| 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 | F | 42 | Very low | 57.3 | Low | 247 Ų | 247 | 131.7 Ų | 131.7 | 100% | 1.083 | 66% | 0.66 | S | S | * | * | 0 | 88.5 | 0 | -81.3 | -93.5 | 0 | 0 | 0 | 109.9 | |||||
| 2 | R | 40.9 | Very low | 59.4 | Low | 251 Ų | 251 | 129.4 Ų | 129.4 | 95% | 0.947 | 65% | 0.645 | S | S | * | * | trans | -118 | 86 | 160.5 | -87.1 | -173.3 | -179 | -177 | 0.5 | 105.8 | A4 | R2-A4 VanDerWaalsContact C-N 3.29Å; R2-A4 PolarHBondContact O-N 3.33Å; R2-A4 VanDerWaalsContact O-N 3.13Å | ||
| 3 | F | 48.7 | Very low | 61.6 | Low | 186 Ų | 186 | 123.8 Ų | 123.8 | 82% | 0.816 | 63% | 0.631 | S | S | * | * | trans | -67.8 | 102.8 | 154.8 | -93 | -87.6 | 0 | 0 | 0 | 104.7 | T5 | F3-T5 PolarHBondContact O-N 2.95Š| ||
| 4 | A | 52.7 | Low | 63.5 | Low | 85 Ų | 85 | 120.9 Ų | 120.9 | 70% | 0.702 | 61% | 0.614 | S | S | * | * | trans | -58.4 | 111.3 | 165.4 | 0 | 0 | 0 | 0 | 0 | 106 | R2 M6 | R2-A4 VanDerWaalsContact C-N 3.29Å; R2-A4 PolarHBondContact O-N 3.33Å; R2-A4 VanDerWaalsContact O-N 3.13Å; A4-M6 PolarHBondContact O-N 3.3Å | ||
| 5 | T | 56.1 | Low | 65.3 | Low | 137 Ų | 137 | 124.1 Ų | 124.1 | 84% | 0.84 | 62% | 0.616 | S | S | * | * | trans | -66.6 | 86.4 | 170.6 | 43.2 | 0 | 0 | 0 | 0 | 107.3 | F3 S7 | F3-T5 PolarHBondContact O-N 2.95Å; T5-S7 PolarHBondContact O-N 2.74Å | ||
| 6 | M | 54.1 | Low | 67 | Low | 75 Ų | 75 | 123.6 Ų | 123.6 | 37% | 0.369 | 61% | 0.611 | S | S | . | * | trans | -59.7 | 127.6 | 163.3 | -75.4 | 171.5 | 75.7 | 0 | 0 | 107.3 | A4 F11 E14 | A4-M6 PolarHBondContact O-N 3.3Å; M6-F11 HydrophobicContact CB-CD2 4.13Å; M6-F11 HydrophobicContact CB-CE1 3.94Å; M6-F11 HydrophobicContact CB-CE2 3.43Å; M6-F11 VanDerWaalsContact CB-CE2 3.43Å; M6-F11 HydrophobicContact CB-CZ 3.34Å; M6-F11 HydrophobicContact CE-CD1 4Å; M6-F11 HydrophobicContact CE-CE1 3.83Å; M6-F11 HydrophobicContact CE-CZ 4.43Å; M6-F11 HydrophobicContact CG-CE1 4.47Å; M6-F11 HydrophobicContact CG-CZ 4.2Å; M6-F11 VanDerWaalsContact O-CE2 3.24Å; M6-F11 WeakPolarHBondContact O-CE2 3.42Å; M6-F11 HydrophobicContact SD-CD1 4.48Å; M6-F11 HydrophobicContact SD-CE1 3.71Å; M6-F11 HydrophobicContact SD-CZ 3.96Å; M6-E14 WeakPolarHBondContact CE-OE1 3.49Å; M6-E14 WeakPolarHBondContact CE-OE2 3.33Å | ||
| 7 | S | 59.6 | Low | 68.6 | Low | 67 Ų | 67 | 123.4 Ų | 123.4 | 47% | 0.469 | 61% | 0.608 | S | S | . | * | trans | -66.6 | 142.1 | 176.7 | 47 | 0 | 0 | 0 | 0 | 110.1 | T5 P9 T10 | T5-S7 PolarHBondContact O-N 2.74Å; S7-P9 VanDerWaalsContact C-CD 3.42Å; S7-P9 VanDerWaalsContact C-N 3.31Å; S7-P9 VanDerWaalsContact O-N 3.16Å; S7-T10 WeakPolarHBondContact O-CB 3.35Å; S7-T10 PolarHBondContact O-N 3.26Å; S7-T10 PolarHBondContact O-OG1 2.95Å; S7-T10 PolarHBondContact OG-OG1 3.1Å | ||
| 8 | K | 60 | Low | 70 | Confident | 152 Ų | 152 | 121.6 Ų | 121.6 | 66% | 0.661 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -41.4 | -45.5 | 175.5 | -167.9 | 179.2 | 176.5 | -172.7 | 0 | 115.3 | T10 F11 E12 | K8-T10 VanDerWaalsContact C-N 3.26Å; K8-T10 PolarHBondContact O-N 2.97Å; K8-F11 PolarHBondContact O-N 3.06Å; K8-E12 VanDerWaalsContact CE-OE1 3.3Å; K8-E12 WeakPolarHBondContact CE-OE1 3.46Å; K8-E12 PolarHBondContact O-N 2.99Å |
| 9 | P | 63.9 | Low | 71.4 | Confident | 86 Ų | 86 | 119 Ų | 119 | 56% | 0.558 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.7 | -24.5 | 176.5 | 21.8 | -34.7 | 0 | 0 | 0 | 114.8 | S7 A13 | S7-P9 VanDerWaalsContact C-CD 3.42Å; S7-P9 VanDerWaalsContact C-N 3.31Å; S7-P9 VanDerWaalsContact O-N 3.16Å; P9-A13 WeakPolarHBondContact O-CB 3.27Å; P9-A13 PolarHBondContact O-N 2.94Å |
| 10 | T | 73.7 | Confident | 72.5 | Confident | 55 Ų | 55 | 119.9 Ų | 119.9 | 34% | 0.337 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -72.4 | -37.1 | 176.1 | -21 | 0 | 0 | 0 | 0 | 111.2 | S7 K8 E14 | S7-T10 WeakPolarHBondContact O-CB 3.35Å; S7-T10 PolarHBondContact O-N 3.26Å; S7-T10 PolarHBondContact O-OG1 2.95Å; S7-T10 PolarHBondContact OG-OG1 3.1Å; K8-T10 VanDerWaalsContact C-N 3.26Å; K8-T10 PolarHBondContact O-N 2.97Å; T10-E14 WeakPolarHBondContact O-CB 3.47Å; T10-E14 VanDerWaalsContact O-CG 3.31Å; T10-E14 WeakPolarHBondContact O-CG 3.5Å; T10-E14 PolarHBondContact O-N 3.46Å |
| 11 | F | 78.4 | Confident | 73.6 | Confident | 108 Ų | 108 | 119.8 Ų | 119.8 | 47% | 0.474 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69.7 | -38.2 | 177.1 | -70.4 | -66.9 | 0 | 0 | 0 | 112.9 | M6 K8 W15 | M6-F11 HydrophobicContact CB-CD2 4.13Å; M6-F11 HydrophobicContact CB-CE1 3.94Å; M6-F11 HydrophobicContact CB-CE2 3.43Å; M6-F11 VanDerWaalsContact CB-CE2 3.43Å; M6-F11 HydrophobicContact CB-CZ 3.34Å; M6-F11 HydrophobicContact CE-CD1 4Å; M6-F11 HydrophobicContact CE-CE1 3.83Å; M6-F11 HydrophobicContact CE-CZ 4.43Å; M6-F11 HydrophobicContact CG-CE1 4.47Å; M6-F11 HydrophobicContact CG-CZ 4.2Å; M6-F11 VanDerWaalsContact O-CE2 3.24Å; M6-F11 WeakPolarHBondContact O-CE2 3.42Å; M6-F11 HydrophobicContact SD-CD1 4.48Å; M6-F11 HydrophobicContact SD-CE1 3.71Å; M6-F11 HydrophobicContact SD-CZ 3.96Å; K8-F11 PolarHBondContact O-N 3.06Å; F11-W15 WeakPolarHBondContact O-CB 3.49Å; F11-W15 PolarHBondContact O-N 3.31Å |
| 12 | E | 83.2 | Confident | 76.1 | Confident | 104 Ų | 104 | 113.8 Ų | 113.8 | 49% | 0.486 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.3 | -41.4 | 178.1 | -71.3 | 170 | -179.3 | 0 | 0 | 110.9 | K8 W15 E16 | K8-E12 VanDerWaalsContact CE-OE1 3.3Å; K8-E12 WeakPolarHBondContact CE-OE1 3.46Å; K8-E12 PolarHBondContact O-N 2.99Å; E12-W15 PolarHBondContact O-N 3.49Å; E12-E16 WeakPolarHBondContact O-CG 3.28Å; E12-E16 PolarHBondContact O-N 2.98Å |
| 13 | A | 87.2 | Confident | 78.7 | Confident | 56 Ų | 56 | 107 Ų | 107 | 46% | 0.463 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.8 | -45.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | P9 W15 E16 E17 | P9-A13 WeakPolarHBondContact O-CB 3.27Å; P9-A13 PolarHBondContact O-N 2.94Å; A13-W15 VanDerWaalsContact C-N 3.31Å; A13-W15 PolarHBondContact O-N 3.21Å; A13-E16 PolarHBondContact O-N 3.15Å; A13-E17 PolarHBondContact O-N 3.47Å |
| 14 | E | 88.6 | Confident | 81 | Confident | 83 Ų | 83 | 104.7 Ų | 104.7 | 39% | 0.388 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.4 | -38.8 | 174.9 | -75.7 | 175.3 | -167.9 | 0 | 0 | 111.7 | M6 T10 E17 I18 | M6-E14 WeakPolarHBondContact CE-OE1 3.49Å; M6-E14 WeakPolarHBondContact CE-OE2 3.33Å; T10-E14 WeakPolarHBondContact O-CB 3.47Å; T10-E14 VanDerWaalsContact O-CG 3.31Å; T10-E14 WeakPolarHBondContact O-CG 3.5Å; T10-E14 PolarHBondContact O-N 3.46Å; E14-E17 PolarHBondContact O-N 2.93Å; E14-I18 VanDerWaalsContact O-CG1 3.29Å; E14-I18 WeakPolarHBondContact O-CG1 3.44Å; E14-I18 PolarHBondContact O-N 3.04Å |
| 15 | W | 90.7 | Very high | 83 | Confident | 170 Ų | 170 | 105.9 Ų | 105.9 | 64% | 0.644 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.1 | -40.6 | 176.1 | -175.8 | -99.6 | 0 | 0 | 0 | 112.4 | F11 E12 A13 E17 I18 E19 | F11-W15 WeakPolarHBondContact O-CB 3.49Å; F11-W15 PolarHBondContact O-N 3.31Å; E12-W15 PolarHBondContact O-N 3.49Å; A13-W15 VanDerWaalsContact C-N 3.31Å; A13-W15 PolarHBondContact O-N 3.21Å; W15-E17 VanDerWaalsContact C-N 3.33Å; W15-E17 PolarHBondContact O-N 3.28Å; W15-I18 PolarHBondContact O-N 3.49Å; W15-E19 WeakPolarHBondContact O-CB 3.35Å; W15-E19 PolarHBondContact O-N 2.8Å |
| 16 | E | 93.1 | Very high | 85 | Confident | 116 Ų | 116 | 103.4 Ų | 103.4 | 54% | 0.542 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.1 | -36.1 | 174.2 | -79 | -173 | -173.5 | 0 | 0 | 112.9 | E12 A13 K20 | E12-E16 WeakPolarHBondContact O-CG 3.28Å; E12-E16 PolarHBondContact O-N 2.98Å; A13-E16 PolarHBondContact O-N 3.15Å; E16-K20 VanDerWaalsContact O-CG 3.3Å; E16-K20 WeakPolarHBondContact O-CG 3.49Å; E16-K20 PolarHBondContact O-N 3.02Å |
| 17 | E | 93.3 | Very high | 87 | Confident | 120 Ų | 120 | 104.3 Ų | 104.3 | 56% | 0.561 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.6 | -47.4 | 174.9 | -172.8 | 169.5 | -164.5 | 0 | 0 | 110.9 | A13 E14 W15 E19 K20 E21 | A13-E17 PolarHBondContact O-N 3.47Å; E14-E17 PolarHBondContact O-N 2.93Å; W15-E17 VanDerWaalsContact C-N 3.33Å; W15-E17 PolarHBondContact O-N 3.28Å; E17-E19 VanDerWaalsContact C-N 3.31Å; E17-E19 PolarHBondContact O-N 3.4Å; E17-K20 PolarHBondContact O-N 2.96Å; E17-E21 WeakPolarHBondContact O-CG 3.28Å; E17-E21 PolarHBondContact O-N 3.02Å |
| 18 | I | 94.3 | Very high | 88.8 | Confident | 91 Ų | 91 | 105 Ų | 105 | 47% | 0.467 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.2 | -42.4 | 175.1 | -68.8 | 166.9 | 0 | 0 | 0 | 111.3 | E14 W15 E21 Y22 | E14-I18 VanDerWaalsContact O-CG1 3.29Å; E14-I18 WeakPolarHBondContact O-CG1 3.44Å; E14-I18 PolarHBondContact O-N 3.04Å; W15-I18 PolarHBondContact O-N 3.49Å; I18-E21 PolarHBondContact O-N 3.32Å; I18-Y22 VanDerWaalsContact O-CB 3.3Å; I18-Y22 WeakPolarHBondContact O-CB 3.48Å; I18-Y22 PolarHBondContact O-N 3.02Å |
| 19 | E | 95.5 | Very high | 90.5 | Very high | 72 Ų | 72 | 103.2 Ų | 103.2 | 34% | 0.336 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.4 | -39.7 | 179.1 | -176.1 | 58.2 | -146.7 | 0 | 0 | 111.5 | W15 E17 Y22 Q23 | W15-E19 WeakPolarHBondContact O-CB 3.35Å; W15-E19 PolarHBondContact O-N 2.8Å; E17-E19 VanDerWaalsContact C-N 3.31Å; E17-E19 PolarHBondContact O-N 3.4Å; E19-Y22 PolarHBondContact O-N 2.97Å; E19-Q23 VanDerWaalsContact O-CG 3.31Å; E19-Q23 WeakPolarHBondContact O-CG 3.38Å; E19-Q23 PolarHBondContact O-N 3.15Å; E19-Q23 PolarHBondContact OE1-NE2 3.32Å |
| 20 | K | 95 | Very high | 92 | Very high | 136 Ų | 136 | 104.9 Ų | 104.9 | 59% | 0.591 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -63.9 | -45.9 | 173.7 | -75 | 169.5 | -173.5 | 161.8 | 0 | 111.8 | E16 E17 Y22 Q23 Q24 | E16-K20 VanDerWaalsContact O-CG 3.3Å; E16-K20 WeakPolarHBondContact O-CG 3.49Å; E16-K20 PolarHBondContact O-N 3.02Å; E17-K20 PolarHBondContact O-N 2.96Å; K20-Y22 VanDerWaalsContact C-N 3.31Å; K20-Y22 PolarHBondContact O-N 3.47Å; K20-Q23 PolarHBondContact O-N 3.26Å; K20-Q24 PolarHBondContact O-N 3.31Å |
| 21 | E | 95.4 | Very high | 93.1 | Very high | 119 Ų | 119 | 106.7 Ų | 106.7 | 56% | 0.556 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.4 | -41.5 | 175.5 | -72.6 | -171.9 | 168.6 | 0 | 0 | 111.6 | E17 I18 Q24 L25 | E17-E21 WeakPolarHBondContact O-CG 3.28Å; E17-E21 PolarHBondContact O-N 3.02Å; I18-E21 PolarHBondContact O-N 3.32Å; E21-Q24 PolarHBondContact O-N 3.31Å; E21-L25 WeakPolarHBondContact O-CB 3.26Å; E21-L25 PolarHBondContact O-N 3.25Å |
| 22 | Y | 94.7 | Very high | 94 | Very high | 120 Ų | 120 | 108.4 Ų | 108.4 | 47% | 0.471 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.7 | -44.5 | 177.4 | -178.3 | -106.8 | 0 | 0 | 0 | 112 | I18 E19 K20 Q24 L25 Q26 | I18-Y22 VanDerWaalsContact O-CB 3.3Å; I18-Y22 WeakPolarHBondContact O-CB 3.48Å; I18-Y22 PolarHBondContact O-N 3.02Å; E19-Y22 PolarHBondContact O-N 2.97Å; K20-Y22 VanDerWaalsContact C-N 3.31Å; K20-Y22 PolarHBondContact O-N 3.47Å; Y22-Q24 PolarHBondContact O-N 2.8Å; Y22-L25 WeakPolarHBondContact O-CB 3.38Å; Y22-L25 PolarHBondContact O-N 3.12Å; Y22-Q26 HydrophobicContact CD1-CG 4.47Å; Y22-Q26 HydrophobicContact CE1-CG 4.08Å; Y22-Q26 VanDerWaalsContact CZ-NE2 3.27Å; Y22-Q26 WeakPolarHBondContact O-CG 3.25Å; Y22-Q26 PolarHBondContact O-N 2.86Å; Y22-Q26 PolarHBondContact OH-NE2 3.22Å |
| 23 | Q | 95.4 | Very high | 94.5 | Very high | 108 Ų | 108 | 110.7 Ų | 110.7 | 51% | 0.505 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 175.6 | -72.3 | 176 | 13 | 0 | 0 | 111.8 | E19 K20 Q26 E27 | E19-Q23 VanDerWaalsContact O-CG 3.31Å; E19-Q23 WeakPolarHBondContact O-CG 3.38Å; E19-Q23 PolarHBondContact O-N 3.15Å; E19-Q23 PolarHBondContact OE1-NE2 3.32Å; K20-Q23 PolarHBondContact O-N 3.26Å; Q23-Q26 PolarHBondContact O-N 3.31Å; Q23-E27 PolarHBondContact O-N 3.03Å; Q23-E27 VanDerWaalsContact O-N 3.11Å |
| 24 | Q | 96.1 | Very high | 94.9 | Very high | 138 Ų | 138 | 112.9 Ų | 112.9 | 65% | 0.645 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.3 | -39.7 | 175.4 | -173.6 | 177 | -0.7 | 0 | 0 | 112.3 | K20 E21 Y22 E27 T28 | K20-Q24 PolarHBondContact O-N 3.31Å; E21-Q24 PolarHBondContact O-N 3.31Å; Y22-Q24 PolarHBondContact O-N 2.8Å; Q24-E27 PolarHBondContact O-N 3.39Å; Q24-T28 WeakPolarHBondContact O-CB 3.43Å; Q24-T28 PolarHBondContact O-N 2.97Å; Q24-T28 PolarHBondContact O-OG1 3.14Å |
| 25 | L | 95.8 | Very high | 95.3 | Very high | 111 Ų | 111 | 114.5 Ų | 114.5 | 58% | 0.581 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.6 | -44.5 | 175.3 | 176.4 | 63.6 | 0 | 0 | 0 | 111.4 | E21 Y22 E27 T28 H29 | E21-L25 WeakPolarHBondContact O-CB 3.26Å; E21-L25 PolarHBondContact O-N 3.25Å; Y22-L25 WeakPolarHBondContact O-CB 3.38Å; Y22-L25 PolarHBondContact O-N 3.12Å; L25-E27 VanDerWaalsContact C-N 3.33Å; L25-E27 PolarHBondContact O-N 3.1Å; L25-T28 PolarHBondContact O-N 3.43Å; L25-H29 WeakPolarHBondContact O-CB 3.45Å; L25-H29 PolarHBondContact O-N 3.49Å |
| 26 | Q | 96.8 | Very high | 95.3 | Very high | 85 Ų | 85 | 110 Ų | 110 | 40% | 0.397 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.7 | -44.1 | 177.1 | -75 | -170.6 | -20.9 | 0 | 0 | 111.7 | Y22 Q23 H29 K30 | Y22-Q26 HydrophobicContact CD1-CG 4.47Å; Y22-Q26 HydrophobicContact CE1-CG 4.08Å; Y22-Q26 VanDerWaalsContact CZ-NE2 3.27Å; Y22-Q26 WeakPolarHBondContact O-CG 3.25Å; Y22-Q26 PolarHBondContact O-N 2.86Å; Y22-Q26 PolarHBondContact OH-NE2 3.22Å; Q23-Q26 PolarHBondContact O-N 3.31Å; Q26-H29 PolarHBondContact O-N 3.28Å; Q26-K30 WeakPolarHBondContact O-CG 3.29Å; Q26-K30 PolarHBondContact O-N 3.36Å |
| 27 | E | 96.4 | Very high | 95.3 | Very high | 94 Ų | 94 | 108.8 Ų | 108.8 | 44% | 0.439 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.3 | -42.7 | 179 | -165.1 | 55.3 | -147.5 | 0 | 0 | 111.7 | Q23 Q24 L25 H29 K30 I31 | Q23-E27 PolarHBondContact O-N 3.03Å; Q23-E27 VanDerWaalsContact O-N 3.11Å; Q24-E27 PolarHBondContact O-N 3.39Å; L25-E27 VanDerWaalsContact C-N 3.33Å; L25-E27 PolarHBondContact O-N 3.1Å; E27-H29 VanDerWaalsContact C-N 3.29Å; E27-H29 PolarHBondContact O-N 2.89Å; E27-K30 WeakPolarHBondContact O-CB 3.47Å; E27-K30 PolarHBondContact O-N 3.31Å; E27-K30 IonicContact OE2-NZ 3.51Å; E27-K30 PolarHBondContact OE2-NZ 2.96Å; E27-I31 WeakPolarHBondContact O-CG1 3.37Å; E27-I31 PolarHBondContact O-N 2.96Å; E27-I31 VanDerWaalsContact O-N 3.12Å |
| 28 | T | 96.4 | Very high | 95.4 | Very high | 81 Ų | 81 | 106.6 Ų | 106.6 | 50% | 0.497 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.4 | -41.5 | 174.1 | -56.5 | 0 | 0 | 0 | 0 | 111.5 | Q24 L25 I31 Y32 | Q24-T28 WeakPolarHBondContact O-CB 3.43Å; Q24-T28 PolarHBondContact O-N 2.97Å; Q24-T28 PolarHBondContact O-OG1 3.14Å; L25-T28 PolarHBondContact O-N 3.43Å; T28-I31 PolarHBondContact O-N 3.18Å; T28-Y32 WeakPolarHBondContact O-CB 3.42Å; T28-Y32 PolarHBondContact O-N 3.5Å |
| 29 | H | 96.2 | Very high | 95.3 | Very high | 114 Ų | 114 | 106 Ų | 106 | 53% | 0.528 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -66.3 | -38.1 | 177.8 | 178.5 | -98.2 | 0 | 0 | 0 | 112.8 | L25 Q26 E27 Y32 R33 | L25-H29 WeakPolarHBondContact O-CB 3.45Å; L25-H29 PolarHBondContact O-N 3.49Å; Q26-H29 PolarHBondContact O-N 3.28Å; E27-H29 VanDerWaalsContact C-N 3.29Å; E27-H29 PolarHBondContact O-N 2.89Å; H29-Y32 PolarHBondContact O-N 2.91Å; H29-R33 PolarHBondContact O-N 3.37Å |
| 30 | K | 96.3 | Very high | 95 | Very high | 122 Ų | 122 | 106 Ų | 106 | 53% | 0.53 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.3 | -46.4 | 173.7 | -70.1 | 177.8 | -158.4 | 155.7 | 0 | 111.1 | Q26 E27 Y32 R33 H34 | Q26-K30 WeakPolarHBondContact O-CG 3.29Å; Q26-K30 PolarHBondContact O-N 3.36Å; E27-K30 WeakPolarHBondContact O-CB 3.47Å; E27-K30 PolarHBondContact O-N 3.31Å; E27-K30 IonicContact OE2-NZ 3.51Å; E27-K30 PolarHBondContact OE2-NZ 2.96Å; K30-Y32 PolarHBondContact O-N 3.39Å; K30-R33 PolarHBondContact O-N 3.31Å; K30-H34 PolarHBondContact O-N 3.49Å |
| 31 | I | 97.1 | Very high | 94.8 | Very high | 93 Ų | 93 | 104.6 Ų | 104.6 | 48% | 0.477 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.4 | -47.2 | 177.1 | -63.5 | 168.2 | 0 | 0 | 0 | 110.3 | E27 T28 R33 H34 K35 | E27-I31 WeakPolarHBondContact O-CG1 3.37Å; E27-I31 PolarHBondContact O-N 2.96Å; E27-I31 VanDerWaalsContact O-N 3.12Å; T28-I31 PolarHBondContact O-N 3.18Å; I31-R33 PolarHBondContact O-N 3.08Å; I31-H34 PolarHBondContact O-N 2.89Å; I31-K35 HydrophobicContact CG2-CG 4.38Å; I31-K35 WeakPolarHBondContact O-CG 3.49Å; I31-K35 PolarHBondContact O-N 3.42Å |
| 32 | Y | 95.5 | Very high | 94.7 | Very high | 143 Ų | 143 | 104.2 Ų | 104.2 | 56% | 0.561 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -55.5 | -49.4 | 176.9 | 165.9 | -99.6 | 0 | 0 | 0 | 112.3 | T28 H29 K30 H34 K35 L36 | T28-Y32 WeakPolarHBondContact O-CB 3.42Å; T28-Y32 PolarHBondContact O-N 3.5Å; H29-Y32 PolarHBondContact O-N 2.91Å; K30-Y32 PolarHBondContact O-N 3.39Å; Y32-H34 VanDerWaalsContact C-N 3.33Å; Y32-H34 PolarHBondContact O-N 2.96Å; Y32-K35 PolarHBondContact O-N 3.07Å; Y32-L36 PolarHBondContact O-N 2.92Å |
| 33 | R | 95 | Very high | 94.5 | Very high | 152 Ų | 152 | 99.8 Ų | 99.8 | 57% | 0.574 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -60.5 | -44.1 | 179.4 | -178 | -179.1 | 173.4 | 168.4 | 3.7 | 111.5 | H29 K30 I31 K35 L36 E37 | H29-R33 PolarHBondContact O-N 3.37Å; K30-R33 PolarHBondContact O-N 3.31Å; I31-R33 PolarHBondContact O-N 3.08Å; R33-K35 PolarHBondContact O-N 2.91Å; R33-L36 WeakPolarHBondContact O-CB 3.33Å; R33-L36 PolarHBondContact O-N 2.92Å; R33-E37 IonicContact NE-OE1 3.01Å; R33-E37 PolarHBondContact NE-OE1 3.37Å; R33-E37 IonicContact NH2-OE1 3.57Å; R33-E37 PolarHBondContact O-N 3.35Å |
| 34 | H | 95.8 | Very high | 94.3 | Very high | 102 Ų | 102 | 97.5 Ų | 97.5 | 47% | 0.472 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 177.4 | -176.6 | 61.6 | 0 | 0 | 0 | 111.7 | K30 I31 Y32 L36 E37 E38 | K30-H34 PolarHBondContact O-N 3.49Å; I31-H34 PolarHBondContact O-N 2.89Å; Y32-H34 VanDerWaalsContact C-N 3.33Å; Y32-H34 PolarHBondContact O-N 2.96Å; H34-L36 VanDerWaalsContact C-N 3.3Å; H34-L36 PolarHBondContact O-N 3.42Å; H34-E37 PolarHBondContact O-N 3.49Å; H34-E38 IonicContact NE2-OE1 2.78Å; H34-E38 PolarHBondContact O-N 3.06Å |
| 35 | K | 95.8 | Very high | 94.1 | Very high | 117 Ų | 117 | 94.8 Ų | 94.8 | 51% | 0.509 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -63.1 | -33.9 | 175.8 | -68.2 | -57.8 | 176.9 | -166.3 | 0 | 113.3 | I31 Y32 R33 E38 L39 | I31-K35 HydrophobicContact CG2-CG 4.38Å; I31-K35 WeakPolarHBondContact O-CG 3.49Å; I31-K35 PolarHBondContact O-N 3.42Å; Y32-K35 PolarHBondContact O-N 3.07Å; R33-K35 PolarHBondContact O-N 2.91Å; K35-E38 WeakPolarHBondContact CD-OE2 3.35Å; K35-E38 IonicContact NZ-OE2 2.73Å; K35-E38 PolarHBondContact NZ-OE2 3.37Å; K35-L39 WeakPolarHBondContact O-CB 3.49Å; K35-L39 PolarHBondContact O-N 3.03Å |
| 36 | L | 91.9 | Very high | 93.9 | Very high | 77 Ų | 77 | 92.3 Ų | 92.3 | 40% | 0.403 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.5 | -41.7 | 174.9 | -178.6 | 63.1 | 0 | 0 | 0 | 112.1 | Y32 R33 H34 L39 T40 | Y32-L36 PolarHBondContact O-N 2.92Å; R33-L36 WeakPolarHBondContact O-CB 3.33Å; R33-L36 PolarHBondContact O-N 2.92Å; H34-L36 VanDerWaalsContact C-N 3.3Å; H34-L36 PolarHBondContact O-N 3.42Å; L36-L39 PolarHBondContact O-N 3.03Å; L36-T40 WeakPolarHBondContact O-CB 3.48Å; L36-T40 PolarHBondContact O-N 3.39Å; L36-T40 PolarHBondContact O-OG1 3.18Å |
| 37 | E | 92.9 | Very high | 93.6 | Very high | 89 Ų | 89 | 90 Ų | 90 | 42% | 0.416 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64.9 | -45.6 | 175.5 | -71.2 | 172.2 | -169.4 | 0 | 0 | 111.1 | R33 H34 L39 T40 N41 | R33-E37 IonicContact NE-OE1 3.01Å; R33-E37 PolarHBondContact NE-OE1 3.37Å; R33-E37 IonicContact NH2-OE1 3.57Å; R33-E37 PolarHBondContact O-N 3.35Å; H34-E37 PolarHBondContact O-N 3.49Å; E37-L39 PolarHBondContact O-N 3.12Å; E37-T40 PolarHBondContact O-N 3.44Å; E37-N41 PolarHBondContact O-N 3.09Å; E37-N41 PolarHBondContact O-ND2 3.12Å |
| 38 | E | 95.1 | Very high | 93.4 | Very high | 75 Ų | 75 | 88.8 Ų | 88.8 | 35% | 0.35 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -56.5 | -47.9 | 173.7 | -72.9 | -170.9 | 140.9 | 0 | 0 | 111.8 | H34 K35 T40 N41 L42 | H34-E38 IonicContact NE2-OE1 2.78Å; H34-E38 PolarHBondContact O-N 3.06Å; K35-E38 WeakPolarHBondContact CD-OE2 3.35Å; K35-E38 IonicContact NZ-OE2 2.73Å; K35-E38 PolarHBondContact NZ-OE2 3.37Å; E38-T40 VanDerWaalsContact C-N 3.33Å; E38-T40 PolarHBondContact O-N 3.43Å; E38-N41 PolarHBondContact O-N 3.36Å; E38-L42 WeakPolarHBondContact O-CG 3.49Å; E38-L42 PolarHBondContact O-N 3.48Å |
| 39 | L | 91.2 | Very high | 93.2 | Very high | 78 Ų | 78 | 87.9 Ų | 87.9 | 41% | 0.408 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -59.3 | -44.5 | 178.3 | 178.3 | 64.9 | 0 | 0 | 0 | 111.6 | K35 L36 E37 N41 L42 Q43 | K35-L39 WeakPolarHBondContact O-CB 3.49Å; K35-L39 PolarHBondContact O-N 3.03Å; L36-L39 PolarHBondContact O-N 3.03Å; E37-L39 PolarHBondContact O-N 3.12Å; L39-N41 VanDerWaalsContact C-N 3.35Å; L39-N41 PolarHBondContact O-N 3.23Å; L39-L42 PolarHBondContact O-N 2.87Å; L39-Q43 HydrophobicContact CD1-CG 4.45Å; L39-Q43 WeakPolarHBondContact O-CB 3.4Å; L39-Q43 VanDerWaalsContact O-CG 3.28Å; L39-Q43 WeakPolarHBondContact O-CG 3.47Å; L39-Q43 PolarHBondContact O-N 2.95Å |
| 40 | T | 89.2 | Confident | 93 | Very high | 73 Ų | 73 | 82.9 Ų | 82.9 | 45% | 0.448 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | -179.5 | -57.1 | 0 | 0 | 0 | 0 | 111.2 | L36 E37 E38 Q43 A44 | L36-T40 WeakPolarHBondContact O-CB 3.48Å; L36-T40 PolarHBondContact O-N 3.39Å; L36-T40 PolarHBondContact O-OG1 3.18Å; E37-T40 PolarHBondContact O-N 3.44Å; E38-T40 VanDerWaalsContact C-N 3.33Å; E38-T40 PolarHBondContact O-N 3.43Å; T40-Q43 PolarHBondContact O-N 3.21Å; T40-A44 PolarHBondContact O-N 3.31Å |
| 41 | N | 92.4 | Very high | 92.7 | Very high | 106 Ų | 106 | 80.7 Ų | 80.7 | 57% | 0.567 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -64.7 | -42.3 | 176.7 | -71.3 | -25.7 | 0 | 0 | 0 | 112.1 | E37 E38 L39 A44 T45 | E37-N41 PolarHBondContact O-N 3.09Å; E37-N41 PolarHBondContact O-ND2 3.12Å; E38-N41 PolarHBondContact O-N 3.36Å; L39-N41 VanDerWaalsContact C-N 3.35Å; L39-N41 PolarHBondContact O-N 3.23Å; N41-A44 PolarHBondContact O-N 3.3Å; N41-T45 WeakPolarHBondContact O-CB 3.42Å; N41-T45 PolarHBondContact O-N 3.08Å; N41-T45 PolarHBondContact O-OG1 3.46Å |
| 42 | L | 93.4 | Very high | 92.5 | Very high | 111 Ų | 111 | 83.6 Ų | 83.6 | 58% | 0.581 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -63.1 | -42.9 | 175 | -72.7 | 172.2 | 0 | 0 | 0 | 111.5 | E38 L39 A44 T45 C46 | E38-L42 WeakPolarHBondContact O-CG 3.49Å; E38-L42 PolarHBondContact O-N 3.48Å; L39-L42 PolarHBondContact O-N 2.87Å; L42-A44 PolarHBondContact O-N 3.12Å; L42-T45 PolarHBondContact O-N 3.4Å; L42-C46 WeakPolarHBondContact O-CB 3.2Å; L42-C46 PolarHBondContact O-N 3.08Å; L42-C46 PolarHBondContact O-SG 3.47Å; L42-C46 VanDerWaalsContact O-SG 3.41Å |
| 43 | Q | 90.5 | Very high | 92.3 | Very high | 27 Ų | 27 | 81.5 Ų | 81.5 | 13% | 0.126 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -59.2 | -44.5 | 176.6 | -75.9 | 175.3 | -8.7 | 0 | 0 | 112.2 | L39 T40 S47 L100 P101 L120 | L39-Q43 HydrophobicContact CD1-CG 4.45Å; L39-Q43 WeakPolarHBondContact O-CB 3.4Å; L39-Q43 VanDerWaalsContact O-CG 3.28Å; L39-Q43 WeakPolarHBondContact O-CG 3.47Å; L39-Q43 PolarHBondContact O-N 2.95Å; T40-Q43 PolarHBondContact O-N 3.21Å; Q43-S47 VanDerWaalsContact O-CB 3.29Å; Q43-S47 WeakPolarHBondContact O-CB 3.48Å; Q43-S47 PolarHBondContact O-N 2.97Å; Q43-S47 PolarHBondContact O-OG 3.15Å; Q43-L100 HydrophobicContact CB-CD2 4.33Å; Q43-L100 HydrophobicContact CG-CD2 4.16Å; Q43-P101 HydrophobicContact CB-CG 4.38Å; Q43-P101 HydrophobicContact CG-CG 4.42Å; Q43-L120 VanDerWaalsContact NE2-CD1 3.31Å |
| 44 | A | 89.8 | Confident | 92.1 | Very high | 60 Ų | 60 | 78.9 Ų | 78.9 | 50% | 0.496 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.7 | -42.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | T40 N41 L42 S47 S48 | T40-A44 PolarHBondContact O-N 3.31Å; N41-A44 PolarHBondContact O-N 3.3Å; L42-A44 PolarHBondContact O-N 3.12Å; A44-S47 PolarHBondContact O-N 3.46Å; A44-S48 WeakPolarHBondContact O-CB 3.31Å; A44-S48 PolarHBondContact O-N 3.27Å; A44-S48 PolarHBondContact O-OG 3.11Å |
| 45 | T | 92.8 | Very high | 91.9 | Very high | 80 Ų | 80 | 80.9 Ų | 80.9 | 49% | 0.491 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -65.1 | -46 | 178.9 | -57.3 | 0 | 0 | 0 | 0 | 111.6 | N41 L42 S48 S49 | N41-T45 WeakPolarHBondContact O-CB 3.42Å; N41-T45 PolarHBondContact O-N 3.08Å; N41-T45 PolarHBondContact O-OG1 3.46Å; L42-T45 PolarHBondContact O-N 3.4Å; T45-S48 PolarHBondContact O-OG 3.44Å; T45-S49 VanDerWaalsContact O-CB 3.27Å; T45-S49 WeakPolarHBondContact O-CB 3.47Å; T45-S49 PolarHBondContact O-N 3.25Å; T45-S49 PolarHBondContact O-OG 2.79Å |
| 46 | C | 92.2 | Very high | 91.7 | Very high | 59 Ų | 59 | 78.5 Ų | 78.5 | 40% | 0.399 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63 | -46.9 | 176.1 | -73.5 | 0 | 0 | 0 | 0 | 111.4 | L42 S48 S49 I50 L100 | L42-C46 WeakPolarHBondContact O-CB 3.2Å; L42-C46 PolarHBondContact O-N 3.08Å; L42-C46 PolarHBondContact O-SG 3.47Å; L42-C46 VanDerWaalsContact O-SG 3.41Å; C46-S48 PolarHBondContact O-N 3.36Å; C46-S49 PolarHBondContact O-N 3.29Å; C46-I50 VanDerWaalsContact O-CG1 3.31Å; C46-I50 WeakPolarHBondContact O-CG1 3.37Å; C46-I50 PolarHBondContact O-N 3.06Å; C46-L100 HydrophobicContact CB-CD1 3.86Å; C46-L100 HydrophobicContact CB-CD2 3.92Å |
| 47 | S | 89.6 | Confident | 91.7 | Very high | 36 Ų | 36 | 75.5 Ų | 75.5 | 25% | 0.252 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.8 | -42.4 | -178.2 | -58.9 | 0 | 0 | 0 | 0 | 112.4 | Q43 A44 S51 | Q43-S47 VanDerWaalsContact O-CB 3.29Å; Q43-S47 WeakPolarHBondContact O-CB 3.48Å; Q43-S47 PolarHBondContact O-N 2.97Å; Q43-S47 PolarHBondContact O-OG 3.15Å; A44-S47 PolarHBondContact O-N 3.46Å; S47-S51 WeakPolarHBondContact O-CB 3.45Å; S47-S51 PolarHBondContact O-N 3.34Å; S47-S51 PolarHBondContact O-OG 3.33Å |
| 48 | S | 91.5 | Very high | 91.7 | Very high | 69 Ų | 69 | 78 Ų | 78 | 48% | 0.483 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -68 | -40.8 | 176.7 | 58.1 | 0 | 0 | 0 | 0 | 112.1 | A44 T45 C46 S51 K52 | A44-S48 WeakPolarHBondContact O-CB 3.31Å; A44-S48 PolarHBondContact O-N 3.27Å; A44-S48 PolarHBondContact O-OG 3.11Å; T45-S48 PolarHBondContact O-OG 3.44Å; C46-S48 PolarHBondContact O-N 3.36Å; S48-S51 PolarHBondContact O-N 2.93Å; S48-K52 WeakPolarHBondContact O-CB 3.28Å; S48-K52 PolarHBondContact O-N 3.42Å |
| 49 | S | 92.9 | Very high | 91.5 | Very high | 62 Ų | 62 | 78.1 Ų | 78.1 | 43% | 0.434 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.5 | -44.8 | 177.9 | -62.1 | 0 | 0 | 0 | 0 | 112.5 | T45 C46 S51 K52 Q53 | T45-S49 VanDerWaalsContact O-CB 3.27Å; T45-S49 WeakPolarHBondContact O-CB 3.47Å; T45-S49 PolarHBondContact O-N 3.25Å; T45-S49 PolarHBondContact O-OG 2.79Å; C46-S49 PolarHBondContact O-N 3.29Å; S49-S51 VanDerWaalsContact C-N 3.35Å; S49-K52 PolarHBondContact O-N 2.89Å; S49-Q53 WeakPolarHBondContact O-CG 3.38Å; S49-Q53 PolarHBondContact O-N 2.7Å |
| 50 | I | 91.3 | Very high | 91.5 | Very high | 9 Ų | 9 | 78 Ų | 78 | 5% | 0.046 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -62.1 | -44 | 175 | -68.4 | 169.1 | 0 | 0 | 0 | 110.4 | C46 K52 Q53 R54 F93 M96 E97 L100 | C46-I50 VanDerWaalsContact O-CG1 3.31Å; C46-I50 WeakPolarHBondContact O-CG1 3.37Å; C46-I50 PolarHBondContact O-N 3.06Å; I50-K52 VanDerWaalsContact C-N 3.33Å; I50-K52 PolarHBondContact O-N 2.95Å; I50-Q53 PolarHBondContact O-N 2.98Å; I50-R54 WeakPolarHBondContact O-CB 3.5Å; I50-R54 PolarHBondContact O-N 2.69Å; I50-F93 HydrophobicContact CG2-CB 4.12Å; I50-F93 HydrophobicContact CG2-CG 4.21Å; I50-M96 HydrophobicContact CD1-CB 3.93Å; I50-E97 HydrophobicContact CD1-CG 4.13Å; I50-E97 HydrophobicContact CG2-CG 4.26Å; I50-E97 WeakPolarHBondContact CG2-OE1 3.45Å; I50-L100 HydrophobicContact CD1-CD1 3.65Å |
| 51 | S | 89.8 | Confident | 91.5 | Very high | 76 Ų | 76 | 81 Ų | 81 | 53% | 0.531 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -60.7 | -42.4 | 178 | -62.5 | 0 | 0 | 0 | 0 | 112 | S47 S48 S49 K55 | S47-S51 WeakPolarHBondContact O-CB 3.45Å; S47-S51 PolarHBondContact O-N 3.34Å; S47-S51 PolarHBondContact O-OG 3.33Å; S48-S51 PolarHBondContact O-N 2.93Å; S49-S51 VanDerWaalsContact C-N 3.35Å; S51-K55 PolarHBondContact O-N 3Å; S51-K55 VanDerWaalsContact O-N 3.12Å |
| 52 | K | 93 | Very high | 91.3 | Very high | 155 Ų | 155 | 80.8 Ų | 80.8 | 67% | 0.674 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -63.1 | -49.2 | 175.7 | -173.9 | 179.3 | 178.9 | -178.3 | 0 | 111.3 | S48 S49 I50 R54 K55 C56 | S48-K52 WeakPolarHBondContact O-CB 3.28Å; S48-K52 PolarHBondContact O-N 3.42Å; S49-K52 PolarHBondContact O-N 2.89Å; I50-K52 VanDerWaalsContact C-N 3.33Å; I50-K52 PolarHBondContact O-N 2.95Å; K52-R54 PolarHBondContact O-N 2.91Å; K52-K55 WeakPolarHBondContact O-CB 3.31Å; K52-K55 PolarHBondContact O-N 2.78Å; K52-C56 PolarHBondContact O-N 3.4Å; K52-C56 VanDerWaalsContact O-N 3.09Å; K52-C56 PolarHBondContact O-SG 3.42Å |
| 53 | Q | 92.4 | Very high | 91 | Very high | 99 Ų | 99 | 78.6 Ų | 78.6 | 46% | 0.463 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -60.3 | -45.1 | 178.1 | -78 | -71.5 | -11.3 | 0 | 0 | 112.1 | S49 I50 K55 C56 L57 F93 | S49-Q53 WeakPolarHBondContact O-CG 3.38Å; S49-Q53 PolarHBondContact O-N 2.7Å; I50-Q53 PolarHBondContact O-N 2.98Å; Q53-K55 VanDerWaalsContact C-N 3.31Å; Q53-K55 PolarHBondContact O-N 3.5Å; Q53-C56 PolarHBondContact O-N 2.93Å; Q53-L57 WeakPolarHBondContact O-CG 3.36Å; Q53-L57 PolarHBondContact O-N 3Å; Q53-F93 HydrophobicContact CB-CE2 3.93Å; Q53-F93 HydrophobicContact CB-CZ 3.64Å; Q53-F93 HydrophobicContact CG-CZ 4.27Å |
| 54 | R | 90.1 | Very high | 90.8 | Very high | 96 Ų | 96 | 78.2 Ų | 78.2 | 36% | 0.362 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -58.1 | -41.6 | 175.3 | -90.5 | -171.8 | 175.4 | 151 | 6.9 | 112.8 | I50 K52 L57 K58 F93 E97 | I50-R54 WeakPolarHBondContact O-CB 3.5Å; I50-R54 PolarHBondContact O-N 2.69Å; K52-R54 PolarHBondContact O-N 2.91Å; R54-L57 PolarHBondContact O-N 3.41Å; R54-K58 WeakPolarHBondContact O-CB 3.27Å; R54-K58 PolarHBondContact O-N 2.96Å; R54-F93 HydrophobicContact CG-CD2 3.96Å; R54-F93 HydrophobicContact CG-CE2 4.39Å; R54-E97 IonicContact CZ-OE1 3.24Å; R54-E97 IonicContact CZ-OE2 2.81Å; R54-E97 VanDerWaalsContact CZ-OE2 3.24Å; R54-E97 IonicContact NH1-OE1 2.98Å; R54-E97 PolarHBondContact NH1-OE1 3.28Å; R54-E97 IonicContact NH1-OE2 2.82Å; R54-E97 PolarHBondContact NH1-OE2 3.49Å; R54-E97 IonicContact NH2-OE1 2.7Å; R54-E97 IonicContact NH2-OE2 2.8Å; R54-E97 PolarHBondContact NH2-OE2 2.76Å |
| 55 | K | 91.9 | Very high | 90.6 | Very high | 144 Ų | 144 | 82.3 Ų | 82.3 | 63% | 0.626 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -60.4 | -49.4 | 176.1 | -173.1 | 179.2 | 177.2 | -178.2 | 0 | 110.5 | S51 K52 Q53 L57 K58 D59 | S51-K55 PolarHBondContact O-N 3Å; S51-K55 VanDerWaalsContact O-N 3.12Å; K52-K55 WeakPolarHBondContact O-CB 3.31Å; K52-K55 PolarHBondContact O-N 2.78Å; Q53-K55 VanDerWaalsContact C-N 3.31Å; Q53-K55 PolarHBondContact O-N 3.5Å; K55-L57 PolarHBondContact O-N 3.24Å; K55-K58 WeakPolarHBondContact O-CB 3.36Å; K55-K58 PolarHBondContact O-N 3.27Å; K55-D59 VanDerWaalsContact O-CG 3.28Å; K55-D59 PolarHBondContact O-N 3Å |
| 56 | C | 92.6 | Very high | 90.2 | Very high | 67 Ų | 67 | 85.9 Ų | 85.9 | 45% | 0.453 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -59.4 | -44.2 | 177.2 | -65.4 | 0 | 0 | 0 | 0 | 112.7 | K52 Q53 K58 D59 L60 | K52-C56 PolarHBondContact O-N 3.4Å; K52-C56 VanDerWaalsContact O-N 3.09Å; K52-C56 PolarHBondContact O-SG 3.42Å; Q53-C56 PolarHBondContact O-N 2.93Å; C56-K58 VanDerWaalsContact C-N 3.35Å; C56-K58 PolarHBondContact O-N 3.13Å; C56-D59 PolarHBondContact O-N 2.96Å; C56-L60 WeakPolarHBondContact O-CB 3.39Å; C56-L60 PolarHBondContact O-N 3.3Å |
| 57 | L | 91.8 | Very high | 89.5 | Confident | 15 Ų | 15 | 86.1 Ų | 86.1 | 8% | 0.079 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -65.3 | -37.3 | 177.3 | -65.9 | -174.7 | 0 | 0 | 0 | 112.2 | Q53 R54 K55 L60 R61 I86 K89 F93 | Q53-L57 WeakPolarHBondContact O-CG 3.36Å; Q53-L57 PolarHBondContact O-N 3Å; R54-L57 PolarHBondContact O-N 3.41Å; K55-L57 PolarHBondContact O-N 3.24Å; L57-L60 PolarHBondContact O-N 3.07Å; L57-R61 VanDerWaalsContact O-CB 3.29Å; L57-R61 WeakPolarHBondContact O-CB 3.36Å; L57-R61 PolarHBondContact O-N 3.23Å; L57-I86 HydrophobicContact CB-CG2 4.42Å; L57-I86 HydrophobicContact CD2-CG1 4.3Å; L57-K89 HydrophobicContact CD1-CB 4.01Å; L57-K89 HydrophobicContact CD2-CD 4.48Å; L57-F93 HydrophobicContact CD1-CE2 3.63Å; L57-F93 HydrophobicContact CD1-CZ 4.3Å |
| 58 | K | 91.1 | Very high | 88.8 | Confident | 142 Ų | 142 | 85.9 Ų | 85.9 | 62% | 0.617 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -64.5 | -44.4 | 175.7 | -173.4 | -179.8 | 179 | -177.2 | 0 | 111.3 | R54 K55 C56 R61 L62 | R54-K58 WeakPolarHBondContact O-CB 3.27Å; R54-K58 PolarHBondContact O-N 2.96Å; K55-K58 WeakPolarHBondContact O-CB 3.36Å; K55-K58 PolarHBondContact O-N 3.27Å; C56-K58 VanDerWaalsContact C-N 3.35Å; C56-K58 PolarHBondContact O-N 3.13Å; K58-R61 PolarHBondContact O-N 3.4Å; K58-L62 WeakPolarHBondContact O-CG 3.39Å; K58-L62 PolarHBondContact O-N 3.45Å; K58-L62 VanDerWaalsContact O-N 3.08Å |
| 59 | D | 92.1 | Very high | 87.9 | Confident | 77 Ų | 77 | 90.3 Ų | 90.3 | 41% | 0.412 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.8 | -44.3 | 177.7 | -65.3 | -20.1 | 0 | 0 | 0 | 110.8 | K55 C56 R61 L62 S63 | K55-D59 VanDerWaalsContact O-CG 3.28Å; K55-D59 PolarHBondContact O-N 3Å; C56-D59 PolarHBondContact O-N 2.96Å; D59-R61 VanDerWaalsContact C-N 3.32Å; D59-R61 PolarHBondContact O-N 3.24Å; D59-L62 WeakPolarHBondContact O-CB 3.2Å; D59-L62 PolarHBondContact O-N 2.96Å; D59-S63 PolarHBondContact O-N 3.43Å; D59-S63 PolarHBondContact O-OG 2.74Å |
| 60 | L | 90.8 | Very high | 86.8 | Confident | 75 Ų | 75 | 93.2 Ų | 93.2 | 39% | 0.393 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.5 | -43.7 | 173.9 | 179.5 | 60.9 | 0 | 0 | 0 | 111.7 | C56 L57 L62 S63 L64 I82 I86 | C56-L60 WeakPolarHBondContact O-CB 3.39Å; C56-L60 PolarHBondContact O-N 3.3Å; L57-L60 PolarHBondContact O-N 3.07Å; L60-L62 VanDerWaalsContact C-N 3.3Å; L60-L62 PolarHBondContact O-N 3.08Å; L60-S63 PolarHBondContact O-N 2.98Å; L60-L64 HydrophobicContact CD1-CD1 4.32Å; L60-L64 HydrophobicContact CD1-CG 4.24Å; L60-L64 HydrophobicContact CG-CD1 3.97Å; L60-L64 HydrophobicContact CG-CG 4.36Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 VanDerWaalsContact O-CG 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.27Å; L60-L64 PolarHBondContact O-N 2.98Å; L60-I82 HydrophobicContact CD2-CG2 4.31Å; L60-I86 HydrophobicContact CD2-CD1 4.15Å; L60-I86 HydrophobicContact CG-CD1 4.35Å |
| 61 | R | 88.7 | Confident | 85.8 | Confident | 137 Ų | 137 | 94.6 Ų | 94.6 | 52% | 0.517 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.9 | -35.6 | 178.4 | -173.5 | 174.1 | 169.8 | 157.3 | -1.3 | 112.5 | L57 K58 D59 K65 I86 E90 | L57-R61 VanDerWaalsContact O-CB 3.29Å; L57-R61 WeakPolarHBondContact O-CB 3.36Å; L57-R61 PolarHBondContact O-N 3.23Å; K58-R61 PolarHBondContact O-N 3.4Å; D59-R61 VanDerWaalsContact C-N 3.32Å; D59-R61 PolarHBondContact O-N 3.24Å; R61-K65 WeakPolarHBondContact O-CB 3.37Å; R61-K65 PolarHBondContact O-N 3.47Å; R61-K65 VanDerWaalsContact O-N 3.1Å; R61-I86 HydrophobicContact CB-CD1 4.49Å; R61-E90 IonicContact NH1-OE1 3.99Å |
| 62 | L | 88.4 | Confident | 85.2 | Confident | 100 Ų | 100 | 95 Ų | 95 | 52% | 0.524 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -67.2 | -44.7 | 173.8 | -71.2 | 169.7 | 0 | 0 | 0 | 111.4 | K58 D59 L60 K65 K66 | K58-L62 WeakPolarHBondContact O-CG 3.39Å; K58-L62 PolarHBondContact O-N 3.45Å; K58-L62 VanDerWaalsContact O-N 3.08Å; D59-L62 WeakPolarHBondContact O-CB 3.2Å; D59-L62 PolarHBondContact O-N 2.96Å; L60-L62 VanDerWaalsContact C-N 3.3Å; L60-L62 PolarHBondContact O-N 3.08Å; L62-K65 PolarHBondContact O-N 2.87Å; L62-K66 PolarHBondContact O-N 2.99Å; L62-K66 VanDerWaalsContact O-N 3.15Å |
| 63 | S | 87.8 | Confident | 84.4 | Confident | 66 Ų | 66 | 95.6 Ų | 95.6 | 46% | 0.462 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 176.1 | -61.9 | 0 | 0 | 0 | 0 | 112 | D59 L60 K65 K66 C67 | D59-S63 PolarHBondContact O-N 3.43Å; D59-S63 PolarHBondContact O-OG 2.74Å; L60-S63 PolarHBondContact O-N 2.98Å; S63-K65 VanDerWaalsContact C-N 3.27Å; S63-K65 PolarHBondContact O-N 2.83Å; S63-K66 PolarHBondContact O-N 3.27Å; S63-K66 VanDerWaalsContact O-N 3.12Å; S63-C67 PolarHBondContact O-N 3.43Å; S63-C67 PolarHBondContact O-SG 3.2Å |
| 64 | L | 86.7 | Confident | 83.6 | Confident | 18 Ų | 18 | 96.3 Ų | 96.3 | 9% | 0.094 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -60.7 | -35.2 | 175.9 | -70.7 | 169.1 | 0 | 0 | 0 | 112.5 | L60 A68 I79 I82 I86 | L60-L64 HydrophobicContact CD1-CD1 4.32Å; L60-L64 HydrophobicContact CD1-CG 4.24Å; L60-L64 HydrophobicContact CG-CD1 3.97Å; L60-L64 HydrophobicContact CG-CG 4.36Å; L60-L64 WeakPolarHBondContact O-CB 3.42Å; L60-L64 VanDerWaalsContact O-CG 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.27Å; L60-L64 PolarHBondContact O-N 2.98Å; L64-A68 WeakPolarHBondContact O-CB 3.48Å; L64-A68 PolarHBondContact O-N 3.22Å; L64-I79 HydrophobicContact CB-CG2 4.44Å; L64-I79 HydrophobicContact CD2-CG1 4.1Å; L64-I82 HydrophobicContact CD1-CB 4.25Å; L64-I82 HydrophobicContact CD1-CG2 3.56Å; L64-I82 HydrophobicContact CD2-CD1 4.34Å; L64-I86 HydrophobicContact CD1-CD1 3.86Å |
| 65 | K | 85.3 | Confident | 83 | Confident | 146 Ų | 146 | 96 Ų | 96 | 64% | 0.635 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -68.1 | -36.6 | 176.5 | -170.2 | 179.9 | 178.3 | -174.9 | 0 | 112 | R61 L62 S63 | R61-K65 WeakPolarHBondContact O-CB 3.37Å; R61-K65 PolarHBondContact O-N 3.47Å; R61-K65 VanDerWaalsContact O-N 3.1Å; L62-K65 PolarHBondContact O-N 2.87Å; S63-K65 VanDerWaalsContact C-N 3.27Å; S63-K65 PolarHBondContact O-N 2.83Å |
| 66 | K | 83.9 | Confident | 82.5 | Confident | 156 Ų | 156 | 93.1 Ų | 93.1 | 68% | 0.678 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -68.9 | -46.6 | 174.7 | -69.6 | -178.9 | 179.1 | -177.4 | 0 | 111.2 | L62 S63 A68 Q69 | L62-K66 PolarHBondContact O-N 2.99Å; L62-K66 VanDerWaalsContact O-N 3.15Å; S63-K66 PolarHBondContact O-N 3.27Å; S63-K66 VanDerWaalsContact O-N 3.12Å; K66-A68 VanDerWaalsContact C-N 3.33Å; K66-A68 PolarHBondContact O-N 3.4Å; K66-Q69 PolarHBondContact O-N 3.06Å |
| 67 | C | 77.9 | Confident | 82.1 | Confident | 63 Ų | 63 | 96.9 Ų | 96.9 | 43% | 0.426 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.7 | -36.9 | 179.2 | -65.3 | 0 | 0 | 0 | 0 | 112.7 | S63 Q69 T70 C71 | S63-C67 PolarHBondContact O-N 3.43Å; S63-C67 PolarHBondContact O-SG 3.2Å; C67-Q69 PolarHBondContact O-N 3.22Å; C67-T70 PolarHBondContact O-N 3.14Å; C67-T70 PolarHBondContact O-OG1 3.27Å; C67-T70 VanDerWaalsContact O-OG1 3.1Å; C67-C71 PolarHBondContact O-SG 2.9Å |
| 68 | A | 75.2 | Confident | 81.8 | Confident | 31 Ų | 31 | 100.9 Ų | 100.9 | 26% | 0.256 | 51% | 0.506 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.3 | -15.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | L64 K66 T70 I79 | L64-A68 WeakPolarHBondContact O-CB 3.48Å; L64-A68 PolarHBondContact O-N 3.22Å; K66-A68 VanDerWaalsContact C-N 3.33Å; K66-A68 PolarHBondContact O-N 3.4Å; A68-T70 VanDerWaalsContact C-N 3.33Å; A68-I79 HydrophobicContact CB-CD1 4.07Å |
| 69 | Q | 72.5 | Confident | 81.5 | Confident | 162 Ų | 162 | 94.6 Ų | 94.6 | 76% | 0.757 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.7 | -14.9 | 177.2 | -64.5 | 178.4 | -22.2 | 0 | 0 | 113.3 | K66 C67 | K66-Q69 PolarHBondContact O-N 3.06Å; C67-Q69 PolarHBondContact O-N 3.22Å |
| 70 | T | 70 | Confident | 81.2 | Confident | 124 Ų | 124 | 94.9 Ų | 94.9 | 76% | 0.761 | 48% | 0.484 | S | S | * | . | S | Bend | trans | -128.4 | 12.7 | -171.3 | 50.3 | 0 | 0 | 0 | 0 | 113.3 | C67 A68 | C67-T70 PolarHBondContact O-N 3.14Å; C67-T70 PolarHBondContact O-OG1 3.27Å; C67-T70 VanDerWaalsContact O-OG1 3.1Å; A68-T70 VanDerWaalsContact C-N 3.33Å |
| 71 | C | 70.4 | Confident | 81.2 | Confident | 37 Ų | 37 | 95.6 Ų | 95.6 | 25% | 0.25 | 49% | 0.488 | C | S | . | . | trans | -102.5 | 151.7 | -169.2 | -77.4 | 0 | 0 | 0 | 0 | 114.3 | C67 Q75 I79 | C67-C71 PolarHBondContact O-SG 2.9Å; C71-Q75 HydrophobicContact CB-CB 3.76Å; C71-Q75 PolarHBondContact SG-OE1 3.04Å; C71-I79 HydrophobicContact CB-CD1 4.36Å | ||
| 72 | D | 77.7 | Confident | 81.1 | Confident | 84 Ų | 84 | 91.4 Ų | 91.4 | 45% | 0.449 | 48% | 0.475 | S | S | . | . | trans | -74.9 | 171 | 169.9 | 68 | 44.7 | 0 | 0 | 0 | 113.1 | N74 Q75 L76 | D72-N74 VanDerWaalsContact C-N 3.3Å; D72-N74 PolarHBondContact O-N 3.33Å; D72-N74 WeakPolarHBondContact OD1-CA 3.3Å; D72-N74 PolarHBondContact OD1-N 3.39Å; D72-Q75 PolarHBondContact O-N 2.99Å; D72-Q75 WeakPolarHBondContact OD1-CB 3.29Å; D72-Q75 WeakPolarHBondContact OD1-CG 2.94Å; D72-Q75 PolarHBondContact OD1-N 2.83Å; D72-L76 PolarHBondContact O-N 3.39Å | ||
| 73 | E | 75.4 | Confident | 81.1 | Confident | 169 Ų | 169 | 91 Ų | 91 | 79% | 0.79 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -60.3 | -32.3 | -178.9 | -78.9 | -169.6 | 153.5 | 0 | 0 | 114.2 | K77 | E73-K77 PolarHBondContact O-N 2.93Å |
| 74 | N | 75.8 | Confident | 81.3 | Confident | 114 Ų | 114 | 91.3 Ų | 91.3 | 61% | 0.61 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -75.5 | -40.4 | 179.3 | -99 | -10 | 0 | 0 | 0 | 111.4 | D72 L76 K77 I78 | D72-N74 VanDerWaalsContact C-N 3.3Å; D72-N74 PolarHBondContact O-N 3.33Å; D72-N74 WeakPolarHBondContact OD1-CA 3.3Å; D72-N74 PolarHBondContact OD1-N 3.39Å; N74-L76 VanDerWaalsContact C-N 3.28Å; N74-L76 PolarHBondContact O-N 2.92Å; N74-K77 WeakPolarHBondContact O-CB 3.38Å; N74-K77 PolarHBondContact O-N 3.03Å; N74-I78 PolarHBondContact O-N 3.46Å |
| 75 | Q | 77.8 | Confident | 81.5 | Confident | 88 Ų | 88 | 94.1 Ų | 94.1 | 41% | 0.411 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.8 | -34 | 172.9 | -70.3 | -176.2 | 11.4 | 0 | 0 | 111.3 | C71 D72 K77 I78 I79 | C71-Q75 HydrophobicContact CB-CB 3.76Å; C71-Q75 PolarHBondContact SG-OE1 3.04Å; D72-Q75 PolarHBondContact O-N 2.99Å; D72-Q75 WeakPolarHBondContact OD1-CB 3.29Å; D72-Q75 WeakPolarHBondContact OD1-CG 2.94Å; D72-Q75 PolarHBondContact OD1-N 2.83Å; Q75-K77 PolarHBondContact O-N 3.19Å; Q75-I78 PolarHBondContact O-N 3.36Å; Q75-I79 VanDerWaalsContact O-CG1 3.27Å; Q75-I79 WeakPolarHBondContact O-CG1 3.44Å; Q75-I79 PolarHBondContact O-N 2.92Å |
| 76 | L | 81.7 | Confident | 81.7 | Confident | 84 Ų | 84 | 87.4 Ų | 87.4 | 44% | 0.44 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.3 | -37 | 175.1 | -161.9 | 72 | 0 | 0 | 0 | 112.5 | D72 N74 I79 T80 | D72-L76 PolarHBondContact O-N 3.39Å; N74-L76 VanDerWaalsContact C-N 3.28Å; N74-L76 PolarHBondContact O-N 2.92Å; L76-I79 PolarHBondContact O-N 3.1Å; L76-T80 WeakPolarHBondContact O-CB 3.42Å; L76-T80 PolarHBondContact O-N 3.11Å; L76-T80 PolarHBondContact O-OG1 3.19Å |
| 77 | K | 84.1 | Confident | 81.9 | Confident | 146 Ų | 146 | 86.3 Ų | 86.3 | 64% | 0.635 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -62.9 | -46.2 | 172.4 | -74.5 | 177.6 | -178.3 | 171 | 0 | 111.6 | E73 N74 Q75 I79 T80 D81 | E73-K77 PolarHBondContact O-N 2.93Å; N74-K77 WeakPolarHBondContact O-CB 3.38Å; N74-K77 PolarHBondContact O-N 3.03Å; Q75-K77 PolarHBondContact O-N 3.19Å; K77-I79 PolarHBondContact O-N 3.4Å; K77-T80 WeakPolarHBondContact O-CB 3.37Å; K77-T80 PolarHBondContact O-N 3.13Å; K77-T80 VanDerWaalsContact O-N 3.15Å; K77-D81 PolarHBondContact O-N 2.9Å |
| 78 | I | 85.2 | Confident | 82.5 | Confident | 100 Ų | 100 | 89.3 Ų | 89.3 | 51% | 0.513 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60.7 | -45.1 | 177.1 | -66.3 | 161 | 0 | 0 | 0 | 111.1 | N74 Q75 T80 D81 I82 | N74-I78 PolarHBondContact O-N 3.46Å; Q75-I78 PolarHBondContact O-N 3.36Å; I78-T80 PolarHBondContact O-N 3.3Å; I78-D81 PolarHBondContact O-N 3.28Å; I78-I82 HydrophobicContact CG2-CD1 3.81Å; I78-I82 HydrophobicContact CG2-CG1 4.41Å; I78-I82 WeakPolarHBondContact O-CG1 3.21Å; I78-I82 PolarHBondContact O-N 2.93Å |
| 79 | I | 84.2 | Confident | 83.2 | Confident | 9 Ų | 9 | 92 Ų | 92 | 5% | 0.046 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -60 | -37.6 | 176.9 | -70.9 | 169.1 | 0 | 0 | 0 | 111.2 | L64 A68 C71 Q75 L76 K77 K83 | L64-I79 HydrophobicContact CB-CG2 4.44Å; L64-I79 HydrophobicContact CD2-CG1 4.1Å; A68-I79 HydrophobicContact CB-CD1 4.07Å; C71-I79 HydrophobicContact CB-CD1 4.36Å; Q75-I79 VanDerWaalsContact O-CG1 3.27Å; Q75-I79 WeakPolarHBondContact O-CG1 3.44Å; Q75-I79 PolarHBondContact O-N 2.92Å; L76-I79 PolarHBondContact O-N 3.1Å; K77-I79 PolarHBondContact O-N 3.4Å; I79-K83 HydrophobicContact CG2-CD 4.14Å; I79-K83 WeakPolarHBondContact O-CB 3.38Å; I79-K83 VanDerWaalsContact O-CG 3.28Å; I79-K83 WeakPolarHBondContact O-CG 3.43Å; I79-K83 PolarHBondContact O-N 3.01Å |
| 80 | T | 86.1 | Confident | 84 | Confident | 84 Ų | 84 | 87.4 Ų | 87.4 | 52% | 0.515 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -69.5 | -41.9 | 179.2 | -56.8 | 0 | 0 | 0 | 0 | 111.5 | L76 K77 I78 K83 S84 | L76-T80 WeakPolarHBondContact O-CB 3.42Å; L76-T80 PolarHBondContact O-N 3.11Å; L76-T80 PolarHBondContact O-OG1 3.19Å; K77-T80 WeakPolarHBondContact O-CB 3.37Å; K77-T80 PolarHBondContact O-N 3.13Å; K77-T80 VanDerWaalsContact O-N 3.15Å; I78-T80 PolarHBondContact O-N 3.3Å; T80-K83 WeakPolarHBondContact O-CB 3.49Å; T80-K83 PolarHBondContact O-N 3.49Å; T80-S84 PolarHBondContact O-N 3.1Å |
| 81 | D | 89.5 | Confident | 84.7 | Confident | 89 Ų | 89 | 86 Ų | 86 | 48% | 0.476 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.3 | -48.9 | 174.5 | -176.5 | 65.3 | 0 | 0 | 0 | 111.7 | K77 I78 K83 S84 Q85 | K77-D81 PolarHBondContact O-N 2.9Å; I78-D81 PolarHBondContact O-N 3.28Å; D81-K83 VanDerWaalsContact C-N 3.28Å; D81-K83 PolarHBondContact O-N 3.48Å; D81-S84 WeakPolarHBondContact O-CA 3.33Å; D81-S84 VanDerWaalsContact O-CB 3.25Å; D81-S84 WeakPolarHBondContact O-CB 3.3Å; D81-S84 PolarHBondContact O-N 3.34Å; D81-Q85 PolarHBondContact O-N 2.74Å; D81-Q85 PolarHBondContact OD2-NE2 3.4Å |
| 82 | I | 88.6 | Confident | 85.6 | Confident | 50 Ų | 50 | 87.2 Ų | 87.2 | 26% | 0.256 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60 | -39.8 | 177.4 | -63.2 | 168.4 | 0 | 0 | 0 | 111 | L60 L64 I78 S84 Q85 I86 | L60-I82 HydrophobicContact CD2-CG2 4.31Å; L64-I82 HydrophobicContact CD1-CB 4.25Å; L64-I82 HydrophobicContact CD1-CG2 3.56Å; L64-I82 HydrophobicContact CD2-CD1 4.34Å; I78-I82 HydrophobicContact CG2-CD1 3.81Å; I78-I82 HydrophobicContact CG2-CG1 4.41Å; I78-I82 WeakPolarHBondContact O-CG1 3.21Å; I78-I82 PolarHBondContact O-N 2.93Å; I82-S84 VanDerWaalsContact C-N 3.31Å; I82-S84 PolarHBondContact O-N 3.34Å; I82-Q85 PolarHBondContact O-N 3.16Å; I82-I86 HydrophobicContact CG2-CD1 4.02Å; I82-I86 HydrophobicContact CG2-CG1 4.38Å; I82-I86 VanDerWaalsContact O-CG1 3.26Å; I82-I86 WeakPolarHBondContact O-CG1 3.23Å; I82-I86 PolarHBondContact O-N 2.99Å |
| 83 | K | 88.4 | Confident | 86.1 | Confident | 90 Ų | 90 | 84.3 Ų | 84.3 | 39% | 0.391 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.7 | -37.6 | 174.2 | -79.9 | 170.6 | 178.3 | 169.7 | 0 | 112.4 | I79 T80 D81 I86 K87 | I79-K83 HydrophobicContact CG2-CD 4.14Å; I79-K83 WeakPolarHBondContact O-CB 3.38Å; I79-K83 VanDerWaalsContact O-CG 3.28Å; I79-K83 WeakPolarHBondContact O-CG 3.43Å; I79-K83 PolarHBondContact O-N 3.01Å; T80-K83 WeakPolarHBondContact O-CB 3.49Å; T80-K83 PolarHBondContact O-N 3.49Å; D81-K83 VanDerWaalsContact C-N 3.28Å; D81-K83 PolarHBondContact O-N 3.48Å; K83-I86 PolarHBondContact O-N 3.31Å; K83-K87 PolarHBondContact O-N 3.03Å; K83-K87 VanDerWaalsContact O-N 3.14Å |
| 84 | S | 90.1 | Very high | 86.4 | Confident | 73 Ų | 73 | 81.2 Ų | 81.2 | 51% | 0.51 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.4 | -48.7 | 174.8 | -168.2 | 0 | 0 | 0 | 0 | 110.9 | T80 D81 I82 I86 K87 E88 | T80-S84 PolarHBondContact O-N 3.1Å; D81-S84 WeakPolarHBondContact O-CA 3.33Å; D81-S84 VanDerWaalsContact O-CB 3.25Å; D81-S84 WeakPolarHBondContact O-CB 3.3Å; D81-S84 PolarHBondContact O-N 3.34Å; I82-S84 VanDerWaalsContact C-N 3.31Å; I82-S84 PolarHBondContact O-N 3.34Å; S84-I86 VanDerWaalsContact C-N 3.32Å; S84-I86 PolarHBondContact O-N 3.14Å; S84-K87 WeakPolarHBondContact O-CB 3.48Å; S84-K87 PolarHBondContact O-N 2.99Å; S84-K87 VanDerWaalsContact O-N 3.07Å; S84-E88 PolarHBondContact O-N 2.93Å |
| 85 | Q | 91.1 | Very high | 86.7 | Confident | 77 Ų | 77 | 80.6 Ų | 80.6 | 36% | 0.36 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.5 | -36.2 | 177.4 | -63.8 | -174.1 | 34.4 | 0 | 0 | 112.9 | D81 I82 K87 E88 K89 | D81-Q85 PolarHBondContact O-N 2.74Å; D81-Q85 PolarHBondContact OD2-NE2 3.4Å; I82-Q85 PolarHBondContact O-N 3.16Å; Q85-K87 VanDerWaalsContact C-N 3.32Å; Q85-E88 PolarHBondContact O-N 3.4Å; Q85-K89 WeakPolarHBondContact O-CG 3.48Å; Q85-K89 PolarHBondContact O-N 3.01Å |
| 86 | I | 90.1 | Very high | 87.1 | Confident | 5 Ų | 5 | 81.1 Ų | 81.1 | 3% | 0.026 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -60.1 | -46 | 173.3 | -71.9 | 167.5 | 0 | 0 | 0 | 109.8 | L57 L60 R61 L64 I82 K83 S84 E88 K89 E90 | L57-I86 HydrophobicContact CB-CG2 4.42Å; L57-I86 HydrophobicContact CD2-CG1 4.3Å; L60-I86 HydrophobicContact CD2-CD1 4.15Å; L60-I86 HydrophobicContact CG-CD1 4.35Å; R61-I86 HydrophobicContact CB-CD1 4.49Å; L64-I86 HydrophobicContact CD1-CD1 3.86Å; I82-I86 HydrophobicContact CG2-CD1 4.02Å; I82-I86 HydrophobicContact CG2-CG1 4.38Å; I82-I86 VanDerWaalsContact O-CG1 3.26Å; I82-I86 WeakPolarHBondContact O-CG1 3.23Å; I82-I86 PolarHBondContact O-N 2.99Å; K83-I86 PolarHBondContact O-N 3.31Å; S84-I86 VanDerWaalsContact C-N 3.32Å; S84-I86 PolarHBondContact O-N 3.14Å; I86-E88 PolarHBondContact O-N 2.95Å; I86-K89 PolarHBondContact O-N 3.22Å; I86-E90 HydrophobicContact CG2-CG 4.46Å; I86-E90 WeakPolarHBondContact O-CG 3.13Å; I86-E90 PolarHBondContact O-N 3.34Å |
| 87 | K | 89.2 | Confident | 87.2 | Confident | 133 Ų | 133 | 79 Ų | 79 | 58% | 0.578 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -64.4 | -39.4 | 179.7 | -172.7 | -178.9 | 179.1 | -174.3 | 0 | 112.1 | K83 S84 Q85 E90 N91 | K83-K87 PolarHBondContact O-N 3.03Å; K83-K87 VanDerWaalsContact O-N 3.14Å; S84-K87 WeakPolarHBondContact O-CB 3.48Å; S84-K87 PolarHBondContact O-N 2.99Å; S84-K87 VanDerWaalsContact O-N 3.07Å; Q85-K87 VanDerWaalsContact C-N 3.32Å; K87-E90 PolarHBondContact O-N 3.23Å; K87-N91 VanDerWaalsContact O-CG 3.3Å; K87-N91 PolarHBondContact O-N 3.07Å; K87-N91 PolarHBondContact O-ND2 3.21Å |
| 88 | E | 90.3 | Very high | 87 | Confident | 126 Ų | 126 | 73.2 Ų | 73.2 | 59% | 0.589 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.7 | -47.6 | 175.1 | -172.1 | 179.2 | -173.6 | 0 | 0 | 111.5 | S84 Q85 I86 E90 N91 V92 | S84-E88 PolarHBondContact O-N 2.93Å; Q85-E88 PolarHBondContact O-N 3.4Å; I86-E88 PolarHBondContact O-N 2.95Å; E88-E90 VanDerWaalsContact C-N 3.31Å; E88-E90 PolarHBondContact O-N 3.02Å; E88-N91 WeakPolarHBondContact O-CB 3.14Å; E88-N91 PolarHBondContact O-N 2.99Å; E88-N91 VanDerWaalsContact O-N 3.12Å; E88-V92 WeakPolarHBondContact O-CG2 3.45Å; E88-V92 PolarHBondContact O-N 3.38Å |
| 89 | K | 90.1 | Very high | 86.7 | Confident | 88 Ų | 88 | 73.9 Ų | 73.9 | 38% | 0.383 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.5 | -39.3 | 174.9 | -69.9 | -178.9 | 179.5 | 89.1 | 0 | 112.2 | L57 Q85 I86 N91 V92 F93 | L57-K89 HydrophobicContact CD1-CB 4.01Å; L57-K89 HydrophobicContact CD2-CD 4.48Å; Q85-K89 WeakPolarHBondContact O-CG 3.48Å; Q85-K89 PolarHBondContact O-N 3.01Å; I86-K89 PolarHBondContact O-N 3.22Å; K89-N91 VanDerWaalsContact C-N 3.32Å; K89-N91 PolarHBondContact O-N 3.46Å; K89-V92 PolarHBondContact O-N 3.33Å; K89-F93 HydrophobicContact CB-CZ 4.44Å; K89-F93 WeakPolarHBondContact O-CD2 3.36Å; K89-F93 WeakPolarHBondContact O-CG 3.36Å; K89-F93 PolarHBondContact O-N 3.42Å |
| 90 | E | 87.4 | Confident | 86.7 | Confident | 65 Ų | 65 | 74.4 Ų | 74.4 | 30% | 0.304 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61 | -38.7 | 174.2 | -76.9 | 176.2 | 166.3 | 0 | 0 | 112.5 | R61 I86 K87 E88 F93 F94 | R61-E90 IonicContact NH1-OE1 3.99Å; I86-E90 HydrophobicContact CG2-CG 4.46Å; I86-E90 WeakPolarHBondContact O-CG 3.13Å; I86-E90 PolarHBondContact O-N 3.34Å; K87-E90 PolarHBondContact O-N 3.23Å; E88-E90 VanDerWaalsContact C-N 3.31Å; E88-E90 PolarHBondContact O-N 3.02Å; E90-F93 PolarHBondContact O-N 3.25Å; E90-F94 PolarHBondContact O-N 3.44Å; E90-F94 VanDerWaalsContact O-N 3.08Å |
| 91 | N | 86.3 | Confident | 86.5 | Confident | 94 Ų | 94 | 72.5 Ų | 72.5 | 50% | 0.503 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -66.4 | -43.9 | 174.9 | -66.3 | -27.9 | 0 | 0 | 0 | 111.5 | K87 E88 K89 F93 F94 D95 | K87-N91 VanDerWaalsContact O-CG 3.3Å; K87-N91 PolarHBondContact O-N 3.07Å; K87-N91 PolarHBondContact O-ND2 3.21Å; E88-N91 WeakPolarHBondContact O-CB 3.14Å; E88-N91 PolarHBondContact O-N 2.99Å; E88-N91 VanDerWaalsContact O-N 3.12Å; K89-N91 VanDerWaalsContact C-N 3.32Å; K89-N91 PolarHBondContact O-N 3.46Å; N91-F93 VanDerWaalsContact C-N 3.31Å; N91-F93 PolarHBondContact O-N 2.95Å; N91-F94 VanDerWaalsContact O-CB 3.31Å; N91-F94 WeakPolarHBondContact O-CB 3.23Å; N91-F94 PolarHBondContact O-N 2.98Å; N91-F94 VanDerWaalsContact O-N 3.08Å; N91-D95 PolarHBondContact O-N 2.87Å; N91-D95 VanDerWaalsContact O-N 3.12Å |
| 92 | V | 88.3 | Confident | 86 | Confident | 64 Ų | 64 | 70.9 Ų | 70.9 | 39% | 0.388 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.3 | -42.4 | 176.4 | 174.1 | 0 | 0 | 0 | 0 | 111 | E88 K89 F94 D95 M96 | E88-V92 WeakPolarHBondContact O-CG2 3.45Å; E88-V92 PolarHBondContact O-N 3.38Å; K89-V92 PolarHBondContact O-N 3.33Å; V92-F94 VanDerWaalsContact C-N 3.29Å; V92-F94 PolarHBondContact O-N 3.04Å; V92-D95 PolarHBondContact O-N 3.09Å; V92-M96 HydrophobicContact CG1-CE 3.58Å; V92-M96 HydrophobicContact CG1-SD 4.16Å; V92-M96 WeakPolarHBondContact O-CG 3.49Å; V92-M96 PolarHBondContact O-N 3.42Å |
| 93 | F | 88.2 | Confident | 85.4 | Confident | 22 Ų | 22 | 78.2 Ų | 78.2 | 10% | 0.096 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.2 | -37 | 175.1 | -62 | -21.3 | 0 | 0 | 0 | 112.4 | I50 Q53 R54 L57 K89 E90 N91 D95 M96 E97 | I50-F93 HydrophobicContact CG2-CB 4.12Å; I50-F93 HydrophobicContact CG2-CG 4.21Å; Q53-F93 HydrophobicContact CB-CE2 3.93Å; Q53-F93 HydrophobicContact CB-CZ 3.64Å; Q53-F93 HydrophobicContact CG-CZ 4.27Å; R54-F93 HydrophobicContact CG-CD2 3.96Å; R54-F93 HydrophobicContact CG-CE2 4.39Å; L57-F93 HydrophobicContact CD1-CE2 3.63Å; L57-F93 HydrophobicContact CD1-CZ 4.3Å; K89-F93 HydrophobicContact CB-CZ 4.44Å; K89-F93 WeakPolarHBondContact O-CD2 3.36Å; K89-F93 WeakPolarHBondContact O-CG 3.36Å; K89-F93 PolarHBondContact O-N 3.42Å; E90-F93 PolarHBondContact O-N 3.25Å; N91-F93 VanDerWaalsContact C-N 3.31Å; N91-F93 PolarHBondContact O-N 2.95Å; F93-D95 VanDerWaalsContact C-N 3.33Å; F93-D95 PolarHBondContact O-N 3.36Å; F93-M96 HydrophobicContact CD1-SD 4.36Å; F93-M96 PolarHBondContact O-N 2.91Å; F93-E97 WeakPolarHBondContact O-CB 3.5Å; F93-E97 VanDerWaalsContact O-CG 3.3Å; F93-E97 WeakPolarHBondContact O-CG 3.41Å; F93-E97 PolarHBondContact O-N 3.26Å |
| 94 | F | 82.1 | Confident | 84.9 | Confident | 104 Ų | 104 | 75.2 Ų | 75.2 | 46% | 0.456 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 176.2 | 179.8 | -91.1 | 0 | 0 | 0 | 112 | E90 N91 V92 A98 | E90-F94 PolarHBondContact O-N 3.44Å; E90-F94 VanDerWaalsContact O-N 3.08Å; N91-F94 VanDerWaalsContact O-CB 3.31Å; N91-F94 WeakPolarHBondContact O-CB 3.23Å; N91-F94 PolarHBondContact O-N 2.98Å; N91-F94 VanDerWaalsContact O-N 3.08Å; V92-F94 VanDerWaalsContact C-N 3.29Å; V92-F94 PolarHBondContact O-N 3.04Å; F94-A98 PolarHBondContact O-N 3.43Å |
| 95 | D | 82.6 | Confident | 84.4 | Confident | 102 Ų | 102 | 73.7 Ų | 73.7 | 55% | 0.545 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69.4 | -40.9 | 177.7 | -68 | -23.3 | 0 | 0 | 0 | 111.9 | N91 V92 F93 A98 Y99 | N91-D95 PolarHBondContact O-N 2.87Å; N91-D95 VanDerWaalsContact O-N 3.12Å; V92-D95 PolarHBondContact O-N 3.09Å; F93-D95 VanDerWaalsContact C-N 3.33Å; F93-D95 PolarHBondContact O-N 3.36Å; D95-A98 VanDerWaalsContact O-CB 3.27Å; D95-A98 WeakPolarHBondContact O-CB 3.2Å; D95-A98 PolarHBondContact O-N 2.96Å; D95-Y99 WeakPolarHBondContact O-CD2 3.28Å |
| 96 | M | 86 | Confident | 83.9 | Confident | 99 Ų | 99 | 77.6 Ų | 77.6 | 49% | 0.488 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.9 | -45.5 | 174.2 | -69.7 | 176 | 174.7 | 0 | 0 | 111.8 | I50 V92 F93 A98 Y99 | I50-M96 HydrophobicContact CD1-CB 3.93Å; V92-M96 HydrophobicContact CG1-CE 3.58Å; V92-M96 HydrophobicContact CG1-SD 4.16Å; V92-M96 WeakPolarHBondContact O-CG 3.49Å; V92-M96 PolarHBondContact O-N 3.42Å; F93-M96 HydrophobicContact CD1-SD 4.36Å; F93-M96 PolarHBondContact O-N 2.91Å; M96-A98 PolarHBondContact O-N 3.27Å; M96-Y99 PolarHBondContact O-N 2.89Å |
| 97 | E | 84.1 | Confident | 83.5 | Confident | 40 Ų | 40 | 80.8 Ų | 80.8 | 19% | 0.187 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.8 | -17.8 | 178.8 | -75.7 | -180 | 158 | 0 | 0 | 113.3 | I50 R54 F93 Y99 L100 K102 | I50-E97 HydrophobicContact CD1-CG 4.13Å; I50-E97 HydrophobicContact CG2-CG 4.26Å; I50-E97 WeakPolarHBondContact CG2-OE1 3.45Å; R54-E97 IonicContact CZ-OE1 3.24Å; R54-E97 IonicContact CZ-OE2 2.81Å; R54-E97 VanDerWaalsContact CZ-OE2 3.24Å; R54-E97 IonicContact NH1-OE1 2.98Å; R54-E97 PolarHBondContact NH1-OE1 3.28Å; R54-E97 IonicContact NH1-OE2 2.82Å; R54-E97 PolarHBondContact NH1-OE2 3.49Å; R54-E97 IonicContact NH2-OE1 2.7Å; R54-E97 IonicContact NH2-OE2 2.8Å; R54-E97 PolarHBondContact NH2-OE2 2.76Å; F93-E97 WeakPolarHBondContact O-CB 3.5Å; F93-E97 VanDerWaalsContact O-CG 3.3Å; F93-E97 WeakPolarHBondContact O-CG 3.41Å; F93-E97 PolarHBondContact O-N 3.26Å; E97-Y99 PolarHBondContact O-N 2.82Å; E97-Y99 VanDerWaalsContact O-N 3.14Å; E97-L100 PolarHBondContact O-N 3.48Å; E97-K102 WeakPolarHBondContact O-CE 3.06Å |
| 98 | A | 78.3 | Confident | 83.2 | Confident | 23 Ų | 23 | 74.5 Ų | 74.5 | 19% | 0.19 | 37% | 0.371 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -15.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | F94 D95 M96 K125 | F94-A98 PolarHBondContact O-N 3.43Å; D95-A98 VanDerWaalsContact O-CB 3.27Å; D95-A98 WeakPolarHBondContact O-CB 3.2Å; D95-A98 PolarHBondContact O-N 2.96Å; M96-A98 PolarHBondContact O-N 3.27Å; A98-K125 PolarHBondContact O-NZ 2.87Å |
| 99 | Y | 79.9 | Confident | 82.9 | Confident | 115 Ų | 115 | 70.3 Ų | 70.3 | 45% | 0.451 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.8 | 5.6 | 179.8 | -57.1 | -83.8 | 0 | 0 | 0 | 113 | D95 M96 E97 L120 N122 | D95-Y99 WeakPolarHBondContact O-CD2 3.28Å; M96-Y99 PolarHBondContact O-N 2.89Å; E97-Y99 PolarHBondContact O-N 2.82Å; E97-Y99 VanDerWaalsContact O-N 3.14Å; Y99-L120 WeakPolarHBondContact CD1-O 3.37Å; Y99-L120 WeakPolarHBondContact O-CD2 3.41Å; Y99-N122 PolarHBondContact OH-ND2 3.34Å |
| 100 | L | 84.6 | Confident | 82.7 | Confident | 19 Ų | 19 | 73.1 Ų | 73.1 | 10% | 0.099 | 37% | 0.374 | C | S | . | . | S | Bend | trans | -107.9 | 151.1 | 178.4 | -66.5 | 175.1 | 0 | 0 | 0 | 110.9 | Q43 C46 I50 E97 K102 T118 | Q43-L100 HydrophobicContact CB-CD2 4.33Å; Q43-L100 HydrophobicContact CG-CD2 4.16Å; C46-L100 HydrophobicContact CB-CD1 3.86Å; C46-L100 HydrophobicContact CB-CD2 3.92Å; I50-L100 HydrophobicContact CD1-CD1 3.65Å; E97-L100 PolarHBondContact O-N 3.48Å; L100-K102 PolarHBondContact O-N 3.38Å; L100-K102 VanDerWaalsContact O-N 3.16Å; L100-T118 WeakPolarHBondContact O-CG2 3.49Å |
| 101 | P | 81.8 | Confident | 82.6 | Confident | 45 Ų | 45 | 73.2 Ų | 73.2 | 29% | 0.292 | 38% | 0.378 | S | S | . | . | P | Polyproline II helix | trans | -47.5 | 118.3 | 168.8 | -31.8 | 39 | 0 | 0 | 0 | 112.7 | Q43 N116 | Q43-P101 HydrophobicContact CB-CG 4.38Å; Q43-P101 HydrophobicContact CG-CG 4.42Å; P101-N116 VanDerWaalsContact CB-ND2 3.3Å; P101-N116 WeakPolarHBondContact CB-ND2 3.31Å |
| 102 | K | 77.8 | Confident | 82.5 | Confident | 55 Ų | 55 | 71.8 Ų | 71.8 | 24% | 0.239 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -98.5 | 148.5 | 176.1 | -68.6 | -175.9 | -177.6 | -176.7 | 0 | 111.1 | E97 L100 T118 T183 | E97-K102 WeakPolarHBondContact O-CE 3.06Å; L100-K102 PolarHBondContact O-N 3.38Å; L100-K102 VanDerWaalsContact O-N 3.16Å; K102-T118 PolarHBondContact N-OG1 3.2Å; K102-T183 HydrophobicContact CB-CG2 4.18Å; K102-T183 WeakPolarHBondContact CD-O 3.44Å |
| 103 | K | 75.8 | Confident | 82.2 | Confident | 203 Ų | 203 | 70.1 Ų | 70.1 | 88% | 0.883 | 37% | 0.367 | S | S | * | . | P | Polyproline II helix | trans | -70.9 | 134.8 | 168 | -65.5 | -171.4 | 178.9 | -174.4 | 0 | 109.2 | ||
| 104 | N | 79.6 | Confident | 81.6 | Confident | 27 Ų | 27 | 77 Ų | 77 | 14% | 0.144 | 40% | 0.404 | C | S | . | . | P | Polyproline II helix | trans | -62 | 143.6 | 174.5 | -66.1 | -16.1 | 0 | 0 | 0 | 110.3 | L108 G113 V115 | N104-L108 HydrophobicContact CB-CB 4.13Å; N104-L108 HydrophobicContact CB-CD2 4.21Å; N104-L108 HydrophobicContact CB-CG 4.27Å; N104-G113 PolarHBondContact ND2-O 3.34Å; N104-V115 PolarHBondContact ND2-O 3.07Å |
| 105 | G | 78.3 | Confident | 81.6 | Confident | 41 Ų | 41 | 76.3 Ų | 76.3 | 42% | 0.423 | 41% | 0.409 | S | S | . | . | P | Polyproline II helix | trans | -67 | 161.3 | 167.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y107 L108 S109 | G105-Y107 VanDerWaalsContact C-N 3.33Å; G105-Y107 PolarHBondContact O-N 3.16Å; G105-Y107 VanDerWaalsContact O-N 3.16Å; G105-L108 PolarHBondContact O-N 3.16Å; G105-S109 PolarHBondContact O-N 3.08Å; G105-S109 PolarHBondContact O-OG 2.83Å |
| 106 | L | 80.8 | Confident | 81.4 | Confident | 160 Ų | 160 | 75.2 Ų | 75.2 | 84% | 0.838 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -47 | -48.6 | -173.4 | -70.6 | 169.1 | 0 | 0 | 0 | 114.3 | S109 L110 | L106-S109 VanDerWaalsContact CA-OG 3.32Å; L106-S109 WeakPolarHBondContact CA-OG 3.21Å; L106-S109 PolarHBondContact O-OG 3.07Å; L106-L110 WeakPolarHBondContact O-CB 2.98Å; L106-L110 PolarHBondContact O-N 3.35Å |
| 107 | Y | 83 | Confident | 81.3 | Confident | 71 Ų | 71 | 71.7 Ų | 71.7 | 28% | 0.278 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.4 | -48.4 | 178.6 | 174.3 | -109.2 | 0 | 0 | 0 | 112 | G105 S109 L110 V111 T175 I176 S179 Y197 | G105-Y107 VanDerWaalsContact C-N 3.33Å; G105-Y107 PolarHBondContact O-N 3.16Å; G105-Y107 VanDerWaalsContact O-N 3.16Å; Y107-S109 PolarHBondContact O-N 3.14Å; Y107-L110 WeakPolarHBondContact O-CB 3.38Å; Y107-L110 PolarHBondContact O-N 3.09Å; Y107-V111 HydrophobicContact CD2-CG2 4.2Å; Y107-V111 HydrophobicContact CE1-CG2 4.42Å; Y107-V111 HydrophobicContact CE2-CG2 3.74Å; Y107-V111 WeakPolarHBondContact O-CG2 3.45Å; Y107-V111 PolarHBondContact O-N 3.48Å; Y107-T175 PolarHBondContact OH-OG1 3.37Å; Y107-I176 HydrophobicContact CE1-CG1 4.26Å; Y107-S179 WeakPolarHBondContact CD1-OG 3.4Å; Y107-Y197 WeakPolarHBondContact CD1-OH 3.38Å; Y107-Y197 HydrophobicContact CD2-CE1 4.15Å; Y107-Y197 HydrophobicContact CE1-CE1 4.3Å; Y107-Y197 WeakPolarHBondContact CE1-OH 3.32Å; Y107-Y197 AromaticContact CE2-CE1 3.87Å; Y107-Y197 HydrophobicContact CE2-CE1 3.87Å; Y107-Y197 HydrophobicContact CG-CE1 4.5Å; Y107-Y197 VanDerWaalsContact CG-OH 3.32Å; Y107-Y197 AromaticContact CZ-CE1 3.94Å |
| 108 | L | 81.8 | Confident | 81.3 | Confident | 2 Ų | 2 | 70.6 Ų | 70.6 | 1% | 0.01 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -69.5 | -35.8 | -177.2 | -167.6 | 67 | 0 | 0 | 0 | 111.7 | N104 G105 L110 V111 L112 V117 I176 I180 | N104-L108 HydrophobicContact CB-CB 4.13Å; N104-L108 HydrophobicContact CB-CD2 4.21Å; N104-L108 HydrophobicContact CB-CG 4.27Å; G105-L108 PolarHBondContact O-N 3.16Å; L108-L110 VanDerWaalsContact C-N 3.31Å; L108-V111 PolarHBondContact O-N 3.22Å; L108-L112 HydrophobicContact CD1-CD1 3.38Å; L108-L112 HydrophobicContact CD1-CG 3.92Å; L108-L112 HydrophobicContact CG-CD1 3.98Å; L108-L112 HydrophobicContact CG-CG 4.5Å; L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 PolarHBondContact O-N 3.12Å; L108-V117 HydrophobicContact CD2-CG2 3.6Å; L108-I176 HydrophobicContact CD1-CG2 4.46Å; L108-I180 HydrophobicContact CD1-CG1 3.96Å; L108-I180 HydrophobicContact CD2-CG1 4.22Å |
| 109 | S | 84.6 | Confident | 81.5 | Confident | 37 Ų | 37 | 71.3 Ų | 71.3 | 26% | 0.259 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -66.6 | -32.9 | 172.2 | 55 | 0 | 0 | 0 | 0 | 112.6 | G105 L106 Y107 G113 | G105-S109 PolarHBondContact O-N 3.08Å; G105-S109 PolarHBondContact O-OG 2.83Å; L106-S109 VanDerWaalsContact CA-OG 3.32Å; L106-S109 WeakPolarHBondContact CA-OG 3.21Å; L106-S109 PolarHBondContact O-OG 3.07Å; Y107-S109 PolarHBondContact O-N 3.14Å; S109-G113 WeakPolarHBondContact O-CA 3.49Å; S109-G113 PolarHBondContact O-N 3.32Å |
| 110 | L | 85.4 | Confident | 81.5 | Confident | 148 Ų | 148 | 69.1 Ų | 69.1 | 78% | 0.775 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -69.2 | -42.1 | 176 | -176.8 | 68.6 | 0 | 0 | 0 | 111.2 | L106 Y107 L108 | L106-L110 WeakPolarHBondContact O-CB 2.98Å; L106-L110 PolarHBondContact O-N 3.35Å; Y107-L110 WeakPolarHBondContact O-CB 3.38Å; Y107-L110 PolarHBondContact O-N 3.09Å; L108-L110 VanDerWaalsContact C-N 3.31Å |
| 111 | V | 86.4 | Confident | 81.4 | Confident | 66 Ų | 66 | 70.9 Ų | 70.9 | 40% | 0.4 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -81.9 | -42.3 | -175.2 | 176.7 | 0 | 0 | 0 | 0 | 112.8 | Y107 L108 I176 | Y107-V111 HydrophobicContact CD2-CG2 4.2Å; Y107-V111 HydrophobicContact CE1-CG2 4.42Å; Y107-V111 HydrophobicContact CE2-CG2 3.74Å; Y107-V111 WeakPolarHBondContact O-CG2 3.45Å; Y107-V111 PolarHBondContact O-N 3.48Å; L108-V111 PolarHBondContact O-N 3.22Å; V111-I176 HydrophobicContact CG1-CD1 3.86Å; V111-I176 HydrophobicContact CG1-CG1 4.16Å |
| 112 | L | 84 | Confident | 81.3 | Confident | 64 Ų | 64 | 72.2 Ų | 72.2 | 34% | 0.335 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -106.5 | -5.1 | -174.6 | -60.5 | -178 | 0 | 0 | 0 | 113.8 | L108 V115 V117 I180 | L108-L112 HydrophobicContact CD1-CD1 3.38Å; L108-L112 HydrophobicContact CD1-CG 3.92Å; L108-L112 HydrophobicContact CG-CD1 3.98Å; L108-L112 HydrophobicContact CG-CG 4.5Å; L108-L112 WeakPolarHBondContact O-CB 3.32Å; L108-L112 PolarHBondContact O-N 3.12Å; L112-V115 WeakPolarHBondContact O-CG2 3.48Å; L112-V117 HydrophobicContact CD1-CG1 3.78Å; L112-I180 HydrophobicContact CD1-CD1 4.32Å |
| 113 | G | 81.4 | Confident | 81.5 | Confident | 30 Ų | 30 | 77.3 Ų | 77.3 | 31% | 0.309 | 42% | 0.422 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 69.2 | -155.2 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | N104 S109 V115 | N104-G113 PolarHBondContact ND2-O 3.34Å; S109-G113 WeakPolarHBondContact O-CA 3.49Å; S109-G113 PolarHBondContact O-N 3.32Å; G113-V115 PolarHBondContact O-N 3.43Å; G113-V115 VanDerWaalsContact O-N 3.14Å |
| 114 | N | 76.3 | Confident | 81.9 | Confident | 165 Ų | 165 | 69.2 Ų | 69.2 | 88% | 0.882 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | 23.9 | -177.6 | -72.9 | -21.6 | 0 | 0 | 0 | 113.8 | ||
| 115 | V | 80.6 | Confident | 82.2 | Confident | 91 Ų | 91 | 69.6 Ų | 69.6 | 55% | 0.552 | 39% | 0.393 | S | S | * | . | trans | -76 | 128.7 | 178.1 | -179.8 | 0 | 0 | 0 | 0 | 110.1 | N104 L112 G113 V117 | N104-V115 PolarHBondContact ND2-O 3.07Å; L112-V115 WeakPolarHBondContact O-CG2 3.48Å; G113-V115 PolarHBondContact O-N 3.43Å; G113-V115 VanDerWaalsContact O-N 3.14Å; V115-V117 PolarHBondContact O-N 3.37Å | ||
| 116 | N | 79.6 | Confident | 82.4 | Confident | 79 Ų | 79 | 71.5 Ų | 71.5 | 42% | 0.422 | 39% | 0.39 | S | S | . | . | trans | -75.6 | 113.4 | 177.2 | -178.6 | 17 | 0 | 0 | 0 | 110.9 | P101 T118 | P101-N116 VanDerWaalsContact CB-ND2 3.3Å; P101-N116 WeakPolarHBondContact CB-ND2 3.31Å; N116-T118 WeakPolarHBondContact OD1-CB 3.05Å; N116-T118 PolarHBondContact OD1-N 2.9Å; N116-T118 PolarHBondContact OD1-OG1 3.44Å | ||
| 117 | V | 83.4 | Confident | 82.6 | Confident | 25 Ų | 25 | 66.4 Ų | 66.4 | 15% | 0.152 | 37% | 0.371 | C | S | . | . | trans | -97.6 | 16.2 | 176.2 | -61.6 | 0 | 0 | 0 | 0 | 113.2 | L108 L112 V115 L119 I180 T183 N184 | L108-V117 HydrophobicContact CD2-CG2 3.6Å; L112-V117 HydrophobicContact CD1-CG1 3.78Å; V115-V117 PolarHBondContact O-N 3.37Å; V117-L119 PolarHBondContact O-N 3.22Å; V117-I180 HydrophobicContact CB-CG1 4.43Å; V117-I180 HydrophobicContact CB-CG2 4.38Å; V117-I180 HydrophobicContact CG1-CG1 4.49Å; V117-I180 HydrophobicContact CG2-CG1 4.31Å; V117-I180 HydrophobicContact CG2-CG2 4.43Å; V117-T183 HydrophobicContact CG2-CG2 4.37Å; V117-N184 PolarHBondContact O-ND2 3.36Å | ||
| 118 | T | 83.7 | Confident | 82.9 | Confident | 16 Ų | 16 | 65.6 Ų | 65.6 | 10% | 0.098 | 37% | 0.368 | C | S | . | . | trans | -74.2 | 121.6 | -176.2 | -52.4 | 0 | 0 | 0 | 0 | 110.8 | L100 K102 N116 L120 N184 | L100-T118 WeakPolarHBondContact O-CG2 3.49Å; K102-T118 PolarHBondContact N-OG1 3.2Å; N116-T118 WeakPolarHBondContact OD1-CB 3.05Å; N116-T118 PolarHBondContact OD1-N 2.9Å; N116-T118 PolarHBondContact OD1-OG1 3.44Å; T118-L120 HydrophobicContact CG2-CD2 4.36Å; T118-L120 PolarHBondContact O-N 2.95Å; T118-N184 WeakPolarHBondContact CA-OD1 3.43Å | ||
| 119 | L | 82.8 | Confident | 83.2 | Confident | 39 Ų | 39 | 68.2 Ų | 68.2 | 20% | 0.204 | 38% | 0.379 | C | S | . | . | trans | -86.1 | 105.8 | 174.3 | -58.2 | 173.8 | 0 | 0 | 0 | 107.9 | V117 S121 A124 K125 Y128 N184 | V117-L119 PolarHBondContact O-N 3.22Å; L119-S121 PolarHBondContact O-N 3.3Å; L119-A124 HydrophobicContact CB-CB 4.18Å; L119-A124 HydrophobicContact CD2-CB 4.31Å; L119-K125 HydrophobicContact CB-CG 3.76Å; L119-K125 HydrophobicContact CD1-CG 4.34Å; L119-K125 WeakPolarHBondContact O-CE 2.92Å; L119-Y128 HydrophobicContact CD1-CD1 4.45Å; L119-Y128 HydrophobicContact CD1-CD2 4.42Å; L119-Y128 HydrophobicContact CD1-CG 3.9Å; L119-N184 WeakPolarHBondContact CB-OD1 3.48Å; L119-N184 PolarHBondContact N-OD1 3.25Å | ||
| 120 | L | 80.9 | Confident | 83.3 | Confident | 68 Ų | 68 | 68.4 Ų | 68.4 | 36% | 0.356 | 38% | 0.377 | S | S | . | . | trans | -72.7 | -26.9 | -172.3 | -60.9 | 170.6 | 0 | 0 | 0 | 113.1 | Q43 Y99 T118 | Q43-L120 VanDerWaalsContact NE2-CD1 3.31Å; Y99-L120 WeakPolarHBondContact CD1-O 3.37Å; Y99-L120 WeakPolarHBondContact O-CD2 3.41Å; T118-L120 HydrophobicContact CG2-CD2 4.36Å; T118-L120 PolarHBondContact O-N 2.95Å | ||
| 121 | S | 81.4 | Confident | 83.6 | Confident | 56 Ų | 56 | 66 Ų | 66 | 39% | 0.392 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -104.5 | 146.5 | -179.4 | 73.9 | 0 | 0 | 0 | 0 | 112.3 | L119 Q123 A124 K125 | L119-S121 PolarHBondContact O-N 3.3Å; S121-Q123 PolarHBondContact O-N 3.2Å; S121-A124 PolarHBondContact O-N 3.19Å; S121-A124 WeakPolarHBondContact OG-CB 2.98Å; S121-A124 PolarHBondContact OG-N 2.8Å; S121-K125 WeakPolarHBondContact O-CG 3.17Å; S121-K125 PolarHBondContact O-N 2.62Å |
| 122 | N | 79.8 | Confident | 83.8 | Confident | 74 Ų | 74 | 63.2 Ų | 63.2 | 40% | 0.396 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.1 | -35.8 | 174.2 | -69.9 | -30.3 | 0 | 0 | 0 | 111.2 | Y99 A124 K125 F126 | Y99-N122 PolarHBondContact OH-ND2 3.34Å; N122-A124 PolarHBondContact O-N 3.31Å; N122-K125 WeakPolarHBondContact O-CB 3.14Å; N122-K125 PolarHBondContact O-N 3.38Å; N122-F126 HydrophobicContact CB-CE2 4.46Å; N122-F126 WeakPolarHBondContact O-CD2 3.3Å; N122-F126 PolarHBondContact O-N 2.8Å |
| 123 | Q | 82.1 | Confident | 84 | Confident | 161 Ų | 161 | 60.8 Ų | 60.8 | 75% | 0.752 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -60 | -44.4 | 173.8 | -170 | 178.5 | 9.1 | 0 | 0 | 112.1 | S121 K125 F126 A127 | S121-Q123 PolarHBondContact O-N 3.2Å; Q123-K125 PolarHBondContact O-N 3.16Å; Q123-F126 PolarHBondContact O-N 2.99Å; Q123-A127 WeakPolarHBondContact O-CB 3.45Å; Q123-A127 PolarHBondContact O-N 3.44Å |
| 124 | A | 84.1 | Confident | 84.4 | Confident | 33 Ų | 33 | 62.4 Ų | 62.4 | 27% | 0.273 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | L119 S121 N122 F126 A127 Y128 | L119-A124 HydrophobicContact CB-CB 4.18Å; L119-A124 HydrophobicContact CD2-CB 4.31Å; S121-A124 PolarHBondContact O-N 3.19Å; S121-A124 WeakPolarHBondContact OG-CB 2.98Å; S121-A124 PolarHBondContact OG-N 2.8Å; N122-A124 PolarHBondContact O-N 3.31Å; A124-F126 VanDerWaalsContact C-N 3.34Å; A124-F126 PolarHBondContact O-N 2.96Å; A124-A127 PolarHBondContact O-N 3.31Å; A124-Y128 WeakPolarHBondContact O-CB 3.19Å; A124-Y128 PolarHBondContact O-N 3.18Å |
| 125 | K | 85.1 | Confident | 85.3 | Confident | 36 Ų | 36 | 55.5 Ų | 55.5 | 16% | 0.157 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -59.4 | -44.3 | 173.8 | -66.8 | 173.7 | -170.8 | 172.2 | 0 | 111.6 | A98 L119 S121 N122 Q123 K129 | A98-K125 PolarHBondContact O-NZ 2.87Å; L119-K125 HydrophobicContact CB-CG 3.76Å; L119-K125 HydrophobicContact CD1-CG 4.34Å; L119-K125 WeakPolarHBondContact O-CE 2.92Å; S121-K125 WeakPolarHBondContact O-CG 3.17Å; S121-K125 PolarHBondContact O-N 2.62Å; N122-K125 WeakPolarHBondContact O-CB 3.14Å; N122-K125 PolarHBondContact O-N 3.38Å; Q123-K125 PolarHBondContact O-N 3.16Å; K125-K129 WeakPolarHBondContact O-CB 3.41Å; K125-K129 PolarHBondContact O-N 2.98Å; K125-K129 VanDerWaalsContact O-N 3.13Å |
| 126 | F | 82.4 | Confident | 85.8 | Confident | 81 Ų | 81 | 53 Ų | 53 | 36% | 0.355 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -68.1 | -44.1 | 177.2 | -76.1 | -62.1 | 0 | 0 | 0 | 112.6 | N122 Q123 A124 K129 D130 L244 | N122-F126 HydrophobicContact CB-CE2 4.46Å; N122-F126 WeakPolarHBondContact O-CD2 3.3Å; N122-F126 PolarHBondContact O-N 2.8Å; Q123-F126 PolarHBondContact O-N 2.99Å; A124-F126 VanDerWaalsContact C-N 3.34Å; A124-F126 PolarHBondContact O-N 2.96Å; F126-K129 PolarHBondContact O-N 3.48Å; F126-D130 WeakPolarHBondContact O-CB 3.32Å; F126-D130 PolarHBondContact O-N 3.2Å; F126-L244 HydrophobicContact CD1-CD1 4.27Å |
| 127 | A | 86.1 | Confident | 86.4 | Confident | 53 Ų | 53 | 50.4 Ų | 50.4 | 44% | 0.438 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61 | -45.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q123 A124 K129 D130 E131 | Q123-A127 WeakPolarHBondContact O-CB 3.45Å; Q123-A127 PolarHBondContact O-N 3.44Å; A124-A127 PolarHBondContact O-N 3.31Å; A127-K129 VanDerWaalsContact C-N 3.32Å; A127-K129 PolarHBondContact O-N 2.9Å; A127-D130 WeakPolarHBondContact O-CB 3.39Å; A127-D130 PolarHBondContact O-N 2.74Å; A127-E131 WeakPolarHBondContact O-CG 3.34Å; A127-E131 PolarHBondContact O-N 2.97Å |
| 128 | Y | 89.9 | Confident | 86.9 | Confident | 53 Ų | 53 | 56.2 Ų | 56.2 | 21% | 0.208 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.9 | -41.6 | 175.8 | -174.6 | -88.6 | 0 | 0 | 0 | 112.1 | L119 A124 D130 E131 Y132 R177 I180 L181 | L119-Y128 HydrophobicContact CD1-CD1 4.45Å; L119-Y128 HydrophobicContact CD1-CD2 4.42Å; L119-Y128 HydrophobicContact CD1-CG 3.9Å; A124-Y128 WeakPolarHBondContact O-CB 3.19Å; A124-Y128 PolarHBondContact O-N 3.18Å; Y128-D130 VanDerWaalsContact C-N 3.35Å; Y128-E131 PolarHBondContact O-N 2.66Å; Y128-Y132 WeakPolarHBondContact O-CB 3.36Å; Y128-Y132 PolarHBondContact O-N 3.45Å; Y128-R177 WeakPolarHBondContact OH-CA 3.29Å; Y128-I180 HydrophobicContact CD1-CG2 4.47Å; Y128-I180 HydrophobicContact CE1-CB 4.2Å; Y128-I180 HydrophobicContact CE1-CG2 3.83Å; Y128-I180 HydrophobicContact CE2-CG2 4.16Å; Y128-I180 VanDerWaalsContact OH-CD1 3.26Å; Y128-I180 WeakPolarHBondContact OH-CD1 3.31Å; Y128-L181 HydrophobicContact CD1-CD2 3.69Å; Y128-L181 HydrophobicContact CD1-CG 4.12Å; Y128-L181 HydrophobicContact CE1-CD2 4.06Å; Y128-L181 HydrophobicContact CE1-CG 3.95Å |
| 129 | K | 87.9 | Confident | 87.5 | Confident | 58 Ų | 58 | 57 Ų | 57 | 25% | 0.252 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -64.4 | -39.7 | 176.5 | -175 | 165.2 | -177 | 159.4 | 0 | 112.1 | K125 F126 A127 Y132 E133 L181 L244 | K125-K129 WeakPolarHBondContact O-CB 3.41Å; K125-K129 PolarHBondContact O-N 2.98Å; K125-K129 VanDerWaalsContact O-N 3.13Å; F126-K129 PolarHBondContact O-N 3.48Å; A127-K129 VanDerWaalsContact C-N 3.32Å; A127-K129 PolarHBondContact O-N 2.9Å; K129-Y132 PolarHBondContact O-N 2.83Å; K129-E133 WeakPolarHBondContact O-CG 3.11Å; K129-E133 PolarHBondContact O-N 3.08Å; K129-L181 HydrophobicContact CB-CD2 4.09Å; K129-L181 HydrophobicContact CG-CD2 4.44Å; K129-L244 HydrophobicContact CD-CD1 3.89Å; K129-L244 HydrophobicContact CG-CD1 4.34Å; K129-L244 HydrophobicContact CG-CD2 4.31Å |
| 130 | D | 87 | Confident | 88 | Confident | 41 Ų | 41 | 55.2 Ų | 55.2 | 22% | 0.219 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.3 | -49.1 | 174.9 | -159.9 | 84 | 0 | 0 | 0 | 111 | F126 A127 Y128 Y132 E133 K134 R248 | F126-D130 WeakPolarHBondContact O-CB 3.32Å; F126-D130 PolarHBondContact O-N 3.2Å; A127-D130 WeakPolarHBondContact O-CB 3.39Å; A127-D130 PolarHBondContact O-N 2.74Å; Y128-D130 VanDerWaalsContact C-N 3.35Å; D130-Y132 VanDerWaalsContact C-N 3.31Å; D130-Y132 PolarHBondContact O-N 3.4Å; D130-E133 PolarHBondContact O-N 3.46Å; D130-K134 WeakPolarHBondContact O-CG 3.35Å; D130-K134 PolarHBondContact O-N 2.8Å; D130-K134 WeakPolarHBondContact OD2-CE 3.48Å; D130-K134 IonicContact OD2-NZ 3.15Å; D130-K134 PolarHBondContact OD2-NZ 2.79Å; D130-R248 IonicContact OD1-NH2 3.33Å; D130-R248 PolarHBondContact OD1-NH2 3.17Å; D130-R248 VanDerWaalsContact OD1-NH2 3.13Å |
| 131 | E | 90.6 | Very high | 88.7 | Confident | 97 Ų | 97 | 54.7 Ų | 54.7 | 45% | 0.453 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.4 | -30.8 | 176.7 | -70 | -54.2 | 125.4 | 0 | 0 | 113.4 | A127 Y128 K134 F135 R177 | A127-E131 WeakPolarHBondContact O-CG 3.34Å; A127-E131 PolarHBondContact O-N 2.97Å; Y128-E131 PolarHBondContact O-N 2.66Å; E131-K134 IonicContact OE1-NZ 3.2Å; E131-K134 PolarHBondContact OE1-NZ 2.74Å; E131-F135 VanDerWaalsContact O-CB 3.23Å; E131-F135 WeakPolarHBondContact O-CB 3.25Å; E131-F135 PolarHBondContact O-N 3.33Å; E131-R177 PolarHBondContact O-NH1 2.78Å; E131-R177 VanDerWaalsContact O-NH1 3.15Å |
| 132 | Y | 91.1 | Very high | 89.4 | Confident | 8 Ų | 8 | 56.1 Ų | 56.1 | 3% | 0.031 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -66.7 | -44.1 | 170.9 | 163.2 | -98.4 | 0 | 0 | 0 | 112.2 | Y128 K129 D130 F135 K136 L174 R177 E178 L181 | Y128-Y132 WeakPolarHBondContact O-CB 3.36Å; Y128-Y132 PolarHBondContact O-N 3.45Å; K129-Y132 PolarHBondContact O-N 2.83Å; D130-Y132 VanDerWaalsContact C-N 3.31Å; D130-Y132 PolarHBondContact O-N 3.4Å; Y132-F135 PolarHBondContact O-N 3.25Å; Y132-K136 HydrophobicContact CE1-CD 4.11Å; Y132-K136 HydrophobicContact CE2-CD 4.24Å; Y132-K136 HydrophobicContact CE2-CG 4.46Å; Y132-K136 PolarHBondContact O-N 3.19Å; Y132-K136 VanDerWaalsContact O-N 3.13Å; Y132-K136 PolarHBondContact OH-NZ 2.93Å; Y132-L174 HydrophobicContact CD2-CD2 4.49Å; Y132-L174 HydrophobicContact CE2-CD2 3.73Å; Y132-R177 HydrophobicContact CD2-CB 3.63Å; Y132-R177 HydrophobicContact CD2-CG 4.4Å; Y132-R177 HydrophobicContact CE2-CB 4.09Å; Y132-E178 HydrophobicContact CE2-CG 3.98Å; Y132-E178 PolarHBondContact OH-OE1 3.28Å; Y132-L181 HydrophobicContact CD1-CD1 3.76Å; Y132-L181 HydrophobicContact CD2-CD1 4.38Å; Y132-L181 HydrophobicContact CE1-CD1 4Å; Y132-L181 HydrophobicContact CG-CD1 3.96Å |
| 133 | E | 88.7 | Confident | 90.2 | Very high | 12 Ų | 12 | 52.7 Ų | 52.7 | 6% | 0.056 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66.5 | -43.6 | 176.7 | -66.1 | -60.7 | 147.8 | 0 | 0 | 111.3 | K129 D130 F135 K136 L137 Y237 | K129-E133 WeakPolarHBondContact O-CG 3.11Å; K129-E133 PolarHBondContact O-N 3.08Å; D130-E133 PolarHBondContact O-N 3.46Å; E133-F135 VanDerWaalsContact C-N 3.35Å; E133-F135 PolarHBondContact O-N 3.41Å; E133-K136 VanDerWaalsContact CD-CE 3.4Å; E133-K136 WeakPolarHBondContact O-CB 3.48Å; E133-K136 PolarHBondContact O-N 3.06Å; E133-K136 WeakPolarHBondContact OE1-CE 3.44Å; E133-K136 IonicContact OE1-NZ 3.88Å; E133-K136 PolarHBondContact OE1-NZ 3.18Å; E133-K136 WeakPolarHBondContact OE2-CE 3.37Å; E133-K136 IonicContact OE2-NZ 3.26Å; E133-K136 PolarHBondContact OE2-NZ 2.83Å; E133-L137 PolarHBondContact O-N 3.15Å; E133-Y237 VanDerWaalsContact C-CE2 3.47Å; E133-Y237 HydrophobicContact CB-CD2 4.07Å; E133-Y237 HydrophobicContact CB-CE2 3.77Å; E133-Y237 VanDerWaalsContact O-CD2 3.32Å; E133-Y237 WeakPolarHBondContact O-CD2 3.47Å; E133-Y237 VanDerWaalsContact O-CE2 3.22Å; E133-Y237 WeakPolarHBondContact O-CE2 3.31Å |
| 134 | K | 89.8 | Confident | 90.9 | Very high | 64 Ų | 64 | 47.2 Ų | 47.2 | 28% | 0.278 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -58.7 | -44.8 | 174.6 | -73 | 176.6 | -171.4 | 150.1 | 0 | 112.2 | D130 E131 K136 L137 Y138 | D130-K134 WeakPolarHBondContact O-CG 3.35Å; D130-K134 PolarHBondContact O-N 2.8Å; D130-K134 WeakPolarHBondContact OD2-CE 3.48Å; D130-K134 IonicContact OD2-NZ 3.15Å; D130-K134 PolarHBondContact OD2-NZ 2.79Å; E131-K134 IonicContact OE1-NZ 3.2Å; E131-K134 PolarHBondContact OE1-NZ 2.74Å; K134-K136 VanDerWaalsContact C-N 3.31Å; K134-K136 PolarHBondContact O-N 3.45Å; K134-L137 WeakPolarHBondContact O-CB 3.08Å; K134-L137 PolarHBondContact O-N 3.4Å; K134-L137 VanDerWaalsContact O-N 3.1Å; K134-Y138 HydrophobicContact CB-CD2 4.37Å; K134-Y138 HydrophobicContact CB-CE2 4.09Å; K134-Y138 WeakPolarHBondContact O-CD2 3.11Å; K134-Y138 PolarHBondContact O-N 2.84Å |
| 135 | F | 93.4 | Very high | 91.5 | Very high | 21 Ų | 21 | 51.5 Ų | 51.5 | 9% | 0.092 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -56.2 | -45.3 | 175.8 | 169.5 | -96.2 | 0 | 0 | 0 | 112 | E131 Y132 E133 L137 Y138 M139 W169 Y170 T173 L174 R177 | E131-F135 VanDerWaalsContact O-CB 3.23Å; E131-F135 WeakPolarHBondContact O-CB 3.25Å; E131-F135 PolarHBondContact O-N 3.33Å; Y132-F135 PolarHBondContact O-N 3.25Å; E133-F135 VanDerWaalsContact C-N 3.35Å; E133-F135 PolarHBondContact O-N 3.41Å; F135-L137 VanDerWaalsContact C-N 3.32Å; F135-L137 PolarHBondContact O-N 3.44Å; F135-Y138 PolarHBondContact O-N 3Å; F135-M139 HydrophobicContact CD2-CE 4.43Å; F135-M139 HydrophobicContact CD2-CG 4.15Å; F135-M139 HydrophobicContact CE1-CG 4.25Å; F135-M139 HydrophobicContact CE2-CE 3.84Å; F135-M139 HydrophobicContact CE2-CG 3.74Å; F135-M139 HydrophobicContact CZ-CG 3.78Å; F135-M139 WeakPolarHBondContact O-CB 3.43Å; F135-M139 WeakPolarHBondContact O-CG 3.45Å; F135-M139 PolarHBondContact O-N 3.36Å; F135-W169 AromaticContact CE2-CH2 3.86Å; F135-W169 HydrophobicContact CE2-CH2 3.86Å; F135-W169 HydrophobicContact CE2-CZ3 4.26Å; F135-W169 HydrophobicContact CZ-CH2 4.03Å; F135-W169 HydrophobicContact CZ-CZ3 4.09Å; F135-Y170 AromaticContact CE1-CD2 3.94Å; F135-Y170 HydrophobicContact CE1-CD2 3.94Å; F135-Y170 AromaticContact CE1-CE2 3.95Å; F135-Y170 HydrophobicContact CE1-CE2 3.95Å; F135-Y170 HydrophobicContact CZ-CD2 4.2Å; F135-T173 HydrophobicContact CE1-CG2 3.76Å; F135-T173 HydrophobicContact CE2-CG2 4.15Å; F135-T173 HydrophobicContact CZ-CG2 3.43Å; F135-T173 VanDerWaalsContact CZ-CG2 3.43Å; F135-L174 HydrophobicContact CD1-CD2 4.19Å; F135-L174 HydrophobicContact CE1-CD2 3.98Å; F135-R177 VanDerWaalsContact CG-CZ 3.49Å |
| 136 | K | 92.2 | Very high | 92 | Very high | 38 Ų | 38 | 50.9 Ų | 50.9 | 17% | 0.165 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.2 | -45.2 | 174.6 | -77.4 | -172.7 | -64.5 | -176.4 | 0 | 111.5 | Y132 E133 K134 M139 T140 L174 | Y132-K136 HydrophobicContact CE1-CD 4.11Å; Y132-K136 HydrophobicContact CE2-CD 4.24Å; Y132-K136 HydrophobicContact CE2-CG 4.46Å; Y132-K136 PolarHBondContact O-N 3.19Å; Y132-K136 VanDerWaalsContact O-N 3.13Å; Y132-K136 PolarHBondContact OH-NZ 2.93Å; E133-K136 VanDerWaalsContact CD-CE 3.4Å; E133-K136 WeakPolarHBondContact O-CB 3.48Å; E133-K136 PolarHBondContact O-N 3.06Å; E133-K136 WeakPolarHBondContact OE1-CE 3.44Å; E133-K136 IonicContact OE1-NZ 3.88Å; E133-K136 PolarHBondContact OE1-NZ 3.18Å; E133-K136 WeakPolarHBondContact OE2-CE 3.37Å; E133-K136 IonicContact OE2-NZ 3.26Å; E133-K136 PolarHBondContact OE2-NZ 2.83Å; K134-K136 VanDerWaalsContact C-N 3.31Å; K134-K136 PolarHBondContact O-N 3.45Å; K136-M139 PolarHBondContact O-N 3.26Å; K136-T140 WeakPolarHBondContact O-CB 3.45Å; K136-T140 PolarHBondContact O-N 3.03Å; K136-T140 PolarHBondContact O-OG1 3.06Å; K136-L174 HydrophobicContact CD-CD2 4.08Å; K136-L174 HydrophobicContact CG-CD2 3.62Å |
| 137 | L | 92 | Very high | 92.7 | Very high | 24 Ų | 24 | 47 Ų | 47 | 13% | 0.126 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.5 | -53.2 | 178.8 | 179.8 | 67.7 | 0 | 0 | 0 | 111.8 | E133 K134 F135 M139 T140 I141 F234 Y237 | E133-L137 PolarHBondContact O-N 3.15Å; K134-L137 WeakPolarHBondContact O-CB 3.08Å; K134-L137 PolarHBondContact O-N 3.4Å; K134-L137 VanDerWaalsContact O-N 3.1Å; F135-L137 VanDerWaalsContact C-N 3.32Å; F135-L137 PolarHBondContact O-N 3.44Å; L137-M139 VanDerWaalsContact C-N 3.31Å; L137-M139 PolarHBondContact O-N 3.04Å; L137-T140 WeakPolarHBondContact O-CB 3.46Å; L137-T140 PolarHBondContact O-N 3.47Å; L137-I141 HydrophobicContact CD1-CD1 4.1Å; L137-I141 HydrophobicContact CD1-CG1 4.45Å; L137-I141 HydrophobicContact CG-CD1 4Å; L137-I141 WeakPolarHBondContact O-CG1 3.48Å; L137-I141 PolarHBondContact O-N 3.38Å; L137-F234 HydrophobicContact CD1-CD2 3.58Å; L137-F234 HydrophobicContact CD1-CE2 3.91Å; L137-Y237 HydrophobicContact CB-CD1 4.32Å; L137-Y237 HydrophobicContact CB-CD2 3.93Å; L137-Y237 HydrophobicContact CB-CE1 4.32Å; L137-Y237 HydrophobicContact CB-CE2 3.9Å; L137-Y237 HydrophobicContact CB-CG 4.13Å; L137-Y237 HydrophobicContact CD1-CD1 3.86Å; L137-Y237 HydrophobicContact CD1-CE1 4.22Å; L137-Y237 HydrophobicContact CD1-CG 4.19Å; L137-Y237 HydrophobicContact CD2-CD1 4.16Å; L137-Y237 HydrophobicContact CD2-CE1 3.64Å; L137-Y237 HydrophobicContact CD2-CE2 4.45Å; L137-Y237 HydrophobicContact CG-CD1 4.33Å; L137-Y237 HydrophobicContact CG-CE1 4.27Å |
| 138 | Y | 94.3 | Very high | 93.2 | Very high | 147 Ų | 147 | 46.8 Ų | 46.8 | 58% | 0.576 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -57.2 | -45.9 | -179.7 | -70.6 | -57 | 0 | 0 | 0 | 111.5 | K134 F135 I141 I142 | K134-Y138 HydrophobicContact CB-CD2 4.37Å; K134-Y138 HydrophobicContact CB-CE2 4.09Å; K134-Y138 WeakPolarHBondContact O-CD2 3.11Å; K134-Y138 PolarHBondContact O-N 2.84Å; F135-Y138 PolarHBondContact O-N 3Å; Y138-I141 PolarHBondContact O-N 3.23Å; Y138-I142 WeakPolarHBondContact O-CG1 3.44Å; Y138-I142 PolarHBondContact O-N 2.84Å |
| 139 | M | 94.9 | Very high | 93.4 | Very high | 32 Ų | 32 | 46.9 Ų | 46.9 | 16% | 0.158 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -68.6 | -37.3 | 179.1 | -70 | -59.3 | 163.3 | 0 | 0 | 112.9 | F135 K136 L137 I141 I142 L143 W169 Y170 | F135-M139 HydrophobicContact CD2-CE 4.43Å; F135-M139 HydrophobicContact CD2-CG 4.15Å; F135-M139 HydrophobicContact CE1-CG 4.25Å; F135-M139 HydrophobicContact CE2-CE 3.84Å; F135-M139 HydrophobicContact CE2-CG 3.74Å; F135-M139 HydrophobicContact CZ-CG 3.78Å; F135-M139 WeakPolarHBondContact O-CB 3.43Å; F135-M139 WeakPolarHBondContact O-CG 3.45Å; F135-M139 PolarHBondContact O-N 3.36Å; K136-M139 PolarHBondContact O-N 3.26Å; L137-M139 VanDerWaalsContact C-N 3.31Å; L137-M139 PolarHBondContact O-N 3.04Å; M139-I141 VanDerWaalsContact C-N 3.3Å; M139-I141 PolarHBondContact O-N 3.49Å; M139-I142 HydrophobicContact CE-CD1 4.41Å; M139-I142 PolarHBondContact O-N 2.98Å; M139-I142 HydrophobicContact SD-CD1 4.02Å; M139-L143 WeakPolarHBondContact O-CB 3.48Å; M139-L143 VanDerWaalsContact O-CG 3.23Å; M139-L143 WeakPolarHBondContact O-CG 3.4Å; M139-L143 PolarHBondContact O-N 3.35Å; M139-W169 HydrophobicContact CE-CH2 3.52Å; M139-W169 HydrophobicContact CE-CZ3 3.5Å; M139-W169 HydrophobicContact CG-CZ3 4.3Å; M139-W169 HydrophobicContact SD-CH2 4.28Å; M139-W169 HydrophobicContact SD-CZ3 3.63Å; M139-Y170 HydrophobicContact CB-CD2 3.59Å; M139-Y170 HydrophobicContact CB-CE2 3.56Å; M139-Y170 HydrophobicContact CB-CG 4.47Å; M139-Y170 HydrophobicContact CG-CD2 3.97Å; M139-Y170 HydrophobicContact CG-CE2 4.23Å |
| 140 | T | 94.4 | Very high | 93.7 | Very high | 3 Ų | 3 | 44.5 Ų | 44.5 | 2% | 0.018 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.2 | -43.1 | 174.4 | -62 | 0 | 0 | 0 | 0 | 111.1 | K136 L137 L143 M144 S230 Q233 F234 | K136-T140 WeakPolarHBondContact O-CB 3.45Å; K136-T140 PolarHBondContact O-N 3.03Å; K136-T140 PolarHBondContact O-OG1 3.06Å; L137-T140 WeakPolarHBondContact O-CB 3.46Å; L137-T140 PolarHBondContact O-N 3.47Å; T140-L143 PolarHBondContact O-N 2.8Å; T140-M144 VanDerWaalsContact O-CB 3.31Å; T140-M144 WeakPolarHBondContact O-CB 3.07Å; T140-M144 PolarHBondContact O-N 3.23Å; T140-S230 WeakPolarHBondContact CG2-O 3.08Å; T140-Q233 HydrophobicContact CG2-CB 3.8Å; T140-Q233 PolarHBondContact OG1-OE1 3.35Å; T140-F234 HydrophobicContact CG2-CB 4.46Å |
| 141 | I | 95.4 | Very high | 94.1 | Very high | 57 Ų | 57 | 44.3 Ų | 44.3 | 29% | 0.292 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -64.2 | -48 | 177.5 | -67.5 | 168 | 0 | 0 | 0 | 110.5 | L137 Y138 M139 L143 M144 F145 | L137-I141 HydrophobicContact CD1-CD1 4.1Å; L137-I141 HydrophobicContact CD1-CG1 4.45Å; L137-I141 HydrophobicContact CG-CD1 4Å; L137-I141 WeakPolarHBondContact O-CG1 3.48Å; L137-I141 PolarHBondContact O-N 3.38Å; Y138-I141 PolarHBondContact O-N 3.23Å; M139-I141 VanDerWaalsContact C-N 3.3Å; M139-I141 PolarHBondContact O-N 3.49Å; I141-L143 PolarHBondContact O-N 3.2Å; I141-M144 PolarHBondContact O-N 3.16Å; I141-F145 HydrophobicContact CG2-CD2 3.69Å; I141-F145 HydrophobicContact CG2-CE2 3.58Å; I141-F145 VanDerWaalsContact O-CD2 3.24Å; I141-F145 WeakPolarHBondContact O-CD2 3.4Å; I141-F145 PolarHBondContact O-N 3.38Å |
| 142 | I | 96.9 | Very high | 94.2 | Very high | 85 Ų | 85 | 46.5 Ų | 46.5 | 44% | 0.436 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -59.5 | -46.8 | 178 | -66.5 | 165.8 | 0 | 0 | 0 | 110.6 | Y138 M139 M144 F145 G146 L166 | Y138-I142 WeakPolarHBondContact O-CG1 3.44Å; Y138-I142 PolarHBondContact O-N 2.84Å; M139-I142 HydrophobicContact CE-CD1 4.41Å; M139-I142 PolarHBondContact O-N 2.98Å; M139-I142 HydrophobicContact SD-CD1 4.02Å; I142-M144 VanDerWaalsContact C-N 3.35Å; I142-M144 PolarHBondContact O-N 3.17Å; I142-F145 PolarHBondContact O-N 2.74Å; I142-G146 PolarHBondContact O-N 2.94Å; I142-L166 HydrophobicContact CG2-CD2 3.83Å |
| 143 | L | 96.6 | Very high | 94.2 | Very high | 2 Ų | 2 | 53.5 Ų | 53.5 | 1% | 0.01 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.8 | -39.1 | 178.5 | -72.9 | 169.9 | 0 | 0 | 0 | 112 | M139 T140 I141 G146 A147 F163 L166 L167 Y170 | M139-L143 WeakPolarHBondContact O-CB 3.48Å; M139-L143 VanDerWaalsContact O-CG 3.23Å; M139-L143 WeakPolarHBondContact O-CG 3.4Å; M139-L143 PolarHBondContact O-N 3.35Å; T140-L143 PolarHBondContact O-N 2.8Å; I141-L143 PolarHBondContact O-N 3.2Å; L143-G146 PolarHBondContact O-N 3.24Å; L143-A147 WeakPolarHBondContact O-CB 3.4Å; L143-A147 PolarHBondContact O-N 2.95Å; L143-F163 HydrophobicContact CB-CE2 4.46Å; L143-F163 HydrophobicContact CD2-CD2 4.43Å; L143-F163 HydrophobicContact CD2-CE2 3.87Å; L143-F163 HydrophobicContact CD2-CZ 4.48Å; L143-F163 WeakPolarHBondContact O-CE2 3.45Å; L143-L166 HydrophobicContact CD2-CB 4.42Å; L143-L166 HydrophobicContact CD2-CD2 3.83Å; L143-L166 HydrophobicContact CD2-CG 3.86Å; L143-L167 HydrophobicContact CD1-CD2 3.89Å; L143-L167 HydrophobicContact CD2-CD2 3.64Å; L143-L167 HydrophobicContact CD2-CG 3.96Å; L143-L167 HydrophobicContact CG-CD2 4.35Å; L143-Y170 HydrophobicContact CD1-CD1 3.66Å; L143-Y170 HydrophobicContact CD1-CE1 4Å; L143-Y170 HydrophobicContact CD1-CG 4.03Å |
| 144 | M | 96.6 | Very high | 94.1 | Very high | 46 Ų | 46 | 56 Ų | 56 | 23% | 0.227 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.4 | -51.1 | 176.4 | -170 | 172.1 | 64.6 | 0 | 0 | 111.5 | T140 I141 I142 G146 A147 I148 I227 | T140-M144 VanDerWaalsContact O-CB 3.31Å; T140-M144 WeakPolarHBondContact O-CB 3.07Å; T140-M144 PolarHBondContact O-N 3.23Å; I141-M144 PolarHBondContact O-N 3.16Å; I142-M144 VanDerWaalsContact C-N 3.35Å; I142-M144 PolarHBondContact O-N 3.17Å; M144-G146 VanDerWaalsContact C-N 3.34Å; M144-G146 PolarHBondContact O-N 3.31Å; M144-A147 PolarHBondContact O-N 3.12Å; M144-I148 HydrophobicContact CG-CD1 4.15Å; M144-I148 VanDerWaalsContact O-CG1 3.29Å; M144-I148 WeakPolarHBondContact O-CG1 3.26Å; M144-I148 PolarHBondContact O-N 3.43Å; M144-I227 HydrophobicContact CG-CG2 4.5Å |
| 145 | F | 96.6 | Very high | 93.9 | Very high | 123 Ų | 123 | 57.9 Ų | 57.9 | 54% | 0.539 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.8 | -35.7 | 177.6 | -75.2 | -64.5 | 0 | 0 | 0 | 112.6 | I141 I142 I148 T149 | I141-F145 HydrophobicContact CG2-CD2 3.69Å; I141-F145 HydrophobicContact CG2-CE2 3.58Å; I141-F145 VanDerWaalsContact O-CD2 3.24Å; I141-F145 WeakPolarHBondContact O-CD2 3.4Å; I141-F145 PolarHBondContact O-N 3.38Å; I142-F145 PolarHBondContact O-N 2.74Å; F145-I148 PolarHBondContact O-N 3.28Å; F145-T149 VanDerWaalsContact O-CB 3.31Å; F145-T149 WeakPolarHBondContact O-CB 3.46Å; F145-T149 PolarHBondContact O-N 3.03Å; F145-T149 PolarHBondContact O-OG1 3.35Å |
| 146 | G | 95.8 | Very high | 93.6 | Very high | 23 Ų | 23 | 64.4 Ų | 64.4 | 24% | 0.237 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.9 | -48.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | I142 L143 M144 T149 C150 | I142-G146 PolarHBondContact O-N 2.94Å; L143-G146 PolarHBondContact O-N 3.24Å; M144-G146 VanDerWaalsContact C-N 3.34Å; M144-G146 PolarHBondContact O-N 3.31Å; G146-T149 PolarHBondContact O-N 3.5Å; G146-C150 PolarHBondContact O-N 2.94Å; G146-C150 PolarHBondContact O-SG 3.45Å |
| 147 | A | 96.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 64.5 Ų | 64.5 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -66.1 | -40.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L143 M144 C150 L151 F163 I227 | L143-A147 WeakPolarHBondContact O-CB 3.4Å; L143-A147 PolarHBondContact O-N 2.95Å; M144-A147 PolarHBondContact O-N 3.12Å; A147-C150 PolarHBondContact O-N 3.44Å; A147-L151 VanDerWaalsContact O-CB 3.24Å; A147-L151 WeakPolarHBondContact O-CB 3.37Å; A147-L151 PolarHBondContact O-N 2.88Å; A147-F163 HydrophobicContact CB-CE2 3.83Å; A147-F163 HydrophobicContact CB-CZ 3.74Å; A147-I227 HydrophobicContact CB-CD1 4.4Å; A147-I227 HydrophobicContact CB-CG1 3.56Å |
| 148 | I | 96.3 | Very high | 93.5 | Very high | 49 Ų | 49 | 67.6 Ų | 67.6 | 25% | 0.251 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -61 | -45.9 | 173.7 | -69.8 | 168.2 | 0 | 0 | 0 | 110.4 | M144 F145 L151 F152 F153 I227 | M144-I148 HydrophobicContact CG-CD1 4.15Å; M144-I148 VanDerWaalsContact O-CG1 3.29Å; M144-I148 WeakPolarHBondContact O-CG1 3.26Å; M144-I148 PolarHBondContact O-N 3.43Å; F145-I148 PolarHBondContact O-N 3.28Å; I148-L151 PolarHBondContact O-N 3.4Å; I148-F152 HydrophobicContact CG2-CD2 4Å; I148-F152 WeakPolarHBondContact O-CD2 3.18Å; I148-F152 PolarHBondContact O-N 3.47Å; I148-F153 HydrophobicContact CG2-CE2 4.41Å; I148-I227 HydrophobicContact CB-CD1 4.48Å; I148-I227 HydrophobicContact CG1-CD1 3.7Å; I148-I227 HydrophobicContact CG1-CG1 3.93Å; I148-I227 HydrophobicContact CG1-CG2 4.33Å |
| 149 | T | 95.1 | Very high | 93.4 | Very high | 54 Ų | 54 | 62 Ų | 62 | 33% | 0.331 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.5 | -47.9 | 178.5 | -57 | 0 | 0 | 0 | 0 | 111.2 | F145 G146 L151 F153 L154 | F145-T149 VanDerWaalsContact O-CB 3.31Å; F145-T149 WeakPolarHBondContact O-CB 3.46Å; F145-T149 PolarHBondContact O-N 3.03Å; F145-T149 PolarHBondContact O-OG1 3.35Å; G146-T149 PolarHBondContact O-N 3.5Å; T149-L151 VanDerWaalsContact C-N 3.31Å; T149-L151 PolarHBondContact O-N 2.85Å; T149-F153 HydrophobicContact CG2-CB 4.42Å; T149-F153 WeakPolarHBondContact O-CA 3.46Å; T149-F153 WeakPolarHBondContact O-CB 3.23Å; T149-F153 PolarHBondContact O-N 3.28Å; T149-L154 HydrophobicContact CG2-CB 4.47Å; T149-L154 HydrophobicContact CG2-CD1 3.57Å; T149-L154 HydrophobicContact CG2-CG 3.84Å; T149-L154 PolarHBondContact O-N 3.13Å |
| 150 | C | 94.8 | Very high | 93.3 | Very high | 8 Ų | 8 | 60.5 Ų | 60.5 | 5% | 0.054 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.5 | -35.1 | 177.4 | -62 | 0 | 0 | 0 | 0 | 112.2 | G146 A147 L154 R219 L223 | G146-C150 PolarHBondContact O-N 2.94Å; G146-C150 PolarHBondContact O-SG 3.45Å; A147-C150 PolarHBondContact O-N 3.44Å; C150-L154 CarbonylContact C-O 3.59Å; C150-L154 WeakPolarHBondContact CA-O 3.37Å; C150-R219 PolarHBondContact O-NH1 3.39Å; C150-R219 PolarHBondContact O-NH2 3.48Å; C150-L223 HydrophobicContact CB-CD1 3.99Å; C150-L223 HydrophobicContact CB-CD2 4Å |
| 151 | L | 93.6 | Very high | 93.3 | Very high | 37 Ų | 37 | 64 Ų | 64 | 19% | 0.194 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -74.3 | -44.1 | -177 | -176.1 | 58.2 | 0 | 0 | 0 | 112.7 | A147 I148 T149 N220 L223 I227 | A147-L151 VanDerWaalsContact O-CB 3.24Å; A147-L151 WeakPolarHBondContact O-CB 3.37Å; A147-L151 PolarHBondContact O-N 2.88Å; I148-L151 PolarHBondContact O-N 3.4Å; T149-L151 VanDerWaalsContact C-N 3.31Å; T149-L151 PolarHBondContact O-N 2.85Å; L151-N220 HydrophobicContact CD1-CB 4Å; L151-L223 HydrophobicContact CB-CB 4.24Å; L151-L223 HydrophobicContact CB-CD1 4.26Å; L151-L223 HydrophobicContact CD1-CB 4.16Å; L151-L223 HydrophobicContact CD1-CD1 4.32Å; L151-I227 HydrophobicContact CD2-CD1 3.7Å |
| 152 | F | 93 | Very high | 93.3 | Very high | 144 Ų | 144 | 66.5 Ų | 66.5 | 63% | 0.632 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -106.8 | -25.3 | -169.4 | -65.5 | -73.4 | 0 | 0 | 0 | 115 | I148 | I148-F152 HydrophobicContact CG2-CD2 4Å; I148-F152 WeakPolarHBondContact O-CD2 3.18Å; I148-F152 PolarHBondContact O-N 3.47Å |
| 153 | F | 90.9 | Very high | 93.3 | Very high | 154 Ų | 154 | 62.8 Ų | 62.8 | 68% | 0.675 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119 | -38.6 | -169 | -59 | -86.8 | 0 | 0 | 0 | 113.3 | I148 T149 | I148-F153 HydrophobicContact CG2-CE2 4.41Å; T149-F153 HydrophobicContact CG2-CB 4.42Å; T149-F153 WeakPolarHBondContact O-CA 3.46Å; T149-F153 WeakPolarHBondContact O-CB 3.23Å; T149-F153 PolarHBondContact O-N 3.28Å |
| 154 | L | 87.4 | Confident | 93.3 | Very high | 66 Ų | 66 | 62.7 Ų | 62.7 | 35% | 0.346 | 31% | 0.309 | S | S | . | . | trans | -122 | 92.3 | -173.6 | -59.6 | -178.6 | 0 | 0 | 0 | 110.9 | T149 C150 Y156 T159 R219 | T149-L154 HydrophobicContact CG2-CB 4.47Å; T149-L154 HydrophobicContact CG2-CD1 3.57Å; T149-L154 HydrophobicContact CG2-CG 3.84Å; T149-L154 PolarHBondContact O-N 3.13Å; C150-L154 CarbonylContact C-O 3.59Å; C150-L154 WeakPolarHBondContact CA-O 3.37Å; L154-Y156 VanDerWaalsContact C-N 3.31Å; L154-Y156 HydrophobicContact CB-CD2 4.46Å; L154-Y156 HydrophobicContact CD2-CD2 4.45Å; L154-Y156 HydrophobicContact CD2-CE2 4.4Å; L154-Y156 PolarHBondContact O-N 2.9Å; L154-T159 HydrophobicContact CB-CG2 4.09Å; L154-T159 HydrophobicContact CD1-CG2 3.91Å; L154-T159 PolarHBondContact O-OG1 3.48Å; L154-R219 PolarHBondContact O-NH2 3.32Å | ||
| 155 | N | 84.9 | Confident | 93.3 | Very high | 102 Ų | 102 | 66.5 Ų | 66.5 | 55% | 0.545 | 32% | 0.324 | S | S | . | . | trans | -93.3 | 58.5 | 175 | -166.4 | 6.2 | 0 | 0 | 0 | 111.4 | R219 | N155-R219 PolarHBondContact OD1-NE 3.36Å; N155-R219 PolarHBondContact OD1-NH1 3.5Å | ||
| 156 | Y | 88.4 | Confident | 93.3 | Very high | 159 Ų | 159 | 62.9 Ų | 62.9 | 62% | 0.624 | 31% | 0.31 | S | S | * | . | trans | -118.6 | 139.7 | 177.6 | -62.2 | -70.3 | 0 | 0 | 0 | 110.6 | L154 V158 T159 D160 | L154-Y156 VanDerWaalsContact C-N 3.31Å; L154-Y156 HydrophobicContact CB-CD2 4.46Å; L154-Y156 HydrophobicContact CD2-CD2 4.45Å; L154-Y156 HydrophobicContact CD2-CE2 4.4Å; L154-Y156 PolarHBondContact O-N 2.9Å; Y156-V158 PolarHBondContact O-N 2.81Å; Y156-T159 PolarHBondContact O-N 3.03Å; Y156-T159 VanDerWaalsContact O-N 3.12Å; Y156-T159 PolarHBondContact O-OG1 3.26Å; Y156-D160 PolarHBondContact O-N 2.87Å | ||
| 157 | R | 89.3 | Confident | 93.4 | Very high | 39 Ų | 39 | 62.3 Ų | 62.3 | 15% | 0.147 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -57.4 | -37.4 | 179.3 | -179.5 | 58.2 | -177.8 | 87 | 1.1 | 112.9 | T159 D160 E161 L207 W209 E211 | R157-T159 PolarHBondContact O-N 3.35Å; R157-D160 PolarHBondContact O-N 3.47Å; R157-E161 IonicContact CZ-OE1 2.94Å; R157-E161 IonicContact NE-OE1 3.49Å; R157-E161 IonicContact NH1-OE1 2.72Å; R157-E161 PolarHBondContact NH1-OE1 2.84Å; R157-E161 IonicContact NH2-OE1 3.72Å; R157-E161 PolarHBondContact NH2-OE1 3.26Å; R157-E161 VanDerWaalsContact NH2-OE1 3.15Å; R157-E161 WeakPolarHBondContact O-CB 3.41Å; R157-E161 PolarHBondContact O-N 3.29Å; R157-L207 PolarHBondContact NH2-O 3.33Å; R157-L207 VanDerWaalsContact NH2-O 3.16Å; R157-W209 PolarHBondContact NH2-O 2.81Å; R157-E211 WeakPolarHBondContact CD-OE2 3.27Å; R157-E211 HydrophobicContact CG-CB 4.2Å |
| 158 | V | 91.4 | Very high | 93.5 | Very high | 90 Ų | 90 | 63.8 Ų | 63.8 | 55% | 0.545 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 179.7 | 179 | 0 | 0 | 0 | 0 | 111.4 | Y156 D160 E161 I162 | Y156-V158 PolarHBondContact O-N 2.81Å; V158-D160 VanDerWaalsContact C-N 3.35Å; V158-E161 VanDerWaalsContact O-CB 3.31Å; V158-E161 WeakPolarHBondContact O-CB 3.47Å; V158-E161 PolarHBondContact O-N 3.06Å; V158-I162 HydrophobicContact CG1-CD1 4.12Å; V158-I162 WeakPolarHBondContact O-CG1 3.5Å; V158-I162 PolarHBondContact O-N 3.1Å |
| 159 | T | 92.6 | Very high | 93.5 | Very high | 28 Ų | 28 | 66.4 Ų | 66.4 | 17% | 0.172 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -68.9 | -37.4 | 179.4 | 49.8 | 0 | 0 | 0 | 0 | 111.4 | L154 Y156 R157 E161 I162 F163 | L154-T159 HydrophobicContact CB-CG2 4.09Å; L154-T159 HydrophobicContact CD1-CG2 3.91Å; L154-T159 PolarHBondContact O-OG1 3.48Å; Y156-T159 PolarHBondContact O-N 3.03Å; Y156-T159 VanDerWaalsContact O-N 3.12Å; Y156-T159 PolarHBondContact O-OG1 3.26Å; R157-T159 PolarHBondContact O-N 3.35Å; T159-E161 VanDerWaalsContact C-N 3.31Å; T159-E161 PolarHBondContact O-N 3.48Å; T159-I162 PolarHBondContact O-N 3.46Å; T159-F163 WeakPolarHBondContact O-CB 3.45Å; T159-F163 PolarHBondContact O-N 3.13Å |
| 160 | D | 93.5 | Very high | 93.6 | Very high | 1 Ų | 1 | 64 Ų | 64 | 1% | 0.005 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.7 | -36.5 | 173.3 | -60.7 | -10.9 | 0 | 0 | 0 | 111.8 | Y156 R157 V158 F163 N164 Y215 R219 | Y156-D160 PolarHBondContact O-N 2.87Å; R157-D160 PolarHBondContact O-N 3.47Å; V158-D160 VanDerWaalsContact C-N 3.35Å; D160-F163 PolarHBondContact O-N 3.46Å; D160-N164 WeakPolarHBondContact O-CB 3.45Å; D160-N164 PolarHBondContact O-N 3.42Å; D160-N164 PolarHBondContact O-ND2 3.43Å; D160-Y215 WeakPolarHBondContact CB-OH 3.28Å; D160-Y215 VanDerWaalsContact CG-OH 3.29Å; D160-Y215 PolarHBondContact OD2-OH 3.41Å; D160-R219 IonicContact OD1-CZ 3.54Å; D160-R219 IonicContact OD1-NE 3.1Å; D160-R219 PolarHBondContact OD1-NE 2.87Å; D160-R219 IonicContact OD1-NH2 2.78Å; D160-R219 PolarHBondContact OD1-NH2 3.5Å; D160-R219 WeakPolarHBondContact OD2-CD 3.45Å; D160-R219 IonicContact OD2-CZ 3.57Å; D160-R219 IonicContact OD2-NE 3.31Å; D160-R219 PolarHBondContact OD2-NE 3.12Å; D160-R219 IonicContact OD2-NH2 3.53Å |
| 161 | E | 94.1 | Very high | 93.7 | Very high | 76 Ų | 76 | 64.6 Ų | 64.6 | 36% | 0.355 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -62.9 | -47.1 | 176.1 | -128.3 | 149.6 | -131.5 | 0 | 0 | 111.4 | R157 V158 T159 F163 N164 F165 L207 | R157-E161 IonicContact CZ-OE1 2.94Å; R157-E161 IonicContact NE-OE1 3.49Å; R157-E161 IonicContact NH1-OE1 2.72Å; R157-E161 PolarHBondContact NH1-OE1 2.84Å; R157-E161 IonicContact NH2-OE1 3.72Å; R157-E161 PolarHBondContact NH2-OE1 3.26Å; R157-E161 VanDerWaalsContact NH2-OE1 3.15Å; R157-E161 WeakPolarHBondContact O-CB 3.41Å; R157-E161 PolarHBondContact O-N 3.29Å; V158-E161 VanDerWaalsContact O-CB 3.31Å; V158-E161 WeakPolarHBondContact O-CB 3.47Å; V158-E161 PolarHBondContact O-N 3.06Å; T159-E161 VanDerWaalsContact C-N 3.31Å; T159-E161 PolarHBondContact O-N 3.48Å; E161-F163 VanDerWaalsContact C-N 3.31Å; E161-F163 PolarHBondContact O-N 3.18Å; E161-N164 PolarHBondContact O-N 2.92Å; E161-F165 VanDerWaalsContact O-CB 3.29Å; E161-F165 WeakPolarHBondContact O-CB 3.08Å; E161-F165 PolarHBondContact O-N 2.76Å; E161-L207 HydrophobicContact CB-CD1 4.4Å; E161-L207 HydrophobicContact CG-CD1 3.78Å; E161-L207 WeakPolarHBondContact O-CD1 3.41Å |
| 162 | I | 95.9 | Very high | 93.8 | Very high | 110 Ų | 110 | 64.9 Ų | 64.9 | 56% | 0.564 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -60.5 | -43.9 | 175.1 | -67.5 | 166.3 | 0 | 0 | 0 | 110.2 | V158 T159 F165 L166 | V158-I162 HydrophobicContact CG1-CD1 4.12Å; V158-I162 WeakPolarHBondContact O-CG1 3.5Å; V158-I162 PolarHBondContact O-N 3.1Å; T159-I162 PolarHBondContact O-N 3.46Å; I162-F165 PolarHBondContact O-N 3.31Å; I162-L166 WeakPolarHBondContact O-CB 3.28Å; I162-L166 PolarHBondContact O-N 2.95Å |
| 163 | F | 96.7 | Very high | 93.9 | Very high | 7 Ų | 7 | 59.1 Ų | 59.1 | 3% | 0.031 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.6 | -47.4 | 177.1 | 176.4 | -102.8 | 0 | 0 | 0 | 112.3 | L143 A147 T159 D160 E161 L166 L167 F222 L223 | L143-F163 HydrophobicContact CB-CE2 4.46Å; L143-F163 HydrophobicContact CD2-CD2 4.43Å; L143-F163 HydrophobicContact CD2-CE2 3.87Å; L143-F163 HydrophobicContact CD2-CZ 4.48Å; L143-F163 WeakPolarHBondContact O-CE2 3.45Å; A147-F163 HydrophobicContact CB-CE2 3.83Å; A147-F163 HydrophobicContact CB-CZ 3.74Å; T159-F163 WeakPolarHBondContact O-CB 3.45Å; T159-F163 PolarHBondContact O-N 3.13Å; D160-F163 PolarHBondContact O-N 3.46Å; E161-F163 VanDerWaalsContact C-N 3.31Å; E161-F163 PolarHBondContact O-N 3.18Å; F163-L166 WeakPolarHBondContact O-CB 3.3Å; F163-L166 PolarHBondContact O-N 2.75Å; F163-L167 HydrophobicContact CD1-CD1 4.08Å; F163-L167 HydrophobicContact CE1-CD1 3.46Å; F163-L167 VanDerWaalsContact CE1-CD1 3.46Å; F163-L167 HydrophobicContact CE1-CG 4.14Å; F163-L167 HydrophobicContact CZ-CD1 3.84Å; F163-L167 HydrophobicContact CZ-CD2 4.4Å; F163-L167 HydrophobicContact CZ-CG 4.11Å; F163-L167 PolarHBondContact O-N 2.94Å; F163-F222 HydrophobicContact CE1-CE1 4.15Å; F163-L223 HydrophobicContact CD1-CD2 4.04Å; F163-L223 HydrophobicContact CE1-CD2 4.01Å |
| 164 | N | 95.8 | Very high | 94.1 | Very high | 1 Ų | 1 | 51.9 Ų | 51.9 | 1% | 0.005 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -66.2 | -37.9 | 178.3 | -76.8 | -59.5 | 0 | 0 | 0 | 112.1 | D160 E161 L166 L167 V168 M206 L207 F222 | D160-N164 WeakPolarHBondContact O-CB 3.45Å; D160-N164 PolarHBondContact O-N 3.42Å; D160-N164 PolarHBondContact O-ND2 3.43Å; E161-N164 PolarHBondContact O-N 2.92Å; N164-L166 VanDerWaalsContact C-N 3.32Å; N164-L166 PolarHBondContact O-N 2.91Å; N164-L167 WeakPolarHBondContact O-CB 3.26Å; N164-L167 PolarHBondContact O-N 3.02Å; N164-V168 WeakPolarHBondContact O-CG2 3.44Å; N164-V168 PolarHBondContact O-N 3.44Å; N164-M206 VanDerWaalsContact OD1-CG 3.24Å; N164-M206 WeakPolarHBondContact OD1-CG 3.27Å; N164-L207 HydrophobicContact CB-CB 4.04Å; N164-L207 HydrophobicContact CB-CD1 4.02Å; N164-F222 WeakPolarHBondContact OD1-CE1 3.49Å |
| 165 | F | 97.1 | Very high | 94.3 | Very high | 126 Ų | 126 | 48.9 Ų | 48.9 | 55% | 0.553 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -60.1 | -44.2 | 172.4 | 176.4 | -96.5 | 0 | 0 | 0 | 111.2 | E161 I162 L167 V168 W169 L207 | E161-F165 VanDerWaalsContact O-CB 3.29Å; E161-F165 WeakPolarHBondContact O-CB 3.08Å; E161-F165 PolarHBondContact O-N 2.76Å; I162-F165 PolarHBondContact O-N 3.31Å; F165-L167 VanDerWaalsContact C-N 3.3Å; F165-L167 PolarHBondContact O-N 3.33Å; F165-V168 PolarHBondContact O-N 3.03Å; F165-W169 WeakPolarHBondContact O-CB 3.41Å; F165-W169 PolarHBondContact O-N 3.21Å; F165-L207 HydrophobicContact CB-CD1 4.34Å; F165-L207 HydrophobicContact CB-CD2 4.38Å; F165-L207 HydrophobicContact CD2-CD2 4.39Å |
| 166 | L | 97.5 | Very high | 94.7 | Very high | 46 Ų | 46 | 46 Ų | 46 | 24% | 0.241 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.3 | -38.5 | 175.6 | -176.8 | 62.6 | 0 | 0 | 0 | 111.9 | I142 L143 I162 F163 N164 W169 Y170 | I142-L166 HydrophobicContact CG2-CD2 3.83Å; L143-L166 HydrophobicContact CD2-CB 4.42Å; L143-L166 HydrophobicContact CD2-CD2 3.83Å; L143-L166 HydrophobicContact CD2-CG 3.86Å; I162-L166 WeakPolarHBondContact O-CB 3.28Å; I162-L166 PolarHBondContact O-N 2.95Å; F163-L166 WeakPolarHBondContact O-CB 3.3Å; F163-L166 PolarHBondContact O-N 2.75Å; N164-L166 VanDerWaalsContact C-N 3.32Å; N164-L166 PolarHBondContact O-N 2.91Å; L166-W169 HydrophobicContact CD1-CE3 3.92Å; L166-W169 HydrophobicContact CD1-CZ3 4.35Å; L166-W169 PolarHBondContact O-N 3.14Å; L166-Y170 VanDerWaalsContact O-CB 3.27Å; L166-Y170 WeakPolarHBondContact O-CB 3.47Å; L166-Y170 PolarHBondContact O-N 2.72Å |
| 167 | L | 96.9 | Very high | 94.9 | Very high | 12 Ų | 12 | 41.5 Ų | 41.5 | 6% | 0.063 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -62.9 | -46.3 | 173.5 | -76.1 | 173 | 0 | 0 | 0 | 112.5 | L143 F163 N164 F165 W169 Y170 Y171 S203 F222 | L143-L167 HydrophobicContact CD1-CD2 3.89Å; L143-L167 HydrophobicContact CD2-CD2 3.64Å; L143-L167 HydrophobicContact CD2-CG 3.96Å; L143-L167 HydrophobicContact CG-CD2 4.35Å; F163-L167 HydrophobicContact CD1-CD1 4.08Å; F163-L167 HydrophobicContact CE1-CD1 3.46Å; F163-L167 VanDerWaalsContact CE1-CD1 3.46Å; F163-L167 HydrophobicContact CE1-CG 4.14Å; F163-L167 HydrophobicContact CZ-CD1 3.84Å; F163-L167 HydrophobicContact CZ-CD2 4.4Å; F163-L167 HydrophobicContact CZ-CG 4.11Å; F163-L167 PolarHBondContact O-N 2.94Å; N164-L167 WeakPolarHBondContact O-CB 3.26Å; N164-L167 PolarHBondContact O-N 3.02Å; F165-L167 VanDerWaalsContact C-N 3.3Å; F165-L167 PolarHBondContact O-N 3.33Å; L167-W169 VanDerWaalsContact C-N 3.34Å; L167-W169 PolarHBondContact O-N 2.99Å; L167-Y170 PolarHBondContact O-N 3.1Å; L167-Y171 HydrophobicContact CD2-CE2 4.21Å; L167-Y171 VanDerWaalsContact O-CD2 3.26Å; L167-Y171 WeakPolarHBondContact O-CD2 3.44Å; L167-Y171 PolarHBondContact O-N 3.38Å; L167-S203 WeakPolarHBondContact CB-OG 3.35Å; L167-F222 HydrophobicContact CD1-CE1 4.24Å; L167-F222 HydrophobicContact CD1-CZ 3.9Å |
| 168 | V | 97.8 | Very high | 95 | Very high | 30 Ų | 30 | 40 Ų | 40 | 18% | 0.182 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -57.4 | -51.2 | 175.9 | 173.6 | 0 | 0 | 0 | 0 | 109.9 | N164 F165 Y170 Y171 C172 L207 | N164-V168 WeakPolarHBondContact O-CG2 3.44Å; N164-V168 PolarHBondContact O-N 3.44Å; F165-V168 PolarHBondContact O-N 3.03Å; V168-Y170 VanDerWaalsContact C-N 3.32Å; V168-Y170 PolarHBondContact O-N 3.18Å; V168-Y171 PolarHBondContact O-N 3.49Å; V168-C172 WeakPolarHBondContact O-CB 3.45Å; V168-C172 PolarHBondContact O-N 2.86Å; V168-C172 PolarHBondContact O-SG 3.49Å; V168-L207 HydrophobicContact CG2-CD2 4.46Å |
| 169 | W | 97.4 | Very high | 94.9 | Very high | 105 Ų | 105 | 36.3 Ų | 36.3 | 40% | 0.398 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -58.9 | -43.2 | 179.2 | 175.8 | 85.6 | 0 | 0 | 0 | 112.2 | F135 M139 F165 L166 L167 T173 | F135-W169 AromaticContact CE2-CH2 3.86Å; F135-W169 HydrophobicContact CE2-CH2 3.86Å; F135-W169 HydrophobicContact CE2-CZ3 4.26Å; F135-W169 HydrophobicContact CZ-CH2 4.03Å; F135-W169 HydrophobicContact CZ-CZ3 4.09Å; M139-W169 HydrophobicContact CE-CH2 3.52Å; M139-W169 HydrophobicContact CE-CZ3 3.5Å; M139-W169 HydrophobicContact CG-CZ3 4.3Å; M139-W169 HydrophobicContact SD-CH2 4.28Å; M139-W169 HydrophobicContact SD-CZ3 3.63Å; F165-W169 WeakPolarHBondContact O-CB 3.41Å; F165-W169 PolarHBondContact O-N 3.21Å; L166-W169 HydrophobicContact CD1-CE3 3.92Å; L166-W169 HydrophobicContact CD1-CZ3 4.35Å; L166-W169 PolarHBondContact O-N 3.14Å; L167-W169 VanDerWaalsContact C-N 3.34Å; L167-W169 PolarHBondContact O-N 2.99Å; W169-T173 WeakPolarHBondContact O-CB 3.37Å; W169-T173 PolarHBondContact O-N 3.36Å; W169-T173 PolarHBondContact O-OG1 2.85Å |
| 170 | Y | 97.2 | Very high | 94.8 | Very high | 4 Ų | 4 | 35.9 Ų | 35.9 | 2% | 0.016 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.4 | -53.8 | 178.2 | 171.5 | -120.5 | 0 | 0 | 0 | 111.6 | F135 M139 L143 L166 L167 V168 C172 T173 L174 | F135-Y170 AromaticContact CE1-CD2 3.94Å; F135-Y170 HydrophobicContact CE1-CD2 3.94Å; F135-Y170 AromaticContact CE1-CE2 3.95Å; F135-Y170 HydrophobicContact CE1-CE2 3.95Å; F135-Y170 HydrophobicContact CZ-CD2 4.2Å; M139-Y170 HydrophobicContact CB-CD2 3.59Å; M139-Y170 HydrophobicContact CB-CE2 3.56Å; M139-Y170 HydrophobicContact CB-CG 4.47Å; M139-Y170 HydrophobicContact CG-CD2 3.97Å; M139-Y170 HydrophobicContact CG-CE2 4.23Å; L143-Y170 HydrophobicContact CD1-CD1 3.66Å; L143-Y170 HydrophobicContact CD1-CE1 4Å; L143-Y170 HydrophobicContact CD1-CG 4.03Å; L166-Y170 VanDerWaalsContact O-CB 3.27Å; L166-Y170 WeakPolarHBondContact O-CB 3.47Å; L166-Y170 PolarHBondContact O-N 2.72Å; L167-Y170 PolarHBondContact O-N 3.1Å; V168-Y170 VanDerWaalsContact C-N 3.32Å; V168-Y170 PolarHBondContact O-N 3.18Å; Y170-C172 PolarHBondContact O-N 3.25Å; Y170-T173 WeakPolarHBondContact O-CB 3.42Å; Y170-T173 PolarHBondContact O-N 3.27Å; Y170-T173 VanDerWaalsContact O-N 3.11Å; Y170-L174 HydrophobicContact CD1-CD1 4.38Å; Y170-L174 HydrophobicContact CD2-CG 4.32Å; Y170-L174 HydrophobicContact CE1-CD1 3.82Å; Y170-L174 HydrophobicContact CE2-CD1 3.94Å; Y170-L174 HydrophobicContact CE2-CD2 3.96Å; Y170-L174 HydrophobicContact CE2-CG 3.96Å; Y170-L174 WeakPolarHBondContact O-CG 3.09Å; Y170-L174 PolarHBondContact O-N 2.93Å |
| 171 | Y | 96.4 | Very high | 94.5 | Very high | 19 Ų | 19 | 36.3 Ų | 36.3 | 8% | 0.075 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -66.7 | -36.2 | -178.9 | -72.9 | -61.2 | 0 | 0 | 0 | 112.6 | L167 V168 T173 L174 T175 H196 T200 Q233 | L167-Y171 HydrophobicContact CD2-CE2 4.21Å; L167-Y171 VanDerWaalsContact O-CD2 3.26Å; L167-Y171 WeakPolarHBondContact O-CD2 3.44Å; L167-Y171 PolarHBondContact O-N 3.38Å; V168-Y171 PolarHBondContact O-N 3.49Å; Y171-T173 VanDerWaalsContact C-N 3.31Å; Y171-T173 PolarHBondContact O-N 3.18Å; Y171-L174 HydrophobicContact CD1-CD1 4.05Å; Y171-L174 HydrophobicContact CE1-CD1 4.41Å; Y171-L174 PolarHBondContact O-N 2.94Å; Y171-T175 WeakPolarHBondContact O-CG2 3.22Å; Y171-T175 PolarHBondContact O-N 3.27Å; Y171-H196 AromaticContact CD1-ND1 3.75Å; Y171-T200 VanDerWaalsContact C-OG1 3.3Å; Y171-T200 WeakPolarHBondContact CB-OG1 3.48Å; Y171-Q233 PolarHBondContact OH-NE2 3.15Å |
| 172 | C | 95.4 | Very high | 94.1 | Very high | 43 Ų | 43 | 36 Ų | 36 | 29% | 0.291 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -58.4 | -43.9 | 169.9 | -75.3 | 0 | 0 | 0 | 0 | 111.7 | V168 Y170 L174 T175 I176 T200 | V168-C172 WeakPolarHBondContact O-CB 3.45Å; V168-C172 PolarHBondContact O-N 2.86Å; V168-C172 PolarHBondContact O-SG 3.49Å; Y170-C172 PolarHBondContact O-N 3.25Å; C172-L174 VanDerWaalsContact C-N 3.32Å; C172-L174 PolarHBondContact O-N 2.96Å; C172-T175 PolarHBondContact O-N 3.06Å; C172-T175 PolarHBondContact O-OG1 2.89Å; C172-I176 WeakPolarHBondContact O-CG1 3.39Å; C172-I176 PolarHBondContact O-N 3.21Å; C172-T200 PolarHBondContact N-OG1 3.39Å; C172-T200 WeakPolarHBondContact SG-CG2 2.97Å |
| 173 | T | 95.7 | Very high | 93.6 | Very high | 24 Ų | 24 | 31.9 Ų | 31.9 | 15% | 0.147 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -65.1 | -37.9 | 178.6 | -57.6 | 0 | 0 | 0 | 0 | 111.5 | F135 W169 Y170 Y171 I176 R177 | F135-T173 HydrophobicContact CE1-CG2 3.76Å; F135-T173 HydrophobicContact CE2-CG2 4.15Å; F135-T173 HydrophobicContact CZ-CG2 3.43Å; F135-T173 VanDerWaalsContact CZ-CG2 3.43Å; W169-T173 WeakPolarHBondContact O-CB 3.37Å; W169-T173 PolarHBondContact O-N 3.36Å; W169-T173 PolarHBondContact O-OG1 2.85Å; Y170-T173 WeakPolarHBondContact O-CB 3.42Å; Y170-T173 PolarHBondContact O-N 3.27Å; Y170-T173 VanDerWaalsContact O-N 3.11Å; Y171-T173 VanDerWaalsContact C-N 3.31Å; Y171-T173 PolarHBondContact O-N 3.18Å; T173-I176 PolarHBondContact O-N 3.33Å; T173-R177 HydrophobicContact CG2-CG 4.34Å; T173-R177 WeakPolarHBondContact O-CG 3.43Å; T173-R177 PolarHBondContact O-N 3.45Å |
| 174 | L | 93.8 | Very high | 93 | Very high | 1 Ų | 1 | 32.3 Ų | 32.3 | 1% | 0.005 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.5 | -44 | 175.4 | -66.7 | -176.2 | 0 | 0 | 0 | 112.4 | Y132 F135 K136 Y170 Y171 C172 I176 R177 E178 | Y132-L174 HydrophobicContact CD2-CD2 4.49Å; Y132-L174 HydrophobicContact CE2-CD2 3.73Å; F135-L174 HydrophobicContact CD1-CD2 4.19Å; F135-L174 HydrophobicContact CE1-CD2 3.98Å; K136-L174 HydrophobicContact CD-CD2 4.08Å; K136-L174 HydrophobicContact CG-CD2 3.62Å; Y170-L174 HydrophobicContact CD1-CD1 4.38Å; Y170-L174 HydrophobicContact CD2-CG 4.32Å; Y170-L174 HydrophobicContact CE1-CD1 3.82Å; Y170-L174 HydrophobicContact CE2-CD1 3.94Å; Y170-L174 HydrophobicContact CE2-CD2 3.96Å; Y170-L174 HydrophobicContact CE2-CG 3.96Å; Y170-L174 WeakPolarHBondContact O-CG 3.09Å; Y170-L174 PolarHBondContact O-N 2.93Å; Y171-L174 HydrophobicContact CD1-CD1 4.05Å; Y171-L174 HydrophobicContact CE1-CD1 4.41Å; Y171-L174 PolarHBondContact O-N 2.94Å; C172-L174 VanDerWaalsContact C-N 3.32Å; C172-L174 PolarHBondContact O-N 2.96Å; L174-I176 VanDerWaalsContact C-N 3.27Å; L174-I176 PolarHBondContact O-N 3.13Å; L174-R177 PolarHBondContact O-N 2.77Å; L174-E178 WeakPolarHBondContact O-CB 3.2Å; L174-E178 WeakPolarHBondContact O-CG 3.34Å; L174-E178 PolarHBondContact O-N 3.32Å |
| 175 | T | 93.6 | Very high | 92.1 | Very high | 3 Ų | 3 | 34.3 Ų | 34.3 | 2% | 0.018 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -61.5 | -37.5 | 179 | 61.4 | 0 | 0 | 0 | 0 | 112 | Y107 Y171 C172 S179 H196 Y197 | Y107-T175 PolarHBondContact OH-OG1 3.37Å; Y171-T175 WeakPolarHBondContact O-CG2 3.22Å; Y171-T175 PolarHBondContact O-N 3.27Å; C172-T175 PolarHBondContact O-N 3.06Å; C172-T175 PolarHBondContact O-OG1 2.89Å; T175-S179 VanDerWaalsContact O-CB 3.31Å; T175-S179 WeakPolarHBondContact O-CB 3.21Å; T175-S179 PolarHBondContact O-N 2.9Å; T175-S179 PolarHBondContact O-OG 3.26Å; T175-H196 HydrophobicContact CG2-CB 3.66Å; T175-Y197 HydrophobicContact CG2-CD1 3.82Å; T175-Y197 HydrophobicContact CG2-CD2 3.99Å; T175-Y197 HydrophobicContact CG2-CE1 3.8Å; T175-Y197 HydrophobicContact CG2-CE2 3.96Å; T175-Y197 HydrophobicContact CG2-CG 3.92Å |
| 176 | I | 92.2 | Very high | 91.4 | Very high | 43 Ų | 43 | 29.7 Ų | 29.7 | 22% | 0.221 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -66.2 | -52.5 | 175.3 | -62.1 | 168.8 | 0 | 0 | 0 | 110.3 | Y107 L108 V111 C172 T173 L174 E178 S179 I180 | Y107-I176 HydrophobicContact CE1-CG1 4.26Å; L108-I176 HydrophobicContact CD1-CG2 4.46Å; V111-I176 HydrophobicContact CG1-CD1 3.86Å; V111-I176 HydrophobicContact CG1-CG1 4.16Å; C172-I176 WeakPolarHBondContact O-CG1 3.39Å; C172-I176 PolarHBondContact O-N 3.21Å; T173-I176 PolarHBondContact O-N 3.33Å; L174-I176 VanDerWaalsContact C-N 3.27Å; L174-I176 PolarHBondContact O-N 3.13Å; I176-E178 VanDerWaalsContact C-N 3.32Å; I176-E178 PolarHBondContact O-N 2.89Å; I176-S179 WeakPolarHBondContact O-CB 3.02Å; I176-S179 PolarHBondContact O-N 3.47Å; I176-I180 HydrophobicContact CG2-CD1 4.14Å; I176-I180 WeakPolarHBondContact O-CG1 3.43Å; I176-I180 PolarHBondContact O-N 3.26Å |
| 177 | R | 92.6 | Very high | 90.5 | Very high | 63 Ų | 63 | 38.3 Ų | 38.3 | 24% | 0.238 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -62.2 | -38.6 | -178.2 | -69.8 | -172.2 | 175 | -142 | 3.6 | 112.4 | Y128 E131 Y132 F135 T173 L174 I180 L181 | Y128-R177 WeakPolarHBondContact OH-CA 3.29Å; E131-R177 PolarHBondContact O-NH1 2.78Å; E131-R177 VanDerWaalsContact O-NH1 3.15Å; Y132-R177 HydrophobicContact CD2-CB 3.63Å; Y132-R177 HydrophobicContact CD2-CG 4.4Å; Y132-R177 HydrophobicContact CE2-CB 4.09Å; F135-R177 VanDerWaalsContact CG-CZ 3.49Å; T173-R177 HydrophobicContact CG2-CG 4.34Å; T173-R177 WeakPolarHBondContact O-CG 3.43Å; T173-R177 PolarHBondContact O-N 3.45Å; L174-R177 PolarHBondContact O-N 2.77Å; R177-I180 PolarHBondContact O-N 3.08Å; R177-L181 WeakPolarHBondContact O-CG 3.34Å; R177-L181 PolarHBondContact O-N 2.84Å |
| 178 | E | 90.6 | Very high | 89.7 | Confident | 7 Ų | 7 | 39.9 Ų | 39.9 | 3% | 0.033 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -69.4 | -36.9 | 175.4 | -73.1 | -166.5 | 175.1 | 0 | 0 | 112.9 | Y132 L174 I176 I180 L181 I182 I188 H196 | Y132-E178 HydrophobicContact CE2-CG 3.98Å; Y132-E178 PolarHBondContact OH-OE1 3.28Å; L174-E178 WeakPolarHBondContact O-CB 3.2Å; L174-E178 WeakPolarHBondContact O-CG 3.34Å; L174-E178 PolarHBondContact O-N 3.32Å; I176-E178 VanDerWaalsContact C-N 3.32Å; I176-E178 PolarHBondContact O-N 2.89Å; E178-I180 VanDerWaalsContact C-N 3.27Å; E178-I180 PolarHBondContact O-N 3.18Å; E178-L181 WeakPolarHBondContact O-CB 3.48Å; E178-L181 PolarHBondContact O-N 3.46Å; E178-L181 VanDerWaalsContact O-N 3.15Å; E178-I182 WeakPolarHBondContact O-CB 3.29Å; E178-I182 WeakPolarHBondContact O-CD1 3.39Å; E178-I182 VanDerWaalsContact O-CG1 3.23Å; E178-I182 WeakPolarHBondContact O-CG1 3.41Å; E178-I182 PolarHBondContact O-N 3.37Å; E178-I188 HydrophobicContact CB-CD1 4.13Å; E178-I188 HydrophobicContact CG-CD1 4.01Å; E178-H196 VanDerWaalsContact CD-CD2 3.42Å; E178-H196 IonicContact OE1-CD2 2.69Å; E178-H196 PolarHBondContact OE1-CD2 3.02Å; E178-H196 VanDerWaalsContact OE1-CD2 3.31Å; E178-H196 IonicContact OE1-NE2 2.76Å; E178-H196 PolarHBondContact OE1-NE2 2.78Å; E178-H196 VanDerWaalsContact OE1-NE2 3.1Å; E178-H196 IonicContact OE2-CD2 3.57Å; E178-H196 PolarHBondContact OE2-CD2 3.05Å; E178-H196 VanDerWaalsContact OE2-CD2 3.26Å; E178-H196 IonicContact OE2-NE2 3.72Å |
| 179 | S | 89.9 | Confident | 88.9 | Confident | 14 Ų | 14 | 42.8 Ų | 42.8 | 10% | 0.098 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.7 | -37.5 | 173.6 | -64.2 | 0 | 0 | 0 | 0 | 111.8 | Y107 T175 I176 T183 | Y107-S179 WeakPolarHBondContact CD1-OG 3.4Å; T175-S179 VanDerWaalsContact O-CB 3.31Å; T175-S179 WeakPolarHBondContact O-CB 3.21Å; T175-S179 PolarHBondContact O-N 2.9Å; T175-S179 PolarHBondContact O-OG 3.26Å; I176-S179 WeakPolarHBondContact O-CB 3.02Å; I176-S179 PolarHBondContact O-N 3.47Å; S179-T183 WeakPolarHBondContact O-CB 3.26Å; S179-T183 PolarHBondContact O-N 2.98Å; S179-T183 PolarHBondContact O-OG1 3.28Å |
| 180 | I | 89.9 | Confident | 88.2 | Confident | 19 Ų | 19 | 40.3 Ų | 40.3 | 10% | 0.097 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.1 | -45.6 | 172.4 | -65.2 | 166 | 0 | 0 | 0 | 110.4 | L108 L112 V117 Y128 I176 R177 E178 I182 T183 N184 | L108-I180 HydrophobicContact CD1-CG1 3.96Å; L108-I180 HydrophobicContact CD2-CG1 4.22Å; L112-I180 HydrophobicContact CD1-CD1 4.32Å; V117-I180 HydrophobicContact CB-CG1 4.43Å; V117-I180 HydrophobicContact CB-CG2 4.38Å; V117-I180 HydrophobicContact CG1-CG1 4.49Å; V117-I180 HydrophobicContact CG2-CG1 4.31Å; V117-I180 HydrophobicContact CG2-CG2 4.43Å; Y128-I180 HydrophobicContact CD1-CG2 4.47Å; Y128-I180 HydrophobicContact CE1-CB 4.2Å; Y128-I180 HydrophobicContact CE1-CG2 3.83Å; Y128-I180 HydrophobicContact CE2-CG2 4.16Å; Y128-I180 VanDerWaalsContact OH-CD1 3.26Å; Y128-I180 WeakPolarHBondContact OH-CD1 3.31Å; I176-I180 HydrophobicContact CG2-CD1 4.14Å; I176-I180 WeakPolarHBondContact O-CG1 3.43Å; I176-I180 PolarHBondContact O-N 3.26Å; R177-I180 PolarHBondContact O-N 3.08Å; E178-I180 VanDerWaalsContact C-N 3.27Å; E178-I180 PolarHBondContact O-N 3.18Å; I180-I182 PolarHBondContact O-N 3.38Å; I180-T183 PolarHBondContact O-N 3.33Å; I180-N184 WeakPolarHBondContact O-CB 3.47Å; I180-N184 PolarHBondContact O-N 3.32Å; I180-N184 VanDerWaalsContact O-N 3.07Å; I180-N184 PolarHBondContact O-ND2 3.31Å |
| 181 | L | 88.6 | Confident | 88 | Confident | 10 Ų | 10 | 42.5 Ų | 42.5 | 5% | 0.052 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.2 | -44.2 | 176.1 | -75.6 | 171.5 | 0 | 0 | 0 | 112.3 | Y128 K129 Y132 R177 E178 N184 G185 S186 I188 | Y128-L181 HydrophobicContact CD1-CD2 3.69Å; Y128-L181 HydrophobicContact CD1-CG 4.12Å; Y128-L181 HydrophobicContact CE1-CD2 4.06Å; Y128-L181 HydrophobicContact CE1-CG 3.95Å; K129-L181 HydrophobicContact CB-CD2 4.09Å; K129-L181 HydrophobicContact CG-CD2 4.44Å; Y132-L181 HydrophobicContact CD1-CD1 3.76Å; Y132-L181 HydrophobicContact CD2-CD1 4.38Å; Y132-L181 HydrophobicContact CE1-CD1 4Å; Y132-L181 HydrophobicContact CG-CD1 3.96Å; R177-L181 WeakPolarHBondContact O-CG 3.34Å; R177-L181 PolarHBondContact O-N 2.84Å; E178-L181 WeakPolarHBondContact O-CB 3.48Å; E178-L181 PolarHBondContact O-N 3.46Å; E178-L181 VanDerWaalsContact O-N 3.15Å; L181-N184 CarbonylContact O-C 3.44Å; L181-N184 PolarHBondContact O-N 3.06Å; L181-G185 PolarHBondContact O-N 3.27Å; L181-S186 VanDerWaalsContact C-CB 3.46Å; L181-S186 WeakPolarHBondContact O-CB 3.44Å; L181-S186 PolarHBondContact O-N 2.9Å; L181-I188 HydrophobicContact CB-CD1 4.17Å; L181-I188 HydrophobicContact CD1-CD1 4.27Å |
| 182 | I | 86.1 | Confident | 87.6 | Confident | 70 Ų | 70 | 44.7 Ų | 44.7 | 36% | 0.359 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -64.8 | -45.3 | -179.7 | -69.1 | 161.2 | 0 | 0 | 0 | 110.6 | E178 I180 N184 G185 I188 V193 | E178-I182 WeakPolarHBondContact O-CB 3.29Å; E178-I182 WeakPolarHBondContact O-CD1 3.39Å; E178-I182 VanDerWaalsContact O-CG1 3.23Å; E178-I182 WeakPolarHBondContact O-CG1 3.41Å; E178-I182 PolarHBondContact O-N 3.37Å; I180-I182 PolarHBondContact O-N 3.38Å; I182-N184 PolarHBondContact O-N 2.88Å; I182-G185 PolarHBondContact O-N 3.27Å; I182-I188 HydrophobicContact CG1-CB 4.34Å; I182-I188 HydrophobicContact CG1-CD1 4.18Å; I182-I188 HydrophobicContact CG1-CG1 4.32Å; I182-V193 HydrophobicContact CD1-CG1 4.36Å; I182-V193 HydrophobicContact CD1-CG2 3.56Å |
| 183 | T | 84.3 | Confident | 87.2 | Confident | 22 Ų | 22 | 43.8 Ų | 43.8 | 14% | 0.135 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -57.3 | -36.1 | 175.4 | -56.8 | 0 | 0 | 0 | 0 | 110.9 | K102 V117 S179 I180 G185 | K102-T183 HydrophobicContact CB-CG2 4.18Å; K102-T183 WeakPolarHBondContact CD-O 3.44Å; V117-T183 HydrophobicContact CG2-CG2 4.37Å; S179-T183 WeakPolarHBondContact O-CB 3.26Å; S179-T183 PolarHBondContact O-N 2.98Å; S179-T183 PolarHBondContact O-OG1 3.28Å; I180-T183 PolarHBondContact O-N 3.33Å; T183-G185 VanDerWaalsContact C-N 3.3Å; T183-G185 PolarHBondContact O-N 3.38Å |
| 184 | N | 84.1 | Confident | 87 | Confident | 16 Ų | 16 | 45.4 Ų | 45.4 | 9% | 0.086 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | 11.4 | 178 | -75.6 | -71.8 | 0 | 0 | 0 | 115.2 | V117 T118 L119 I180 L181 I182 | V117-N184 PolarHBondContact O-ND2 3.36Å; T118-N184 WeakPolarHBondContact CA-OD1 3.43Å; L119-N184 WeakPolarHBondContact CB-OD1 3.48Å; L119-N184 PolarHBondContact N-OD1 3.25Å; I180-N184 WeakPolarHBondContact O-CB 3.47Å; I180-N184 PolarHBondContact O-N 3.32Å; I180-N184 VanDerWaalsContact O-N 3.07Å; I180-N184 PolarHBondContact O-ND2 3.31Å; L181-N184 CarbonylContact O-C 3.44Å; L181-N184 PolarHBondContact O-N 3.06Å; I182-N184 PolarHBondContact O-N 2.88Å |
| 185 | G | 78.1 | Confident | 87 | Confident | 44 Ų | 44 | 46.2 Ų | 46.2 | 45% | 0.454 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 96.6 | 6.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | L181 I182 T183 R187 | L181-G185 PolarHBondContact O-N 3.27Å; I182-G185 PolarHBondContact O-N 3.27Å; T183-G185 VanDerWaalsContact C-N 3.3Å; T183-G185 PolarHBondContact O-N 3.38Å; G185-R187 PolarHBondContact O-N 2.95Å |
| 186 | S | 81.7 | Confident | 87.1 | Confident | 29 Ų | 29 | 47 Ų | 47 | 20% | 0.203 | 25% | 0.246 | C | C | . | . | trans | -66.3 | 124.7 | 174 | -169 | 0 | 0 | 0 | 0 | 111 | L181 I188 | L181-S186 VanDerWaalsContact C-CB 3.46Å; L181-S186 WeakPolarHBondContact O-CB 3.44Å; L181-S186 PolarHBondContact O-N 2.9Å; S186-I188 VanDerWaalsContact C-N 3.27Å; S186-I188 PolarHBondContact O-N 3.06Å; S186-I188 VanDerWaalsContact O-N 3.09Å; S186-I188 VanDerWaalsContact OG-CG1 3.31Å; S186-I188 WeakPolarHBondContact OG-CG1 3.43Å | ||
| 187 | R | 78.6 | Confident | 87.2 | Confident | 226 Ų | 226 | 49 Ų | 49 | 85% | 0.853 | 25% | 0.251 | S | S | * | . | trans | -86.6 | 60.3 | 178.4 | -62.4 | -176.2 | -177.5 | -177.5 | 1.1 | 111.6 | G185 | G185-R187 PolarHBondContact O-N 2.95Š| ||
| 188 | I | 80.8 | Confident | 87.4 | Confident | 45 Ų | 45 | 47.5 Ų | 47.5 | 23% | 0.231 | 25% | 0.249 | C | C | . | . | trans | -72.3 | 132.6 | 175.2 | -51.3 | -177.6 | 0 | 0 | 0 | 108.2 | E178 L181 I182 S186 W192 V193 | E178-I188 HydrophobicContact CB-CD1 4.13Å; E178-I188 HydrophobicContact CG-CD1 4.01Å; L181-I188 HydrophobicContact CB-CD1 4.17Å; L181-I188 HydrophobicContact CD1-CD1 4.27Å; I182-I188 HydrophobicContact CG1-CB 4.34Å; I182-I188 HydrophobicContact CG1-CD1 4.18Å; I182-I188 HydrophobicContact CG1-CG1 4.32Å; S186-I188 VanDerWaalsContact C-N 3.27Å; S186-I188 PolarHBondContact O-N 3.06Å; S186-I188 VanDerWaalsContact O-N 3.09Å; S186-I188 VanDerWaalsContact OG-CG1 3.31Å; S186-I188 WeakPolarHBondContact OG-CG1 3.43Å; I188-W192 HydrophobicContact CG2-CB 4.05Å; I188-V193 HydrophobicContact CB-CG2 4.22Å; I188-V193 HydrophobicContact CG2-CG2 3.8Å | ||
| 189 | K | 80.9 | Confident | 87.7 | Confident | 92 Ų | 92 | 47.4 Ų | 47.4 | 40% | 0.4 | 25% | 0.249 | S | C | . | . | trans | -67.5 | 139.5 | 177.9 | -56.9 | -173.7 | 175.5 | -173.9 | 0 | 109.4 | W191 W192 V327 | K189-W191 VanDerWaalsContact C-N 3.27Å; K189-W191 PolarHBondContact O-N 3.19Å; K189-W191 VanDerWaalsContact O-N 3.14Å; K189-W192 PolarHBondContact O-N 2.94Å; K189-V327 VanDerWaalsContact NZ-CG2 3.33Å | ||
| 190 | G | 82.7 | Confident | 88 | Confident | 52 Ų | 52 | 48 Ų | 48 | 54% | 0.536 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -52.6 | -39.5 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | W192 V193 S194 | G190-W192 VanDerWaalsContact C-N 3.33Å; G190-W192 PolarHBondContact O-N 2.9Å; G190-V193 WeakPolarHBondContact O-CB 3.49Å; G190-V193 PolarHBondContact O-N 3.4Å; G190-S194 PolarHBondContact O-N 3.2Å; G190-S194 PolarHBondContact O-OG 3.19Å |
| 191 | W | 91.5 | Very high | 88.3 | Confident | 51 Ų | 51 | 52 Ų | 52 | 19% | 0.193 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -57.8 | -41.3 | 176.8 | 172.6 | -105.5 | 0 | 0 | 0 | 113.3 | K189 V193 S194 H195 V315 G319 N320 T323 | K189-W191 VanDerWaalsContact C-N 3.27Å; K189-W191 PolarHBondContact O-N 3.19Å; K189-W191 VanDerWaalsContact O-N 3.14Å; W191-V193 VanDerWaalsContact C-N 3.29Å; W191-V193 PolarHBondContact O-N 3.1Å; W191-S194 PolarHBondContact O-N 2.71Å; W191-H195 HydrophobicContact CZ2-CB 4.31Å; W191-H195 VanDerWaalsContact O-CB 3.25Å; W191-H195 WeakPolarHBondContact O-CB 3.49Å; W191-H195 PolarHBondContact O-N 2.81Å; W191-V315 HydrophobicContact CH2-CG1 4.32Å; W191-V315 WeakPolarHBondContact CH2-O 3.37Å; W191-G319 VanDerWaalsContact CH2-CA 3.46Å; W191-G319 PolarHBondContact NE1-O 2.78Å; W191-N320 VanDerWaalsContact CZ2-N 3.32Å; W191-N320 PolarHBondContact NE1-OD1 3.29Å; W191-T323 HydrophobicContact CB-CG2 4.47Å; W191-T323 VanDerWaalsContact CD1-OG1 3.25Å; W191-T323 HydrophobicContact CG-CG2 4.46Å; W191-T323 VanDerWaalsContact CG-OG1 3.28Å |
| 192 | W | 88.6 | Confident | 88.8 | Confident | 65 Ų | 65 | 52 Ų | 52 | 25% | 0.246 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.3 | -35.8 | -178.4 | -61.9 | 119.9 | 0 | 0 | 0 | 111.8 | I188 K189 G190 H195 H196 T323 | I188-W192 HydrophobicContact CG2-CB 4.05Å; K189-W192 PolarHBondContact O-N 2.94Å; G190-W192 VanDerWaalsContact C-N 3.33Å; G190-W192 PolarHBondContact O-N 2.9Å; W192-H195 WeakPolarHBondContact O-CB 3.49Å; W192-H196 PolarHBondContact O-CD2 2.94Å; W192-H196 PolarHBondContact O-N 3.34Å; W192-T323 HydrophobicContact CZ2-CG2 3.99Å |
| 193 | V | 87.7 | Confident | 89.3 | Confident | 23 Ų | 23 | 48.9 Ų | 48.9 | 14% | 0.139 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.4 | -52.5 | 172.4 | -178.9 | 0 | 0 | 0 | 0 | 109.9 | I182 I188 G190 W191 H195 H196 Y197 | I182-V193 HydrophobicContact CD1-CG1 4.36Å; I182-V193 HydrophobicContact CD1-CG2 3.56Å; I188-V193 HydrophobicContact CB-CG2 4.22Å; I188-V193 HydrophobicContact CG2-CG2 3.8Å; G190-V193 WeakPolarHBondContact O-CB 3.49Å; G190-V193 PolarHBondContact O-N 3.4Å; W191-V193 VanDerWaalsContact C-N 3.29Å; W191-V193 PolarHBondContact O-N 3.1Å; V193-H195 VanDerWaalsContact C-N 3.28Å; V193-H195 PolarHBondContact O-N 3.47Å; V193-H196 PolarHBondContact O-N 3.36Å; V193-Y197 HydrophobicContact CG1-CD2 4.34Å; V193-Y197 HydrophobicContact CG1-CE2 3.77Å; V193-Y197 WeakPolarHBondContact O-CD2 3.5Å |
| 194 | S | 91.4 | Very high | 89.9 | Confident | 59 Ų | 59 | 48.9 Ų | 48.9 | 41% | 0.413 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -58.7 | -38.6 | 178.3 | -61.3 | 0 | 0 | 0 | 0 | 112.7 | G190 W191 H196 Y197 V198 | G190-S194 PolarHBondContact O-N 3.2Å; G190-S194 PolarHBondContact O-OG 3.19Å; W191-S194 PolarHBondContact O-N 2.71Å; S194-H196 VanDerWaalsContact C-N 3.29Å; S194-H196 PolarHBondContact O-N 3.12Å; S194-Y197 PolarHBondContact O-N 3.06Å; S194-Y197 VanDerWaalsContact O-N 3.13Å; S194-V198 WeakPolarHBondContact O-CG2 3.48Å; S194-V198 PolarHBondContact O-N 3.02Å |
| 195 | H | 93.7 | Very high | 90.5 | Very high | 18 Ų | 18 | 48.3 Ų | 48.3 | 8% | 0.083 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -54.7 | -44.3 | 177.4 | 169.7 | -146.2 | 0 | 0 | 0 | 111.1 | W191 W192 V193 Y197 V198 S199 L316 | W191-H195 HydrophobicContact CZ2-CB 4.31Å; W191-H195 VanDerWaalsContact O-CB 3.25Å; W191-H195 WeakPolarHBondContact O-CB 3.49Å; W191-H195 PolarHBondContact O-N 2.81Å; W192-H195 WeakPolarHBondContact O-CB 3.49Å; V193-H195 VanDerWaalsContact C-N 3.28Å; V193-H195 PolarHBondContact O-N 3.47Å; H195-Y197 PolarHBondContact O-N 2.8Å; H195-V198 PolarHBondContact O-N 3.34Å; H195-S199 PolarHBondContact CD2-OG 2.98Å; H195-S199 VanDerWaalsContact CD2-OG 3.26Å; H195-S199 PolarHBondContact NE2-OG 3.45Å; H195-S199 WeakPolarHBondContact O-CB 3.45Å; H195-S199 PolarHBondContact O-N 2.9Å; H195-S199 PolarHBondContact O-OG 3.21Å; H195-S199 VanDerWaalsContact O-OG 3.08Å; H195-L316 WeakPolarHBondContact CD2-CD2 3.24Å |
| 196 | H | 94.3 | Very high | 91.3 | Very high | 20 Ų | 20 | 46.2 Ų | 46.2 | 9% | 0.093 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.2 | -39.4 | 178.3 | -66.4 | -52.1 | 0 | 0 | 0 | 112.9 | Y171 T175 E178 W192 V193 S194 S199 T200 | Y171-H196 AromaticContact CD1-ND1 3.75Å; T175-H196 HydrophobicContact CG2-CB 3.66Å; E178-H196 VanDerWaalsContact CD-CD2 3.42Å; E178-H196 IonicContact OE1-CD2 2.69Å; E178-H196 PolarHBondContact OE1-CD2 3.02Å; E178-H196 VanDerWaalsContact OE1-CD2 3.31Å; E178-H196 IonicContact OE1-NE2 2.76Å; E178-H196 PolarHBondContact OE1-NE2 2.78Å; E178-H196 VanDerWaalsContact OE1-NE2 3.1Å; E178-H196 IonicContact OE2-CD2 3.57Å; E178-H196 PolarHBondContact OE2-CD2 3.05Å; E178-H196 VanDerWaalsContact OE2-CD2 3.26Å; E178-H196 IonicContact OE2-NE2 3.72Å; W192-H196 PolarHBondContact O-CD2 2.94Å; W192-H196 PolarHBondContact O-N 3.34Å; V193-H196 PolarHBondContact O-N 3.36Å; S194-H196 VanDerWaalsContact C-N 3.29Å; S194-H196 PolarHBondContact O-N 3.12Å; H196-S199 PolarHBondContact O-N 3.38Å; H196-T200 PolarHBondContact O-N 2.96Å; H196-T200 PolarHBondContact O-OG1 3.16Å |
| 197 | Y | 94.6 | Very high | 92 | Very high | 83 Ų | 83 | 46.9 Ų | 46.9 | 33% | 0.325 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.9 | -43 | 174 | -69.4 | -80.4 | 0 | 0 | 0 | 112.3 | Y107 T175 V193 S194 H195 S199 T200 F201 | Y107-Y197 WeakPolarHBondContact CD1-OH 3.38Å; Y107-Y197 HydrophobicContact CD2-CE1 4.15Å; Y107-Y197 HydrophobicContact CE1-CE1 4.3Å; Y107-Y197 WeakPolarHBondContact CE1-OH 3.32Å; Y107-Y197 AromaticContact CE2-CE1 3.87Å; Y107-Y197 HydrophobicContact CE2-CE1 3.87Å; Y107-Y197 HydrophobicContact CG-CE1 4.5Å; Y107-Y197 VanDerWaalsContact CG-OH 3.32Å; Y107-Y197 AromaticContact CZ-CE1 3.94Å; T175-Y197 HydrophobicContact CG2-CD1 3.82Å; T175-Y197 HydrophobicContact CG2-CD2 3.99Å; T175-Y197 HydrophobicContact CG2-CE1 3.8Å; T175-Y197 HydrophobicContact CG2-CE2 3.96Å; T175-Y197 HydrophobicContact CG2-CG 3.92Å; V193-Y197 HydrophobicContact CG1-CD2 4.34Å; V193-Y197 HydrophobicContact CG1-CE2 3.77Å; V193-Y197 WeakPolarHBondContact O-CD2 3.5Å; S194-Y197 PolarHBondContact O-N 3.06Å; S194-Y197 VanDerWaalsContact O-N 3.13Å; H195-Y197 PolarHBondContact O-N 2.8Å; Y197-S199 VanDerWaalsContact C-N 3.32Å; Y197-S199 PolarHBondContact O-N 3.41Å; Y197-T200 PolarHBondContact O-N 2.82Å; Y197-F201 PolarHBondContact O-N 3.18Å |
| 198 | V | 96.8 | Very high | 92.8 | Very high | 33 Ų | 33 | 39.9 Ų | 39.9 | 20% | 0.2 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.9 | -40 | 177 | 178 | 0 | 0 | 0 | 0 | 110.6 | S194 H195 F201 L202 T312 V315 L316 | S194-V198 WeakPolarHBondContact O-CG2 3.48Å; S194-V198 PolarHBondContact O-N 3.02Å; H195-V198 PolarHBondContact O-N 3.34Å; V198-F201 PolarHBondContact O-N 3.34Å; V198-L202 WeakPolarHBondContact O-CB 3.45Å; V198-L202 PolarHBondContact O-N 2.96Å; V198-T312 HydrophobicContact CG1-CG2 3.5Å; V198-T312 VanDerWaalsContact CG1-CG2 3.5Å; V198-V315 HydrophobicContact CG1-CG1 4.36Å; V198-V315 HydrophobicContact CG2-CG1 4.49Å; V198-L316 HydrophobicContact CB-CD2 3.94Å; V198-L316 HydrophobicContact CG1-CD1 4.41Å; V198-L316 HydrophobicContact CG1-CD2 3.52Å; V198-L316 HydrophobicContact CG1-CG 3.7Å |
| 199 | S | 96.7 | Very high | 93.5 | Very high | 4 Ų | 4 | 37.8 Ų | 37.8 | 3% | 0.028 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -69.4 | -37.2 | 176.6 | -64.5 | 0 | 0 | 0 | 0 | 113 | H195 H196 Y197 F201 L202 S203 | H195-S199 PolarHBondContact CD2-OG 2.98Å; H195-S199 VanDerWaalsContact CD2-OG 3.26Å; H195-S199 PolarHBondContact NE2-OG 3.45Å; H195-S199 WeakPolarHBondContact O-CB 3.45Å; H195-S199 PolarHBondContact O-N 2.9Å; H195-S199 PolarHBondContact O-OG 3.21Å; H195-S199 VanDerWaalsContact O-OG 3.08Å; H196-S199 PolarHBondContact O-N 3.38Å; Y197-S199 VanDerWaalsContact C-N 3.32Å; Y197-S199 PolarHBondContact O-N 3.41Å; S199-F201 VanDerWaalsContact C-N 3.32Å; S199-F201 PolarHBondContact O-N 3.34Å; S199-L202 WeakPolarHBondContact O-CB 3.41Å; S199-L202 PolarHBondContact O-N 2.88Å; S199-S203 WeakPolarHBondContact O-CB 3.49Å; S199-S203 PolarHBondContact O-N 2.95Å; S199-S203 PolarHBondContact O-OG 2.91Å |
| 200 | T | 97 | Very high | 94 | Very high | 28 Ų | 28 | 36.3 Ų | 36.3 | 17% | 0.172 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -57.3 | -47.4 | 169.3 | -69.3 | 0 | 0 | 0 | 0 | 110.8 | Y171 C172 H196 Y197 S203 G204 | Y171-T200 VanDerWaalsContact C-OG1 3.3Å; Y171-T200 WeakPolarHBondContact CB-OG1 3.48Å; C172-T200 PolarHBondContact N-OG1 3.39Å; C172-T200 WeakPolarHBondContact SG-CG2 2.97Å; H196-T200 PolarHBondContact O-N 2.96Å; H196-T200 PolarHBondContact O-OG1 3.16Å; Y197-T200 PolarHBondContact O-N 2.82Å; T200-S203 PolarHBondContact O-N 3.2Å; T200-G204 PolarHBondContact O-N 3.24Å |
| 201 | F | 97.3 | Very high | 94.2 | Very high | 103 Ų | 103 | 38 Ų | 38 | 45% | 0.452 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -62 | -47.6 | 177.6 | 178.7 | -102 | 0 | 0 | 0 | 111.4 | Y197 V198 S199 S203 G204 V205 T312 | Y197-F201 PolarHBondContact O-N 3.18Å; V198-F201 PolarHBondContact O-N 3.34Å; S199-F201 VanDerWaalsContact C-N 3.32Å; S199-F201 PolarHBondContact O-N 3.34Å; F201-S203 PolarHBondContact O-N 2.89Å; F201-G204 PolarHBondContact O-N 3.35Å; F201-G204 VanDerWaalsContact O-N 3.12Å; F201-V205 HydrophobicContact CD1-CG2 4.19Å; F201-V205 HydrophobicContact CD2-CG2 4.35Å; F201-V205 HydrophobicContact CE1-CG2 3.77Å; F201-V205 HydrophobicContact CE2-CG2 3.94Å; F201-V205 HydrophobicContact CG-CG2 4.46Å; F201-V205 HydrophobicContact CZ-CG2 3.64Å; F201-V205 WeakPolarHBondContact O-CG2 3.31Å; F201-V205 PolarHBondContact O-N 3.23Å; F201-T312 HydrophobicContact CD1-CG2 4.18Å |
| 202 | L | 97.6 | Very high | 94.1 | Very high | 10 Ų | 10 | 36.7 Ų | 36.7 | 5% | 0.052 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -52.4 | -52.3 | 175.6 | -173.8 | 80.5 | 0 | 0 | 0 | 111.5 | V198 S199 G204 V205 M206 L309 T312 F313 L316 | V198-L202 WeakPolarHBondContact O-CB 3.45Å; V198-L202 PolarHBondContact O-N 2.96Å; S199-L202 WeakPolarHBondContact O-CB 3.41Å; S199-L202 PolarHBondContact O-N 2.88Å; L202-G204 VanDerWaalsContact C-N 3.3Å; L202-G204 PolarHBondContact O-N 3.37Å; L202-V205 PolarHBondContact O-N 3.45Å; L202-M206 WeakPolarHBondContact O-CB 3.45Å; L202-M206 PolarHBondContact O-N 3.14Å; L202-L309 HydrophobicContact CD1-CD2 3.47Å; L202-L309 VanDerWaalsContact CD1-CD2 3.47Å; L202-L309 HydrophobicContact CG-CD2 3.98Å; L202-L309 WeakPolarHBondContact O-CD2 3.43Å; L202-T312 HydrophobicContact CB-CG2 3.72Å; L202-T312 HydrophobicContact CD1-CG2 3.61Å; L202-T312 HydrophobicContact CG-CG2 4.27Å; L202-F313 HydrophobicContact CD1-CD2 3.76Å; L202-F313 HydrophobicContact CD1-CE2 3.77Å; L202-F313 HydrophobicContact CD1-CG 4.2Å; L202-F313 HydrophobicContact CD1-CZ 4.2Å; L202-F313 HydrophobicContact CD2-CD1 4.4Å; L202-F313 HydrophobicContact CD2-CE1 3.87Å; L202-F313 HydrophobicContact CD2-CE2 4.18Å; L202-F313 HydrophobicContact CD2-CZ 3.75Å; L202-F313 HydrophobicContact CG-CE2 4.43Å; L202-F313 HydrophobicContact CG-CZ 4.46Å; L202-L316 HydrophobicContact CD2-CD1 3.92Å |
| 203 | S | 96.6 | Very high | 94.1 | Very high | 3 Ų | 3 | 39.7 Ų | 39.7 | 2% | 0.021 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -65.4 | -33.3 | -179.9 | -61.5 | 0 | 0 | 0 | 0 | 112.3 | L167 S199 T200 F201 M206 L207 | L167-S203 WeakPolarHBondContact CB-OG 3.35Å; S199-S203 WeakPolarHBondContact O-CB 3.49Å; S199-S203 PolarHBondContact O-N 2.95Å; S199-S203 PolarHBondContact O-OG 2.91Å; T200-S203 PolarHBondContact O-N 3.2Å; F201-S203 PolarHBondContact O-N 2.89Å; S203-M206 PolarHBondContact O-N 2.88Å; S203-L207 WeakPolarHBondContact O-CB 3.47Å; S203-L207 PolarHBondContact O-N 3.34Å |
| 204 | G | 97.1 | Very high | 94.3 | Very high | 22 Ų | 22 | 38.9 Ų | 38.9 | 23% | 0.227 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -68.3 | -40.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | T200 F201 L202 M206 L207 T208 | T200-G204 PolarHBondContact O-N 3.24Å; F201-G204 PolarHBondContact O-N 3.35Å; F201-G204 VanDerWaalsContact O-N 3.12Å; L202-G204 VanDerWaalsContact C-N 3.3Å; L202-G204 PolarHBondContact O-N 3.37Å; G204-M206 VanDerWaalsContact C-N 3.34Å; G204-L207 PolarHBondContact O-N 3.14Å; G204-T208 WeakPolarHBondContact O-CG2 3.42Å; G204-T208 PolarHBondContact O-N 3.39Å; G204-T208 VanDerWaalsContact O-N 3.11Å; G204-T208 PolarHBondContact O-OG1 3.46Å |
| 205 | V | 97.1 | Very high | 94.4 | Very high | 4 Ų | 4 | 36.2 Ų | 36.2 | 2% | 0.024 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66 | -39.6 | 173.4 | -179.9 | 0 | 0 | 0 | 0 | 110.5 | F201 L202 T208 W209 W304 Q305 M308 L309 | F201-V205 HydrophobicContact CD1-CG2 4.19Å; F201-V205 HydrophobicContact CD2-CG2 4.35Å; F201-V205 HydrophobicContact CE1-CG2 3.77Å; F201-V205 HydrophobicContact CE2-CG2 3.94Å; F201-V205 HydrophobicContact CG-CG2 4.46Å; F201-V205 HydrophobicContact CZ-CG2 3.64Å; F201-V205 WeakPolarHBondContact O-CG2 3.31Å; F201-V205 PolarHBondContact O-N 3.23Å; L202-V205 PolarHBondContact O-N 3.45Å; V205-T208 PolarHBondContact O-N 3.24Å; V205-T208 PolarHBondContact O-OG1 3.45Å; V205-T208 VanDerWaalsContact O-OG1 3.14Å; V205-W209 PolarHBondContact O-N 2.86Å; V205-W209 VanDerWaalsContact O-N 3.12Å; V205-W304 HydrophobicContact CG1-CZ3 4.31Å; V205-W304 HydrophobicContact CG2-CH2 4.37Å; V205-W304 HydrophobicContact CG2-CZ3 4.32Å; V205-Q305 HydrophobicContact CG1-CB 3.66Å; V205-Q305 HydrophobicContact CG1-CG 3.89Å; V205-M308 HydrophobicContact CG1-CB 4.24Å; V205-L309 HydrophobicContact CB-CD2 3.86Å; V205-L309 HydrophobicContact CB-CG 4.23Å; V205-L309 HydrophobicContact CG1-CD1 4.25Å; V205-L309 HydrophobicContact CG1-CD2 3.88Å; V205-L309 HydrophobicContact CG1-CG 3.65Å |
| 206 | M | 95.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.6 | -42.1 | 175.7 | -164.8 | 68.4 | -132.7 | 0 | 0 | 112 | N164 L202 S203 G204 T208 W209 Y215 F222 L309 | N164-M206 VanDerWaalsContact OD1-CG 3.24Å; N164-M206 WeakPolarHBondContact OD1-CG 3.27Å; L202-M206 WeakPolarHBondContact O-CB 3.45Å; L202-M206 PolarHBondContact O-N 3.14Å; S203-M206 PolarHBondContact O-N 2.88Å; G204-M206 VanDerWaalsContact C-N 3.34Å; M206-T208 VanDerWaalsContact C-N 3.31Å; M206-T208 PolarHBondContact O-N 2.73Å; M206-W209 HydrophobicContact CE-CD2 4.35Å; M206-W209 HydrophobicContact CE-CE3 3.61Å; M206-W209 HydrophobicContact CE-CZ3 4.16Å; M206-W209 WeakPolarHBondContact O-CB 3.37Å; M206-W209 PolarHBondContact O-N 2.93Å; M206-W209 HydrophobicContact SD-CE3 3.85Å; M206-W209 HydrophobicContact SD-CZ3 4.26Å; M206-Y215 HydrophobicContact CE-CD2 3.54Å; M206-Y215 HydrophobicContact CE-CE2 3.19Å; M206-F222 HydrophobicContact CG-CD1 4.27Å; M206-F222 HydrophobicContact CG-CE1 3.88Å; M206-F222 HydrophobicContact CG-CE2 4.31Å; M206-F222 HydrophobicContact CG-CZ 3.9Å; M206-F222 HydrophobicContact SD-CD1 4.41Å; M206-F222 HydrophobicContact SD-CD2 4.38Å; M206-F222 HydrophobicContact SD-CG 4.32Å; M206-L309 HydrophobicContact CB-CD2 4.38Å; M206-L309 HydrophobicContact SD-CD1 3.85Å |
| 207 | L | 96 | Very high | 94.2 | Very high | 43 Ų | 43 | 42.7 Ų | 42.7 | 23% | 0.225 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61.2 | -39.7 | 176.9 | 178.8 | 61.5 | 0 | 0 | 0 | 112.3 | R157 E161 N164 F165 V168 S203 G204 W209 | R157-L207 PolarHBondContact NH2-O 3.33Å; R157-L207 VanDerWaalsContact NH2-O 3.16Å; E161-L207 HydrophobicContact CB-CD1 4.4Å; E161-L207 HydrophobicContact CG-CD1 3.78Å; E161-L207 WeakPolarHBondContact O-CD1 3.41Å; N164-L207 HydrophobicContact CB-CB 4.04Å; N164-L207 HydrophobicContact CB-CD1 4.02Å; F165-L207 HydrophobicContact CB-CD1 4.34Å; F165-L207 HydrophobicContact CB-CD2 4.38Å; F165-L207 HydrophobicContact CD2-CD2 4.39Å; V168-L207 HydrophobicContact CG2-CD2 4.46Å; S203-L207 WeakPolarHBondContact O-CB 3.47Å; S203-L207 PolarHBondContact O-N 3.34Å; G204-L207 PolarHBondContact O-N 3.14Å; L207-W209 VanDerWaalsContact C-N 3.34Å |
| 208 | T | 95.3 | Very high | 94.2 | Very high | 80 Ų | 80 | 38.7 Ų | 38.7 | 49% | 0.491 | 21% | 0.21 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | 0.5 | -178.4 | 56.6 | 0 | 0 | 0 | 0 | 113.8 | G204 V205 M206 P210 Q305 | G204-T208 WeakPolarHBondContact O-CG2 3.42Å; G204-T208 PolarHBondContact O-N 3.39Å; G204-T208 VanDerWaalsContact O-N 3.11Å; G204-T208 PolarHBondContact O-OG1 3.46Å; V205-T208 PolarHBondContact O-N 3.24Å; V205-T208 PolarHBondContact O-OG1 3.45Å; V205-T208 VanDerWaalsContact O-OG1 3.14Å; M206-T208 VanDerWaalsContact C-N 3.31Å; M206-T208 PolarHBondContact O-N 2.73Å; T208-P210 VanDerWaalsContact O-CD 3.27Å; T208-P210 WeakPolarHBondContact O-CD 3.04Å; T208-Q305 PolarHBondContact O-NE2 2.83Å |
| 209 | W | 94.5 | Very high | 94.1 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.201 | C | C | . | . | trans | -72.3 | 115.2 | 174.5 | -167.5 | -19.2 | 0 | 0 | 0 | 109.1 | R157 V205 M206 L207 M214 Y215 F218 L292 Q305 I306 L309 | R157-W209 PolarHBondContact NH2-O 2.81Å; V205-W209 PolarHBondContact O-N 2.86Å; V205-W209 VanDerWaalsContact O-N 3.12Å; M206-W209 HydrophobicContact CE-CD2 4.35Å; M206-W209 HydrophobicContact CE-CE3 3.61Å; M206-W209 HydrophobicContact CE-CZ3 4.16Å; M206-W209 WeakPolarHBondContact O-CB 3.37Å; M206-W209 PolarHBondContact O-N 2.93Å; M206-W209 HydrophobicContact SD-CE3 3.85Å; M206-W209 HydrophobicContact SD-CZ3 4.26Å; L207-W209 VanDerWaalsContact C-N 3.34Å; W209-M214 HydrophobicContact CZ2-CB 3.95Å; W209-Y215 HydrophobicContact CB-CD2 4.21Å; W209-Y215 HydrophobicContact CD2-CD2 4.01Å; W209-Y215 HydrophobicContact CE3-CD2 4.37Å; W209-Y215 AromaticContact CG-CD2 3.93Å; W209-Y215 HydrophobicContact CG-CD2 3.93Å; W209-F218 HydrophobicContact CH2-CB 4.06Å; W209-F218 HydrophobicContact CH2-CD1 4.29Å; W209-F218 HydrophobicContact CH2-CG 4.45Å; W209-F218 HydrophobicContact CZ3-CB 4.44Å; W209-F218 AromaticContact CZ3-CD1 3.86Å; W209-F218 HydrophobicContact CZ3-CD1 3.86Å; W209-F218 HydrophobicContact CZ3-CG 4.46Å; W209-L292 HydrophobicContact CH2-CD2 3.75Å; W209-L292 HydrophobicContact CZ3-CD2 3.83Å; W209-Q305 HydrophobicContact CB-CB 4.18Å; W209-Q305 HydrophobicContact CB-CG 4.24Å; W209-Q305 HydrophobicContact CD2-CB 4.37Å; W209-Q305 HydrophobicContact CG-CB 4.11Å; W209-I306 HydrophobicContact CD2-CG1 4.5Å; W209-I306 HydrophobicContact CH2-CB 4.47Å; W209-I306 HydrophobicContact CH2-CD1 4.15Å; W209-I306 HydrophobicContact CH2-CG1 3.77Å; W209-I306 HydrophobicContact CH2-CG2 4.38Å; W209-I306 HydrophobicContact CZ2-CB 4.47Å; W209-I306 HydrophobicContact CZ2-CD1 3.45Å; W209-I306 VanDerWaalsContact CZ2-CD1 3.45Å; W209-I306 HydrophobicContact CZ2-CG1 3.34Å; W209-I306 HydrophobicContact CZ3-CG1 4.5Å; W209-L309 HydrophobicContact CD2-CD1 4.34Å; W209-L309 HydrophobicContact CE3-CD1 3.22Å; W209-L309 HydrophobicContact CZ3-CD1 3.37Å | ||
| 210 | P | 90.9 | Very high | 94.1 | Very high | 61 Ų | 61 | 41.2 Ų | 41.2 | 40% | 0.396 | 22% | 0.222 | S | C | . | . | trans | -62.7 | 155.2 | 178.2 | 27.2 | -36.4 | 0 | 0 | 0 | 112.3 | T208 G212 E303 | T208-P210 VanDerWaalsContact O-CD 3.27Å; T208-P210 WeakPolarHBondContact O-CD 3.04Å; P210-G212 PolarHBondContact O-N 3.02Å; P210-E303 HydrophobicContact CG-CG 4.12Å | ||
| 211 | E | 88.5 | Confident | 94.1 | Very high | 89 Ų | 89 | 41.4 Ų | 41.4 | 42% | 0.416 | 22% | 0.221 | S | C | . | . | S | Bend | trans | -60.9 | 133 | 170.9 | -178.1 | 57.5 | -119.5 | 0 | 0 | 110.3 | R157 Q216 | R157-E211 WeakPolarHBondContact CD-OE2 3.27Å; R157-E211 HydrophobicContact CG-CB 4.2Å; E211-Q216 VanDerWaalsContact CD-NE2 3.31Å; E211-Q216 VanDerWaalsContact OE1-CG 3.25Å; E211-Q216 WeakPolarHBondContact OE1-CG 3.42Å; E211-Q216 PolarHBondContact OE1-NE2 3.44Å; E211-Q216 PolarHBondContact OE2-NE2 3.45Å |
| 212 | G | 88.8 | Confident | 94 | Very high | 22 Ų | 22 | 36.9 Ų | 36.9 | 23% | 0.227 | 20% | 0.201 | C | C | . | . | S | Bend | trans | 178.3 | 170.8 | -173.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | P210 M214 Y215 Q216 | P210-G212 PolarHBondContact O-N 3.02Å; G212-M214 VanDerWaalsContact C-N 3.34Å; G212-M214 PolarHBondContact O-N 2.82Å; G212-Y215 WeakPolarHBondContact O-CB 3.48Å; G212-Y215 PolarHBondContact O-N 2.65Å; G212-Q216 PolarHBondContact O-N 3.49Å |
| 213 | Q | 89.6 | Confident | 94 | Very high | 129 Ų | 129 | 36.6 Ų | 36.6 | 60% | 0.603 | 20% | 0.199 | S | C | * | . | H | α-helix | trans | -57.8 | -46.2 | -177.1 | -174.3 | -177.7 | 15.6 | 0 | 0 | 111.9 | Y215 Q216 M217 | Q213-Y215 VanDerWaalsContact C-N 3.31Å; Q213-Y215 PolarHBondContact O-N 3.26Å; Q213-Q216 PolarHBondContact O-N 3.37Å; Q213-M217 HydrophobicContact CG-SD 4.27Å; Q213-M217 VanDerWaalsContact O-CG 3.32Å; Q213-M217 WeakPolarHBondContact O-CG 3.37Å; Q213-M217 PolarHBondContact O-N 3.45Å |
| 214 | M | 91.5 | Very high | 94 | Very high | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.025 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.8 | -36.7 | -179.2 | -61.9 | -60.7 | 143.2 | 0 | 0 | 112.3 | W209 G212 M217 F218 L295 H298 I306 | W209-M214 HydrophobicContact CZ2-CB 3.95Å; G212-M214 VanDerWaalsContact C-N 3.34Å; G212-M214 PolarHBondContact O-N 2.82Å; M214-M217 HydrophobicContact CE-SD 4.42Å; M214-M217 PolarHBondContact O-N 3.43Å; M214-M217 HydrophobicContact SD-SD 4.21Å; M214-F218 PolarHBondContact O-N 2.89Å; M214-L295 HydrophobicContact SD-CB 4.36Å; M214-L295 HydrophobicContact SD-CD2 3.86Å; M214-H298 HydrophobicContact CE-CB 4.07Å; M214-H298 HydrophobicContact SD-CB 4.38Å; M214-I306 HydrophobicContact CB-CD1 3.48Å; M214-I306 VanDerWaalsContact CB-CD1 3.48Å; M214-I306 HydrophobicContact CG-CD1 3.9Å |
| 215 | Y | 92.2 | Very high | 94 | Very high | 3 Ų | 3 | 37.5 Ų | 37.5 | 1% | 0.012 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.1 | -50.7 | 174 | 174.4 | -90.5 | 0 | 0 | 0 | 110.3 | D160 M206 W209 G212 Q213 M217 F218 R219 | D160-Y215 WeakPolarHBondContact CB-OH 3.28Å; D160-Y215 VanDerWaalsContact CG-OH 3.29Å; D160-Y215 PolarHBondContact OD2-OH 3.41Å; M206-Y215 HydrophobicContact CE-CD2 3.54Å; M206-Y215 HydrophobicContact CE-CE2 3.19Å; W209-Y215 HydrophobicContact CB-CD2 4.21Å; W209-Y215 HydrophobicContact CD2-CD2 4.01Å; W209-Y215 HydrophobicContact CE3-CD2 4.37Å; W209-Y215 AromaticContact CG-CD2 3.93Å; W209-Y215 HydrophobicContact CG-CD2 3.93Å; G212-Y215 WeakPolarHBondContact O-CB 3.48Å; G212-Y215 PolarHBondContact O-N 2.65Å; Q213-Y215 VanDerWaalsContact C-N 3.31Å; Q213-Y215 PolarHBondContact O-N 3.26Å; Y215-M217 VanDerWaalsContact C-N 3.28Å; Y215-M217 PolarHBondContact O-N 3.27Å; Y215-F218 PolarHBondContact O-N 3.02Å; Y215-R219 HydrophobicContact CE1-CB 4.23Å; Y215-R219 HydrophobicContact CE1-CG 4.14Å; Y215-R219 WeakPolarHBondContact O-CB 3.38Å; Y215-R219 PolarHBondContact O-N 3.15Å |
| 216 | Q | 91.9 | Very high | 94 | Very high | 70 Ų | 70 | 37.8 Ų | 37.8 | 33% | 0.327 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -62.1 | -34.9 | -179.3 | -69.9 | -61.4 | -26.9 | 0 | 0 | 112.9 | E211 G212 Q213 F218 | E211-Q216 VanDerWaalsContact CD-NE2 3.31Å; E211-Q216 VanDerWaalsContact OE1-CG 3.25Å; E211-Q216 WeakPolarHBondContact OE1-CG 3.42Å; E211-Q216 PolarHBondContact OE1-NE2 3.44Å; E211-Q216 PolarHBondContact OE2-NE2 3.45Å; G212-Q216 PolarHBondContact O-N 3.49Å; Q213-Q216 PolarHBondContact O-N 3.37Å; Q216-F218 VanDerWaalsContact C-N 3.31Å; Q216-F218 PolarHBondContact O-N 2.88Å |
| 217 | M | 92.2 | Very high | 94.1 | Very high | 104 Ų | 104 | 39.5 Ų | 39.5 | 51% | 0.512 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -64.4 | -33.8 | 175.1 | -70.8 | 176.9 | 77 | 0 | 0 | 112.9 | Q213 M214 Y215 L295 | Q213-M217 HydrophobicContact CG-SD 4.27Å; Q213-M217 VanDerWaalsContact O-CG 3.32Å; Q213-M217 WeakPolarHBondContact O-CG 3.37Å; Q213-M217 PolarHBondContact O-N 3.45Å; M214-M217 HydrophobicContact CE-SD 4.42Å; M214-M217 PolarHBondContact O-N 3.43Å; M214-M217 HydrophobicContact SD-SD 4.21Å; Y215-M217 VanDerWaalsContact C-N 3.28Å; Y215-M217 PolarHBondContact O-N 3.27Å; M217-L295 HydrophobicContact CB-CD2 4.38Å; M217-L295 HydrophobicContact CE-CD2 3.84Å; M217-L295 HydrophobicContact SD-CD2 4.08Å |
| 218 | F | 95.1 | Very high | 94.2 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -95.1 | -23.2 | -179.1 | -172.8 | -113.4 | 0 | 0 | 0 | 113.8 | W209 M214 Y215 Q216 N220 Q221 F222 N288 T291 L292 L295 F313 | W209-F218 HydrophobicContact CH2-CB 4.06Å; W209-F218 HydrophobicContact CH2-CD1 4.29Å; W209-F218 HydrophobicContact CH2-CG 4.45Å; W209-F218 HydrophobicContact CZ3-CB 4.44Å; W209-F218 AromaticContact CZ3-CD1 3.86Å; W209-F218 HydrophobicContact CZ3-CD1 3.86Å; W209-F218 HydrophobicContact CZ3-CG 4.46Å; M214-F218 PolarHBondContact O-N 2.89Å; Y215-F218 PolarHBondContact O-N 3.02Å; Q216-F218 VanDerWaalsContact C-N 3.31Å; Q216-F218 PolarHBondContact O-N 2.88Å; F218-N220 PolarHBondContact O-N 3.49Å; F218-Q221 HydrophobicContact CD2-CB 4.32Å; F218-Q221 HydrophobicContact CD2-CG 4.45Å; F218-Q221 HydrophobicContact CE2-CB 4.43Å; F218-Q221 HydrophobicContact CE2-CG 4.14Å; F218-Q221 WeakPolarHBondContact O-CB 3.3Å; F218-Q221 PolarHBondContact O-N 3.32Å; F218-Q221 VanDerWaalsContact O-N 3.07Å; F218-F222 HydrophobicContact CD1-CB 4Å; F218-F222 HydrophobicContact CE1-CB 3.71Å; F218-F222 HydrophobicContact CE1-CD2 4.11Å; F218-F222 HydrophobicContact CE1-CG 4.26Å; F218-F222 HydrophobicContact CZ-CB 4.28Å; F218-F222 PolarHBondContact O-N 2.86Å; F218-N288 HydrophobicContact CE2-CB 4.17Å; F218-N288 HydrophobicContact CZ-CB 4.06Å; F218-T291 HydrophobicContact CD2-CG2 4.22Å; F218-L292 HydrophobicContact CB-CD2 4.43Å; F218-L292 HydrophobicContact CD1-CD2 3.83Å; F218-L292 HydrophobicContact CD1-CG 4.49Å; F218-L292 HydrophobicContact CD2-CD2 3.92Å; F218-L292 HydrophobicContact CD2-CG 4.05Å; F218-L292 HydrophobicContact CE1-CD1 3.97Å; F218-L292 HydrophobicContact CE1-CD2 4Å; F218-L292 HydrophobicContact CE1-CG 4.24Å; F218-L292 HydrophobicContact CE2-CD1 4.04Å; F218-L292 HydrophobicContact CE2-CD2 4.11Å; F218-L292 HydrophobicContact CE2-CG 3.8Å; F218-L292 HydrophobicContact CG-CD2 3.79Å; F218-L292 HydrophobicContact CG-CG 4.39Å; F218-L292 HydrophobicContact CZ-CD1 3.64Å; F218-L292 HydrophobicContact CZ-CD2 4.14Å; F218-L292 HydrophobicContact CZ-CG 3.91Å; F218-L295 HydrophobicContact CB-CD1 4.1Å; F218-F313 HydrophobicContact CE1-CE2 4.22Å; F218-F313 AromaticContact CZ-CE2 3.92Å; F218-F313 HydrophobicContact CZ-CE2 3.92Å; F218-F313 HydrophobicContact CZ-CZ 4.44Å |
| 219 | R | 94.9 | Very high | 94.2 | Very high | 3 Ų | 3 | 36.2 Ų | 36.2 | 1% | 0.011 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -46.5 | -57.5 | -173.7 | -179.9 | -170.9 | -180 | -87.7 | -3.8 | 113.5 | C150 L154 N155 D160 Y215 Q221 F222 L223 | C150-R219 PolarHBondContact O-NH1 3.39Å; C150-R219 PolarHBondContact O-NH2 3.48Å; L154-R219 PolarHBondContact O-NH2 3.32Å; N155-R219 PolarHBondContact OD1-NE 3.36Å; N155-R219 PolarHBondContact OD1-NH1 3.5Å; D160-R219 IonicContact OD1-CZ 3.54Å; D160-R219 IonicContact OD1-NE 3.1Å; D160-R219 PolarHBondContact OD1-NE 2.87Å; D160-R219 IonicContact OD1-NH2 2.78Å; D160-R219 PolarHBondContact OD1-NH2 3.5Å; D160-R219 WeakPolarHBondContact OD2-CD 3.45Å; D160-R219 IonicContact OD2-CZ 3.57Å; D160-R219 IonicContact OD2-NE 3.31Å; D160-R219 PolarHBondContact OD2-NE 3.12Å; D160-R219 IonicContact OD2-NH2 3.53Å; Y215-R219 HydrophobicContact CE1-CB 4.23Å; Y215-R219 HydrophobicContact CE1-CG 4.14Å; Y215-R219 WeakPolarHBondContact O-CB 3.38Å; Y215-R219 PolarHBondContact O-N 3.15Å; R219-Q221 VanDerWaalsContact C-N 3.28Å; R219-Q221 PolarHBondContact O-N 2.94Å; R219-F222 PolarHBondContact O-N 2.93Å; R219-F222 VanDerWaalsContact O-N 3.17Å; R219-L223 HydrophobicContact CG-CD1 4.1Å; R219-L223 WeakPolarHBondContact O-CG 3.36Å; R219-L223 PolarHBondContact O-N 3.27Å |
| 220 | N | 95.3 | Very high | 94.2 | Very high | 87 Ų | 87 | 36.5 Ų | 36.5 | 47% | 0.465 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -65.4 | -35.1 | -175.4 | -68.8 | -11.1 | 0 | 0 | 0 | 111.7 | L151 F218 A224 | L151-N220 HydrophobicContact CD1-CB 4Å; F218-N220 PolarHBondContact O-N 3.49Å; N220-A224 VanDerWaalsContact O-CB 3.24Å; N220-A224 WeakPolarHBondContact O-CB 3.49Å; N220-A224 PolarHBondContact O-N 2.9Å |
| 221 | Q | 97.1 | Very high | 94.4 | Very high | 31 Ų | 31 | 37.6 Ų | 37.6 | 15% | 0.145 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66.1 | -41.5 | 175.3 | -179.9 | 171.6 | -26.3 | 0 | 0 | 111.3 | F218 R219 F225 Y287 N288 T291 | F218-Q221 HydrophobicContact CD2-CB 4.32Å; F218-Q221 HydrophobicContact CD2-CG 4.45Å; F218-Q221 HydrophobicContact CE2-CB 4.43Å; F218-Q221 HydrophobicContact CE2-CG 4.14Å; F218-Q221 WeakPolarHBondContact O-CB 3.3Å; F218-Q221 PolarHBondContact O-N 3.32Å; F218-Q221 VanDerWaalsContact O-N 3.07Å; R219-Q221 VanDerWaalsContact C-N 3.28Å; R219-Q221 PolarHBondContact O-N 2.94Å; Q221-F225 VanDerWaalsContact O-CB 3.29Å; Q221-F225 WeakPolarHBondContact O-CB 3.47Å; Q221-F225 PolarHBondContact O-N 3.45Å; Q221-Y287 VanDerWaalsContact CD-CE1 3.41Å; Q221-Y287 HydrophobicContact CG-CE1 4.26Å; Q221-N288 WeakPolarHBondContact CG-OD1 3.41Å; Q221-N288 PolarHBondContact NE2-OD1 3.44Å; Q221-T291 PolarHBondContact NE2-OG1 3.29Å |
| 222 | F | 96.5 | Very high | 94.7 | Very high | 9 Ų | 9 | 33.6 Ų | 33.6 | 4% | 0.039 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.1 | -44.2 | 175.5 | 178.2 | -104.9 | 0 | 0 | 0 | 112.7 | F163 N164 L167 M206 F218 R219 F225 S226 F313 | F163-F222 HydrophobicContact CE1-CE1 4.15Å; N164-F222 WeakPolarHBondContact OD1-CE1 3.49Å; L167-F222 HydrophobicContact CD1-CE1 4.24Å; L167-F222 HydrophobicContact CD1-CZ 3.9Å; M206-F222 HydrophobicContact CG-CD1 4.27Å; M206-F222 HydrophobicContact CG-CE1 3.88Å; M206-F222 HydrophobicContact CG-CE2 4.31Å; M206-F222 HydrophobicContact CG-CZ 3.9Å; M206-F222 HydrophobicContact SD-CD1 4.41Å; M206-F222 HydrophobicContact SD-CD2 4.38Å; M206-F222 HydrophobicContact SD-CG 4.32Å; F218-F222 HydrophobicContact CD1-CB 4Å; F218-F222 HydrophobicContact CE1-CB 3.71Å; F218-F222 HydrophobicContact CE1-CD2 4.11Å; F218-F222 HydrophobicContact CE1-CG 4.26Å; F218-F222 HydrophobicContact CZ-CB 4.28Å; F218-F222 PolarHBondContact O-N 2.86Å; R219-F222 PolarHBondContact O-N 2.93Å; R219-F222 VanDerWaalsContact O-N 3.17Å; F222-F225 PolarHBondContact O-N 2.99Å; F222-S226 WeakPolarHBondContact O-CB 3.49Å; F222-S226 PolarHBondContact O-N 3.16Å; F222-S226 PolarHBondContact O-OG 3.3Å; F222-F313 HydrophobicContact CD2-CZ 4.15Å; F222-F313 HydrophobicContact CE2-CZ 4.3Å |
| 223 | L | 96.6 | Very high | 94.9 | Very high | 4 Ų | 4 | 33.6 Ų | 33.6 | 2% | 0.021 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -66.1 | -43.3 | 177.7 | -70.4 | 173.1 | 0 | 0 | 0 | 111.5 | C150 L151 F163 R219 F225 S226 I227 | C150-L223 HydrophobicContact CB-CD1 3.99Å; C150-L223 HydrophobicContact CB-CD2 4Å; L151-L223 HydrophobicContact CB-CB 4.24Å; L151-L223 HydrophobicContact CB-CD1 4.26Å; L151-L223 HydrophobicContact CD1-CB 4.16Å; L151-L223 HydrophobicContact CD1-CD1 4.32Å; F163-L223 HydrophobicContact CD1-CD2 4.04Å; F163-L223 HydrophobicContact CE1-CD2 4.01Å; R219-L223 HydrophobicContact CG-CD1 4.1Å; R219-L223 WeakPolarHBondContact O-CG 3.36Å; R219-L223 PolarHBondContact O-N 3.27Å; L223-F225 VanDerWaalsContact C-N 3.35Å; L223-F225 PolarHBondContact O-N 3.4Å; L223-S226 WeakPolarHBondContact O-CB 3.34Å; L223-S226 PolarHBondContact O-N 3.12Å; L223-S226 VanDerWaalsContact O-N 3.11Å; L223-I227 WeakPolarHBondContact O-CG1 3.17Å; L223-I227 PolarHBondContact O-N 3.39Å |
| 224 | A | 97.4 | Very high | 94.9 | Very high | 31 Ų | 31 | 30.3 Ų | 30.3 | 26% | 0.256 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -61 | -43.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | N220 S226 I227 Y228 W284 | N220-A224 VanDerWaalsContact O-CB 3.24Å; N220-A224 WeakPolarHBondContact O-CB 3.49Å; N220-A224 PolarHBondContact O-N 2.9Å; A224-S226 VanDerWaalsContact C-N 3.3Å; A224-S226 PolarHBondContact O-N 2.85Å; A224-I227 PolarHBondContact O-N 3.49Å; A224-Y228 PolarHBondContact O-N 3.31Å; A224-W284 HydrophobicContact CB-CH2 4.37Å; A224-W284 HydrophobicContact CB-CZ2 4.08Å |
| 225 | F | 97.4 | Very high | 94.9 | Very high | 13 Ų | 13 | 30.7 Ų | 30.7 | 6% | 0.057 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -59.9 | -40.6 | 172.2 | 175 | -102.5 | 0 | 0 | 0 | 112 | Q221 F222 L223 Y228 Q229 W284 Q285 N288 F313 | Q221-F225 VanDerWaalsContact O-CB 3.29Å; Q221-F225 WeakPolarHBondContact O-CB 3.47Å; Q221-F225 PolarHBondContact O-N 3.45Å; F222-F225 PolarHBondContact O-N 2.99Å; L223-F225 VanDerWaalsContact C-N 3.35Å; L223-F225 PolarHBondContact O-N 3.4Å; F225-Y228 PolarHBondContact O-N 2.84Å; F225-Q229 HydrophobicContact CE1-CB 4.46Å; F225-Q229 VanDerWaalsContact O-CB 3.26Å; F225-Q229 WeakPolarHBondContact O-CB 3.26Å; F225-Q229 PolarHBondContact O-N 3.13Å; F225-W284 HydrophobicContact CD2-CB 4.01Å; F225-W284 AromaticContact CD2-CD1 3.73Å; F225-W284 HydrophobicContact CD2-CD2 4.04Å; F225-W284 AromaticContact CD2-CG 3.66Å; F225-W284 HydrophobicContact CD2-CG 3.66Å; F225-W284 HydrophobicContact CE2-CB 4.19Å; F225-W284 HydrophobicContact CE2-CG 4.34Å; F225-Q285 HydrophobicContact CE2-CG 3.79Å; F225-Q285 HydrophobicContact CZ-CG 3.58Å; F225-N288 VanDerWaalsContact CG-ND2 3.3Å; F225-N288 WeakPolarHBondContact CG-ND2 3.44Å; F225-F313 HydrophobicContact CD1-CE1 4.12Å; F225-F313 HydrophobicContact CD1-CZ 4.4Å; F225-F313 AromaticContact CE1-CE1 3.74Å; F225-F313 HydrophobicContact CE1-CE1 3.74Å; F225-F313 HydrophobicContact CE1-CZ 4.39Å; F225-F313 HydrophobicContact CZ-CE1 4.22Å |
| 226 | S | 96.9 | Very high | 94.6 | Very high | 10 Ų | 10 | 32.8 Ų | 32.8 | 7% | 0.07 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.8 | -41.3 | 178.6 | -59.4 | 0 | 0 | 0 | 0 | 112.2 | F222 L223 A224 Q229 S230 | F222-S226 WeakPolarHBondContact O-CB 3.49Å; F222-S226 PolarHBondContact O-N 3.16Å; F222-S226 PolarHBondContact O-OG 3.3Å; L223-S226 WeakPolarHBondContact O-CB 3.34Å; L223-S226 PolarHBondContact O-N 3.12Å; L223-S226 VanDerWaalsContact O-N 3.11Å; A224-S226 VanDerWaalsContact C-N 3.3Å; A224-S226 PolarHBondContact O-N 2.85Å; S226-Q229 PolarHBondContact O-N 2.97Å; S226-S230 PolarHBondContact O-N 3.46Å; S226-S230 PolarHBondContact O-OG 3.45Å |
| 227 | I | 97.6 | Very high | 94.4 | Very high | 35 Ų | 35 | 31.5 Ų | 31.5 | 18% | 0.179 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.2 | -49.3 | 173.5 | -64.6 | 166.5 | 0 | 0 | 0 | 109.9 | M144 A147 I148 L151 L223 A224 Q229 S230 F231 | M144-I227 HydrophobicContact CG-CG2 4.5Å; A147-I227 HydrophobicContact CB-CD1 4.4Å; A147-I227 HydrophobicContact CB-CG1 3.56Å; I148-I227 HydrophobicContact CB-CD1 4.48Å; I148-I227 HydrophobicContact CG1-CD1 3.7Å; I148-I227 HydrophobicContact CG1-CG1 3.93Å; I148-I227 HydrophobicContact CG1-CG2 4.33Å; L151-I227 HydrophobicContact CD2-CD1 3.7Å; L223-I227 WeakPolarHBondContact O-CG1 3.17Å; L223-I227 PolarHBondContact O-N 3.39Å; A224-I227 PolarHBondContact O-N 3.49Å; I227-Q229 VanDerWaalsContact C-N 3.33Å; I227-Q229 PolarHBondContact O-N 3.11Å; I227-S230 PolarHBondContact O-N 3.15Å; I227-F231 PolarHBondContact O-N 3.24Å |
| 228 | Y | 97.4 | Very high | 93.9 | Very high | 32 Ų | 32 | 30.9 Ų | 30.9 | 13% | 0.125 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -60.2 | -44.1 | 178.5 | -179.8 | -94.4 | 0 | 0 | 0 | 112 | A224 F225 S230 F231 V232 F277 F280 G281 W284 | A224-Y228 PolarHBondContact O-N 3.31Å; F225-Y228 PolarHBondContact O-N 2.84Å; Y228-S230 VanDerWaalsContact C-N 3.31Å; Y228-S230 PolarHBondContact O-N 3.41Å; Y228-F231 WeakPolarHBondContact O-CB 3.3Å; Y228-F231 PolarHBondContact O-N 3.43Å; Y228-F231 VanDerWaalsContact O-N 3.15Å; Y228-V232 HydrophobicContact CD1-CG2 4.06Å; Y228-V232 HydrophobicContact CE1-CG2 3.37Å; Y228-V232 HydrophobicContact CE2-CG2 4.27Å; Y228-V232 VanDerWaalsContact CZ-CG2 3.49Å; Y228-V232 PolarHBondContact O-N 3Å; Y228-F277 WeakPolarHBondContact OH-CA 3.45Å; Y228-F277 PolarHBondContact OH-O 3.48Å; Y228-F280 HydrophobicContact CD2-CD1 4.37Å; Y228-F280 HydrophobicContact CD2-CE1 4.15Å; Y228-F280 AromaticContact CE1-CD1 3.8Å; Y228-F280 HydrophobicContact CE1-CD1 3.8Å; Y228-F280 HydrophobicContact CE1-CE1 4.38Å; Y228-F280 AromaticContact CE2-CD1 3.62Å; Y228-F280 HydrophobicContact CE2-CD1 3.62Å; Y228-F280 AromaticContact CE2-CE1 3.76Å; Y228-F280 HydrophobicContact CE2-CE1 3.76Å; Y228-F280 AromaticContact CZ-CD1 3.3Å; Y228-F280 AromaticContact CZ-CE1 3.91Å; Y228-F280 VanDerWaalsContact OH-CD1 3.27Å; Y228-F280 WeakPolarHBondContact OH-CD1 3.36Å; Y228-G281 VanDerWaalsContact CE1-CA 3.47Å; Y228-W284 AromaticContact CD1-CE3 4Å; Y228-W284 HydrophobicContact CD1-CE3 4Å; Y228-W284 HydrophobicContact CD1-CZ3 4.35Å; Y228-W284 HydrophobicContact CD2-CE3 4.35Å; Y228-W284 AromaticContact CD2-CZ3 3.99Å; Y228-W284 HydrophobicContact CD2-CZ3 3.99Å; Y228-W284 AromaticContact CG-CE3 3.86Å; Y228-W284 HydrophobicContact CG-CE3 3.86Å; Y228-W284 AromaticContact CG-CZ3 3.74Å; Y228-W284 HydrophobicContact CG-CZ3 3.74Å |
| 229 | Q | 95.1 | Very high | 93.3 | Very high | 23 Ų | 23 | 32.4 Ų | 32.4 | 11% | 0.107 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -61.3 | -40.9 | 178.2 | -175.3 | 61.2 | 50.8 | 0 | 0 | 111.2 | F225 S226 I227 V232 Q233 | F225-Q229 HydrophobicContact CE1-CB 4.46Å; F225-Q229 VanDerWaalsContact O-CB 3.26Å; F225-Q229 WeakPolarHBondContact O-CB 3.26Å; F225-Q229 PolarHBondContact O-N 3.13Å; S226-Q229 PolarHBondContact O-N 2.97Å; I227-Q229 VanDerWaalsContact C-N 3.33Å; I227-Q229 PolarHBondContact O-N 3.11Å; Q229-V232 PolarHBondContact O-N 3.43Å; Q229-Q233 WeakPolarHBondContact O-CB 3.47Å; Q229-Q233 VanDerWaalsContact O-CG 3.31Å; Q229-Q233 WeakPolarHBondContact O-CG 3.46Å; Q229-Q233 PolarHBondContact O-N 2.92Å |
| 230 | S | 96 | Very high | 92.4 | Very high | 5 Ų | 5 | 36.2 Ų | 36.2 | 4% | 0.035 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -63.8 | -40.4 | 174 | -65.1 | 0 | 0 | 0 | 0 | 112.1 | T140 S226 I227 Y228 V232 Q233 F234 | T140-S230 WeakPolarHBondContact CG2-O 3.08Å; S226-S230 PolarHBondContact O-N 3.46Å; S226-S230 PolarHBondContact O-OG 3.45Å; I227-S230 PolarHBondContact O-N 3.15Å; Y228-S230 VanDerWaalsContact C-N 3.31Å; Y228-S230 PolarHBondContact O-N 3.41Å; S230-V232 PolarHBondContact O-N 3.33Å; S230-Q233 PolarHBondContact O-N 3.37Å; S230-F234 PolarHBondContact O-N 3.28Å |
| 231 | F | 94.8 | Very high | 91.5 | Very high | 85 Ų | 85 | 33.7 Ų | 33.7 | 37% | 0.373 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -60 | -45.5 | 173.6 | 171.9 | -101.6 | 0 | 0 | 0 | 112 | I227 Y228 Q233 F234 L235 F277 | I227-F231 PolarHBondContact O-N 3.24Å; Y228-F231 WeakPolarHBondContact O-CB 3.3Å; Y228-F231 PolarHBondContact O-N 3.43Å; Y228-F231 VanDerWaalsContact O-N 3.15Å; F231-Q233 PolarHBondContact O-N 2.95Å; F231-F234 WeakPolarHBondContact O-CB 3.41Å; F231-F234 PolarHBondContact O-N 3.25Å; F231-L235 HydrophobicContact CD1-CD1 4.31Å; F231-L235 HydrophobicContact CE1-CD1 3.62Å; F231-L235 HydrophobicContact CE1-CG 4.31Å; F231-L235 HydrophobicContact CE2-CG 4.5Å; F231-L235 HydrophobicContact CZ-CD1 3.76Å; F231-L235 HydrophobicContact CZ-CD2 4.36Å; F231-L235 HydrophobicContact CZ-CG 4.18Å; F231-L235 PolarHBondContact O-N 2.97Å; F231-L235 VanDerWaalsContact O-N 3.1Å; F231-F277 AromaticContact CE1-CD1 3.83Å; F231-F277 HydrophobicContact CE1-CD1 3.83Å; F231-F277 AromaticContact CE1-CE1 3.94Å; F231-F277 HydrophobicContact CE1-CE1 3.94Å; F231-F277 HydrophobicContact CZ-CE1 4.37Å |
| 232 | V | 94.3 | Very high | 90.3 | Very high | 4 Ų | 4 | 33.2 Ų | 33.2 | 2% | 0.024 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.5 | -40 | 176.4 | 175.8 | 0 | 0 | 0 | 0 | 111.7 | Y228 Q229 S230 F234 L235 Q236 F277 L278 | Y228-V232 HydrophobicContact CD1-CG2 4.06Å; Y228-V232 HydrophobicContact CE1-CG2 3.37Å; Y228-V232 HydrophobicContact CE2-CG2 4.27Å; Y228-V232 VanDerWaalsContact CZ-CG2 3.49Å; Y228-V232 PolarHBondContact O-N 3Å; Q229-V232 PolarHBondContact O-N 3.43Å; S230-V232 PolarHBondContact O-N 3.33Å; V232-F234 VanDerWaalsContact C-N 3.31Å; V232-F234 PolarHBondContact O-N 2.89Å; V232-L235 PolarHBondContact O-N 3.44Å; V232-Q236 HydrophobicContact CG1-CG 4.37Å; V232-Q236 WeakPolarHBondContact O-CB 3.44Å; V232-Q236 VanDerWaalsContact O-CG 3.32Å; V232-Q236 WeakPolarHBondContact O-CG 3.4Å; V232-Q236 PolarHBondContact O-N 3.1Å; V232-F277 HydrophobicContact CG2-CB 4.29Å; V232-L278 HydrophobicContact CG1-CD2 3.73Å |
| 233 | Q | 92.1 | Very high | 89.3 | Confident | 22 Ų | 22 | 33.8 Ų | 33.8 | 10% | 0.103 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -62.5 | -38 | 175.9 | -76.6 | 176.7 | 5.9 | 0 | 0 | 112 | T140 Y171 Q229 S230 F231 Q236 Y237 | T140-Q233 HydrophobicContact CG2-CB 3.8Å; T140-Q233 PolarHBondContact OG1-OE1 3.35Å; Y171-Q233 PolarHBondContact OH-NE2 3.15Å; Q229-Q233 WeakPolarHBondContact O-CB 3.47Å; Q229-Q233 VanDerWaalsContact O-CG 3.31Å; Q229-Q233 WeakPolarHBondContact O-CG 3.46Å; Q229-Q233 PolarHBondContact O-N 2.92Å; S230-Q233 PolarHBondContact O-N 3.37Å; F231-Q233 PolarHBondContact O-N 2.95Å; Q233-Q236 WeakPolarHBondContact O-CB 3.26Å; Q233-Q236 PolarHBondContact O-N 3.06Å; Q233-Y237 PolarHBondContact O-N 3.39Å |
| 234 | F | 91 | Very high | 88 | Confident | 61 Ų | 61 | 34.1 Ų | 34.1 | 27% | 0.268 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -60.2 | -49.6 | 172.5 | -179.4 | -91.8 | 0 | 0 | 0 | 111 | L137 T140 S230 F231 V232 Q236 Y237 Y238 | L137-F234 HydrophobicContact CD1-CD2 3.58Å; L137-F234 HydrophobicContact CD1-CE2 3.91Å; T140-F234 HydrophobicContact CG2-CB 4.46Å; S230-F234 PolarHBondContact O-N 3.28Å; F231-F234 WeakPolarHBondContact O-CB 3.41Å; F231-F234 PolarHBondContact O-N 3.25Å; V232-F234 VanDerWaalsContact C-N 3.31Å; V232-F234 PolarHBondContact O-N 2.89Å; F234-Q236 VanDerWaalsContact C-N 3.32Å; F234-Q236 PolarHBondContact O-N 2.84Å; F234-Y237 WeakPolarHBondContact O-CB 3.27Å; F234-Y237 PolarHBondContact O-N 3.2Å; F234-Y237 VanDerWaalsContact O-N 3.14Å; F234-Y238 HydrophobicContact CD1-CD2 4.07Å; F234-Y238 AromaticContact CD1-CE2 3.93Å; F234-Y238 HydrophobicContact CD1-CE2 3.93Å; F234-Y238 HydrophobicContact CD2-CE2 4.07Å; F234-Y238 AromaticContact CE1-CD2 3.85Å; F234-Y238 HydrophobicContact CE1-CD2 3.85Å; F234-Y238 AromaticContact CE1-CE2 3.37Å; F234-Y238 HydrophobicContact CE1-CE2 3.37Å; F234-Y238 AromaticContact CE2-CE2 3.55Å; F234-Y238 HydrophobicContact CE2-CE2 3.55Å; F234-Y238 HydrophobicContact CG-CD2 4.5Å; F234-Y238 HydrophobicContact CG-CE2 4.26Å; F234-Y238 HydrophobicContact CZ-CD2 4.11Å; F234-Y238 AromaticContact CZ-CE2 3.18Å; F234-Y238 HydrophobicContact CZ-CE2 3.18Å; F234-Y238 AromaticContact CZ-CZ 3.79Å; F234-Y238 WeakPolarHBondContact O-CD2 3.42Å; F234-Y238 PolarHBondContact O-N 3.46Å |
| 235 | L | 90.1 | Very high | 86.7 | Confident | 12 Ų | 12 | 39.3 Ų | 39.3 | 6% | 0.063 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -60.1 | -41.5 | 176 | -63.3 | -178.7 | 0 | 0 | 0 | 112.5 | F231 V232 Y237 Y238 Y239 W268 F273 L274 F277 | F231-L235 HydrophobicContact CD1-CD1 4.31Å; F231-L235 HydrophobicContact CE1-CD1 3.62Å; F231-L235 HydrophobicContact CE1-CG 4.31Å; F231-L235 HydrophobicContact CE2-CG 4.5Å; F231-L235 HydrophobicContact CZ-CD1 3.76Å; F231-L235 HydrophobicContact CZ-CD2 4.36Å; F231-L235 HydrophobicContact CZ-CG 4.18Å; F231-L235 PolarHBondContact O-N 2.97Å; F231-L235 VanDerWaalsContact O-N 3.1Å; V232-L235 PolarHBondContact O-N 3.44Å; L235-Y237 VanDerWaalsContact C-N 3.33Å; L235-Y237 PolarHBondContact O-N 3.48Å; L235-Y238 PolarHBondContact O-N 2.64Å; L235-Y239 PolarHBondContact O-N 3.44Å; L235-Y239 VanDerWaalsContact O-N 3.14Å; L235-W268 HydrophobicContact CD2-CH2 4.2Å; L235-W268 HydrophobicContact CD2-CZ3 3.99Å; L235-F273 HydrophobicContact CD1-CE1 4.42Å; L235-F273 HydrophobicContact CD2-CE1 4.32Å; L235-L274 HydrophobicContact CB-CD1 3.65Å; L235-L274 HydrophobicContact CD1-CD1 4.47Å; L235-F277 HydrophobicContact CD1-CB 4.32Å; L235-F277 HydrophobicContact CD1-CD1 4.2Å; L235-F277 HydrophobicContact CD1-CD2 3.87Å; L235-F277 HydrophobicContact CD1-CE1 4.5Å; L235-F277 HydrophobicContact CD1-CE2 4.2Å; L235-F277 HydrophobicContact CD1-CG 3.87Å |
| 236 | Q | 87.5 | Confident | 85.4 | Confident | 48 Ų | 48 | 43.1 Ų | 43.1 | 22% | 0.224 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.1 | -41.5 | 175.1 | -75.6 | 174.6 | -37.5 | 0 | 0 | 111.8 | V232 Q233 F234 Y239 Q240 L274 L278 | V232-Q236 HydrophobicContact CG1-CG 4.37Å; V232-Q236 WeakPolarHBondContact O-CB 3.44Å; V232-Q236 VanDerWaalsContact O-CG 3.32Å; V232-Q236 WeakPolarHBondContact O-CG 3.4Å; V232-Q236 PolarHBondContact O-N 3.1Å; Q233-Q236 WeakPolarHBondContact O-CB 3.26Å; Q233-Q236 PolarHBondContact O-N 3.06Å; F234-Q236 VanDerWaalsContact C-N 3.32Å; F234-Q236 PolarHBondContact O-N 2.84Å; Q236-Y239 PolarHBondContact O-N 3.49Å; Q236-Q240 WeakPolarHBondContact O-CB 3.47Å; Q236-Q240 VanDerWaalsContact O-CG 3.27Å; Q236-Q240 WeakPolarHBondContact O-CG 3.39Å; Q236-Q240 PolarHBondContact O-N 3.36Å; Q236-L274 HydrophobicContact CG-CD1 4.21Å; Q236-L274 HydrophobicContact CG-CD2 3.97Å; Q236-L278 HydrophobicContact CG-CD2 4.33Å; Q236-L278 VanDerWaalsContact NE2-CD2 3.29Å |
| 237 | Y | 86.1 | Confident | 84 | Confident | 42 Ų | 42 | 47.4 Ų | 47.4 | 17% | 0.165 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -59.7 | -47 | 177.7 | 167.2 | -92.5 | 0 | 0 | 0 | 111.9 | E133 L137 Q233 F234 L235 Y239 Q240 S241 | E133-Y237 VanDerWaalsContact C-CE2 3.47Å; E133-Y237 HydrophobicContact CB-CD2 4.07Å; E133-Y237 HydrophobicContact CB-CE2 3.77Å; E133-Y237 VanDerWaalsContact O-CD2 3.32Å; E133-Y237 WeakPolarHBondContact O-CD2 3.47Å; E133-Y237 VanDerWaalsContact O-CE2 3.22Å; E133-Y237 WeakPolarHBondContact O-CE2 3.31Å; L137-Y237 HydrophobicContact CB-CD1 4.32Å; L137-Y237 HydrophobicContact CB-CD2 3.93Å; L137-Y237 HydrophobicContact CB-CE1 4.32Å; L137-Y237 HydrophobicContact CB-CE2 3.9Å; L137-Y237 HydrophobicContact CB-CG 4.13Å; L137-Y237 HydrophobicContact CD1-CD1 3.86Å; L137-Y237 HydrophobicContact CD1-CE1 4.22Å; L137-Y237 HydrophobicContact CD1-CG 4.19Å; L137-Y237 HydrophobicContact CD2-CD1 4.16Å; L137-Y237 HydrophobicContact CD2-CE1 3.64Å; L137-Y237 HydrophobicContact CD2-CE2 4.45Å; L137-Y237 HydrophobicContact CG-CD1 4.33Å; L137-Y237 HydrophobicContact CG-CE1 4.27Å; Q233-Y237 PolarHBondContact O-N 3.39Å; F234-Y237 WeakPolarHBondContact O-CB 3.27Å; F234-Y237 PolarHBondContact O-N 3.2Å; F234-Y237 VanDerWaalsContact O-N 3.14Å; L235-Y237 VanDerWaalsContact C-N 3.33Å; L235-Y237 PolarHBondContact O-N 3.48Å; Y237-Y239 VanDerWaalsContact C-N 3.33Å; Y237-Y239 PolarHBondContact O-N 3.13Å; Y237-Q240 PolarHBondContact O-N 2.95Å; Y237-S241 WeakPolarHBondContact CE2-OG 3.21Å; Y237-S241 VanDerWaalsContact CZ-OG 3.28Å; Y237-S241 VanDerWaalsContact O-CB 3.27Å; Y237-S241 WeakPolarHBondContact O-CB 3.31Å; Y237-S241 PolarHBondContact O-N 3.48Å; Y237-S241 PolarHBondContact O-OG 3.44Å |
| 238 | Y | 82.2 | Confident | 82.6 | Confident | 91 Ų | 91 | 49.8 Ų | 49.8 | 36% | 0.357 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.3 | -41.9 | 178.2 | -81.7 | -90.9 | 0 | 0 | 0 | 111.8 | F234 L235 Q240 S241 G242 W268 | F234-Y238 HydrophobicContact CD1-CD2 4.07Å; F234-Y238 AromaticContact CD1-CE2 3.93Å; F234-Y238 HydrophobicContact CD1-CE2 3.93Å; F234-Y238 HydrophobicContact CD2-CE2 4.07Å; F234-Y238 AromaticContact CE1-CD2 3.85Å; F234-Y238 HydrophobicContact CE1-CD2 3.85Å; F234-Y238 AromaticContact CE1-CE2 3.37Å; F234-Y238 HydrophobicContact CE1-CE2 3.37Å; F234-Y238 AromaticContact CE2-CE2 3.55Å; F234-Y238 HydrophobicContact CE2-CE2 3.55Å; F234-Y238 HydrophobicContact CG-CD2 4.5Å; F234-Y238 HydrophobicContact CG-CE2 4.26Å; F234-Y238 HydrophobicContact CZ-CD2 4.11Å; F234-Y238 AromaticContact CZ-CE2 3.18Å; F234-Y238 HydrophobicContact CZ-CE2 3.18Å; F234-Y238 AromaticContact CZ-CZ 3.79Å; F234-Y238 WeakPolarHBondContact O-CD2 3.42Å; F234-Y238 PolarHBondContact O-N 3.46Å; L235-Y238 PolarHBondContact O-N 2.64Å; Y238-Q240 PolarHBondContact O-N 3.45Å; Y238-S241 PolarHBondContact O-N 3.27Å; Y238-G242 PolarHBondContact O-N 3.48Å; Y238-W268 HydrophobicContact CD1-CD2 4.41Å; Y238-W268 HydrophobicContact CD1-CE3 4.28Å; Y238-W268 HydrophobicContact CD1-CH2 4.43Å; Y238-W268 HydrophobicContact CD1-CZ3 4.29Å; Y238-W268 HydrophobicContact CD2-CH2 4.27Å; Y238-W268 HydrophobicContact CD2-CZ3 4.06Å; Y238-W268 HydrophobicContact CG-CD2 4.44Å; Y238-W268 AromaticContact CG-CE3 3.86Å; Y238-W268 HydrophobicContact CG-CE3 3.86Å; Y238-W268 HydrophobicContact CG-CH2 4.06Å; Y238-W268 AromaticContact CG-CZ3 3.65Å; Y238-W268 HydrophobicContact CG-CZ3 3.65Å |
| 239 | Y | 82.5 | Confident | 80.9 | Confident | 33 Ų | 33 | 50.6 Ų | 50.6 | 13% | 0.129 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.9 | -46 | 174.8 | 173.5 | -96.2 | 0 | 0 | 0 | 112 | L235 Q236 Y237 G242 C243 L271 L274 | L235-Y239 PolarHBondContact O-N 3.44Å; L235-Y239 VanDerWaalsContact O-N 3.14Å; Q236-Y239 PolarHBondContact O-N 3.49Å; Y237-Y239 VanDerWaalsContact C-N 3.33Å; Y237-Y239 PolarHBondContact O-N 3.13Å; Y239-G242 PolarHBondContact O-N 2.99Å; Y239-C243 PolarHBondContact O-N 2.93Å; Y239-C243 PolarHBondContact O-SG 3.28Å; Y239-L271 HydrophobicContact CE1-CD1 4.28Å; Y239-L271 HydrophobicContact CE2-CB 4.07Å; Y239-L271 HydrophobicContact CE2-CD1 4.42Å; Y239-L274 HydrophobicContact CD1-CD2 4.38Å; Y239-L274 HydrophobicContact CG-CD2 4.31Å |
| 240 | Q | 76.1 | Confident | 79.5 | Confident | 83 Ų | 83 | 56.4 Ų | 56.4 | 39% | 0.388 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -68.3 | -42.1 | 179.6 | -69.1 | -64.5 | -15.7 | 0 | 0 | 112.2 | Q236 Y237 Y238 G242 C243 L244 | Q236-Q240 WeakPolarHBondContact O-CB 3.47Å; Q236-Q240 VanDerWaalsContact O-CG 3.27Å; Q236-Q240 WeakPolarHBondContact O-CG 3.39Å; Q236-Q240 PolarHBondContact O-N 3.36Å; Y237-Q240 PolarHBondContact O-N 2.95Å; Y238-Q240 PolarHBondContact O-N 3.45Å; Q240-G242 VanDerWaalsContact C-N 3.33Å; Q240-G242 PolarHBondContact O-N 3.11Å; Q240-C243 WeakPolarHBondContact O-CB 3.43Å; Q240-C243 PolarHBondContact O-N 3.41Å; Q240-C243 VanDerWaalsContact O-N 3.1Å; Q240-L244 WeakPolarHBondContact O-CB 3.23Å; Q240-L244 PolarHBondContact O-N 2.78Å |
| 241 | S | 75.6 | Confident | 77.9 | Confident | 33 Ų | 33 | 59.4 Ų | 59.4 | 23% | 0.231 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -61 | -42.9 | 176 | -62.3 | 0 | 0 | 0 | 0 | 111.1 | Y237 Y238 C243 L244 Y245 | Y237-S241 WeakPolarHBondContact CE2-OG 3.21Å; Y237-S241 VanDerWaalsContact CZ-OG 3.28Å; Y237-S241 VanDerWaalsContact O-CB 3.27Å; Y237-S241 WeakPolarHBondContact O-CB 3.31Å; Y237-S241 PolarHBondContact O-N 3.48Å; Y237-S241 PolarHBondContact O-OG 3.44Å; Y238-S241 PolarHBondContact O-N 3.27Å; S241-C243 VanDerWaalsContact C-N 3.32Å; S241-C243 PolarHBondContact O-N 3.1Å; S241-L244 PolarHBondContact O-N 2.87Å; S241-Y245 WeakPolarHBondContact O-CB 3.13Å; S241-Y245 PolarHBondContact O-N 3.31Å |
| 242 | G | 73.8 | Confident | 75.9 | Confident | 22 Ų | 22 | 62.5 Ų | 62.5 | 23% | 0.227 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.4 | -36.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113 | Y238 Y239 Q240 R246 | Y238-G242 PolarHBondContact O-N 3.48Å; Y239-G242 PolarHBondContact O-N 2.99Å; Q240-G242 VanDerWaalsContact C-N 3.33Å; Q240-G242 PolarHBondContact O-N 3.11Å; G242-R246 WeakPolarHBondContact O-CG 3.45Å; G242-R246 PolarHBondContact O-N 3Å; G242-R246 PolarHBondContact O-NH1 3.3Å |
| 243 | C | 74.7 | Confident | 73.3 | Confident | 21 Ų | 21 | 72.4 Ų | 72.4 | 14% | 0.142 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -68.4 | -42.8 | 173.7 | -65.2 | 0 | 0 | 0 | 0 | 112.4 | Y239 Q240 S241 R246 L247 | Y239-C243 PolarHBondContact O-N 2.93Å; Y239-C243 PolarHBondContact O-SG 3.28Å; Q240-C243 WeakPolarHBondContact O-CB 3.43Å; Q240-C243 PolarHBondContact O-N 3.41Å; Q240-C243 VanDerWaalsContact O-N 3.1Å; S241-C243 VanDerWaalsContact C-N 3.32Å; S241-C243 PolarHBondContact O-N 3.1Å; C243-R246 PolarHBondContact O-N 3.34Å; C243-R246 PolarHBondContact SG-NH2 2.91Å; C243-L247 PolarHBondContact O-N 3.2Å; C243-L247 VanDerWaalsContact O-N 3.09Å |
| 244 | L | 69.4 | Low | 71 | Confident | 10 Ų | 10 | 78.8 Ų | 78.8 | 5% | 0.052 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -64.9 | -41.9 | 179.9 | -173.7 | 64 | 0 | 0 | 0 | 111.5 | F126 K129 Q240 S241 R246 L247 R248 | F126-L244 HydrophobicContact CD1-CD1 4.27Å; K129-L244 HydrophobicContact CD-CD1 3.89Å; K129-L244 HydrophobicContact CG-CD1 4.34Å; K129-L244 HydrophobicContact CG-CD2 4.31Å; Q240-L244 WeakPolarHBondContact O-CB 3.23Å; Q240-L244 PolarHBondContact O-N 2.78Å; S241-L244 PolarHBondContact O-N 2.87Å; L244-R246 VanDerWaalsContact C-N 3.33Å; L244-R246 PolarHBondContact O-N 3.45Å; L244-L247 PolarHBondContact O-N 3.26Å; L244-R248 PolarHBondContact O-N 3.29Å |
| 245 | Y | 69.5 | Low | 68.4 | Low | 140 Ų | 140 | 85.1 Ų | 85.1 | 55% | 0.549 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -57.5 | -44.6 | 174.3 | 179.9 | -96.4 | 0 | 0 | 0 | 111.8 | S241 L247 R248 A249 | S241-Y245 WeakPolarHBondContact O-CB 3.13Å; S241-Y245 PolarHBondContact O-N 3.31Å; Y245-L247 PolarHBondContact O-N 3.16Å; Y245-R248 PolarHBondContact O-N 3.05Å; Y245-A249 PolarHBondContact O-N 3.46Å |
| 246 | R | 70.4 | Confident | 66.1 | Low | 93 Ų | 93 | 92 Ų | 92 | 35% | 0.351 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.7 | -42.5 | 176.2 | -70.2 | -168.9 | -53.6 | -85.6 | 5.9 | 112.4 | G242 C243 L244 R248 A249 L250 | G242-R246 WeakPolarHBondContact O-CG 3.45Å; G242-R246 PolarHBondContact O-N 3Å; G242-R246 PolarHBondContact O-NH1 3.3Å; C243-R246 PolarHBondContact O-N 3.34Å; C243-R246 PolarHBondContact SG-NH2 2.91Å; L244-R246 VanDerWaalsContact C-N 3.33Å; L244-R246 PolarHBondContact O-N 3.45Å; R246-R248 VanDerWaalsContact C-N 3.29Å; R246-R248 PolarHBondContact O-N 3.18Å; R246-A249 PolarHBondContact O-N 2.81Å; R246-L250 WeakPolarHBondContact O-CB 3.22Å; R246-L250 WeakPolarHBondContact O-CG 3.32Å; R246-L250 PolarHBondContact O-N 2.94Å |
| 247 | L | 67.1 | Low | 63.8 | Low | 101 Ų | 101 | 96.7 Ų | 96.7 | 53% | 0.529 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.6 | -37.5 | 176.3 | -73.1 | 170.6 | 0 | 0 | 0 | 111.9 | C243 L244 Y245 G251 | C243-L247 PolarHBondContact O-N 3.2Å; C243-L247 VanDerWaalsContact O-N 3.09Å; L244-L247 PolarHBondContact O-N 3.26Å; Y245-L247 PolarHBondContact O-N 3.16Å; L247-G251 PolarHBondContact O-N 3.14Å |
| 248 | R | 67.9 | Low | 61.7 | Low | 84 Ų | 84 | 99.8 Ų | 99.8 | 32% | 0.317 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.2 | -47.9 | 175.2 | -169.1 | 179.6 | -65.9 | 161.1 | 2.6 | 111.2 | D130 L244 Y245 R246 L250 G251 E252 | D130-R248 IonicContact OD1-NH2 3.33Å; D130-R248 PolarHBondContact OD1-NH2 3.17Å; D130-R248 VanDerWaalsContact OD1-NH2 3.13Å; L244-R248 PolarHBondContact O-N 3.29Å; Y245-R248 PolarHBondContact O-N 3.05Å; R246-R248 VanDerWaalsContact C-N 3.29Å; R246-R248 PolarHBondContact O-N 3.18Å; R248-L250 PolarHBondContact O-N 3.12Å; R248-G251 PolarHBondContact O-N 3.34Å; R248-G251 VanDerWaalsContact O-N 3.13Å; R248-E252 PolarHBondContact O-N 2.89Å |
| 249 | A | 63.2 | Low | 59.8 | Low | 49 Ų | 49 | 101 Ų | 101 | 41% | 0.405 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.9 | -44.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y245 R246 G251 E252 R253 | Y245-A249 PolarHBondContact O-N 3.46Å; R246-A249 PolarHBondContact O-N 2.81Å; A249-G251 VanDerWaalsContact C-N 3.27Å; A249-G251 PolarHBondContact O-N 3.3Å; A249-E252 PolarHBondContact O-N 2.98Å; A249-R253 PolarHBondContact O-N 3.46Å; A249-R253 VanDerWaalsContact O-N 3.1Å |
| 250 | L | 64.3 | Low | 57.8 | Low | 145 Ų | 145 | 102.7 Ų | 102.7 | 76% | 0.759 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -66.4 | -27.5 | 175.8 | -70.9 | 169.1 | 0 | 0 | 0 | 113 | R246 R248 | R246-L250 WeakPolarHBondContact O-CB 3.22Å; R246-L250 WeakPolarHBondContact O-CG 3.32Å; R246-L250 PolarHBondContact O-N 2.94Å; R248-L250 PolarHBondContact O-N 3.12Å |
| 251 | G | 62.3 | Low | 56.3 | Low | 68 Ų | 68 | 107.6 Ų | 107.6 | 70% | 0.701 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -82.5 | -21.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | L247 R248 A249 | L247-G251 PolarHBondContact O-N 3.14Å; R248-G251 PolarHBondContact O-N 3.34Å; R248-G251 VanDerWaalsContact O-N 3.13Å; A249-G251 VanDerWaalsContact C-N 3.27Å; A249-G251 PolarHBondContact O-N 3.3Å |
| 252 | E | 53.6 | Low | 55.4 | Low | 150 Ų | 150 | 108.2 Ų | 108.2 | 70% | 0.701 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -108.3 | -17.8 | -175.1 | -76.2 | -173.3 | 168.2 | 0 | 0 | 115.3 | R248 A249 | R248-E252 PolarHBondContact O-N 2.89Å; A249-E252 PolarHBondContact O-N 2.98Å |
| 253 | R | 40.6 | Very low | 54.3 | Low | 213 Ų | 213 | 113.4 Ų | 113.4 | 80% | 0.804 | 58% | 0.584 | S | S | * | * | trans | -163.8 | 148 | 175.2 | -108.8 | 156.9 | -167.7 | 178.8 | 3.8 | 114.9 | A249 Q255 | A249-R253 PolarHBondContact O-N 3.46Å; A249-R253 VanDerWaalsContact O-N 3.1Å; R253-Q255 PolarHBondContact O-N 3.11Å | ||
| 254 | N | 42.3 | Very low | 53.3 | Low | 156 Ų | 156 | 118.6 Ų | 118.6 | 83% | 0.834 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -48 | 133.2 | 160.9 | -74.9 | -32.6 | 0 | 0 | 0 | 110.5 | L256 | N254-L256 PolarHBondContact O-N 3.4Š|
| 255 | Q | 36.5 | Very low | 52.8 | Low | 194 Ų | 194 | 119 Ų | 119 | 91% | 0.907 | 61% | 0.609 | S | S | * | * | trans | 10.7 | 93.8 | 162.8 | -72.1 | 175.4 | -34.1 | 0 | 0 | 115.7 | R253 | R253-Q255 PolarHBondContact O-N 3.11Š| ||
| 256 | L | 42.1 | Very low | 52.4 | Low | 157 Ų | 157 | 118.3 Ų | 118.3 | 82% | 0.822 | 61% | 0.606 | S | S | * | * | trans | -124.6 | 94.8 | 152.2 | -114.4 | 154.7 | 0 | 0 | 0 | 106.8 | N254 L258 | N254-L256 PolarHBondContact O-N 3.4Å; L256-L258 PolarHBondContact O-N 2.94Å | ||
| 257 | D | 39.7 | Very low | 51.8 | Low | 146 Ų | 146 | 115.5 Ų | 115.5 | 78% | 0.781 | 60% | 0.597 | S | S | * | * | trans | -61.6 | 110.3 | 176.2 | -113.9 | -27.3 | 0 | 0 | 0 | 109.2 | T259 | D257-T259 PolarHBondContact O-N 3.28Š| ||
| 258 | L | 41.6 | Very low | 51.4 | Low | 107 Ų | 107 | 113.9 Ų | 113.9 | 56% | 0.56 | 58% | 0.584 | S | S | * | * | trans | -88.1 | 89.8 | 161.4 | -87.7 | 156.8 | 0 | 0 | 0 | 107.5 | L256 V260 R269 | L256-L258 PolarHBondContact O-N 2.94Å; L258-V260 PolarHBondContact O-N 2.94Å; L258-R269 PolarHBondContact O-NH2 3.3Å | ||
| 259 | T | 41.7 | Very low | 51 | Low | 117 Ų | 117 | 115 Ų | 115 | 72% | 0.718 | 59% | 0.588 | S | S | * | * | trans | -61.5 | 72.7 | 167.5 | 53.6 | 0 | 0 | 0 | 0 | 110.1 | D257 | D257-T259 PolarHBondContact O-N 3.28Š| ||
| 260 | V | 42.4 | Very low | 51.2 | Low | 68 Ų | 68 | 113.4 Ų | 113.4 | 41% | 0.412 | 58% | 0.577 | S | S | . | * | trans | -95.6 | 87.9 | 152.9 | -173.1 | 0 | 0 | 0 | 0 | 104.3 | L258 S265 R269 | L258-V260 PolarHBondContact O-N 2.94Å; V260-S265 WeakPolarHBondContact O-CB 3.41Å; V260-S265 PolarHBondContact O-OG 2.93Å; V260-R269 PolarHBondContact O-NH1 3.41Å | ||
| 261 | E | 43.3 | Very low | 51.7 | Low | 185 Ų | 185 | 107.5 Ų | 107.5 | 86% | 0.864 | 55% | 0.546 | S | S | * | . | trans | -91 | 129.3 | 163.5 | -70.4 | -166.8 | 154.8 | 0 | 0 | 107.6 | ||||
| 262 | G | 56.5 | Low | 52.6 | Low | 46 Ų | 46 | 108.5 Ų | 108.5 | 47% | 0.474 | 54% | 0.539 | S | S | . | . | S | Bend | trans | 155.1 | 178 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q264 S265 W266 | G262-Q264 VanDerWaalsContact C-N 3.31Å; G262-Q264 PolarHBondContact O-N 2.89Å; G262-S265 WeakPolarHBondContact O-CA 3.44Å; G262-S265 VanDerWaalsContact O-CB 3.26Å; G262-S265 WeakPolarHBondContact O-CB 3.39Å; G262-S265 PolarHBondContact O-N 3.39Å; G262-W266 PolarHBondContact O-N 3.41Å |
| 263 | F | 51.7 | Low | 54.1 | Low | 131 Ų | 131 | 102.8 Ų | 102.8 | 58% | 0.575 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -57.3 | -39.8 | -179.4 | -178.6 | -100.3 | 0 | 0 | 0 | 112.8 | S265 W266 M267 | F263-S265 VanDerWaalsContact C-N 3.31Å; F263-S265 PolarHBondContact O-N 2.91Å; F263-W266 AromaticContact CD2-CE3 3.8Å; F263-W266 HydrophobicContact CD2-CE3 3.8Å; F263-W266 AromaticContact CD2-CZ3 3.95Å; F263-W266 HydrophobicContact CD2-CZ3 3.95Å; F263-W266 AromaticContact CE2-CE3 3.77Å; F263-W266 HydrophobicContact CE2-CE3 3.77Å; F263-W266 AromaticContact CE2-CZ3 3.44Å; F263-W266 HydrophobicContact CE2-CZ3 3.44Å; F263-W266 VanDerWaalsContact CE2-CZ3 3.44Å; F263-W266 HydrophobicContact CZ-CZ3 4.16Å; F263-W266 PolarHBondContact O-N 3.41Å; F263-M267 HydrophobicContact CD1-CE 4.21Å; F263-M267 HydrophobicContact CD1-SD 4.34Å; F263-M267 HydrophobicContact CE1-CB 4.48Å; F263-M267 HydrophobicContact CE1-CE 3.94Å; F263-M267 HydrophobicContact CE1-SD 3.59Å; F263-M267 VanDerWaalsContact CE1-SD 3.59Å; F263-M267 HydrophobicContact CZ-SD 4.14Å; F263-M267 WeakPolarHBondContact O-CB 3.48Å; F263-M267 PolarHBondContact O-N 3.42Å |
| 264 | Q | 53.5 | Low | 56.3 | Low | 131 Ų | 131 | 93 Ų | 93 | 61% | 0.612 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -63.1 | -37.8 | 175 | -73.5 | -173.8 | -23.7 | 0 | 0 | 112.2 | G262 W268 | G262-Q264 VanDerWaalsContact C-N 3.31Å; G262-Q264 PolarHBondContact O-N 2.89Å; Q264-W268 VanDerWaalsContact O-CB 3.28Å; Q264-W268 WeakPolarHBondContact O-CB 3.35Å; Q264-W268 VanDerWaalsContact O-CG 3.29Å; Q264-W268 PolarHBondContact O-N 2.79Å |
| 265 | S | 59.4 | Low | 58.6 | Low | 17 Ų | 17 | 86.8 Ų | 86.8 | 12% | 0.119 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -67.2 | -46 | 174.9 | -164.1 | 0 | 0 | 0 | 0 | 111.2 | V260 G262 F263 R269 | V260-S265 WeakPolarHBondContact O-CB 3.41Å; V260-S265 PolarHBondContact O-OG 2.93Å; G262-S265 WeakPolarHBondContact O-CA 3.44Å; G262-S265 VanDerWaalsContact O-CB 3.26Å; G262-S265 WeakPolarHBondContact O-CB 3.39Å; G262-S265 PolarHBondContact O-N 3.39Å; F263-S265 VanDerWaalsContact C-N 3.31Å; F263-S265 PolarHBondContact O-N 2.91Å; S265-R269 VanDerWaalsContact O-CA 3.3Å; S265-R269 WeakPolarHBondContact O-CA 3.49Å; S265-R269 WeakPolarHBondContact O-CB 3.2Å; S265-R269 WeakPolarHBondContact O-CG 3.38Å; S265-R269 PolarHBondContact O-N 3.21Å; S265-R269 WeakPolarHBondContact OG-CD 3.43Å; S265-R269 PolarHBondContact OG-NE 3Å; S265-R269 PolarHBondContact OG-NH1 3.4Å |
| 266 | W | 59.7 | Low | 61.3 | Low | 126 Ų | 126 | 81.5 Ų | 81.5 | 48% | 0.477 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.7 | -42.5 | 175.9 | 172.3 | 83.2 | 0 | 0 | 0 | 112.8 | G262 F263 G270 F273 | G262-W266 PolarHBondContact O-N 3.41Å; F263-W266 AromaticContact CD2-CE3 3.8Å; F263-W266 HydrophobicContact CD2-CE3 3.8Å; F263-W266 AromaticContact CD2-CZ3 3.95Å; F263-W266 HydrophobicContact CD2-CZ3 3.95Å; F263-W266 AromaticContact CE2-CE3 3.77Å; F263-W266 HydrophobicContact CE2-CE3 3.77Å; F263-W266 AromaticContact CE2-CZ3 3.44Å; F263-W266 HydrophobicContact CE2-CZ3 3.44Å; F263-W266 VanDerWaalsContact CE2-CZ3 3.44Å; F263-W266 HydrophobicContact CZ-CZ3 4.16Å; F263-W266 PolarHBondContact O-N 3.41Å; W266-G270 WeakPolarHBondContact O-CA 3.29Å; W266-G270 PolarHBondContact O-N 2.87Å; W266-F273 HydrophobicContact CD2-CB 4.4Å; W266-F273 HydrophobicContact CE3-CB 4.29Å; W266-F273 HydrophobicContact CE3-CD2 4.09Å; W266-F273 HydrophobicContact CE3-CG 4.49Å; W266-F273 HydrophobicContact CH2-CB 4.06Å; W266-F273 AromaticContact CH2-CD2 3.57Å; W266-F273 HydrophobicContact CH2-CD2 3.57Å; W266-F273 HydrophobicContact CH2-CG 4.29Å; W266-F273 HydrophobicContact CZ2-CB 4.13Å; W266-F273 HydrophobicContact CZ2-CD2 4.46Å; W266-F273 HydrophobicContact CZ3-CB 4.13Å; W266-F273 AromaticContact CZ3-CD2 3.34Å; W266-F273 HydrophobicContact CZ3-CD2 3.34Å; W266-F273 HydrophobicContact CZ3-CE2 4.12Å; W266-F273 HydrophobicContact CZ3-CG 4.1Å |
| 267 | M | 59.2 | Low | 63.8 | Low | 34 Ų | 34 | 76.9 Ų | 76.9 | 17% | 0.167 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64.6 | -45.1 | 178.9 | 179.8 | 162.7 | 67.3 | 0 | 0 | 111.9 | F263 F273 | F263-M267 HydrophobicContact CD1-CE 4.21Å; F263-M267 HydrophobicContact CD1-SD 4.34Å; F263-M267 HydrophobicContact CE1-CB 4.48Å; F263-M267 HydrophobicContact CE1-CE 3.94Å; F263-M267 HydrophobicContact CE1-SD 3.59Å; F263-M267 VanDerWaalsContact CE1-SD 3.59Å; F263-M267 HydrophobicContact CZ-SD 4.14Å; F263-M267 WeakPolarHBondContact O-CB 3.48Å; F263-M267 PolarHBondContact O-N 3.42Å; M267-F273 HydrophobicContact CB-CD1 4.35Å; M267-F273 HydrophobicContact CB-CG 4.35Å; M267-F273 HydrophobicContact CG-CD1 3.74Å; M267-F273 HydrophobicContact CG-CD2 4.26Å; M267-F273 HydrophobicContact CG-CE1 3.48Å; M267-F273 VanDerWaalsContact CG-CE1 3.48Å; M267-F273 HydrophobicContact CG-CE2 3.99Å; M267-F273 HydrophobicContact CG-CG 4.13Å; M267-F273 HydrophobicContact CG-CZ 3.6Å; M267-F273 VanDerWaalsContact O-CD1 3.3Å; M267-F273 WeakPolarHBondContact O-CD1 3.37Å; M267-F273 HydrophobicContact SD-CE1 4.23Å; M267-F273 HydrophobicContact SD-CE2 4.21Å; M267-F273 HydrophobicContact SD-CZ 3.8Å |
| 268 | W | 57.8 | Low | 66.3 | Low | 67 Ų | 67 | 70.4 Ų | 70.4 | 25% | 0.254 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -97.1 | -14 | -173.8 | -54.1 | 129.2 | 0 | 0 | 0 | 114.4 | L235 Y238 Q264 | L235-W268 HydrophobicContact CD2-CH2 4.2Å; L235-W268 HydrophobicContact CD2-CZ3 3.99Å; Y238-W268 HydrophobicContact CD1-CD2 4.41Å; Y238-W268 HydrophobicContact CD1-CE3 4.28Å; Y238-W268 HydrophobicContact CD1-CH2 4.43Å; Y238-W268 HydrophobicContact CD1-CZ3 4.29Å; Y238-W268 HydrophobicContact CD2-CH2 4.27Å; Y238-W268 HydrophobicContact CD2-CZ3 4.06Å; Y238-W268 HydrophobicContact CG-CD2 4.44Å; Y238-W268 AromaticContact CG-CE3 3.86Å; Y238-W268 HydrophobicContact CG-CE3 3.86Å; Y238-W268 HydrophobicContact CG-CH2 4.06Å; Y238-W268 AromaticContact CG-CZ3 3.65Å; Y238-W268 HydrophobicContact CG-CZ3 3.65Å; Q264-W268 VanDerWaalsContact O-CB 3.28Å; Q264-W268 WeakPolarHBondContact O-CB 3.35Å; Q264-W268 VanDerWaalsContact O-CG 3.29Å; Q264-W268 PolarHBondContact O-N 2.79Å |
| 269 | R | 60.5 | Low | 68.9 | Low | 107 Ų | 107 | 67.4 Ų | 67.4 | 40% | 0.404 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -110.7 | -22 | 176.2 | -49.3 | -178.8 | -178.2 | 173.9 | -9.4 | 113.1 | L258 V260 S265 | L258-R269 PolarHBondContact O-NH2 3.3Å; V260-R269 PolarHBondContact O-NH1 3.41Å; S265-R269 VanDerWaalsContact O-CA 3.3Å; S265-R269 WeakPolarHBondContact O-CA 3.49Å; S265-R269 WeakPolarHBondContact O-CB 3.2Å; S265-R269 WeakPolarHBondContact O-CG 3.38Å; S265-R269 PolarHBondContact O-N 3.21Å; S265-R269 WeakPolarHBondContact OG-CD 3.43Å; S265-R269 PolarHBondContact OG-NE 3Å; S265-R269 PolarHBondContact OG-NH1 3.4Å |
| 270 | G | 66.6 | Low | 71.5 | Confident | 17 Ų | 17 | 67.2 Ų | 67.2 | 18% | 0.175 | 34% | 0.335 | C | S | . | . | trans | -90.6 | 114.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | W266 T272 F273 | W266-G270 WeakPolarHBondContact O-CA 3.29Å; W266-G270 PolarHBondContact O-N 2.87Å; G270-T272 PolarHBondContact O-N 3.24Å; G270-T272 VanDerWaalsContact O-N 3.14Å; G270-F273 PolarHBondContact O-N 2.82Å | ||
| 271 | L | 74.9 | Confident | 74.1 | Confident | 21 Ų | 21 | 64.1 Ų | 64.1 | 11% | 0.11 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -56.2 | -31.1 | 170.2 | -176.8 | 65.5 | 0 | 0 | 0 | 111.7 | Y239 F273 L274 L275 V327 K331 | Y239-L271 HydrophobicContact CE1-CD1 4.28Å; Y239-L271 HydrophobicContact CE2-CB 4.07Å; Y239-L271 HydrophobicContact CE2-CD1 4.42Å; L271-F273 VanDerWaalsContact C-N 3.29Å; L271-F273 PolarHBondContact O-N 3.49Å; L271-L274 HydrophobicContact CD1-CD2 4.36Å; L271-L274 WeakPolarHBondContact O-CB 3.22Å; L271-L274 PolarHBondContact O-N 3.48Å; L271-L274 VanDerWaalsContact O-N 3.08Å; L271-L275 HydrophobicContact CG-CD2 4.48Å; L271-L275 HydrophobicContact CG-CG 4.42Å; L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 2.92Å; L271-L275 VanDerWaalsContact O-N 3.16Å; L271-V327 HydrophobicContact CD2-CG1 3.63Å; L271-K331 VanDerWaalsContact CB-NZ 3.34Å; L271-K331 HydrophobicContact CD2-CD 3.78Å; L271-K331 VanDerWaalsContact CD2-CE 3.47Å |
| 272 | T | 81.1 | Confident | 76.6 | Confident | 88 Ų | 88 | 55.8 Ų | 55.8 | 54% | 0.54 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -59.9 | -35.8 | -179.7 | -46.8 | 0 | 0 | 0 | 0 | 112.9 | G270 L274 L275 P276 | G270-T272 PolarHBondContact O-N 3.24Å; G270-T272 VanDerWaalsContact O-N 3.14Å; T272-L274 VanDerWaalsContact C-N 3.3Å; T272-L274 PolarHBondContact O-N 2.97Å; T272-L275 PolarHBondContact O-N 3.39Å; T272-P276 VanDerWaalsContact O-CD 3.23Å; T272-P276 WeakPolarHBondContact O-CD 3.43Å |
| 273 | F | 84.9 | Confident | 78.6 | Confident | 30 Ų | 30 | 58.8 Ų | 58.8 | 13% | 0.132 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.6 | -38.3 | 175 | 170.9 | -101 | 0 | 0 | 0 | 111.9 | L235 W266 M267 G270 L271 P276 F277 | L235-F273 HydrophobicContact CD1-CE1 4.42Å; L235-F273 HydrophobicContact CD2-CE1 4.32Å; W266-F273 HydrophobicContact CD2-CB 4.4Å; W266-F273 HydrophobicContact CE3-CB 4.29Å; W266-F273 HydrophobicContact CE3-CD2 4.09Å; W266-F273 HydrophobicContact CE3-CG 4.49Å; W266-F273 HydrophobicContact CH2-CB 4.06Å; W266-F273 AromaticContact CH2-CD2 3.57Å; W266-F273 HydrophobicContact CH2-CD2 3.57Å; W266-F273 HydrophobicContact CH2-CG 4.29Å; W266-F273 HydrophobicContact CZ2-CB 4.13Å; W266-F273 HydrophobicContact CZ2-CD2 4.46Å; W266-F273 HydrophobicContact CZ3-CB 4.13Å; W266-F273 AromaticContact CZ3-CD2 3.34Å; W266-F273 HydrophobicContact CZ3-CD2 3.34Å; W266-F273 HydrophobicContact CZ3-CE2 4.12Å; W266-F273 HydrophobicContact CZ3-CG 4.1Å; M267-F273 HydrophobicContact CB-CD1 4.35Å; M267-F273 HydrophobicContact CB-CG 4.35Å; M267-F273 HydrophobicContact CG-CD1 3.74Å; M267-F273 HydrophobicContact CG-CD2 4.26Å; M267-F273 HydrophobicContact CG-CE1 3.48Å; M267-F273 VanDerWaalsContact CG-CE1 3.48Å; M267-F273 HydrophobicContact CG-CE2 3.99Å; M267-F273 HydrophobicContact CG-CG 4.13Å; M267-F273 HydrophobicContact CG-CZ 3.6Å; M267-F273 VanDerWaalsContact O-CD1 3.3Å; M267-F273 WeakPolarHBondContact O-CD1 3.37Å; M267-F273 HydrophobicContact SD-CE1 4.23Å; M267-F273 HydrophobicContact SD-CE2 4.21Å; M267-F273 HydrophobicContact SD-CZ 3.8Å; G270-F273 PolarHBondContact O-N 2.82Å; L271-F273 VanDerWaalsContact C-N 3.29Å; L271-F273 PolarHBondContact O-N 3.49Å; F273-P276 WeakPolarHBondContact O-CD 3.43Å; F273-F277 HydrophobicContact CD2-CE2 4.38Å; F273-F277 AromaticContact CE1-CE2 3.98Å; F273-F277 HydrophobicContact CE1-CE2 3.98Å; F273-F277 AromaticContact CE2-CE2 3.86Å; F273-F277 HydrophobicContact CE2-CE2 3.86Å; F273-F277 HydrophobicContact CE2-CZ 4.39Å; F273-F277 AromaticContact CZ-CE2 3.63Å; F273-F277 HydrophobicContact CZ-CE2 3.63Å; F273-F277 HydrophobicContact CZ-CZ 4.15Å; F273-F277 VanDerWaalsContact O-CD2 3.31Å; F273-F277 WeakPolarHBondContact O-CD2 3.3Å; F273-F277 WeakPolarHBondContact O-CE2 3.4Å |
| 274 | L | 87.6 | Confident | 80.8 | Confident | 8 Ų | 8 | 55.2 Ų | 55.2 | 4% | 0.042 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -76.1 | -26.8 | -176.7 | -172.4 | 64.7 | 0 | 0 | 0 | 112.7 | L235 Q236 Y239 L271 T272 F277 L278 | L235-L274 HydrophobicContact CB-CD1 3.65Å; L235-L274 HydrophobicContact CD1-CD1 4.47Å; Q236-L274 HydrophobicContact CG-CD1 4.21Å; Q236-L274 HydrophobicContact CG-CD2 3.97Å; Y239-L274 HydrophobicContact CD1-CD2 4.38Å; Y239-L274 HydrophobicContact CG-CD2 4.31Å; L271-L274 HydrophobicContact CD1-CD2 4.36Å; L271-L274 WeakPolarHBondContact O-CB 3.22Å; L271-L274 PolarHBondContact O-N 3.48Å; L271-L274 VanDerWaalsContact O-N 3.08Å; T272-L274 VanDerWaalsContact C-N 3.3Å; T272-L274 PolarHBondContact O-N 2.97Å; L274-F277 PolarHBondContact O-N 3.5Å; L274-L278 HydrophobicContact CD2-CD1 3.97Å; L274-L278 HydrophobicContact CD2-CG 4.48Å; L274-L278 HydrophobicContact CG-CD1 3.78Å; L274-L278 HydrophobicContact CG-CD2 4.46Å; L274-L278 HydrophobicContact CG-CG 3.92Å; L274-L278 WeakPolarHBondContact O-CG 3.42Å; L274-L278 PolarHBondContact O-N 2.8Å |
| 275 | L | 90.1 | Very high | 82.9 | Confident | 26 Ų | 26 | 49.2 Ų | 49.2 | 14% | 0.136 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.9 | -47.2 | -173.5 | -74.1 | 174.8 | 0 | 0 | 0 | 114.5 | L271 T272 F277 L278 F279 T324 V328 | L271-L275 HydrophobicContact CG-CD2 4.48Å; L271-L275 HydrophobicContact CG-CG 4.42Å; L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 2.92Å; L271-L275 VanDerWaalsContact O-N 3.16Å; T272-L275 PolarHBondContact O-N 3.39Å; L275-F277 VanDerWaalsContact C-N 3.3Å; L275-F277 PolarHBondContact O-N 2.93Å; L275-L278 PolarHBondContact O-N 2.84Å; L275-L278 VanDerWaalsContact O-N 3.16Å; L275-F279 HydrophobicContact CB-CD2 4.35Å; L275-F279 HydrophobicContact CB-CE2 4.4Å; L275-F279 HydrophobicContact CD2-CE2 4.2Å; L275-F279 VanDerWaalsContact O-CD2 3.26Å; L275-F279 WeakPolarHBondContact O-CD2 3.36Å; L275-F279 PolarHBondContact O-N 3.17Å; L275-T324 HydrophobicContact CD2-CG2 3.61Å; L275-V328 HydrophobicContact CD1-CG2 3.66Å; L275-V328 HydrophobicContact CD2-CG2 3.65Å; L275-V328 HydrophobicContact CG-CG2 4.33Å |
| 276 | P | 92.5 | Very high | 84.7 | Confident | 83 Ų | 83 | 50.8 Ų | 50.8 | 54% | 0.539 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -55.3 | -44.3 | 177.8 | -27 | 34.5 | 0 | 0 | 0 | 112.9 | T272 F273 F279 F280 | T272-P276 VanDerWaalsContact O-CD 3.23Å; T272-P276 WeakPolarHBondContact O-CD 3.43Å; F273-P276 WeakPolarHBondContact O-CD 3.43Å; P276-F279 PolarHBondContact O-N 3.11Å; P276-F280 WeakPolarHBondContact O-CB 3.49Å; P276-F280 PolarHBondContact O-N 3.3Å |
| 277 | F | 94.3 | Very high | 86.6 | Confident | 59 Ų | 59 | 50.8 Ų | 50.8 | 26% | 0.259 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -66.5 | -40.5 | 177.8 | -57.2 | -79.7 | 0 | 0 | 0 | 111.7 | Y228 F231 V232 L235 F273 L274 L275 G281 | Y228-F277 WeakPolarHBondContact OH-CA 3.45Å; Y228-F277 PolarHBondContact OH-O 3.48Å; F231-F277 AromaticContact CE1-CD1 3.83Å; F231-F277 HydrophobicContact CE1-CD1 3.83Å; F231-F277 AromaticContact CE1-CE1 3.94Å; F231-F277 HydrophobicContact CE1-CE1 3.94Å; F231-F277 HydrophobicContact CZ-CE1 4.37Å; V232-F277 HydrophobicContact CG2-CB 4.29Å; L235-F277 HydrophobicContact CD1-CB 4.32Å; L235-F277 HydrophobicContact CD1-CD1 4.2Å; L235-F277 HydrophobicContact CD1-CD2 3.87Å; L235-F277 HydrophobicContact CD1-CE1 4.5Å; L235-F277 HydrophobicContact CD1-CE2 4.2Å; L235-F277 HydrophobicContact CD1-CG 3.87Å; F273-F277 HydrophobicContact CD2-CE2 4.38Å; F273-F277 AromaticContact CE1-CE2 3.98Å; F273-F277 HydrophobicContact CE1-CE2 3.98Å; F273-F277 AromaticContact CE2-CE2 3.86Å; F273-F277 HydrophobicContact CE2-CE2 3.86Å; F273-F277 HydrophobicContact CE2-CZ 4.39Å; F273-F277 AromaticContact CZ-CE2 3.63Å; F273-F277 HydrophobicContact CZ-CE2 3.63Å; F273-F277 HydrophobicContact CZ-CZ 4.15Å; F273-F277 VanDerWaalsContact O-CD2 3.31Å; F273-F277 WeakPolarHBondContact O-CD2 3.3Å; F273-F277 WeakPolarHBondContact O-CE2 3.4Å; L274-F277 PolarHBondContact O-N 3.5Å; L275-F277 VanDerWaalsContact C-N 3.3Å; L275-F277 PolarHBondContact O-N 2.93Å; F277-G281 PolarHBondContact O-N 3.03Å |
| 278 | L | 93.9 | Very high | 88.4 | Confident | 11 Ų | 11 | 49.1 Ų | 49.1 | 6% | 0.058 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.5 | -49.2 | 175.3 | -67 | 172.4 | 0 | 0 | 0 | 111.7 | V232 Q236 L274 L275 F280 G281 H282 | V232-L278 HydrophobicContact CG1-CD2 3.73Å; Q236-L278 HydrophobicContact CG-CD2 4.33Å; Q236-L278 VanDerWaalsContact NE2-CD2 3.29Å; L274-L278 HydrophobicContact CD2-CD1 3.97Å; L274-L278 HydrophobicContact CD2-CG 4.48Å; L274-L278 HydrophobicContact CG-CD1 3.78Å; L274-L278 HydrophobicContact CG-CD2 4.46Å; L274-L278 HydrophobicContact CG-CG 3.92Å; L274-L278 WeakPolarHBondContact O-CG 3.42Å; L274-L278 PolarHBondContact O-N 2.8Å; L275-L278 PolarHBondContact O-N 2.84Å; L275-L278 VanDerWaalsContact O-N 3.16Å; L278-F280 VanDerWaalsContact C-N 3.34Å; L278-F280 PolarHBondContact O-N 2.78Å; L278-G281 PolarHBondContact O-N 3.01Å; L278-H282 PolarHBondContact O-CD2 2.89Å; L278-H282 VanDerWaalsContact O-CD2 3.31Å; L278-H282 PolarHBondContact O-CE1 3.41Å; L278-H282 PolarHBondContact O-N 3.35Å; L278-H282 PolarHBondContact O-ND1 3.48Å; L278-H282 VanDerWaalsContact O-ND1 3.17Å |
| 279 | F | 94.9 | Very high | 90.3 | Very high | 43 Ų | 43 | 46 Ų | 46 | 19% | 0.189 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.9 | -41.8 | -179.6 | -81.7 | -65.9 | 0 | 0 | 0 | 112 | L275 P276 G281 H282 F283 F321 T324 L325 | L275-F279 HydrophobicContact CB-CD2 4.35Å; L275-F279 HydrophobicContact CB-CE2 4.4Å; L275-F279 HydrophobicContact CD2-CE2 4.2Å; L275-F279 VanDerWaalsContact O-CD2 3.26Å; L275-F279 WeakPolarHBondContact O-CD2 3.36Å; L275-F279 PolarHBondContact O-N 3.17Å; P276-F279 PolarHBondContact O-N 3.11Å; F279-G281 VanDerWaalsContact C-N 3.33Å; F279-G281 PolarHBondContact O-N 3.44Å; F279-H282 PolarHBondContact O-N 3.01Å; F279-F283 HydrophobicContact CB-CE2 4.41Å; F279-F283 WeakPolarHBondContact O-CD2 3.5Å; F279-F283 PolarHBondContact O-N 3Å; F279-F321 AromaticContact CD1-CD2 3.79Å; F279-F321 HydrophobicContact CD1-CD2 3.79Å; F279-F321 AromaticContact CD1-CE2 3.7Å; F279-F321 HydrophobicContact CD1-CE2 3.7Å; F279-F321 AromaticContact CE1-CD2 3.71Å; F279-F321 HydrophobicContact CE1-CD2 3.71Å; F279-F321 AromaticContact CE1-CE2 3.54Å; F279-F321 HydrophobicContact CE1-CE2 3.54Å; F279-F321 HydrophobicContact CE1-CZ 4.45Å; F279-T324 HydrophobicContact CE1-CG2 4.21Å; F279-T324 HydrophobicContact CE2-CG2 3.94Å; F279-T324 HydrophobicContact CZ-CG2 3.72Å; F279-L325 HydrophobicContact CE1-CD2 4.3Å; F279-L325 HydrophobicContact CE1-CG 4.46Å; F279-L325 HydrophobicContact CZ-CD2 4.1Å |
| 280 | F | 97.1 | Very high | 92.1 | Very high | 114 Ų | 114 | 43.5 Ų | 43.5 | 50% | 0.5 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -59.8 | -45.2 | 174.4 | -177.3 | -88.9 | 0 | 0 | 0 | 111.5 | Y228 P276 L278 H282 F283 W284 | Y228-F280 HydrophobicContact CD2-CD1 4.37Å; Y228-F280 HydrophobicContact CD2-CE1 4.15Å; Y228-F280 AromaticContact CE1-CD1 3.8Å; Y228-F280 HydrophobicContact CE1-CD1 3.8Å; Y228-F280 HydrophobicContact CE1-CE1 4.38Å; Y228-F280 AromaticContact CE2-CD1 3.62Å; Y228-F280 HydrophobicContact CE2-CD1 3.62Å; Y228-F280 AromaticContact CE2-CE1 3.76Å; Y228-F280 HydrophobicContact CE2-CE1 3.76Å; Y228-F280 AromaticContact CZ-CD1 3.3Å; Y228-F280 AromaticContact CZ-CE1 3.91Å; Y228-F280 VanDerWaalsContact OH-CD1 3.27Å; Y228-F280 WeakPolarHBondContact OH-CD1 3.36Å; P276-F280 WeakPolarHBondContact O-CB 3.49Å; P276-F280 PolarHBondContact O-N 3.3Å; L278-F280 VanDerWaalsContact C-N 3.34Å; L278-F280 PolarHBondContact O-N 2.78Å; F280-H282 VanDerWaalsContact C-N 3.32Å; F280-H282 PolarHBondContact O-N 3.19Å; F280-F283 PolarHBondContact O-N 3.21Å; F280-W284 HydrophobicContact CD1-CE3 4.13Å; F280-W284 HydrophobicContact CE1-CD2 4.48Å; F280-W284 AromaticContact CE1-CE3 3.36Å; F280-W284 HydrophobicContact CE1-CE3 3.36Å; F280-W284 AromaticContact CE1-CZ3 3.63Å; F280-W284 HydrophobicContact CE1-CZ3 3.63Å; F280-W284 HydrophobicContact CZ-CE3 4.05Å; F280-W284 HydrophobicContact CZ-CZ3 4.2Å; F280-W284 PolarHBondContact O-N 3.3Å |
| 281 | G | 96.4 | Very high | 93.5 | Very high | 3 Ų | 3 | 43.8 Ų | 43.8 | 3% | 0.031 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -57.8 | -42.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y228 F277 L278 F279 W284 Q285 | Y228-G281 VanDerWaalsContact CE1-CA 3.47Å; F277-G281 PolarHBondContact O-N 3.03Å; L278-G281 PolarHBondContact O-N 3.01Å; F279-G281 VanDerWaalsContact C-N 3.33Å; F279-G281 PolarHBondContact O-N 3.44Å; G281-W284 WeakPolarHBondContact O-CB 3.43Å; G281-W284 PolarHBondContact O-N 2.84Å; G281-Q285 WeakPolarHBondContact O-CG 3.27Å; G281-Q285 PolarHBondContact O-N 3Å |
| 282 | H | 96.4 | Very high | 94.5 | Very high | 9 Ų | 9 | 42.8 Ų | 42.8 | 4% | 0.042 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -63.5 | -46.5 | 176.9 | -56.6 | -18.7 | 0 | 0 | 0 | 111 | L278 F279 F280 W284 Q285 L286 F317 N320 T324 | L278-H282 PolarHBondContact O-CD2 2.89Å; L278-H282 VanDerWaalsContact O-CD2 3.31Å; L278-H282 PolarHBondContact O-CE1 3.41Å; L278-H282 PolarHBondContact O-N 3.35Å; L278-H282 PolarHBondContact O-ND1 3.48Å; L278-H282 VanDerWaalsContact O-ND1 3.17Å; F279-H282 PolarHBondContact O-N 3.01Å; F280-H282 VanDerWaalsContact C-N 3.32Å; F280-H282 PolarHBondContact O-N 3.19Å; H282-W284 VanDerWaalsContact C-N 3.27Å; H282-W284 PolarHBondContact O-N 3.36Å; H282-Q285 WeakPolarHBondContact O-CA 3.42Å; H282-Q285 VanDerWaalsContact O-CB 3.31Å; H282-Q285 WeakPolarHBondContact O-CB 3.44Å; H282-Q285 PolarHBondContact O-N 3.06Å; H282-L286 PolarHBondContact O-N 3.06Å; H282-F317 HydrophobicContact CB-CD2 4.04Å; H282-F317 HydrophobicContact CB-CE2 4.34Å; H282-F317 WeakPolarHBondContact O-CD2 3.46Å; H282-N320 VanDerWaalsContact CE1-CB 3.48Å; H282-N320 WeakPolarHBondContact CE1-CB 3.25Å; H282-T324 PolarHBondContact NE2-OG1 3.34Å; H282-T324 VanDerWaalsContact NE2-OG1 3.16Å |
| 283 | F | 97.8 | Very high | 95.3 | Very high | 110 Ų | 110 | 41.1 Ų | 41.1 | 48% | 0.482 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -64.4 | -32 | 176 | -73 | -62.5 | 0 | 0 | 0 | 112.6 | F279 F280 L286 Y287 F317 F321 | F279-F283 HydrophobicContact CB-CE2 4.41Å; F279-F283 WeakPolarHBondContact O-CD2 3.5Å; F279-F283 PolarHBondContact O-N 3Å; F280-F283 PolarHBondContact O-N 3.21Å; F283-L286 WeakPolarHBondContact O-CB 3.41Å; F283-L286 PolarHBondContact O-N 2.96Å; F283-Y287 PolarHBondContact O-N 3.21Å; F283-F317 HydrophobicContact CD1-CE2 4.22Å; F283-F317 HydrophobicContact CE1-CE2 4.41Å; F283-F321 HydrophobicContact CE2-CE2 4.46Å; F283-F321 AromaticContact CZ-CE2 3.95Å; F283-F321 HydrophobicContact CZ-CE2 3.95Å |
| 284 | W | 97.9 | Very high | 95.7 | Very high | 55 Ų | 55 | 48 Ų | 48 | 21% | 0.208 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.8 | -39.5 | 170.8 | -156.8 | -30.7 | 0 | 0 | 0 | 111.3 | A224 F225 Y228 F280 G281 H282 L286 Y287 N288 | A224-W284 HydrophobicContact CB-CH2 4.37Å; A224-W284 HydrophobicContact CB-CZ2 4.08Å; F225-W284 HydrophobicContact CD2-CB 4.01Å; F225-W284 AromaticContact CD2-CD1 3.73Å; F225-W284 HydrophobicContact CD2-CD2 4.04Å; F225-W284 AromaticContact CD2-CG 3.66Å; F225-W284 HydrophobicContact CD2-CG 3.66Å; F225-W284 HydrophobicContact CE2-CB 4.19Å; F225-W284 HydrophobicContact CE2-CG 4.34Å; Y228-W284 AromaticContact CD1-CE3 4Å; Y228-W284 HydrophobicContact CD1-CE3 4Å; Y228-W284 HydrophobicContact CD1-CZ3 4.35Å; Y228-W284 HydrophobicContact CD2-CE3 4.35Å; Y228-W284 AromaticContact CD2-CZ3 3.99Å; Y228-W284 HydrophobicContact CD2-CZ3 3.99Å; Y228-W284 AromaticContact CG-CE3 3.86Å; Y228-W284 HydrophobicContact CG-CE3 3.86Å; Y228-W284 AromaticContact CG-CZ3 3.74Å; Y228-W284 HydrophobicContact CG-CZ3 3.74Å; F280-W284 HydrophobicContact CD1-CE3 4.13Å; F280-W284 HydrophobicContact CE1-CD2 4.48Å; F280-W284 AromaticContact CE1-CE3 3.36Å; F280-W284 HydrophobicContact CE1-CE3 3.36Å; F280-W284 AromaticContact CE1-CZ3 3.63Å; F280-W284 HydrophobicContact CE1-CZ3 3.63Å; F280-W284 HydrophobicContact CZ-CE3 4.05Å; F280-W284 HydrophobicContact CZ-CZ3 4.2Å; F280-W284 PolarHBondContact O-N 3.3Å; G281-W284 WeakPolarHBondContact O-CB 3.43Å; G281-W284 PolarHBondContact O-N 2.84Å; H282-W284 VanDerWaalsContact C-N 3.27Å; H282-W284 PolarHBondContact O-N 3.36Å; W284-L286 VanDerWaalsContact C-N 3.29Å; W284-L286 PolarHBondContact O-N 3.38Å; W284-Y287 AromaticContact CD1-CD1 3.97Å; W284-Y287 WeakPolarHBondContact O-CB 3.29Å; W284-Y287 PolarHBondContact O-N 3.02Å; W284-Y287 VanDerWaalsContact O-N 3.12Å; W284-N288 PolarHBondContact NE1-OD1 2.95Å; W284-N288 PolarHBondContact O-N 3.3Å |
| 285 | Q | 97.8 | Very high | 96 | Very high | 5 Ų | 5 | 48.3 Ų | 48.3 | 2% | 0.023 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57.8 | -42.7 | 171.9 | -67.4 | 169.2 | -5.9 | 0 | 0 | 111.4 | F225 G281 H282 N288 S289 F313 L316 F317 N320 | F225-Q285 HydrophobicContact CE2-CG 3.79Å; F225-Q285 HydrophobicContact CZ-CG 3.58Å; G281-Q285 WeakPolarHBondContact O-CG 3.27Å; G281-Q285 PolarHBondContact O-N 3Å; H282-Q285 WeakPolarHBondContact O-CA 3.42Å; H282-Q285 VanDerWaalsContact O-CB 3.31Å; H282-Q285 WeakPolarHBondContact O-CB 3.44Å; H282-Q285 PolarHBondContact O-N 3.06Å; Q285-N288 PolarHBondContact O-N 3.1Å; Q285-S289 PolarHBondContact O-N 3.29Å; Q285-F313 HydrophobicContact CB-CD1 4.33Å; Q285-F313 HydrophobicContact CG-CD1 4.41Å; Q285-L316 PolarHBondContact OE1-O 3.34Å; Q285-F317 HydrophobicContact CB-CB 4.05Å; Q285-N320 PolarHBondContact NE2-ND2 2.99Å; Q285-N320 VanDerWaalsContact NE2-ND2 3.19Å; Q285-N320 PolarHBondContact OE1-ND2 3.44Å |
| 286 | L | 98.1 | Very high | 96 | Very high | 51 Ų | 51 | 48.4 Ų | 48.4 | 27% | 0.267 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.2 | -43.6 | 173.8 | -179.6 | 62 | 0 | 0 | 0 | 111.8 | H282 F283 W284 N288 S289 V290 L314 F317 | H282-L286 PolarHBondContact O-N 3.06Å; F283-L286 WeakPolarHBondContact O-CB 3.41Å; F283-L286 PolarHBondContact O-N 2.96Å; W284-L286 VanDerWaalsContact C-N 3.29Å; W284-L286 PolarHBondContact O-N 3.38Å; L286-N288 VanDerWaalsContact C-N 3.34Å; L286-N288 PolarHBondContact O-N 2.85Å; L286-S289 WeakPolarHBondContact O-CB 3.23Å; L286-S289 PolarHBondContact O-N 3.36Å; L286-V290 HydrophobicContact CD1-CG2 4.27Å; L286-V290 HydrophobicContact CG-CG2 4.46Å; L286-V290 WeakPolarHBondContact O-CG2 3.33Å; L286-V290 PolarHBondContact O-N 2.93Å; L286-L314 HydrophobicContact CD1-CD1 4.07Å; L286-F317 HydrophobicContact CB-CB 4.38Å; L286-F317 HydrophobicContact CB-CD1 4.01Å; L286-F317 HydrophobicContact CB-CD2 3.88Å; L286-F317 HydrophobicContact CB-CE1 4.25Å; L286-F317 HydrophobicContact CB-CE2 4.1Å; L286-F317 HydrophobicContact CB-CG 3.8Å; L286-F317 HydrophobicContact CB-CZ 4.28Å; L286-F317 HydrophobicContact CD1-CD1 3.86Å; L286-F317 HydrophobicContact CD1-CE1 4.01Å; L286-F317 HydrophobicContact CD1-CG 4.45Å; L286-F317 HydrophobicContact CD2-CD1 4.4Å; L286-F317 HydrophobicContact CD2-CE1 3.87Å; L286-F317 HydrophobicContact CD2-CE2 4.35Å; L286-F317 HydrophobicContact CD2-CZ 3.83Å; L286-F317 HydrophobicContact CG-CD1 4.3Å; L286-F317 HydrophobicContact CG-CE1 4.26Å; L286-F317 HydrophobicContact CG-CZ 4.5Å |
| 287 | Y | 98.1 | Very high | 95.9 | Very high | 125 Ų | 125 | 54.4 Ų | 54.4 | 49% | 0.49 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -58.8 | -45.1 | 176.3 | 175 | -120.9 | 0 | 0 | 0 | 111.6 | Q221 F283 W284 S289 V290 T291 | Q221-Y287 VanDerWaalsContact CD-CE1 3.41Å; Q221-Y287 HydrophobicContact CG-CE1 4.26Å; F283-Y287 PolarHBondContact O-N 3.21Å; W284-Y287 AromaticContact CD1-CD1 3.97Å; W284-Y287 WeakPolarHBondContact O-CB 3.29Å; W284-Y287 PolarHBondContact O-N 3.02Å; W284-Y287 VanDerWaalsContact O-N 3.12Å; Y287-S289 VanDerWaalsContact C-N 3.35Å; Y287-S289 PolarHBondContact O-N 3.43Å; Y287-V290 PolarHBondContact O-N 3.31Å; Y287-T291 PolarHBondContact O-N 3.2Å; Y287-T291 PolarHBondContact O-OG1 2.95Å; Y287-T291 VanDerWaalsContact O-OG1 3.13Å |
| 288 | N | 97.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -58.8 | -45.9 | 173.9 | -70.3 | -15.8 | 0 | 0 | 0 | 111.6 | F218 Q221 F225 W284 Q285 L286 V290 T291 L292 F313 | F218-N288 HydrophobicContact CE2-CB 4.17Å; F218-N288 HydrophobicContact CZ-CB 4.06Å; Q221-N288 WeakPolarHBondContact CG-OD1 3.41Å; Q221-N288 PolarHBondContact NE2-OD1 3.44Å; F225-N288 VanDerWaalsContact CG-ND2 3.3Å; F225-N288 WeakPolarHBondContact CG-ND2 3.44Å; W284-N288 PolarHBondContact NE1-OD1 2.95Å; W284-N288 PolarHBondContact O-N 3.3Å; Q285-N288 PolarHBondContact O-N 3.1Å; L286-N288 VanDerWaalsContact C-N 3.34Å; L286-N288 PolarHBondContact O-N 2.85Å; N288-V290 PolarHBondContact O-N 2.8Å; N288-T291 PolarHBondContact O-N 3.46Å; N288-L292 WeakPolarHBondContact O-CB 3.4Å; N288-L292 WeakPolarHBondContact O-CD1 3.04Å; N288-L292 VanDerWaalsContact O-CG 3.3Å; N288-L292 WeakPolarHBondContact O-CG 3.31Å; N288-L292 PolarHBondContact O-N 3.07Å; N288-F313 HydrophobicContact CB-CD1 3.98Å; N288-F313 HydrophobicContact CB-CD2 4.02Å; N288-F313 HydrophobicContact CB-CE1 4.12Å; N288-F313 HydrophobicContact CB-CE2 4.15Å; N288-F313 HydrophobicContact CB-CG 3.94Å; N288-F313 HydrophobicContact CB-CZ 4.2Å |
| 289 | S | 97.8 | Very high | 94.7 | Very high | 2 Ų | 2 | 62.9 Ų | 62.9 | 1% | 0.014 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.6 | -48.1 | 176.8 | -179.6 | 0 | 0 | 0 | 0 | 112 | Q285 L286 Y287 L292 F293 A310 L314 | Q285-S289 PolarHBondContact O-N 3.29Å; L286-S289 WeakPolarHBondContact O-CB 3.23Å; L286-S289 PolarHBondContact O-N 3.36Å; Y287-S289 VanDerWaalsContact C-N 3.35Å; Y287-S289 PolarHBondContact O-N 3.43Å; S289-L292 PolarHBondContact O-N 3.16Å; S289-F293 WeakPolarHBondContact O-CD2 3.48Å; S289-F293 PolarHBondContact O-N 3.3Å; S289-F293 WeakPolarHBondContact OG-CE2 3.43Å; S289-A310 WeakPolarHBondContact CB-O 3.45Å; S289-A310 PolarHBondContact OG-O 3.4Å; S289-L314 WeakPolarHBondContact OG-CB 3.49Å |
| 290 | V | 97.6 | Very high | 93.9 | Very high | 54 Ų | 54 | 66 Ų | 66 | 33% | 0.327 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64 | -43.9 | 179.2 | 172 | 0 | 0 | 0 | 0 | 111.4 | L286 Y287 N288 L292 F293 R294 | L286-V290 HydrophobicContact CD1-CG2 4.27Å; L286-V290 HydrophobicContact CG-CG2 4.46Å; L286-V290 WeakPolarHBondContact O-CG2 3.33Å; L286-V290 PolarHBondContact O-N 2.93Å; Y287-V290 PolarHBondContact O-N 3.31Å; N288-V290 PolarHBondContact O-N 2.8Å; V290-L292 VanDerWaalsContact C-N 3.35Å; V290-L292 PolarHBondContact O-N 3.07Å; V290-F293 PolarHBondContact O-N 3.41Å; V290-R294 WeakPolarHBondContact O-CG 3.31Å; V290-R294 PolarHBondContact O-N 2.81Å |
| 291 | T | 96.6 | Very high | 93.2 | Very high | 22 Ų | 22 | 62 Ų | 62 | 14% | 0.135 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.3 | -48 | 175.4 | -64.5 | 0 | 0 | 0 | 0 | 110.7 | F218 Q221 Y287 N288 F293 R294 L295 | F218-T291 HydrophobicContact CD2-CG2 4.22Å; Q221-T291 PolarHBondContact NE2-OG1 3.29Å; Y287-T291 PolarHBondContact O-N 3.2Å; Y287-T291 PolarHBondContact O-OG1 2.95Å; Y287-T291 VanDerWaalsContact O-OG1 3.13Å; N288-T291 PolarHBondContact O-N 3.46Å; T291-F293 PolarHBondContact O-N 2.93Å; T291-R294 WeakPolarHBondContact O-CB 3.33Å; T291-R294 PolarHBondContact O-N 3.46Å; T291-R294 VanDerWaalsContact O-N 3.15Å; T291-L295 HydrophobicContact CG2-CD1 4.17Å; T291-L295 WeakPolarHBondContact O-CG 3.3Å; T291-L295 PolarHBondContact O-N 3.48Å |
| 292 | L | 96.5 | Very high | 92.5 | Very high | 0 Ų | 0 | 71.1 Ų | 71.1 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -66.3 | -37.5 | 179.8 | -71.4 | 163.5 | 0 | 0 | 0 | 112.6 | W209 F218 N288 S289 V290 R294 L295 A296 I306 L309 A310 F313 | W209-L292 HydrophobicContact CH2-CD2 3.75Å; W209-L292 HydrophobicContact CZ3-CD2 3.83Å; F218-L292 HydrophobicContact CB-CD2 4.43Å; F218-L292 HydrophobicContact CD1-CD2 3.83Å; F218-L292 HydrophobicContact CD1-CG 4.49Å; F218-L292 HydrophobicContact CD2-CD2 3.92Å; F218-L292 HydrophobicContact CD2-CG 4.05Å; F218-L292 HydrophobicContact CE1-CD1 3.97Å; F218-L292 HydrophobicContact CE1-CD2 4Å; F218-L292 HydrophobicContact CE1-CG 4.24Å; F218-L292 HydrophobicContact CE2-CD1 4.04Å; F218-L292 HydrophobicContact CE2-CD2 4.11Å; F218-L292 HydrophobicContact CE2-CG 3.8Å; F218-L292 HydrophobicContact CG-CD2 3.79Å; F218-L292 HydrophobicContact CG-CG 4.39Å; F218-L292 HydrophobicContact CZ-CD1 3.64Å; F218-L292 HydrophobicContact CZ-CD2 4.14Å; F218-L292 HydrophobicContact CZ-CG 3.91Å; N288-L292 WeakPolarHBondContact O-CB 3.4Å; N288-L292 WeakPolarHBondContact O-CD1 3.04Å; N288-L292 VanDerWaalsContact O-CG 3.3Å; N288-L292 WeakPolarHBondContact O-CG 3.31Å; N288-L292 PolarHBondContact O-N 3.07Å; S289-L292 PolarHBondContact O-N 3.16Å; V290-L292 VanDerWaalsContact C-N 3.35Å; V290-L292 PolarHBondContact O-N 3.07Å; L292-R294 VanDerWaalsContact C-N 3.28Å; L292-R294 PolarHBondContact O-N 2.82Å; L292-L295 HydrophobicContact CD2-CD1 4.47Å; L292-L295 PolarHBondContact O-N 3.34Å; L292-A296 VanDerWaalsContact O-CB 3.29Å; L292-A296 WeakPolarHBondContact O-CB 3.48Å; L292-A296 PolarHBondContact O-N 2.83Å; L292-I306 HydrophobicContact CB-CG2 4.35Å; L292-I306 HydrophobicContact CD2-CG2 3.92Å; L292-I306 WeakPolarHBondContact O-CG2 3.34Å; L292-L309 HydrophobicContact CD1-CB 3.67Å; L292-A310 HydrophobicContact CB-CB 3.59Å; L292-F313 HydrophobicContact CD1-CD2 3.56Å; L292-F313 HydrophobicContact CD1-CE2 3.91Å |
| 293 | F | 96.6 | Very high | 92.2 | Very high | 53 Ų | 53 | 72.5 Ų | 72.5 | 23% | 0.232 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -64.5 | -32.3 | 172.7 | -82.8 | -56.1 | 0 | 0 | 0 | 112.9 | S289 V290 T291 R297 F307 A310 L314 | S289-F293 WeakPolarHBondContact O-CD2 3.48Å; S289-F293 PolarHBondContact O-N 3.3Å; S289-F293 WeakPolarHBondContact OG-CE2 3.43Å; V290-F293 PolarHBondContact O-N 3.41Å; T291-F293 PolarHBondContact O-N 2.93Å; F293-R297 WeakPolarHBondContact O-CG 3.3Å; F293-R297 PolarHBondContact O-N 3.43Å; F293-F307 HydrophobicContact CD1-CD2 4.4Å; F293-F307 HydrophobicContact CD1-CE2 4.45Å; F293-F307 HydrophobicContact CE1-CD2 4.02Å; F293-F307 AromaticContact CE1-CE2 3.8Å; F293-F307 HydrophobicContact CE1-CE2 3.8Å; F293-A310 HydrophobicContact CB-CB 4.49Å; F293-A310 HydrophobicContact CD1-CB 3.69Å; F293-A310 HydrophobicContact CD2-CB 3.79Å; F293-A310 HydrophobicContact CE1-CB 3.71Å; F293-A310 HydrophobicContact CE2-CB 3.83Å; F293-A310 HydrophobicContact CG-CB 3.72Å; F293-A310 HydrophobicContact CZ-CB 3.78Å; F293-L314 HydrophobicContact CE2-CD2 4.32Å |
| 294 | R | 94.5 | Very high | 92 | Very high | 175 Ų | 175 | 74 Ų | 74 | 66% | 0.66 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -69.4 | -44.8 | 172.7 | -70.4 | 174.3 | -174.8 | 175.2 | 1.6 | 111 | V290 T291 L292 A296 R297 | V290-R294 WeakPolarHBondContact O-CG 3.31Å; V290-R294 PolarHBondContact O-N 2.81Å; T291-R294 WeakPolarHBondContact O-CB 3.33Å; T291-R294 PolarHBondContact O-N 3.46Å; T291-R294 VanDerWaalsContact O-N 3.15Å; L292-R294 VanDerWaalsContact C-N 3.28Å; L292-R294 PolarHBondContact O-N 2.82Å; R294-A296 VanDerWaalsContact C-N 3.32Å; R294-A296 PolarHBondContact O-N 3.23Å; R294-R297 PolarHBondContact O-N 2.96Å |
| 295 | L | 92.6 | Very high | 91.9 | Very high | 15 Ų | 15 | 72.2 Ų | 72.2 | 8% | 0.079 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.2 | -39.3 | 175.8 | -67.2 | 173.8 | 0 | 0 | 0 | 111.7 | M214 M217 F218 T291 L292 R297 H298 I306 | M214-L295 HydrophobicContact SD-CB 4.36Å; M214-L295 HydrophobicContact SD-CD2 3.86Å; M217-L295 HydrophobicContact CB-CD2 4.38Å; M217-L295 HydrophobicContact CE-CD2 3.84Å; M217-L295 HydrophobicContact SD-CD2 4.08Å; F218-L295 HydrophobicContact CB-CD1 4.1Å; T291-L295 HydrophobicContact CG2-CD1 4.17Å; T291-L295 WeakPolarHBondContact O-CG 3.3Å; T291-L295 PolarHBondContact O-N 3.48Å; L292-L295 HydrophobicContact CD2-CD1 4.47Å; L292-L295 PolarHBondContact O-N 3.34Å; L295-R297 PolarHBondContact O-N 3.35Å; L295-H298 WeakPolarHBondContact O-CB 3.36Å; L295-H298 PolarHBondContact O-N 2.92Å; L295-I306 HydrophobicContact CB-CG2 3.99Å |
| 296 | A | 91.6 | Very high | 91.8 | Very high | 28 Ų | 28 | 72 Ų | 72 | 23% | 0.231 | 33% | 0.329 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -16.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114 | L292 R294 I306 | L292-A296 VanDerWaalsContact O-CB 3.29Å; L292-A296 WeakPolarHBondContact O-CB 3.48Å; L292-A296 PolarHBondContact O-N 2.83Å; R294-A296 VanDerWaalsContact C-N 3.32Å; R294-A296 PolarHBondContact O-N 3.23Å; A296-I306 HydrophobicContact CB-CB 4.46Å; A296-I306 HydrophobicContact CB-CG2 3.97Å |
| 297 | R | 89.6 | Confident | 91.6 | Very high | 208 Ų | 208 | 74.6 Ų | 74.6 | 79% | 0.785 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96 | 0.3 | 175.3 | -70.6 | 176.8 | -177.4 | -178.3 | 0.9 | 113 | F293 R294 L295 | F293-R297 WeakPolarHBondContact O-CG 3.3Å; F293-R297 PolarHBondContact O-N 3.43Å; R294-R297 PolarHBondContact O-N 2.96Å; L295-R297 PolarHBondContact O-N 3.35Å |
| 298 | H | 88 | Confident | 91.5 | Very high | 84 Ų | 84 | 71.7 Ų | 71.7 | 39% | 0.389 | 33% | 0.331 | S | S | . | . | S | Bend | trans | -69.2 | 137.1 | 176.1 | -158 | -81.7 | 0 | 0 | 0 | 109.4 | M214 L295 D300 C301 | M214-H298 HydrophobicContact CE-CB 4.07Å; M214-H298 HydrophobicContact SD-CB 4.38Å; L295-H298 WeakPolarHBondContact O-CB 3.36Å; L295-H298 PolarHBondContact O-N 2.92Å; H298-D300 IonicContact CE1-OD2 3.13Å; H298-D300 IonicContact ND1-OD2 3.91Å; H298-D300 PolarHBondContact O-N 2.95Å; H298-D300 VanDerWaalsContact O-N 3.1Å; H298-C301 HydrophobicContact CB-CB 4.39Å; H298-C301 WeakPolarHBondContact O-CB 3.2Å; H298-C301 PolarHBondContact O-N 2.99Å |
| 299 | D | 75.9 | Confident | 91.5 | Very high | 165 Ų | 165 | 71.7 Ų | 71.7 | 88% | 0.882 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | -26.3 | -173.2 | -64.9 | -40.5 | 0 | 0 | 0 | 113.1 | ||
| 300 | D | 77.2 | Confident | 91.5 | Very high | 107 Ų | 107 | 71.6 Ų | 71.6 | 57% | 0.572 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.1 | -1.7 | 177.6 | -61.4 | -49.4 | 0 | 0 | 0 | 114.8 | H298 K302 | H298-D300 IonicContact CE1-OD2 3.13Å; H298-D300 IonicContact ND1-OD2 3.91Å; H298-D300 PolarHBondContact O-N 2.95Å; H298-D300 VanDerWaalsContact O-N 3.1Å; D300-K302 PolarHBondContact O-N 2.94Å |
| 301 | C | 81.8 | Confident | 91.5 | Very high | 31 Ų | 31 | 72.7 Ų | 72.7 | 21% | 0.209 | 33% | 0.333 | C | S | . | . | trans | -72.9 | 115.3 | -178.2 | 174.8 | 0 | 0 | 0 | 0 | 111.2 | H298 | H298-C301 HydrophobicContact CB-CB 4.39Å; H298-C301 WeakPolarHBondContact O-CB 3.2Å; H298-C301 PolarHBondContact O-N 2.99Å | ||
| 302 | K | 82.1 | Confident | 91.5 | Very high | 194 Ų | 194 | 72 Ų | 72 | 84% | 0.843 | 33% | 0.329 | S | S | * | . | trans | -113.6 | -12.4 | 176.3 | -64.1 | -179.6 | -175.9 | 174.6 | 0 | 112.6 | D300 | D300-K302 PolarHBondContact O-N 2.94Š| ||
| 303 | E | 90.4 | Very high | 91.6 | Very high | 39 Ų | 39 | 72 Ų | 72 | 18% | 0.182 | 33% | 0.329 | C | S | . | . | trans | -85.7 | 111.9 | -172.3 | -58 | 92 | 154 | 0 | 0 | 111.5 | P210 Q305 I306 | P210-E303 HydrophobicContact CG-CG 4.12Å; E303-Q305 PolarHBondContact O-N 3.48Å; E303-I306 HydrophobicContact CB-CD1 4.09Å; E303-I306 HydrophobicContact CB-CG1 3.96Å; E303-I306 WeakPolarHBondContact O-CG1 3.27Å; E303-I306 PolarHBondContact O-N 3.35Å | ||
| 304 | W | 93 | Very high | 91.7 | Very high | 141 Ų | 141 | 71.9 Ų | 71.9 | 53% | 0.534 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.1 | -24 | 176.9 | 68.4 | -91 | 0 | 0 | 0 | 112.8 | V205 I306 F307 M308 | V205-W304 HydrophobicContact CG1-CZ3 4.31Å; V205-W304 HydrophobicContact CG2-CH2 4.37Å; V205-W304 HydrophobicContact CG2-CZ3 4.32Å; W304-I306 PolarHBondContact O-N 3.5Å; W304-F307 PolarHBondContact O-N 2.88Å; W304-M308 HydrophobicContact CE3-CB 4.11Å; W304-M308 HydrophobicContact CE3-CG 3.47Å; W304-M308 VanDerWaalsContact CE3-CG 3.47Å; W304-M308 HydrophobicContact CZ3-CB 4.03Å; W304-M308 HydrophobicContact CZ3-CG 3.63Å; W304-M308 PolarHBondContact O-N 3.43Å; W304-M308 VanDerWaalsContact O-N 3.16Å |
| 305 | Q | 96.3 | Very high | 91.8 | Very high | 17 Ų | 17 | 66.2 Ų | 66.2 | 8% | 0.079 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -55.4 | -38.8 | 178.7 | -66.8 | 88.2 | -23.6 | 0 | 0 | 111.1 | V205 T208 W209 E303 F307 M308 L309 | V205-Q305 HydrophobicContact CG1-CB 3.66Å; V205-Q305 HydrophobicContact CG1-CG 3.89Å; T208-Q305 PolarHBondContact O-NE2 2.83Å; W209-Q305 HydrophobicContact CB-CB 4.18Å; W209-Q305 HydrophobicContact CB-CG 4.24Å; W209-Q305 HydrophobicContact CD2-CB 4.37Å; W209-Q305 HydrophobicContact CG-CB 4.11Å; E303-Q305 PolarHBondContact O-N 3.48Å; Q305-F307 PolarHBondContact O-N 3.05Å; Q305-M308 PolarHBondContact O-N 3.27Å; Q305-L309 WeakPolarHBondContact O-CB 3.47Å; Q305-L309 WeakPolarHBondContact O-CG 3.36Å; Q305-L309 PolarHBondContact O-N 2.89Å |
| 306 | I | 94.9 | Very high | 92 | Very high | 0 Ų | 0 | 65.7 Ų | 65.7 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.7 | -48.6 | -177 | -50.5 | -171.3 | 0 | 0 | 0 | 110.6 | W209 M214 L292 L295 A296 E303 W304 L309 A310 | W209-I306 HydrophobicContact CD2-CG1 4.5Å; W209-I306 HydrophobicContact CH2-CB 4.47Å; W209-I306 HydrophobicContact CH2-CD1 4.15Å; W209-I306 HydrophobicContact CH2-CG1 3.77Å; W209-I306 HydrophobicContact CH2-CG2 4.38Å; W209-I306 HydrophobicContact CZ2-CB 4.47Å; W209-I306 HydrophobicContact CZ2-CD1 3.45Å; W209-I306 VanDerWaalsContact CZ2-CD1 3.45Å; W209-I306 HydrophobicContact CZ2-CG1 3.34Å; W209-I306 HydrophobicContact CZ3-CG1 4.5Å; M214-I306 HydrophobicContact CB-CD1 3.48Å; M214-I306 VanDerWaalsContact CB-CD1 3.48Å; M214-I306 HydrophobicContact CG-CD1 3.9Å; L292-I306 HydrophobicContact CB-CG2 4.35Å; L292-I306 HydrophobicContact CD2-CG2 3.92Å; L292-I306 WeakPolarHBondContact O-CG2 3.34Å; L295-I306 HydrophobicContact CB-CG2 3.99Å; A296-I306 HydrophobicContact CB-CB 4.46Å; A296-I306 HydrophobicContact CB-CG2 3.97Å; E303-I306 HydrophobicContact CB-CD1 4.09Å; E303-I306 HydrophobicContact CB-CG1 3.96Å; E303-I306 WeakPolarHBondContact O-CG1 3.27Å; E303-I306 PolarHBondContact O-N 3.35Å; W304-I306 PolarHBondContact O-N 3.5Å; I306-L309 PolarHBondContact O-N 3.01Å; I306-A310 WeakPolarHBondContact O-CB 3.24Å; I306-A310 PolarHBondContact O-N 3.42Å |
| 307 | F | 94.8 | Very high | 92.3 | Very high | 106 Ų | 106 | 65.3 Ų | 65.3 | 47% | 0.465 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 178.1 | -178.7 | -98.6 | 0 | 0 | 0 | 111.7 | F293 W304 Q305 A310 L311 | F293-F307 HydrophobicContact CD1-CD2 4.4Å; F293-F307 HydrophobicContact CD1-CE2 4.45Å; F293-F307 HydrophobicContact CE1-CD2 4.02Å; F293-F307 AromaticContact CE1-CE2 3.8Å; F293-F307 HydrophobicContact CE1-CE2 3.8Å; W304-F307 PolarHBondContact O-N 2.88Å; Q305-F307 PolarHBondContact O-N 3.05Å; F307-A310 WeakPolarHBondContact O-CB 3.29Å; F307-A310 PolarHBondContact O-N 3.47Å; F307-L311 PolarHBondContact O-N 3.47Å |
| 308 | M | 96.9 | Very high | 92.7 | Very high | 65 Ų | 65 | 59.3 Ų | 59.3 | 32% | 0.32 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -67.3 | -39.1 | 179 | -70.1 | -60.8 | 173.1 | 0 | 0 | 112.5 | V205 W304 Q305 A310 L311 T312 | V205-M308 HydrophobicContact CG1-CB 4.24Å; W304-M308 HydrophobicContact CE3-CB 4.11Å; W304-M308 HydrophobicContact CE3-CG 3.47Å; W304-M308 VanDerWaalsContact CE3-CG 3.47Å; W304-M308 HydrophobicContact CZ3-CB 4.03Å; W304-M308 HydrophobicContact CZ3-CG 3.63Å; W304-M308 PolarHBondContact O-N 3.43Å; W304-M308 VanDerWaalsContact O-N 3.16Å; Q305-M308 PolarHBondContact O-N 3.27Å; M308-A310 VanDerWaalsContact C-N 3.34Å; M308-L311 PolarHBondContact O-N 3.4Å; M308-T312 VanDerWaalsContact O-CB 3.28Å; M308-T312 WeakPolarHBondContact O-CB 3.42Å; M308-T312 PolarHBondContact O-N 3.46Å; M308-T312 PolarHBondContact O-OG1 3.39Å |
| 309 | L | 97.1 | Very high | 93.1 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 173 | -69.4 | 169.2 | 0 | 0 | 0 | 110.8 | L202 V205 M206 W209 L292 Q305 I306 L311 T312 F313 | L202-L309 HydrophobicContact CD1-CD2 3.47Å; L202-L309 VanDerWaalsContact CD1-CD2 3.47Å; L202-L309 HydrophobicContact CG-CD2 3.98Å; L202-L309 WeakPolarHBondContact O-CD2 3.43Å; V205-L309 HydrophobicContact CB-CD2 3.86Å; V205-L309 HydrophobicContact CB-CG 4.23Å; V205-L309 HydrophobicContact CG1-CD1 4.25Å; V205-L309 HydrophobicContact CG1-CD2 3.88Å; V205-L309 HydrophobicContact CG1-CG 3.65Å; M206-L309 HydrophobicContact CB-CD2 4.38Å; M206-L309 HydrophobicContact SD-CD1 3.85Å; W209-L309 HydrophobicContact CD2-CD1 4.34Å; W209-L309 HydrophobicContact CE3-CD1 3.22Å; W209-L309 HydrophobicContact CZ3-CD1 3.37Å; L292-L309 HydrophobicContact CD1-CB 3.67Å; Q305-L309 WeakPolarHBondContact O-CB 3.47Å; Q305-L309 WeakPolarHBondContact O-CG 3.36Å; Q305-L309 PolarHBondContact O-N 2.89Å; I306-L309 PolarHBondContact O-N 3.01Å; L309-L311 PolarHBondContact O-N 3.36Å; L309-T312 PolarHBondContact O-N 3.49Å; L309-F313 WeakPolarHBondContact O-CB 3.32Å; L309-F313 VanDerWaalsContact O-CD2 3.3Å; L309-F313 WeakPolarHBondContact O-CD2 3.37Å; L309-F313 PolarHBondContact O-N 2.94Å |
| 310 | A | 97.1 | Very high | 94 | Very high | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.2 | -47.9 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | S289 L292 F293 I306 F307 M308 L314 | S289-A310 WeakPolarHBondContact CB-O 3.45Å; S289-A310 PolarHBondContact OG-O 3.4Å; L292-A310 HydrophobicContact CB-CB 3.59Å; F293-A310 HydrophobicContact CB-CB 4.49Å; F293-A310 HydrophobicContact CD1-CB 3.69Å; F293-A310 HydrophobicContact CD2-CB 3.79Å; F293-A310 HydrophobicContact CE1-CB 3.71Å; F293-A310 HydrophobicContact CE2-CB 3.83Å; F293-A310 HydrophobicContact CG-CB 3.72Å; F293-A310 HydrophobicContact CZ-CB 3.78Å; I306-A310 WeakPolarHBondContact O-CB 3.24Å; I306-A310 PolarHBondContact O-N 3.42Å; F307-A310 WeakPolarHBondContact O-CB 3.29Å; F307-A310 PolarHBondContact O-N 3.47Å; M308-A310 VanDerWaalsContact C-N 3.34Å; A310-L314 PolarHBondContact O-N 2.91Å; A310-L314 VanDerWaalsContact O-N 3.1Å |
| 311 | L | 97.7 | Very high | 94.8 | Very high | 76 Ų | 76 | 45.4 Ų | 45.4 | 40% | 0.398 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -63.8 | -43.5 | 176.5 | -177.4 | 66.6 | 0 | 0 | 0 | 111.6 | F307 M308 L309 L314 V315 | F307-L311 PolarHBondContact O-N 3.47Å; M308-L311 PolarHBondContact O-N 3.4Å; L309-L311 PolarHBondContact O-N 3.36Å; L311-L314 WeakPolarHBondContact O-CB 3.37Å; L311-L314 PolarHBondContact O-N 3.32Å; L311-V315 WeakPolarHBondContact O-CG2 3.33Å; L311-V315 PolarHBondContact O-N 3.05Å |
| 312 | T | 97.2 | Very high | 95.5 | Very high | 8 Ų | 8 | 49 Ų | 49 | 5% | 0.049 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -66.7 | -44.1 | -177 | -54.8 | 0 | 0 | 0 | 0 | 111.1 | V198 F201 L202 M308 L309 L314 V315 L316 | V198-T312 HydrophobicContact CG1-CG2 3.5Å; V198-T312 VanDerWaalsContact CG1-CG2 3.5Å; F201-T312 HydrophobicContact CD1-CG2 4.18Å; L202-T312 HydrophobicContact CB-CG2 3.72Å; L202-T312 HydrophobicContact CD1-CG2 3.61Å; L202-T312 HydrophobicContact CG-CG2 4.27Å; M308-T312 VanDerWaalsContact O-CB 3.28Å; M308-T312 WeakPolarHBondContact O-CB 3.42Å; M308-T312 PolarHBondContact O-N 3.46Å; M308-T312 PolarHBondContact O-OG1 3.39Å; L309-T312 PolarHBondContact O-N 3.49Å; T312-L314 VanDerWaalsContact C-N 3.28Å; T312-L314 PolarHBondContact O-N 3.03Å; T312-V315 PolarHBondContact O-N 3.36Å; T312-L316 VanDerWaalsContact O-CG 3.29Å; T312-L316 WeakPolarHBondContact O-CG 3.44Å; T312-L316 PolarHBondContact O-N 3.04Å |
| 313 | F | 98.1 | Very high | 96 | Very high | 1 Ų | 1 | 40.8 Ų | 40.8 | 0% | 0.004 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.8 | -35.8 | 172 | -86.8 | -65.6 | 0 | 0 | 0 | 112.6 | L202 F218 F222 F225 Q285 N288 L292 L309 L316 F317 | L202-F313 HydrophobicContact CD1-CD2 3.76Å; L202-F313 HydrophobicContact CD1-CE2 3.77Å; L202-F313 HydrophobicContact CD1-CG 4.2Å; L202-F313 HydrophobicContact CD1-CZ 4.2Å; L202-F313 HydrophobicContact CD2-CD1 4.4Å; L202-F313 HydrophobicContact CD2-CE1 3.87Å; L202-F313 HydrophobicContact CD2-CE2 4.18Å; L202-F313 HydrophobicContact CD2-CZ 3.75Å; L202-F313 HydrophobicContact CG-CE2 4.43Å; L202-F313 HydrophobicContact CG-CZ 4.46Å; F218-F313 HydrophobicContact CE1-CE2 4.22Å; F218-F313 AromaticContact CZ-CE2 3.92Å; F218-F313 HydrophobicContact CZ-CE2 3.92Å; F218-F313 HydrophobicContact CZ-CZ 4.44Å; F222-F313 HydrophobicContact CD2-CZ 4.15Å; F222-F313 HydrophobicContact CE2-CZ 4.3Å; F225-F313 HydrophobicContact CD1-CE1 4.12Å; F225-F313 HydrophobicContact CD1-CZ 4.4Å; F225-F313 AromaticContact CE1-CE1 3.74Å; F225-F313 HydrophobicContact CE1-CE1 3.74Å; F225-F313 HydrophobicContact CE1-CZ 4.39Å; F225-F313 HydrophobicContact CZ-CE1 4.22Å; Q285-F313 HydrophobicContact CB-CD1 4.33Å; Q285-F313 HydrophobicContact CG-CD1 4.41Å; N288-F313 HydrophobicContact CB-CD1 3.98Å; N288-F313 HydrophobicContact CB-CD2 4.02Å; N288-F313 HydrophobicContact CB-CE1 4.12Å; N288-F313 HydrophobicContact CB-CE2 4.15Å; N288-F313 HydrophobicContact CB-CG 3.94Å; N288-F313 HydrophobicContact CB-CZ 4.2Å; L292-F313 HydrophobicContact CD1-CD2 3.56Å; L292-F313 HydrophobicContact CD1-CE2 3.91Å; L309-F313 WeakPolarHBondContact O-CB 3.32Å; L309-F313 VanDerWaalsContact O-CD2 3.3Å; L309-F313 WeakPolarHBondContact O-CD2 3.37Å; L309-F313 PolarHBondContact O-N 2.94Å; F313-L316 PolarHBondContact O-N 2.94Å; F313-F317 WeakPolarHBondContact O-CB 3.38Å; F313-F317 PolarHBondContact O-N 2.98Å |
| 314 | L | 98.1 | Very high | 96 | Very high | 49 Ų | 49 | 39.2 Ų | 39.2 | 26% | 0.257 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -65.4 | -45.5 | 175.2 | -175.4 | 61.2 | 0 | 0 | 0 | 111.8 | L286 S289 F293 A310 L311 T312 L316 F317 L318 | L286-L314 HydrophobicContact CD1-CD1 4.07Å; S289-L314 WeakPolarHBondContact OG-CB 3.49Å; F293-L314 HydrophobicContact CE2-CD2 4.32Å; A310-L314 PolarHBondContact O-N 2.91Å; A310-L314 VanDerWaalsContact O-N 3.1Å; L311-L314 WeakPolarHBondContact O-CB 3.37Å; L311-L314 PolarHBondContact O-N 3.32Å; T312-L314 VanDerWaalsContact C-N 3.28Å; T312-L314 PolarHBondContact O-N 3.03Å; L314-L316 VanDerWaalsContact C-N 3.32Å; L314-L316 PolarHBondContact O-N 3.47Å; L314-F317 HydrophobicContact CD1-CD1 4.34Å; L314-F317 PolarHBondContact O-N 2.8Å; L314-L318 HydrophobicContact CD1-CD1 4.34Å; L314-L318 HydrophobicContact CD1-CG 4.34Å; L314-L318 HydrophobicContact CG-CD1 4.08Å; L314-L318 HydrophobicContact CG-CG 4.48Å; L314-L318 WeakPolarHBondContact O-CB 3.24Å; L314-L318 WeakPolarHBondContact O-CG 3.49Å; L314-L318 PolarHBondContact O-N 3.25Å |
| 315 | V | 98 | Very high | 95.9 | Very high | 57 Ų | 57 | 35.9 Ų | 35.9 | 35% | 0.345 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -60.7 | -44.6 | 176.6 | 170 | 0 | 0 | 0 | 0 | 110.5 | W191 V198 L311 T312 L318 G319 | W191-V315 HydrophobicContact CH2-CG1 4.32Å; W191-V315 WeakPolarHBondContact CH2-O 3.37Å; V198-V315 HydrophobicContact CG1-CG1 4.36Å; V198-V315 HydrophobicContact CG2-CG1 4.49Å; L311-V315 WeakPolarHBondContact O-CG2 3.33Å; L311-V315 PolarHBondContact O-N 3.05Å; T312-V315 PolarHBondContact O-N 3.36Å; V315-L318 PolarHBondContact O-N 3.01Å; V315-G319 PolarHBondContact O-N 3.15Å |
| 316 | L | 97.4 | Very high | 95.5 | Very high | 4 Ų | 4 | 41.4 Ų | 41.4 | 2% | 0.021 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.4 | -49.8 | 175.3 | -72.1 | 177.6 | 0 | 0 | 0 | 111.5 | H195 V198 L202 Q285 T312 F313 L314 N320 | H195-L316 WeakPolarHBondContact CD2-CD2 3.24Å; V198-L316 HydrophobicContact CB-CD2 3.94Å; V198-L316 HydrophobicContact CG1-CD1 4.41Å; V198-L316 HydrophobicContact CG1-CD2 3.52Å; V198-L316 HydrophobicContact CG1-CG 3.7Å; L202-L316 HydrophobicContact CD2-CD1 3.92Å; Q285-L316 PolarHBondContact OE1-O 3.34Å; T312-L316 VanDerWaalsContact O-CG 3.29Å; T312-L316 WeakPolarHBondContact O-CG 3.44Å; T312-L316 PolarHBondContact O-N 3.04Å; F313-L316 PolarHBondContact O-N 2.94Å; L314-L316 VanDerWaalsContact C-N 3.32Å; L314-L316 PolarHBondContact O-N 3.47Å; L316-N320 WeakPolarHBondContact O-CB 3.29Å; L316-N320 PolarHBondContact O-N 3.45Å; L316-N320 PolarHBondContact O-ND2 3.49Å; L316-N320 VanDerWaalsContact O-ND2 3.08Å |
| 317 | F | 97.7 | Very high | 95.1 | Very high | 20 Ų | 20 | 42.9 Ų | 42.9 | 9% | 0.088 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -55.7 | -55.5 | 176.5 | 164.5 | -113 | 0 | 0 | 0 | 111.4 | H282 F283 Q285 L286 F313 L314 G319 N320 F321 | H282-F317 HydrophobicContact CB-CD2 4.04Å; H282-F317 HydrophobicContact CB-CE2 4.34Å; H282-F317 WeakPolarHBondContact O-CD2 3.46Å; F283-F317 HydrophobicContact CD1-CE2 4.22Å; F283-F317 HydrophobicContact CE1-CE2 4.41Å; Q285-F317 HydrophobicContact CB-CB 4.05Å; L286-F317 HydrophobicContact CB-CB 4.38Å; L286-F317 HydrophobicContact CB-CD1 4.01Å; L286-F317 HydrophobicContact CB-CD2 3.88Å; L286-F317 HydrophobicContact CB-CE1 4.25Å; L286-F317 HydrophobicContact CB-CE2 4.1Å; L286-F317 HydrophobicContact CB-CG 3.8Å; L286-F317 HydrophobicContact CB-CZ 4.28Å; L286-F317 HydrophobicContact CD1-CD1 3.86Å; L286-F317 HydrophobicContact CD1-CE1 4.01Å; L286-F317 HydrophobicContact CD1-CG 4.45Å; L286-F317 HydrophobicContact CD2-CD1 4.4Å; L286-F317 HydrophobicContact CD2-CE1 3.87Å; L286-F317 HydrophobicContact CD2-CE2 4.35Å; L286-F317 HydrophobicContact CD2-CZ 3.83Å; L286-F317 HydrophobicContact CG-CD1 4.3Å; L286-F317 HydrophobicContact CG-CE1 4.26Å; L286-F317 HydrophobicContact CG-CZ 4.5Å; F313-F317 WeakPolarHBondContact O-CB 3.38Å; F313-F317 PolarHBondContact O-N 2.98Å; L314-F317 HydrophobicContact CD1-CD1 4.34Å; L314-F317 PolarHBondContact O-N 2.8Å; F317-G319 PolarHBondContact O-N 2.69Å; F317-N320 PolarHBondContact O-N 3.41Å; F317-F321 HydrophobicContact CD2-CB 4.24Å; F317-F321 HydrophobicContact CE2-CB 3.99Å; F317-F321 HydrophobicContact CE2-CD2 4.08Å; F317-F321 HydrophobicContact CE2-CG 4.07Å; F317-F321 HydrophobicContact CZ-CB 4.42Å; F317-F321 HydrophobicContact CZ-CD2 4.5Å; F317-F321 HydrophobicContact CZ-CG 4.28Å; F317-F321 WeakPolarHBondContact O-CB 3.29Å; F317-F321 PolarHBondContact O-N 2.72Å |
| 318 | L | 97.4 | Very high | 94.7 | Very high | 82 Ų | 82 | 39.8 Ų | 39.8 | 43% | 0.429 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.2 | -50.6 | -175.7 | -72.3 | 172.7 | 0 | 0 | 0 | 111.2 | L314 V315 L322 | L314-L318 HydrophobicContact CD1-CD1 4.34Å; L314-L318 HydrophobicContact CD1-CG 4.34Å; L314-L318 HydrophobicContact CG-CD1 4.08Å; L314-L318 HydrophobicContact CG-CG 4.48Å; L314-L318 WeakPolarHBondContact O-CB 3.24Å; L314-L318 WeakPolarHBondContact O-CG 3.49Å; L314-L318 PolarHBondContact O-N 3.25Å; V315-L318 PolarHBondContact O-N 3.01Å; L318-L322 VanDerWaalsContact O-CB 3.23Å; L318-L322 WeakPolarHBondContact O-CB 3.22Å; L318-L322 WeakPolarHBondContact O-CD1 3.31Å; L318-L322 WeakPolarHBondContact O-CG 3.49Å; L318-L322 PolarHBondContact O-N 3.49Å |
| 319 | G | 95.7 | Very high | 94.2 | Very high | 12 Ų | 12 | 41.8 Ų | 41.8 | 12% | 0.124 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -69.5 | -37.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113 | W191 V315 F317 T323 | W191-G319 VanDerWaalsContact CH2-CA 3.46Å; W191-G319 PolarHBondContact NE1-O 2.78Å; V315-G319 PolarHBondContact O-N 3.15Å; F317-G319 PolarHBondContact O-N 2.69Å; G319-T323 WeakPolarHBondContact O-CB 3.32Å; G319-T323 PolarHBondContact O-N 3.3Å; G319-T323 PolarHBondContact O-OG1 2.77Å |
| 320 | N | 94.9 | Very high | 93.6 | Very high | 3 Ų | 3 | 46.1 Ų | 46.1 | 2% | 0.016 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.5 | -47.7 | 176.3 | -75.4 | -29 | 0 | 0 | 0 | 111.4 | W191 H282 Q285 L316 F317 T323 T324 | W191-N320 VanDerWaalsContact CZ2-N 3.32Å; W191-N320 PolarHBondContact NE1-OD1 3.29Å; H282-N320 VanDerWaalsContact CE1-CB 3.48Å; H282-N320 WeakPolarHBondContact CE1-CB 3.25Å; Q285-N320 PolarHBondContact NE2-ND2 2.99Å; Q285-N320 VanDerWaalsContact NE2-ND2 3.19Å; Q285-N320 PolarHBondContact OE1-ND2 3.44Å; L316-N320 WeakPolarHBondContact O-CB 3.29Å; L316-N320 PolarHBondContact O-N 3.45Å; L316-N320 PolarHBondContact O-ND2 3.49Å; L316-N320 VanDerWaalsContact O-ND2 3.08Å; F317-N320 PolarHBondContact O-N 3.41Å; N320-T323 PolarHBondContact O-N 3.49Å; N320-T324 WeakPolarHBondContact O-CB 3.43Å; N320-T324 PolarHBondContact O-N 3.33Å; N320-T324 PolarHBondContact O-OG1 3.36Å; N320-T324 VanDerWaalsContact O-OG1 3.12Å |
| 321 | F | 95.2 | Very high | 92.8 | Very high | 49 Ų | 49 | 50.6 Ų | 50.6 | 22% | 0.215 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.1 | -50.8 | 179.7 | -175.9 | -101.1 | 0 | 0 | 0 | 111.7 | F279 F283 F317 T323 T324 L325 | F279-F321 AromaticContact CD1-CD2 3.79Å; F279-F321 HydrophobicContact CD1-CD2 3.79Å; F279-F321 AromaticContact CD1-CE2 3.7Å; F279-F321 HydrophobicContact CD1-CE2 3.7Å; F279-F321 AromaticContact CE1-CD2 3.71Å; F279-F321 HydrophobicContact CE1-CD2 3.71Å; F279-F321 AromaticContact CE1-CE2 3.54Å; F279-F321 HydrophobicContact CE1-CE2 3.54Å; F279-F321 HydrophobicContact CE1-CZ 4.45Å; F283-F321 HydrophobicContact CE2-CE2 4.46Å; F283-F321 AromaticContact CZ-CE2 3.95Å; F283-F321 HydrophobicContact CZ-CE2 3.95Å; F317-F321 HydrophobicContact CD2-CB 4.24Å; F317-F321 HydrophobicContact CE2-CB 3.99Å; F317-F321 HydrophobicContact CE2-CD2 4.08Å; F317-F321 HydrophobicContact CE2-CG 4.07Å; F317-F321 HydrophobicContact CZ-CB 4.42Å; F317-F321 HydrophobicContact CZ-CD2 4.5Å; F317-F321 HydrophobicContact CZ-CG 4.28Å; F317-F321 WeakPolarHBondContact O-CB 3.29Å; F317-F321 PolarHBondContact O-N 2.72Å; F321-T323 VanDerWaalsContact C-N 3.34Å; F321-T323 PolarHBondContact O-N 3.43Å; F321-T324 PolarHBondContact O-N 2.99Å; F321-L325 HydrophobicContact CD1-CD1 3.68Å; F321-L325 HydrophobicContact CD1-CG 4.35Å; F321-L325 HydrophobicContact CE1-CD1 3.23Å; F321-L325 HydrophobicContact CE1-CG 4.1Å; F321-L325 HydrophobicContact CZ-CD1 3.74Å; F321-L325 HydrophobicContact CZ-CG 4.25Å; F321-L325 WeakPolarHBondContact O-CB 3.1Å; F321-L325 WeakPolarHBondContact O-CG 3.34Å; F321-L325 PolarHBondContact O-N 3.5Å |
| 322 | L | 94.8 | Very high | 92 | Very high | 106 Ų | 106 | 50.3 Ų | 50.3 | 56% | 0.555 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -63.6 | -39.1 | 179.1 | -67.8 | 172.8 | 0 | 0 | 0 | 112 | L318 K326 | L318-L322 VanDerWaalsContact O-CB 3.23Å; L318-L322 WeakPolarHBondContact O-CB 3.22Å; L318-L322 WeakPolarHBondContact O-CD1 3.31Å; L318-L322 WeakPolarHBondContact O-CG 3.49Å; L318-L322 PolarHBondContact O-N 3.49Å; L322-K326 WeakPolarHBondContact O-CB 3.47Å; L322-K326 PolarHBondContact O-N 2.9Å |
| 323 | T | 92.4 | Very high | 91.1 | Very high | 21 Ų | 21 | 54 Ų | 54 | 13% | 0.129 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.5 | -43 | 177.5 | -62.4 | 0 | 0 | 0 | 0 | 111.6 | W191 W192 G319 N320 F321 K326 V327 | W191-T323 HydrophobicContact CB-CG2 4.47Å; W191-T323 VanDerWaalsContact CD1-OG1 3.25Å; W191-T323 HydrophobicContact CG-CG2 4.46Å; W191-T323 VanDerWaalsContact CG-OG1 3.28Å; W192-T323 HydrophobicContact CZ2-CG2 3.99Å; G319-T323 WeakPolarHBondContact O-CB 3.32Å; G319-T323 PolarHBondContact O-N 3.3Å; G319-T323 PolarHBondContact O-OG1 2.77Å; N320-T323 PolarHBondContact O-N 3.49Å; F321-T323 VanDerWaalsContact C-N 3.34Å; F321-T323 PolarHBondContact O-N 3.43Å; T323-K326 PolarHBondContact O-N 3.17Å; T323-V327 WeakPolarHBondContact O-CG2 3.48Å; T323-V327 PolarHBondContact O-N 3.25Å |
| 324 | T | 90.8 | Very high | 90 | Very high | 7 Ų | 7 | 60.4 Ų | 60.4 | 4% | 0.043 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -63.3 | -46.2 | 175.3 | -66.5 | 0 | 0 | 0 | 0 | 110.8 | L275 F279 H282 N320 F321 K326 V327 V328 | L275-T324 HydrophobicContact CD2-CG2 3.61Å; F279-T324 HydrophobicContact CE1-CG2 4.21Å; F279-T324 HydrophobicContact CE2-CG2 3.94Å; F279-T324 HydrophobicContact CZ-CG2 3.72Å; H282-T324 PolarHBondContact NE2-OG1 3.34Å; H282-T324 VanDerWaalsContact NE2-OG1 3.16Å; N320-T324 WeakPolarHBondContact O-CB 3.43Å; N320-T324 PolarHBondContact O-N 3.33Å; N320-T324 PolarHBondContact O-OG1 3.36Å; N320-T324 VanDerWaalsContact O-OG1 3.12Å; F321-T324 PolarHBondContact O-N 2.99Å; T324-K326 VanDerWaalsContact C-N 3.33Å; T324-K326 PolarHBondContact O-N 2.99Å; T324-V327 WeakPolarHBondContact O-CB 3.44Å; T324-V327 PolarHBondContact O-N 3.44Å; T324-V327 VanDerWaalsContact O-N 3.11Å; T324-V328 HydrophobicContact CG2-CG2 4.44Å; T324-V328 WeakPolarHBondContact O-CG2 3.2Å; T324-V328 PolarHBondContact O-N 3.31Å |
| 325 | L | 90.8 | Very high | 88.7 | Confident | 71 Ų | 71 | 64.8 Ų | 64.8 | 37% | 0.372 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -56.8 | -45.8 | 175.1 | -79.3 | 178.5 | 0 | 0 | 0 | 112.1 | F279 F321 V327 V328 H329 | F279-L325 HydrophobicContact CE1-CD2 4.3Å; F279-L325 HydrophobicContact CE1-CG 4.46Å; F279-L325 HydrophobicContact CZ-CD2 4.1Å; F321-L325 HydrophobicContact CD1-CD1 3.68Å; F321-L325 HydrophobicContact CD1-CG 4.35Å; F321-L325 HydrophobicContact CE1-CD1 3.23Å; F321-L325 HydrophobicContact CE1-CG 4.1Å; F321-L325 HydrophobicContact CZ-CD1 3.74Å; F321-L325 HydrophobicContact CZ-CG 4.25Å; F321-L325 WeakPolarHBondContact O-CB 3.1Å; F321-L325 WeakPolarHBondContact O-CG 3.34Å; F321-L325 PolarHBondContact O-N 3.5Å; L325-V327 VanDerWaalsContact C-N 3.29Å; L325-V327 PolarHBondContact O-N 3.43Å; L325-V328 PolarHBondContact O-N 3.25Å; L325-H329 WeakPolarHBondContact O-CB 3.3Å; L325-H329 PolarHBondContact O-N 3.27Å |
| 326 | K | 89.6 | Confident | 87.1 | Confident | 133 Ų | 133 | 68.2 Ų | 68.2 | 58% | 0.578 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -59.4 | -40.6 | 176.7 | -174.9 | 173.4 | -176.6 | 171.1 | 0 | 111.9 | L322 T323 T324 Q330 | L322-K326 WeakPolarHBondContact O-CB 3.47Å; L322-K326 PolarHBondContact O-N 2.9Å; T323-K326 PolarHBondContact O-N 3.17Å; T324-K326 VanDerWaalsContact C-N 3.33Å; T324-K326 PolarHBondContact O-N 2.99Å; K326-Q330 WeakPolarHBondContact O-CB 3.14Å; K326-Q330 WeakPolarHBondContact O-CG 3.31Å; K326-Q330 PolarHBondContact O-N 2.69Å |
| 327 | V | 85.9 | Confident | 85.6 | Confident | 30 Ų | 30 | 76.1 Ų | 76.1 | 18% | 0.182 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -66 | -42.6 | 176.5 | 170.8 | 0 | 0 | 0 | 0 | 111.5 | K189 L271 T323 T324 L325 K331 | K189-V327 VanDerWaalsContact NZ-CG2 3.33Å; L271-V327 HydrophobicContact CD2-CG1 3.63Å; T323-V327 WeakPolarHBondContact O-CG2 3.48Å; T323-V327 PolarHBondContact O-N 3.25Å; T324-V327 WeakPolarHBondContact O-CB 3.44Å; T324-V327 PolarHBondContact O-N 3.44Å; T324-V327 VanDerWaalsContact O-N 3.11Å; L325-V327 VanDerWaalsContact C-N 3.29Å; L325-V327 PolarHBondContact O-N 3.43Å; V327-K331 WeakPolarHBondContact O-CG 3.24Å; V327-K331 PolarHBondContact O-N 2.92Å; V327-K331 VanDerWaalsContact O-N 3.1Å |
| 328 | V | 86.4 | Confident | 83.5 | Confident | 41 Ų | 41 | 81 Ų | 81 | 25% | 0.248 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -63 | -49.9 | 177.3 | 173.8 | 0 | 0 | 0 | 0 | 110.2 | L275 T324 L325 Q330 K331 V332 | L275-V328 HydrophobicContact CD1-CG2 3.66Å; L275-V328 HydrophobicContact CD2-CG2 3.65Å; L275-V328 HydrophobicContact CG-CG2 4.33Å; T324-V328 HydrophobicContact CG2-CG2 4.44Å; T324-V328 WeakPolarHBondContact O-CG2 3.2Å; T324-V328 PolarHBondContact O-N 3.31Å; L325-V328 PolarHBondContact O-N 3.25Å; V328-Q330 PolarHBondContact O-N 3.18Å; V328-K331 PolarHBondContact O-N 2.88Å; V328-V332 HydrophobicContact CG1-CG2 4.37Å; V328-V332 WeakPolarHBondContact O-CG2 3.31Å; V328-V332 PolarHBondContact O-N 2.73Å |
| 329 | H | 86.6 | Confident | 81.1 | Confident | 108 Ų | 108 | 86.2 Ų | 86.2 | 50% | 0.5 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -58.1 | -46.3 | 178.9 | -176.1 | 72.2 | 0 | 0 | 0 | 112.3 | L325 K331 V332 Q333 | L325-H329 WeakPolarHBondContact O-CB 3.3Å; L325-H329 PolarHBondContact O-N 3.27Å; H329-K331 VanDerWaalsContact C-N 3.25Å; H329-K331 PolarHBondContact O-N 3.24Å; H329-V332 PolarHBondContact O-N 3.22Å; H329-Q333 PolarHBondContact CE1-NE2 2.74Å; H329-Q333 PolarHBondContact NE2-NE2 2.85Å; H329-Q333 WeakPolarHBondContact O-CG 3.34Å; H329-Q333 PolarHBondContact O-N 3.29Å |
| 330 | Q | 83.8 | Confident | 80.4 | Confident | 90 Ų | 90 | 89.9 Ų | 89.9 | 42% | 0.421 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.4 | -36 | 175.3 | -76.5 | 177.6 | -17.8 | 0 | 0 | 112.7 | K326 V328 K334 | K326-Q330 WeakPolarHBondContact O-CB 3.14Å; K326-Q330 WeakPolarHBondContact O-CG 3.31Å; K326-Q330 PolarHBondContact O-N 2.69Å; V328-Q330 PolarHBondContact O-N 3.18Å; Q330-K334 WeakPolarHBondContact O-CB 3.01Å; Q330-K334 PolarHBondContact O-N 2.72Å; Q330-K334 VanDerWaalsContact O-N 3.13Å |
| 331 | K | 79.9 | Confident | 79.6 | Confident | 94 Ų | 94 | 94.5 Ų | 94.5 | 41% | 0.409 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -74.5 | -37.3 | 177.8 | -80.1 | -165.6 | 176.2 | -161.2 | 0 | 112.9 | L271 V327 V328 H329 K334 K335 | L271-K331 VanDerWaalsContact CB-NZ 3.34Å; L271-K331 HydrophobicContact CD2-CD 3.78Å; L271-K331 VanDerWaalsContact CD2-CE 3.47Å; V327-K331 WeakPolarHBondContact O-CG 3.24Å; V327-K331 PolarHBondContact O-N 2.92Å; V327-K331 VanDerWaalsContact O-N 3.1Å; V328-K331 PolarHBondContact O-N 2.88Å; H329-K331 VanDerWaalsContact C-N 3.25Å; H329-K331 PolarHBondContact O-N 3.24Å; K331-K334 PolarHBondContact O-N 3.35Å; K331-K335 PolarHBondContact O-N 2.97Å; K331-K335 VanDerWaalsContact O-N 3.08Å |
| 332 | V | 81.3 | Confident | 78.7 | Confident | 70 Ų | 70 | 97 Ų | 97 | 42% | 0.424 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.8 | -50.4 | 175.7 | 173.6 | 0 | 0 | 0 | 0 | 109.9 | V328 H329 K334 K335 E336 | V328-V332 HydrophobicContact CG1-CG2 4.37Å; V328-V332 WeakPolarHBondContact O-CG2 3.31Å; V328-V332 PolarHBondContact O-N 2.73Å; H329-V332 PolarHBondContact O-N 3.22Å; V332-K334 PolarHBondContact O-N 3.21Å; V332-K335 WeakPolarHBondContact O-CB 3.44Å; V332-K335 PolarHBondContact O-N 2.88Å; V332-E336 PolarHBondContact O-N 3.4Å |
| 333 | Q | 78.3 | Confident | 77.8 | Confident | 86 Ų | 86 | 96.5 Ų | 96.5 | 40% | 0.402 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -59.2 | -34.5 | 176.6 | -74.3 | -172 | -24.9 | 0 | 0 | 113.4 | H329 K337 | H329-Q333 PolarHBondContact CE1-NE2 2.74Å; H329-Q333 PolarHBondContact NE2-NE2 2.85Å; H329-Q333 WeakPolarHBondContact O-CG 3.34Å; H329-Q333 PolarHBondContact O-N 3.29Å; Q333-K337 WeakPolarHBondContact O-CG 3.49Å; Q333-K337 PolarHBondContact O-N 2.9Å |
| 334 | K | 75.1 | Confident | 76.9 | Confident | 136 Ų | 136 | 101.2 Ų | 101.2 | 59% | 0.591 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -68.5 | -43.5 | 176.1 | -171.3 | 176 | 178.1 | -177.3 | 0 | 111.1 | Q330 K331 V332 E336 K337 D338 | Q330-K334 WeakPolarHBondContact O-CB 3.01Å; Q330-K334 PolarHBondContact O-N 2.72Å; Q330-K334 VanDerWaalsContact O-N 3.13Å; K331-K334 PolarHBondContact O-N 3.35Å; V332-K334 PolarHBondContact O-N 3.21Å; K334-E336 VanDerWaalsContact C-N 3.32Å; K334-E336 PolarHBondContact O-N 3.12Å; K334-K337 PolarHBondContact O-N 3.38Å; K334-K337 VanDerWaalsContact O-N 3.15Å; K334-D338 VanDerWaalsContact O-CG 3.26Å; K334-D338 PolarHBondContact O-N 3.29Å; K334-D338 VanDerWaalsContact O-N 3.11Å |
| 335 | K | 71.1 | Confident | 76 | Confident | 141 Ų | 141 | 107.5 Ų | 107.5 | 61% | 0.613 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.4 | -39.2 | 175.3 | -76.9 | -174.2 | 171.9 | -166.1 | 0 | 112.5 | K331 V332 K337 D338 I339 | K331-K335 PolarHBondContact O-N 2.97Å; K331-K335 VanDerWaalsContact O-N 3.08Å; V332-K335 WeakPolarHBondContact O-CB 3.44Å; V332-K335 PolarHBondContact O-N 2.88Å; K335-K337 PolarHBondContact O-N 2.84Å; K335-D338 PolarHBondContact O-N 3.13Å; K335-I339 WeakPolarHBondContact O-CD1 3.24Å; K335-I339 VanDerWaalsContact O-CG1 3.28Å; K335-I339 WeakPolarHBondContact O-CG1 3.48Å; K335-I339 PolarHBondContact O-N 3.04Å |
| 336 | E | 65.1 | Low | 74.9 | Confident | 128 Ų | 128 | 110.1 Ų | 110.1 | 60% | 0.598 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -67.3 | -21.2 | 176.2 | -72.4 | 172.7 | 169.8 | 0 | 0 | 113.8 | V332 K334 | V332-E336 PolarHBondContact O-N 3.4Å; K334-E336 VanDerWaalsContact C-N 3.32Å; K334-E336 PolarHBondContact O-N 3.12Å |
| 337 | K | 63.9 | Low | 73.8 | Confident | 170 Ų | 170 | 108.3 Ų | 108.3 | 74% | 0.739 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -90.6 | -20 | 175.1 | -72.5 | 178.9 | -179.4 | -172.7 | 0 | 113.6 | Q333 K334 K335 | Q333-K337 WeakPolarHBondContact O-CG 3.49Å; Q333-K337 PolarHBondContact O-N 2.9Å; K334-K337 PolarHBondContact O-N 3.38Å; K334-K337 VanDerWaalsContact O-N 3.15Å; K335-K337 PolarHBondContact O-N 2.84Å |
| 338 | D | 53.7 | Low | 72.8 | Confident | 122 Ų | 122 | 114.8 Ų | 114.8 | 65% | 0.652 | 55% | 0.549 | S | S | * | . | trans | -93.4 | -2.5 | 178.9 | -64.1 | -22.5 | 0 | 0 | 0 | 111.4 | K334 K335 | K334-D338 VanDerWaalsContact O-CG 3.26Å; K334-D338 PolarHBondContact O-N 3.29Å; K334-D338 VanDerWaalsContact O-N 3.11Å; K335-D338 PolarHBondContact O-N 3.13Å | ||
| 339 | I | 47.9 | Very low | 71.5 | Confident | 192 Ų | 192 | 121.5 Ų | 121.5 | 99% | 0.985 | 58% | 0.576 | S | S | * | * | trans | -103.9 | 0 | 168.8 | -63.4 | 164.9 | 0 | 0 | 0 | 107.2 | K335 | K335-I339 WeakPolarHBondContact O-CD1 3.24Å; K335-I339 VanDerWaalsContact O-CG1 3.28Å; K335-I339 WeakPolarHBondContact O-CG1 3.48Å; K335-I339 PolarHBondContact O-N 3.04Å |
Retrieved 339 of 339 residues in 100.9 ms
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