; I50-W174 VanDerWaalsContact CD1-CD1 3.44Å; I50-W174 HydrophobicContact CD1-CG 4.38Å; F51-W174 HydrophobicContact CE2-CH2 4.1Å; F51-W174 AromaticContact CE2-CZ2 3.93Å; F51-W174 HydrophobicContact CE2-CZ2 3.93Å; F51-W174 AromaticContact CZ-CH2 3.75Å; F51-W174 HydrophobicContact CZ-CH2 3.75Å; F51-W174 AromaticContact CZ-CZ2 3.6Å; F51-W174 HydrophobicContact CZ-CZ2 3.6Å; C106-W174 WeakPolarHBondContact O-CH2 3.18Å; L112-W174 HydrophobicContact CD2-CZ3 4.19Å; F169-W174 HydrophobicContact CD2-CB 4.09Å; F169-W174 HydrophobicContact CE2-CB 4.03Å; W174-S177 WeakPolarHBondContact O-CB 3.34Å; W174-S177 PolarHBondContact O-N 3.2Å; W174-F178 AromaticContact CE3-CD2 3.87Å; W174-F178 HydrophobicContact CE3-CD2 3.87Å; W174-F178 AromaticContact CE3-CE2 3.83Å; W174-F178 HydrophobicContact CE3-CE2 3.83Å; W174-F178 HydrophobicContact CE3-CG 4.49Å; W174-F178 HydrophobicContact CE3-CZ 4.42Å; W174-F178 AromaticContact CZ3-CD2 3.98Å; W174-F178 HydrophobicContact CZ3-CD2 3.98Å; W174-F178 AromaticContact CZ3-CE2 3.98Å; W174-F178 HydrophobicContact CZ3-CE2 3.98Å; W174-F178 PolarHBondContact O-N 2.89Å |
| 175 | R | 94.1 | Very high | 93.9 | Very high | 102 Ų | 102 | 40.6 Ų | 40.6 | 39% | 0.385 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -65.4 | -50.8 | 179 | -67.2 | -169.5 | 165.3 | 93.9 | -3.9 | 111.6 | S104 C106 N107 G173 S177 F178 L179 | S104-R175 VanDerWaalsContact CB-O 3.25Å; S104-R175 WeakPolarHBondContact CB-O 3.35Å; S104-R175 WeakPolarHBondContact O-CD 3.44Å; S104-R175 WeakPolarHBondContact O-CG 2.98Å; S104-R175 PolarHBondContact O-NE 3.46Å; C106-R175 PolarHBondContact O-NH2 3.25Å; N107-R175 PolarHBondContact OD1-NH2 3.06Å; G173-R175 PolarHBondContact O-N 3.03Å; R175-S177 VanDerWaalsContact C-N 3.28Å; R175-S177 PolarHBondContact O-N 2.96Å; R175-F178 PolarHBondContact O-N 3.23Å; R175-L179 PolarHBondContact O-N 3.05Å; R175-L179 VanDerWaalsContact O-N 3.1Å |
| 176 | G | 95.3 | Very high | 94 | Very high | 21 Ų | 21 | 43.6 Ų | 43.6 | 22% | 0.216 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.5 | -38 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L179 I180 | G176-L179 PolarHBondContact O-N 2.92Å; G176-I180 WeakPolarHBondContact O-CG1 3.47Å; G176-I180 PolarHBondContact O-N 2.92Å |
| 177 | S | 95.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -59.9 | -47.4 | 174.5 | -59.7 | 0 | 0 | 0 | 0 | 112.4 | F168 F169 G173 W174 R175 L179 I180 L181 | F168-S177 WeakPolarHBondContact CB-OG 3.4Å; F168-S177 PolarHBondContact O-OG 3.06Å; F169-S177 WeakPolarHBondContact CA-OG 3.32Å; F169-S177 PolarHBondContact N-OG 3.27Å; F169-S177 VanDerWaalsContact N-OG 3.12Å; G173-S177 WeakPolarHBondContact O-CB 3.5Å; G173-S177 PolarHBondContact O-N 3.49Å; G173-S177 PolarHBondContact O-OG 3.42Å; W174-S177 WeakPolarHBondContact O-CB 3.34Å; W174-S177 PolarHBondContact O-N 3.2Å; R175-S177 VanDerWaalsContact C-N 3.28Å; R175-S177 PolarHBondContact O-N 2.96Å; S177-L179 VanDerWaalsContact C-N 3.32Å; S177-L179 PolarHBondContact O-N 2.95Å; S177-I180 PolarHBondContact O-N 3.44Å; S177-L181 WeakPolarHBondContact O-CB 3.44Å; S177-L181 VanDerWaalsContact O-CG 3.23Å; S177-L181 WeakPolarHBondContact O-CG 3.24Å; S177-L181 PolarHBondContact O-N 3.4Å |
| 178 | F | 95.9 | Very high | 94.2 | Very high | 3 Ų | 3 | 43 Ų | 43 | 1% | 0.013 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.4 | -35.9 | 179.6 | -76.9 | 8.5 | 0 | 0 | 0 | 112.3 | I40 F43 I47 A103 L112 V116 W174 R175 L181 G182 | I40-F178 HydrophobicContact CD1-CE1 3.94Å; I40-F178 HydrophobicContact CD1-CZ 3.86Å; I40-F178 HydrophobicContact CG1-CE1 3.95Å; I40-F178 HydrophobicContact CG1-CZ 4.14Å; F43-F178 AromaticContact CD2-CE1 3.85Å; F43-F178 HydrophobicContact CD2-CE1 3.85Å; F43-F178 HydrophobicContact CE2-CE1 4.06Å; F43-F178 HydrophobicContact CG-CE1 4.12Å; F43-F178 HydrophobicContact CZ-CE1 4.49Å; I47-F178 HydrophobicContact CD1-CZ 4.24Å; A103-F178 HydrophobicContact CB-CD2 3.89Å; A103-F178 HydrophobicContact CB-CE2 4.44Å; L112-F178 HydrophobicContact CD2-CE2 4.12Å; V116-F178 HydrophobicContact CG2-CE2 4.35Å; W174-F178 AromaticContact CE3-CD2 3.87Å; W174-F178 HydrophobicContact CE3-CD2 3.87Å; W174-F178 AromaticContact CE3-CE2 3.83Å; W174-F178 HydrophobicContact CE3-CE2 3.83Å; W174-F178 HydrophobicContact CE3-CG 4.49Å; W174-F178 HydrophobicContact CE3-CZ 4.42Å; W174-F178 AromaticContact CZ3-CD2 3.98Å; W174-F178 HydrophobicContact CZ3-CD2 3.98Å; W174-F178 AromaticContact CZ3-CE2 3.98Å; W174-F178 HydrophobicContact CZ3-CE2 3.98Å; W174-F178 PolarHBondContact O-N 2.89Å; R175-F178 PolarHBondContact O-N 3.23Å; F178-L181 HydrophobicContact CD1-CD1 4.37Å; F178-L181 PolarHBondContact O-N 3.25Å; F178-G182 PolarHBondContact O-N 3Å |
| 179 | L | 96.8 | Very high | 94.2 | Very high | 81 Ų | 81 | 42.3 Ų | 42.3 | 42% | 0.424 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -61.9 | -47.8 | 174.1 | -174.3 | 66.9 | 0 | 0 | 0 | 111.6 | I101 R175 G176 S177 G182 G183 | I101-L179 HydrophobicContact CB-CD1 4.38Å; I101-L179 HydrophobicContact CG1-CD1 4.15Å; I101-L179 HydrophobicContact CG2-CD1 3.83Å; R175-L179 PolarHBondContact O-N 3.05Å; R175-L179 VanDerWaalsContact O-N 3.1Å; G176-L179 PolarHBondContact O-N 2.92Å; S177-L179 VanDerWaalsContact C-N 3.32Å; S177-L179 PolarHBondContact O-N 2.95Å; L179-G182 PolarHBondContact O-N 3.31Å; L179-G183 PolarHBondContact O-N 3.29Å |
| 180 | I | 96.9 | Very high | 94.4 | Very high | 59 Ų | 59 | 44.5 Ų | 44.5 | 30% | 0.303 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -65.1 | -44 | 178 | -64.7 | 166.1 | 0 | 0 | 0 | 110.8 | F168 F172 G176 S177 G182 G183 L184 | F168-I180 HydrophobicContact CD2-CG2 4.14Å; F168-I180 HydrophobicContact CE2-CB 4.41Å; F168-I180 HydrophobicContact CE2-CG2 3.56Å; F168-I180 HydrophobicContact CZ-CG2 3.78Å; F172-I180 HydrophobicContact CD2-CD1 3.68Å; F172-I180 HydrophobicContact CE2-CD1 3.88Å; F172-I180 HydrophobicContact CG-CD1 4.2Å; G176-I180 WeakPolarHBondContact O-CG1 3.47Å; G176-I180 PolarHBondContact O-N 2.92Å; S177-I180 PolarHBondContact O-N 3.44Å; I180-G182 VanDerWaalsContact C-N 3.28Å; I180-G182 PolarHBondContact O-N 3.02Å; I180-G183 WeakPolarHBondContact O-CA 3.46Å; I180-G183 PolarHBondContact O-N 3.48Å; I180-L184 PolarHBondContact O-N 3.13Å |
| 181 | L | 95.3 | Very high | 94.6 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.005 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -63.8 | -33.7 | 177.4 | -72.3 | 167.8 | 0 | 0 | 0 | 112.2 | F36 F43 L100 L161 N165 F168 S177 F178 G183 L184 L185 | F36-L181 HydrophobicContact CE2-CB 4.05Å; F36-L181 HydrophobicContact CE2-CD1 4.28Å; F36-L181 HydrophobicContact CE2-CD2 4.03Å; F36-L181 HydrophobicContact CE2-CG 4.35Å; F36-L181 HydrophobicContact CZ-CB 4.28Å; F36-L181 HydrophobicContact CZ-CD1 4.36Å; F43-L181 HydrophobicContact CE2-CD1 3.97Å; F43-L181 HydrophobicContact CZ-CD1 4.1Å; L100-L181 HydrophobicContact CD2-CB 3.85Å; L161-L181 HydrophobicContact CD2-CD2 4.38Å; N165-L181 WeakPolarHBondContact OD1-CD2 3.39Å; F168-L181 HydrophobicContact CE2-CD2 4.49Å; S177-L181 WeakPolarHBondContact O-CB 3.44Å; S177-L181 VanDerWaalsContact O-CG 3.23Å; S177-L181 WeakPolarHBondContact O-CG 3.24Å; S177-L181 PolarHBondContact O-N 3.4Å; F178-L181 HydrophobicContact CD1-CD1 4.37Å; F178-L181 PolarHBondContact O-N 3.25Å; L181-G183 VanDerWaalsContact C-N 3.34Å; L181-L184 HydrophobicContact CD2-CD1 4.04Å; L181-L184 PolarHBondContact O-N 3.01Å; L181-L185 PolarHBondContact O-N 3.4Å |
| 182 | G | 95.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.3 | -44.2 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | G97 F178 L179 I180 L184 L185 L186 | G97-G182 WeakPolarHBondContact CA-O 3.13Å; F178-G182 PolarHBondContact O-N 3Å; L179-G182 PolarHBondContact O-N 3.31Å; I180-G182 VanDerWaalsContact C-N 3.28Å; I180-G182 PolarHBondContact O-N 3.02Å; G182-L184 PolarHBondContact O-N 3.38Å; G182-L185 PolarHBondContact O-N 2.93Å; G182-L186 WeakPolarHBondContact O-CG 3.28Å; G182-L186 PolarHBondContact O-N 3.37Å |
| 183 | G | 94.6 | Very high | 94.6 | Very high | 36 Ų | 36 | 33 Ų | 33 | 37% | 0.371 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -60.4 | -41.4 | 172 | 0 | 0 | 0 | 0 | 0 | 113.3 | L179 I180 L181 L186 | L179-G183 PolarHBondContact O-N 3.29Å; I180-G183 WeakPolarHBondContact O-CA 3.46Å; I180-G183 PolarHBondContact O-N 3.48Å; L181-G183 VanDerWaalsContact C-N 3.34Å; G183-L186 WeakPolarHBondContact O-CB 3.33Å; G183-L186 PolarHBondContact O-N 2.97Å |
| 184 | L | 93.9 | Very high | 94.6 | Very high | 53 Ų | 53 | 34 Ų | 34 | 28% | 0.277 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -64.8 | -39.5 | 175.3 | -69 | 175.9 | 0 | 0 | 0 | 112.1 | F32 F168 I180 L181 G182 L186 N187 | F32-L184 HydrophobicContact CE1-CB 4.34Å; F32-L184 HydrophobicContact CZ-CB 4.22Å; F168-L184 HydrophobicContact CE2-CD1 4.13Å; I180-L184 PolarHBondContact O-N 3.13Å; L181-L184 HydrophobicContact CD2-CD1 4.04Å; L181-L184 PolarHBondContact O-N 3.01Å; G182-L184 PolarHBondContact O-N 3.38Å; L184-L186 VanDerWaalsContact C-N 3.29Å; L184-L186 PolarHBondContact O-N 3.39Å; L184-N187 VanDerWaalsContact O-CB 3.27Å; L184-N187 WeakPolarHBondContact O-CB 3.48Å; L184-N187 PolarHBondContact O-N 3.26Å; L184-N187 VanDerWaalsContact O-N 3.11Å |
| 185 | L | 94.1 | Very high | 94.6 | Very high | 1 Ų | 1 | 33.3 Ų | 33.3 | 1% | 0.005 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -67.7 | -26.6 | 175.4 | -74.6 | -170.4 | 0 | 0 | 0 | 113 | F32 F36 L100 L124 L181 G182 N187 C188 | F32-L185 HydrophobicContact CB-CD2 3.95Å; F32-L185 HydrophobicContact CD1-CD2 3.6Å; F32-L185 HydrophobicContact CE1-CD2 4.2Å; F32-L185 HydrophobicContact CG-CD2 3.85Å; F36-L185 HydrophobicContact CD1-CD1 4.44Å; F36-L185 HydrophobicContact CD2-CD1 4.41Å; F36-L185 HydrophobicContact CD2-CD2 4.07Å; F36-L185 HydrophobicContact CD2-CG 4.37Å; F36-L185 HydrophobicContact CE1-CD1 4.35Å; F36-L185 HydrophobicContact CE2-CD1 4.32Å; F36-L185 HydrophobicContact CE2-CG 4.36Å; F36-L185 HydrophobicContact CG-CD2 4.36Å; F36-L185 HydrophobicContact CZ-CD1 4.34Å; L100-L185 HydrophobicContact CD1-CD1 3.95Å; L100-L185 HydrophobicContact CD2-CD1 3.34Å; L100-L185 HydrophobicContact CD2-CG 3.98Å; L100-L185 HydrophobicContact CG-CD1 4.22Å; L124-L185 HydrophobicContact CD2-CD2 4.23Å; L181-L185 PolarHBondContact O-N 3.4Å; G182-L185 PolarHBondContact O-N 2.93Å; L185-N187 PolarHBondContact O-N 2.98Å; L185-C188 WeakPolarHBondContact O-CB 3.49Å; L185-C188 PolarHBondContact O-N 3.25Å; L185-C188 PolarHBondContact O-SG 3.28Å; L185-C188 VanDerWaalsContact O-SG 3.42Å |
| 186 | L | 95.3 | Very high | 94.3 | Very high | 62 Ų | 62 | 36 Ų | 36 | 33% | 0.325 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -63.4 | -23 | 171.5 | -69.9 | 173.4 | 0 | 0 | 0 | 112.4 | I101 G182 G183 L184 C188 C189 | I101-L186 HydrophobicContact CD1-CD1 4.5Å; G182-L186 WeakPolarHBondContact O-CG 3.28Å; G182-L186 PolarHBondContact O-N 3.37Å; G183-L186 WeakPolarHBondContact O-CB 3.33Å; G183-L186 PolarHBondContact O-N 2.97Å; L184-L186 VanDerWaalsContact C-N 3.29Å; L184-L186 PolarHBondContact O-N 3.39Å; L186-C188 PolarHBondContact O-N 3.41Å; L186-C189 WeakPolarHBondContact O-CB 3.44Å; L186-C189 PolarHBondContact O-N 2.88Å; L186-C189 PolarHBondContact O-SG 3.46Å |
| 187 | N | 94.4 | Very high | 93.7 | Very high | 79 Ų | 79 | 39.4 Ų | 39.4 | 42% | 0.422 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -64.5 | -17.2 | 171.8 | -70.4 | -40 | 0 | 0 | 0 | 113 | L184 L185 C189 V190 A191 | L184-N187 VanDerWaalsContact O-CB 3.27Å; L184-N187 WeakPolarHBondContact O-CB 3.48Å; L184-N187 PolarHBondContact O-N 3.26Å; L184-N187 VanDerWaalsContact O-N 3.11Å; L185-N187 PolarHBondContact O-N 2.98Å; N187-C189 PolarHBondContact O-N 3.49Å; N187-V190 WeakPolarHBondContact O-CB 3.31Å; N187-V190 PolarHBondContact O-N 2.92Å; N187-A191 PolarHBondContact O-N 3.34Å |
| 188 | C | 93.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.2 | -28.1 | 167.4 | -67.8 | 0 | 0 | 0 | 0 | 112.1 | F32 N127 L185 L186 A191 G192 | F32-C188 WeakPolarHBondContact CD2-SG 3.4Å; N127-C188 WeakPolarHBondContact OD1-CB 3.25Å; L185-C188 WeakPolarHBondContact O-CB 3.49Å; L185-C188 PolarHBondContact O-N 3.25Å; L185-C188 PolarHBondContact O-SG 3.28Å; L185-C188 VanDerWaalsContact O-SG 3.42Å; L186-C188 PolarHBondContact O-N 3.41Å; C188-A191 PolarHBondContact O-N 3.48Å; C188-G192 PolarHBondContact O-N 3.41Å |
| 189 | C | 94.5 | Very high | 91.6 | Very high | 21 Ų | 21 | 43.5 Ų | 43.5 | 14% | 0.142 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -65.3 | -41.7 | 173.2 | -53.2 | 0 | 0 | 0 | 0 | 111.4 | I90 G93 C94 L186 N187 G192 S193 | I90-C189 HydrophobicContact CG2-CB 4.32Å; I90-C189 PolarHBondContact O-SG 3.23Å; I90-C189 VanDerWaalsContact O-SG 3.39Å; G93-C189 VanDerWaalsContact C-SG 3.51Å; C94-C189 PolarHBondContact N-SG 3.25Å; L186-C189 WeakPolarHBondContact O-CB 3.44Å; L186-C189 PolarHBondContact O-N 2.88Å; L186-C189 PolarHBondContact O-SG 3.46Å; N187-C189 PolarHBondContact O-N 3.49Å; C189-G192 PolarHBondContact O-N 2.96Å; C189-S193 PolarHBondContact O-N 2.96Å |
| 190 | V | 94.9 | Very high | 89.7 | Confident | 88 Ų | 88 | 42.3 Ų | 42.3 | 53% | 0.533 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -65.3 | -45 | 176.5 | -176.9 | 0 | 0 | 0 | 0 | 109.6 | N187 G192 S193 | N187-V190 WeakPolarHBondContact O-CB 3.31Å; N187-V190 PolarHBondContact O-N 2.92Å; V190-G192 VanDerWaalsContact C-N 3.31Å; V190-G192 PolarHBondContact O-N 3.19Å; V190-S193 WeakPolarHBondContact O-CB 3.44Å; V190-S193 PolarHBondContact O-N 3.37Å; V190-S193 PolarHBondContact O-OG 2.92Å |
| 191 | A | 93.9 | Very high | 87.8 | Confident | 2 Ų | 2 | 46.7 Ų | 46.7 | 2% | 0.017 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -58.2 | -42.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | I28 N187 C188 S193 L194 | I28-A191 HydrophobicContact CB-CB 4Å; I28-A191 HydrophobicContact CG2-CB 3.95Å; N187-A191 PolarHBondContact O-N 3.34Å; C188-A191 PolarHBondContact O-N 3.48Å; A191-S193 VanDerWaalsContact C-N 3.3Å; A191-S193 PolarHBondContact O-N 3.06Å; A191-L194 WeakPolarHBondContact O-CB 3.16Å; A191-L194 PolarHBondContact O-N 3.23Å |
| 192 | G | 92.9 | Very high | 85.8 | Confident | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -64.8 | -29.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | C188 C189 V190 L194 M195 | C188-G192 PolarHBondContact O-N 3.41Å; C189-G192 PolarHBondContact O-N 2.96Å; V190-G192 VanDerWaalsContact C-N 3.31Å; V190-G192 PolarHBondContact O-N 3.19Å; G192-L194 PolarHBondContact O-N 3.01Å; G192-M195 VanDerWaalsContact O-CB 3.27Å; G192-M195 WeakPolarHBondContact O-CB 3.39Å; G192-M195 WeakPolarHBondContact O-CG 3.38Å; G192-M195 PolarHBondContact O-N 2.78Å; G192-M195 VanDerWaalsContact O-N 3.16Å |
| 193 | S | 94.2 | Very high | 83.8 | Confident | 44 Ų | 44 | 55.7 Ų | 55.7 | 31% | 0.308 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -65.8 | -26.7 | 178 | 82 | 0 | 0 | 0 | 0 | 113.2 | C189 V190 A191 M195 | C189-S193 PolarHBondContact O-N 2.96Å; V190-S193 WeakPolarHBondContact O-CB 3.44Å; V190-S193 PolarHBondContact O-N 3.37Å; V190-S193 PolarHBondContact O-OG 2.92Å; A191-S193 VanDerWaalsContact C-N 3.3Å; A191-S193 PolarHBondContact O-N 3.06Å; S193-M195 PolarHBondContact O-N 2.91Å |
| 194 | L | 94.1 | Very high | 81.4 | Confident | 47 Ų | 47 | 58.3 Ų | 58.3 | 25% | 0.246 | 32% | 0.32 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -16.1 | 176.8 | -60.5 | 175.6 | 0 | 0 | 0 | 112.8 | W18 V22 A191 G192 R196 | W18-L194 HydrophobicContact CZ2-CD2 4.39Å; W18-L194 PolarHBondContact NE1-O 3.23Å; V22-L194 WeakPolarHBondContact CG2-O 3.3Å; A191-L194 WeakPolarHBondContact O-CB 3.16Å; A191-L194 PolarHBondContact O-N 3.23Å; G192-L194 PolarHBondContact O-N 3.01Å; L194-R196 VanDerWaalsContact C-N 3.25Å; L194-R196 PolarHBondContact O-N 3.21Å |
| 195 | M | 90.3 | Very high | 79.3 | Confident | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 33% | 0.33 | C | S | . | . | trans | -76.7 | 69.6 | -176.2 | -59 | -64.4 | 168.4 | 0 | 0 | 112.1 | V22 A26 R86 M89 A131 M134 G192 S193 P197 | V22-M195 HydrophobicContact CB-SD 4.37Å; V22-M195 HydrophobicContact CG1-CE 4.35Å; V22-M195 HydrophobicContact CG1-SD 3.7Å; V22-M195 HydrophobicContact CG2-SD 4.28Å; A26-M195 HydrophobicContact CB-CE 4.16Å; R86-M195 HydrophobicContact CB-CB 4.43Å; M89-M195 HydrophobicContact CE-CE 3.99Å; M89-M195 HydrophobicContact CE-CG 4.26Å; M89-M195 HydrophobicContact SD-CE 4.19Å; M89-M195 HydrophobicContact SD-CG 3.56Å; M89-M195 VanDerWaalsContact SD-CG 3.56Å; M89-M195 HydrophobicContact SD-SD 4.33Å; A131-M195 HydrophobicContact CB-CE 4.41Å; M134-M195 HydrophobicContact CB-SD 3.68Å; M134-M195 HydrophobicContact CE-CB 4.45Å; M134-M195 HydrophobicContact CG-CB 4.17Å; M134-M195 HydrophobicContact CG-CG 4.37Å; M134-M195 HydrophobicContact CG-SD 3.87Å; G192-M195 VanDerWaalsContact O-CB 3.27Å; G192-M195 WeakPolarHBondContact O-CB 3.39Å; G192-M195 WeakPolarHBondContact O-CG 3.38Å; G192-M195 PolarHBondContact O-N 2.78Å; G192-M195 VanDerWaalsContact O-N 3.16Å; S193-M195 PolarHBondContact O-N 2.91Å; M195-P197 WeakPolarHBondContact O-CD 3.27Å | ||
| 196 | R | 88.5 | Confident | 77.2 | Confident | 158 Ų | 158 | 67.1 Ų | 67.1 | 60% | 0.596 | 36% | 0.36 | S | S | * | . | trans | -66.7 | 120.8 | 179 | -179.2 | 178.6 | -174.5 | -179.9 | 2 | 109.9 | M134 Y138 L194 | M134-R196 WeakPolarHBondContact CE-O 3.36Å; Y138-R196 WeakPolarHBondContact CE2-O 3.35Å; Y138-R196 WeakPolarHBondContact OH-CB 3.38Å; Y138-R196 PolarHBondContact OH-O 3.42Å; L194-R196 VanDerWaalsContact C-N 3.25Å; L194-R196 PolarHBondContact O-N 3.21Å | ||
| 197 | P | 83.1 | Confident | 74.8 | Confident | 93 Ų | 93 | 71.4 Ų | 71.4 | 60% | 0.604 | 38% | 0.376 | S | S | * | . | trans | -66.5 | 137.3 | 178.6 | 27.7 | -33.3 | 0 | 0 | 0 | 110 | M195 | M195-P197 WeakPolarHBondContact O-CD 3.27Š| ||
| 198 | I | 79.8 | Confident | 72.5 | Confident | 42 Ų | 42 | 71.8 Ų | 71.8 | 22% | 0.215 | 38% | 0.375 | C | S | . | . | trans | -132 | 147.6 | 177.6 | 57.1 | -174.4 | 0 | 0 | 0 | 109.3 | Y11 P14 K137 Y138 | Y11-I198 HydrophobicContact CE2-CB 4.35Å; Y11-I198 HydrophobicContact CE2-CG1 4.39Å; Y11-I198 WeakPolarHBondContact OH-CD1 3.36Å; Y11-I198 VanDerWaalsContact OH-CG1 3.24Å; Y11-I198 WeakPolarHBondContact OH-CG1 3.16Å; P14-I198 HydrophobicContact CG-CD1 4.11Å; K137-I198 HydrophobicContact CB-CD1 4.44Å; K137-I198 HydrophobicContact CB-CG1 4.32Å; Y138-I198 HydrophobicContact CD1-CD1 3.67Å; Y138-I198 HydrophobicContact CD2-CD1 3.39Å; Y138-I198 HydrophobicContact CD2-CG1 4.27Å; Y138-I198 HydrophobicContact CE1-CD1 3.67Å; Y138-I198 HydrophobicContact CE1-CG2 4.37Å; Y138-I198 HydrophobicContact CE2-CD1 3.37Å; Y138-I198 HydrophobicContact CE2-CG1 3.96Å; Y138-I198 HydrophobicContact CE2-CG2 4.37Å; Y138-I198 HydrophobicContact CG-CD1 3.55Å; Y138-I198 WeakPolarHBondContact OH-CG2 3.5Å | ||
| 199 | G | 67.3 | Low | 70.4 | Confident | 47 Ų | 47 | 74.1 Ų | 74.1 | 49% | 0.485 | 39% | 0.394 | S | S | . | . | S | Bend | trans | 93.7 | 168.7 | -170.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 200 | P | 57.4 | Low | 68.2 | Low | 55 Ų | 55 | 77 Ų | 77 | 36% | 0.357 | 41% | 0.412 | S | S | . | . | S | Bend | trans | -61.7 | 147.7 | 179.3 | -14.7 | 27.1 | 0 | 0 | 0 | 111 | Q204 L205 | P200-Q204 HydrophobicContact CB-CB 4.34Å; P200-L205 HydrophobicContact CB-CD2 4.45Å; P200-L205 HydrophobicContact CB-CG 4.14Å; P200-L205 HydrophobicContact CG-CD2 4.26Å; P200-L205 HydrophobicContact CG-CG 4.42Å |
| 201 | K | 57.3 | Low | 65.9 | Low | 152 Ų | 152 | 79.8 Ų | 79.8 | 66% | 0.661 | 42% | 0.416 | S | S | * | . | trans | -59.8 | 144.1 | 176.3 | -69.6 | -178.6 | 178.6 | 175.5 | 0 | 109.2 | D203 Q204 L205 | K201-D203 PolarHBondContact O-N 2.95Å; K201-Q204 HydrophobicContact CB-CG 4.27Å; K201-Q204 VanDerWaalsContact N-OE1 3.17Å; K201-Q204 WeakPolarHBondContact O-CA 3.45Å; K201-Q204 WeakPolarHBondContact O-CB 3.14Å; K201-Q204 PolarHBondContact O-N 3.47Å; K201-L205 PolarHBondContact O-N 2.9Å | ||
| 202 | P | 53.6 | Low | 63.8 | Low | 75 Ų | 75 | 85.7 Ų | 85.7 | 49% | 0.487 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -51.8 | -30.1 | -179.5 | -27.2 | 33.4 | 0 | 0 | 0 | 114.5 | ||
| 203 | D | 52 | Low | 61.9 | Low | 114 Ų | 114 | 90.3 Ų | 90.3 | 61% | 0.61 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -78 | -23.7 | 175.6 | -74.9 | -28.3 | 0 | 0 | 0 | 114.3 | K201 K207 | K201-D203 PolarHBondContact O-N 2.95Å; D203-K207 WeakPolarHBondContact O-CG 3.22Å; D203-K207 PolarHBondContact O-N 2.91Å |
| 204 | Q | 45.9 | Very low | 59.7 | Low | 92 Ų | 92 | 93.9 Ų | 93.9 | 43% | 0.43 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -73.4 | -41 | 174.5 | -73.9 | 177.2 | -47.5 | 0 | 0 | 111 | P200 K201 K206 K207 E208 | P200-Q204 HydrophobicContact CB-CB 4.34Å; K201-Q204 HydrophobicContact CB-CG 4.27Å; K201-Q204 VanDerWaalsContact N-OE1 3.17Å; K201-Q204 WeakPolarHBondContact O-CA 3.45Å; K201-Q204 WeakPolarHBondContact O-CB 3.14Å; K201-Q204 PolarHBondContact O-N 3.47Å; Q204-K206 VanDerWaalsContact C-N 3.32Å; Q204-K206 PolarHBondContact O-N 3.3Å; Q204-K207 CarbonylContact O-C 3.52Å; Q204-K207 WeakPolarHBondContact O-CA 3.45Å; Q204-K207 PolarHBondContact O-N 2.66Å; Q204-E208 WeakPolarHBondContact O-CB 3.39Å; Q204-E208 WeakPolarHBondContact O-CG 3.34Å; Q204-E208 PolarHBondContact O-N 3.08Å |
| 205 | L | 49.3 | Very low | 57.4 | Low | 94 Ų | 94 | 98.1 Ų | 98.1 | 49% | 0.492 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61 | -37.4 | 175 | -74.2 | 164.6 | 0 | 0 | 0 | 112.8 | P200 K201 A209 | P200-L205 HydrophobicContact CB-CD2 4.45Å; P200-L205 HydrophobicContact CB-CG 4.14Å; P200-L205 HydrophobicContact CG-CD2 4.26Å; P200-L205 HydrophobicContact CG-CG 4.42Å; K201-L205 PolarHBondContact O-N 2.9Å; L205-A209 WeakPolarHBondContact O-CB 3.16Å; L205-A209 PolarHBondContact O-N 3.36Å |
| 206 | K | 49.8 | Very low | 55.4 | Low | 145 Ų | 145 | 105 Ų | 105 | 63% | 0.63 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.6 | -39.6 | 172.4 | -79.5 | 178.9 | -178.1 | 166.4 | 0 | 111.9 | Q204 T210 | Q204-K206 VanDerWaalsContact C-N 3.32Å; Q204-K206 PolarHBondContact O-N 3.3Å; K206-T210 VanDerWaalsContact O-CB 3.3Å; K206-T210 WeakPolarHBondContact O-CB 3.38Å; K206-T210 PolarHBondContact O-N 3.13Å; K206-T210 PolarHBondContact O-OG1 3.26Å |
| 207 | K | 43.9 | Very low | 53.3 | Low | 151 Ų | 151 | 100.2 Ų | 100.2 | 66% | 0.657 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -72 | -35.7 | 177.7 | -78.5 | -179.7 | 176.5 | -178.3 | 0 | 112.4 | D203 Q204 K211 | D203-K207 WeakPolarHBondContact O-CG 3.22Å; D203-K207 PolarHBondContact O-N 2.91Å; Q204-K207 CarbonylContact O-C 3.52Å; Q204-K207 WeakPolarHBondContact O-CA 3.45Å; Q204-K207 PolarHBondContact O-N 2.66Å; K207-K211 VanDerWaalsContact O-CB 3.3Å; K207-K211 WeakPolarHBondContact O-CB 3.05Å; K207-K211 VanDerWaalsContact O-CG 3.28Å; K207-K211 WeakPolarHBondContact O-CG 3.4Å; K207-K211 PolarHBondContact O-N 2.92Å |
| 208 | E | 47 | Very low | 51.2 | Low | 87 Ų | 87 | 97.8 Ų | 97.8 | 41% | 0.407 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -72.9 | -46.9 | 177.5 | -76.1 | 166.3 | -179.8 | 0 | 0 | 110.7 | Q204 T210 K211 E212 | Q204-E208 WeakPolarHBondContact O-CB 3.39Å; Q204-E208 WeakPolarHBondContact O-CG 3.34Å; Q204-E208 PolarHBondContact O-N 3.08Å; E208-T210 VanDerWaalsContact C-N 3.28Å; E208-T210 PolarHBondContact O-N 3.3Å; E208-K211 CarbonylContact O-C 3.57Å; E208-K211 WeakPolarHBondContact O-CA 3.46Å; E208-K211 WeakPolarHBondContact O-CB 3.41Å; E208-K211 PolarHBondContact O-N 3.15Å; E208-E212 WeakPolarHBondContact O-CB 3.44Å; E208-E212 WeakPolarHBondContact O-CG 3.37Å; E208-E212 PolarHBondContact O-N 2.99Å |
| 209 | A | 48.4 | Very low | 49.3 | Very low | 49 Ų | 49 | 104 Ų | 104 | 41% | 0.405 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.8 | -35.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L205 V213 | L205-A209 WeakPolarHBondContact O-CB 3.16Å; L205-A209 PolarHBondContact O-N 3.36Å; A209-V213 WeakPolarHBondContact O-CB 3.33Å; A209-V213 WeakPolarHBondContact O-CG2 3.23Å; A209-V213 PolarHBondContact O-N 3.25Å; A209-V213 VanDerWaalsContact O-N 3.14Å |
| 210 | T | 48.3 | Very low | 48 | Very low | 83 Ų | 83 | 105.8 Ų | 105.8 | 51% | 0.509 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -70 | -35.8 | 173.4 | -51.6 | 0 | 0 | 0 | 0 | 111.1 | K206 E208 L214 | K206-T210 VanDerWaalsContact O-CB 3.3Å; K206-T210 WeakPolarHBondContact O-CB 3.38Å; K206-T210 PolarHBondContact O-N 3.13Å; K206-T210 PolarHBondContact O-OG1 3.26Å; E208-T210 VanDerWaalsContact C-N 3.28Å; E208-T210 PolarHBondContact O-N 3.3Å; T210-L214 HydrophobicContact CG2-CD1 3.98Å; T210-L214 WeakPolarHBondContact O-CB 3.35Å; T210-L214 VanDerWaalsContact O-CD1 3.28Å; T210-L214 WeakPolarHBondContact O-CD1 3.21Å; T210-L214 WeakPolarHBondContact O-CG 3.38Å; T210-L214 PolarHBondContact O-N 3.29Å |
| 211 | K | 46.9 | Very low | 46.9 | Very low | 145 Ų | 145 | 108.6 Ų | 108.6 | 63% | 0.63 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -71.5 | -39.8 | 176.8 | -85.5 | -178.6 | 173.9 | -170.1 | 0 | 112.7 | K207 E208 L214 Q215 | K207-K211 VanDerWaalsContact O-CB 3.3Å; K207-K211 WeakPolarHBondContact O-CB 3.05Å; K207-K211 VanDerWaalsContact O-CG 3.28Å; K207-K211 WeakPolarHBondContact O-CG 3.4Å; K207-K211 PolarHBondContact O-N 2.92Å; E208-K211 CarbonylContact O-C 3.57Å; E208-K211 WeakPolarHBondContact O-CA 3.46Å; E208-K211 WeakPolarHBondContact O-CB 3.41Å; E208-K211 PolarHBondContact O-N 3.15Å; K211-L214 CarbonylContact O-C 3.5Å; K211-L214 PolarHBondContact O-N 2.83Å; K211-Q215 WeakPolarHBondContact O-CB 2.99Å; K211-Q215 PolarHBondContact O-N 3.29Å |
| 212 | E | 49.1 | Very low | 45.9 | Very low | 126 Ų | 126 | 110.5 Ų | 110.5 | 59% | 0.589 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -64 | -45.6 | 176 | -76.7 | 176.9 | 165.4 | 0 | 0 | 110.5 | E208 L214 Q215 E216 | E208-E212 WeakPolarHBondContact O-CB 3.44Å; E208-E212 WeakPolarHBondContact O-CG 3.37Å; E208-E212 PolarHBondContact O-N 2.99Å; E212-L214 VanDerWaalsContact C-N 3.32Å; E212-L214 PolarHBondContact O-N 3.28Å; E212-Q215 PolarHBondContact O-N 3Å; E212-Q215 VanDerWaalsContact O-N 3.13Å; E212-E216 PolarHBondContact O-N 2.96Å |
| 213 | V | 53.1 | Low | 44.9 | Very low | 98 Ų | 98 | 116.4 Ų | 116.4 | 59% | 0.594 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -62.2 | -38.2 | 173.5 | 173.5 | 0 | 0 | 0 | 0 | 111.8 | A209 A217 | A209-V213 WeakPolarHBondContact O-CB 3.33Å; A209-V213 WeakPolarHBondContact O-CG2 3.23Å; A209-V213 PolarHBondContact O-N 3.25Å; A209-V213 VanDerWaalsContact O-N 3.14Å; V213-A217 VanDerWaalsContact O-CB 3.3Å; V213-A217 WeakPolarHBondContact O-CB 3.27Å; V213-A217 PolarHBondContact O-N 3.19Å; V213-A217 VanDerWaalsContact O-N 3.11Å |
| 214 | L | 49.7 | Very low | 43.9 | Very low | 118 Ų | 118 | 118.6 Ų | 118.6 | 62% | 0.618 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -70.8 | -30.4 | 174.7 | -74.5 | 164.7 | 0 | 0 | 0 | 112.8 | T210 K211 E212 G218 | T210-L214 HydrophobicContact CG2-CD1 3.98Å; T210-L214 WeakPolarHBondContact O-CB 3.35Å; T210-L214 VanDerWaalsContact O-CD1 3.28Å; T210-L214 WeakPolarHBondContact O-CD1 3.21Å; T210-L214 WeakPolarHBondContact O-CG 3.38Å; T210-L214 PolarHBondContact O-N 3.29Å; K211-L214 CarbonylContact O-C 3.5Å; K211-L214 PolarHBondContact O-N 2.83Å; E212-L214 VanDerWaalsContact C-N 3.32Å; E212-L214 PolarHBondContact O-N 3.28Å; L214-G218 PolarHBondContact O-N 2.99Å; L214-G218 VanDerWaalsContact O-N 3.15Å |
| 215 | Q | 44.8 | Very low | 43.3 | Very low | 136 Ų | 136 | 122.5 Ų | 122.5 | 64% | 0.636 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -78.9 | -36.6 | 178 | -112.8 | 177.8 | -14 | 0 | 0 | 112.6 | K211 E212 G218 K219 | K211-Q215 WeakPolarHBondContact O-CB 2.99Å; K211-Q215 PolarHBondContact O-N 3.29Å; E212-Q215 PolarHBondContact O-N 3Å; E212-Q215 VanDerWaalsContact O-N 3.13Å; Q215-G218 PolarHBondContact O-N 3.21Å; Q215-K219 PolarHBondContact O-N 3.13Å; Q215-K219 VanDerWaalsContact O-N 3.17Å |
| 216 | E | 47.3 | Very low | 42.2 | Very low | 144 Ų | 144 | 121.8 Ų | 121.8 | 67% | 0.673 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -67.6 | -41.8 | 172.4 | -76.7 | -176 | 152.9 | 0 | 0 | 111.2 | E212 G218 K219 A220 | E212-E216 PolarHBondContact O-N 2.96Å; E216-G218 VanDerWaalsContact C-N 3.31Å; E216-G218 PolarHBondContact O-N 2.78Å; E216-K219 PolarHBondContact O-N 2.86Å; E216-A220 PolarHBondContact O-N 3Å |
| 217 | A | 45.1 | Very low | 41.2 | Very low | 58 Ų | 58 | 120.4 Ų | 120.4 | 48% | 0.479 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -63.4 | -33.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | V213 T221 | V213-A217 VanDerWaalsContact O-CB 3.3Å; V213-A217 WeakPolarHBondContact O-CB 3.27Å; V213-A217 PolarHBondContact O-N 3.19Å; V213-A217 VanDerWaalsContact O-N 3.11Å; A217-T221 PolarHBondContact O-OG1 3.37Å |
| 218 | G | 39.6 | Very low | 40.4 | Very low | 43 Ų | 43 | 116.9 Ų | 116.9 | 44% | 0.443 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -78.9 | -15.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | L214 Q215 E216 | L214-G218 PolarHBondContact O-N 2.99Å; L214-G218 VanDerWaalsContact O-N 3.15Å; Q215-G218 PolarHBondContact O-N 3.21Å; E216-G218 VanDerWaalsContact C-N 3.31Å; E216-G218 PolarHBondContact O-N 2.78Å |
| 219 | K | 40 | Very low | 39.4 | Very low | 173 Ų | 173 | 120 Ų | 120 | 75% | 0.752 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -87.5 | -27.4 | 172.6 | -79.1 | 180 | 177.8 | 179.1 | 0 | 112.4 | Q215 E216 T221 | Q215-K219 PolarHBondContact O-N 3.13Å; Q215-K219 VanDerWaalsContact O-N 3.17Å; E216-K219 PolarHBondContact O-N 2.86Å; K219-T221 VanDerWaalsContact C-N 3.25Å; K219-T221 PolarHBondContact O-N 3.33Å |
| 220 | A | 38.6 | Very low | 38.5 | Very low | 84 Ų | 84 | 124 Ų | 124 | 69% | 0.694 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -10.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | E216 | E216-A220 PolarHBondContact O-N 3Š|
| 221 | T | 35.8 | Very low | 37.5 | Very low | 113 Ų | 113 | 127 Ų | 127 | 69% | 0.693 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104 | 13.7 | -172.4 | 20.9 | 0 | 0 | 0 | 0 | 115.1 | A217 K219 | A217-T221 PolarHBondContact O-OG1 3.37Å; K219-T221 VanDerWaalsContact C-N 3.25Å; K219-T221 PolarHBondContact O-N 3.33Å |
| 222 | K | 34.6 | Very low | 36.6 | Very low | 192 Ų | 192 | 125.8 Ų | 125.8 | 84% | 0.835 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -110.8 | 21.4 | 179.2 | -82.8 | -165 | 175.7 | -171.8 | 0 | 115.7 | ||
| 223 | K | 34.3 | Very low | 35.7 | Very low | 199 Ų | 199 | 126.5 Ų | 126.5 | 87% | 0.865 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -143.6 | 84.4 | 168.7 | -84.3 | -170.7 | 173.4 | -175.9 | 0 | 109.9 | ||
| 224 | D | 31.3 | Very low | 35 | Very low | 161 Ų | 161 | 130.3 Ų | 130.3 | 86% | 0.861 | 76% | 0.756 | S | S | * | * | -178.9 | 114 | 127.2 | -119 | -9.2 | 0 | 0 | 0 | 108.8 | |||||
| 225 | D | 32.4 | Very low | 34.2 | Very low | 173 Ų | 173 | 132.2 Ų | 132.2 | 93% | 0.925 | 77% | 0.765 | S | S | * | * | trans | -92.6 | 119.1 | 165 | -74 | -39.4 | 0 | 0 | 0 | 107.2 | ||||
| 226 | G | 27.3 | Very low | 33.7 | Very low | 79 Ų | 79 | 129.4 Ų | 129.4 | 81% | 0.814 | 77% | 0.773 | S | S | * | * | trans | -179.2 | 119.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 227 | A | 27.9 | Very low | 32.7 | Very low | 116 Ų | 116 | 125.8 Ų | 125.8 | 96% | 0.959 | 77% | 0.774 | S | S | * | * | trans | -75.9 | 160.5 | -165.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 228 | G | 26.7 | Very low | 32 | Very low | 77 Ų | 77 | 132.4 Ų | 132.4 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | trans | 158 | 111.8 | 161.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 229 | D | 27.2 | Very low | 31.5 | Very low | 153 Ų | 153 | 137.2 Ų | 137.2 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -55.9 | 149.1 | -177.2 | -56.7 | -58.3 | 0 | 0 | 0 | 114.6 | ||||
| 230 | T | 27.7 | Very low | 31.2 | Very low | 132 Ų | 132 | 138.4 Ų | 138.4 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | 179.9 | 153.2 | 73.4 | 25.2 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 231 | N | 28.7 | Very low | 31.2 | Very low | 148 Ų | 148 | 144 Ų | 144 | 79% | 0.791 | 83% | 0.827 | S | S | * | * | trans | -38 | 149.3 | 179.5 | -60.1 | -61.5 | 0 | 0 | 0 | 115.4 | ||||
| 232 | T | 27.9 | Very low | 31.3 | Very low | 118 Ų | 118 | 147.1 Ų | 147.1 | 72% | 0.724 | 83% | 0.834 | S | S | * | * | -172.3 | 151.7 | 69.6 | -22.4 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 233 | D | 29.1 | Very low | 31.6 | Very low | 141 Ų | 141 | 147.8 Ų | 147.8 | 75% | 0.754 | 84% | 0.836 | S | S | * | * | trans | 80.2 | 91 | 153.5 | -59.2 | -27.6 | 0 | 0 | 0 | 121.8 | I235 | D233-I235 PolarHBondContact O-N 2.93Š| ||
| 234 | L | 38.3 | Very low | 32.4 | Very low | 179 Ų | 179 | 146.2 Ų | 146.2 | 94% | 0.937 | 83% | 0.825 | S | S | * | * | trans | -43.1 | 103.3 | 145.1 | -67.8 | 158.8 | 0 | 0 | 0 | 112.8 | ||||
| 235 | I | 33.4 | Very low | 33.6 | Very low | 157 Ų | 157 | 142.6 Ų | 142.6 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | trans | -128.2 | 103.9 | 147.4 | -61.5 | -177.7 | 0 | 0 | 0 | 108.7 | D233 G237 | D233-I235 PolarHBondContact O-N 2.93Å; I235-G237 PolarHBondContact O-N 3.4Å | ||
| 236 | G | 35.1 | Very low | 34.8 | Very low | 78 Ų | 78 | 140 Ų | 140 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -57.7 | 97 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | K238 | G236-K238 PolarHBondContact O-N 3.4Š| ||
| 237 | G | 26.7 | Very low | 35.8 | Very low | 68 Ų | 68 | 142.9 Ų | 142.9 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | -74.4 | 86.9 | 166.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | I235 T239 | I235-G237 PolarHBondContact O-N 3.4Å; G237-T239 PolarHBondContact O-N 3.43Å | ||
| 238 | K | 29.6 | Very low | 37.1 | Very low | 197 Ų | 197 | 142.7 Ų | 142.7 | 86% | 0.857 | 77% | 0.769 | S | S | * | * | trans | -52.1 | 109.3 | 154.3 | -79.3 | 178.7 | 177.9 | 171.8 | 0 | 106.6 | G236 K240 | G236-K238 PolarHBondContact O-N 3.4Å; K238-K240 VanDerWaalsContact C-N 3.26Å; K238-K240 PolarHBondContact O-N 3.43Å | ||
| 239 | T | 30.1 | Very low | 38.4 | Very low | 143 Ų | 143 | 141.8 Ų | 141.8 | 88% | 0.877 | 75% | 0.748 | S | S | * | * | trans | -60.3 | 93.6 | 170.5 | 12.7 | 0 | 0 | 0 | 0 | 107.6 | G237 K241 | G237-T239 PolarHBondContact O-N 3.43Å; T239-K241 PolarHBondContact O-N 2.89Å | ||
| 240 | K | 32.3 | Very low | 39.9 | Very low | 198 Ų | 198 | 137.3 Ų | 137.3 | 86% | 0.861 | 73% | 0.726 | S | S | * | * | trans | -57.1 | 107.4 | 168.3 | -86 | 179.6 | 176.5 | 173.2 | 0 | 105.9 | K238 Q242 | K238-K240 VanDerWaalsContact C-N 3.26Å; K238-K240 PolarHBondContact O-N 3.43Å; K240-Q242 VanDerWaalsContact C-N 3.27Å; K240-Q242 PolarHBondContact O-N 2.82Å | ||
| 241 | K | 39.3 | Very low | 41.3 | Very low | 202 Ų | 202 | 134.4 Ų | 134.4 | 88% | 0.878 | 71% | 0.705 | S | S | * | * | trans | -54.7 | 99.2 | 163.2 | -84 | 178.9 | 176.9 | 170.7 | 0 | 106.6 | T239 K243 | T239-K241 PolarHBondContact O-N 2.89Å; K241-K243 PolarHBondContact O-N 3.25Å; K241-K243 VanDerWaalsContact O-N 3.09Å | ||
| 242 | Q | 37.3 | Very low | 42.8 | Very low | 179 Ų | 179 | 134.3 Ų | 134.3 | 84% | 0.836 | 70% | 0.698 | S | S | * | * | trans | -53.8 | 118.1 | 175.8 | -148.2 | 173.9 | 12.5 | 0 | 0 | 106.6 | K240 R244 | K240-Q242 VanDerWaalsContact C-N 3.27Å; K240-Q242 PolarHBondContact O-N 2.82Å; Q242-R244 PolarHBondContact O-N 3.11Å | ||
| 243 | K | 42.3 | Very low | 44.2 | Very low | 205 Ų | 205 | 133.4 Ų | 133.4 | 89% | 0.891 | 68% | 0.684 | S | S | * | * | trans | -61.5 | 105.9 | 176.8 | -77.1 | -175.6 | 178.8 | 179.9 | 0 | 106.5 | K241 T245 | K241-K243 PolarHBondContact O-N 3.25Å; K241-K243 VanDerWaalsContact O-N 3.09Å; K243-T245 PolarHBondContact O-N 3.21Å | ||
| 244 | R | 50.1 | Low | 46 | Very low | 167 Ų | 167 | 128 Ų | 128 | 63% | 0.63 | 66% | 0.655 | S | S | * | * | trans | -57.2 | 133 | 177.4 | -66.4 | -179.8 | -179.6 | -166.7 | -4.7 | 108.5 | Q242 | Q242-R244 PolarHBondContact O-N 3.11Š| ||
| 245 | T | 56.3 | Low | 47.7 | Very low | 84 Ų | 84 | 121.5 Ų | 121.5 | 52% | 0.515 | 62% | 0.621 | S | S | . | * | trans | -61.6 | 150.8 | 173.2 | 26.6 | 0 | 0 | 0 | 0 | 110.1 | K243 F247 Q248 T249 | K243-T245 PolarHBondContact O-N 3.21Å; T245-F247 PolarHBondContact O-N 3.2Å; T245-Q248 PolarHBondContact O-N 2.85Å; T245-Q248 WeakPolarHBondContact OG1-CG 3.2Å; T245-Q248 PolarHBondContact OG1-OE1 3.27Å; T245-T249 PolarHBondContact O-N 2.77Å; T245-T249 VanDerWaalsContact O-N 3.09Å; T245-T249 PolarHBondContact O-OG1 2.91Å | ||
| 246 | V | 58.6 | Low | 49.8 | Very low | 119 Ų | 119 | 116.6 Ų | 116.6 | 72% | 0.721 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -52.4 | -40.2 | 176.6 | 178.1 | 0 | 0 | 0 | 0 | 110 | Q248 T249 V250 | V246-Q248 PolarHBondContact O-N 2.82Å; V246-T249 WeakPolarHBondContact O-CB 3.47Å; V246-T249 PolarHBondContact O-N 3.37Å; V246-T249 VanDerWaalsContact O-N 3.15Å; V246-V250 HydrophobicContact CG1-CG2 4.17Å; V246-V250 WeakPolarHBondContact O-CB 3.17Å; V246-V250 VanDerWaalsContact O-CG2 3.25Å; V246-V250 WeakPolarHBondContact O-CG2 3.24Å; V246-V250 PolarHBondContact O-N 3.23Å |
| 247 | F | 47 | Very low | 52.1 | Low | 139 Ų | 139 | 115.1 Ų | 115.1 | 61% | 0.61 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -60.7 | -42 | 176.5 | -167.1 | -98.4 | 0 | 0 | 0 | 114 | T245 T249 V250 N251 L256 | T245-F247 PolarHBondContact O-N 3.2Å; F247-T249 VanDerWaalsContact C-N 3.3Å; F247-T249 PolarHBondContact O-N 3.2Å; F247-V250 PolarHBondContact O-N 3.03Å; F247-N251 WeakPolarHBondContact O-CB 3.23Å; F247-N251 PolarHBondContact O-N 2.71Å; F247-L256 HydrophobicContact CE2-CD1 4.3Å; F247-L256 HydrophobicContact CZ-CD1 4.03Å |
| 248 | Q | 54.7 | Low | 54.8 | Low | 113 Ų | 113 | 112 Ų | 112 | 53% | 0.528 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -69.2 | -30.7 | 175.7 | -73.1 | 177.2 | -15.8 | 0 | 0 | 112.3 | T245 V246 K252 | T245-Q248 PolarHBondContact O-N 2.85Å; T245-Q248 WeakPolarHBondContact OG1-CG 3.2Å; T245-Q248 PolarHBondContact OG1-OE1 3.27Å; V246-Q248 PolarHBondContact O-N 2.82Å; Q248-K252 WeakPolarHBondContact O-CB 3.47Å; Q248-K252 PolarHBondContact O-N 2.87Å |
| 249 | T | 55.1 | Low | 57.6 | Low | 58 Ų | 58 | 106 Ų | 106 | 36% | 0.356 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -71.1 | -45.2 | 173.9 | -54.8 | 0 | 0 | 0 | 0 | 110.2 | T245 V246 F247 K252 F253 | T245-T249 PolarHBondContact O-N 2.77Å; T245-T249 VanDerWaalsContact O-N 3.09Å; T245-T249 PolarHBondContact O-OG1 2.91Å; V246-T249 WeakPolarHBondContact O-CB 3.47Å; V246-T249 PolarHBondContact O-N 3.37Å; V246-T249 VanDerWaalsContact O-N 3.15Å; F247-T249 VanDerWaalsContact C-N 3.3Å; F247-T249 PolarHBondContact O-N 3.2Å; T249-K252 PolarHBondContact O-N 3.35Å; T249-F253 HydrophobicContact CG2-CD2 4.05Å; T249-F253 HydrophobicContact CG2-CE2 3.87Å; T249-F253 WeakPolarHBondContact O-CD2 3.4Å; T249-F253 PolarHBondContact O-N 2.9Å |
| 250 | V | 58.2 | Low | 60.2 | Low | 58 Ų | 58 | 104.8 Ų | 104.8 | 35% | 0.352 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 175.8 | 173.1 | 0 | 0 | 0 | 0 | 111.2 | V246 F247 K252 F253 L254 | V246-V250 HydrophobicContact CG1-CG2 4.17Å; V246-V250 WeakPolarHBondContact O-CB 3.17Å; V246-V250 VanDerWaalsContact O-CG2 3.25Å; V246-V250 WeakPolarHBondContact O-CG2 3.24Å; V246-V250 PolarHBondContact O-N 3.23Å; F247-V250 PolarHBondContact O-N 3.03Å; V250-K252 VanDerWaalsContact C-N 3.27Å; V250-K252 PolarHBondContact O-N 3.47Å; V250-F253 PolarHBondContact O-N 3.05Å; V250-L254 HydrophobicContact CG1-CD1 3.86Å; V250-L254 HydrophobicContact CG1-CG 4.47Å; V250-L254 WeakPolarHBondContact O-CB 3.34Å; V250-L254 PolarHBondContact O-N 3.23Å |
| 251 | N | 57.4 | Low | 62.8 | Low | 71 Ų | 71 | 99 Ų | 99 | 38% | 0.38 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.5 | -31.5 | 178.6 | -163.6 | 31.4 | 0 | 0 | 0 | 112.6 | F247 F253 D255 L256 | F247-N251 WeakPolarHBondContact O-CB 3.23Å; F247-N251 PolarHBondContact O-N 2.71Å; N251-F253 VanDerWaalsContact C-N 3.3Å; N251-F253 PolarHBondContact O-N 3.23Å; N251-D255 PolarHBondContact O-N 2.7Å; N251-D255 VanDerWaalsContact O-N 3.15Å; N251-L256 WeakPolarHBondContact OD1-CB 3.5Å; N251-L256 PolarHBondContact OD1-N 3.32Å |
| 252 | K | 60.6 | Low | 65.1 | Low | 147 Ų | 147 | 96.4 Ų | 96.4 | 64% | 0.639 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -67 | -30.4 | 172.8 | -171.4 | 180 | 177.3 | -172.3 | 0 | 112.6 | Q248 T249 V250 | Q248-K252 WeakPolarHBondContact O-CB 3.47Å; Q248-K252 PolarHBondContact O-N 2.87Å; T249-K252 PolarHBondContact O-N 3.35Å; V250-K252 VanDerWaalsContact C-N 3.27Å; V250-K252 PolarHBondContact O-N 3.47Å |
| 253 | F | 57.4 | Low | 67.6 | Low | 99 Ų | 99 | 87.9 Ų | 87.9 | 43% | 0.434 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -95.7 | -25.7 | -177.9 | -76.3 | -69.5 | 0 | 0 | 0 | 114.1 | T249 V250 N251 | T249-F253 HydrophobicContact CG2-CD2 4.05Å; T249-F253 HydrophobicContact CG2-CE2 3.87Å; T249-F253 WeakPolarHBondContact O-CD2 3.4Å; T249-F253 PolarHBondContact O-N 2.9Å; V250-F253 PolarHBondContact O-N 3.05Å; N251-F253 VanDerWaalsContact C-N 3.3Å; N251-F253 PolarHBondContact O-N 3.23Å |
| 254 | L | 66 | Low | 69.9 | Low | 27 Ų | 27 | 78.1 Ų | 78.1 | 14% | 0.141 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -114.3 | 1.6 | -173.6 | -70.7 | -178.6 | 0 | 0 | 0 | 114.8 | V250 L256 L394 I397 | V250-L254 HydrophobicContact CG1-CD1 3.86Å; V250-L254 HydrophobicContact CG1-CG 4.47Å; V250-L254 WeakPolarHBondContact O-CB 3.34Å; V250-L254 PolarHBondContact O-N 3.23Å; L254-L256 PolarHBondContact O-N 3.35Å; L254-L394 HydrophobicContact CB-CD2 3.86Å; L254-L394 HydrophobicContact CB-CG 4.31Å; L254-L394 HydrophobicContact CD1-CD2 4.27Å; L254-L394 HydrophobicContact CD2-CD2 4.23Å; L254-L394 HydrophobicContact CD2-CG 4.39Å; L254-L394 HydrophobicContact CG-CD2 4.34Å; L254-L394 WeakPolarHBondContact O-CD1 3.49Å; L254-L394 VanDerWaalsContact O-CG 3.28Å; L254-L394 WeakPolarHBondContact O-CG 3.41Å; L254-I397 HydrophobicContact CD1-CD1 3.74Å; L254-I397 HydrophobicContact CD2-CD1 3.86Å; L254-I397 HydrophobicContact CG-CD1 4.49Å |
| 255 | D | 73.6 | Confident | 71.9 | Confident | 42 Ų | 42 | 73.9 Ų | 73.9 | 23% | 0.225 | 38% | 0.375 | C | S | . | . | trans | 31.8 | 71.5 | 178.7 | -169.3 | 5.4 | 0 | 0 | 0 | 113.6 | N251 S257 L258 | N251-D255 PolarHBondContact O-N 2.7Å; N251-D255 VanDerWaalsContact O-N 3.15Å; D255-S257 PolarHBondContact O-N 3.32Å; D255-S257 VanDerWaalsContact OD1-CB 3.3Å; D255-S257 WeakPolarHBondContact OD1-CB 3.47Å; D255-S257 PolarHBondContact OD1-N 3.02Å; D255-S257 PolarHBondContact OD1-OG 2.88Å; D255-L258 HydrophobicContact CB-CD1 4.33Å; D255-L258 WeakPolarHBondContact O-CB 3.43Å; D255-L258 PolarHBondContact O-N 3.17Å | ||
| 256 | L | 78.7 | Confident | 73.7 | Confident | 55 Ų | 55 | 72 Ų | 72 | 29% | 0.288 | 36% | 0.362 | S | S | . | . | G | 310 helix | trans | -62.9 | -10.4 | -175.4 | -63.3 | 174.5 | 0 | 0 | 0 | 112.9 | F247 N251 L254 L258 F259 L394 | F247-L256 HydrophobicContact CE2-CD1 4.3Å; F247-L256 HydrophobicContact CZ-CD1 4.03Å; N251-L256 WeakPolarHBondContact OD1-CB 3.5Å; N251-L256 PolarHBondContact OD1-N 3.32Å; L254-L256 PolarHBondContact O-N 3.35Å; L256-L258 PolarHBondContact O-N 3.39Å; L256-F259 HydrophobicContact CD2-CD2 4.11Å; L256-F259 HydrophobicContact CD2-CE2 3.85Å; L256-F259 PolarHBondContact O-N 2.97Å; L256-F259 VanDerWaalsContact O-N 3.13Å; L256-L394 HydrophobicContact CD2-CD2 4.14Å |
| 257 | S | 82.6 | Confident | 75.4 | Confident | 46 Ų | 46 | 66.4 Ų | 66.4 | 32% | 0.322 | 33% | 0.328 | S | S | . | . | G | 310 helix | trans | -60.8 | -20.8 | 170.8 | 80.2 | 0 | 0 | 0 | 0 | 112.4 | D255 F259 T260 | D255-S257 PolarHBondContact O-N 3.32Å; D255-S257 VanDerWaalsContact OD1-CB 3.3Å; D255-S257 WeakPolarHBondContact OD1-CB 3.47Å; D255-S257 PolarHBondContact OD1-N 3.02Å; D255-S257 PolarHBondContact OD1-OG 2.88Å; S257-F259 PolarHBondContact O-N 3.37Å; S257-T260 PolarHBondContact O-N 3.01Å; S257-T260 PolarHBondContact O-OG1 3.17Å |
| 258 | L | 83.8 | Confident | 77.6 | Confident | 2 Ų | 2 | 60.3 Ų | 60.3 | 1% | 0.01 | 30% | 0.302 | C | S | . | . | G | 310 helix | trans | -60.1 | -27.4 | 174.1 | -78.7 | 161.1 | 0 | 0 | 0 | 113.1 | D255 L256 T260 H261 F264 V383 R387 A391 L394 | D255-L258 HydrophobicContact CB-CD1 4.33Å; D255-L258 WeakPolarHBondContact O-CB 3.43Å; D255-L258 PolarHBondContact O-N 3.17Å; L256-L258 PolarHBondContact O-N 3.39Å; L258-T260 PolarHBondContact O-N 2.93Å; L258-H261 WeakPolarHBondContact O-CB 3.24Å; L258-H261 PolarHBondContact O-N 3.4Å; L258-F264 HydrophobicContact CB-CD1 4.02Å; L258-F264 HydrophobicContact CB-CE1 4Å; L258-F264 HydrophobicContact CB-CG 4.47Å; L258-F264 HydrophobicContact CB-CZ 4.45Å; L258-F264 WeakPolarHBondContact O-CD1 3.31Å; L258-V383 HydrophobicContact CD2-CB 4.27Å; L258-V383 HydrophobicContact CD2-CG1 4.05Å; L258-R387 HydrophobicContact CD2-CB 4.32Å; L258-A391 HydrophobicContact CD1-CB 3.92Å; L258-A391 HydrophobicContact CD2-CB 4.43Å; L258-L394 HydrophobicContact CB-CD1 3.89Å; L258-L394 HydrophobicContact CD1-CD1 3.9Å |
| 259 | F | 87.3 | Confident | 79.5 | Confident | 73 Ų | 73 | 56.8 Ų | 56.8 | 32% | 0.32 | 29% | 0.289 | S | S | . | . | G | 310 helix | trans | -69.9 | -9.9 | 174.9 | -72.3 | -73.6 | 0 | 0 | 0 | 113.8 | L256 S257 F264 L265 L268 L394 | L256-F259 HydrophobicContact CD2-CD2 4.11Å; L256-F259 HydrophobicContact CD2-CE2 3.85Å; L256-F259 PolarHBondContact O-N 2.97Å; L256-F259 VanDerWaalsContact O-N 3.13Å; S257-F259 PolarHBondContact O-N 3.37Å; F259-F264 HydrophobicContact CD1-CE1 4.46Å; F259-F264 HydrophobicContact CE1-CE1 4.46Å; F259-L265 HydrophobicContact CD1-CD2 3.97Å; F259-L265 WeakPolarHBondContact O-CD1 3.28Å; F259-L265 WeakPolarHBondContact O-CG 3.3Å; F259-L268 HydrophobicContact CD1-CD2 4.31Å; F259-L268 HydrophobicContact CE1-CD2 3.54Å; F259-L268 HydrophobicContact CZ-CD2 4.34Å; F259-L394 HydrophobicContact CD2-CD1 4.38Å; F259-L394 HydrophobicContact CE2-CD1 3.93Å; F259-L394 HydrophobicContact CE2-CD2 3.75Å; F259-L394 HydrophobicContact CE2-CG 4.43Å; F259-L394 HydrophobicContact CZ-CD1 4.44Å; F259-L394 HydrophobicContact CZ-CD2 4.14Å |
| 260 | T | 85.5 | Confident | 81.5 | Confident | 117 Ų | 117 | 54 Ų | 54 | 72% | 0.718 | 27% | 0.273 | S | S | * | . | G | 310 helix | trans | -90.2 | -12 | 169.9 | 67.7 | 0 | 0 | 0 | 0 | 112.3 | S257 L258 R262 | S257-T260 PolarHBondContact O-N 3.01Å; S257-T260 PolarHBondContact O-OG1 3.17Å; L258-T260 PolarHBondContact O-N 2.93Å; T260-R262 PolarHBondContact O-N 3.02Å |
| 261 | H | 86.8 | Confident | 83.2 | Confident | 75 Ų | 75 | 51.3 Ų | 51.3 | 35% | 0.347 | 26% | 0.256 | S | S | . | . | trans | -78.5 | 113.4 | 179.7 | -169.3 | -92.8 | 0 | 0 | 0 | 110.9 | L258 G263 F264 L265 L382 | L258-H261 WeakPolarHBondContact O-CB 3.24Å; L258-H261 PolarHBondContact O-N 3.4Å; H261-G263 PolarHBondContact O-N 3.39Å; H261-F264 HydrophobicContact CB-CB 3.97Å; H261-F264 PolarHBondContact ND1-N 2.94Å; H261-F264 WeakPolarHBondContact O-CB 3.36Å; H261-F264 PolarHBondContact O-N 2.87Å; H261-F264 VanDerWaalsContact O-N 3.07Å; H261-L265 PolarHBondContact O-N 3.45Å; H261-L382 PolarHBondContact CE1-O 3.49Å | ||
| 262 | R | 88.8 | Confident | 85 | Confident | 148 Ų | 148 | 49.7 Ų | 49.7 | 56% | 0.558 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -56.1 | -48.7 | -173.2 | -59.9 | 177.2 | -173.8 | 155.6 | 2.3 | 112.9 | T260 F264 L265 L266 E452 | T260-R262 PolarHBondContact O-N 3.02Å; R262-F264 VanDerWaalsContact C-N 3.27Å; R262-F264 PolarHBondContact O-N 3.48Å; R262-L265 PolarHBondContact O-N 3.34Å; R262-L266 WeakPolarHBondContact O-CG 3.49Å; R262-L266 PolarHBondContact O-N 3.1Å; R262-L266 VanDerWaalsContact O-N 3.13Å; R262-E452 IonicContact CZ-OE1 2.75Å; R262-E452 IonicContact NH1-OE1 3.68Å; R262-E452 PolarHBondContact NH1-OE1 3.14Å |
| 263 | G | 88.7 | Confident | 86.7 | Confident | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.01 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.9 | -33.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | H261 Y267 | H261-G263 PolarHBondContact O-N 3.39Å; G263-Y267 WeakPolarHBondContact O-CB 3.27Å; G263-Y267 PolarHBondContact O-N 3.33Å; G263-Y267 VanDerWaalsContact O-N 3.08Å |
| 264 | F | 91.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -71.1 | -42.5 | 178.4 | 177.1 | -101.3 | 0 | 0 | 0 | 111.2 | L258 F259 H261 R262 L266 Y267 L268 L379 V383 A391 L394 V395 | L258-F264 HydrophobicContact CB-CD1 4.02Å; L258-F264 HydrophobicContact CB-CE1 4Å; L258-F264 HydrophobicContact CB-CG 4.47Å; L258-F264 HydrophobicContact CB-CZ 4.45Å; L258-F264 WeakPolarHBondContact O-CD1 3.31Å; F259-F264 HydrophobicContact CD1-CE1 4.46Å; F259-F264 HydrophobicContact CE1-CE1 4.46Å; H261-F264 HydrophobicContact CB-CB 3.97Å; H261-F264 PolarHBondContact ND1-N 2.94Å; H261-F264 WeakPolarHBondContact O-CB 3.36Å; H261-F264 PolarHBondContact O-N 2.87Å; H261-F264 VanDerWaalsContact O-N 3.07Å; R262-F264 VanDerWaalsContact C-N 3.27Å; R262-F264 PolarHBondContact O-N 3.48Å; F264-L266 PolarHBondContact O-N 2.87Å; F264-Y267 PolarHBondContact O-N 3.32Å; F264-L268 HydrophobicContact CE1-CD2 4.08Å; F264-L268 HydrophobicContact CZ-CD2 4.45Å; F264-L268 VanDerWaalsContact O-CB 3.26Å; F264-L268 WeakPolarHBondContact O-CB 3.35Å; F264-L268 PolarHBondContact O-N 3.06Å; F264-L379 HydrophobicContact CD2-CD1 3.98Å; F264-L379 HydrophobicContact CE2-CD1 4.05Å; F264-V383 HydrophobicContact CB-CG1 4.25Å; F264-V383 HydrophobicContact CD2-CG1 3.75Å; F264-V383 HydrophobicContact CG-CG1 4.38Å; F264-A391 HydrophobicContact CD2-CB 4.38Å; F264-A391 HydrophobicContact CE2-CB 3.87Å; F264-L394 HydrophobicContact CE1-CD1 4.32Å; F264-L394 HydrophobicContact CZ-CB 4.06Å; F264-L394 HydrophobicContact CZ-CD1 4.21Å; F264-V395 HydrophobicContact CE2-CG2 3.54Å; F264-V395 HydrophobicContact CZ-CG2 3.83Å |
| 265 | L | 92.5 | Very high | 89.9 | Confident | 78 Ų | 78 | 40 Ų | 40 | 41% | 0.408 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.7 | -45.8 | 175.6 | -78.4 | 174.1 | 0 | 0 | 0 | 112.4 | F259 H261 R262 Y267 L268 S269 | F259-L265 HydrophobicContact CD1-CD2 3.97Å; F259-L265 WeakPolarHBondContact O-CD1 3.28Å; F259-L265 WeakPolarHBondContact O-CG 3.3Å; H261-L265 PolarHBondContact O-N 3.45Å; R262-L265 PolarHBondContact O-N 3.34Å; L265-Y267 VanDerWaalsContact C-N 3.34Å; L265-L268 PolarHBondContact O-N 3.15Å; L265-S269 WeakPolarHBondContact O-CB 3.49Å; L265-S269 PolarHBondContact O-N 3.37Å; L265-S269 PolarHBondContact O-OG 3.35Å; L265-S269 VanDerWaalsContact O-OG 3.05Å |
| 266 | L | 93 | Very high | 90.9 | Very high | 44 Ų | 44 | 41.1 Ų | 41.1 | 23% | 0.23 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.8 | -39.8 | 178.3 | -71.1 | 170.8 | 0 | 0 | 0 | 112.3 | R262 F264 S269 G270 M442 N445 | R262-L266 WeakPolarHBondContact O-CG 3.49Å; R262-L266 PolarHBondContact O-N 3.1Å; R262-L266 VanDerWaalsContact O-N 3.13Å; F264-L266 PolarHBondContact O-N 2.87Å; L266-S269 PolarHBondContact O-OG 3.31Å; L266-S269 VanDerWaalsContact O-OG 3.09Å; L266-G270 PolarHBondContact O-N 3.24Å; L266-M442 HydrophobicContact CB-CE 4.19Å; L266-N445 HydrophobicContact CD1-CB 4.3Å |
| 267 | Y | 93.9 | Very high | 91.7 | Very high | 1 Ų | 1 | 38.5 Ų | 38.5 | 0% | 0.004 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.1 | -48.1 | 174.4 | 176.7 | -90.8 | 0 | 0 | 0 | 111.1 | G263 F264 L265 G270 N271 F334 L375 T378 L379 L382 V395 M442 | G263-Y267 WeakPolarHBondContact O-CB 3.27Å; G263-Y267 PolarHBondContact O-N 3.33Å; G263-Y267 VanDerWaalsContact O-N 3.08Å; F264-Y267 PolarHBondContact O-N 3.32Å; L265-Y267 VanDerWaalsContact C-N 3.34Å; Y267-G270 PolarHBondContact O-N 2.77Å; Y267-N271 WeakPolarHBondContact CE1-ND2 3.47Å; Y267-N271 VanDerWaalsContact CZ-ND2 3.26Å; Y267-N271 WeakPolarHBondContact O-CB 3.26Å; Y267-N271 PolarHBondContact O-N 3.25Å; Y267-N271 PolarHBondContact O-OD1 3.34Å; Y267-N271 PolarHBondContact OH-ND2 3.33Å; Y267-F334 HydrophobicContact CE2-CE1 4.1Å; Y267-L375 WeakPolarHBondContact OH-CD1 3.29Å; Y267-L375 WeakPolarHBondContact OH-CG 3.43Å; Y267-L375 PolarHBondContact OH-O 3.46Å; Y267-T378 HydrophobicContact CD2-CG2 3.99Å; Y267-T378 HydrophobicContact CE2-CG2 3.89Å; Y267-L379 HydrophobicContact CD1-CD1 3.99Å; Y267-L379 HydrophobicContact CE1-CB 4.2Å; Y267-L379 HydrophobicContact CE1-CD1 3.84Å; Y267-L379 HydrophobicContact CE1-CG 4.41Å; Y267-L379 HydrophobicContact CE2-CB 4.48Å; Y267-L382 HydrophobicContact CD2-CD1 3.68Å; Y267-L382 HydrophobicContact CG-CD1 3.95Å; Y267-V395 HydrophobicContact CE1-CG1 4.4Å; Y267-V395 HydrophobicContact CE1-CG2 4.25Å; Y267-M442 HydrophobicContact CD2-CE 4.43Å |
| 268 | L | 94.2 | Very high | 92.2 | Very high | 12 Ų | 12 | 36.4 Ų | 36.4 | 6% | 0.063 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.4 | -46.4 | -178 | -176.5 | 64.9 | 0 | 0 | 0 | 112 | F259 F264 L265 G270 N271 V272 V395 V398 | F259-L268 HydrophobicContact CD1-CD2 4.31Å; F259-L268 HydrophobicContact CE1-CD2 3.54Å; F259-L268 HydrophobicContact CZ-CD2 4.34Å; F264-L268 HydrophobicContact CE1-CD2 4.08Å; F264-L268 HydrophobicContact CZ-CD2 4.45Å; F264-L268 VanDerWaalsContact O-CB 3.26Å; F264-L268 WeakPolarHBondContact O-CB 3.35Å; F264-L268 PolarHBondContact O-N 3.06Å; L265-L268 PolarHBondContact O-N 3.15Å; L268-G270 PolarHBondContact O-N 2.95Å; L268-N271 PolarHBondContact O-N 3.12Å; L268-V272 WeakPolarHBondContact O-CG2 2.95Å; L268-V272 PolarHBondContact O-N 2.99Å; L268-V395 HydrophobicContact CD1-CB 4.42Å; L268-V395 HydrophobicContact CD1-CG2 4.04Å; L268-V398 HydrophobicContact CD1-CB 3.98Å; L268-V398 HydrophobicContact CD1-CG1 3.93Å; L268-V398 HydrophobicContact CD1-CG2 4.47Å; L268-V398 HydrophobicContact CD2-CG1 4.44Å; L268-V398 HydrophobicContact CD2-CG2 4.44Å; L268-V398 HydrophobicContact CG-CG1 4.29Å |
| 269 | S | 94.9 | Very high | 92.7 | Very high | 39 Ų | 39 | 36.9 Ų | 36.9 | 27% | 0.273 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -63.3 | -42 | 178.6 | 57.5 | 0 | 0 | 0 | 0 | 111.9 | L265 L266 V272 I273 Y437 | L265-S269 WeakPolarHBondContact O-CB 3.49Å; L265-S269 PolarHBondContact O-N 3.37Å; L265-S269 PolarHBondContact O-OG 3.35Å; L265-S269 VanDerWaalsContact O-OG 3.05Å; L266-S269 PolarHBondContact O-OG 3.31Å; L266-S269 VanDerWaalsContact O-OG 3.09Å; S269-V272 PolarHBondContact O-N 3.19Å; S269-I273 WeakPolarHBondContact O-CG1 3.36Å; S269-I273 PolarHBondContact O-N 2.64Å; S269-Y437 VanDerWaalsContact OG-CE1 3.25Å; S269-Y437 WeakPolarHBondContact OG-CE1 3.18Å; S269-Y437 PolarHBondContact OG-OH 3.26Å |
| 270 | G | 95.4 | Very high | 93 | Very high | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.4 | -43.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L266 Y267 L268 V272 I273 M274 S434 | L266-G270 PolarHBondContact O-N 3.24Å; Y267-G270 PolarHBondContact O-N 2.77Å; L268-G270 PolarHBondContact O-N 2.95Å; G270-V272 PolarHBondContact O-N 3.44Å; G270-I273 PolarHBondContact O-N 3.39Å; G270-M274 WeakPolarHBondContact O-CB 3.47Å; G270-M274 PolarHBondContact O-N 3.16Å; G270-S434 PolarHBondContact O-OG 3.45Å |
| 271 | N | 94.6 | Very high | 93.5 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60 | -44.9 | 175 | -84.2 | 19.1 | 0 | 0 | 0 | 111.8 | Y267 L268 I273 M274 F275 E399 | Y267-N271 WeakPolarHBondContact CE1-ND2 3.47Å; Y267-N271 VanDerWaalsContact CZ-ND2 3.26Å; Y267-N271 WeakPolarHBondContact O-CB 3.26Å; Y267-N271 PolarHBondContact O-N 3.25Å; Y267-N271 PolarHBondContact O-OD1 3.34Å; Y267-N271 PolarHBondContact OH-ND2 3.33Å; L268-N271 PolarHBondContact O-N 3.12Å; N271-I273 VanDerWaalsContact C-N 3.29Å; N271-I273 PolarHBondContact O-N 3.13Å; N271-M274 WeakPolarHBondContact O-CB 3.3Å; N271-M274 PolarHBondContact O-N 3.49Å; N271-M274 VanDerWaalsContact O-N 3.09Å; N271-F275 HydrophobicContact CB-CD2 4.11Å; N271-F275 HydrophobicContact CB-CE2 4.2Å; N271-F275 WeakPolarHBondContact O-CB 3.43Å; N271-F275 WeakPolarHBondContact O-CD2 3.35Å; N271-F275 PolarHBondContact O-N 2.94Å; N271-E399 PolarHBondContact ND2-OE1 2.99Å |
| 272 | V | 95.3 | Very high | 93.8 | Very high | 37 Ų | 37 | 24.3 Ų | 24.3 | 22% | 0.224 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -56.2 | -45.6 | 178.7 | 168.4 | 0 | 0 | 0 | 0 | 111.3 | L268 S269 G270 F276 V398 P402 | L268-V272 WeakPolarHBondContact O-CG2 2.95Å; L268-V272 PolarHBondContact O-N 2.99Å; S269-V272 PolarHBondContact O-N 3.19Å; G270-V272 PolarHBondContact O-N 3.44Å; V272-F276 HydrophobicContact CG1-CE2 4.27Å; V272-F276 VanDerWaalsContact O-CD2 3.24Å; V272-F276 WeakPolarHBondContact O-CD2 3.46Å; V272-V398 HydrophobicContact CG2-CG1 3.52Å; V272-P402 HydrophobicContact CG1-CG 4.38Å; V272-P402 WeakPolarHBondContact O-CB 3.14Å |
| 273 | I | 96.3 | Very high | 94.1 | Very high | 64 Ų | 64 | 17.8 Ų | 17.8 | 33% | 0.328 | 10% | 0.095 | S | C | . | . | H | α-helix | trans | -64.6 | -44.7 | 176.6 | -58.3 | 167.2 | 0 | 0 | 0 | 110.4 | S269 G270 N271 F275 F276 I430 | S269-I273 WeakPolarHBondContact O-CG1 3.36Å; S269-I273 PolarHBondContact O-N 2.64Å; G270-I273 PolarHBondContact O-N 3.39Å; N271-I273 VanDerWaalsContact C-N 3.29Å; N271-I273 PolarHBondContact O-N 3.13Å; I273-F275 PolarHBondContact O-N 3.19Å; I273-F276 PolarHBondContact O-N 3.39Å; I273-I430 HydrophobicContact CG2-CG2 4.28Å; I273-I430 WeakPolarHBondContact O-CG2 3.19Å |
| 274 | M | 96.4 | Very high | 94.4 | Very high | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -57.6 | -48.3 | 179.5 | -174.4 | -173 | 64.5 | 0 | 0 | 111.9 | G270 N271 F276 G277 L278 F334 V338 L371 L375 L431 S434 | G270-M274 WeakPolarHBondContact O-CB 3.47Å; G270-M274 PolarHBondContact O-N 3.16Å; N271-M274 WeakPolarHBondContact O-CB 3.3Å; N271-M274 PolarHBondContact O-N 3.49Å; N271-M274 VanDerWaalsContact O-N 3.09Å; M274-F276 PolarHBondContact O-N 3.45Å; M274-G277 PolarHBondContact O-N 3.4Å; M274-L278 HydrophobicContact CE-CD2 4.21Å; M274-L278 PolarHBondContact O-N 3.01Å; M274-F334 HydrophobicContact CE-CZ 4.36Å; M274-F334 HydrophobicContact SD-CZ 4.12Å; M274-V338 HydrophobicContact CG-CG1 3.94Å; M274-V338 HydrophobicContact SD-CG1 4.08Å; M274-V338 HydrophobicContact SD-CG2 3.6Å; M274-V338 VanDerWaalsContact SD-CG2 3.6Å; M274-L371 HydrophobicContact CE-CD2 4.47Å; M274-L371 HydrophobicContact SD-CD1 3.8Å; M274-L371 HydrophobicContact SD-CG 4.4Å; M274-L375 HydrophobicContact CE-CD1 4.25Å; M274-L431 HydrophobicContact CB-CD2 4.35Å; M274-L431 HydrophobicContact CG-CD2 3.56Å; M274-L431 VanDerWaalsContact O-CD2 3.31Å; M274-L431 WeakPolarHBondContact O-CD2 3.49Å; M274-S434 WeakPolarHBondContact CB-OG 3.42Å; M274-S434 PolarHBondContact N-OG 3.16Å |
| 275 | F | 95 | Very high | 94.6 | Very high | 7 Ų | 7 | 17.7 Ų | 17.7 | 3% | 0.031 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -67.4 | -20 | -173.1 | -86 | -73.2 | 0 | 0 | 0 | 113.7 | N271 I273 G277 L278 F279 L375 E399 P402 V403 | N271-F275 HydrophobicContact CB-CD2 4.11Å; N271-F275 HydrophobicContact CB-CE2 4.2Å; N271-F275 WeakPolarHBondContact O-CB 3.43Å; N271-F275 WeakPolarHBondContact O-CD2 3.35Å; N271-F275 PolarHBondContact O-N 2.94Å; I273-F275 PolarHBondContact O-N 3.19Å; F275-G277 VanDerWaalsContact C-N 3.27Å; F275-G277 PolarHBondContact O-N 2.95Å; F275-L278 HydrophobicContact CD1-CD2 3.97Å; F275-L278 HydrophobicContact CE1-CD2 3.71Å; F275-L278 HydrophobicContact CZ-CD2 4.29Å; F275-F279 AromaticContact CD1-CD2 3.92Å; F275-F279 HydrophobicContact CD1-CD2 3.92Å; F275-F279 AromaticContact CD1-CE2 3.41Å; F275-F279 HydrophobicContact CD1-CE2 3.41Å; F275-F279 VanDerWaalsContact CD1-CE2 3.41Å; F275-F279 HydrophobicContact CD1-CZ 4.35Å; F275-F279 HydrophobicContact CE1-CD2 4.38Å; F275-F279 AromaticContact CE1-CE2 3.47Å; F275-F279 HydrophobicContact CE1-CE2 3.47Å; F275-F279 VanDerWaalsContact CE1-CE2 3.47Å; F275-F279 AromaticContact CE1-CZ 3.99Å; F275-F279 HydrophobicContact CE1-CZ 3.99Å; F275-L375 HydrophobicContact CZ-CD2 4.24Å; F275-E399 HydrophobicContact CD2-CB 4.35Å; F275-E399 HydrophobicContact CD2-CG 3.65Å; F275-E399 HydrophobicContact CE2-CG 3.85Å; F275-E399 WeakPolarHBondContact CE2-OE1 3.26Å; F275-E399 HydrophobicContact CG-CG 4.37Å; F275-P402 HydrophobicContact CB-CB 3.9Å; F275-P402 HydrophobicContact CB-CG 3.77Å; F275-V403 HydrophobicContact CB-CG2 4.42Å; F275-V403 HydrophobicContact CD1-CG2 4.01Å; F275-V403 HydrophobicContact CG-CG2 4.49Å |
| 276 | F | 94.8 | Very high | 94.6 | Very high | 64 Ų | 64 | 14 Ų | 14 | 28% | 0.281 | 8% | 0.075 | S | C | . | . | H | α-helix | trans | -62 | -36.4 | 170.2 | -88.5 | -77.4 | 0 | 0 | 0 | 112 | V272 I273 M274 P402 L405 G406 L409 L410 I430 | V272-F276 HydrophobicContact CG1-CE2 4.27Å; V272-F276 VanDerWaalsContact O-CD2 3.24Å; V272-F276 WeakPolarHBondContact O-CD2 3.46Å; I273-F276 PolarHBondContact O-N 3.39Å; M274-F276 PolarHBondContact O-N 3.45Å; F276-P402 HydrophobicContact CB-CB 4.46Å; F276-P402 HydrophobicContact CD1-CB 4.23Å; F276-P402 HydrophobicContact CD2-CB 3.52Å; F276-P402 HydrophobicContact CE1-CB 4.38Å; F276-P402 HydrophobicContact CE2-CB 3.67Å; F276-P402 HydrophobicContact CG-CB 3.81Å; F276-P402 HydrophobicContact CZ-CB 4.1Å; F276-L405 HydrophobicContact CE1-CB 3.93Å; F276-L405 HydrophobicContact CE1-CD1 4.48Å; F276-G406 WeakPolarHBondContact O-CA 3.38Å; F276-L409 HydrophobicContact CE1-CD1 4.25Å; F276-L410 WeakPolarHBondContact O-CD1 3.33Å; F276-I430 HydrophobicContact CB-CG2 4.35Å |
| 277 | G | 94.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -101.5 | -16.8 | -176.3 | 0 | 0 | 0 | 0 | 0 | 115 | M274 F275 P281 | M274-G277 PolarHBondContact O-N 3.4Å; F275-G277 VanDerWaalsContact C-N 3.27Å; F275-G277 PolarHBondContact O-N 2.95Å; G277-P281 WeakPolarHBondContact O-CD 3.22Å |
| 278 | L | 94.7 | Very high | 94.6 | Very high | 3 Ų | 3 | 12 Ų | 12 | 2% | 0.016 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -71.8 | -44.1 | -169 | -176.1 | 63.7 | 0 | 0 | 0 | 114.1 | M274 F275 F368 L371 L431 | M274-L278 HydrophobicContact CE-CD2 4.21Å; M274-L278 PolarHBondContact O-N 3.01Å; F275-L278 HydrophobicContact CD1-CD2 3.97Å; F275-L278 HydrophobicContact CE1-CD2 3.71Å; F275-L278 HydrophobicContact CZ-CD2 4.29Å; L278-F368 HydrophobicContact CD1-CD2 4.24Å; L278-F368 HydrophobicContact CD1-CE2 4.3Å; L278-F368 HydrophobicContact CD2-CE2 4.45Å; L278-F368 HydrophobicContact CG-CE2 4.25Å; L278-L371 HydrophobicContact CD1-CD1 3.77Å; L278-L371 HydrophobicContact CD2-CD1 4.35Å; L278-L371 HydrophobicContact CD2-CD2 4.08Å; L278-L431 HydrophobicContact CB-CD2 4.31Å |
| 279 | F | 92.3 | Very high | 94.6 | Very high | 11 Ų | 11 | 11.4 Ų | 11.4 | 5% | 0.048 | 6% | 0.061 | C | C | . | . | S | Bend | trans | -88.2 | -25.2 | -172.6 | -74.4 | -67.4 | 0 | 0 | 0 | 113.9 | L66 F275 L282 V283 F368 V403 | L66-F279 HydrophobicContact CD2-CD1 3.96Å; L66-F279 HydrophobicContact CD2-CD2 4.01Å; L66-F279 HydrophobicContact CD2-CE1 3.81Å; L66-F279 HydrophobicContact CD2-CE2 3.82Å; L66-F279 HydrophobicContact CD2-CG 4.06Å; L66-F279 HydrophobicContact CD2-CZ 3.74Å; F275-F279 AromaticContact CD1-CD2 3.92Å; F275-F279 HydrophobicContact CD1-CD2 3.92Å; F275-F279 AromaticContact CD1-CE2 3.41Å; F275-F279 HydrophobicContact CD1-CE2 3.41Å; F275-F279 VanDerWaalsContact CD1-CE2 3.41Å; F275-F279 HydrophobicContact CD1-CZ 4.35Å; F275-F279 HydrophobicContact CE1-CD2 4.38Å; F275-F279 AromaticContact CE1-CE2 3.47Å; F275-F279 HydrophobicContact CE1-CE2 3.47Å; F275-F279 VanDerWaalsContact CE1-CE2 3.47Å; F275-F279 AromaticContact CE1-CZ 3.99Å; F275-F279 HydrophobicContact CE1-CZ 3.99Å; F279-L282 WeakPolarHBondContact O-CB 3.27Å; F279-L282 PolarHBondContact O-N 3.44Å; F279-L282 VanDerWaalsContact O-N 3.13Å; F279-V283 WeakPolarHBondContact O-CG2 3.22Å; F279-V283 PolarHBondContact O-N 3.34Å; F279-F368 HydrophobicContact CE1-CZ 4.33Å; F279-V403 HydrophobicContact CD2-CG2 3.8Å; F279-V403 HydrophobicContact CE2-CG2 3.66Å |
| 280 | T | 94.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -57.1 | -48.1 | -175.7 | -58.9 | 0 | 0 | 0 | 0 | 113.1 | L282 V283 F284 P407 L410 T423 | T280-L282 VanDerWaalsContact C-N 3.27Å; T280-L282 PolarHBondContact O-N 3.28Å; T280-V283 PolarHBondContact O-N 3.5Å; T280-F284 HydrophobicContact CG2-CD2 3.57Å; T280-F284 HydrophobicContact CG2-CE2 3.71Å; T280-F284 WeakPolarHBondContact O-CD2 3.2Å; T280-F284 PolarHBondContact O-N 2.84Å; T280-P407 VanDerWaalsContact OG1-CA 3.31Å; T280-P407 WeakPolarHBondContact OG1-CA 3.39Å; T280-L410 HydrophobicContact CG2-CB 3.65Å; T280-L410 HydrophobicContact CG2-CD1 4.06Å; T280-L410 WeakPolarHBondContact OG1-CD1 3.19Å; T280-T423 HydrophobicContact CG2-CG2 3.59Å |
| 281 | P | 95.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -65.2 | -32.2 | 178.2 | -26 | 40.3 | 0 | 0 | 0 | 112.6 | G277 L285 H345 F364 Y424 C427 | G277-P281 WeakPolarHBondContact O-CD 3.22Å; P281-L285 WeakPolarHBondContact O-CB 3.38Å; P281-L285 PolarHBondContact O-N 3.07Å; P281-L285 VanDerWaalsContact O-N 3.11Å; P281-H345 VanDerWaalsContact CB-CE1 3.43Å; P281-H345 WeakPolarHBondContact CB-CE1 3.42Å; P281-F364 HydrophobicContact CB-CE1 4.45Å; P281-F364 HydrophobicContact CB-CZ 4.46Å; P281-Y424 HydrophobicContact CB-CD1 4.1Å; P281-Y424 HydrophobicContact CB-CE1 3.7Å; P281-Y424 PolarHBondContact O-OH 3Å; P281-Y424 VanDerWaalsContact O-OH 3.05Å; P281-C427 HydrophobicContact CG-CB 3.58Å |
| 282 | L | 93.9 | Very high | 94.2 | Very high | 1 Ų | 1 | 16.6 Ų | 16.6 | 1% | 0.005 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -65.5 | -47.4 | 174.5 | -165.8 | 159.4 | 0 | 0 | 0 | 110.6 | K38 F279 T280 F284 L285 F364 F368 | K38-L282 HydrophobicContact CB-CD2 3.69Å; K38-L282 HydrophobicContact CD-CD1 3.97Å; K38-L282 HydrophobicContact CD-CD2 3.76Å; K38-L282 HydrophobicContact CG-CD2 3.51Å; F279-L282 WeakPolarHBondContact O-CB 3.27Å; F279-L282 PolarHBondContact O-N 3.44Å; F279-L282 VanDerWaalsContact O-N 3.13Å; T280-L282 VanDerWaalsContact C-N 3.27Å; T280-L282 PolarHBondContact O-N 3.28Å; L282-F284 PolarHBondContact O-N 3.32Å; L282-L285 PolarHBondContact O-N 3.48Å; L282-F364 HydrophobicContact CB-CE1 4.01Å; L282-F364 HydrophobicContact CB-CZ 3.94Å; L282-F364 HydrophobicContact CG-CE1 4.45Å; L282-F368 HydrophobicContact CD1-CE2 4.21Å; L282-F368 HydrophobicContact CD1-CZ 4.25Å |
| 283 | V | 93.5 | Very high | 94 | Very high | 11 Ų | 11 | 24.4 Ų | 24.4 | 7% | 0.067 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.6 | -43.9 | -179.5 | 168.9 | 0 | 0 | 0 | 0 | 111.5 | T41 F44 F279 T280 P407 | T41-V283 VanDerWaalsContact CB-O 3.28Å; T41-V283 WeakPolarHBondContact CB-O 3.38Å; T41-V283 HydrophobicContact CG2-CB 4.31Å; T41-V283 HydrophobicContact CG2-CG1 3.92Å; T41-V283 HydrophobicContact CG2-CG2 4.36Å; T41-V283 PolarHBondContact OG1-O 3.03Å; F44-V283 HydrophobicContact CD2-CG1 4.15Å; F44-V283 HydrophobicContact CE2-CG1 3.7Å; F279-V283 WeakPolarHBondContact O-CG2 3.22Å; F279-V283 PolarHBondContact O-N 3.34Å; T280-V283 PolarHBondContact O-N 3.5Å; V283-P407 HydrophobicContact CG2-CG 4.4Å |
| 284 | F | 95.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 11% | 0.106 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.2 | 7.2 | -174.7 | -65.3 | -51.9 | 0 | 0 | 0 | 114.9 | S59 T280 L282 N287 Y288 Y420 T423 | S59-F284 VanDerWaalsContact CB-CZ 3.48Å; T280-F284 HydrophobicContact CG2-CD2 3.57Å; T280-F284 HydrophobicContact CG2-CE2 3.71Å; T280-F284 WeakPolarHBondContact O-CD2 3.2Å; T280-F284 PolarHBondContact O-N 2.84Å; L282-F284 PolarHBondContact O-N 3.32Å; F284-N287 PolarHBondContact O-N 2.93Å; F284-Y288 VanDerWaalsContact O-CB 3.32Å; F284-Y288 WeakPolarHBondContact O-CB 3.38Å; F284-Y288 PolarHBondContact O-N 3.37Å; F284-Y420 HydrophobicContact CB-CD1 3.98Å; F284-Y420 HydrophobicContact CB-CE1 3.7Å; F284-Y420 AromaticContact CD1-CE1 3.69Å; F284-Y420 HydrophobicContact CD1-CE1 3.69Å; F284-Y420 HydrophobicContact CD2-CE1 4.2Å; F284-Y420 HydrophobicContact CE1-CE1 4.31Å; F284-Y420 HydrophobicContact CG-CD1 4.21Å; F284-Y420 AromaticContact CG-CE1 3.62Å; F284-Y420 HydrophobicContact CG-CE1 3.62Å; F284-T423 HydrophobicContact CD2-CG2 4.13Å; F284-T423 HydrophobicContact CE2-CG2 4.48Å |
| 285 | L | 95.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -59.4 | -52.9 | -177.3 | -178.8 | 54.1 | 0 | 0 | 0 | 113.1 | P281 L282 N287 Y288 A289 L302 L303 L306 F357 Y360 Y424 | P281-L285 WeakPolarHBondContact O-CB 3.38Å; P281-L285 PolarHBondContact O-N 3.07Å; P281-L285 VanDerWaalsContact O-N 3.11Å; L282-L285 PolarHBondContact O-N 3.48Å; L285-N287 VanDerWaalsContact C-N 3.34Å; L285-N287 PolarHBondContact O-N 3.35Å; L285-Y288 PolarHBondContact O-N 2.72Å; L285-A289 PolarHBondContact O-N 2.9Å; L285-A289 VanDerWaalsContact O-N 3.12Å; L285-L302 HydrophobicContact CD1-CD1 4.48Å; L285-L302 HydrophobicContact CD2-CB 4.17Å; L285-L302 HydrophobicContact CG-CB 4.31Å; L285-L303 HydrophobicContact CB-CD2 4.27Å; L285-L303 HydrophobicContact CD2-CD2 4.1Å; L285-L306 HydrophobicContact CD2-CD1 3.96Å; L285-F357 HydrophobicContact CD1-CD1 4.39Å; L285-Y360 HydrophobicContact CD1-CD1 4.07Å; L285-Y360 HydrophobicContact CD1-CE1 3.73Å; L285-Y424 VanDerWaalsContact CA-OH 3.28Å; L285-Y424 WeakPolarHBondContact CA-OH 3.48Å; L285-Y424 PolarHBondContact N-OH 3.08Å |
| 286 | S | 92.9 | Very high | 93.5 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.9 | -45.4 | 177.8 | 53.2 | 0 | 0 | 0 | 0 | 110.9 | Y288 A289 K290 | S286-Y288 VanDerWaalsContact C-N 3.32Å; S286-Y288 PolarHBondContact O-N 2.87Å; S286-A289 PolarHBondContact O-N 3.14Å; S286-K290 WeakPolarHBondContact O-CB 3.4Å; S286-K290 VanDerWaalsContact O-CG 3.32Å; S286-K290 WeakPolarHBondContact O-CG 3.49Å; S286-K290 PolarHBondContact O-N 2.95Å |
| 287 | N | 92.1 | Very high | 93.3 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.9 | -37.8 | 179.8 | -69.2 | -4.6 | 0 | 0 | 0 | 112.5 | F44 K45 F284 L285 K290 S291 Y420 | F44-N287 WeakPolarHBondContact CB-ND2 3.22Å; K45-N287 PolarHBondContact N-OD1 2.97Å; F284-N287 PolarHBondContact O-N 2.93Å; L285-N287 VanDerWaalsContact C-N 3.34Å; L285-N287 PolarHBondContact O-N 3.35Å; N287-K290 PolarHBondContact O-N 3.06Å; N287-S291 PolarHBondContact O-N 2.83Å; N287-Y420 HydrophobicContact CB-CE2 4.19Å; N287-Y420 WeakPolarHBondContact CB-OH 3.4Å |
| 288 | Y | 94.7 | Very high | 93.3 | Very high | 2 Ų | 2 | 31.4 Ų | 31.4 | 1% | 0.008 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -67.9 | -42.9 | 177.8 | -174.6 | -156.6 | 0 | 0 | 0 | 111.6 | F284 L285 S286 S291 K292 P349 F357 Y420 Y424 | F284-Y288 VanDerWaalsContact O-CB 3.32Å; F284-Y288 WeakPolarHBondContact O-CB 3.38Å; F284-Y288 PolarHBondContact O-N 3.37Å; L285-Y288 PolarHBondContact O-N 2.72Å; S286-Y288 VanDerWaalsContact C-N 3.32Å; S286-Y288 PolarHBondContact O-N 2.87Å; Y288-S291 PolarHBondContact O-N 3.02Å; Y288-S291 PolarHBondContact O-OG 3.48Å; Y288-K292 HydrophobicContact CD2-CG 4.49Å; Y288-K292 HydrophobicContact CE2-CG 4.33Å; Y288-K292 PolarHBondContact O-N 2.85Å; Y288-P349 WeakPolarHBondContact OH-CA 3.37Å; Y288-F357 AromaticContact CD1-CE1 3.53Å; Y288-F357 HydrophobicContact CD1-CE1 3.53Å; Y288-F357 AromaticContact CD1-CZ 3.8Å; Y288-F357 HydrophobicContact CD1-CZ 3.8Å; Y288-F357 HydrophobicContact CD2-CZ 4.4Å; Y288-F357 AromaticContact CE1-CE1 3.88Å; Y288-F357 HydrophobicContact CE1-CE1 3.88Å; Y288-F357 AromaticContact CE1-CZ 3.9Å; Y288-F357 HydrophobicContact CE1-CZ 3.9Å; Y288-F357 HydrophobicContact CG-CE1 4.08Å; Y288-F357 HydrophobicContact CG-CZ 4.07Å; Y288-Y420 HydrophobicContact CD2-CD2 4.08Å; Y288-Y420 HydrophobicContact CD2-CG 4.04Å; Y288-Y420 HydrophobicContact CG-CG 4.28Å; Y288-Y424 HydrophobicContact CD1-CD2 4.09Å; Y288-Y424 HydrophobicContact CD1-CE1 4.3Å; Y288-Y424 AromaticContact CD1-CE2 3.64Å; Y288-Y424 HydrophobicContact CD1-CE2 3.64Å; Y288-Y424 AromaticContact CD1-CZ 3.75Å; Y288-Y424 HydrophobicContact CE1-CD2 4.32Å; Y288-Y424 HydrophobicContact CE1-CE2 4.32Å; Y288-Y424 HydrophobicContact CG-CE2 4.12Å |
| 289 | A | 94.5 | Very high | 93.2 | Very high | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -62.1 | -44.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L285 S286 S291 K292 I294 A299 L302 | L285-A289 PolarHBondContact O-N 2.9Å; L285-A289 VanDerWaalsContact O-N 3.12Å; S286-A289 PolarHBondContact O-N 3.14Å; A289-S291 VanDerWaalsContact C-N 3.29Å; A289-S291 PolarHBondContact O-N 3.24Å; A289-K292 CarbonylContact O-C 3.59Å; A289-K292 PolarHBondContact O-N 3.29Å; A289-K292 VanDerWaalsContact O-N 3.09Å; A289-I294 HydrophobicContact CB-CB 4.35Å; A289-I294 HydrophobicContact CB-CD1 4.03Å; A289-I294 WeakPolarHBondContact O-CB 3.4Å; A289-I294 PolarHBondContact O-N 3.35Å; A289-A299 HydrophobicContact CB-CB 3.8Å; A289-L302 HydrophobicContact CB-CD1 3.52Å |
| 290 | K | 92.4 | Very high | 93.2 | Very high | 19 Ų | 19 | 30.8 Ų | 30.8 | 8% | 0.083 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59 | -38.6 | 175.4 | -71.6 | 179.2 | -178.9 | -172.4 | 0 | 111.7 | V42 K45 E46 S286 N287 K292 K293 N296 A299 | V42-K290 PolarHBondContact O-NZ 3.26Å; K45-K290 HydrophobicContact CB-CD 3.98Å; K45-K290 HydrophobicContact CG-CD 4.27Å; E46-K290 IonicContact OE1-NZ 2.9Å; E46-K290 PolarHBondContact OE1-NZ 3.18Å; E46-K290 IonicContact OE2-NZ 3.37Å; E46-K290 PolarHBondContact OE2-NZ 3.11Å; S286-K290 WeakPolarHBondContact O-CB 3.4Å; S286-K290 VanDerWaalsContact O-CG 3.32Å; S286-K290 WeakPolarHBondContact O-CG 3.49Å; S286-K290 PolarHBondContact O-N 2.95Å; N287-K290 PolarHBondContact O-N 3.06Å; K290-K292 PolarHBondContact O-N 3.36Å; K290-K293 PolarHBondContact O-N 3.35Å; K290-N296 WeakPolarHBondContact CD-OD1 3.29Å; K290-N296 VanDerWaalsContact CE-OD1 3.32Å; K290-N296 WeakPolarHBondContact CE-OD1 3.16Å; K290-N296 WeakPolarHBondContact CG-OD1 3.45Å; K290-A299 HydrophobicContact CG-CB 3.86Å |
| 291 | S | 91.6 | Very high | 93.2 | Very high | 56 Ų | 56 | 35.5 Ų | 35.5 | 39% | 0.392 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -67.9 | -23.6 | 177.8 | 84 | 0 | 0 | 0 | 0 | 113.5 | N287 Y288 A289 K293 | N287-S291 PolarHBondContact O-N 2.83Å; Y288-S291 PolarHBondContact O-N 3.02Å; Y288-S291 PolarHBondContact O-OG 3.48Å; A289-S291 VanDerWaalsContact C-N 3.29Å; A289-S291 PolarHBondContact O-N 3.24Å; S291-K293 PolarHBondContact O-N 3.03Å |
| 292 | K | 92.8 | Very high | 93.2 | Very high | 74 Ų | 74 | 35.5 Ų | 35.5 | 32% | 0.322 | 18% | 0.184 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.3 | 18.7 | 170.6 | -61 | -62.9 | 178.6 | -171.1 | 0 | 113.5 | Y288 A289 K290 I294 F357 D419 | Y288-K292 HydrophobicContact CD2-CG 4.49Å; Y288-K292 HydrophobicContact CE2-CG 4.33Å; Y288-K292 PolarHBondContact O-N 2.85Å; A289-K292 CarbonylContact O-C 3.59Å; A289-K292 PolarHBondContact O-N 3.29Å; A289-K292 VanDerWaalsContact O-N 3.09Å; K290-K292 PolarHBondContact O-N 3.36Å; K292-I294 PolarHBondContact O-N 3.02Å; K292-F357 HydrophobicContact CB-CE2 4.32Å; K292-F357 HydrophobicContact CG-CE2 4.14Å; K292-F357 HydrophobicContact CG-CZ 4.24Å; K292-D419 IonicContact NZ-OD1 3.78Å; K292-D419 IonicContact NZ-OD2 3.05Å |
| 293 | K | 91.2 | Very high | 93.2 | Very high | 200 Ų | 200 | 35.5 Ų | 35.5 | 87% | 0.87 | 18% | 0.184 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 62.9 | 24.6 | 178.3 | -52.9 | -178.3 | 178.2 | -178.2 | 0 | 114.3 | K290 S291 | K290-K293 PolarHBondContact O-N 3.35Å; S291-K293 PolarHBondContact O-N 3.03Å |
| 294 | I | 94.3 | Very high | 93.3 | Very high | 22 Ų | 22 | 35.3 Ų | 35.3 | 11% | 0.113 | 18% | 0.184 | C | C | . | . | trans | -76.4 | 139.7 | 169.8 | -63.1 | 171.3 | 0 | 0 | 0 | 108.4 | A289 K292 Y354 F357 | A289-I294 HydrophobicContact CB-CB 4.35Å; A289-I294 HydrophobicContact CB-CD1 4.03Å; A289-I294 WeakPolarHBondContact O-CB 3.4Å; A289-I294 PolarHBondContact O-N 3.35Å; K292-I294 PolarHBondContact O-N 3.02Å; I294-Y354 HydrophobicContact CG2-CD2 3.96Å; I294-F357 HydrophobicContact CD1-CD2 3.42Å; I294-F357 VanDerWaalsContact CD1-CD2 3.42Å; I294-F357 HydrophobicContact CD1-CE2 3.83Å; I294-F357 HydrophobicContact CD1-CG 4.27Å | ||
| 295 | A | 93.6 | Very high | 93.4 | Very high | 61 Ų | 61 | 37.1 Ų | 37.1 | 50% | 0.504 | 19% | 0.193 | S | C | . | . | trans | -56.4 | 144.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | E297 S298 A299 | A295-E297 VanDerWaalsContact C-N 3.31Å; A295-E297 PolarHBondContact O-N 2.97Å; A295-S298 PolarHBondContact O-N 2.95Å; A295-S298 VanDerWaalsContact O-N 3.11Å; A295-A299 PolarHBondContact O-N 3.35Å | ||
| 296 | N | 90 | Very high | 93.4 | Very high | 64 Ų | 64 | 37.2 Ų | 37.2 | 34% | 0.342 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -57.9 | -41.6 | -174.8 | -68.1 | -17.5 | 0 | 0 | 0 | 112.9 | Q166 K290 A299 A300 | Q166-N296 HydrophobicContact CG-CB 4.33Å; K290-N296 WeakPolarHBondContact CD-OD1 3.29Å; K290-N296 VanDerWaalsContact CE-OD1 3.32Å; K290-N296 WeakPolarHBondContact CE-OD1 3.16Å; K290-N296 WeakPolarHBondContact CG-OD1 3.45Å; N296-A299 PolarHBondContact O-N 2.91Å; N296-A300 PolarHBondContact O-N 3.35Å |
| 297 | E | 90.8 | Very high | 93.5 | Very high | 96 Ų | 96 | 37.2 Ų | 37.2 | 45% | 0.449 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -60.2 | -48.4 | 175.7 | -59 | -57.9 | 156.8 | 0 | 0 | 111.7 | Q166 A295 A299 A300 F301 | Q166-E297 VanDerWaalsContact CG-CD 3.46Å; Q166-E297 HydrophobicContact CG-CG 4.45Å; Q166-E297 WeakPolarHBondContact CG-OE1 3.49Å; Q166-E297 VanDerWaalsContact CG-OE2 3.24Å; Q166-E297 WeakPolarHBondContact CG-OE2 3.27Å; A295-E297 VanDerWaalsContact C-N 3.31Å; A295-E297 PolarHBondContact O-N 2.97Å; E297-A299 VanDerWaalsContact C-N 3.32Å; E297-A299 PolarHBondContact O-N 2.92Å; E297-A300 PolarHBondContact O-N 3.32Å; E297-F301 PolarHBondContact O-N 3.32Å |
| 298 | S | 92.9 | Very high | 93.6 | Very high | 40 Ų | 40 | 43.1 Ų | 43.1 | 28% | 0.28 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -63.1 | -39.2 | 178 | -54.3 | 0 | 0 | 0 | 0 | 111.7 | A295 F301 L302 Y354 | A295-S298 PolarHBondContact O-N 2.95Å; A295-S298 VanDerWaalsContact O-N 3.11Å; S298-F301 WeakPolarHBondContact O-CB 3.25Å; S298-F301 PolarHBondContact O-N 3.49Å; S298-L302 PolarHBondContact O-N 3.38Å; S298-Y354 WeakPolarHBondContact O-CE2 3.24Å |
| 299 | A | 93.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.6 | -40.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A289 K290 A295 N296 E297 F301 L302 | A289-A299 HydrophobicContact CB-CB 3.8Å; K290-A299 HydrophobicContact CG-CB 3.86Å; A295-A299 PolarHBondContact O-N 3.35Å; N296-A299 PolarHBondContact O-N 2.91Å; E297-A299 VanDerWaalsContact C-N 3.32Å; E297-A299 PolarHBondContact O-N 2.92Å; A299-F301 VanDerWaalsContact C-N 3.32Å; A299-L302 WeakPolarHBondContact O-CB 3.35Å; A299-L302 PolarHBondContact O-N 3.02Å |
| 300 | A | 91.2 | Very high | 93.7 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65 | -37 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | V42 Q166 N296 E297 L302 L303 | V42-A300 HydrophobicContact CG2-CB 3.92Å; Q166-A300 HydrophobicContact CB-CB 3.79Å; Q166-A300 HydrophobicContact CG-CB 4.1Å; N296-A300 PolarHBondContact O-N 3.35Å; E297-A300 PolarHBondContact O-N 3.32Å; A300-L302 PolarHBondContact O-N 3.37Å; A300-L303 PolarHBondContact O-N 3.03Å |
| 301 | F | 94.8 | Very high | 93.6 | Very high | 100 Ų | 100 | 47 Ų | 47 | 44% | 0.439 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -62.5 | -24.5 | 177.3 | -162.2 | -104.8 | 0 | 0 | 0 | 113.4 | P163 E297 S298 A299 L303 S304 I305 Y354 | P163-F301 HydrophobicContact CG-CD2 4.39Å; E297-F301 PolarHBondContact O-N 3.32Å; S298-F301 WeakPolarHBondContact O-CB 3.25Å; S298-F301 PolarHBondContact O-N 3.49Å; A299-F301 VanDerWaalsContact C-N 3.32Å; F301-L303 VanDerWaalsContact C-N 3.32Å; F301-L303 PolarHBondContact O-N 3.28Å; F301-S304 WeakPolarHBondContact O-CA 3.33Å; F301-S304 VanDerWaalsContact O-CB 3.22Å; F301-S304 WeakPolarHBondContact O-CB 3.28Å; F301-S304 PolarHBondContact O-N 3.44Å; F301-I305 HydrophobicContact CD1-CD1 3.83Å; F301-I305 HydrophobicContact CD1-CG1 3.88Å; F301-I305 HydrophobicContact CE1-CD1 4Å; F301-I305 HydrophobicContact CE1-CG1 3.81Å; F301-I305 PolarHBondContact O-N 3.39Å; F301-Y354 WeakPolarHBondContact CD1-OH 3.22Å |
| 302 | L | 96.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.5 | -39.5 | 174.8 | -63.6 | 173.6 | 0 | 0 | 0 | 112.7 | L285 A289 S298 A299 A300 S304 I305 L306 Y354 F357 A361 | L285-L302 HydrophobicContact CD1-CD1 4.48Å; L285-L302 HydrophobicContact CD2-CB 4.17Å; L285-L302 HydrophobicContact CG-CB 4.31Å; A289-L302 HydrophobicContact CB-CD1 3.52Å; S298-L302 PolarHBondContact O-N 3.38Å; A299-L302 WeakPolarHBondContact O-CB 3.35Å; A299-L302 PolarHBondContact O-N 3.02Å; A300-L302 PolarHBondContact O-N 3.37Å; L302-S304 PolarHBondContact O-N 2.93Å; L302-I305 HydrophobicContact CD2-CD1 4.49Å; L302-I305 PolarHBondContact O-N 2.84Å; L302-L306 WeakPolarHBondContact O-CB 3.38Å; L302-L306 PolarHBondContact O-N 2.94Å; L302-Y354 HydrophobicContact CD2-CD2 4.34Å; L302-Y354 HydrophobicContact CD2-CE2 3.86Å; L302-Y354 HydrophobicContact CG-CE2 4.3Å; L302-F357 HydrophobicContact CD1-CB 3.77Å; L302-F357 HydrophobicContact CD1-CD1 4.28Å; L302-F357 HydrophobicContact CD1-CG 4.19Å; L302-F357 HydrophobicContact CD2-CB 3.82Å; L302-F357 HydrophobicContact CG-CB 4.47Å; L302-A361 HydrophobicContact CB-CB 4.49Å; L302-A361 HydrophobicContact CD2-CB 4.45Å |
| 303 | L | 94.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.7 | -28.7 | 174.2 | -69.9 | 169.5 | 0 | 0 | 0 | 111.3 | V42 A162 L285 A300 F301 A307 | V42-L303 HydrophobicContact CG2-CD1 4.02Å; A162-L303 HydrophobicContact CB-CB 3.92Å; A162-L303 HydrophobicContact CB-CD1 4.15Å; L285-L303 HydrophobicContact CB-CD2 4.27Å; L285-L303 HydrophobicContact CD2-CD2 4.1Å; A300-L303 PolarHBondContact O-N 3.03Å; F301-L303 VanDerWaalsContact C-N 3.32Å; F301-L303 PolarHBondContact O-N 3.28Å; L303-A307 VanDerWaalsContact O-CB 3.27Å; L303-A307 WeakPolarHBondContact O-CB 3.46Å; L303-A307 PolarHBondContact O-N 3.45Å |
| 304 | S | 95.1 | Very high | 93.7 | Very high | 8 Ų | 8 | 37.3 Ų | 37.3 | 6% | 0.056 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -75.4 | -42.3 | 177.8 | -49.2 | 0 | 0 | 0 | 0 | 112.2 | S159 P163 F301 L302 A307 F308 | S159-S304 PolarHBondContact O-OG 3.34Å; P163-S304 VanDerWaalsContact CD-OG 3.27Å; P163-S304 WeakPolarHBondContact CD-OG 3.36Å; P163-S304 WeakPolarHBondContact CG-OG 3.48Å; F301-S304 WeakPolarHBondContact O-CA 3.33Å; F301-S304 VanDerWaalsContact O-CB 3.22Å; F301-S304 WeakPolarHBondContact O-CB 3.28Å; F301-S304 PolarHBondContact O-N 3.44Å; L302-S304 PolarHBondContact O-N 2.93Å; S304-A307 PolarHBondContact O-N 3.46Å; S304-F308 WeakPolarHBondContact O-CB 3.47Å; S304-F308 PolarHBondContact O-N 2.9Å |
| 305 | I | 96.4 | Very high | 93.5 | Very high | 38 Ų | 38 | 39.9 Ų | 39.9 | 20% | 0.195 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -58.4 | -50 | 172.3 | -65.1 | 171.8 | 0 | 0 | 0 | 109.7 | F301 L302 A307 F308 V309 C358 A361 | F301-I305 HydrophobicContact CD1-CD1 3.83Å; F301-I305 HydrophobicContact CD1-CG1 3.88Å; F301-I305 HydrophobicContact CE1-CD1 4Å; F301-I305 HydrophobicContact CE1-CG1 3.81Å; F301-I305 PolarHBondContact O-N 3.39Å; L302-I305 HydrophobicContact CD2-CD1 4.49Å; L302-I305 PolarHBondContact O-N 2.84Å; I305-A307 VanDerWaalsContact C-N 3.33Å; I305-A307 PolarHBondContact O-N 3.19Å; I305-F308 PolarHBondContact O-N 3.13Å; I305-V309 WeakPolarHBondContact O-CG2 3.49Å; I305-V309 PolarHBondContact O-N 3.41Å; I305-C358 HydrophobicContact CD1-CB 4Å; I305-C358 VanDerWaalsContact CD1-SG 3.59Å; I305-A361 HydrophobicContact CB-CB 4.39Å; I305-A361 HydrophobicContact CG2-CB 4.2Å |
| 306 | L | 96.4 | Very high | 93.4 | Very high | 1 Ų | 1 | 39 Ų | 39 | 1% | 0.005 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -54.7 | -49.5 | 177.2 | -178.3 | 163.4 | 0 | 0 | 0 | 111.2 | L285 L302 F308 V309 D310 A361 F364 G365 | L285-L306 HydrophobicContact CD2-CD1 3.96Å; L302-L306 WeakPolarHBondContact O-CB 3.38Å; L302-L306 PolarHBondContact O-N 2.94Å; L306-F308 PolarHBondContact O-N 3.29Å; L306-V309 PolarHBondContact O-N 3.48Å; L306-D310 WeakPolarHBondContact O-CB 3.4Å; L306-D310 PolarHBondContact O-N 2.79Å; L306-A361 HydrophobicContact CB-CB 4.43Å; L306-F364 HydrophobicContact CD1-CD1 3.25Å; L306-F364 HydrophobicContact CD1-CE1 3.49Å; L306-F364 VanDerWaalsContact CD1-CE1 3.49Å; L306-F364 HydrophobicContact CD1-CG 4.05Å; L306-F364 HydrophobicContact CD1-CZ 4.44Å; L306-F364 HydrophobicContact CG-CD1 4.33Å; L306-G365 WeakPolarHBondContact O-CA 3.32Å |
| 307 | A | 95.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.2 | -40.4 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | P155 L158 L303 S304 I305 D310 M311 | P155-A307 HydrophobicContact CB-CB 4.18Å; P155-A307 WeakPolarHBondContact CB-O 3.42Å; P155-A307 WeakPolarHBondContact O-CB 3.47Å; L158-A307 HydrophobicContact CB-CB 3.97Å; L158-A307 HydrophobicContact CD2-CB 4Å; L158-A307 HydrophobicContact CG-CB 3.98Å; L303-A307 VanDerWaalsContact O-CB 3.27Å; L303-A307 WeakPolarHBondContact O-CB 3.46Å; L303-A307 PolarHBondContact O-N 3.45Å; S304-A307 PolarHBondContact O-N 3.46Å; I305-A307 VanDerWaalsContact C-N 3.33Å; I305-A307 PolarHBondContact O-N 3.19Å; A307-D310 PolarHBondContact O-N 3.38Å; A307-M311 WeakPolarHBondContact O-CB 3.48Å; A307-M311 PolarHBondContact O-N 3.18Å |
| 308 | F | 94.8 | Very high | 93.4 | Very high | 125 Ų | 125 | 33.6 Ų | 33.6 | 55% | 0.548 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -64.3 | -42.3 | 176.9 | -173.9 | -97.7 | 0 | 0 | 0 | 111.8 | S304 I305 L306 M311 V312 | S304-F308 WeakPolarHBondContact O-CB 3.47Å; S304-F308 PolarHBondContact O-N 2.9Å; I305-F308 PolarHBondContact O-N 3.13Å; L306-F308 PolarHBondContact O-N 3.29Å; F308-M311 HydrophobicContact CD2-CE 3.62Å; F308-M311 HydrophobicContact CE2-CE 3.63Å; F308-M311 WeakPolarHBondContact O-CB 3.19Å; F308-M311 PolarHBondContact O-N 2.94Å; F308-V312 PolarHBondContact O-N 3.47Å |
| 309 | V | 96.5 | Very high | 93.3 | Very high | 42 Ų | 42 | 37.7 Ų | 37.7 | 26% | 0.255 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -67.9 | -42.1 | 177 | -179.3 | 0 | 0 | 0 | 0 | 111.3 | I305 L306 M311 V312 A313 G362 F366 | I305-V309 WeakPolarHBondContact O-CG2 3.49Å; I305-V309 PolarHBondContact O-N 3.41Å; L306-V309 PolarHBondContact O-N 3.48Å; V309-M311 VanDerWaalsContact C-N 3.31Å; V309-M311 PolarHBondContact O-N 3.22Å; V309-V312 PolarHBondContact O-N 3.25Å; V309-A313 WeakPolarHBondContact O-CB 3.03Å; V309-A313 PolarHBondContact O-N 2.77Å; V309-G362 WeakPolarHBondContact CG1-O 3.41Å; V309-F366 HydrophobicContact CG1-CB 3.86Å |
| 310 | D | 93.8 | Very high | 93.3 | Very high | 2 Ų | 2 | 39.9 Ų | 39.9 | 1% | 0.011 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -56.6 | -43.8 | 173.2 | 173.2 | 15 | 0 | 0 | 0 | 111.6 | L306 A307 V312 A313 R314 G365 G369 | L306-D310 WeakPolarHBondContact O-CB 3.4Å; L306-D310 PolarHBondContact O-N 2.79Å; A307-D310 PolarHBondContact O-N 3.38Å; D310-V312 PolarHBondContact O-N 3.43Å; D310-A313 PolarHBondContact O-N 2.9Å; D310-R314 VanDerWaalsContact O-CB 3.27Å; D310-R314 WeakPolarHBondContact O-CB 3.42Å; D310-R314 PolarHBondContact O-N 2.82Å; D310-R314 IonicContact OD1-CZ 2.66Å; D310-R314 IonicContact OD1-NE 2.71Å; D310-R314 PolarHBondContact OD1-NE 3Å; D310-R314 IonicContact OD1-NH2 3.78Å; D310-R314 PolarHBondContact OD1-NH2 3.43Å; D310-R314 IonicContact OD2-CZ 3.22Å; D310-R314 IonicContact OD2-NH2 2.7Å; D310-R314 PolarHBondContact OD2-NH2 3.44Å; D310-G365 WeakPolarHBondContact CA-O 3.34Å; D310-G369 WeakPolarHBondContact OD1-CA 3.48Å |
| 311 | M | 91.2 | Very high | 93.2 | Very high | 57 Ų | 57 | 40 Ų | 40 | 28% | 0.281 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -55.1 | -38 | 177.9 | -171.7 | 178.4 | 63.4 | 0 | 0 | 113 | P155 V156 A307 F308 V309 P315 | P155-M311 HydrophobicContact CB-CB 3.9Å; P155-M311 HydrophobicContact CG-CB 3.81Å; P155-M311 HydrophobicContact CG-CG 4.06Å; V156-M311 HydrophobicContact CG2-SD 3.57Å; V156-M311 VanDerWaalsContact CG2-SD 3.57Å; A307-M311 WeakPolarHBondContact O-CB 3.48Å; A307-M311 PolarHBondContact O-N 3.18Å; F308-M311 HydrophobicContact CD2-CE 3.62Å; F308-M311 HydrophobicContact CE2-CE 3.63Å; F308-M311 WeakPolarHBondContact O-CB 3.19Å; F308-M311 PolarHBondContact O-N 2.94Å; V309-M311 VanDerWaalsContact C-N 3.31Å; V309-M311 PolarHBondContact O-N 3.22Å; M311-P315 WeakPolarHBondContact O-CD 3.17Å; M311-P315 WeakPolarHBondContact O-CG 3.01Å |
| 312 | V | 92.7 | Very high | 92.8 | Very high | 86 Ų | 86 | 39.2 Ų | 39.2 | 52% | 0.521 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -85.6 | -40.7 | 178.6 | -179.5 | 0 | 0 | 0 | 0 | 111.2 | F308 V309 D310 R314 P315 S316 | F308-V312 PolarHBondContact O-N 3.47Å; V309-V312 PolarHBondContact O-N 3.25Å; D310-V312 PolarHBondContact O-N 3.43Å; V312-R314 VanDerWaalsContact C-N 3.35Å; V312-R314 PolarHBondContact O-N 3.35Å; V312-P315 WeakPolarHBondContact O-CD 3.08Å; V312-S316 WeakPolarHBondContact O-CB 3.44Å; V312-S316 PolarHBondContact O-N 3.17Å; V312-S316 PolarHBondContact O-OG 3.14Å; V312-S316 VanDerWaalsContact O-OG 3.11Å |
| 313 | A | 93.9 | Very high | 92.5 | Very high | 2 Ų | 2 | 41.6 Ų | 41.6 | 2% | 0.017 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.6 | -41.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | V309 D310 S316 M317 F366 | V309-A313 WeakPolarHBondContact O-CB 3.03Å; V309-A313 PolarHBondContact O-N 2.77Å; D310-A313 PolarHBondContact O-N 2.9Å; A313-S316 WeakPolarHBondContact CA-OG 3.45Å; A313-S316 PolarHBondContact O-N 3.38Å; A313-S316 PolarHBondContact O-OG 2.91Å; A313-M317 WeakPolarHBondContact O-CB 3.23Å; A313-M317 WeakPolarHBondContact O-CG 3.37Å; A313-M317 PolarHBondContact O-N 3.11Å; A313-F366 HydrophobicContact CB-CB 4.46Å; A313-F366 HydrophobicContact CB-CD2 3.68Å; A313-F366 HydrophobicContact CB-CE2 4.29Å; A313-F366 HydrophobicContact CB-CG 4.35Å |
| 314 | R | 90.2 | Very high | 92.2 | Very high | 39 Ų | 39 | 50.8 Ų | 50.8 | 15% | 0.147 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.5 | -50.2 | -173.2 | -173.9 | -172.3 | -56.2 | -171.1 | -2.1 | 113.9 | D310 V312 G318 S373 | D310-R314 VanDerWaalsContact O-CB 3.27Å; D310-R314 WeakPolarHBondContact O-CB 3.42Å; D310-R314 PolarHBondContact O-N 2.82Å; D310-R314 IonicContact OD1-CZ 2.66Å; D310-R314 IonicContact OD1-NE 2.71Å; D310-R314 PolarHBondContact OD1-NE 3Å; D310-R314 IonicContact OD1-NH2 3.78Å; D310-R314 PolarHBondContact OD1-NH2 3.43Å; D310-R314 IonicContact OD2-CZ 3.22Å; D310-R314 IonicContact OD2-NH2 2.7Å; D310-R314 PolarHBondContact OD2-NH2 3.44Å; V312-R314 VanDerWaalsContact C-N 3.35Å; V312-R314 PolarHBondContact O-N 3.35Å; R314-G318 PolarHBondContact O-N 2.92Å; R314-S373 WeakPolarHBondContact O-CB 3.25Å |
| 315 | P | 89.4 | Confident | 91.9 | Very high | 77 Ų | 77 | 61.3 Ų | 61.3 | 50% | 0.5 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.3 | -41.6 | 173 | -21.4 | 33.2 | 0 | 0 | 0 | 112.4 | M311 V312 G318 L319 | M311-P315 WeakPolarHBondContact O-CD 3.17Å; M311-P315 WeakPolarHBondContact O-CG 3.01Å; V312-P315 WeakPolarHBondContact O-CD 3.08Å; P315-G318 PolarHBondContact O-N 3.18Å; P315-L319 WeakPolarHBondContact O-CG 3.2Å; P315-L319 PolarHBondContact O-N 2.62Å |
| 316 | S | 92 | Very high | 91.7 | Very high | 42 Ų | 42 | 61.5 Ų | 61.5 | 29% | 0.294 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.1 | -48.8 | -178.3 | 68.6 | 0 | 0 | 0 | 0 | 112.2 | V312 A313 G318 L319 V320 | V312-S316 WeakPolarHBondContact O-CB 3.44Å; V312-S316 PolarHBondContact O-N 3.17Å; V312-S316 PolarHBondContact O-OG 3.14Å; V312-S316 VanDerWaalsContact O-OG 3.11Å; A313-S316 WeakPolarHBondContact CA-OG 3.45Å; A313-S316 PolarHBondContact O-N 3.38Å; A313-S316 PolarHBondContact O-OG 2.91Å; S316-G318 VanDerWaalsContact C-N 3.35Å; S316-G318 PolarHBondContact O-N 3.16Å; S316-L319 WeakPolarHBondContact O-CB 3.36Å; S316-L319 PolarHBondContact O-N 2.88Å; S316-V320 VanDerWaalsContact O-CG2 3.31Å; S316-V320 WeakPolarHBondContact O-CG2 3.21Å; S316-V320 PolarHBondContact O-N 3.08Å |
| 317 | M | 93.4 | Very high | 91.3 | Very high | 28 Ų | 28 | 65 Ų | 65 | 14% | 0.138 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -71.2 | -30.4 | 178.9 | -66.7 | -59.7 | 102.7 | 0 | 0 | 112.4 | A313 V320 A321 F333 F366 W370 | A313-M317 WeakPolarHBondContact O-CB 3.23Å; A313-M317 WeakPolarHBondContact O-CG 3.37Å; A313-M317 PolarHBondContact O-N 3.11Å; M317-V320 HydrophobicContact CE-CB 4.49Å; M317-V320 HydrophobicContact CE-CG2 3.95Å; M317-V320 PolarHBondContact O-N 2.96Å; M317-A321 WeakPolarHBondContact O-CB 3.38Å; M317-A321 PolarHBondContact O-N 3.38Å; M317-F333 HydrophobicContact SD-CZ 4.14Å; M317-F366 HydrophobicContact CE-CE2 4.14Å; M317-F366 HydrophobicContact CE-CZ 4.08Å; M317-F366 HydrophobicContact CG-CE2 4.31Å; M317-F366 HydrophobicContact CG-CZ 4.27Å; M317-F366 HydrophobicContact SD-CE2 4.3Å; M317-F366 HydrophobicContact SD-CZ 3.85Å; M317-W370 HydrophobicContact CB-CB 4.21Å; M317-W370 HydrophobicContact CB-CG 4.11Å; M317-W370 HydrophobicContact CG-CB 3.79Å; M317-W370 HydrophobicContact CG-CD2 4.43Å; M317-W370 HydrophobicContact CG-CG 3.8Å; M317-W370 HydrophobicContact SD-CD2 4.26Å; M317-W370 HydrophobicContact SD-CG 4.21Å |
| 318 | G | 88.5 | Confident | 91 | Very high | 18 Ų | 18 | 69 Ų | 69 | 19% | 0.186 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.9 | -37.7 | 169.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | R314 P315 S316 N322 | R314-G318 PolarHBondContact O-N 2.92Å; P315-G318 PolarHBondContact O-N 3.18Å; S316-G318 VanDerWaalsContact C-N 3.35Å; S316-G318 PolarHBondContact O-N 3.16Å; G318-N322 PolarHBondContact O-N 2.66Å; G318-N322 PolarHBondContact O-ND2 3.12Å |
| 319 | L | 89 | Confident | 90.8 | Very high | 126 Ų | 126 | 71.1 Ų | 71.1 | 66% | 0.66 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -69.1 | -43.2 | 173.1 | -69.9 | 171.4 | 0 | 0 | 0 | 111.4 | P315 S316 A321 N322 T323 | P315-L319 WeakPolarHBondContact O-CG 3.2Å; P315-L319 PolarHBondContact O-N 2.62Å; S316-L319 WeakPolarHBondContact O-CB 3.36Å; S316-L319 PolarHBondContact O-N 2.88Å; L319-A321 VanDerWaalsContact C-N 3.33Å; L319-A321 PolarHBondContact O-N 2.94Å; L319-N322 PolarHBondContact O-N 3.25Å; L319-N322 VanDerWaalsContact O-N 3.09Å; L319-T323 PolarHBondContact O-N 3.05Å |
| 320 | V | 93.2 | Very high | 90.5 | Very high | 47 Ų | 47 | 69.1 Ų | 69.1 | 29% | 0.285 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -59.1 | -44.2 | 176.3 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | S316 M317 N322 T323 I326 F333 | S316-V320 VanDerWaalsContact O-CG2 3.31Å; S316-V320 WeakPolarHBondContact O-CG2 3.21Å; S316-V320 PolarHBondContact O-N 3.08Å; M317-V320 HydrophobicContact CE-CB 4.49Å; M317-V320 HydrophobicContact CE-CG2 3.95Å; M317-V320 PolarHBondContact O-N 2.96Å; V320-N322 PolarHBondContact O-N 3.33Å; V320-N322 VanDerWaalsContact O-N 3.15Å; V320-T323 WeakPolarHBondContact O-CB 3.33Å; V320-T323 WeakPolarHBondContact O-CG2 3.45Å; V320-T323 PolarHBondContact O-N 2.83Å; V320-T323 VanDerWaalsContact O-N 3.1Å; V320-T323 PolarHBondContact O-OG1 3.26Å; V320-I326 HydrophobicContact CG1-CD1 3.26Å; V320-F333 HydrophobicContact CB-CZ 4.33Å; V320-F333 HydrophobicContact CG1-CE1 4.47Å; V320-F333 HydrophobicContact CG1-CE2 4.04Å; V320-F333 HydrophobicContact CG1-CZ 3.66Å |
| 321 | A | 89.8 | Confident | 90.5 | Very high | 2 Ų | 2 | 69.4 Ų | 69.4 | 2% | 0.017 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -59.7 | -25.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | M317 L319 R327 V330 F333 V374 | M317-A321 WeakPolarHBondContact O-CB 3.38Å; M317-A321 PolarHBondContact O-N 3.38Å; L319-A321 VanDerWaalsContact C-N 3.33Å; L319-A321 PolarHBondContact O-N 2.94Å; A321-R327 WeakPolarHBondContact O-CA 3.47Å; A321-R327 PolarHBondContact O-N 3.48Å; A321-V330 HydrophobicContact CB-CG2 4.28Å; A321-F333 HydrophobicContact CB-CD1 4.06Å; A321-F333 HydrophobicContact CB-CE1 3.91Å; A321-V374 HydrophobicContact CB-CG2 4.25Å |
| 322 | N | 87.3 | Confident | 90.6 | Very high | 84 Ų | 84 | 69.4 Ų | 69.4 | 45% | 0.449 | 34% | 0.341 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.8 | 0.5 | -179.7 | -78.2 | -51.7 | 0 | 0 | 0 | 114.3 | G318 L319 V320 R327 | G318-N322 PolarHBondContact O-N 2.66Å; G318-N322 PolarHBondContact O-ND2 3.12Å; L319-N322 PolarHBondContact O-N 3.25Å; L319-N322 VanDerWaalsContact O-N 3.09Å; V320-N322 PolarHBondContact O-N 3.33Å; V320-N322 VanDerWaalsContact O-N 3.15Å; N322-R327 PolarHBondContact OD1-NH1 3.16Å |
| 323 | T | 89.7 | Confident | 90.8 | Very high | 50 Ų | 50 | 66.5 Ų | 66.5 | 31% | 0.307 | 32% | 0.322 | S | S | . | . | S | Bend | trans | -69.4 | 152.6 | 175.3 | 61 | 0 | 0 | 0 | 0 | 111.6 | L319 V320 W325 I326 R327 | L319-T323 PolarHBondContact O-N 3.05Å; V320-T323 WeakPolarHBondContact O-CB 3.33Å; V320-T323 WeakPolarHBondContact O-CG2 3.45Å; V320-T323 PolarHBondContact O-N 2.83Å; V320-T323 VanDerWaalsContact O-N 3.1Å; V320-T323 PolarHBondContact O-OG1 3.26Å; T323-W325 PolarHBondContact O-N 3.09Å; T323-I326 PolarHBondContact O-N 3.17Å; T323-R327 VanDerWaalsContact O-CB 3.22Å; T323-R327 WeakPolarHBondContact O-CB 3.4Å; T323-R327 PolarHBondContact O-N 3.16Å |
| 324 | K | 87.8 | Confident | 90.9 | Very high | 193 Ų | 193 | 66.5 Ų | 66.5 | 84% | 0.839 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.3 | -25.7 | -177.6 | -65.2 | -177.7 | 179.3 | -179.6 | 0 | 113.8 | P328 | K324-P328 VanDerWaalsContact O-CD 3.25Å; K324-P328 WeakPolarHBondContact O-CD 3.38Å |
| 325 | W | 89.4 | Confident | 91.2 | Very high | 228 Ų | 228 | 64.6 Ų | 64.6 | 86% | 0.864 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -35.3 | -178.3 | -53.4 | -48 | 0 | 0 | 0 | 113.1 | T323 | T323-W325 PolarHBondContact O-N 3.09Š|
| 326 | I | 91.6 | Very high | 91.5 | Very high | 42 Ų | 42 | 64.6 Ų | 64.6 | 22% | 0.215 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.7 | -34.2 | -174.3 | -62.5 | 172.7 | 0 | 0 | 0 | 111 | V320 T323 R329 V330 F333 | V320-I326 HydrophobicContact CG1-CD1 3.26Å; T323-I326 PolarHBondContact O-N 3.17Å; I326-R329 CarbonylContact O-C 3.16Å; I326-R329 WeakPolarHBondContact O-CA 3.19Å; I326-R329 PolarHBondContact O-N 2.88Å; I326-V330 PolarHBondContact O-N 3.28Å; I326-F333 HydrophobicContact CD1-CE2 4.29Å; I326-F333 HydrophobicContact CG2-CB 3.8Å; I326-F333 HydrophobicContact CG2-CD1 3.96Å; I326-F333 HydrophobicContact CG2-CD2 3.92Å; I326-F333 HydrophobicContact CG2-CE2 4.47Å; I326-F333 HydrophobicContact CG2-CG 3.64Å |
| 327 | R | 88.9 | Confident | 91.8 | Very high | 75 Ų | 75 | 62.6 Ų | 62.6 | 28% | 0.283 | 30% | 0.295 | S | S | . | . | G | 310 helix | trans | -53.1 | -46.6 | -177.2 | -178.7 | 64.8 | -177 | -150.4 | 21.1 | 113.6 | A321 N322 T323 R329 V330 E377 | A321-R327 WeakPolarHBondContact O-CA 3.47Å; A321-R327 PolarHBondContact O-N 3.48Å; N322-R327 PolarHBondContact OD1-NH1 3.16Å; T323-R327 VanDerWaalsContact O-CB 3.22Å; T323-R327 WeakPolarHBondContact O-CB 3.4Å; T323-R327 PolarHBondContact O-N 3.16Å; R327-R329 PolarHBondContact O-N 3.4Å; R327-R329 VanDerWaalsContact O-N 3.1Å; R327-V330 PolarHBondContact O-N 2.96Å; R327-E377 IonicContact CZ-OE1 3.06Å; R327-E377 IonicContact NH1-OE1 2.6Å; R327-E377 PolarHBondContact NH1-OE1 3.39Å; R327-E377 IonicContact NH2-OE1 2.76Å; R327-E377 PolarHBondContact NH2-OE1 3.15Å |
| 328 | P | 88 | Confident | 92 | Very high | 83 Ų | 83 | 61.3 Ų | 61.3 | 54% | 0.539 | 29% | 0.288 | S | S | . | . | G | 310 helix | trans | -67.2 | -10.7 | 178.2 | -19.6 | 33.9 | 0 | 0 | 0 | 114.3 | K324 Y446 | K324-P328 VanDerWaalsContact O-CD 3.25Å; K324-P328 WeakPolarHBondContact O-CD 3.38Å; P328-Y446 PolarHBondContact O-OH 3.48Å |
| 329 | R | 91.1 | Very high | 92.5 | Very high | 171 Ų | 171 | 63 Ų | 63 | 65% | 0.645 | 29% | 0.293 | S | S | * | . | G | 310 helix | trans | -130.1 | 26.7 | -176.2 | -68.1 | -170.2 | -176.8 | 178.9 | 3 | 111.8 | I326 R327 Q331 Y332 F333 Y446 | I326-R329 CarbonylContact O-C 3.16Å; I326-R329 WeakPolarHBondContact O-CA 3.19Å; I326-R329 PolarHBondContact O-N 2.88Å; R327-R329 PolarHBondContact O-N 3.4Å; R327-R329 VanDerWaalsContact O-N 3.1Å; R329-Q331 PolarHBondContact O-N 3.43Å; R329-Q331 VanDerWaalsContact O-N 3.17Å; R329-Y332 HydrophobicContact CB-CD2 4.12Å; R329-Y332 HydrophobicContact CG-CD2 4.42Å; R329-Y332 PolarHBondContact O-N 3.12Å; R329-F333 PolarHBondContact O-N 2.91Å; R329-Y446 WeakPolarHBondContact CA-OH 3.18Å |
| 330 | V | 90.4 | Very high | 92.9 | Very high | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -59.7 | -32.6 | -172.3 | 70.3 | 0 | 0 | 0 | 0 | 112.6 | A321 I326 R327 Y332 F333 F334 V374 E377 D381 | A321-V330 HydrophobicContact CB-CG2 4.28Å; I326-V330 PolarHBondContact O-N 3.28Å; R327-V330 PolarHBondContact O-N 2.96Å; V330-Y332 VanDerWaalsContact C-N 3.31Å; V330-Y332 PolarHBondContact O-N 3.45Å; V330-F333 WeakPolarHBondContact O-CB 3.22Å; V330-F333 PolarHBondContact O-N 3.22Å; V330-F333 VanDerWaalsContact O-N 3.11Å; V330-F334 PolarHBondContact O-N 3.48Å; V330-V374 HydrophobicContact CG2-CG1 3.83Å; V330-E377 HydrophobicContact CG2-CG 4.43Å; V330-D381 HydrophobicContact CG1-CB 4Å |
| 331 | Q | 92.1 | Very high | 93.1 | Very high | 7 Ų | 7 | 57.9 Ų | 57.9 | 3% | 0.033 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.5 | -36.3 | 175.5 | -64.3 | 168.4 | 29.8 | 0 | 0 | 113.3 | R329 F334 A335 T378 D381 L382 M442 Y446 | R329-Q331 PolarHBondContact O-N 3.43Å; R329-Q331 VanDerWaalsContact O-N 3.17Å; Q331-F334 WeakPolarHBondContact O-CB 3.23Å; Q331-A335 PolarHBondContact O-N 3.02Å; Q331-A335 VanDerWaalsContact O-N 3.16Å; Q331-T378 HydrophobicContact CB-CG2 4.4Å; Q331-T378 HydrophobicContact CG-CG2 3.85Å; Q331-D381 PolarHBondContact NE2-OD2 2.82Å; Q331-L382 HydrophobicContact CG-CG 4.48Å; Q331-M442 HydrophobicContact CB-CB 3.86Å; Q331-M442 HydrophobicContact CB-CG 3.83Å; Q331-M442 HydrophobicContact CB-SD 4.03Å; Q331-M442 HydrophobicContact CG-CG 4.47Å; Q331-M442 HydrophobicContact CG-SD 4.01Å; Q331-M442 PolarHBondContact OE1-SD 2.86Å; Q331-Y446 HydrophobicContact CB-CE2 3.92Å; Q331-Y446 HydrophobicContact CG-CE2 4.43Å |
| 332 | Y | 94.8 | Very high | 93.5 | Very high | 57 Ų | 57 | 57.8 Ų | 57.8 | 22% | 0.224 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -73.6 | -38 | 174.3 | -69 | -65.1 | 0 | 0 | 0 | 111.8 | R329 V330 F334 A335 I336 F439 G443 Y446 | R329-Y332 HydrophobicContact CB-CD2 4.12Å; R329-Y332 HydrophobicContact CG-CD2 4.42Å; R329-Y332 PolarHBondContact O-N 3.12Å; V330-Y332 VanDerWaalsContact C-N 3.31Å; V330-Y332 PolarHBondContact O-N 3.45Å; Y332-F334 PolarHBondContact O-N 2.98Å; Y332-A335 PolarHBondContact O-N 2.96Å; Y332-I336 VanDerWaalsContact O-CG1 3.28Å; Y332-I336 WeakPolarHBondContact O-CG1 3.39Å; Y332-I336 PolarHBondContact O-N 3.26Å; Y332-F439 HydrophobicContact CD1-CD1 4.46Å; Y332-F439 AromaticContact CD1-CD2 3.68Å; Y332-F439 HydrophobicContact CD1-CD2 3.68Å; Y332-F439 HydrophobicContact CD1-CE1 4.33Å; Y332-F439 AromaticContact CD1-CE2 3.52Å; Y332-F439 HydrophobicContact CD1-CE2 3.52Å; Y332-F439 HydrophobicContact CD1-CG 4.15Å; Y332-F439 AromaticContact CD1-CZ 3.87Å; Y332-F439 HydrophobicContact CD1-CZ 3.87Å; Y332-F439 HydrophobicContact CE1-CD1 4.36Å; Y332-F439 HydrophobicContact CE1-CD2 4.37Å; Y332-F439 HydrophobicContact CE1-CE1 4.17Å; Y332-F439 HydrophobicContact CE1-CE2 4.18Å; Y332-F439 HydrophobicContact CE1-CG 4.45Å; Y332-F439 HydrophobicContact CE1-CZ 4.07Å; Y332-F439 WeakPolarHBondContact CE1-O 3.25Å; Y332-F439 HydrophobicContact CG-CE2 4.29Å; Y332-G443 WeakPolarHBondContact OH-CA 3.35Å; Y332-Y446 HydrophobicContact CD2-CD2 4.1Å; Y332-Y446 AromaticContact CD2-CE2 3.71Å; Y332-Y446 HydrophobicContact CD2-CE2 3.71Å; Y332-Y446 AromaticContact CE2-CD2 3.41Å; Y332-Y446 HydrophobicContact CE2-CD2 3.41Å; Y332-Y446 VanDerWaalsContact CE2-CD2 3.41Å; Y332-Y446 AromaticContact CE2-CE2 3.53Å; Y332-Y446 HydrophobicContact CE2-CE2 3.53Å; Y332-Y446 HydrophobicContact CE2-CG 4.49Å; Y332-Y446 AromaticContact CZ-CD2 3.86Å |
| 333 | F | 95.8 | Very high | 94 | Very high | 26 Ų | 26 | 57.8 Ų | 57.8 | 11% | 0.114 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.5 | -38.3 | 174.8 | -172.5 | -114.7 | 0 | 0 | 0 | 111.1 | M317 V320 A321 I326 R329 V330 S337 W370 V374 | M317-F333 HydrophobicContact SD-CZ 4.14Å; V320-F333 HydrophobicContact CB-CZ 4.33Å; V320-F333 HydrophobicContact CG1-CE1 4.47Å; V320-F333 HydrophobicContact CG1-CE2 4.04Å; V320-F333 HydrophobicContact CG1-CZ 3.66Å; A321-F333 HydrophobicContact CB-CD1 4.06Å; A321-F333 HydrophobicContact CB-CE1 3.91Å; I326-F333 HydrophobicContact CD1-CE2 4.29Å; I326-F333 HydrophobicContact CG2-CB 3.8Å; I326-F333 HydrophobicContact CG2-CD1 3.96Å; I326-F333 HydrophobicContact CG2-CD2 3.92Å; I326-F333 HydrophobicContact CG2-CE2 4.47Å; I326-F333 HydrophobicContact CG2-CG 3.64Å; R329-F333 PolarHBondContact O-N 2.91Å; V330-F333 WeakPolarHBondContact O-CB 3.22Å; V330-F333 PolarHBondContact O-N 3.22Å; V330-F333 VanDerWaalsContact O-N 3.11Å; F333-S337 PolarHBondContact O-N 3.19Å; F333-S337 VanDerWaalsContact O-N 3.17Å; F333-W370 AromaticContact CD1-NE1 3.45Å; F333-W370 AromaticContact CD2-CZ2 3.57Å; F333-W370 HydrophobicContact CD2-CZ2 3.57Å; F333-W370 AromaticContact CD2-NE1 3.95Å; F333-W370 AromaticContact CE1-CD1 3.71Å; F333-W370 AromaticContact CE1-CE2 3.91Å; F333-W370 HydrophobicContact CE1-CZ2 4.38Å; F333-W370 AromaticContact CE1-NE1 2.99Å; F333-W370 AromaticContact CE2-CE2 3.59Å; F333-W370 HydrophobicContact CE2-CH2 4.29Å; F333-W370 AromaticContact CE2-CZ2 3.27Å; F333-W370 HydrophobicContact CE2-CZ2 3.27Å; F333-W370 AromaticContact CE2-NE1 3.55Å; F333-W370 HydrophobicContact CG-CZ2 4.24Å; F333-W370 AromaticContact CG-NE1 3.9Å; F333-W370 AromaticContact CZ-CD1 3.9Å; F333-W370 AromaticContact CZ-CE2 3.49Å; F333-W370 VanDerWaalsContact CZ-CE2 3.49Å; F333-W370 AromaticContact CZ-CZ2 3.72Å; F333-W370 HydrophobicContact CZ-CZ2 3.72Å; F333-W370 AromaticContact CZ-NE1 3.04Å; F333-V374 HydrophobicContact CD1-CG1 4.14Å; F333-V374 HydrophobicContact CD1-CG2 3.62Å; F333-V374 HydrophobicContact CE1-CG2 3.6Å |
| 334 | F | 95.8 | Very high | 94.3 | Very high | 1 Ų | 1 | 56 Ų | 56 | 0% | 0.004 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.2 | -53.8 | 170.2 | -179.5 | -119.8 | 0 | 0 | 0 | 112.2 | Y267 M274 V330 Q331 Y332 I336 S337 V338 L371 V374 L375 T378 L438 | Y267-F334 HydrophobicContact CE2-CE1 4.1Å; M274-F334 HydrophobicContact CE-CZ 4.36Å; M274-F334 HydrophobicContact SD-CZ 4.12Å; V330-F334 PolarHBondContact O-N 3.48Å; Q331-F334 WeakPolarHBondContact O-CB 3.23Å; Y332-F334 PolarHBondContact O-N 2.98Å; F334-I336 VanDerWaalsContact C-N 3.3Å; F334-I336 PolarHBondContact O-N 3.27Å; F334-S337 WeakPolarHBondContact O-CB 3.41Å; F334-S337 PolarHBondContact O-N 3.27Å; F334-S337 PolarHBondContact O-OG 3.16Å; F334-V338 HydrophobicContact CE1-CG2 4.41Å; F334-V338 HydrophobicContact CE2-CG2 4.22Å; F334-V338 HydrophobicContact CZ-CG2 4.12Å; F334-V338 PolarHBondContact O-N 2.92Å; F334-L371 HydrophobicContact CE2-CG 4.21Å; F334-V374 HydrophobicContact CB-CG1 3.76Å; F334-V374 HydrophobicContact CD2-CB 4.32Å; F334-V374 HydrophobicContact CD2-CG1 4.28Å; F334-V374 HydrophobicContact CG-CG1 4.46Å; F334-L375 HydrophobicContact CE2-CB 4.23Å; F334-L375 HydrophobicContact CE2-CD1 3.72Å; F334-L375 HydrophobicContact CZ-CD1 3.57Å; F334-T378 HydrophobicContact CB-CG2 4.44Å; F334-T378 HydrophobicContact CD1-CG2 4.37Å; F334-L438 HydrophobicContact CD1-CD1 4.24Å; F334-L438 HydrophobicContact CE1-CD1 3.67Å; F334-L438 HydrophobicContact CZ-CD1 4.49Å |
| 335 | A | 96.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -58.3 | -40.1 | -179 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q331 Y332 S337 V338 I339 L438 F439 | Q331-A335 PolarHBondContact O-N 3.02Å; Q331-A335 VanDerWaalsContact O-N 3.16Å; Y332-A335 PolarHBondContact O-N 2.96Å; A335-S337 VanDerWaalsContact C-N 3.33Å; A335-S337 PolarHBondContact O-N 3.49Å; A335-V338 PolarHBondContact O-N 2.95Å; A335-I339 WeakPolarHBondContact O-CG1 3.34Å; A335-I339 PolarHBondContact O-N 3.42Å; A335-L438 HydrophobicContact CB-CB 4.08Å; A335-F439 HydrophobicContact CB-CB 3.87Å; A335-F439 HydrophobicContact CB-CD2 4.08Å; A335-F439 HydrophobicContact CB-CG 4.49Å |
| 336 | I | 97.1 | Very high | 95.1 | Very high | 77 Ų | 77 | 38.3 Ų | 38.3 | 40% | 0.395 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -61.6 | -41.5 | 175.1 | -67.1 | 164.9 | 0 | 0 | 0 | 110.9 | Y332 F334 V338 I339 Y340 W370 F439 | Y332-I336 VanDerWaalsContact O-CG1 3.28Å; Y332-I336 WeakPolarHBondContact O-CG1 3.39Å; Y332-I336 PolarHBondContact O-N 3.26Å; F334-I336 VanDerWaalsContact C-N 3.3Å; F334-I336 PolarHBondContact O-N 3.27Å; I336-V338 VanDerWaalsContact C-N 3.27Å; I336-V338 PolarHBondContact O-N 3.48Å; I336-I339 PolarHBondContact O-N 3.16Å; I336-Y340 WeakPolarHBondContact O-CB 3.47Å; I336-Y340 PolarHBondContact O-N 3.44Å; I336-W370 HydrophobicContact CG2-CH2 3.69Å; I336-W370 HydrophobicContact CG2-CZ2 4.17Å; I336-F439 HydrophobicContact CG1-CE2 4.39Å |
| 337 | S | 97.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.6 | -37.2 | 176.9 | 80.3 | 0 | 0 | 0 | 0 | 112.4 | F333 F334 A335 N341 | F333-S337 PolarHBondContact O-N 3.19Å; F333-S337 VanDerWaalsContact O-N 3.17Å; F334-S337 WeakPolarHBondContact O-CB 3.41Å; F334-S337 PolarHBondContact O-N 3.27Å; F334-S337 PolarHBondContact O-OG 3.16Å; A335-S337 VanDerWaalsContact C-N 3.33Å; A335-S337 PolarHBondContact O-N 3.49Å; S337-N341 WeakPolarHBondContact O-CB 3.48Å; S337-N341 PolarHBondContact O-N 2.91Å |
| 338 | V | 97.9 | Very high | 95.5 | Very high | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -68.8 | -45.1 | 177.8 | -178.5 | 0 | 0 | 0 | 0 | 111 | M274 F334 A335 I336 Y340 N341 G342 L371 L431 L438 | M274-V338 HydrophobicContact CG-CG1 3.94Å; M274-V338 HydrophobicContact SD-CG1 4.08Å; M274-V338 HydrophobicContact SD-CG2 3.6Å; M274-V338 VanDerWaalsContact SD-CG2 3.6Å; F334-V338 HydrophobicContact CE1-CG2 4.41Å; F334-V338 HydrophobicContact CE2-CG2 4.22Å; F334-V338 HydrophobicContact CZ-CG2 4.12Å; F334-V338 PolarHBondContact O-N 2.92Å; A335-V338 PolarHBondContact O-N 2.95Å; I336-V338 VanDerWaalsContact C-N 3.27Å; I336-V338 PolarHBondContact O-N 3.48Å; V338-Y340 VanDerWaalsContact C-N 3.34Å; V338-Y340 PolarHBondContact O-N 3.38Å; V338-N341 WeakPolarHBondContact O-CB 3.49Å; V338-N341 PolarHBondContact O-N 3.37Å; V338-G342 PolarHBondContact O-N 2.92Å; V338-L371 HydrophobicContact CG2-CD1 4.08Å; V338-L431 HydrophobicContact CG1-CB 4.46Å; V338-L431 HydrophobicContact CG1-CD2 4.35Å; V338-L431 WeakPolarHBondContact CG1-O 3.33Å; V338-L438 HydrophobicContact CG2-CD1 4.38Å |
| 339 | I | 98.1 | Very high | 95.8 | Very high | 54 Ų | 54 | 34.3 Ų | 34.3 | 28% | 0.277 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -61.8 | -44.2 | 176.1 | -63.9 | 172.2 | 0 | 0 | 0 | 110.5 | A335 I336 N341 G342 L343 I436 | A335-I339 WeakPolarHBondContact O-CG1 3.34Å; A335-I339 PolarHBondContact O-N 3.42Å; I336-I339 PolarHBondContact O-N 3.16Å; I339-N341 VanDerWaalsContact C-N 3.31Å; I339-N341 PolarHBondContact O-N 3.22Å; I339-G342 PolarHBondContact O-N 2.9Å; I339-L343 PolarHBondContact O-N 2.96Å; I339-I436 HydrophobicContact CD1-CG1 4.18Å |
| 340 | Y | 97.9 | Very high | 95.8 | Very high | 65 Ų | 65 | 32.6 Ų | 32.6 | 26% | 0.255 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -60.1 | -41.9 | 177 | -179.5 | -98.6 | 0 | 0 | 0 | 111.7 | I336 V338 L343 C344 F363 F366 A367 W370 | I336-Y340 WeakPolarHBondContact O-CB 3.47Å; I336-Y340 PolarHBondContact O-N 3.44Å; V338-Y340 VanDerWaalsContact C-N 3.34Å; V338-Y340 PolarHBondContact O-N 3.38Å; Y340-L343 PolarHBondContact O-N 3.33Å; Y340-C344 PolarHBondContact O-N 3.09Å; Y340-C344 PolarHBondContact O-SG 3.33Å; Y340-F363 WeakPolarHBondContact OH-CD1 3.44Å; Y340-F366 AromaticContact CE1-CD1 3.83Å; Y340-F366 HydrophobicContact CE1-CD1 3.83Å; Y340-F366 HydrophobicContact CE1-CE1 4.37Å; Y340-A367 HydrophobicContact CD1-CB 3.48Å; Y340-A367 VanDerWaalsContact CD1-CB 3.48Å; Y340-A367 HydrophobicContact CE1-CB 3.65Å; Y340-W370 HydrophobicContact CD1-CE3 4.43Å; Y340-W370 HydrophobicContact CG-CZ3 4.41Å |
| 341 | N | 97.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -61.5 | -45.4 | 175 | -151.4 | -71.8 | 0 | 0 | 0 | 111.6 | S337 V338 I339 L343 C344 H345 A367 F368 L431 | S337-N341 WeakPolarHBondContact O-CB 3.48Å; S337-N341 PolarHBondContact O-N 2.91Å; V338-N341 WeakPolarHBondContact O-CB 3.49Å; V338-N341 PolarHBondContact O-N 3.37Å; I339-N341 VanDerWaalsContact C-N 3.31Å; I339-N341 PolarHBondContact O-N 3.22Å; N341-L343 PolarHBondContact O-N 3.41Å; N341-C344 WeakPolarHBondContact O-CB 3.23Å; N341-C344 PolarHBondContact O-N 3.2Å; N341-H345 PolarHBondContact O-CD2 3.36Å; N341-H345 PolarHBondContact O-N 3.5Å; N341-H345 VanDerWaalsContact O-N 3.15Å; N341-H345 PolarHBondContact OD1-NE2 3.38Å; N341-A367 HydrophobicContact CB-CB 4.01Å; N341-A367 VanDerWaalsContact ND2-C 3.26Å; N341-A367 WeakPolarHBondContact ND2-CB 3.38Å; N341-A367 PolarHBondContact ND2-O 3.21Å; N341-F368 PolarHBondContact ND2-N 3.28Å; N341-L431 HydrophobicContact CB-CD1 4.1Å; N341-L431 WeakPolarHBondContact OD1-CD1 3.07Å |
| 342 | G | 97.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62 | -40.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | V338 I339 H345 L346 G428 | V338-G342 PolarHBondContact O-N 2.92Å; I339-G342 PolarHBondContact O-N 2.9Å; G342-H345 PolarHBondContact O-N 2.93Å; G342-L346 PolarHBondContact O-N 3.5Å; G342-G428 VanDerWaalsContact O-CA 3.3Å; G342-G428 WeakPolarHBondContact O-CA 3.42Å |
| 343 | L | 97.6 | Very high | 95.7 | Very high | 84 Ų | 84 | 38.6 Ų | 38.6 | 44% | 0.44 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -63.5 | -41.4 | 174.9 | -177.4 | 61.1 | 0 | 0 | 0 | 111.6 | I339 Y340 N341 H345 L346 L347 | I339-L343 PolarHBondContact O-N 2.96Å; Y340-L343 PolarHBondContact O-N 3.33Å; N341-L343 PolarHBondContact O-N 3.41Å; L343-H345 VanDerWaalsContact C-N 3.26Å; L343-H345 PolarHBondContact O-N 2.92Å; L343-L346 PolarHBondContact O-N 3.42Å; L343-L347 HydrophobicContact CD1-CD1 4.18Å; L343-L347 HydrophobicContact CD1-CG 4.3Å; L343-L347 HydrophobicContact CG-CD1 4.1Å; L343-L347 WeakPolarHBondContact O-CG 3.27Å; L343-L347 PolarHBondContact O-N 3.46Å; L343-L347 VanDerWaalsContact O-N 3.08Å |
| 344 | C | 97.1 | Very high | 95.7 | Very high | 12 Ų | 12 | 41.3 Ų | 41.3 | 8% | 0.081 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -56.6 | -43 | 173.9 | -65.7 | 0 | 0 | 0 | 0 | 111.1 | Y340 N341 L347 A348 Y360 | Y340-C344 PolarHBondContact O-N 3.09Å; Y340-C344 PolarHBondContact O-SG 3.33Å; N341-C344 WeakPolarHBondContact O-CB 3.23Å; N341-C344 PolarHBondContact O-N 3.2Å; C344-L347 PolarHBondContact O-N 3.13Å; C344-A348 PolarHBondContact O-N 3.05Å; C344-Y360 WeakPolarHBondContact O-CE2 3.35Å |
| 345 | H | 97.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -70.3 | -35.5 | 178.5 | -63.4 | -31 | 0 | 0 | 0 | 113.8 | P281 N341 G342 L343 L347 A348 Y360 F364 L431 | P281-H345 VanDerWaalsContact CB-CE1 3.43Å; P281-H345 WeakPolarHBondContact CB-CE1 3.42Å; N341-H345 PolarHBondContact O-CD2 3.36Å; N341-H345 PolarHBondContact O-N 3.5Å; N341-H345 VanDerWaalsContact O-N 3.15Å; N341-H345 PolarHBondContact OD1-NE2 3.38Å; G342-H345 PolarHBondContact O-N 2.93Å; L343-H345 VanDerWaalsContact C-N 3.26Å; L343-H345 PolarHBondContact O-N 2.92Å; H345-L347 VanDerWaalsContact C-N 3.27Å; H345-L347 PolarHBondContact O-N 3.18Å; H345-A348 WeakPolarHBondContact O-CB 3.32Å; H345-A348 PolarHBondContact O-N 3.03Å; H345-Y360 PolarHBondContact CE1-OH 3.37Å; H345-Y360 VanDerWaalsContact CE1-OH 3.29Å; H345-Y360 AromaticContact ND1-CZ 3.89Å; H345-Y360 PolarHBondContact ND1-OH 3.01Å; H345-F364 AromaticContact CE1-CD2 3.44Å; H345-F364 VanDerWaalsContact CE1-CD2 3.44Å; H345-F364 WeakPolarHBondContact CE1-CD2 3.4Å; H345-F364 AromaticContact CE1-CE2 3.28Å; H345-F364 WeakPolarHBondContact CE1-CE2 3.43Å; H345-F364 AromaticContact CE1-CG 3.93Å; H345-F364 AromaticContact CE1-CZ 3.61Å; H345-F364 AromaticContact NE2-CE2 3.66Å; H345-L431 VanDerWaalsContact CD2-CD1 3.42Å; H345-L431 WeakPolarHBondContact CD2-CD1 3.28Å |
| 346 | L | 96.5 | Very high | 95.7 | Very high | 50 Ų | 50 | 44.9 Ų | 44.9 | 26% | 0.262 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -63 | -35.9 | 173.4 | -74.7 | -170.6 | 0 | 0 | 0 | 112.5 | G342 L343 P349 W425 V429 I432 | G342-L346 PolarHBondContact O-N 3.5Å; L343-L346 PolarHBondContact O-N 3.42Å; L346-P349 WeakPolarHBondContact O-CD 3.17Å; L346-W425 HydrophobicContact CD2-CB 4.49Å; L346-W425 WeakPolarHBondContact CD2-O 3.43Å; L346-W425 PolarHBondContact O-NE1 3.39Å; L346-V429 HydrophobicContact CD2-CG2 4.08Å; L346-I432 HydrophobicContact CD1-CD1 3.36Å; L346-I432 HydrophobicContact CG-CD1 4.05Å |
| 347 | L | 94.8 | Very high | 95.6 | Very high | 91 Ų | 91 | 41.2 Ų | 41.2 | 48% | 0.476 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -84 | -12.9 | 179.5 | -62.7 | 175.5 | 0 | 0 | 0 | 113.2 | L343 C344 H345 P349 L350 | L343-L347 HydrophobicContact CD1-CD1 4.18Å; L343-L347 HydrophobicContact CD1-CG 4.3Å; L343-L347 HydrophobicContact CG-CD1 4.1Å; L343-L347 WeakPolarHBondContact O-CG 3.27Å; L343-L347 PolarHBondContact O-N 3.46Å; L343-L347 VanDerWaalsContact O-N 3.08Å; C344-L347 PolarHBondContact O-N 3.13Å; H345-L347 VanDerWaalsContact C-N 3.27Å; H345-L347 PolarHBondContact O-N 3.18Å; L347-P349 VanDerWaalsContact C-CD 3.46Å; L347-P349 VanDerWaalsContact C-N 3.34Å; L347-L350 HydrophobicContact CB-CD1 4.38Å; L347-L350 HydrophobicContact CD2-CD1 3.84Å; L347-L350 WeakPolarHBondContact O-CB 3.2Å; L347-L350 PolarHBondContact O-N 3.14Å; L347-L350 VanDerWaalsContact O-N 3.12Å |
| 348 | A | 93.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 24% | 0.238 | C | C | . | . | G | 310 helix | trans | -53.3 | -41.9 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | C344 H345 L350 S351 Y360 Y424 | C344-A348 PolarHBondContact O-N 3.05Å; H345-A348 WeakPolarHBondContact O-CB 3.32Å; H345-A348 PolarHBondContact O-N 3.03Å; A348-L350 PolarHBondContact O-N 3.09Å; A348-L350 VanDerWaalsContact O-N 3.1Å; A348-S351 WeakPolarHBondContact O-CB 3.45Å; A348-S351 PolarHBondContact O-N 3.35Å; A348-S351 PolarHBondContact O-OG 3.48Å; A348-Y360 HydrophobicContact CB-CD2 3.68Å; A348-Y360 HydrophobicContact CB-CE1 4.39Å; A348-Y360 HydrophobicContact CB-CE2 3.4Å; A348-Y360 HydrophobicContact CB-CG 4.3Å; A348-Y424 HydrophobicContact CB-CD1 3.45Å; A348-Y424 VanDerWaalsContact CB-CD1 3.45Å; A348-Y424 HydrophobicContact CB-CE1 4.01Å; A348-Y424 HydrophobicContact CB-CG 4.25Å |
| 349 | P | 93.7 | Very high | 95.6 | Very high | 25 Ų | 25 | 47.5 Ų | 47.5 | 16% | 0.162 | 26% | 0.264 | C | S | . | . | G | 310 helix | trans | -66.3 | -11.7 | -178.3 | -25.8 | 39.8 | 0 | 0 | 0 | 115.8 | Y288 L346 L347 S351 K421 | Y288-P349 WeakPolarHBondContact OH-CA 3.37Å; L346-P349 WeakPolarHBondContact O-CD 3.17Å; L347-P349 VanDerWaalsContact C-CD 3.46Å; L347-P349 VanDerWaalsContact C-N 3.34Å; P349-S351 PolarHBondContact O-N 2.83Å; P349-K421 HydrophobicContact CB-CB 3.88Å; P349-K421 HydrophobicContact CG-CB 3.99Å |
| 350 | L | 91.8 | Very high | 95.6 | Very high | 135 Ų | 135 | 45.4 Ų | 45.4 | 71% | 0.707 | 25% | 0.253 | S | S | * | . | G | 310 helix | trans | -69.6 | -16.7 | 170.6 | -60.8 | 171.6 | 0 | 0 | 0 | 111.9 | L347 A348 T352 | L347-L350 HydrophobicContact CB-CD1 4.38Å; L347-L350 HydrophobicContact CD2-CD1 3.84Å; L347-L350 WeakPolarHBondContact O-CB 3.2Å; L347-L350 PolarHBondContact O-N 3.14Å; L347-L350 VanDerWaalsContact O-N 3.12Å; A348-L350 PolarHBondContact O-N 3.09Å; A348-L350 VanDerWaalsContact O-N 3.1Å; L350-T352 PolarHBondContact O-N 2.9Å |
| 351 | S | 91.4 | Very high | 95.6 | Very high | 12 Ų | 12 | 42.3 Ų | 42.3 | 8% | 0.084 | 24% | 0.241 | C | C | . | . | trans | -79.7 | 101.6 | 179.2 | -54.4 | 0 | 0 | 0 | 0 | 110.6 | A348 P349 G356 F357 | A348-S351 WeakPolarHBondContact O-CB 3.45Å; A348-S351 PolarHBondContact O-N 3.35Å; A348-S351 PolarHBondContact O-OG 3.48Å; P349-S351 PolarHBondContact O-N 2.83Å; S351-G356 PolarHBondContact OG-O 3.39Å; S351-F357 WeakPolarHBondContact O-CE2 3.48Å; S351-F357 WeakPolarHBondContact O-CZ 3.17Å | ||
| 352 | T | 89.4 | Confident | 95.6 | Very high | 95 Ų | 95 | 43.1 Ų | 43.1 | 58% | 0.583 | 25% | 0.249 | S | C | * | . | trans | -105.8 | -21.6 | 176.6 | 56.4 | 0 | 0 | 0 | 0 | 113.2 | L350 | L350-T352 PolarHBondContact O-N 2.9Š| ||
| 353 | T | 94.8 | Very high | 95.6 | Very high | 83 Ų | 83 | 48.4 Ų | 48.4 | 51% | 0.509 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -108.1 | 160.7 | -179.6 | 64.7 | 0 | 0 | 0 | 0 | 111.3 | A355 G356 F357 | T353-A355 VanDerWaalsContact C-N 3.27Å; T353-A355 PolarHBondContact O-N 3.32Å; T353-G356 PolarHBondContact O-N 3.27Å; T353-G356 VanDerWaalsContact O-N 3.07Å; T353-G356 PolarHBondContact OG1-N 3.42Å; T353-F357 WeakPolarHBondContact O-CD2 3.45Å; T353-F357 PolarHBondContact O-N 3.27Å |
| 354 | Y | 94.6 | Very high | 95.5 | Very high | 83 Ų | 83 | 44.4 Ų | 44.4 | 33% | 0.325 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -56 | -41.5 | 175.7 | 178.6 | -118.1 | 0 | 0 | 0 | 112.6 | I294 S298 F301 L302 G356 F357 C358 | I294-Y354 HydrophobicContact CG2-CD2 3.96Å; S298-Y354 WeakPolarHBondContact O-CE2 3.24Å; F301-Y354 WeakPolarHBondContact CD1-OH 3.22Å; L302-Y354 HydrophobicContact CD2-CD2 4.34Å; L302-Y354 HydrophobicContact CD2-CE2 3.86Å; L302-Y354 HydrophobicContact CG-CE2 4.3Å; Y354-G356 VanDerWaalsContact C-N 3.35Å; Y354-G356 PolarHBondContact O-N 3.29Å; Y354-F357 PolarHBondContact O-N 2.99Å; Y354-C358 PolarHBondContact O-N 3.31Å; Y354-C358 PolarHBondContact O-SG 2.9Å |
| 355 | A | 96 | Very high | 95.5 | Very high | 59 Ų | 59 | 43.8 Ų | 43.8 | 49% | 0.488 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60.8 | -42.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | T353 F357 C358 I359 | T353-A355 VanDerWaalsContact C-N 3.27Å; T353-A355 PolarHBondContact O-N 3.32Å; A355-F357 PolarHBondContact O-N 3.01Å; A355-C358 WeakPolarHBondContact O-CB 3.46Å; A355-C358 PolarHBondContact O-N 3.22Å; A355-I359 WeakPolarHBondContact O-CG1 3.37Å; A355-I359 PolarHBondContact O-N 3.31Å |
| 356 | G | 96.4 | Very high | 95.6 | Very high | 17 Ų | 17 | 46.8 Ų | 46.8 | 18% | 0.175 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59 | -45.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S351 T353 Y354 C358 I359 Y360 | S351-G356 PolarHBondContact OG-O 3.39Å; T353-G356 PolarHBondContact O-N 3.27Å; T353-G356 VanDerWaalsContact O-N 3.07Å; T353-G356 PolarHBondContact OG1-N 3.42Å; Y354-G356 VanDerWaalsContact C-N 3.35Å; Y354-G356 PolarHBondContact O-N 3.29Å; G356-C358 VanDerWaalsContact C-N 3.34Å; G356-C358 PolarHBondContact O-N 3.39Å; G356-I359 PolarHBondContact O-N 3.29Å; G356-Y360 PolarHBondContact O-N 3.36Å |
| 357 | F | 96.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64.7 | -34.2 | 175.7 | -84.1 | -75.6 | 0 | 0 | 0 | 113.4 | L285 Y288 K292 I294 L302 S351 T353 Y354 A355 Y360 A361 | L285-F357 HydrophobicContact CD1-CD1 4.39Å; Y288-F357 AromaticContact CD1-CE1 3.53Å; Y288-F357 HydrophobicContact CD1-CE1 3.53Å; Y288-F357 AromaticContact CD1-CZ 3.8Å; Y288-F357 HydrophobicContact CD1-CZ 3.8Å; Y288-F357 HydrophobicContact CD2-CZ 4.4Å; Y288-F357 AromaticContact CE1-CE1 3.88Å; Y288-F357 HydrophobicContact CE1-CE1 3.88Å; Y288-F357 AromaticContact CE1-CZ 3.9Å; Y288-F357 HydrophobicContact CE1-CZ 3.9Å; Y288-F357 HydrophobicContact CG-CE1 4.08Å; Y288-F357 HydrophobicContact CG-CZ 4.07Å; K292-F357 HydrophobicContact CB-CE2 4.32Å; K292-F357 HydrophobicContact CG-CE2 4.14Å; K292-F357 HydrophobicContact CG-CZ 4.24Å; I294-F357 HydrophobicContact CD1-CD2 3.42Å; I294-F357 VanDerWaalsContact CD1-CD2 3.42Å; I294-F357 HydrophobicContact CD1-CE2 3.83Å; I294-F357 HydrophobicContact CD1-CG 4.27Å; L302-F357 HydrophobicContact CD1-CB 3.77Å; L302-F357 HydrophobicContact CD1-CD1 4.28Å; L302-F357 HydrophobicContact CD1-CG 4.19Å; L302-F357 HydrophobicContact CD2-CB 3.82Å; L302-F357 HydrophobicContact CG-CB 4.47Å; S351-F357 WeakPolarHBondContact O-CE2 3.48Å; S351-F357 WeakPolarHBondContact O-CZ 3.17Å; T353-F357 WeakPolarHBondContact O-CD2 3.45Å; T353-F357 PolarHBondContact O-N 3.27Å; Y354-F357 PolarHBondContact O-N 2.99Å; A355-F357 PolarHBondContact O-N 3.01Å; F357-Y360 PolarHBondContact O-N 3.46Å; F357-A361 VanDerWaalsContact O-CB 3.26Å; F357-A361 WeakPolarHBondContact O-CB 3.41Å; F357-A361 PolarHBondContact O-N 3.19Å |
| 358 | C | 97.4 | Very high | 95.6 | Very high | 27 Ų | 27 | 40.5 Ų | 40.5 | 18% | 0.182 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.1 | -43.7 | 174.7 | -67.2 | 0 | 0 | 0 | 0 | 111.5 | I305 Y354 A355 G356 A361 G362 | I305-C358 HydrophobicContact CD1-CB 4Å; I305-C358 VanDerWaalsContact CD1-SG 3.59Å; Y354-C358 PolarHBondContact O-N 3.31Å; Y354-C358 PolarHBondContact O-SG 2.9Å; A355-C358 WeakPolarHBondContact O-CB 3.46Å; A355-C358 PolarHBondContact O-N 3.22Å; G356-C358 VanDerWaalsContact C-N 3.34Å; G356-C358 PolarHBondContact O-N 3.39Å; C358-A361 PolarHBondContact O-N 3.33Å; C358-G362 PolarHBondContact O-N 2.85Å |
| 359 | I | 97.3 | Very high | 95.6 | Very high | 106 Ų | 106 | 40.5 Ų | 40.5 | 54% | 0.544 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.9 | -47.6 | 175.8 | -66.8 | 166.6 | 0 | 0 | 0 | 109.9 | A355 G356 A361 G362 F363 | A355-I359 WeakPolarHBondContact O-CG1 3.37Å; A355-I359 PolarHBondContact O-N 3.31Å; G356-I359 PolarHBondContact O-N 3.29Å; I359-A361 PolarHBondContact O-N 3.45Å; I359-G362 PolarHBondContact O-N 2.83Å; I359-F363 HydrophobicContact CG2-CD2 3.73Å; I359-F363 HydrophobicContact CG2-CE2 3.44Å; I359-F363 VanDerWaalsContact CG2-CE2 3.44Å; I359-F363 VanDerWaalsContact O-CD2 3.28Å; I359-F363 WeakPolarHBondContact O-CD2 3.22Å; I359-F363 PolarHBondContact O-N 3.23Å |
| 360 | Y | 97.5 | Very high | 95.7 | Very high | 9 Ų | 9 | 40.6 Ų | 40.6 | 4% | 0.035 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -58.4 | -46.8 | 175.3 | 166.6 | -101 | 0 | 0 | 0 | 112.2 | L285 C344 H345 A348 G356 F357 G362 F363 F364 Y424 | L285-Y360 HydrophobicContact CD1-CD1 4.07Å; L285-Y360 HydrophobicContact CD1-CE1 3.73Å; C344-Y360 WeakPolarHBondContact O-CE2 3.35Å; H345-Y360 PolarHBondContact CE1-OH 3.37Å; H345-Y360 VanDerWaalsContact CE1-OH 3.29Å; H345-Y360 AromaticContact ND1-CZ 3.89Å; H345-Y360 PolarHBondContact ND1-OH 3.01Å; A348-Y360 HydrophobicContact CB-CD2 3.68Å; A348-Y360 HydrophobicContact CB-CE1 4.39Å; A348-Y360 HydrophobicContact CB-CE2 3.4Å; A348-Y360 HydrophobicContact CB-CG 4.3Å; G356-Y360 PolarHBondContact O-N 3.36Å; F357-Y360 PolarHBondContact O-N 3.46Å; Y360-G362 VanDerWaalsContact C-N 3.25Å; Y360-G362 PolarHBondContact O-N 2.98Å; Y360-F363 PolarHBondContact O-N 3.43Å; Y360-F364 HydrophobicContact CE1-CB 4.4Å; Y360-F364 HydrophobicContact CE1-CD1 4.24Å; Y360-F364 HydrophobicContact CE2-CB 4.24Å; Y360-F364 WeakPolarHBondContact O-CB 3.26Å; Y360-F364 PolarHBondContact O-N 3.26Å; Y360-Y424 HydrophobicContact CE1-CE1 4.14Å; Y360-Y424 AromaticContact CZ-CE1 3.89Å; Y360-Y424 WeakPolarHBondContact OH-CE1 3.39Å |
| 361 | A | 97.1 | Very high | 95.8 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.8 | -35.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | L302 I305 L306 F357 C358 I359 G365 | L302-A361 HydrophobicContact CB-CB 4.49Å; L302-A361 HydrophobicContact CD2-CB 4.45Å; I305-A361 HydrophobicContact CB-CB 4.39Å; I305-A361 HydrophobicContact CG2-CB 4.2Å; L306-A361 HydrophobicContact CB-CB 4.43Å; F357-A361 VanDerWaalsContact O-CB 3.26Å; F357-A361 WeakPolarHBondContact O-CB 3.41Å; F357-A361 PolarHBondContact O-N 3.19Å; C358-A361 PolarHBondContact O-N 3.33Å; I359-A361 PolarHBondContact O-N 3.45Å; A361-G365 PolarHBondContact O-N 2.96Å |
| 362 | G | 97.8 | Very high | 95.8 | Very high | 17 Ų | 17 | 35 Ų | 35 | 18% | 0.175 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.2 | -51.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | V309 C358 I359 Y360 F364 G365 F366 | V309-G362 WeakPolarHBondContact CG1-O 3.41Å; C358-G362 PolarHBondContact O-N 2.85Å; I359-G362 PolarHBondContact O-N 2.83Å; Y360-G362 VanDerWaalsContact C-N 3.25Å; Y360-G362 PolarHBondContact O-N 2.98Å; G362-F364 VanDerWaalsContact C-N 3.35Å; G362-F364 PolarHBondContact O-N 2.88Å; G362-G365 PolarHBondContact O-N 3.49Å; G362-F366 PolarHBondContact O-N 3.31Å |
| 363 | F | 97.9 | Very high | 95.8 | Very high | 111 Ų | 111 | 31.7 Ų | 31.7 | 49% | 0.487 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -62.1 | -42.1 | 177.3 | -74.5 | -57.5 | 0 | 0 | 0 | 112.6 | Y340 I359 Y360 F366 A367 | Y340-F363 WeakPolarHBondContact OH-CD1 3.44Å; I359-F363 HydrophobicContact CG2-CD2 3.73Å; I359-F363 HydrophobicContact CG2-CE2 3.44Å; I359-F363 VanDerWaalsContact CG2-CE2 3.44Å; I359-F363 VanDerWaalsContact O-CD2 3.28Å; I359-F363 WeakPolarHBondContact O-CD2 3.22Å; I359-F363 PolarHBondContact O-N 3.23Å; Y360-F363 PolarHBondContact O-N 3.43Å; F363-F366 PolarHBondContact O-N 3.36Å; F363-A367 WeakPolarHBondContact O-CB 3.28Å; F363-A367 PolarHBondContact O-N 3.1Å |
| 364 | F | 97.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.9 | -43 | 176.3 | -179.7 | -151.4 | 0 | 0 | 0 | 111.7 | P281 L282 L306 H345 Y360 G362 F366 A367 F368 | P281-F364 HydrophobicContact CB-CE1 4.45Å; P281-F364 HydrophobicContact CB-CZ 4.46Å; L282-F364 HydrophobicContact CB-CE1 4.01Å; L282-F364 HydrophobicContact CB-CZ 3.94Å; L282-F364 HydrophobicContact CG-CE1 4.45Å; L306-F364 HydrophobicContact CD1-CD1 3.25Å; L306-F364 HydrophobicContact CD1-CE1 3.49Å; L306-F364 VanDerWaalsContact CD1-CE1 3.49Å; L306-F364 HydrophobicContact CD1-CG 4.05Å; L306-F364 HydrophobicContact CD1-CZ 4.44Å; L306-F364 HydrophobicContact CG-CD1 4.33Å; H345-F364 AromaticContact CE1-CD2 3.44Å; H345-F364 VanDerWaalsContact CE1-CD2 3.44Å; H345-F364 WeakPolarHBondContact CE1-CD2 3.4Å; H345-F364 AromaticContact CE1-CE2 3.28Å; H345-F364 WeakPolarHBondContact CE1-CE2 3.43Å; H345-F364 AromaticContact CE1-CG 3.93Å; H345-F364 AromaticContact CE1-CZ 3.61Å; H345-F364 AromaticContact NE2-CE2 3.66Å; Y360-F364 HydrophobicContact CE1-CB 4.4Å; Y360-F364 HydrophobicContact CE1-CD1 4.24Å; Y360-F364 HydrophobicContact CE2-CB 4.24Å; Y360-F364 WeakPolarHBondContact O-CB 3.26Å; Y360-F364 PolarHBondContact O-N 3.26Å; G362-F364 VanDerWaalsContact C-N 3.35Å; G362-F364 PolarHBondContact O-N 2.88Å; F364-F366 VanDerWaalsContact C-N 3.34Å; F364-F366 PolarHBondContact O-N 3.29Å; F364-A367 PolarHBondContact O-N 3.24Å; F364-F368 HydrophobicContact CD2-CB 4.42Å; F364-F368 HydrophobicContact CE2-CB 4.25Å; F364-F368 HydrophobicContact CE2-CD2 4.17Å; F364-F368 HydrophobicContact CZ-CD2 4.5Å; F364-F368 WeakPolarHBondContact O-CB 3.28Å; F364-F368 PolarHBondContact O-N 2.94Å |
| 365 | G | 96.6 | Very high | 95.5 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.7 | -42.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L306 D310 A361 G362 F368 G369 | L306-G365 WeakPolarHBondContact O-CA 3.32Å; D310-G365 WeakPolarHBondContact CA-O 3.34Å; A361-G365 PolarHBondContact O-N 2.96Å; G362-G365 PolarHBondContact O-N 3.49Å; G365-F368 PolarHBondContact O-N 3.46Å; G365-G369 PolarHBondContact O-N 3.02Å |
| 366 | F | 97.6 | Very high | 95 | Very high | 63 Ų | 63 | 25.1 Ų | 25.1 | 28% | 0.276 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -63 | -49.6 | 174.9 | 178.9 | -97.4 | 0 | 0 | 0 | 111.7 | V309 A313 M317 Y340 G362 F363 F364 F368 G369 W370 | V309-F366 HydrophobicContact CG1-CB 3.86Å; A313-F366 HydrophobicContact CB-CB 4.46Å; A313-F366 HydrophobicContact CB-CD2 3.68Å; A313-F366 HydrophobicContact CB-CE2 4.29Å; A313-F366 HydrophobicContact CB-CG 4.35Å; M317-F366 HydrophobicContact CE-CE2 4.14Å; M317-F366 HydrophobicContact CE-CZ 4.08Å; M317-F366 HydrophobicContact CG-CE2 4.31Å; M317-F366 HydrophobicContact CG-CZ 4.27Å; M317-F366 HydrophobicContact SD-CE2 4.3Å; M317-F366 HydrophobicContact SD-CZ 3.85Å; Y340-F366 AromaticContact CE1-CD1 3.83Å; Y340-F366 HydrophobicContact CE1-CD1 3.83Å; Y340-F366 HydrophobicContact CE1-CE1 4.37Å; G362-F366 PolarHBondContact O-N 3.31Å; F363-F366 PolarHBondContact O-N 3.36Å; F364-F366 VanDerWaalsContact C-N 3.34Å; F364-F366 PolarHBondContact O-N 3.29Å; F366-F368 VanDerWaalsContact C-N 3.31Å; F366-F368 PolarHBondContact O-N 2.92Å; F366-G369 PolarHBondContact O-N 3.02Å; F366-W370 AromaticContact CE1-CE3 3.86Å; F366-W370 HydrophobicContact CE1-CE3 3.86Å; F366-W370 HydrophobicContact CE1-CZ3 4.38Å; F366-W370 HydrophobicContact CZ-CE3 4.49Å; F366-W370 WeakPolarHBondContact O-CB 3.19Å; F366-W370 PolarHBondContact O-N 3.49Å |
| 367 | A | 97.2 | Very high | 94.5 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.5 | -41.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y340 N341 F363 F364 L371 | Y340-A367 HydrophobicContact CD1-CB 3.48Å; Y340-A367 VanDerWaalsContact CD1-CB 3.48Å; Y340-A367 HydrophobicContact CE1-CB 3.65Å; N341-A367 HydrophobicContact CB-CB 4.01Å; N341-A367 VanDerWaalsContact ND2-C 3.26Å; N341-A367 WeakPolarHBondContact ND2-CB 3.38Å; N341-A367 PolarHBondContact ND2-O 3.21Å; F363-A367 WeakPolarHBondContact O-CB 3.28Å; F363-A367 PolarHBondContact O-N 3.1Å; F364-A367 PolarHBondContact O-N 3.24Å; A367-L371 WeakPolarHBondContact O-CB 3.31Å; A367-L371 PolarHBondContact O-N 3.23Å |
| 368 | F | 94.6 | Very high | 94.2 | Very high | 8 Ų | 8 | 26 Ų | 26 | 4% | 0.035 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -70.3 | -40.4 | -179.5 | -169.3 | -93.4 | 0 | 0 | 0 | 111.7 | L278 F279 L282 N341 F364 G365 F366 S372 | L278-F368 HydrophobicContact CD1-CD2 4.24Å; L278-F368 HydrophobicContact CD1-CE2 4.3Å; L278-F368 HydrophobicContact CD2-CE2 4.45Å; L278-F368 HydrophobicContact CG-CE2 4.25Å; F279-F368 HydrophobicContact CE1-CZ 4.33Å; L282-F368 HydrophobicContact CD1-CE2 4.21Å; L282-F368 HydrophobicContact CD1-CZ 4.25Å; N341-F368 PolarHBondContact ND2-N 3.28Å; F364-F368 HydrophobicContact CD2-CB 4.42Å; F364-F368 HydrophobicContact CE2-CB 4.25Å; F364-F368 HydrophobicContact CE2-CD2 4.17Å; F364-F368 HydrophobicContact CZ-CD2 4.5Å; F364-F368 WeakPolarHBondContact O-CB 3.28Å; F364-F368 PolarHBondContact O-N 2.94Å; G365-F368 PolarHBondContact O-N 3.46Å; F366-F368 VanDerWaalsContact C-N 3.31Å; F366-F368 PolarHBondContact O-N 2.92Å; F368-S372 VanDerWaalsContact O-CB 3.25Å; F368-S372 WeakPolarHBondContact O-CB 3.46Å; F368-S372 PolarHBondContact O-N 3.06Å; F368-S372 PolarHBondContact O-OG 3.49Å |
| 369 | G | 93.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -67.3 | -39.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | D310 G365 F366 S373 | D310-G369 WeakPolarHBondContact OD1-CA 3.48Å; G365-G369 PolarHBondContact O-N 3.02Å; F366-G369 PolarHBondContact O-N 3.02Å; G369-S373 WeakPolarHBondContact O-CB 3.49Å; G369-S373 PolarHBondContact O-N 3.36Å; G369-S373 PolarHBondContact O-OG 3.07Å |
| 370 | W | 96.3 | Very high | 93.2 | Very high | 28 Ų | 28 | 22.7 Ų | 22.7 | 11% | 0.106 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -57.7 | -57.5 | 171.3 | -174.9 | -0.6 | 0 | 0 | 0 | 110.8 | M317 F333 I336 Y340 F366 S372 S373 V374 | M317-W370 HydrophobicContact CB-CB 4.21Å; M317-W370 HydrophobicContact CB-CG 4.11Å; M317-W370 HydrophobicContact CG-CB 3.79Å; M317-W370 HydrophobicContact CG-CD2 4.43Å; M317-W370 HydrophobicContact CG-CG 3.8Å; M317-W370 HydrophobicContact SD-CD2 4.26Å; M317-W370 HydrophobicContact SD-CG 4.21Å; F333-W370 AromaticContact CD1-NE1 3.45Å; F333-W370 AromaticContact CD2-CZ2 3.57Å; F333-W370 HydrophobicContact CD2-CZ2 3.57Å; F333-W370 AromaticContact CD2-NE1 3.95Å; F333-W370 AromaticContact CE1-CD1 3.71Å; F333-W370 AromaticContact CE1-CE2 3.91Å; F333-W370 HydrophobicContact CE1-CZ2 4.38Å; F333-W370 AromaticContact CE1-NE1 2.99Å; F333-W370 AromaticContact CE2-CE2 3.59Å; F333-W370 HydrophobicContact CE2-CH2 4.29Å; F333-W370 AromaticContact CE2-CZ2 3.27Å; F333-W370 HydrophobicContact CE2-CZ2 3.27Å; F333-W370 AromaticContact CE2-NE1 3.55Å; F333-W370 HydrophobicContact CG-CZ2 4.24Å; F333-W370 AromaticContact CG-NE1 3.9Å; F333-W370 AromaticContact CZ-CD1 3.9Å; F333-W370 AromaticContact CZ-CE2 3.49Å; F333-W370 VanDerWaalsContact CZ-CE2 3.49Å; F333-W370 AromaticContact CZ-CZ2 3.72Å; F333-W370 HydrophobicContact CZ-CZ2 3.72Å; F333-W370 AromaticContact CZ-NE1 3.04Å; I336-W370 HydrophobicContact CG2-CH2 3.69Å; I336-W370 HydrophobicContact CG2-CZ2 4.17Å; Y340-W370 HydrophobicContact CD1-CE3 4.43Å; Y340-W370 HydrophobicContact CG-CZ3 4.41Å; F366-W370 AromaticContact CE1-CE3 3.86Å; F366-W370 HydrophobicContact CE1-CE3 3.86Å; F366-W370 HydrophobicContact CE1-CZ3 4.38Å; F366-W370 HydrophobicContact CZ-CE3 4.49Å; F366-W370 WeakPolarHBondContact O-CB 3.19Å; F366-W370 PolarHBondContact O-N 3.49Å; W370-S372 VanDerWaalsContact C-N 3.34Å; W370-S372 PolarHBondContact O-N 3.46Å; W370-S373 PolarHBondContact O-N 3.13Å; W370-S373 PolarHBondContact O-OG 3.21Å; W370-V374 WeakPolarHBondContact O-CG2 3.36Å; W370-V374 PolarHBondContact O-N 2.84Å |
| 371 | L | 95.1 | Very high | 92.7 | Very high | 2 Ų | 2 | 25.2 Ų | 25.2 | 1% | 0.01 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -54.7 | -49.4 | 179.4 | -176.9 | 159.8 | 0 | 0 | 0 | 111.6 | M274 L278 F334 V338 A367 S373 V374 L375 | M274-L371 HydrophobicContact CE-CD2 4.47Å; M274-L371 HydrophobicContact SD-CD1 3.8Å; M274-L371 HydrophobicContact SD-CG 4.4Å; L278-L371 HydrophobicContact CD1-CD1 3.77Å; L278-L371 HydrophobicContact CD2-CD1 4.35Å; L278-L371 HydrophobicContact CD2-CD2 4.08Å; F334-L371 HydrophobicContact CE2-CG 4.21Å; V338-L371 HydrophobicContact CG2-CD1 4.08Å; A367-L371 WeakPolarHBondContact O-CB 3.31Å; A367-L371 PolarHBondContact O-N 3.23Å; L371-S373 VanDerWaalsContact C-N 3.29Å; L371-S373 PolarHBondContact O-N 3.06Å; L371-V374 PolarHBondContact O-N 3.23Å; L371-L375 WeakPolarHBondContact O-CB 3.41Å; L371-L375 PolarHBondContact O-N 2.94Å |
| 372 | S | 90.1 | Very high | 92.2 | Very high | 28 Ų | 28 | 25.9 Ų | 25.9 | 20% | 0.196 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.8 | -34 | -177.9 | -60.8 | 0 | 0 | 0 | 0 | 113 | F368 W370 | F368-S372 VanDerWaalsContact O-CB 3.25Å; F368-S372 WeakPolarHBondContact O-CB 3.46Å; F368-S372 PolarHBondContact O-N 3.06Å; F368-S372 PolarHBondContact O-OG 3.49Å; W370-S372 VanDerWaalsContact C-N 3.34Å; W370-S372 PolarHBondContact O-N 3.46Å |
| 373 | S | 89 | Confident | 91.6 | Very high | 24 Ų | 24 | 26 Ų | 26 | 17% | 0.168 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -70.4 | -36.8 | 177.8 | 68.9 | 0 | 0 | 0 | 0 | 112.8 | R314 G369 W370 L371 | R314-S373 WeakPolarHBondContact O-CB 3.25Å; G369-S373 WeakPolarHBondContact O-CB 3.49Å; G369-S373 PolarHBondContact O-N 3.36Å; G369-S373 PolarHBondContact O-OG 3.07Å; W370-S373 PolarHBondContact O-N 3.13Å; W370-S373 PolarHBondContact O-OG 3.21Å; L371-S373 VanDerWaalsContact C-N 3.29Å; L371-S373 PolarHBondContact O-N 3.06Å |
| 374 | V | 92.2 | Very high | 90.6 | Very high | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -93.7 | -20.5 | -172.2 | -173.3 | 0 | 0 | 0 | 0 | 112.3 | A321 V330 F333 F334 W370 L371 F376 E377 T378 | A321-V374 HydrophobicContact CB-CG2 4.25Å; V330-V374 HydrophobicContact CG2-CG1 3.83Å; F333-V374 HydrophobicContact CD1-CG1 4.14Å; F333-V374 HydrophobicContact CD1-CG2 3.62Å; F333-V374 HydrophobicContact CE1-CG2 3.6Å; F334-V374 HydrophobicContact CB-CG1 3.76Å; F334-V374 HydrophobicContact CD2-CB 4.32Å; F334-V374 HydrophobicContact CD2-CG1 4.28Å; F334-V374 HydrophobicContact CG-CG1 4.46Å; W370-V374 WeakPolarHBondContact O-CG2 3.36Å; W370-V374 PolarHBondContact O-N 2.84Å; L371-V374 PolarHBondContact O-N 3.23Å; V374-F376 PolarHBondContact O-N 3.11Å; V374-E377 PolarHBondContact O-N 3.04Å; V374-T378 WeakPolarHBondContact CG1-OG1 3.43Å; V374-T378 WeakPolarHBondContact O-CB 3.41Å; V374-T378 PolarHBondContact O-N 3.02Å; V374-T378 PolarHBondContact O-OG1 3.22Å |
| 375 | L | 92.1 | Very high | 89.4 | Confident | 14 Ų | 14 | 25.9 Ų | 25.9 | 7% | 0.073 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -50.4 | -57.3 | -178 | -177 | 71.4 | 0 | 0 | 0 | 112.5 | Y267 M274 F275 F334 L371 L379 | Y267-L375 WeakPolarHBondContact OH-CD1 3.29Å; Y267-L375 WeakPolarHBondContact OH-CG 3.43Å; Y267-L375 PolarHBondContact OH-O 3.46Å; M274-L375 HydrophobicContact CE-CD1 4.25Å; F275-L375 HydrophobicContact CZ-CD2 4.24Å; F334-L375 HydrophobicContact CE2-CB 4.23Å; F334-L375 HydrophobicContact CE2-CD1 3.72Å; F334-L375 HydrophobicContact CZ-CD1 3.57Å; L371-L375 WeakPolarHBondContact O-CB 3.41Å; L371-L375 PolarHBondContact O-N 2.94Å; L375-L379 PolarHBondContact O-N 3.09Å |
| 376 | F | 85.6 | Confident | 88.3 | Confident | 73 Ų | 73 | 34.8 Ų | 34.8 | 32% | 0.32 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -77.3 | -28.3 | -178.8 | -67.8 | -60.1 | 0 | 0 | 0 | 113.1 | V374 T378 L379 M380 F388 V392 | V374-F376 PolarHBondContact O-N 3.11Å; F376-T378 VanDerWaalsContact C-N 3.33Å; F376-L379 PolarHBondContact O-N 3.05Å; F376-M380 WeakPolarHBondContact O-CB 3.46Å; F376-M380 PolarHBondContact O-N 3.42Å; F376-F388 HydrophobicContact CB-CE2 4.48Å; F376-F388 HydrophobicContact CB-CZ 4.13Å; F376-F388 HydrophobicContact CD1-CZ 4.3Å; F376-F388 WeakPolarHBondContact O-CE2 3.41Å; F376-V392 HydrophobicContact CD1-CG2 4.18Å; F376-V392 HydrophobicContact CE1-CG1 4.24Å; F376-V392 HydrophobicContact CE1-CG2 4.3Å |
| 377 | E | 86.1 | Confident | 87.3 | Confident | 36 Ų | 36 | 37.4 Ų | 37.4 | 17% | 0.168 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -65.3 | -42.1 | 176.5 | -166.9 | 59.3 | -132.7 | 0 | 0 | 110.8 | R327 V330 V374 M380 D381 | R327-E377 IonicContact CZ-OE1 3.06Å; R327-E377 IonicContact NH1-OE1 2.6Å; R327-E377 PolarHBondContact NH1-OE1 3.39Å; R327-E377 IonicContact NH2-OE1 2.76Å; R327-E377 PolarHBondContact NH2-OE1 3.15Å; V330-E377 HydrophobicContact CG2-CG 4.43Å; V374-E377 PolarHBondContact O-N 3.04Å; E377-M380 VanDerWaalsContact CD-CE 3.48Å; E377-M380 PolarHBondContact O-N 3.45Å; E377-M380 WeakPolarHBondContact OE1-CE 3.39Å; E377-M380 WeakPolarHBondContact OE2-CE 3.41Å; E377-D381 WeakPolarHBondContact O-CB 3.43Å; E377-D381 PolarHBondContact O-N 2.84Å |
| 378 | T | 90.6 | Very high | 86.2 | Confident | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -66.5 | -42.3 | 176.5 | -65.5 | 0 | 0 | 0 | 0 | 110.8 | Y267 Q331 F334 V374 F376 M380 D381 L382 | Y267-T378 HydrophobicContact CD2-CG2 3.99Å; Y267-T378 HydrophobicContact CE2-CG2 3.89Å; Q331-T378 HydrophobicContact CB-CG2 4.4Å; Q331-T378 HydrophobicContact CG-CG2 3.85Å; F334-T378 HydrophobicContact CB-CG2 4.44Å; F334-T378 HydrophobicContact CD1-CG2 4.37Å; V374-T378 WeakPolarHBondContact CG1-OG1 3.43Å; V374-T378 WeakPolarHBondContact O-CB 3.41Å; V374-T378 PolarHBondContact O-N 3.02Å; V374-T378 PolarHBondContact O-OG1 3.22Å; F376-T378 VanDerWaalsContact C-N 3.33Å; T378-M380 VanDerWaalsContact C-N 3.32Å; T378-M380 PolarHBondContact O-N 2.83Å; T378-D381 WeakPolarHBondContact O-CB 3.37Å; T378-D381 PolarHBondContact O-N 3.28Å; T378-L382 HydrophobicContact CG2-CD1 3.74Å; T378-L382 WeakPolarHBondContact O-CB 3.42Å; T378-L382 WeakPolarHBondContact O-CD1 3.35Å; T378-L382 WeakPolarHBondContact O-CG 3.31Å; T378-L382 PolarHBondContact O-N 3.44Å |
| 379 | L | 88.8 | Confident | 85.1 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59.9 | -43.8 | 174.1 | -178.6 | 60.4 | 0 | 0 | 0 | 111.6 | F264 Y267 L375 F376 L382 V383 F388 A391 V392 V395 | F264-L379 HydrophobicContact CD2-CD1 3.98Å; F264-L379 HydrophobicContact CE2-CD1 4.05Å; Y267-L379 HydrophobicContact CD1-CD1 3.99Å; Y267-L379 HydrophobicContact CE1-CB 4.2Å; Y267-L379 HydrophobicContact CE1-CD1 3.84Å; Y267-L379 HydrophobicContact CE1-CG 4.41Å; Y267-L379 HydrophobicContact CE2-CB 4.48Å; L375-L379 PolarHBondContact O-N 3.09Å; F376-L379 PolarHBondContact O-N 3.05Å; L379-L382 PolarHBondContact O-N 3.47Å; L379-V383 HydrophobicContact CD1-CG1 4.01Å; L379-V383 VanDerWaalsContact O-CG2 3.25Å; L379-V383 WeakPolarHBondContact O-CG2 3.36Å; L379-V383 PolarHBondContact O-N 2.92Å; L379-F388 HydrophobicContact CB-CE2 4.25Å; L379-F388 HydrophobicContact CD2-CE2 4.14Å; L379-F388 HydrophobicContact CG-CD2 4.32Å; L379-F388 HydrophobicContact CG-CE2 4.16Å; L379-A391 HydrophobicContact CD1-CB 4.15Å; L379-A391 HydrophobicContact CD2-CB 4.4Å; L379-A391 HydrophobicContact CG-CB 4.44Å; L379-V392 HydrophobicContact CD2-CG2 3.67Å; L379-V395 HydrophobicContact CD1-CG2 4.35Å; L379-V395 HydrophobicContact CD2-CG2 4.29Å |
| 380 | M | 83.9 | Confident | 84.4 | Confident | 63 Ų | 63 | 45.9 Ų | 45.9 | 31% | 0.31 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.7 | -38.1 | 178.3 | -174.8 | 170.9 | 54.3 | 0 | 0 | 112.6 | F376 E377 T378 L382 G384 F388 | F376-M380 WeakPolarHBondContact O-CB 3.46Å; F376-M380 PolarHBondContact O-N 3.42Å; E377-M380 VanDerWaalsContact CD-CE 3.48Å; E377-M380 PolarHBondContact O-N 3.45Å; E377-M380 WeakPolarHBondContact OE1-CE 3.39Å; E377-M380 WeakPolarHBondContact OE2-CE 3.41Å; T378-M380 VanDerWaalsContact C-N 3.32Å; T378-M380 PolarHBondContact O-N 2.83Å; M380-L382 VanDerWaalsContact C-N 3.35Å; M380-G384 VanDerWaalsContact O-CA 3.23Å; M380-G384 WeakPolarHBondContact O-CA 3.42Å; M380-G384 PolarHBondContact O-N 2.82Å; M380-F388 HydrophobicContact CB-CD2 3.7Å; M380-F388 HydrophobicContact CB-CE2 3.77Å; M380-F388 HydrophobicContact CG-CD2 4.2Å |
| 381 | D | 86.9 | Confident | 83.8 | Confident | 62 Ų | 62 | 44.5 Ų | 44.5 | 33% | 0.332 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -62.8 | -40.6 | 173 | -175 | 73.3 | 0 | 0 | 0 | 112 | V330 Q331 E377 T378 | V330-D381 HydrophobicContact CG1-CB 4Å; Q331-D381 PolarHBondContact NE2-OD2 2.82Å; E377-D381 WeakPolarHBondContact O-CB 3.43Å; E377-D381 PolarHBondContact O-N 2.84Å; T378-D381 WeakPolarHBondContact O-CB 3.37Å; T378-D381 PolarHBondContact O-N 3.28Å |
| 382 | L | 86.4 | Confident | 83.3 | Confident | 14 Ų | 14 | 46 Ų | 46 | 7% | 0.073 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -72.6 | -41.8 | -178.5 | -80.9 | 153.9 | 0 | 0 | 0 | 114.2 | H261 Y267 Q331 T378 L379 M380 M442 | H261-L382 PolarHBondContact CE1-O 3.49Å; Y267-L382 HydrophobicContact CD2-CD1 3.68Å; Y267-L382 HydrophobicContact CG-CD1 3.95Å; Q331-L382 HydrophobicContact CG-CG 4.48Å; T378-L382 HydrophobicContact CG2-CD1 3.74Å; T378-L382 WeakPolarHBondContact O-CB 3.42Å; T378-L382 WeakPolarHBondContact O-CD1 3.35Å; T378-L382 WeakPolarHBondContact O-CG 3.31Å; T378-L382 PolarHBondContact O-N 3.44Å; L379-L382 PolarHBondContact O-N 3.47Å; M380-L382 VanDerWaalsContact C-N 3.35Å; L382-M442 HydrophobicContact CD1-CE 4.3Å; L382-M442 HydrophobicContact CD1-SD 4.35Å; L382-M442 HydrophobicContact CD2-SD 4.28Å |
| 383 | V | 85.3 | Confident | 82.9 | Confident | 20 Ų | 20 | 45.5 Ų | 45.5 | 12% | 0.121 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -107.6 | -12.3 | -171.8 | -53 | 0 | 0 | 0 | 0 | 113.8 | L258 F264 L379 F388 A391 | L258-V383 HydrophobicContact CD2-CB 4.27Å; L258-V383 HydrophobicContact CD2-CG1 4.05Å; F264-V383 HydrophobicContact CB-CG1 4.25Å; F264-V383 HydrophobicContact CD2-CG1 3.75Å; F264-V383 HydrophobicContact CG-CG1 4.38Å; L379-V383 HydrophobicContact CD1-CG1 4.01Å; L379-V383 VanDerWaalsContact O-CG2 3.25Å; L379-V383 WeakPolarHBondContact O-CG2 3.36Å; L379-V383 PolarHBondContact O-N 2.92Å; V383-F388 HydrophobicContact CG2-CB 4.42Å; V383-F388 HydrophobicContact CG2-CD2 4.49Å; V383-A391 HydrophobicContact CB-CB 4.34Å; V383-A391 HydrophobicContact CG1-CB 4.1Å; V383-A391 HydrophobicContact CG2-CB 3.82Å |
| 384 | G | 78.2 | Confident | 82.7 | Confident | 30 Ų | 30 | 44.8 Ų | 44.8 | 31% | 0.309 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | 74.8 | 164.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | M380 Q386 R387 F388 | M380-G384 VanDerWaalsContact O-CA 3.23Å; M380-G384 WeakPolarHBondContact O-CA 3.42Å; M380-G384 PolarHBondContact O-N 2.82Å; G384-Q386 VanDerWaalsContact C-N 3.33Å; G384-Q386 PolarHBondContact O-N 3.46Å; G384-R387 PolarHBondContact O-N 2.92Å; G384-F388 PolarHBondContact O-N 3.12Å |
| 385 | A | 72.2 | Confident | 82.5 | Confident | 79 Ų | 79 | 44.9 Ų | 44.9 | 65% | 0.653 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -63.4 | -33.1 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 386 | Q | 71.7 | Confident | 82.2 | Confident | 186 Ų | 186 | 45.5 Ų | 45.5 | 87% | 0.869 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -69.4 | -39 | -175.7 | -65.3 | -63.4 | -22.9 | 0 | 0 | 112.6 | G384 | G384-Q386 VanDerWaalsContact C-N 3.33Å; G384-Q386 PolarHBondContact O-N 3.46Å |
| 387 | R | 76.8 | Confident | 82.3 | Confident | 119 Ų | 119 | 44.9 Ų | 44.9 | 45% | 0.449 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -97.4 | -2.9 | -177.9 | -62 | -172.3 | -178.6 | -172.2 | 0.6 | 113.5 | L258 G384 S389 S390 A391 | L258-R387 HydrophobicContact CD2-CB 4.32Å; G384-R387 PolarHBondContact O-N 2.92Å; R387-S389 PolarHBondContact O-N 3.26Å; R387-S390 PolarHBondContact O-N 2.95Å; R387-A391 WeakPolarHBondContact O-CB 3.44Å; R387-A391 PolarHBondContact O-N 3.34Å |
| 388 | F | 74.8 | Confident | 82.4 | Confident | 56 Ų | 56 | 45.4 Ų | 45.4 | 25% | 0.246 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -55.4 | -45.5 | -175.9 | -178.5 | -105.1 | 0 | 0 | 0 | 113.6 | F376 L379 M380 V383 G384 S390 A391 V392 | F376-F388 HydrophobicContact CB-CE2 4.48Å; F376-F388 HydrophobicContact CB-CZ 4.13Å; F376-F388 HydrophobicContact CD1-CZ 4.3Å; F376-F388 WeakPolarHBondContact O-CE2 3.41Å; L379-F388 HydrophobicContact CB-CE2 4.25Å; L379-F388 HydrophobicContact CD2-CE2 4.14Å; L379-F388 HydrophobicContact CG-CD2 4.32Å; L379-F388 HydrophobicContact CG-CE2 4.16Å; M380-F388 HydrophobicContact CB-CD2 3.7Å; M380-F388 HydrophobicContact CB-CE2 3.77Å; M380-F388 HydrophobicContact CG-CD2 4.2Å; V383-F388 HydrophobicContact CG2-CB 4.42Å; V383-F388 HydrophobicContact CG2-CD2 4.49Å; G384-F388 PolarHBondContact O-N 3.12Å; F388-S390 VanDerWaalsContact C-N 3.34Å; F388-S390 PolarHBondContact O-N 3.17Å; F388-A391 PolarHBondContact O-N 3.12Å; F388-V392 HydrophobicContact CD1-CG2 4.18Å; F388-V392 HydrophobicContact CD2-CG2 4.22Å; F388-V392 HydrophobicContact CE1-CG2 3.75Å; F388-V392 HydrophobicContact CE2-CG2 3.8Å; F388-V392 HydrophobicContact CG-CG2 4.41Å; F388-V392 HydrophobicContact CZ-CG2 3.54Å; F388-V392 WeakPolarHBondContact O-CG2 3.36Å; F388-V392 PolarHBondContact O-N 3.37Å |
| 389 | S | 72.1 | Confident | 82.4 | Confident | 98 Ų | 98 | 45.7 Ų | 45.7 | 69% | 0.685 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -63.4 | -39.3 | -178.1 | -170.7 | 0 | 0 | 0 | 0 | 112.7 | R387 G393 | R387-S389 PolarHBondContact O-N 3.26Å; S389-G393 PolarHBondContact O-N 3.5Å |
| 390 | S | 79.1 | Confident | 82.4 | Confident | 31 Ų | 31 | 46.3 Ų | 46.3 | 22% | 0.217 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -70.3 | -41.3 | 176.7 | -54.4 | 0 | 0 | 0 | 0 | 110.9 | R387 F388 G393 L394 | R387-S390 PolarHBondContact O-N 2.95Å; F388-S390 VanDerWaalsContact C-N 3.34Å; F388-S390 PolarHBondContact O-N 3.17Å; S390-G393 PolarHBondContact O-N 3.45Å; S390-L394 PolarHBondContact O-N 3.32Å |
| 391 | A | 83.7 | Confident | 82.9 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.9 | -44.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L258 F264 L379 V383 R387 F388 G393 L394 V395 | L258-A391 HydrophobicContact CD1-CB 3.92Å; L258-A391 HydrophobicContact CD2-CB 4.43Å; F264-A391 HydrophobicContact CD2-CB 4.38Å; F264-A391 HydrophobicContact CE2-CB 3.87Å; L379-A391 HydrophobicContact CD1-CB 4.15Å; L379-A391 HydrophobicContact CD2-CB 4.4Å; L379-A391 HydrophobicContact CG-CB 4.44Å; V383-A391 HydrophobicContact CB-CB 4.34Å; V383-A391 HydrophobicContact CG1-CB 4.1Å; V383-A391 HydrophobicContact CG2-CB 3.82Å; R387-A391 WeakPolarHBondContact O-CB 3.44Å; R387-A391 PolarHBondContact O-N 3.34Å; F388-A391 PolarHBondContact O-N 3.12Å; A391-G393 VanDerWaalsContact C-N 3.3Å; A391-G393 PolarHBondContact O-N 3.4Å; A391-L394 PolarHBondContact O-N 3.27Å; A391-V395 WeakPolarHBondContact O-CB 3.32Å; A391-V395 WeakPolarHBondContact O-CG2 3.43Å; A391-V395 PolarHBondContact O-N 3.44Å |
| 392 | V | 83.1 | Confident | 83.2 | Confident | 34 Ų | 34 | 44.2 Ų | 44.2 | 21% | 0.206 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.6 | -42.6 | 174.5 | 171.6 | 0 | 0 | 0 | 0 | 111 | F376 L379 F388 V395 T396 | F376-V392 HydrophobicContact CD1-CG2 4.18Å; F376-V392 HydrophobicContact CE1-CG1 4.24Å; F376-V392 HydrophobicContact CE1-CG2 4.3Å; L379-V392 HydrophobicContact CD2-CG2 3.67Å; F388-V392 HydrophobicContact CD1-CG2 4.18Å; F388-V392 HydrophobicContact CD2-CG2 4.22Å; F388-V392 HydrophobicContact CE1-CG2 3.75Å; F388-V392 HydrophobicContact CE2-CG2 3.8Å; F388-V392 HydrophobicContact CG-CG2 4.41Å; F388-V392 HydrophobicContact CZ-CG2 3.54Å; F388-V392 WeakPolarHBondContact O-CG2 3.36Å; F388-V392 PolarHBondContact O-N 3.37Å; V392-V395 PolarHBondContact O-N 3.47Å; V392-T396 HydrophobicContact CG1-CG2 4.25Å; V392-T396 WeakPolarHBondContact O-CB 3.32Å; V392-T396 VanDerWaalsContact O-CG2 3.27Å; V392-T396 WeakPolarHBondContact O-CG2 3.21Å; V392-T396 PolarHBondContact O-N 2.8Å; V392-T396 PolarHBondContact O-OG1 2.78Å |
| 393 | G | 81.8 | Confident | 83.5 | Confident | 17 Ų | 17 | 43.6 Ų | 43.6 | 18% | 0.175 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | S389 S390 A391 T396 I397 | S389-G393 PolarHBondContact O-N 3.5Å; S390-G393 PolarHBondContact O-N 3.45Å; A391-G393 VanDerWaalsContact C-N 3.3Å; A391-G393 PolarHBondContact O-N 3.4Å; G393-T396 PolarHBondContact O-OG1 3.42Å; G393-I397 WeakPolarHBondContact O-CD1 3.48Å; G393-I397 VanDerWaalsContact O-CG1 3.24Å; G393-I397 WeakPolarHBondContact O-CG1 3.46Å; G393-I397 PolarHBondContact O-N 3.31Å |
| 394 | L | 85.4 | Confident | 84 | Confident | 8 Ų | 8 | 45.1 Ų | 45.1 | 4% | 0.042 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.3 | -48.1 | 176 | -79.2 | 178 | 0 | 0 | 0 | 112.6 | L254 L256 L258 F259 F264 S390 A391 T396 I397 V398 | L254-L394 HydrophobicContact CB-CD2 3.86Å; L254-L394 HydrophobicContact CB-CG 4.31Å; L254-L394 HydrophobicContact CD1-CD2 4.27Å; L254-L394 HydrophobicContact CD2-CD2 4.23Å; L254-L394 HydrophobicContact CD2-CG 4.39Å; L254-L394 HydrophobicContact CG-CD2 4.34Å; L254-L394 WeakPolarHBondContact O-CD1 3.49Å; L254-L394 VanDerWaalsContact O-CG 3.28Å; L254-L394 WeakPolarHBondContact O-CG 3.41Å; L256-L394 HydrophobicContact CD2-CD2 4.14Å; L258-L394 HydrophobicContact CB-CD1 3.89Å; L258-L394 HydrophobicContact CD1-CD1 3.9Å; F259-L394 HydrophobicContact CD2-CD1 4.38Å; F259-L394 HydrophobicContact CE2-CD1 3.93Å; F259-L394 HydrophobicContact CE2-CD2 3.75Å; F259-L394 HydrophobicContact CE2-CG 4.43Å; F259-L394 HydrophobicContact CZ-CD1 4.44Å; F259-L394 HydrophobicContact CZ-CD2 4.14Å; F264-L394 HydrophobicContact CE1-CD1 4.32Å; F264-L394 HydrophobicContact CZ-CB 4.06Å; F264-L394 HydrophobicContact CZ-CD1 4.21Å; S390-L394 PolarHBondContact O-N 3.32Å; A391-L394 PolarHBondContact O-N 3.27Å; L394-T396 PolarHBondContact O-N 3.49Å; L394-I397 PolarHBondContact O-N 2.83Å; L394-V398 WeakPolarHBondContact O-CG2 3.39Å; L394-V398 PolarHBondContact O-N 3.11Å; L394-V398 VanDerWaalsContact O-N 3.11Å |
| 395 | V | 88.2 | Confident | 84.8 | Confident | 2 Ų | 2 | 46.8 Ų | 46.8 | 1% | 0.012 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58 | -50.3 | -179.5 | 167.7 | 0 | 0 | 0 | 0 | 110.2 | F264 Y267 L268 L379 A391 V392 I397 V398 E399 | F264-V395 HydrophobicContact CE2-CG2 3.54Å; F264-V395 HydrophobicContact CZ-CG2 3.83Å; Y267-V395 HydrophobicContact CE1-CG1 4.4Å; Y267-V395 HydrophobicContact CE1-CG2 4.25Å; L268-V395 HydrophobicContact CD1-CB 4.42Å; L268-V395 HydrophobicContact CD1-CG2 4.04Å; L379-V395 HydrophobicContact CD1-CG2 4.35Å; L379-V395 HydrophobicContact CD2-CG2 4.29Å; A391-V395 WeakPolarHBondContact O-CB 3.32Å; A391-V395 WeakPolarHBondContact O-CG2 3.43Å; A391-V395 PolarHBondContact O-N 3.44Å; V392-V395 PolarHBondContact O-N 3.47Å; V395-I397 PolarHBondContact O-N 3.47Å; V395-V398 PolarHBondContact O-N 3.41Å; V395-E399 HydrophobicContact CG1-CG 4.08Å; V395-E399 WeakPolarHBondContact CG1-OE1 3.24Å; V395-E399 WeakPolarHBondContact O-CB 3.25Å; V395-E399 VanDerWaalsContact O-CG 3.23Å; V395-E399 WeakPolarHBondContact O-CG 3.35Å; V395-E399 PolarHBondContact O-N 3.29Å |
| 396 | T | 85.8 | Confident | 85.9 | Confident | 27 Ų | 27 | 43 Ų | 43 | 17% | 0.166 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -62.3 | -38 | -178.6 | 49.5 | 0 | 0 | 0 | 0 | 113.2 | V392 G393 L394 C400 | V392-T396 HydrophobicContact CG1-CG2 4.25Å; V392-T396 WeakPolarHBondContact O-CB 3.32Å; V392-T396 VanDerWaalsContact O-CG2 3.27Å; V392-T396 WeakPolarHBondContact O-CG2 3.21Å; V392-T396 PolarHBondContact O-N 2.8Å; V392-T396 PolarHBondContact O-OG1 2.78Å; G393-T396 PolarHBondContact O-OG1 3.42Å; L394-T396 PolarHBondContact O-N 3.49Å; T396-C400 PolarHBondContact O-N 3.41Å; T396-C400 PolarHBondContact O-SG 3.05Å |
| 397 | I | 86.6 | Confident | 87 | Confident | 61 Ų | 61 | 34.2 Ų | 34.2 | 31% | 0.313 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -63.1 | -47 | 175 | -68.2 | 165.4 | 0 | 0 | 0 | 110.7 | P74 L254 G393 L394 V395 C400 | P74-I397 HydrophobicContact CG-CD1 3.74Å; P74-I397 HydrophobicContact CG-CG1 4.03Å; L254-I397 HydrophobicContact CD1-CD1 3.74Å; L254-I397 HydrophobicContact CD2-CD1 3.86Å; L254-I397 HydrophobicContact CG-CD1 4.49Å; G393-I397 WeakPolarHBondContact O-CD1 3.48Å; G393-I397 VanDerWaalsContact O-CG1 3.24Å; G393-I397 WeakPolarHBondContact O-CG1 3.46Å; G393-I397 PolarHBondContact O-N 3.31Å; L394-I397 PolarHBondContact O-N 2.83Å; V395-I397 PolarHBondContact O-N 3.47Å; I397-C400 VanDerWaalsContact O-CB 3.27Å; I397-C400 WeakPolarHBondContact O-CB 3.49Å; I397-C400 PolarHBondContact O-N 3.49Å |
| 398 | V | 89.8 | Confident | 87.8 | Confident | 47 Ų | 47 | 28.7 Ų | 28.7 | 29% | 0.285 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -69.6 | -36.1 | -178.2 | 175.4 | 0 | 0 | 0 | 0 | 111.2 | L268 V272 L394 V395 C400 C401 P402 | L268-V398 HydrophobicContact CD1-CB 3.98Å; L268-V398 HydrophobicContact CD1-CG1 3.93Å; L268-V398 HydrophobicContact CD1-CG2 4.47Å; L268-V398 HydrophobicContact CD2-CG1 4.44Å; L268-V398 HydrophobicContact CD2-CG2 4.44Å; L268-V398 HydrophobicContact CG-CG1 4.29Å; V272-V398 HydrophobicContact CG2-CG1 3.52Å; L394-V398 WeakPolarHBondContact O-CG2 3.39Å; L394-V398 PolarHBondContact O-N 3.11Å; L394-V398 VanDerWaalsContact O-N 3.11Å; V395-V398 PolarHBondContact O-N 3.41Å; V398-C400 PolarHBondContact O-N 3.28Å; V398-C401 PolarHBondContact O-N 3.33Å; V398-P402 VanDerWaalsContact O-CD 3.32Å; V398-P402 WeakPolarHBondContact O-CD 3.43Å |
| 399 | E | 89.1 | Confident | 88.8 | Confident | 6 Ų | 6 | 30.6 Ų | 30.6 | 3% | 0.028 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.1 | -15.8 | 175.3 | -73.4 | 174.9 | 177.1 | 0 | 0 | 113.4 | N271 F275 V395 C401 P402 V403 | N271-E399 PolarHBondContact ND2-OE1 2.99Å; F275-E399 HydrophobicContact CD2-CB 4.35Å; F275-E399 HydrophobicContact CD2-CG 3.65Å; F275-E399 HydrophobicContact CE2-CG 3.85Å; F275-E399 WeakPolarHBondContact CE2-OE1 3.26Å; F275-E399 HydrophobicContact CG-CG 4.37Å; V395-E399 HydrophobicContact CG1-CG 4.08Å; V395-E399 WeakPolarHBondContact CG1-OE1 3.24Å; V395-E399 WeakPolarHBondContact O-CB 3.25Å; V395-E399 VanDerWaalsContact O-CG 3.23Å; V395-E399 WeakPolarHBondContact O-CG 3.35Å; V395-E399 PolarHBondContact O-N 3.29Å; E399-C401 VanDerWaalsContact C-N 3.3Å; E399-C401 PolarHBondContact O-N 3.49Å; E399-P402 WeakPolarHBondContact O-CD 3.22Å; E399-P402 VanDerWaalsContact O-CG 3.25Å; E399-P402 WeakPolarHBondContact O-CG 3.4Å; E399-V403 WeakPolarHBondContact O-CB 3.45Å; E399-V403 WeakPolarHBondContact O-CG2 3.17Å; E399-V403 PolarHBondContact O-N 3Å |
| 400 | C | 90.6 | Very high | 89.8 | Confident | 13 Ų | 13 | 26.6 Ų | 26.6 | 9% | 0.088 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -60.6 | -39.3 | 176.3 | -68.1 | 0 | 0 | 0 | 0 | 112.5 | Y70 A71 T396 I397 V398 V403 L404 | Y70-C400 WeakPolarHBondContact CB-SG 3.47Å; A71-C400 PolarHBondContact N-SG 3.17Å; T396-C400 PolarHBondContact O-N 3.41Å; T396-C400 PolarHBondContact O-SG 3.05Å; I397-C400 VanDerWaalsContact O-CB 3.27Å; I397-C400 WeakPolarHBondContact O-CB 3.49Å; I397-C400 PolarHBondContact O-N 3.49Å; V398-C400 PolarHBondContact O-N 3.28Å; C400-V403 PolarHBondContact O-N 3.18Å; C400-L404 WeakPolarHBondContact O-CB 3.45Å; C400-L404 PolarHBondContact O-N 2.83Å |
| 401 | C | 92.8 | Very high | 90.4 | Very high | 80 Ų | 80 | 25.1 Ų | 25.1 | 54% | 0.541 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -61 | -55.2 | -178.8 | -64.7 | 0 | 0 | 0 | 0 | 112.9 | V398 E399 V403 L404 L405 | V398-C401 PolarHBondContact O-N 3.33Å; E399-C401 VanDerWaalsContact C-N 3.3Å; E399-C401 PolarHBondContact O-N 3.49Å; C401-V403 VanDerWaalsContact C-N 3.32Å; C401-V403 PolarHBondContact O-N 2.92Å; C401-L404 PolarHBondContact O-N 3.21Å; C401-L405 WeakPolarHBondContact O-CB 3.4Å; C401-L405 WeakPolarHBondContact O-CG 3.44Å; C401-L405 PolarHBondContact O-N 3.46Å |
| 402 | P | 94.6 | Very high | 90.9 | Very high | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.006 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -64.8 | -35.1 | 177.9 | 23.6 | -33.6 | 0 | 0 | 0 | 112.8 | V272 F275 F276 V398 E399 L405 G406 | V272-P402 HydrophobicContact CG1-CG 4.38Å; V272-P402 WeakPolarHBondContact O-CB 3.14Å; F275-P402 HydrophobicContact CB-CB 3.9Å; F275-P402 HydrophobicContact CB-CG 3.77Å; F276-P402 HydrophobicContact CB-CB 4.46Å; F276-P402 HydrophobicContact CD1-CB 4.23Å; F276-P402 HydrophobicContact CD2-CB 3.52Å; F276-P402 HydrophobicContact CE1-CB 4.38Å; F276-P402 HydrophobicContact CE2-CB 3.67Å; F276-P402 HydrophobicContact CG-CB 3.81Å; F276-P402 HydrophobicContact CZ-CB 4.1Å; V398-P402 VanDerWaalsContact O-CD 3.32Å; V398-P402 WeakPolarHBondContact O-CD 3.43Å; E399-P402 WeakPolarHBondContact O-CD 3.22Å; E399-P402 VanDerWaalsContact O-CG 3.25Å; E399-P402 WeakPolarHBondContact O-CG 3.4Å; P402-L405 PolarHBondContact O-N 3.33Å; P402-G406 WeakPolarHBondContact O-CA 3.33Å; P402-G406 PolarHBondContact O-N 3.4Å |
| 403 | V | 92.7 | Very high | 91.3 | Very high | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.006 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.3 | -40.9 | 176.2 | 167.4 | 0 | 0 | 0 | 0 | 112.1 | S63 L66 F275 F279 E399 C400 C401 P407 | S63-V403 PolarHBondContact OG-O 3.43Å; L66-V403 HydrophobicContact CB-CG1 3.79Å; L66-V403 HydrophobicContact CD2-CG1 3.63Å; L66-V403 HydrophobicContact CG-CG1 3.85Å; F275-V403 HydrophobicContact CB-CG2 4.42Å; F275-V403 HydrophobicContact CD1-CG2 4.01Å; F275-V403 HydrophobicContact CG-CG2 4.49Å; F279-V403 HydrophobicContact CD2-CG2 3.8Å; F279-V403 HydrophobicContact CE2-CG2 3.66Å; E399-V403 WeakPolarHBondContact O-CB 3.45Å; E399-V403 WeakPolarHBondContact O-CG2 3.17Å; E399-V403 PolarHBondContact O-N 3Å; C400-V403 PolarHBondContact O-N 3.18Å; C401-V403 VanDerWaalsContact C-N 3.32Å; C401-V403 PolarHBondContact O-N 2.92Å; V403-P407 WeakPolarHBondContact O-CD 3.47Å |
| 404 | L | 95.1 | Very high | 91.8 | Very high | 52 Ų | 52 | 31.6 Ų | 31.6 | 27% | 0.272 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -67.1 | -43 | 178 | -178.9 | 60.4 | 0 | 0 | 0 | 111.5 | W60 S63 I64 A67 C400 C401 P408 | W60-L404 HydrophobicContact CE3-CD1 3.96Å; W60-L404 HydrophobicContact CZ3-CD1 3.65Å; W60-L404 HydrophobicContact CZ3-CD2 4.41Å; W60-L404 HydrophobicContact CZ3-CG 3.75Å; S63-L404 WeakPolarHBondContact CB-O 3.46Å; I64-L404 HydrophobicContact CB-CD1 4.36Å; I64-L404 HydrophobicContact CG1-CD1 3.68Å; A67-L404 HydrophobicContact CB-CB 3.79Å; A67-L404 HydrophobicContact CB-CD1 4.01Å; A67-L404 HydrophobicContact CB-CG 4.37Å; C400-L404 WeakPolarHBondContact O-CB 3.45Å; C400-L404 PolarHBondContact O-N 2.83Å; C401-L404 PolarHBondContact O-N 3.21Å; L404-P408 WeakPolarHBondContact O-CD 3.5Å; L404-P408 WeakPolarHBondContact O-CG 3.32Å |
| 405 | L | 95.2 | Very high | 92.1 | Very high | 64 Ų | 64 | 34 Ų | 34 | 34% | 0.335 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -90.8 | -27.9 | -171.1 | -63.7 | 177 | 0 | 0 | 0 | 113.9 | W60 F276 C401 P402 P408 L409 | W60-L405 HydrophobicContact CH2-CD2 3.82Å; F276-L405 HydrophobicContact CE1-CB 3.93Å; F276-L405 HydrophobicContact CE1-CD1 4.48Å; C401-L405 WeakPolarHBondContact O-CB 3.4Å; C401-L405 WeakPolarHBondContact O-CG 3.44Å; C401-L405 PolarHBondContact O-N 3.46Å; P402-L405 PolarHBondContact O-N 3.33Å; L405-P408 WeakPolarHBondContact O-CD 3.43Å; L405-L409 HydrophobicContact CB-CD1 3.88Å; L405-L409 HydrophobicContact CB-CG 4.44Å; L405-L409 VanDerWaalsContact O-CB 3.26Å; L405-L409 WeakPolarHBondContact O-CB 3.34Å; L405-L409 WeakPolarHBondContact O-CG 3.48Å; L405-L409 PolarHBondContact O-N 3.35Å |
| 406 | G | 94.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -55.8 | -64.9 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | F276 P402 L409 L410 | F276-G406 WeakPolarHBondContact O-CA 3.38Å; P402-G406 WeakPolarHBondContact O-CA 3.33Å; P402-G406 PolarHBondContact O-N 3.4Å; G406-L409 PolarHBondContact O-N 3Å; G406-L410 WeakPolarHBondContact O-CB 3.28Å; G406-L410 WeakPolarHBondContact O-CG 3.28Å; G406-L410 PolarHBondContact O-N 3.24Å |
| 407 | P | 94.9 | Very high | 92.6 | Very high | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.006 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.7 | -39.4 | -178.2 | -23 | 33 | 0 | 0 | 0 | 114.6 | S59 S63 T280 V283 V403 G411 | S59-P407 VanDerWaalsContact OG-C 3.32Å; S59-P407 PolarHBondContact OG-O 3.36Å; S63-P407 WeakPolarHBondContact OG-CB 3.35Å; S63-P407 VanDerWaalsContact OG-CD 3.32Å; S63-P407 WeakPolarHBondContact OG-CD 3.39Å; S63-P407 WeakPolarHBondContact OG-CG 3.32Å; T280-P407 VanDerWaalsContact OG1-CA 3.31Å; T280-P407 WeakPolarHBondContact OG1-CA 3.39Å; V283-P407 HydrophobicContact CG2-CG 4.4Å; V403-P407 WeakPolarHBondContact O-CD 3.47Å; P407-G411 WeakPolarHBondContact O-CA 3.33Å; P407-G411 PolarHBondContact O-N 3.03Å |
| 408 | P | 94.6 | Very high | 92.7 | Very high | 3 Ų | 3 | 45.3 Ų | 45.3 | 2% | 0.019 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.7 | -45.6 | 173.7 | -27.8 | 37 | 0 | 0 | 0 | 114.4 | S56 S59 W60 S63 L404 L405 K412 | S56-P408 WeakPolarHBondContact CB-O 3.45Å; S56-P408 PolarHBondContact OG-O 3.29Å; S59-P408 WeakPolarHBondContact OG-CA 3.27Å; W60-P408 HydrophobicContact CB-CG 4.45Å; W60-P408 HydrophobicContact CD2-CB 3.9Å; W60-P408 HydrophobicContact CD2-CG 3.47Å; W60-P408 VanDerWaalsContact CD2-CG 3.47Å; W60-P408 VanDerWaalsContact CE2-CB 3.41Å; W60-P408 HydrophobicContact CE3-CG 3.95Å; W60-P408 HydrophobicContact CG-CB 4.12Å; W60-P408 HydrophobicContact CG-CG 3.69Å; W60-P408 HydrophobicContact CH2-CG 4.49Å; W60-P408 HydrophobicContact CZ2-CB 3.8Å; W60-P408 HydrophobicContact CZ2-CG 4.06Å; W60-P408 HydrophobicContact CZ3-CG 4.44Å; S63-P408 WeakPolarHBondContact OG-CD 3.48Å; L404-P408 WeakPolarHBondContact O-CD 3.5Å; L404-P408 WeakPolarHBondContact O-CG 3.32Å; L405-P408 WeakPolarHBondContact O-CD 3.43Å; P408-K412 PolarHBondContact O-N 3.24Å; P408-K412 VanDerWaalsContact O-N 3.17Å |
| 409 | L | 94.4 | Very high | 92.8 | Very high | 97 Ų | 97 | 44.3 Ų | 44.3 | 51% | 0.508 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -65.2 | -44.6 | -179.6 | -72.5 | 175.1 | 0 | 0 | 0 | 111.4 | F276 L405 G406 K412 | F276-L409 HydrophobicContact CE1-CD1 4.25Å; L405-L409 HydrophobicContact CB-CD1 3.88Å; L405-L409 HydrophobicContact CB-CG 4.44Å; L405-L409 VanDerWaalsContact O-CB 3.26Å; L405-L409 WeakPolarHBondContact O-CB 3.34Å; L405-L409 WeakPolarHBondContact O-CG 3.48Å; L405-L409 PolarHBondContact O-N 3.35Å; G406-L409 PolarHBondContact O-N 3Å; L409-K412 VanDerWaalsContact O-CB 3.28Å; L409-K412 WeakPolarHBondContact O-CB 3.39Å; L409-K412 PolarHBondContact O-N 3.11Å |
| 410 | L | 93.7 | Very high | 93 | Very high | 14 Ų | 14 | 44.2 Ų | 44.2 | 7% | 0.073 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -79.4 | -24.9 | -178.3 | -68.9 | 163.9 | 0 | 0 | 0 | 112.5 | F276 T280 G406 K412 L413 T423 A426 I430 | F276-L410 WeakPolarHBondContact O-CD1 3.33Å; T280-L410 HydrophobicContact CG2-CB 3.65Å; T280-L410 HydrophobicContact CG2-CD1 4.06Å; T280-L410 WeakPolarHBondContact OG1-CD1 3.19Å; G406-L410 WeakPolarHBondContact O-CB 3.28Å; G406-L410 WeakPolarHBondContact O-CG 3.28Å; G406-L410 PolarHBondContact O-N 3.24Å; L410-K412 VanDerWaalsContact C-N 3.27Å; L410-L413 HydrophobicContact CD2-CD1 4.01Å; L410-L413 WeakPolarHBondContact O-CB 3.37Å; L410-L413 PolarHBondContact O-N 3.47Å; L410-T423 HydrophobicContact CB-CG2 4.14Å; L410-T423 WeakPolarHBondContact O-CG2 3.29Å; L410-T423 PolarHBondContact O-OG1 3.2Å; L410-A426 HydrophobicContact CD2-CB 3.71Å; L410-I430 HydrophobicContact CD1-CD1 4.35Å; L410-I430 HydrophobicContact CD2-CD1 4.08Å |
| 411 | G | 91.8 | Very high | 93.1 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.6 | -30.1 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | P407 L413 N414 D415 | P407-G411 WeakPolarHBondContact O-CA 3.33Å; P407-G411 PolarHBondContact O-N 3.03Å; G411-L413 PolarHBondContact O-N 3.06Å; G411-N414 WeakPolarHBondContact O-CB 3.43Å; G411-N414 PolarHBondContact O-N 3.33Å; G411-D415 PolarHBondContact O-N 3.48Å |
| 412 | K | 93 | Very high | 93.3 | Very high | 122 Ų | 122 | 46.6 Ų | 46.6 | 53% | 0.53 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.6 | -29.3 | 174.6 | -166.3 | 178.9 | 178.8 | -179.6 | 0 | 112.6 | P408 L409 L410 N414 D415 M416 | P408-K412 PolarHBondContact O-N 3.24Å; P408-K412 VanDerWaalsContact O-N 3.17Å; L409-K412 VanDerWaalsContact O-CB 3.28Å; L409-K412 WeakPolarHBondContact O-CB 3.39Å; L409-K412 PolarHBondContact O-N 3.11Å; L410-K412 VanDerWaalsContact C-N 3.27Å; K412-N414 VanDerWaalsContact C-N 3.34Å; K412-D415 PolarHBondContact O-N 2.94Å; K412-M416 HydrophobicContact CG-SD 4.4Å; K412-M416 WeakPolarHBondContact O-CG 3.3Å; K412-M416 PolarHBondContact O-N 2.92Å |
| 413 | L | 93.2 | Very high | 93.3 | Very high | 49 Ų | 49 | 46.5 Ų | 46.5 | 26% | 0.257 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.3 | -41.7 | 173.3 | -63.8 | 173.7 | 0 | 0 | 0 | 111.2 | L410 G411 D415 M416 Y417 A426 | L410-L413 HydrophobicContact CD2-CD1 4.01Å; L410-L413 WeakPolarHBondContact O-CB 3.37Å; L410-L413 PolarHBondContact O-N 3.47Å; G411-L413 PolarHBondContact O-N 3.06Å; L413-D415 VanDerWaalsContact C-N 3.35Å; L413-M416 PolarHBondContact O-N 3.29Å; L413-Y417 HydrophobicContact CD2-CE2 4.28Å; L413-Y417 VanDerWaalsContact O-CD2 3.29Å; L413-Y417 WeakPolarHBondContact O-CD2 3.44Å; L413-Y417 PolarHBondContact O-N 2.9Å; L413-A426 HydrophobicContact CD1-CB 3.63Å |
| 414 | N | 91.4 | Very high | 93.5 | Very high | 16 Ų | 16 | 46.5 Ų | 46.5 | 9% | 0.086 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.8 | -40.8 | 173.1 | 178.5 | 70 | 0 | 0 | 0 | 111.2 | S55 G411 K412 M416 G418 D419 Y420 | S55-N414 PolarHBondContact OG-ND2 3.29Å; G411-N414 WeakPolarHBondContact O-CB 3.43Å; G411-N414 PolarHBondContact O-N 3.33Å; K412-N414 VanDerWaalsContact C-N 3.34Å; N414-M416 VanDerWaalsContact C-N 3.29Å; N414-M416 PolarHBondContact O-N 2.82Å; N414-G418 VanDerWaalsContact O-CA 3.24Å; N414-G418 WeakPolarHBondContact O-CA 3.42Å; N414-G418 PolarHBondContact O-N 3.47Å; N414-D419 PolarHBondContact OD1-N 3.31Å; N414-Y420 HydrophobicContact CB-CD1 4.06Å; N414-Y420 HydrophobicContact CB-CE1 4.14Å; N414-Y420 HydrophobicContact CB-CG 4.46Å; N414-Y420 WeakPolarHBondContact OD1-CD2 3.46Å; N414-Y420 PolarHBondContact OD1-N 3.34Å |
| 415 | D | 91.5 | Very high | 93.6 | Very high | 57 Ų | 57 | 49.4 Ų | 49.4 | 31% | 0.305 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.7 | -34.6 | 178.3 | -63.8 | -19.7 | 0 | 0 | 0 | 112.6 | S54 S55 S56 G411 K412 L413 | S54-D415 VanDerWaalsContact CB-CG 3.47Å; S54-D415 WeakPolarHBondContact CB-OD2 3.35Å; S54-D415 PolarHBondContact OG-OD2 3.26Å; S55-D415 VanDerWaalsContact CB-OD1 3.3Å; S55-D415 WeakPolarHBondContact CB-OD1 3.45Å; S55-D415 PolarHBondContact N-OD1 3.45Å; S56-D415 WeakPolarHBondContact CB-OD2 3.13Å; S56-D415 PolarHBondContact N-OD2 3.17Å; G411-D415 PolarHBondContact O-N 3.48Å; K412-D415 PolarHBondContact O-N 2.94Å; L413-D415 VanDerWaalsContact C-N 3.35Å |
| 416 | M | 92.1 | Very high | 93.7 | Very high | 125 Ų | 125 | 47.6 Ų | 47.6 | 62% | 0.616 | 24% | 0.238 | S | C | * | . | H | α-helix | trans | -80.5 | -42.6 | 179.8 | -72 | 177.4 | 60.5 | 0 | 0 | 113.6 | K412 L413 N414 | K412-M416 HydrophobicContact CG-SD 4.4Å; K412-M416 WeakPolarHBondContact O-CG 3.3Å; K412-M416 PolarHBondContact O-N 2.92Å; L413-M416 PolarHBondContact O-N 3.29Å; N414-M416 VanDerWaalsContact C-N 3.29Å; N414-M416 PolarHBondContact O-N 2.82Å |
| 417 | Y | 92.5 | Very high | 93.8 | Very high | 137 Ų | 137 | 47.6 Ų | 47.6 | 54% | 0.537 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -101.6 | -10.6 | -172.5 | -65.9 | -73.4 | 0 | 0 | 0 | 114 | L413 D419 Y422 | L413-Y417 HydrophobicContact CD2-CE2 4.28Å; L413-Y417 VanDerWaalsContact O-CD2 3.29Å; L413-Y417 WeakPolarHBondContact O-CD2 3.44Å; L413-Y417 PolarHBondContact O-N 2.9Å; Y417-D419 VanDerWaalsContact C-N 3.26Å; Y417-D419 PolarHBondContact O-N 3.4Å; Y417-Y422 VanDerWaalsContact CB-CD2 3.43Å; Y417-Y422 HydrophobicContact CD1-CE2 4.37Å; Y417-Y422 HydrophobicContact CD2-CD2 4.21Å; Y417-Y422 HydrophobicContact CD2-CG 4.25Å; Y417-Y422 AromaticContact CG-CD2 3.88Å; Y417-Y422 HydrophobicContact CG-CD2 3.88Å; Y417-Y422 HydrophobicContact CG-CE2 4.01Å; Y417-Y422 HydrophobicContact CG-CG 4.33Å |
| 418 | G | 89 | Confident | 94 | Very high | 66 Ų | 66 | 47.6 Ų | 47.6 | 68% | 0.68 | 24% | 0.238 | S | C | * | . | S | Bend | trans | 71.1 | 11.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | N414 | N414-G418 VanDerWaalsContact O-CA 3.24Å; N414-G418 WeakPolarHBondContact O-CA 3.42Å; N414-G418 PolarHBondContact O-N 3.47Å |
| 419 | D | 91.3 | Very high | 94.1 | Very high | 27 Ų | 27 | 51.3 Ų | 51.3 | 14% | 0.144 | 26% | 0.261 | C | S | . | . | trans | -142.8 | 126.3 | 179.5 | -164.1 | -25.9 | 0 | 0 | 0 | 111.7 | K292 N414 Y417 K421 Y422 | K292-D419 IonicContact NZ-OD1 3.78Å; K292-D419 IonicContact NZ-OD2 3.05Å; N414-D419 PolarHBondContact OD1-N 3.31Å; Y417-D419 VanDerWaalsContact C-N 3.26Å; Y417-D419 PolarHBondContact O-N 3.4Å; D419-K421 HydrophobicContact CB-CD 4.24Å; D419-K421 HydrophobicContact CB-CG 4Å; D419-K421 PolarHBondContact O-N 2.86Å; D419-K421 VanDerWaalsContact O-N 3.11Å; D419-K421 PolarHBondContact OD1-N 3.12Å; D419-K421 VanDerWaalsContact OD2-CD 3.29Å; D419-K421 WeakPolarHBondContact OD2-CD 3.33Å; D419-K421 WeakPolarHBondContact OD2-CE 3.3Å; D419-K421 IonicContact OD2-NZ 3.54Å; D419-Y422 HydrophobicContact CB-CD2 4.32Å; D419-Y422 HydrophobicContact CB-CE2 4.33Å; D419-Y422 WeakPolarHBondContact O-CD2 3.45Å; D419-Y422 PolarHBondContact O-N 3.35Å | ||
| 420 | Y | 93.1 | Very high | 94.3 | Very high | 4 Ų | 4 | 48.8 Ų | 48.8 | 2% | 0.016 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.6 | -16.8 | 177.3 | -78.1 | -77.7 | 0 | 0 | 0 | 113.2 | S55 F284 N287 Y288 N414 Y422 T423 Y424 | S55-Y420 PolarHBondContact OG-OH 2.98Å; F284-Y420 HydrophobicContact CB-CD1 3.98Å; F284-Y420 HydrophobicContact CB-CE1 3.7Å; F284-Y420 AromaticContact CD1-CE1 3.69Å; F284-Y420 HydrophobicContact CD1-CE1 3.69Å; F284-Y420 HydrophobicContact CD2-CE1 4.2Å; F284-Y420 HydrophobicContact CE1-CE1 4.31Å; F284-Y420 HydrophobicContact CG-CD1 4.21Å; F284-Y420 AromaticContact CG-CE1 3.62Å; F284-Y420 HydrophobicContact CG-CE1 3.62Å; N287-Y420 HydrophobicContact CB-CE2 4.19Å; N287-Y420 WeakPolarHBondContact CB-OH 3.4Å; Y288-Y420 HydrophobicContact CD2-CD2 4.08Å; Y288-Y420 HydrophobicContact CD2-CG 4.04Å; Y288-Y420 HydrophobicContact CG-CG 4.28Å; N414-Y420 HydrophobicContact CB-CD1 4.06Å; N414-Y420 HydrophobicContact CB-CE1 4.14Å; N414-Y420 HydrophobicContact CB-CG 4.46Å; N414-Y420 WeakPolarHBondContact OD1-CD2 3.46Å; N414-Y420 PolarHBondContact OD1-N 3.34Å; Y420-Y422 PolarHBondContact O-N 3.49Å; Y420-Y422 VanDerWaalsContact O-N 3.16Å; Y420-T423 WeakPolarHBondContact O-CB 3.26Å; Y420-T423 PolarHBondContact O-N 3.29Å; Y420-Y424 WeakPolarHBondContact O-CD2 3.31Å; Y420-Y424 PolarHBondContact O-N 3.15Å |
| 421 | K | 94.4 | Very high | 94.5 | Very high | 61 Ų | 61 | 48.1 Ų | 48.1 | 27% | 0.265 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -52.2 | -39 | 176.6 | 70.8 | -172.9 | 175 | -164.4 | 0 | 112.9 | P349 D419 Y424 W425 | P349-K421 HydrophobicContact CB-CB 3.88Å; P349-K421 HydrophobicContact CG-CB 3.99Å; D419-K421 HydrophobicContact CB-CD 4.24Å; D419-K421 HydrophobicContact CB-CG 4Å; D419-K421 PolarHBondContact O-N 2.86Å; D419-K421 VanDerWaalsContact O-N 3.11Å; D419-K421 PolarHBondContact OD1-N 3.12Å; D419-K421 VanDerWaalsContact OD2-CD 3.29Å; D419-K421 WeakPolarHBondContact OD2-CD 3.33Å; D419-K421 WeakPolarHBondContact OD2-CE 3.3Å; D419-K421 IonicContact OD2-NZ 3.54Å; K421-Y424 PolarHBondContact O-N 3.05Å; K421-W425 PolarHBondContact O-N 3.46Å |
| 422 | Y | 95.2 | Very high | 94.8 | Very high | 81 Ų | 81 | 49.9 Ų | 49.9 | 32% | 0.318 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -70.3 | -37.7 | -179.5 | -62.6 | -73.5 | 0 | 0 | 0 | 111.7 | Y417 D419 Y420 W425 A426 | Y417-Y422 VanDerWaalsContact CB-CD2 3.43Å; Y417-Y422 HydrophobicContact CD1-CE2 4.37Å; Y417-Y422 HydrophobicContact CD2-CD2 4.21Å; Y417-Y422 HydrophobicContact CD2-CG 4.25Å; Y417-Y422 AromaticContact CG-CD2 3.88Å; Y417-Y422 HydrophobicContact CG-CD2 3.88Å; Y417-Y422 HydrophobicContact CG-CE2 4.01Å; Y417-Y422 HydrophobicContact CG-CG 4.33Å; D419-Y422 HydrophobicContact CB-CD2 4.32Å; D419-Y422 HydrophobicContact CB-CE2 4.33Å; D419-Y422 WeakPolarHBondContact O-CD2 3.45Å; D419-Y422 PolarHBondContact O-N 3.35Å; Y420-Y422 PolarHBondContact O-N 3.49Å; Y420-Y422 VanDerWaalsContact O-N 3.16Å; Y422-W425 HydrophobicContact CD1-CE3 4.08Å; Y422-W425 HydrophobicContact CD1-CZ3 4.19Å; Y422-W425 HydrophobicContact CE1-CE3 4.42Å; Y422-W425 HydrophobicContact CE1-CZ3 4.07Å; Y422-A426 WeakPolarHBondContact O-CB 3.31Å; Y422-A426 PolarHBondContact O-N 2.88Å |
| 423 | T | 96 | Very high | 95 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.1 | -47 | 172.7 | -60.5 | 0 | 0 | 0 | 0 | 110.7 | T280 F284 L410 Y420 A426 C427 | T280-T423 HydrophobicContact CG2-CG2 3.59Å; F284-T423 HydrophobicContact CD2-CG2 4.13Å; F284-T423 HydrophobicContact CE2-CG2 4.48Å; L410-T423 HydrophobicContact CB-CG2 4.14Å; L410-T423 WeakPolarHBondContact O-CG2 3.29Å; L410-T423 PolarHBondContact O-OG1 3.2Å; Y420-T423 WeakPolarHBondContact O-CB 3.26Å; Y420-T423 PolarHBondContact O-N 3.29Å; T423-A426 PolarHBondContact O-N 2.96Å; T423-C427 PolarHBondContact O-N 2.97Å; T423-C427 PolarHBondContact O-SG 3.22Å |
| 424 | Y | 96.9 | Very high | 95.2 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -69.3 | -40.1 | -179.1 | -83.1 | -108.9 | 0 | 0 | 0 | 112.9 | P281 L285 Y288 A348 Y360 Y420 K421 C427 G428 | P281-Y424 HydrophobicContact CB-CD1 4.1Å; P281-Y424 HydrophobicContact CB-CE1 3.7Å; P281-Y424 PolarHBondContact O-OH 3Å; P281-Y424 VanDerWaalsContact O-OH 3.05Å; L285-Y424 VanDerWaalsContact CA-OH 3.28Å; L285-Y424 WeakPolarHBondContact CA-OH 3.48Å; L285-Y424 PolarHBondContact N-OH 3.08Å; Y288-Y424 HydrophobicContact CD1-CD2 4.09Å; Y288-Y424 HydrophobicContact CD1-CE1 4.3Å; Y288-Y424 AromaticContact CD1-CE2 3.64Å; Y288-Y424 HydrophobicContact CD1-CE2 3.64Å; Y288-Y424 AromaticContact CD1-CZ 3.75Å; Y288-Y424 HydrophobicContact CE1-CD2 4.32Å; Y288-Y424 HydrophobicContact CE1-CE2 4.32Å; Y288-Y424 HydrophobicContact CG-CE2 4.12Å; A348-Y424 HydrophobicContact CB-CD1 3.45Å; A348-Y424 VanDerWaalsContact CB-CD1 3.45Å; A348-Y424 HydrophobicContact CB-CE1 4.01Å; A348-Y424 HydrophobicContact CB-CG 4.25Å; Y360-Y424 HydrophobicContact CE1-CE1 4.14Å; Y360-Y424 AromaticContact CZ-CE1 3.89Å; Y360-Y424 WeakPolarHBondContact OH-CE1 3.39Å; Y420-Y424 WeakPolarHBondContact O-CD2 3.31Å; Y420-Y424 PolarHBondContact O-N 3.15Å; K421-Y424 PolarHBondContact O-N 3.05Å; Y424-C427 PolarHBondContact O-N 3.38Å; Y424-G428 PolarHBondContact O-N 3.24Å |
| 425 | W | 97.3 | Very high | 95.5 | Very high | 114 Ų | 114 | 44.9 Ų | 44.9 | 43% | 0.432 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -60.1 | -46.2 | 172 | -75.1 | -19.8 | 0 | 0 | 0 | 112.1 | L346 K421 Y422 C427 G428 V429 | L346-W425 HydrophobicContact CD2-CB 4.49Å; L346-W425 WeakPolarHBondContact CD2-O 3.43Å; L346-W425 PolarHBondContact O-NE1 3.39Å; K421-W425 PolarHBondContact O-N 3.46Å; Y422-W425 HydrophobicContact CD1-CE3 4.08Å; Y422-W425 HydrophobicContact CD1-CZ3 4.19Å; Y422-W425 HydrophobicContact CE1-CE3 4.42Å; Y422-W425 HydrophobicContact CE1-CZ3 4.07Å; W425-C427 PolarHBondContact O-N 3.34Å; W425-G428 PolarHBondContact O-N 2.7Å; W425-V429 WeakPolarHBondContact O-CG2 3.43Å; W425-V429 PolarHBondContact O-N 3.38Å |
| 426 | A | 97.3 | Very high | 95.8 | Very high | 26 Ų | 26 | 46.1 Ų | 46.1 | 22% | 0.215 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.4 | -44.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | L410 L413 Y422 T423 G428 V429 I430 | L410-A426 HydrophobicContact CD2-CB 3.71Å; L413-A426 HydrophobicContact CD1-CB 3.63Å; Y422-A426 WeakPolarHBondContact O-CB 3.31Å; Y422-A426 PolarHBondContact O-N 2.88Å; T423-A426 PolarHBondContact O-N 2.96Å; A426-G428 PolarHBondContact O-N 2.83Å; A426-V429 PolarHBondContact O-N 3.44Å; A426-I430 WeakPolarHBondContact O-CD1 3.3Å; A426-I430 VanDerWaalsContact O-CG1 3.25Å; A426-I430 WeakPolarHBondContact O-CG1 3.17Å; A426-I430 PolarHBondContact O-N 3.11Å |
| 427 | C | 97.3 | Very high | 96 | Very high | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.5 | -45.5 | 175.3 | -63.5 | 0 | 0 | 0 | 0 | 111.8 | P281 T423 Y424 W425 I430 L431 | P281-C427 HydrophobicContact CG-CB 3.58Å; T423-C427 PolarHBondContact O-N 2.97Å; T423-C427 PolarHBondContact O-SG 3.22Å; Y424-C427 PolarHBondContact O-N 3.38Å; W425-C427 PolarHBondContact O-N 3.34Å; C427-I430 PolarHBondContact O-N 3.22Å; C427-L431 WeakPolarHBondContact O-CG 3.36Å; C427-L431 PolarHBondContact O-N 3.49Å |
| 428 | G | 97.6 | Very high | 96.2 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.7 | -44.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G342 Y424 W425 A426 L431 I432 | G342-G428 VanDerWaalsContact O-CA 3.3Å; G342-G428 WeakPolarHBondContact O-CA 3.42Å; Y424-G428 PolarHBondContact O-N 3.24Å; W425-G428 PolarHBondContact O-N 2.7Å; A426-G428 PolarHBondContact O-N 2.83Å; G428-L431 PolarHBondContact O-N 3.43Å; G428-I432 WeakPolarHBondContact O-CG1 3.41Å; G428-I432 PolarHBondContact O-N 3.35Å |
| 429 | V | 98.1 | Very high | 96.5 | Very high | 81 Ų | 81 | 38.9 Ų | 38.9 | 49% | 0.491 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -62.6 | -46.9 | 175.4 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | L346 W425 A426 L431 I432 V433 | L346-V429 HydrophobicContact CD2-CG2 4.08Å; W425-V429 WeakPolarHBondContact O-CG2 3.43Å; W425-V429 PolarHBondContact O-N 3.38Å; A426-V429 PolarHBondContact O-N 3.44Å; V429-L431 VanDerWaalsContact C-N 3.32Å; V429-L431 PolarHBondContact O-N 2.84Å; V429-I432 PolarHBondContact O-N 3.01Å; V429-V433 HydrophobicContact CG1-CG2 4.21Å; V429-V433 WeakPolarHBondContact O-CB 3.49Å; V429-V433 VanDerWaalsContact O-CG2 3.29Å; V429-V433 WeakPolarHBondContact O-CG2 3.35Å; V429-V433 PolarHBondContact O-N 3.27Å |
| 430 | I | 97.6 | Very high | 96.7 | Very high | 44 Ų | 44 | 42.3 Ų | 42.3 | 23% | 0.226 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -57.7 | -45.3 | 178.8 | -70.5 | 165.7 | 0 | 0 | 0 | 110.9 | I273 F276 L410 A426 C427 S434 | I273-I430 HydrophobicContact CG2-CG2 4.28Å; I273-I430 WeakPolarHBondContact O-CG2 3.19Å; F276-I430 HydrophobicContact CB-CG2 4.35Å; L410-I430 HydrophobicContact CD1-CD1 4.35Å; L410-I430 HydrophobicContact CD2-CD1 4.08Å; A426-I430 WeakPolarHBondContact O-CD1 3.3Å; A426-I430 VanDerWaalsContact O-CG1 3.25Å; A426-I430 WeakPolarHBondContact O-CG1 3.17Å; A426-I430 PolarHBondContact O-N 3.11Å; C427-I430 PolarHBondContact O-N 3.22Å; I430-S434 WeakPolarHBondContact O-CB 3.38Å; I430-S434 PolarHBondContact O-N 2.96Å |
| 431 | L | 97.9 | Very high | 96.6 | Very high | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.6 | -41.4 | 178.7 | -71.2 | -174 | 0 | 0 | 0 | 112.5 | M274 L278 V338 N341 H345 C427 G428 V429 S434 G435 | M274-L431 HydrophobicContact CB-CD2 4.35Å; M274-L431 HydrophobicContact CG-CD2 3.56Å; M274-L431 VanDerWaalsContact O-CD2 3.31Å; M274-L431 WeakPolarHBondContact O-CD2 3.49Å; L278-L431 HydrophobicContact CB-CD2 4.31Å; V338-L431 HydrophobicContact CG1-CB 4.46Å; V338-L431 HydrophobicContact CG1-CD2 4.35Å; V338-L431 WeakPolarHBondContact CG1-O 3.33Å; N341-L431 HydrophobicContact CB-CD1 4.1Å; N341-L431 WeakPolarHBondContact OD1-CD1 3.07Å; H345-L431 VanDerWaalsContact CD2-CD1 3.42Å; H345-L431 WeakPolarHBondContact CD2-CD1 3.28Å; C427-L431 WeakPolarHBondContact O-CG 3.36Å; C427-L431 PolarHBondContact O-N 3.49Å; G428-L431 PolarHBondContact O-N 3.43Å; V429-L431 VanDerWaalsContact C-N 3.32Å; V429-L431 PolarHBondContact O-N 2.84Å; L431-S434 PolarHBondContact O-N 3.01Å; L431-G435 PolarHBondContact O-N 3.05Å |
| 432 | I | 98.2 | Very high | 96.3 | Very high | 38 Ų | 38 | 39.5 Ų | 39.5 | 20% | 0.195 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -63.7 | -44.3 | 177.1 | -71.2 | 167.2 | 0 | 0 | 0 | 110.7 | L346 G428 V429 G435 I436 | L346-I432 HydrophobicContact CD1-CD1 3.36Å; L346-I432 HydrophobicContact CG-CD1 4.05Å; G428-I432 WeakPolarHBondContact O-CG1 3.41Å; G428-I432 PolarHBondContact O-N 3.35Å; V429-I432 PolarHBondContact O-N 3.01Å; I432-G435 PolarHBondContact O-N 3.27Å; I432-I436 HydrophobicContact CG2-CD1 3.72Å; I432-I436 HydrophobicContact CG2-CG1 4.37Å; I432-I436 VanDerWaalsContact O-CG1 3.3Å; I432-I436 WeakPolarHBondContact O-CG1 3.34Å; I432-I436 PolarHBondContact O-N 2.87Å |
| 433 | V | 98.1 | Very high | 96 | Very high | 82 Ų | 82 | 36.1 Ų | 36.1 | 50% | 0.497 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -61.5 | -45.9 | 176.9 | 171.3 | 0 | 0 | 0 | 0 | 110.8 | V429 I436 Y437 | V429-V433 HydrophobicContact CG1-CG2 4.21Å; V429-V433 WeakPolarHBondContact O-CB 3.49Å; V429-V433 VanDerWaalsContact O-CG2 3.29Å; V429-V433 WeakPolarHBondContact O-CG2 3.35Å; V429-V433 PolarHBondContact O-N 3.27Å; V433-I436 PolarHBondContact O-N 3.21Å; V433-Y437 VanDerWaalsContact O-CB 3.3Å; V433-Y437 WeakPolarHBondContact O-CB 3.26Å; V433-Y437 PolarHBondContact O-N 3.5Å |
| 434 | S | 97.4 | Very high | 95.6 | Very high | 0 Ų | 0 | 40.3 Ų | 40.3 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.1 | -43.9 | 175 | 173.7 | 0 | 0 | 0 | 0 | 112.1 | G270 M274 I430 L431 Y437 L438 | G270-S434 PolarHBondContact O-OG 3.45Å; M274-S434 WeakPolarHBondContact CB-OG 3.42Å; M274-S434 PolarHBondContact N-OG 3.16Å; I430-S434 WeakPolarHBondContact O-CB 3.38Å; I430-S434 PolarHBondContact O-N 2.96Å; L431-S434 PolarHBondContact O-N 3.01Å; S434-Y437 WeakPolarHBondContact O-CB 3.43Å; S434-Y437 PolarHBondContact O-N 3.38Å; S434-L438 WeakPolarHBondContact O-CB 3.4Å; S434-L438 WeakPolarHBondContact O-CG 3.38Å; S434-L438 PolarHBondContact O-N 2.8Å |
| 435 | G | 97.3 | Very high | 95.2 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.2 | -42.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.8 | L431 I432 L438 F439 | L431-G435 PolarHBondContact O-N 3.05Å; I432-G435 PolarHBondContact O-N 3.27Å; G435-L438 PolarHBondContact O-N 2.88Å; G435-F439 VanDerWaalsContact O-CB 3.29Å; G435-F439 WeakPolarHBondContact O-CB 3.43Å; G435-F439 PolarHBondContact O-N 3.06Å |
| 436 | I | 97.4 | Very high | 94.8 | Very high | 82 Ų | 82 | 38.4 Ų | 38.4 | 42% | 0.421 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -65.1 | -43.7 | 173.7 | -68.1 | 168.6 | 0 | 0 | 0 | 110.4 | I339 I432 V433 L438 F439 I440 | I339-I436 HydrophobicContact CD1-CG1 4.18Å; I432-I436 HydrophobicContact CG2-CD1 3.72Å; I432-I436 HydrophobicContact CG2-CG1 4.37Å; I432-I436 VanDerWaalsContact O-CG1 3.3Å; I432-I436 WeakPolarHBondContact O-CG1 3.34Å; I432-I436 PolarHBondContact O-N 2.87Å; V433-I436 PolarHBondContact O-N 3.21Å; I436-L438 PolarHBondContact O-N 3.26Å; I436-F439 PolarHBondContact O-N 3.44Å; I436-I440 HydrophobicContact CG2-CD1 3.75Å; I436-I440 HydrophobicContact CG2-CG1 4.4Å; I436-I440 WeakPolarHBondContact O-CG1 3.46Å; I436-I440 PolarHBondContact O-N 2.94Å |
| 437 | Y | 97.1 | Very high | 94.3 | Very high | 89 Ų | 89 | 46.2 Ų | 46.2 | 35% | 0.349 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -58.4 | -48.1 | 176 | 173.4 | -93.5 | 0 | 0 | 0 | 111.6 | S269 V433 S434 I440 G441 | S269-Y437 VanDerWaalsContact OG-CE1 3.25Å; S269-Y437 WeakPolarHBondContact OG-CE1 3.18Å; S269-Y437 PolarHBondContact OG-OH 3.26Å; V433-Y437 VanDerWaalsContact O-CB 3.3Å; V433-Y437 WeakPolarHBondContact O-CB 3.26Å; V433-Y437 PolarHBondContact O-N 3.5Å; S434-Y437 WeakPolarHBondContact O-CB 3.43Å; S434-Y437 PolarHBondContact O-N 3.38Å; Y437-I440 PolarHBondContact O-N 3.24Å; Y437-G441 PolarHBondContact O-N 2.95Å |
| 438 | L | 95.4 | Very high | 93.7 | Very high | 1 Ų | 1 | 49.3 Ų | 49.3 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62.4 | -42.4 | 175.1 | -77 | 167.9 | 0 | 0 | 0 | 111.3 | F334 A335 V338 S434 G435 I436 I440 G441 M442 | F334-L438 HydrophobicContact CD1-CD1 4.24Å; F334-L438 HydrophobicContact CE1-CD1 3.67Å; F334-L438 HydrophobicContact CZ-CD1 4.49Å; A335-L438 HydrophobicContact CB-CB 4.08Å; V338-L438 HydrophobicContact CG2-CD1 4.38Å; S434-L438 WeakPolarHBondContact O-CB 3.4Å; S434-L438 WeakPolarHBondContact O-CG 3.38Å; S434-L438 PolarHBondContact O-N 2.8Å; G435-L438 PolarHBondContact O-N 2.88Å; I436-L438 PolarHBondContact O-N 3.26Å; L438-I440 PolarHBondContact O-N 3.46Å; L438-G441 PolarHBondContact O-N 2.88Å; L438-M442 HydrophobicContact CD2-CE 3.96Å; L438-M442 VanDerWaalsContact O-CB 3.23Å; L438-M442 WeakPolarHBondContact O-CB 3.49Å; L438-M442 WeakPolarHBondContact O-CG 3.41Å; L438-M442 PolarHBondContact O-N 2.99Å |
| 439 | F | 95.8 | Very high | 93.2 | Very high | 87 Ų | 87 | 51.9 Ų | 51.9 | 38% | 0.382 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -60.5 | -47.2 | 179 | -168.7 | -87.1 | 0 | 0 | 0 | 111.9 | Y332 A335 I336 G435 I436 G443 | Y332-F439 HydrophobicContact CD1-CD1 4.46Å; Y332-F439 AromaticContact CD1-CD2 3.68Å; Y332-F439 HydrophobicContact CD1-CD2 3.68Å; Y332-F439 HydrophobicContact CD1-CE1 4.33Å; Y332-F439 AromaticContact CD1-CE2 3.52Å; Y332-F439 HydrophobicContact CD1-CE2 3.52Å; Y332-F439 HydrophobicContact CD1-CG 4.15Å; Y332-F439 AromaticContact CD1-CZ 3.87Å; Y332-F439 HydrophobicContact CD1-CZ 3.87Å; Y332-F439 HydrophobicContact CE1-CD1 4.36Å; Y332-F439 HydrophobicContact CE1-CD2 4.37Å; Y332-F439 HydrophobicContact CE1-CE1 4.17Å; Y332-F439 HydrophobicContact CE1-CE2 4.18Å; Y332-F439 HydrophobicContact CE1-CG 4.45Å; Y332-F439 HydrophobicContact CE1-CZ 4.07Å; Y332-F439 WeakPolarHBondContact CE1-O 3.25Å; Y332-F439 HydrophobicContact CG-CE2 4.29Å; A335-F439 HydrophobicContact CB-CB 3.87Å; A335-F439 HydrophobicContact CB-CD2 4.08Å; A335-F439 HydrophobicContact CB-CG 4.49Å; I336-F439 HydrophobicContact CG1-CE2 4.39Å; G435-F439 VanDerWaalsContact O-CB 3.29Å; G435-F439 WeakPolarHBondContact O-CB 3.43Å; G435-F439 PolarHBondContact O-N 3.06Å; I436-F439 PolarHBondContact O-N 3.44Å; F439-G443 PolarHBondContact O-N 3.38Å; F439-G443 VanDerWaalsContact O-N 3.11Å |
| 440 | I | 94.6 | Very high | 92.6 | Very high | 98 Ų | 98 | 50 Ų | 50 | 50% | 0.503 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -68.4 | -48.2 | 178.1 | -65 | 170.4 | 0 | 0 | 0 | 110.3 | I436 Y437 L438 M442 G443 I444 | I436-I440 HydrophobicContact CG2-CD1 3.75Å; I436-I440 HydrophobicContact CG2-CG1 4.4Å; I436-I440 WeakPolarHBondContact O-CG1 3.46Å; I436-I440 PolarHBondContact O-N 2.94Å; Y437-I440 PolarHBondContact O-N 3.24Å; L438-I440 PolarHBondContact O-N 3.46Å; I440-M442 PolarHBondContact O-N 3.35Å; I440-G443 PolarHBondContact O-N 3.08Å; I440-G443 VanDerWaalsContact O-N 3.12Å; I440-I444 HydrophobicContact CG2-CD1 3.98Å; I440-I444 WeakPolarHBondContact O-CG1 3.24Å; I440-I444 PolarHBondContact O-N 3.3Å |
| 441 | G | 90.9 | Very high | 92.2 | Very high | 6 Ų | 6 | 54.9 Ų | 54.9 | 6% | 0.062 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59 | -46.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y437 L438 G443 I444 N445 | Y437-G441 PolarHBondContact O-N 2.95Å; L438-G441 PolarHBondContact O-N 2.88Å; G441-G443 VanDerWaalsContact C-N 3.3Å; G441-G443 PolarHBondContact O-N 2.81Å; G441-I444 PolarHBondContact O-N 2.91Å; G441-N445 PolarHBondContact O-N 2.91Å |
| 442 | M | 89.3 | Confident | 91.6 | Very high | 1 Ų | 1 | 58.9 Ų | 58.9 | 1% | 0.005 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -67.3 | -33.1 | 177.1 | -62.9 | -61.7 | 153.5 | 0 | 0 | 111.6 | L266 Y267 Q331 L382 L438 I440 N445 Y446 | L266-M442 HydrophobicContact CB-CE 4.19Å; Y267-M442 HydrophobicContact CD2-CE 4.43Å; Q331-M442 HydrophobicContact CB-CB 3.86Å; Q331-M442 HydrophobicContact CB-CG 3.83Å; Q331-M442 HydrophobicContact CB-SD 4.03Å; Q331-M442 HydrophobicContact CG-CG 4.47Å; Q331-M442 HydrophobicContact CG-SD 4.01Å; Q331-M442 PolarHBondContact OE1-SD 2.86Å; L382-M442 HydrophobicContact CD1-CE 4.3Å; L382-M442 HydrophobicContact CD1-SD 4.35Å; L382-M442 HydrophobicContact CD2-SD 4.28Å; L438-M442 HydrophobicContact CD2-CE 3.96Å; L438-M442 VanDerWaalsContact O-CB 3.23Å; L438-M442 WeakPolarHBondContact O-CB 3.49Å; L438-M442 WeakPolarHBondContact O-CG 3.41Å; L438-M442 PolarHBondContact O-N 2.99Å; I440-M442 PolarHBondContact O-N 3.35Å; M442-N445 WeakPolarHBondContact O-CB 3.34Å; M442-N445 PolarHBondContact O-N 3.04Å; M442-Y446 WeakPolarHBondContact O-CD2 3.35Å; M442-Y446 PolarHBondContact O-N 3.26Å |
| 443 | G | 88 | Confident | 91.1 | Very high | 9 Ų | 9 | 62.3 Ų | 62.3 | 9% | 0.093 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -67.3 | -36.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | Y332 F439 I440 G441 R447 | Y332-G443 WeakPolarHBondContact OH-CA 3.35Å; F439-G443 PolarHBondContact O-N 3.38Å; F439-G443 VanDerWaalsContact O-N 3.11Å; I440-G443 PolarHBondContact O-N 3.08Å; I440-G443 VanDerWaalsContact O-N 3.12Å; G441-G443 VanDerWaalsContact C-N 3.3Å; G441-G443 PolarHBondContact O-N 2.81Å; G443-R447 WeakPolarHBondContact O-CG 3.14Å; G443-R447 PolarHBondContact O-N 2.82Å |
| 444 | I | 88.8 | Confident | 90.6 | Very high | 89 Ų | 89 | 65.6 Ų | 65.6 | 46% | 0.456 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -64.8 | -44.4 | 170.8 | -65.8 | 166.8 | 0 | 0 | 0 | 109.6 | I440 G441 Y446 R447 L448 | I440-I444 HydrophobicContact CG2-CD1 3.98Å; I440-I444 WeakPolarHBondContact O-CG1 3.24Å; I440-I444 PolarHBondContact O-N 3.3Å; G441-I444 PolarHBondContact O-N 2.91Å; I444-Y446 PolarHBondContact O-N 3.32Å; I444-R447 PolarHBondContact O-N 2.95Å; I444-L448 HydrophobicContact CG2-CD1 3.8Å; I444-L448 HydrophobicContact CG2-CG 4.3Å; I444-L448 WeakPolarHBondContact O-CG 3.2Å; I444-L448 PolarHBondContact O-N 3.04Å |
| 445 | N | 88.7 | Confident | 90.1 | Very high | 18 Ų | 18 | 67.9 Ų | 67.9 | 10% | 0.096 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -57.8 | -49 | 178.1 | -169.4 | 52.8 | 0 | 0 | 0 | 111.8 | L266 G441 M442 R447 L448 V449 | L266-N445 HydrophobicContact CD1-CB 4.3Å; G441-N445 PolarHBondContact O-N 2.91Å; M442-N445 WeakPolarHBondContact O-CB 3.34Å; M442-N445 PolarHBondContact O-N 3.04Å; N445-R447 VanDerWaalsContact C-N 3.34Å; N445-R447 PolarHBondContact O-N 3.35Å; N445-L448 PolarHBondContact O-N 3.28Å; N445-V449 WeakPolarHBondContact O-CG2 3.33Å; N445-V449 PolarHBondContact O-N 3.31Å |
| 446 | Y | 87.4 | Confident | 89.5 | Confident | 55 Ų | 55 | 74.4 Ų | 74.4 | 22% | 0.216 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59.2 | -41.8 | 176.2 | -80.5 | -60.5 | 0 | 0 | 0 | 113.1 | P328 R329 Q331 Y332 M442 I444 L448 A450 | P328-Y446 PolarHBondContact O-OH 3.48Å; R329-Y446 WeakPolarHBondContact CA-OH 3.18Å; Q331-Y446 HydrophobicContact CB-CE2 3.92Å; Q331-Y446 HydrophobicContact CG-CE2 4.43Å; Y332-Y446 HydrophobicContact CD2-CD2 4.1Å; Y332-Y446 AromaticContact CD2-CE2 3.71Å; Y332-Y446 HydrophobicContact CD2-CE2 3.71Å; Y332-Y446 AromaticContact CE2-CD2 3.41Å; Y332-Y446 HydrophobicContact CE2-CD2 3.41Å; Y332-Y446 VanDerWaalsContact CE2-CD2 3.41Å; Y332-Y446 AromaticContact CE2-CE2 3.53Å; Y332-Y446 HydrophobicContact CE2-CE2 3.53Å; Y332-Y446 HydrophobicContact CE2-CG 4.49Å; Y332-Y446 AromaticContact CZ-CD2 3.86Å; M442-Y446 WeakPolarHBondContact O-CD2 3.35Å; M442-Y446 PolarHBondContact O-N 3.26Å; I444-Y446 PolarHBondContact O-N 3.32Å; Y446-L448 VanDerWaalsContact C-N 3.35Å; Y446-A450 VanDerWaalsContact O-CB 3.27Å; Y446-A450 WeakPolarHBondContact O-CB 3.34Å; Y446-A450 PolarHBondContact O-N 2.98Å |
| 447 | R | 87.8 | Confident | 88.9 | Confident | 190 Ų | 190 | 76 Ų | 76 | 72% | 0.717 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -65.9 | -38.1 | 179.3 | -74.6 | 178.9 | 179.3 | -168.3 | 0.6 | 112.2 | G443 I444 N445 K451 | G443-R447 WeakPolarHBondContact O-CG 3.14Å; G443-R447 PolarHBondContact O-N 2.82Å; I444-R447 PolarHBondContact O-N 2.95Å; N445-R447 VanDerWaalsContact C-N 3.34Å; N445-R447 PolarHBondContact O-N 3.35Å; R447-K451 WeakPolarHBondContact O-CG 3.32Å; R447-K451 PolarHBondContact O-N 3.34Å; R447-K451 VanDerWaalsContact O-N 3.12Å |
| 448 | L | 85.4 | Confident | 88.4 | Confident | 66 Ų | 66 | 77.9 Ų | 77.9 | 35% | 0.346 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -71.3 | -46.8 | 178.9 | -70.7 | 173.6 | 0 | 0 | 0 | 111.3 | I444 N445 Y446 A450 K451 E452 | I444-L448 HydrophobicContact CG2-CD1 3.8Å; I444-L448 HydrophobicContact CG2-CG 4.3Å; I444-L448 WeakPolarHBondContact O-CG 3.2Å; I444-L448 PolarHBondContact O-N 3.04Å; N445-L448 PolarHBondContact O-N 3.28Å; Y446-L448 VanDerWaalsContact C-N 3.35Å; L448-A450 VanDerWaalsContact C-N 3.28Å; L448-A450 PolarHBondContact O-N 3.07Å; L448-K451 WeakPolarHBondContact O-CA 3.33Å; L448-K451 WeakPolarHBondContact O-CB 3.33Å; L448-K451 PolarHBondContact O-N 3.24Å; L448-E452 WeakPolarHBondContact O-CG 3.46Å; L448-E452 PolarHBondContact O-N 3.35Å |
| 449 | V | 86 | Confident | 87.9 | Confident | 53 Ų | 53 | 84.4 Ų | 84.4 | 32% | 0.321 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -59 | -41.9 | 176 | 173.6 | 0 | 0 | 0 | 0 | 110.7 | N445 K451 E452 Q453 | N445-V449 WeakPolarHBondContact O-CG2 3.33Å; N445-V449 PolarHBondContact O-N 3.31Å; V449-K451 VanDerWaalsContact C-N 3.29Å; V449-K451 PolarHBondContact O-N 3.27Å; V449-E452 PolarHBondContact O-N 3.03Å; V449-Q453 HydrophobicContact CG1-CG 4.46Å; V449-Q453 WeakPolarHBondContact O-CB 3.4Å; V449-Q453 WeakPolarHBondContact O-CG 3.48Å; V449-Q453 PolarHBondContact O-N 2.94Å |
| 450 | A | 86.3 | Confident | 87.3 | Confident | 42 Ų | 42 | 87.3 Ų | 87.3 | 35% | 0.347 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.3 | -30.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y446 L448 K454 | Y446-A450 VanDerWaalsContact O-CB 3.27Å; Y446-A450 WeakPolarHBondContact O-CB 3.34Å; Y446-A450 PolarHBondContact O-N 2.98Å; L448-A450 VanDerWaalsContact C-N 3.28Å; L448-A450 PolarHBondContact O-N 3.07Å; A450-K454 WeakPolarHBondContact O-CB 3.45Å; A450-K454 VanDerWaalsContact O-CG 3.24Å; A450-K454 WeakPolarHBondContact O-CG 3.42Å; A450-K454 PolarHBondContact O-N 3.12Å |
| 451 | K | 88.1 | Confident | 86.8 | Confident | 146 Ų | 146 | 86.4 Ų | 86.4 | 64% | 0.635 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -73 | -42.3 | 173.6 | -79.1 | -179.7 | 177 | -170.2 | 0 | 111.6 | R447 L448 V449 K454 A455 | R447-K451 WeakPolarHBondContact O-CG 3.32Å; R447-K451 PolarHBondContact O-N 3.34Å; R447-K451 VanDerWaalsContact O-N 3.12Å; L448-K451 WeakPolarHBondContact O-CA 3.33Å; L448-K451 WeakPolarHBondContact O-CB 3.33Å; L448-K451 PolarHBondContact O-N 3.24Å; V449-K451 VanDerWaalsContact C-N 3.29Å; V449-K451 PolarHBondContact O-N 3.27Å; K451-K454 PolarHBondContact O-N 3.36Å; K451-A455 WeakPolarHBondContact O-CB 3.39Å; K451-A455 PolarHBondContact O-N 3.03Å |
| 452 | E | 86.9 | Confident | 86.4 | Confident | 84 Ų | 84 | 90.1 Ų | 90.1 | 39% | 0.393 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.4 | -46.4 | 177.6 | -71.1 | 170.4 | 175.1 | 0 | 0 | 110.5 | R262 L448 V449 K454 A455 E456 | R262-E452 IonicContact CZ-OE1 2.75Å; R262-E452 IonicContact NH1-OE1 3.68Å; R262-E452 PolarHBondContact NH1-OE1 3.14Å; L448-E452 WeakPolarHBondContact O-CG 3.46Å; L448-E452 PolarHBondContact O-N 3.35Å; V449-E452 PolarHBondContact O-N 3.03Å; E452-K454 PolarHBondContact O-N 2.92Å; E452-A455 WeakPolarHBondContact O-CB 3.23Å; E452-A455 PolarHBondContact O-N 3.33Å; E452-A455 VanDerWaalsContact O-N 3.13Å; E452-E456 WeakPolarHBondContact O-CG 3.3Å; E452-E456 PolarHBondContact O-N 3.09Å |
| 453 | Q | 85.8 | Confident | 85.9 | Confident | 111 Ų | 111 | 91.5 Ų | 91.5 | 52% | 0.519 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -59.7 | -42.9 | 175.5 | -73.2 | 175.5 | -14.2 | 0 | 0 | 112.8 | V449 A455 E456 E457 | V449-Q453 HydrophobicContact CG1-CG 4.46Å; V449-Q453 WeakPolarHBondContact O-CB 3.4Å; V449-Q453 WeakPolarHBondContact O-CG 3.48Å; V449-Q453 PolarHBondContact O-N 2.94Å; Q453-A455 VanDerWaalsContact C-N 3.33Å; Q453-A455 PolarHBondContact O-N 3.44Å; Q453-E456 PolarHBondContact O-N 3.1Å; Q453-E457 WeakPolarHBondContact O-CG 3.45Å; Q453-E457 PolarHBondContact O-N 3.3Å |
| 454 | K | 87.8 | Confident | 85.5 | Confident | 151 Ų | 151 | 96.3 Ų | 96.3 | 66% | 0.657 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -65.7 | -35.6 | 175.9 | -75.7 | 178.2 | -179.7 | -168.4 | 0 | 112.7 | A450 K451 E452 K458 | A450-K454 WeakPolarHBondContact O-CB 3.45Å; A450-K454 VanDerWaalsContact O-CG 3.24Å; A450-K454 WeakPolarHBondContact O-CG 3.42Å; A450-K454 PolarHBondContact O-N 3.12Å; K451-K454 PolarHBondContact O-N 3.36Å; E452-K454 PolarHBondContact O-N 2.92Å; K454-K458 WeakPolarHBondContact O-CB 3.24Å; K454-K458 PolarHBondContact O-N 3.27Å |
| 455 | A | 86.6 | Confident | 84.9 | Confident | 48 Ų | 48 | 98 Ų | 98 | 40% | 0.397 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -69 | -41.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | K451 E452 Q453 K458 M459 | K451-A455 WeakPolarHBondContact O-CB 3.39Å; K451-A455 PolarHBondContact O-N 3.03Å; E452-A455 WeakPolarHBondContact O-CB 3.23Å; E452-A455 PolarHBondContact O-N 3.33Å; E452-A455 VanDerWaalsContact O-N 3.13Å; Q453-A455 VanDerWaalsContact C-N 3.33Å; Q453-A455 PolarHBondContact O-N 3.44Å; A455-K458 PolarHBondContact O-N 3.08Å; A455-M459 WeakPolarHBondContact O-CG 3.34Å; A455-M459 PolarHBondContact O-N 3.03Å |
| 456 | E | 85.7 | Confident | 84.3 | Confident | 136 Ų | 136 | 103.6 Ų | 103.6 | 64% | 0.636 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.5 | -43.2 | 174.2 | -72.8 | 177.6 | 177.1 | 0 | 0 | 112 | E452 Q453 K458 M459 R460 | E452-E456 WeakPolarHBondContact O-CG 3.3Å; E452-E456 PolarHBondContact O-N 3.09Å; Q453-E456 PolarHBondContact O-N 3.1Å; E456-K458 VanDerWaalsContact C-N 3.31Å; E456-K458 PolarHBondContact O-N 3.4Å; E456-M459 PolarHBondContact O-N 2.94Å; E456-R460 WeakPolarHBondContact O-CB 3.48Å; E456-R460 PolarHBondContact O-N 3.27Å |
| 457 | E | 85.4 | Confident | 83.7 | Confident | 115 Ų | 115 | 107.1 Ų | 107.1 | 54% | 0.537 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 174 | -78.3 | -177.4 | 165.8 | 0 | 0 | 112 | Q453 R460 N461 | Q453-E457 WeakPolarHBondContact O-CG 3.45Å; Q453-E457 PolarHBondContact O-N 3.3Å; E457-R460 PolarHBondContact O-N 3.43Å; E457-N461 WeakPolarHBondContact O-CB 3.25Å; E457-N461 PolarHBondContact O-N 3.05Å; E457-N461 PolarHBondContact O-OD1 2.9Å |
| 458 | K | 86.3 | Confident | 83.2 | Confident | 129 Ų | 129 | 101.4 Ų | 101.4 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.1 | -49.1 | 176.1 | -163.6 | 178.5 | -174 | -90 | 0 | 111.3 | K454 A455 E456 R460 N461 E462 | K454-K458 WeakPolarHBondContact O-CB 3.24Å; K454-K458 PolarHBondContact O-N 3.27Å; A455-K458 PolarHBondContact O-N 3.08Å; E456-K458 VanDerWaalsContact C-N 3.31Å; E456-K458 PolarHBondContact O-N 3.4Å; K458-R460 VanDerWaalsContact C-N 3.3Å; K458-R460 PolarHBondContact O-N 3.36Å; K458-N461 PolarHBondContact O-N 2.93Å; K458-E462 IonicContact NZ-OE1 2.72Å; K458-E462 PolarHBondContact NZ-OE1 3.41Å; K458-E462 WeakPolarHBondContact O-CB 3.41Å; K458-E462 WeakPolarHBondContact O-CG 3.34Å; K458-E462 PolarHBondContact O-N 3.25Å |
| 459 | M | 83.9 | Confident | 82.9 | Confident | 138 Ų | 138 | 102.9 Ų | 102.9 | 68% | 0.68 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61 | -37.8 | 176.3 | -71.8 | -172.2 | -178.5 | 0 | 0 | 112.2 | A455 E456 G463 | A455-M459 WeakPolarHBondContact O-CG 3.34Å; A455-M459 PolarHBondContact O-N 3.03Å; E456-M459 PolarHBondContact O-N 2.94Å; M459-G463 PolarHBondContact O-N 3.42Å |
| 460 | R | 84.6 | Confident | 82.4 | Confident | 148 Ų | 148 | 105.9 Ų | 105.9 | 56% | 0.558 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.7 | -36.1 | 176.9 | -161.3 | -173.2 | 84.7 | -161.8 | 4.9 | 112.3 | E456 E457 K458 K464 | E456-R460 WeakPolarHBondContact O-CB 3.48Å; E456-R460 PolarHBondContact O-N 3.27Å; E457-R460 PolarHBondContact O-N 3.43Å; K458-R460 VanDerWaalsContact C-N 3.3Å; K458-R460 PolarHBondContact O-N 3.36Å; R460-K464 VanDerWaalsContact O-CG 3.32Å; R460-K464 WeakPolarHBondContact O-CG 3.29Å; R460-K464 PolarHBondContact O-N 3.16Å; R460-K464 VanDerWaalsContact O-N 3.17Å |
| 461 | N | 83.9 | Confident | 81.8 | Confident | 80 Ų | 80 | 109.4 Ų | 109.4 | 43% | 0.428 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -73.4 | -40.6 | 176.9 | -69.9 | -9.7 | 0 | 0 | 0 | 111 | E457 K458 K464 E465 | E457-N461 WeakPolarHBondContact O-CB 3.25Å; E457-N461 PolarHBondContact O-N 3.05Å; E457-N461 PolarHBondContact O-OD1 2.9Å; K458-N461 PolarHBondContact O-N 2.93Å; N461-K464 PolarHBondContact O-N 3.35Å; N461-E465 PolarHBondContact O-N 3.42Å |
| 462 | E | 81.9 | Confident | 81.1 | Confident | 84 Ų | 84 | 107.7 Ų | 107.7 | 39% | 0.393 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 173 | -72.7 | 169.2 | 178.2 | 0 | 0 | 111.2 | K458 K464 E465 E466 | K458-E462 IonicContact NZ-OE1 2.72Å; K458-E462 PolarHBondContact NZ-OE1 3.41Å; K458-E462 WeakPolarHBondContact O-CB 3.41Å; K458-E462 WeakPolarHBondContact O-CG 3.34Å; K458-E462 PolarHBondContact O-N 3.25Å; E462-K464 VanDerWaalsContact C-N 3.32Å; E462-K464 PolarHBondContact O-N 3.25Å; E462-E465 PolarHBondContact O-N 3.35Å; E462-E466 PolarHBondContact O-N 2.96Å |
| 463 | G | 79.6 | Confident | 80.5 | Confident | 30 Ų | 30 | 106.2 Ų | 106.2 | 31% | 0.309 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.9 | -33.4 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | M459 E467 | M459-G463 PolarHBondContact O-N 3.42Å; G463-E467 WeakPolarHBondContact O-CG 3.01Å; G463-E467 PolarHBondContact O-N 3.39Å |
| 464 | K | 79.2 | Confident | 79.8 | Confident | 109 Ų | 109 | 107.6 Ų | 107.6 | 47% | 0.474 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -69.8 | -40.2 | 173.1 | -77.5 | -179.2 | 176 | -158.6 | 0 | 112.2 | R460 N461 E462 E467 T468 | R460-K464 VanDerWaalsContact O-CG 3.32Å; R460-K464 WeakPolarHBondContact O-CG 3.29Å; R460-K464 PolarHBondContact O-N 3.16Å; R460-K464 VanDerWaalsContact O-N 3.17Å; N461-K464 PolarHBondContact O-N 3.35Å; E462-K464 VanDerWaalsContact C-N 3.32Å; E462-K464 PolarHBondContact O-N 3.25Å; K464-E467 PolarHBondContact O-N 3.46Å; K464-T468 WeakPolarHBondContact O-CB 3.41Å; K464-T468 PolarHBondContact O-N 3.46Å; K464-T468 PolarHBondContact O-OG1 2.75Å |
| 465 | E | 76.4 | Confident | 79 | Confident | 126 Ų | 126 | 106.3 Ų | 106.3 | 59% | 0.589 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.4 | -41.3 | 175.2 | -75.7 | 176.3 | -175.7 | 0 | 0 | 110.9 | N461 E462 T468 N469 | N461-E465 PolarHBondContact O-N 3.42Å; E462-E465 PolarHBondContact O-N 3.35Å; E465-T468 PolarHBondContact O-N 2.62Å; E465-N469 WeakPolarHBondContact O-CB 3.28Å; E465-N469 PolarHBondContact O-N 2.85Å; E465-N469 PolarHBondContact O-ND2 2.96Å; E465-N469 VanDerWaalsContact O-ND2 3.14Å |
| 466 | E | 74.7 | Confident | 78.3 | Confident | 134 Ų | 134 | 110.5 Ų | 110.5 | 63% | 0.626 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.6 | -45.2 | 173.6 | -76.7 | -177.1 | 170.5 | 0 | 0 | 112.8 | E462 T468 N469 L470 | E462-E466 PolarHBondContact O-N 2.96Å; E466-T468 VanDerWaalsContact C-N 3.33Å; E466-T468 PolarHBondContact O-N 3.27Å; E466-N469 PolarHBondContact O-N 3.31Å; E466-L470 WeakPolarHBondContact O-CB 3.46Å; E466-L470 WeakPolarHBondContact O-CD1 3.12Å; E466-L470 VanDerWaalsContact O-CG 3.31Å; E466-L470 WeakPolarHBondContact O-CG 3.21Å; E466-L470 PolarHBondContact O-N 3.4Å |
| 467 | E | 75.1 | Confident | 77.4 | Confident | 130 Ų | 130 | 106.7 Ų | 106.7 | 61% | 0.607 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.9 | -42.3 | 173.9 | -80.7 | 179.3 | 168.2 | 0 | 0 | 111.9 | G463 K464 L470 E471 | G463-E467 WeakPolarHBondContact O-CG 3.01Å; G463-E467 PolarHBondContact O-N 3.39Å; K464-E467 PolarHBondContact O-N 3.46Å; E467-L470 PolarHBondContact O-N 2.97Å; E467-E471 PolarHBondContact O-N 3.49Å |
| 468 | T | 77.4 | Confident | 76.4 | Confident | 69 Ų | 69 | 107.1 Ų | 107.1 | 42% | 0.423 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.5 | -43 | 179.8 | -44.8 | 0 | 0 | 0 | 0 | 111.1 | K464 E465 E466 L470 E471 E472 | K464-T468 WeakPolarHBondContact O-CB 3.41Å; K464-T468 PolarHBondContact O-N 3.46Å; K464-T468 PolarHBondContact O-OG1 2.75Å; E465-T468 PolarHBondContact O-N 2.62Å; E466-T468 VanDerWaalsContact C-N 3.33Å; E466-T468 PolarHBondContact O-N 3.27Å; T468-L470 VanDerWaalsContact C-N 3.34Å; T468-L470 PolarHBondContact O-N 3Å; T468-E471 PolarHBondContact O-N 3.04Å; T468-E472 WeakPolarHBondContact O-CG 3.43Å; T468-E472 PolarHBondContact O-N 3.15Å |
| 469 | N | 78.8 | Confident | 75.2 | Confident | 97 Ų | 97 | 106.3 Ų | 106.3 | 52% | 0.519 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65.8 | -35.9 | 177.6 | -69.3 | -25.2 | 0 | 0 | 0 | 112.1 | E465 E466 E472 A473 | E465-N469 WeakPolarHBondContact O-CB 3.28Å; E465-N469 PolarHBondContact O-N 2.85Å; E465-N469 PolarHBondContact O-ND2 2.96Å; E465-N469 VanDerWaalsContact O-ND2 3.14Å; E466-N469 PolarHBondContact O-N 3.31Å; N469-E472 PolarHBondContact O-N 2.94Å; N469-A473 WeakPolarHBondContact O-CB 3.4Å; N469-A473 PolarHBondContact O-N 3.06Å |
| 470 | L | 75.9 | Confident | 73.9 | Confident | 117 Ų | 117 | 105.4 Ų | 105.4 | 61% | 0.613 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -67.1 | -42.3 | 174.2 | -76.2 | 163.5 | 0 | 0 | 0 | 111.8 | E466 E467 T468 E472 A473 E474 | E466-L470 WeakPolarHBondContact O-CB 3.46Å; E466-L470 WeakPolarHBondContact O-CD1 3.12Å; E466-L470 VanDerWaalsContact O-CG 3.31Å; E466-L470 WeakPolarHBondContact O-CG 3.21Å; E466-L470 PolarHBondContact O-N 3.4Å; E467-L470 PolarHBondContact O-N 2.97Å; T468-L470 VanDerWaalsContact C-N 3.34Å; T468-L470 PolarHBondContact O-N 3Å; L470-E472 VanDerWaalsContact C-N 3.33Å; L470-E472 PolarHBondContact O-N 3.24Å; L470-A473 PolarHBondContact O-N 2.87Å; L470-E474 PolarHBondContact O-N 3.03Å |
| 471 | E | 73.8 | Confident | 72.5 | Confident | 115 Ų | 115 | 103.1 Ų | 103.1 | 54% | 0.537 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.2 | -36.4 | 174.6 | -77.7 | -170.9 | 178 | 0 | 0 | 112.7 | E467 T468 K475 | E467-E471 PolarHBondContact O-N 3.49Å; T468-E471 PolarHBondContact O-N 3.04Å; E471-K475 VanDerWaalsContact O-CG 3.29Å; E471-K475 WeakPolarHBondContact O-CG 3.24Å; E471-K475 PolarHBondContact O-N 3.26Å; E471-K475 VanDerWaalsContact O-N 3.13Å |
| 472 | E | 73.6 | Confident | 71 | Confident | 110 Ų | 110 | 103.3 Ų | 103.3 | 51% | 0.514 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -68.2 | -44 | 174.5 | -75.3 | -176.6 | 173 | 0 | 0 | 111.5 | T468 N469 L470 E474 K475 E476 | T468-E472 WeakPolarHBondContact O-CG 3.43Å; T468-E472 PolarHBondContact O-N 3.15Å; N469-E472 PolarHBondContact O-N 2.94Å; L470-E472 VanDerWaalsContact C-N 3.33Å; L470-E472 PolarHBondContact O-N 3.24Å; E472-E474 PolarHBondContact O-N 3.05Å; E472-K475 PolarHBondContact O-N 3.33Å; E472-E476 PolarHBondContact O-N 3.36Å |
| 473 | A | 73.9 | Confident | 69.5 | Low | 53 Ų | 53 | 104.2 Ų | 104.2 | 44% | 0.438 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64 | -37.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | N469 L470 E476 A477 | N469-A473 WeakPolarHBondContact O-CB 3.4Å; N469-A473 PolarHBondContact O-N 3.06Å; L470-A473 PolarHBondContact O-N 2.87Å; A473-E476 PolarHBondContact O-N 2.71Å; A473-A477 WeakPolarHBondContact O-CB 3.47Å; A473-A477 PolarHBondContact O-N 3.31Å |
| 474 | E | 71.6 | Confident | 67.8 | Low | 140 Ų | 140 | 109.3 Ų | 109.3 | 65% | 0.654 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.2 | -36.8 | 173.3 | -80.7 | -172.1 | 165.4 | 0 | 0 | 112.3 | L470 E472 N478 | L470-E474 PolarHBondContact O-N 3.03Å; E472-E474 PolarHBondContact O-N 3.05Å; E474-N478 WeakPolarHBondContact O-CB 3.39Å; E474-N478 PolarHBondContact O-N 2.67Å |
| 475 | K | 71.4 | Confident | 66 | Low | 125 Ų | 125 | 109.7 Ų | 109.7 | 54% | 0.543 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -67.8 | -40.7 | 174.9 | -76.6 | 169.3 | -173.4 | 158.4 | 0 | 112 | E471 E472 N479 | E471-K475 VanDerWaalsContact O-CG 3.29Å; E471-K475 WeakPolarHBondContact O-CG 3.24Å; E471-K475 PolarHBondContact O-N 3.26Å; E471-K475 VanDerWaalsContact O-N 3.13Å; E472-K475 PolarHBondContact O-N 3.33Å; K475-N479 WeakPolarHBondContact O-CB 3.29Å; K475-N479 PolarHBondContact O-N 3.44Å |
| 476 | E | 70.9 | Confident | 64.3 | Low | 136 Ų | 136 | 113.1 Ų | 113.1 | 64% | 0.636 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -64.8 | -45.6 | 174.5 | -74.5 | -173.3 | 162.2 | 0 | 0 | 111.3 | E472 A473 N478 N479 D480 | E472-E476 PolarHBondContact O-N 3.36Å; A473-E476 PolarHBondContact O-N 2.71Å; E476-N478 VanDerWaalsContact C-N 3.33Å; E476-N478 PolarHBondContact O-N 3.25Å; E476-N479 PolarHBondContact O-N 3.04Å; E476-N479 VanDerWaalsContact O-N 3.13Å; E476-D480 PolarHBondContact O-N 3.47Å |
| 477 | A | 67.9 | Low | 62.6 | Low | 55 Ų | 55 | 116 Ų | 116 | 46% | 0.455 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -61.4 | -38.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | A473 V481 | A473-A477 WeakPolarHBondContact O-CB 3.47Å; A473-A477 PolarHBondContact O-N 3.31Å; A477-V481 VanDerWaalsContact O-CG2 3.31Å; A477-V481 WeakPolarHBondContact O-CG2 3.47Å; A477-V481 PolarHBondContact O-N 3.17Å |
| 478 | N | 64 | Low | 61.1 | Low | 124 Ų | 124 | 115.3 Ų | 115.3 | 66% | 0.663 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70 | -33.1 | 175.2 | -106.7 | -13.2 | 0 | 0 | 0 | 113 | E474 E476 A482 | E474-N478 WeakPolarHBondContact O-CB 3.39Å; E474-N478 PolarHBondContact O-N 2.67Å; E476-N478 VanDerWaalsContact C-N 3.33Å; E476-N478 PolarHBondContact O-N 3.25Å; N478-A482 PolarHBondContact O-N 3.38Å |
| 479 | N | 60.4 | Low | 59.2 | Low | 113 Ų | 113 | 118.7 Ų | 118.7 | 60% | 0.604 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -70.5 | -39.2 | 175.5 | -81.2 | -18.2 | 0 | 0 | 0 | 111.6 | K475 E476 V481 A482 T483 | K475-N479 WeakPolarHBondContact O-CB 3.29Å; K475-N479 PolarHBondContact O-N 3.44Å; E476-N479 PolarHBondContact O-N 3.04Å; E476-N479 VanDerWaalsContact O-N 3.13Å; N479-V481 VanDerWaalsContact C-N 3.32Å; N479-V481 PolarHBondContact O-N 3.01Å; N479-A482 WeakPolarHBondContact O-CB 3.29Å; N479-A482 PolarHBondContact O-N 3.42Å; N479-A482 VanDerWaalsContact O-N 3.15Å; N479-T483 PolarHBondContact O-OG1 3.32Å |
| 480 | D | 57.4 | Low | 57.3 | Low | 118 Ų | 118 | 123.2 Ų | 123.2 | 63% | 0.631 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -66 | -33.3 | 178.5 | -79.4 | -21.8 | 0 | 0 | 0 | 112.7 | E476 A482 T483 | E476-D480 PolarHBondContact O-N 3.47Å; D480-A482 VanDerWaalsContact C-N 3.3Å; D480-A482 PolarHBondContact O-N 3.11Å; D480-T483 WeakPolarHBondContact CA-OG1 3.34Å; D480-T483 PolarHBondContact O-N 2.8Å; D480-T483 PolarHBondContact O-OG1 3.04Å |
| 481 | V | 55.5 | Low | 55.4 | Low | 100 Ų | 100 | 125.8 Ų | 125.8 | 61% | 0.606 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -68.4 | -28 | 174.5 | 175.3 | 0 | 0 | 0 | 0 | 112.2 | A477 N479 T483 | A477-V481 VanDerWaalsContact O-CG2 3.31Å; A477-V481 WeakPolarHBondContact O-CG2 3.47Å; A477-V481 PolarHBondContact O-N 3.17Å; N479-V481 VanDerWaalsContact C-N 3.32Å; N479-V481 PolarHBondContact O-N 3.01Å; V481-T483 VanDerWaalsContact C-N 3.29Å; V481-T483 PolarHBondContact O-N 3.36Å |
| 482 | A | 52.4 | Low | 53.6 | Low | 84 Ų | 84 | 123.9 Ų | 123.9 | 69% | 0.694 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.6 | -12.5 | 177 | 0 | 0 | 0 | 0 | 0 | 113.8 | N478 N479 D480 | N478-A482 PolarHBondContact O-N 3.38Å; N479-A482 WeakPolarHBondContact O-CB 3.29Å; N479-A482 PolarHBondContact O-N 3.42Å; N479-A482 VanDerWaalsContact O-N 3.15Å; D480-A482 VanDerWaalsContact C-N 3.3Å; D480-A482 PolarHBondContact O-N 3.11Å |
| 483 | T | 49.5 | Very low | 51.7 | Low | 104 Ų | 104 | 125.1 Ų | 125.1 | 64% | 0.638 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | 7.1 | -176.7 | 28.6 | 0 | 0 | 0 | 0 | 115.8 | N479 D480 V481 | N479-T483 PolarHBondContact O-OG1 3.32Å; D480-T483 WeakPolarHBondContact CA-OG1 3.34Å; D480-T483 PolarHBondContact O-N 2.8Å; D480-T483 PolarHBondContact O-OG1 3.04Å; V481-T483 VanDerWaalsContact C-N 3.29Å; V481-T483 PolarHBondContact O-N 3.36Å |
| 484 | L | 44.2 | Very low | 49.9 | Very low | 137 Ų | 137 | 132.8 Ų | 132.8 | 72% | 0.717 | 73% | 0.732 | S | S | * | * | trans | -68.1 | 124.7 | 172 | -77.1 | 163.6 | 0 | 0 | 0 | 110.6 | Q486 | L484-Q486 PolarHBondContact O-N 3.03Š| ||
| 485 | P | 42.2 | Very low | 48.2 | Very low | 116 Ų | 116 | 134.9 Ų | 134.9 | 75% | 0.753 | 74% | 0.742 | S | S | * | * | trans | -67.3 | 125.3 | 179.2 | -9.4 | 22.6 | 0 | 0 | 0 | 109.9 | K487 | P485-K487 PolarHBondContact O-N 3.41Š| ||
| 486 | Q | 40 | Very low | 46.9 | Very low | 198 Ų | 198 | 137.6 Ų | 137.6 | 93% | 0.925 | 76% | 0.757 | S | S | * | * | trans | -58.9 | 101.1 | 162.3 | -83.1 | -178.1 | -28.7 | 0 | 0 | 108.3 | L484 S488 | L484-Q486 PolarHBondContact O-N 3.03Å; Q486-S488 PolarHBondContact O-N 2.95Å | ||
| 487 | K | 39.7 | Very low | 45.2 | Very low | 195 Ų | 195 | 139.6 Ų | 139.6 | 85% | 0.848 | 77% | 0.766 | S | S | * | * | trans | -71.1 | 109.3 | 165.4 | -122.6 | -180 | -179.1 | -178.9 | 0 | 107 | P485 T489 | P485-K487 PolarHBondContact O-N 3.41Å; K487-T489 PolarHBondContact O-N 3.24Å | ||
| 488 | S | 42.5 | Very low | 43.8 | Very low | 115 Ų | 115 | 141.8 Ų | 141.8 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | -56 | 112.1 | 170.9 | 50.4 | 0 | 0 | 0 | 0 | 110.7 | Q486 | Q486-S488 PolarHBondContact O-N 2.95Š| ||
| 489 | T | 37.6 | Very low | 42.7 | Very low | 140 Ų | 140 | 146.5 Ų | 146.5 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | trans | -109.1 | 88.8 | 157.7 | 34.5 | 0 | 0 | 0 | 0 | 107.8 | K487 | K487-T489 PolarHBondContact O-N 3.24Š| ||
| 490 | E | 38.8 | Very low | 41.4 | Very low | 192 Ų | 192 | 153.5 Ų | 153.5 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | trans | -112 | 93.8 | 154.5 | -84.5 | -171.6 | 156.7 | 0 | 0 | 106.6 | ||||
| 491 | D | 35.8 | Very low | 40.6 | Very low | 171 Ų | 171 | 155.3 Ų | 155.3 | 91% | 0.914 | 83% | 0.83 | S | S | * | * | trans | -134 | 102.5 | 160.9 | -102.4 | -30.6 | 0 | 0 | 0 | 108.3 | ||||
| 492 | G | 35.4 | Very low | 39.8 | Very low | 75 Ų | 75 | 158.2 Ų | 158.2 | 77% | 0.773 | 84% | 0.841 | S | S | * | * | trans | 55.3 | 95.5 | 136.5 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 493 | V | 33.9 | Very low | 39.1 | Very low | 137 Ų | 137 | 162.3 Ų | 162.3 | 83% | 0.83 | 85% | 0.85 | S | S | * | * | trans | -138.8 | 106.2 | 136 | -174.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 494 | K | 36.2 | Very low | 38.5 | Very low | 213 Ų | 213 | 165.8 Ų | 165.8 | 93% | 0.926 | 86% | 0.862 | S | S | * | * | trans | -117.8 | 118.7 | 155.9 | -89.2 | -171.3 | 176.4 | -179.4 | 0 | 106.9 | ||||
| 495 | E | 37.6 | Very low | 38.1 | Very low | 185 Ų | 185 | 167.6 Ų | 167.6 | 86% | 0.864 | 87% | 0.871 | S | S | * | * | trans | -63.5 | 153 | 174.8 | -75.5 | 171.7 | 142.5 | 0 | 0 | 112 | ||||
| 496 | E | 42.9 | Very low | 37.8 | Very low | 182 Ų | 182 | 171 Ų | 171 | 85% | 0.85 | 88% | 0.879 | S | S | * | * | trans | -65.1 | 151.9 | -179.2 | -65.2 | 172.1 | 131.5 | 0 | 0 | 113.5 | ||||
| 497 | E | 36.3 | Very low | 37.7 | Very low | 178 Ų | 178 | 169.1 Ų | 169.1 | 83% | 0.832 | 88% | 0.876 | S | S | * | * | 149.2 | 104.8 | 124.5 | -80.1 | -171.1 | 155.6 | 0 | 0 | 113.9 | |||||
| 498 | S | 38.2 | Very low | 37.5 | Very low | 100 Ų | 100 | 167.1 Ų | 167.1 | 70% | 0.699 | 88% | 0.878 | S | S | * | * | 33 | 116.5 | 120.9 | 176.8 | 0 | 0 | 0 | 0 | 121.2 | |||||
| 499 | Y | 39.4 | Very low | 37.1 | Very low | 224 Ų | 224 | 171.4 Ų | 171.4 | 88% | 0.878 | 88% | 0.884 | S | S | * | * | trans | 45.5 | 109.3 | 143 | -66.2 | -89.8 | 0 | 0 | 0 | 119.5 | ||||
| 500 | M | 33.2 | Very low | 37.1 | Very low | 260 Ų | 260 | 174.3 Ų | 174.3 | 100% | 1.281 | 89% | 0.886 | S | S | * | * | 179.4 | 0 | 90.1 | -158.6 | -179.2 | -76 | 0 | 0 | 110.3 |
Retrieved 500 of 500 residues in 282.9 ms
(Link to these results)