| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35 | Very low | 37.4 | Very low | 216 Ų | 216 | 141.5 Ų | 141.5 | 100% | 1.064 | 73% | 0.733 | S | S | * | * | 0 | -45.3 | 0 | -115.5 | -178 | -164.4 | 0 | 0 | 113.4 | V3 L4 C5 | M1-V3 PolarHBondContact O-N 3.24Å; M1-L4 PolarHBondContact O-N 3.4Å; M1-C5 PolarHBondContact O-N 3.49Å | |||
| 2 | L | 32.8 | Very low | 40 | Very low | 159 Ų | 159 | 135.8 Ų | 135.8 | 83% | 0.832 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -60.1 | -34.6 | -179.3 | -94.6 | 114.3 | 0 | 0 | 0 | 115.2 | L4 C5 | L2-L4 PolarHBondContact O-N 3.35Å; L2-C5 PolarHBondContact O-N 3.19Å |
| 3 | V | 35.2 | Very low | 43.3 | Very low | 119 Ų | 119 | 130.4 Ų | 130.4 | 72% | 0.721 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -72.7 | -28.1 | -179.2 | -178.9 | 0 | 0 | 0 | 0 | 113 | M1 | M1-V3 PolarHBondContact O-N 3.24Å |
| 4 | L | 32.1 | Very low | 46.4 | Very low | 142 Ų | 142 | 131.1 Ų | 131.1 | 74% | 0.743 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -79.9 | -27.5 | 175.5 | -92.1 | 143.1 | 0 | 0 | 0 | 112.2 | M1 L2 N6 R7 | M1-L4 PolarHBondContact O-N 3.4Å; L2-L4 PolarHBondContact O-N 3.35Å; L4-N6 VanDerWaalsContact C-N 3.31Å; L4-N6 PolarHBondContact O-N 2.89Å; L4-R7 PolarHBondContact O-N 3.31Å |
| 5 | C | 32.1 | Very low | 49.3 | Very low | 96 Ų | 96 | 123.6 Ų | 123.6 | 65% | 0.649 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -69.3 | -29.2 | 177.2 | -161.6 | 0 | 0 | 0 | 0 | 112.4 | M1 L2 R7 C8 | M1-C5 PolarHBondContact O-N 3.49Å; L2-C5 PolarHBondContact O-N 3.19Å; C5-R7 VanDerWaalsContact C-N 3.34Å; C5-R7 PolarHBondContact O-N 3.02Å; C5-C8 PolarHBondContact O-N 3.09Å |
| 6 | N | 30.3 | Very low | 51.8 | Low | 120 Ų | 120 | 116 Ų | 116 | 64% | 0.642 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -75.8 | -15 | 179.3 | -119.5 | 14 | 0 | 0 | 0 | 114.5 | L4 C9 | L4-N6 VanDerWaalsContact C-N 3.31Å; L4-N6 PolarHBondContact O-N 2.89Å; N6-C9 WeakPolarHBondContact O-CB 3.25Å; N6-C9 PolarHBondContact O-N 3.17Å; N6-C9 PolarHBondContact O-SG 3.18Å |
| 7 | R | 35.2 | Very low | 54 | Low | 221 Ų | 221 | 115.2 Ų | 115.2 | 83% | 0.834 | 60% | 0.595 | S | S | * | * | G | 310 helix | trans | -81 | -16.7 | 172.5 | -83.1 | -176.3 | -145.4 | -132.4 | 1.3 | 113.5 | L4 C5 C9 | L4-R7 PolarHBondContact O-N 3.31Å; C5-R7 VanDerWaalsContact C-N 3.34Å; C5-R7 PolarHBondContact O-N 3.02Å; R7-C9 PolarHBondContact O-N 3.34Å |
| 8 | C | 36 | Very low | 56.2 | Low | 110 Ų | 110 | 110.7 Ų | 110.7 | 74% | 0.743 | 57% | 0.571 | S | S | * | * | G | 310 helix | trans | -85 | 21.4 | 165.3 | -77.4 | 0 | 0 | 0 | 0 | 112.2 | C5 K10 | C5-C8 PolarHBondContact O-N 3.09Å; C8-K10 VanDerWaalsContact C-N 3.27Å; C8-K10 PolarHBondContact O-N 3.48Å |
| 9 | C | 43 | Very low | 58.2 | Low | 78 Ų | 78 | 104.9 Ų | 104.9 | 53% | 0.527 | 54% | 0.541 | S | S | . | . | trans | -52.2 | 99.1 | 163.9 | -87.2 | 0 | 0 | 0 | 0 | 107.9 | N6 R7 H11 | N6-C9 WeakPolarHBondContact O-CB 3.25Å; N6-C9 PolarHBondContact O-N 3.17Å; N6-C9 PolarHBondContact O-SG 3.18Å; R7-C9 PolarHBondContact O-N 3.34Å; C9-H11 PolarHBondContact O-N 3.01Å | ||
| 10 | K | 44.8 | Very low | 59.9 | Low | 201 Ų | 201 | 99.7 Ų | 99.7 | 87% | 0.874 | 51% | 0.514 | S | S | * | . | trans | -42.1 | 109.5 | 160.8 | -76.1 | 175.4 | 176.1 | 175.2 | 0 | 105.1 | C8 S12 | C8-K10 VanDerWaalsContact C-N 3.27Å; C8-K10 PolarHBondContact O-N 3.48Å; K10-S12 PolarHBondContact O-N 2.67Å | ||
| 11 | H | 55.2 | Low | 61.5 | Low | 94 Ų | 94 | 99.9 Ų | 99.9 | 44% | 0.435 | 51% | 0.511 | S | S | . | . | trans | -50.1 | 114.3 | 174.8 | -112.1 | -107.6 | 0 | 0 | 0 | 106.1 | C9 L13 V134 | C9-H11 PolarHBondContact O-N 3.01Å; H11-L13 PolarHBondContact O-N 2.99Å; H11-L13 VanDerWaalsContact O-N 3.13Å; H11-V134 PolarHBondContact CE1-O 2.97Å; H11-V134 PolarHBondContact ND1-O 3.34Å | ||
| 12 | S | 68.7 | Low | 64.4 | Low | 74 Ų | 74 | 89.6 Ų | 89.6 | 52% | 0.517 | 46% | 0.461 | S | S | . | . | trans | -56.6 | 125.2 | -177.6 | 55.9 | 0 | 0 | 0 | 0 | 106.6 | K10 F14 P15 | K10-S12 PolarHBondContact O-N 2.67Å; S12-F14 PolarHBondContact O-N 2.83Å; S12-F14 VanDerWaalsContact O-N 3.13Å; S12-P15 WeakPolarHBondContact O-CD 3.47Å; S12-P15 WeakPolarHBondContact OG-CD 3.38Å | ||
| 13 | L | 82 | Confident | 67.4 | Low | 65 Ų | 65 | 82.1 Ų | 82.1 | 34% | 0.34 | 42% | 0.422 | S | S | . | . | S | Bend | trans | -67.4 | -7.6 | 173.7 | -68.9 | 172.6 | 0 | 0 | 0 | 111.6 | H11 I16 F17 | H11-L13 PolarHBondContact O-N 2.99Å; H11-L13 VanDerWaalsContact O-N 3.13Å; L13-I16 WeakPolarHBondContact O-CA 3.49Å; L13-I16 WeakPolarHBondContact O-CB 3.5Å; L13-I16 PolarHBondContact O-N 3.23Å; L13-F17 HydrophobicContact CB-CD2 3.76Å; L13-F17 HydrophobicContact CB-CE2 3.55Å; L13-F17 HydrophobicContact CD1-CE2 4.13Å; L13-F17 HydrophobicContact CG-CE2 4.46Å; L13-F17 VanDerWaalsContact O-CD2 3.24Å; L13-F17 WeakPolarHBondContact O-CD2 3.23Å; L13-F17 PolarHBondContact O-N 2.96Å |
| 14 | F | 87.9 | Confident | 70.2 | Confident | 140 Ų | 140 | 78.6 Ų | 78.6 | 61% | 0.614 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -52.3 | -50.2 | -177.9 | -179.6 | -95.7 | 0 | 0 | 0 | 114.3 | S12 I16 F17 Q18 | S12-F14 PolarHBondContact O-N 2.83Å; S12-F14 VanDerWaalsContact O-N 3.13Å; F14-I16 VanDerWaalsContact C-N 3.26Å; F14-I16 PolarHBondContact O-N 3.38Å; F14-F17 PolarHBondContact O-N 3.3Å; F14-Q18 WeakPolarHBondContact O-CB 3.47Å; F14-Q18 PolarHBondContact O-N 3.39Å |
| 15 | P | 89.4 | Confident | 73.2 | Confident | 19 Ų | 19 | 72.4 Ų | 72.4 | 12% | 0.123 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -66.1 | -29.2 | 178.3 | -18.8 | 33.9 | 0 | 0 | 0 | 112.7 | S12 L19 Y130 V134 | S12-P15 WeakPolarHBondContact O-CD 3.47Å; S12-P15 WeakPolarHBondContact OG-CD 3.38Å; P15-L19 WeakPolarHBondContact O-CB 3.33Å; P15-L19 PolarHBondContact O-N 3.22Å; P15-Y130 HydrophobicContact CB-CE1 4.41Å; P15-V134 HydrophobicContact CB-CG2 4.17Å; P15-V134 HydrophobicContact CG-CG2 4.35Å |
| 16 | I | 89 | Confident | 76.3 | Confident | 2 Ų | 2 | 68 Ų | 68 | 1% | 0.01 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -67.6 | -49.2 | 174.1 | -65.8 | -63.2 | 0 | 0 | 0 | 109.6 | L13 F14 Q18 L19 S20 V134 N143 I146 V147 | L13-I16 WeakPolarHBondContact O-CA 3.49Å; L13-I16 WeakPolarHBondContact O-CB 3.5Å; L13-I16 PolarHBondContact O-N 3.23Å; F14-I16 VanDerWaalsContact C-N 3.26Å; F14-I16 PolarHBondContact O-N 3.38Å; I16-Q18 PolarHBondContact O-N 3.09Å; I16-L19 WeakPolarHBondContact O-CB 3.46Å; I16-L19 PolarHBondContact O-N 3.02Å; I16-S20 WeakPolarHBondContact O-CB 3.46Å; I16-S20 PolarHBondContact O-N 3.42Å; I16-S20 PolarHBondContact O-OG 3.37Å; I16-V134 HydrophobicContact CD1-CG1 3.4Å; I16-V134 HydrophobicContact CG1-CG1 4.19Å; I16-N143 HydrophobicContact CD1-CB 3.9Å; I16-N143 HydrophobicContact CG1-CB 4.13Å; I16-I146 HydrophobicContact CG2-CB 4.49Å; I16-I146 HydrophobicContact CG2-CG2 4.13Å; I16-V147 HydrophobicContact CG2-CG2 3.82Å |
| 17 | F | 89.9 | Confident | 79.3 | Confident | 102 Ų | 102 | 62.6 Ų | 62.6 | 45% | 0.447 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.6 | -40.9 | 176.6 | -75.3 | -64.3 | 0 | 0 | 0 | 112.7 | L13 F14 S20 F21 I146 I150 | L13-F17 HydrophobicContact CB-CD2 3.76Å; L13-F17 HydrophobicContact CB-CE2 3.55Å; L13-F17 HydrophobicContact CD1-CE2 4.13Å; L13-F17 HydrophobicContact CG-CE2 4.46Å; L13-F17 VanDerWaalsContact O-CD2 3.24Å; L13-F17 WeakPolarHBondContact O-CD2 3.23Å; L13-F17 PolarHBondContact O-N 2.96Å; F14-F17 PolarHBondContact O-N 3.3Å; F17-S20 PolarHBondContact O-N 3.34Å; F17-F21 WeakPolarHBondContact O-CB 3.26Å; F17-F21 PolarHBondContact O-N 2.94Å; F17-I146 HydrophobicContact CE1-CG2 4.22Å; F17-I150 HydrophobicContact CD1-CD1 3.85Å; F17-I150 HydrophobicContact CE1-CD1 4.05Å |
| 18 | Q | 93 | Very high | 82.1 | Confident | 35 Ų | 35 | 52.1 Ų | 52.1 | 16% | 0.164 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.5 | -45.1 | 175.5 | -175 | -178.7 | -9.8 | 0 | 0 | 111.5 | F14 I16 F21 G22 I195 L198 L199 | F14-Q18 WeakPolarHBondContact O-CB 3.47Å; F14-Q18 PolarHBondContact O-N 3.39Å; I16-Q18 PolarHBondContact O-N 3.09Å; Q18-F21 PolarHBondContact O-N 3.3Å; Q18-G22 PolarHBondContact O-N 3.1Å; Q18-I195 HydrophobicContact CG-CG2 3.8Å; Q18-I195 PolarHBondContact NE2-O 3.42Å; Q18-I195 VanDerWaalsContact NE2-O 3.1Å; Q18-I195 WeakPolarHBondContact O-CG2 3.41Å; Q18-L198 VanDerWaalsContact NE2-C 3.29Å; Q18-L198 PolarHBondContact NE2-O 2.83Å; Q18-L199 HydrophobicContact CB-CD1 3.96Å; Q18-L199 HydrophobicContact CG-CD1 3.81Å |
| 19 | L | 93.9 | Very high | 84.8 | Confident | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -58.6 | -51.1 | 173.8 | 174.5 | 68.8 | 0 | 0 | 0 | 110.9 | P15 I16 F21 G22 F23 M87 Q127 Y130 I131 V147 L196 L199 | P15-L19 WeakPolarHBondContact O-CB 3.33Å; P15-L19 PolarHBondContact O-N 3.22Å; I16-L19 WeakPolarHBondContact O-CB 3.46Å; I16-L19 PolarHBondContact O-N 3.02Å; L19-F21 VanDerWaalsContact C-N 3.33Å; L19-F21 PolarHBondContact O-N 2.75Å; L19-G22 PolarHBondContact O-N 3.48Å; L19-F23 HydrophobicContact CD1-CD2 3.68Å; L19-F23 HydrophobicContact CD1-CE2 3.49Å; L19-F23 VanDerWaalsContact CD1-CE2 3.49Å; L19-F23 HydrophobicContact CG-CD2 4.22Å; L19-F23 HydrophobicContact CG-CE2 4.4Å; L19-F23 WeakPolarHBondContact O-CD2 3.36Å; L19-F23 PolarHBondContact O-N 3.45Å; L19-M87 HydrophobicContact CD1-CE 3.94Å; L19-M87 HydrophobicContact CD1-SD 3.46Å; L19-M87 WeakPolarHBondContact CD1-SD 3.37Å; L19-Q127 HydrophobicContact CD2-CG 4.33Å; L19-Y130 HydrophobicContact CD2-CD1 3.93Å; L19-I131 HydrophobicContact CD2-CD1 4.22Å; L19-I131 HydrophobicContact CD2-CG1 3.69Å; L19-V147 HydrophobicContact CD2-CG2 4.35Å; L19-L196 HydrophobicContact CD1-CD2 3.86Å; L19-L199 HydrophobicContact CB-CD2 4.47Å; L19-L199 HydrophobicContact CD1-CD2 4.15Å |
| 20 | S | 92.9 | Very high | 87.2 | Confident | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.007 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.1 | -42.6 | 179.9 | -58.3 | 0 | 0 | 0 | 0 | 112.4 | I16 F17 F23 Y24 V147 I150 | I16-S20 WeakPolarHBondContact O-CB 3.46Å; I16-S20 PolarHBondContact O-N 3.42Å; I16-S20 PolarHBondContact O-OG 3.37Å; F17-S20 PolarHBondContact O-N 3.34Å; S20-F23 PolarHBondContact O-N 3.44Å; S20-Y24 VanDerWaalsContact O-CB 3.25Å; S20-Y24 WeakPolarHBondContact O-CB 3.34Å; S20-Y24 PolarHBondContact O-N 3.4Å; S20-V147 WeakPolarHBondContact OG-CA 3.29Å; S20-V147 WeakPolarHBondContact OG-CG2 3.41Å; S20-I150 VanDerWaalsContact CB-CD1 3.49Å |
| 21 | F | 94.1 | Very high | 89.4 | Confident | 103 Ų | 103 | 35.1 Ų | 35.1 | 45% | 0.452 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -68.2 | -38.3 | 179.6 | -171.6 | -118.2 | 0 | 0 | 0 | 112.2 | F17 Q18 L19 Y24 L25 I195 | F17-F21 WeakPolarHBondContact O-CB 3.26Å; F17-F21 PolarHBondContact O-N 2.94Å; Q18-F21 PolarHBondContact O-N 3.3Å; L19-F21 VanDerWaalsContact C-N 3.33Å; L19-F21 PolarHBondContact O-N 2.75Å; F21-Y24 HydrophobicContact CD2-CD1 4.21Å; F21-Y24 HydrophobicContact CE2-CD1 4.24Å; F21-Y24 HydrophobicContact CE2-CE1 4.49Å; F21-Y24 PolarHBondContact O-N 3.09Å; F21-L25 HydrophobicContact CD1-CD1 4.41Å; F21-L25 HydrophobicContact CE1-CD1 4.01Å; F21-L25 HydrophobicContact CZ-CD1 4.18Å; F21-L25 HydrophobicContact CZ-CG 4.48Å; F21-L25 WeakPolarHBondContact O-CG 3.34Å; F21-L25 PolarHBondContact O-N 3.16Å; F21-I195 HydrophobicContact CD1-CD1 3.68Å; F21-I195 HydrophobicContact CE1-CD1 3.71Å |
| 22 | G | 95 | Very high | 91.1 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.8 | -47 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q18 L19 L25 I26 | Q18-G22 PolarHBondContact O-N 3.1Å; L19-G22 PolarHBondContact O-N 3.48Å; G22-L25 PolarHBondContact O-N 3.02Å; G22-I26 WeakPolarHBondContact O-CG1 3.27Å; G22-I26 PolarHBondContact O-N 3.43Å |
| 23 | F | 94.9 | Very high | 92.1 | Very high | 2 Ų | 2 | 27.1 Ų | 27.1 | 1% | 0.009 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -63.5 | -42 | 176.4 | -90.6 | -109.3 | 0 | 0 | 0 | 112.7 | L19 S20 L25 I26 L27 M87 L123 Q127 L196 | L19-F23 HydrophobicContact CD1-CD2 3.68Å; L19-F23 HydrophobicContact CD1-CE2 3.49Å; L19-F23 VanDerWaalsContact CD1-CE2 3.49Å; L19-F23 HydrophobicContact CG-CD2 4.22Å; L19-F23 HydrophobicContact CG-CE2 4.4Å; L19-F23 WeakPolarHBondContact O-CD2 3.36Å; L19-F23 PolarHBondContact O-N 3.45Å; S20-F23 PolarHBondContact O-N 3.44Å; F23-L25 PolarHBondContact O-N 3.48Å; F23-I26 PolarHBondContact O-N 2.9Å; F23-L27 HydrophobicContact CB-CD1 4.29Å; F23-L27 HydrophobicContact CD1-CD1 3.8Å; F23-L27 VanDerWaalsContact O-CB 3.28Å; F23-L27 WeakPolarHBondContact O-CB 3.42Å; F23-L27 WeakPolarHBondContact O-CG 3.5Å; F23-L27 PolarHBondContact O-N 3.23Å; F23-M87 HydrophobicContact CE2-CG 4.45Å; F23-M87 HydrophobicContact CE2-SD 3.81Å; F23-M87 HydrophobicContact CZ-CG 4.41Å; F23-M87 HydrophobicContact CZ-SD 4.14Å; F23-L123 HydrophobicContact CD1-CD2 4.13Å; F23-L123 HydrophobicContact CE1-CD2 3.21Å; F23-L123 HydrophobicContact CE1-CG 4.06Å; F23-L123 HydrophobicContact CZ-CD2 3.47Å; F23-L123 VanDerWaalsContact CZ-CD2 3.47Å; F23-L123 HydrophobicContact CZ-CG 3.78Å; F23-Q127 HydrophobicContact CD1-CG 4.39Å; F23-Q127 HydrophobicContact CE1-CB 3.85Å; F23-Q127 HydrophobicContact CE1-CG 3.76Å; F23-Q127 HydrophobicContact CE2-CB 4.21Å; F23-Q127 HydrophobicContact CE2-CG 4.09Å; F23-Q127 HydrophobicContact CZ-CB 3.48Å; F23-Q127 VanDerWaalsContact CZ-CB 3.48Å; F23-Q127 HydrophobicContact CZ-CG 3.65Å; F23-L196 HydrophobicContact CD2-CD1 4.27Å; F23-L196 HydrophobicContact CD2-CD2 4.01Å; F23-L196 HydrophobicContact CE2-CD1 3.99Å; F23-L196 HydrophobicContact CE2-CD2 4.04Å |
| 24 | Y | 95.4 | Very high | 92.5 | Very high | 46 Ų | 46 | 24.1 Ų | 24.1 | 18% | 0.18 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -54.7 | -49.4 | 177.3 | 167.1 | -95 | 0 | 0 | 0 | 111.6 | S20 F21 L27 T28 F153 T157 | S20-Y24 VanDerWaalsContact O-CB 3.25Å; S20-Y24 WeakPolarHBondContact O-CB 3.34Å; S20-Y24 PolarHBondContact O-N 3.4Å; F21-Y24 HydrophobicContact CD2-CD1 4.21Å; F21-Y24 HydrophobicContact CE2-CD1 4.24Å; F21-Y24 HydrophobicContact CE2-CE1 4.49Å; F21-Y24 PolarHBondContact O-N 3.09Å; Y24-L27 PolarHBondContact O-N 3.4Å; Y24-T28 WeakPolarHBondContact O-CB 3.49Å; Y24-T28 PolarHBondContact O-N 3.5Å; Y24-T28 PolarHBondContact O-OG1 2.92Å; Y24-F153 HydrophobicContact CE2-CB 4.31Å; Y24-T157 VanDerWaalsContact OH-CB 3.31Å; Y24-T157 WeakPolarHBondContact OH-CB 3.4Å; Y24-T157 WeakPolarHBondContact OH-CG2 3.05Å; Y24-T157 PolarHBondContact OH-OG1 3.19Å |
| 25 | L | 95.5 | Very high | 92.5 | Very high | 11 Ų | 11 | 17.6 Ų | 17.6 | 6% | 0.058 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -64.8 | -44.6 | -179.8 | -68.2 | 169.8 | 0 | 0 | 0 | 113.1 | F21 G22 F23 L27 A29 M188 M191 I195 | F21-L25 HydrophobicContact CD1-CD1 4.41Å; F21-L25 HydrophobicContact CE1-CD1 4.01Å; F21-L25 HydrophobicContact CZ-CD1 4.18Å; F21-L25 HydrophobicContact CZ-CG 4.48Å; F21-L25 WeakPolarHBondContact O-CG 3.34Å; F21-L25 PolarHBondContact O-N 3.16Å; G22-L25 PolarHBondContact O-N 3.02Å; F23-L25 PolarHBondContact O-N 3.48Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-A29 PolarHBondContact O-N 3.48Å; L25-M188 HydrophobicContact CD2-CE 4.49Å; L25-M191 HydrophobicContact CD1-CB 4.47Å; L25-M191 HydrophobicContact CD1-CE 3.58Å; L25-M191 HydrophobicContact CD1-CG 4.11Å; L25-M191 HydrophobicContact CD2-CE 3.76Å; L25-M191 HydrophobicContact CG-CE 4.31Å; L25-I195 HydrophobicContact CD1-CD1 3.46Å; L25-I195 VanDerWaalsContact CD1-CD1 3.46Å |
| 26 | I | 95.8 | Very high | 92.4 | Very high | 4 Ų | 4 | 16.9 Ų | 16.9 | 2% | 0.021 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -61 | -46.1 | 178.5 | -69.9 | 170.7 | 0 | 0 | 0 | 110.1 | G22 F23 A29 F30 A91 N94 L123 L196 | G22-I26 WeakPolarHBondContact O-CG1 3.27Å; G22-I26 PolarHBondContact O-N 3.43Å; F23-I26 PolarHBondContact O-N 2.9Å; I26-A29 PolarHBondContact O-N 2.93Å; I26-F30 PolarHBondContact O-N 2.93Å; I26-A91 HydrophobicContact CD1-CB 3.57Å; I26-N94 HydrophobicContact CG2-CB 4.28Å; I26-N94 WeakPolarHBondContact CG2-ND2 3.31Å; I26-N94 PolarHBondContact O-ND2 2.9Å; I26-L123 HydrophobicContact CG2-CD1 4.47Å; I26-L196 HydrophobicContact CD1-CD1 3.51Å; I26-L196 HydrophobicContact CD1-CG 4.42Å |
| 27 | L | 92.6 | Very high | 92.3 | Very high | 7 Ų | 7 | 16.8 Ų | 16.8 | 4% | 0.037 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -83.9 | -28.2 | -172.4 | -67.7 | 163.5 | 0 | 0 | 0 | 113.2 | F23 Y24 L25 A29 F30 Q31 W124 F151 | F23-L27 HydrophobicContact CB-CD1 4.29Å; F23-L27 HydrophobicContact CD1-CD1 3.8Å; F23-L27 VanDerWaalsContact O-CB 3.28Å; F23-L27 WeakPolarHBondContact O-CB 3.42Å; F23-L27 WeakPolarHBondContact O-CG 3.5Å; F23-L27 PolarHBondContact O-N 3.23Å; Y24-L27 PolarHBondContact O-N 3.4Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L27-A29 PolarHBondContact O-N 3.3Å; L27-F30 HydrophobicContact CD2-CB 4.48Å; L27-F30 HydrophobicContact CD2-CD1 4.15Å; L27-F30 PolarHBondContact O-N 3.49Å; L27-Q31 VanDerWaalsContact O-CB 3.24Å; L27-Q31 WeakPolarHBondContact O-CB 3.46Å; L27-Q31 VanDerWaalsContact O-CG 3.24Å; L27-Q31 WeakPolarHBondContact O-CG 3.33Å; L27-Q31 PolarHBondContact O-N 2.93Å; L27-W124 HydrophobicContact CD1-CH2 4.01Å; L27-W124 HydrophobicContact CD1-CZ2 4.04Å; L27-W124 HydrophobicContact CD2-CZ2 4.18Å; L27-F151 HydrophobicContact CB-CD2 3.84Å; L27-F151 HydrophobicContact CB-CE2 3.53Å; L27-F151 HydrophobicContact CD1-CD2 3.21Å; L27-F151 HydrophobicContact CD1-CE2 3.17Å; L27-F151 HydrophobicContact CD1-CG 4.15Å; L27-F151 HydrophobicContact CD1-CZ 4.02Å; L27-F151 HydrophobicContact CD2-CE2 4.14Å; L27-F151 HydrophobicContact CG-CD2 4.06Å; L27-F151 HydrophobicContact CG-CE2 3.74Å |
| 28 | T | 94.3 | Very high | 92.1 | Very high | 1 Ų | 1 | 12 Ų | 12 | 1% | 0.006 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -54.6 | -46.2 | 167.1 | -72.5 | 0 | 0 | 0 | 0 | 109.8 | Y24 S32 S154 T157 M188 | Y24-T28 WeakPolarHBondContact O-CB 3.49Å; Y24-T28 PolarHBondContact O-N 3.5Å; Y24-T28 PolarHBondContact O-OG1 2.92Å; T28-S32 WeakPolarHBondContact O-CB 3.35Å; T28-S32 PolarHBondContact O-N 3.29Å; T28-S32 PolarHBondContact O-OG 3.18Å; T28-S154 VanDerWaalsContact OG1-CA 3.24Å; T28-S154 WeakPolarHBondContact OG1-CA 3.1Å; T28-S154 WeakPolarHBondContact OG1-CB 3.44Å; T28-S154 PolarHBondContact OG1-O 2.81Å; T28-S154 VanDerWaalsContact OG1-O 3.06Å; T28-T157 HydrophobicContact CG2-CG2 4.32Å; T28-M188 HydrophobicContact CG2-CE 3.56Å |
| 29 | A | 94.1 | Very high | 91.7 | Very high | 0 Ų | 0 | 11.9 Ų | 11.9 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -67.8 | -48.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L25 I26 L27 C33 L98 F185 | L25-A29 PolarHBondContact O-N 3.48Å; I26-A29 PolarHBondContact O-N 2.93Å; L27-A29 PolarHBondContact O-N 3.3Å; A29-C33 WeakPolarHBondContact O-CB 3.37Å; A29-C33 PolarHBondContact O-N 3.08Å; A29-L98 HydrophobicContact CB-CD1 3.63Å; A29-F185 HydrophobicContact CB-CB 3.83Å; A29-F185 HydrophobicContact CB-CD1 4.2Å; A29-F185 HydrophobicContact CB-CG 4.07Å |
| 30 | F | 92.4 | Very high | 91.1 | Very high | 18 Ų | 18 | 12.2 Ų | 12.2 | 8% | 0.079 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -64.8 | -48.8 | -177.6 | 175.8 | -104.2 | 0 | 0 | 0 | 113.2 | I26 L27 S32 C33 S34 Y97 L116 | I26-F30 PolarHBondContact O-N 2.93Å; L27-F30 HydrophobicContact CD2-CB 4.48Å; L27-F30 HydrophobicContact CD2-CD1 4.15Å; L27-F30 PolarHBondContact O-N 3.49Å; F30-S32 PolarHBondContact O-N 3.01Å; F30-C33 WeakPolarHBondContact O-CB 3.34Å; F30-C33 PolarHBondContact O-N 2.67Å; F30-S34 PolarHBondContact O-N 3.34Å; F30-Y97 HydrophobicContact CD2-CD1 4.49Å; F30-Y97 HydrophobicContact CD2-CE1 4.35Å; F30-Y97 HydrophobicContact CE2-CE1 4.31Å; F30-L116 HydrophobicContact CD2-CD2 3.96Å; F30-L116 HydrophobicContact CE2-CD2 3.55Å |
| 31 | Q | 90.5 | Very high | 90.6 | Very high | 14 Ų | 14 | 12.2 Ų | 12.2 | 7% | 0.065 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -66.8 | -37.7 | -178.9 | -65.2 | -71.3 | -0.7 | 0 | 0 | 111.8 | L27 S34 V35 L155 | L27-Q31 VanDerWaalsContact O-CB 3.24Å; L27-Q31 WeakPolarHBondContact O-CB 3.46Å; L27-Q31 VanDerWaalsContact O-CG 3.24Å; L27-Q31 WeakPolarHBondContact O-CG 3.33Å; L27-Q31 PolarHBondContact O-N 2.93Å; Q31-S34 PolarHBondContact O-N 3.38Å; Q31-S34 PolarHBondContact O-OG 3.05Å; Q31-V35 WeakPolarHBondContact O-CG2 3.47Å; Q31-V35 PolarHBondContact O-N 2.9Å; Q31-L155 HydrophobicContact CB-CD2 3.65Å; Q31-L155 HydrophobicContact CG-CD2 4.05Å |
| 32 | S | 91.6 | Very high | 90 | Very high | 0 Ų | 0 | 8.2 Ų | 8.2 | 0% | 0 | 4% | 0.038 | C | C | . | . | H | α-helix | trans | -66.9 | -41 | 174.6 | -57.7 | 0 | 0 | 0 | 0 | 111.2 | T28 F30 V35 I36 G158 | T28-S32 WeakPolarHBondContact O-CB 3.35Å; T28-S32 PolarHBondContact O-N 3.29Å; T28-S32 PolarHBondContact O-OG 3.18Å; F30-S32 PolarHBondContact O-N 3.01Å; S32-V35 PolarHBondContact O-N 3.34Å; S32-I36 WeakPolarHBondContact O-CG1 3.12Å; S32-I36 PolarHBondContact O-N 3.47Å; S32-G158 WeakPolarHBondContact OG-CA 3.42Å |
| 33 | C | 90.7 | Very high | 89.2 | Confident | 0 Ų | 0 | 9.5 Ų | 9.5 | 0% | 0 | 5% | 0.047 | C | C | . | . | H | α-helix | trans | -59.5 | -47.5 | 174.7 | 176.1 | 0 | 0 | 0 | 0 | 111.6 | A29 F30 V35 I36 Q37 L98 F101 F182 | A29-C33 WeakPolarHBondContact O-CB 3.37Å; A29-C33 PolarHBondContact O-N 3.08Å; F30-C33 WeakPolarHBondContact O-CB 3.34Å; F30-C33 PolarHBondContact O-N 2.67Å; C33-V35 PolarHBondContact O-N 2.71Å; C33-I36 PolarHBondContact O-N 2.68Å; C33-Q37 VanDerWaalsContact O-CB 3.23Å; C33-Q37 WeakPolarHBondContact O-CB 3.22Å; C33-Q37 WeakPolarHBondContact O-CG 3.4Å; C33-Q37 PolarHBondContact O-N 2.82Å; C33-L98 HydrophobicContact CB-CD2 3.73Å; C33-F101 VanDerWaalsContact SG-CE2 3.6Å; C33-F182 HydrophobicContact CB-CE1 4.34Å |
| 34 | S | 89 | Confident | 88.4 | Confident | 1 Ų | 1 | 10 Ų | 10 | 1% | 0.007 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -59.9 | -32.2 | -176.6 | 62.3 | 0 | 0 | 0 | 0 | 113 | F30 Q31 Q37 | F30-S34 PolarHBondContact O-N 3.34Å; Q31-S34 PolarHBondContact O-N 3.38Å; Q31-S34 PolarHBondContact O-OG 3.05Å; S34-Q37 WeakPolarHBondContact O-CG 3.44Å |
| 35 | V | 87.8 | Confident | 87.6 | Confident | 4 Ų | 4 | 10.3 Ų | 10.3 | 2% | 0.024 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -77.4 | -40.5 | 178.2 | 176.9 | 0 | 0 | 0 | 0 | 112 | Q31 S32 C33 S271 L292 I296 | Q31-V35 WeakPolarHBondContact O-CG2 3.47Å; Q31-V35 PolarHBondContact O-N 2.9Å; S32-V35 PolarHBondContact O-N 3.34Å; C33-V35 PolarHBondContact O-N 2.71Å; V35-S271 WeakPolarHBondContact CG2-O 3.19Å; V35-L292 HydrophobicContact CG1-CD1 3.46Å; V35-L292 VanDerWaalsContact CG1-CD1 3.46Å; V35-L292 HydrophobicContact CG1-CG 4.09Å; V35-I296 HydrophobicContact CB-CD1 3.82Å; V35-I296 HydrophobicContact CB-CG1 4.07Å; V35-I296 HydrophobicContact CG1-CD1 3.68Å; V35-I296 HydrophobicContact CG1-CG1 3.72Å; V35-I296 HydrophobicContact CG2-CD1 4.21Å; V35-I296 HydrophobicContact CG2-CG1 4.02Å |
| 36 | I | 87.4 | Confident | 86.5 | Confident | 3 Ų | 3 | 15.3 Ų | 15.3 | 2% | 0.015 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -88.3 | -17.9 | -175.6 | 70 | 179 | 0 | 0 | 0 | 114.3 | S32 C33 V38 R39 T40 L162 I181 F182 F185 L292 | S32-I36 WeakPolarHBondContact O-CG1 3.12Å; S32-I36 PolarHBondContact O-N 3.47Å; C33-I36 PolarHBondContact O-N 2.68Å; I36-V38 PolarHBondContact O-N 2.7Å; I36-R39 PolarHBondContact O-N 3.31Å; I36-T40 WeakPolarHBondContact O-CB 3.2Å; I36-T40 PolarHBondContact O-N 3.32Å; I36-T40 PolarHBondContact O-OG1 3.46Å; I36-L162 HydrophobicContact CD1-CD2 3.97Å; I36-L162 HydrophobicContact CG2-CD1 3.58Å; I36-L162 HydrophobicContact CG2-CD2 4.33Å; I36-I181 HydrophobicContact CD1-CG2 3.97Å; I36-F182 HydrophobicContact CD1-CZ 4.11Å; I36-F182 HydrophobicContact CG1-CZ 4.36Å; I36-F185 HydrophobicContact CD1-CE2 4.11Å; I36-L292 HydrophobicContact CG2-CD2 4.09Å |
| 37 | Q | 87 | Confident | 85.2 | Confident | 0 Ų | 0 | 19.2 Ų | 19.2 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.1 | -34.7 | -168.2 | 63.5 | -178.3 | 53.1 | 0 | 0 | 113.9 | C33 S34 T40 S41 G56 L60 Y97 F101 | C33-Q37 VanDerWaalsContact O-CB 3.23Å; C33-Q37 WeakPolarHBondContact O-CB 3.22Å; C33-Q37 WeakPolarHBondContact O-CG 3.4Å; C33-Q37 PolarHBondContact O-N 2.82Å; S34-Q37 WeakPolarHBondContact O-CG 3.44Å; Q37-T40 PolarHBondContact O-N 2.99Å; Q37-S41 WeakPolarHBondContact O-CB 3.32Å; Q37-S41 PolarHBondContact O-N 2.85Å; Q37-S41 PolarHBondContact O-OG 3.21Å; Q37-G56 PolarHBondContact NE2-O 3.47Å; Q37-L60 VanDerWaalsContact NE2-CD2 3.29Å; Q37-Y97 PolarHBondContact NE2-OH 3.5Å; Q37-Y97 PolarHBondContact OE1-OH 3Å; Q37-F101 HydrophobicContact CB-CE1 3.9Å; Q37-F101 HydrophobicContact CB-CZ 3.9Å |
| 38 | V | 86.7 | Confident | 84.1 | Confident | 2 Ų | 2 | 22.1 Ų | 22.1 | 1% | 0.012 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -65.7 | -51.7 | 178.1 | 176.1 | 0 | 0 | 0 | 0 | 110 | I36 T40 S41 V42 Y57 T276 F280 | I36-V38 PolarHBondContact O-N 2.7Å; V38-T40 VanDerWaalsContact C-N 3.27Å; V38-T40 PolarHBondContact O-N 3.5Å; V38-S41 PolarHBondContact O-N 3.47Å; V38-V42 WeakPolarHBondContact O-CG2 3.37Å; V38-V42 PolarHBondContact O-N 3.39Å; V38-Y57 HydrophobicContact CG1-CD2 3.93Å; V38-Y57 HydrophobicContact CG1-CE2 3.58Å; V38-Y57 HydrophobicContact CG2-CD1 3.99Å; V38-Y57 HydrophobicContact CG2-CD2 4.2Å; V38-Y57 HydrophobicContact CG2-CE1 4.03Å; V38-Y57 HydrophobicContact CG2-CE2 4.25Å; V38-Y57 HydrophobicContact CG2-CG 4.09Å; V38-T276 HydrophobicContact CB-CG2 3.57Å; V38-T276 HydrophobicContact CG1-CG2 3.64Å; V38-T276 HydrophobicContact CG2-CG2 3.96Å; V38-F280 HydrophobicContact CG1-CE2 4.35Å; V38-F280 HydrophobicContact CG1-CZ 4.43Å |
| 39 | R | 83.4 | Confident | 82.8 | Confident | 33 Ų | 33 | 25 Ų | 25 | 13% | 0.125 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -55.6 | -44.6 | 175.3 | 172.9 | -173.1 | -91.9 | -64.9 | 12.4 | 111.5 | I36 V42 S43 I173 S279 F280 | I36-R39 PolarHBondContact O-N 3.31Å; R39-V42 PolarHBondContact O-N 2.96Å; R39-S43 WeakPolarHBondContact O-CB 3.38Å; R39-S43 PolarHBondContact O-N 3.36Å; R39-I173 VanDerWaalsContact CD-CD1 3.49Å; R39-I173 HydrophobicContact CG-CD1 3.52Å; R39-S279 PolarHBondContact NE-OG 3.39Å; R39-S279 VanDerWaalsContact NH2-CB 3.33Å; R39-S279 PolarHBondContact NH2-O 2.96Å; R39-S279 PolarHBondContact NH2-OG 3.3Å; R39-F280 HydrophobicContact CB-CE1 4.3Å; R39-F280 HydrophobicContact CG-CE1 4.42Å |
| 40 | T | 83.1 | Confident | 81.6 | Confident | 6 Ų | 6 | 27.6 Ų | 27.6 | 4% | 0.037 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.7 | -42 | -179.3 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | I36 Q37 V38 S43 I44 V178 F182 | I36-T40 WeakPolarHBondContact O-CB 3.2Å; I36-T40 PolarHBondContact O-N 3.32Å; I36-T40 PolarHBondContact O-OG1 3.46Å; Q37-T40 PolarHBondContact O-N 2.99Å; V38-T40 VanDerWaalsContact C-N 3.27Å; V38-T40 PolarHBondContact O-N 3.5Å; T40-S43 PolarHBondContact O-N 3.48Å; T40-I44 HydrophobicContact CG2-CD1 3.5Å; T40-I44 HydrophobicContact CG2-CG1 4.46Å; T40-I44 WeakPolarHBondContact O-CD1 3.22Å; T40-I44 VanDerWaalsContact O-CG1 3.27Å; T40-I44 WeakPolarHBondContact O-CG1 3.14Å; T40-I44 PolarHBondContact O-N 3.09Å; T40-V178 HydrophobicContact CG2-CG1 3.54Å; T40-V178 HydrophobicContact CG2-CG2 4.4Å; T40-F182 HydrophobicContact CG2-CE2 4.12Å |
| 41 | S | 81.9 | Confident | 80.7 | Confident | 1 Ų | 1 | 26.9 Ų | 26.9 | 1% | 0.007 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.5 | -44.7 | 177.9 | -57.7 | 0 | 0 | 0 | 0 | 111.7 | Q37 V38 I44 N45 G56 | Q37-S41 WeakPolarHBondContact O-CB 3.32Å; Q37-S41 PolarHBondContact O-N 2.85Å; Q37-S41 PolarHBondContact O-OG 3.21Å; V38-S41 PolarHBondContact O-N 3.47Å; S41-I44 PolarHBondContact O-N 2.97Å; S41-N45 WeakPolarHBondContact O-CB 3.32Å; S41-N45 PolarHBondContact O-N 2.9Å; S41-G56 PolarHBondContact OG-N 3.2Å |
| 42 | V | 81.8 | Confident | 80.3 | Confident | 19 Ų | 19 | 29.8 Ų | 29.8 | 12% | 0.115 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.8 | -45.1 | 176 | 173 | 0 | 0 | 0 | 0 | 111.1 | V38 R39 I44 N45 V46 S53 F280 | V38-V42 WeakPolarHBondContact O-CG2 3.37Å; V38-V42 PolarHBondContact O-N 3.39Å; R39-V42 PolarHBondContact O-N 2.96Å; V42-I44 PolarHBondContact O-N 3.48Å; V42-N45 PolarHBondContact O-N 3.12Å; V42-V46 WeakPolarHBondContact O-CG2 3.38Å; V42-V46 PolarHBondContact O-N 3.31Å; V42-V46 VanDerWaalsContact O-N 3.1Å; V42-S53 WeakPolarHBondContact CG2-O 3.27Å; V42-F280 HydrophobicContact CB-CZ 4.19Å; V42-F280 HydrophobicContact CG1-CZ 4.43Å; V42-F280 HydrophobicContact CG2-CZ 3.9Å |
| 43 | S | 78 | Confident | 79.5 | Confident | 27 Ų | 27 | 32.4 Ų | 32.4 | 19% | 0.189 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.2 | -33.6 | 177.7 | -171 | 0 | 0 | 0 | 0 | 113 | R39 T40 T47 | R39-S43 WeakPolarHBondContact O-CB 3.38Å; R39-S43 PolarHBondContact O-N 3.36Å; T40-S43 PolarHBondContact O-N 3.48Å; S43-T47 WeakPolarHBondContact O-CG2 3.22Å; S43-T47 PolarHBondContact O-N 3.3Å; S43-T47 PolarHBondContact O-OG1 2.98Å |
| 44 | I | 77.6 | Confident | 79.2 | Confident | 14 Ų | 14 | 36.1 Ų | 36.1 | 7% | 0.072 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -80.9 | -37.2 | 179.6 | -68.5 | 160.5 | 0 | 0 | 0 | 111.3 | T40 S41 V42 V46 T47 A48 V51 I104 L175 | T40-I44 HydrophobicContact CG2-CD1 3.5Å; T40-I44 HydrophobicContact CG2-CG1 4.46Å; T40-I44 WeakPolarHBondContact O-CD1 3.22Å; T40-I44 VanDerWaalsContact O-CG1 3.27Å; T40-I44 WeakPolarHBondContact O-CG1 3.14Å; T40-I44 PolarHBondContact O-N 3.09Å; S41-I44 PolarHBondContact O-N 2.97Å; V42-I44 PolarHBondContact O-N 3.48Å; I44-V46 VanDerWaalsContact C-N 3.31Å; I44-V46 PolarHBondContact O-N 2.89Å; I44-T47 WeakPolarHBondContact CA-OG1 3.47Å; I44-T47 PolarHBondContact O-N 2.66Å; I44-T47 PolarHBondContact O-OG1 3.08Å; I44-A48 HydrophobicContact CG2-CB 4.47Å; I44-A48 PolarHBondContact O-N 3.33Å; I44-V51 HydrophobicContact CG2-CB 4.46Å; I44-V51 HydrophobicContact CG2-CG2 3.82Å; I44-I104 HydrophobicContact CD1-CD1 3.61Å; I44-I104 HydrophobicContact CD1-CG2 4.06Å; I44-I104 HydrophobicContact CG2-CG2 3.68Å; I44-L175 HydrophobicContact CG1-CD2 3.68Å |
| 45 | N | 78.9 | Confident | 79.1 | Confident | 52 Ų | 52 | 36 Ų | 36 | 28% | 0.278 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -55.6 | -48.8 | 172.3 | 174.3 | -64.6 | 0 | 0 | 0 | 110.4 | S41 V42 T47 G49 V51 S53 | S41-N45 WeakPolarHBondContact O-CB 3.32Å; S41-N45 PolarHBondContact O-N 2.9Å; V42-N45 PolarHBondContact O-N 3.12Å; N45-T47 VanDerWaalsContact C-N 3.29Å; N45-T47 PolarHBondContact O-N 2.63Å; N45-G49 VanDerWaalsContact O-CA 3.27Å; N45-G49 WeakPolarHBondContact O-CA 3.32Å; N45-G49 PolarHBondContact O-N 2.65Å; N45-V51 WeakPolarHBondContact CB-O 3.33Å; N45-V51 PolarHBondContact ND2-O 3.33Å; N45-S53 PolarHBondContact ND2-N 3.17Å |
| 46 | V | 71.1 | Confident | 79.1 | Confident | 115 Ų | 115 | 35.9 Ų | 35.9 | 70% | 0.697 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -62.7 | -34.2 | -179.4 | 173.8 | 0 | 0 | 0 | 0 | 112.5 | V42 I44 | V42-V46 WeakPolarHBondContact O-CG2 3.38Å; V42-V46 PolarHBondContact O-N 3.31Å; V42-V46 VanDerWaalsContact O-N 3.1Å; I44-V46 VanDerWaalsContact C-N 3.31Å; I44-V46 PolarHBondContact O-N 2.89Å |
| 47 | T | 68.9 | Low | 79.2 | Confident | 87 Ų | 87 | 38.1 Ų | 38.1 | 53% | 0.534 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -90.9 | -38.2 | -174.4 | 48.6 | 0 | 0 | 0 | 0 | 114.2 | S43 I44 N45 | S43-T47 WeakPolarHBondContact O-CG2 3.22Å; S43-T47 PolarHBondContact O-N 3.3Å; S43-T47 PolarHBondContact O-OG1 2.98Å; I44-T47 WeakPolarHBondContact CA-OG1 3.47Å; I44-T47 PolarHBondContact O-N 2.66Å; I44-T47 PolarHBondContact O-OG1 3.08Å; N45-T47 VanDerWaalsContact C-N 3.29Å; N45-T47 PolarHBondContact O-N 2.63Å |
| 48 | A | 69.2 | Low | 79.4 | Confident | 68 Ų | 68 | 41.5 Ų | 41.5 | 56% | 0.562 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -119 | -15.5 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | I44 A50 | I44-A48 HydrophobicContact CG2-CB 4.47Å; I44-A48 PolarHBondContact O-N 3.33Å; A48-A50 HydrophobicContact CB-CB 4.44Å; A48-A50 PolarHBondContact O-N 2.82Å |
| 49 | G | 68.7 | Low | 79.7 | Confident | 61 Ų | 61 | 41.4 Ų | 41.4 | 63% | 0.629 | 26% | 0.259 | S | S | * | . | S | Bend | trans | 62.5 | 5 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | N45 V51 | N45-G49 VanDerWaalsContact O-CA 3.27Å; N45-G49 WeakPolarHBondContact O-CA 3.32Å; N45-G49 PolarHBondContact O-N 2.65Å; G49-V51 VanDerWaalsContact C-N 3.35Å; G49-V51 PolarHBondContact O-N 2.98Å |
| 50 | A | 67.4 | Low | 80 | Confident | 54 Ų | 54 | 40.7 Ų | 40.7 | 45% | 0.446 | 26% | 0.257 | S | S | . | . | trans | -86.4 | -3.1 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | A48 | A48-A50 HydrophobicContact CB-CB 4.44Å; A48-A50 PolarHBondContact O-N 2.82Å | ||
| 51 | V | 75.3 | Confident | 80.5 | Confident | 3 Ų | 3 | 43.4 Ų | 43.4 | 2% | 0.018 | 28% | 0.281 | C | S | . | . | S | Bend | trans | -134.7 | 141.7 | -169.5 | -179.6 | 0 | 0 | 0 | 0 | 109.1 | I44 N45 G49 A55 I104 N106 | I44-V51 HydrophobicContact CG2-CB 4.46Å; I44-V51 HydrophobicContact CG2-CG2 3.82Å; N45-V51 WeakPolarHBondContact CB-O 3.33Å; N45-V51 PolarHBondContact ND2-O 3.33Å; G49-V51 VanDerWaalsContact C-N 3.35Å; G49-V51 PolarHBondContact O-N 2.98Å; V51-A55 HydrophobicContact CG1-CB 3.41Å; V51-A55 VanDerWaalsContact CG1-CB 3.41Å; V51-I104 HydrophobicContact CG1-CD1 4.48Å; V51-I104 HydrophobicContact CG2-CB 4.39Å; V51-I104 HydrophobicContact CG2-CD1 4.13Å; V51-I104 HydrophobicContact CG2-CG1 3.79Å; V51-I104 HydrophobicContact CG2-CG2 4Å; V51-N106 VanDerWaalsContact CA-OD1 3.23Å; V51-N106 WeakPolarHBondContact CA-OD1 3.44Å |
| 52 | D | 81.6 | Confident | 81.1 | Confident | 76 Ų | 76 | 45.8 Ų | 45.8 | 41% | 0.406 | 29% | 0.293 | S | S | . | . | trans | -66.6 | 147.4 | 177.2 | -63.3 | -22.2 | 0 | 0 | 0 | 111.6 | H54 A55 N106 Y110 | D52-H54 PolarHBondContact O-N 2.98Å; D52-H54 VanDerWaalsContact O-N 3.1Å; D52-A55 HydrophobicContact CB-CB 4.23Å; D52-A55 VanDerWaalsContact O-CB 3.32Å; D52-A55 WeakPolarHBondContact O-CB 3.26Å; D52-A55 PolarHBondContact O-N 3.45Å; D52-N106 PolarHBondContact N-ND2 2.93Å; D52-N106 PolarHBondContact N-OD1 3.26Å; D52-N106 PolarHBondContact OD1-ND2 3.49Å; D52-N106 PolarHBondContact OD2-ND2 3.02Å; D52-Y110 PolarHBondContact OD2-OH 2.98Å | ||
| 53 | S | 74 | Confident | 81.8 | Confident | 54 Ų | 54 | 45 Ų | 45 | 38% | 0.378 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -35.7 | -178.7 | -176.7 | 0 | 0 | 0 | 0 | 112.7 | V42 N45 | V42-S53 WeakPolarHBondContact CG2-O 3.27Å; N45-S53 PolarHBondContact ND2-N 3.17Å |
| 54 | H | 84.2 | Confident | 82.5 | Confident | 78 Ų | 78 | 46.2 Ų | 46.2 | 36% | 0.361 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.2 | 21.1 | -178.8 | -55.9 | -52.8 | 0 | 0 | 0 | 113.7 | D52 G56 Y57 N58 | D52-H54 PolarHBondContact O-N 2.98Å; D52-H54 VanDerWaalsContact O-N 3.1Å; H54-G56 PolarHBondContact O-N 2.92Å; H54-G56 VanDerWaalsContact O-N 3.13Å; H54-Y57 PolarHBondContact O-N 2.74Å; H54-N58 PolarHBondContact O-N 2.88Å |
| 55 | A | 86.8 | Confident | 83.4 | Confident | 0 Ų | 0 | 47.6 Ų | 47.6 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -56.6 | -33.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | V51 D52 S59 L109 Y110 | V51-A55 HydrophobicContact CG1-CB 3.41Å; V51-A55 VanDerWaalsContact CG1-CB 3.41Å; D52-A55 HydrophobicContact CB-CB 4.23Å; D52-A55 VanDerWaalsContact O-CB 3.32Å; D52-A55 WeakPolarHBondContact O-CB 3.26Å; D52-A55 PolarHBondContact O-N 3.45Å; A55-S59 VanDerWaalsContact O-CB 3.23Å; A55-S59 WeakPolarHBondContact O-CB 3.37Å; A55-S59 PolarHBondContact O-N 2.82Å; A55-L109 HydrophobicContact CB-CD2 4.27Å; A55-Y110 HydrophobicContact CB-CE1 4.27Å |
| 56 | G | 87.5 | Confident | 84.2 | Confident | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.01 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64 | -41.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q37 S41 H54 L60 | Q37-G56 PolarHBondContact NE2-O 3.47Å; S41-G56 PolarHBondContact OG-N 3.2Å; H54-G56 PolarHBondContact O-N 2.92Å; H54-G56 VanDerWaalsContact O-N 3.13Å; G56-L60 PolarHBondContact O-N 3.46Å |
| 57 | Y | 90.2 | Very high | 85.4 | Confident | 50 Ų | 50 | 42.7 Ų | 42.7 | 20% | 0.196 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -71.9 | -43.4 | 176.3 | -75.6 | -61.5 | 0 | 0 | 0 | 111.7 | V38 H54 S59 L60 A61 T276 P349 | V38-Y57 HydrophobicContact CG1-CD2 3.93Å; V38-Y57 HydrophobicContact CG1-CE2 3.58Å; V38-Y57 HydrophobicContact CG2-CD1 3.99Å; V38-Y57 HydrophobicContact CG2-CD2 4.2Å; V38-Y57 HydrophobicContact CG2-CE1 4.03Å; V38-Y57 HydrophobicContact CG2-CE2 4.25Å; V38-Y57 HydrophobicContact CG2-CG 4.09Å; H54-Y57 PolarHBondContact O-N 2.74Å; Y57-S59 VanDerWaalsContact C-N 3.26Å; Y57-S59 PolarHBondContact O-N 2.87Å; Y57-L60 PolarHBondContact O-N 3.4Å; Y57-A61 WeakPolarHBondContact O-CB 3.46Å; Y57-A61 PolarHBondContact O-N 2.76Å; Y57-T276 PolarHBondContact OH-OG1 2.88Å; Y57-P349 WeakPolarHBondContact CE2-O 3.5Å; Y57-P349 PolarHBondContact OH-O 2.94Å |
| 58 | N | 91.4 | Very high | 86.5 | Confident | 70 Ų | 70 | 43.4 Ų | 43.4 | 37% | 0.374 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -58.1 | -41.9 | 175.4 | -68.5 | -12.8 | 0 | 0 | 0 | 110.9 | H54 A61 I62 Y110 | H54-N58 PolarHBondContact O-N 2.88Å; N58-A61 PolarHBondContact O-N 3.4Å; N58-I62 WeakPolarHBondContact O-CD1 3.18Å; N58-I62 VanDerWaalsContact O-CG1 3.22Å; N58-I62 WeakPolarHBondContact O-CG1 3.45Å; N58-I62 PolarHBondContact O-N 3.4Å; N58-Y110 HydrophobicContact CB-CE1 3.79Å; N58-Y110 PolarHBondContact ND2-OH 3.32Å |
| 59 | S | 92.2 | Very high | 87.6 | Confident | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -58.4 | -51.1 | 174.3 | 174.4 | 0 | 0 | 0 | 0 | 112 | A55 Y57 A61 I62 V63 Y97 S113 | A55-S59 VanDerWaalsContact O-CB 3.23Å; A55-S59 WeakPolarHBondContact O-CB 3.37Å; A55-S59 PolarHBondContact O-N 2.82Å; Y57-S59 VanDerWaalsContact C-N 3.26Å; Y57-S59 PolarHBondContact O-N 2.87Å; S59-A61 VanDerWaalsContact C-N 3.32Å; S59-A61 PolarHBondContact O-N 2.88Å; S59-I62 PolarHBondContact O-N 3.27Å; S59-V63 WeakPolarHBondContact O-CG2 3.44Å; S59-V63 PolarHBondContact O-N 2.95Å; S59-Y97 PolarHBondContact OG-OH 2.8Å; S59-S113 PolarHBondContact OG-OG 3.27Å |
| 60 | L | 91 | Very high | 88.7 | Confident | 18 Ų | 18 | 41.4 Ų | 41.4 | 9% | 0.094 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60 | -43.3 | 177.3 | -66.6 | 175.9 | 0 | 0 | 0 | 111.5 | Q37 G56 Y57 I62 V63 Y64 | Q37-L60 VanDerWaalsContact NE2-CD2 3.29Å; G56-L60 PolarHBondContact O-N 3.46Å; Y57-L60 PolarHBondContact O-N 3.4Å; L60-I62 VanDerWaalsContact C-N 3.32Å; L60-I62 PolarHBondContact O-N 3.28Å; L60-V63 PolarHBondContact O-N 3.23Å; L60-Y64 VanDerWaalsContact O-CD2 3.29Å; L60-Y64 WeakPolarHBondContact O-CD2 3.38Å; L60-Y64 PolarHBondContact O-N 3.35Å |
| 61 | A | 93.1 | Very high | 89.8 | Confident | 64 Ų | 64 | 42.2 Ų | 42.2 | 53% | 0.529 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60.4 | -42.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y57 N58 S59 G65 | Y57-A61 WeakPolarHBondContact O-CB 3.46Å; Y57-A61 PolarHBondContact O-N 2.76Å; N58-A61 PolarHBondContact O-N 3.4Å; S59-A61 VanDerWaalsContact C-N 3.32Å; S59-A61 PolarHBondContact O-N 2.88Å; A61-G65 WeakPolarHBondContact O-CA 3.4Å; A61-G65 PolarHBondContact O-N 3.17Å |
| 62 | I | 95.3 | Very high | 90.3 | Very high | 51 Ų | 51 | 45.9 Ų | 45.9 | 26% | 0.262 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -64.9 | -47.6 | 175.4 | -67 | 164.1 | 0 | 0 | 0 | 110.6 | N58 S59 L60 Y64 G65 V66 Y110 A114 | N58-I62 WeakPolarHBondContact O-CD1 3.18Å; N58-I62 VanDerWaalsContact O-CG1 3.22Å; N58-I62 WeakPolarHBondContact O-CG1 3.45Å; N58-I62 PolarHBondContact O-N 3.4Å; S59-I62 PolarHBondContact O-N 3.27Å; L60-I62 VanDerWaalsContact C-N 3.32Å; L60-I62 PolarHBondContact O-N 3.28Å; I62-Y64 PolarHBondContact O-N 2.93Å; I62-G65 PolarHBondContact O-N 2.92Å; I62-V66 HydrophobicContact CG2-CG2 4.24Å; I62-V66 WeakPolarHBondContact O-CB 3.03Å; I62-V66 WeakPolarHBondContact O-CG2 3.36Å; I62-V66 PolarHBondContact O-N 3.19Å; I62-Y110 HydrophobicContact CD1-CD1 3.78Å; I62-Y110 HydrophobicContact CD1-CG 3.82Å; I62-A114 HydrophobicContact CG2-CB 3.94Å |
| 63 | V | 94.9 | Very high | 90.4 | Very high | 2 Ų | 2 | 47 Ų | 47 | 1% | 0.012 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -55.9 | -53.4 | 179.2 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | S59 L60 L67 Y97 L116 G117 | S59-V63 WeakPolarHBondContact O-CG2 3.44Å; S59-V63 PolarHBondContact O-N 2.95Å; L60-V63 PolarHBondContact O-N 3.23Å; V63-L67 WeakPolarHBondContact O-CB 3.44Å; V63-L67 PolarHBondContact O-N 2.77Å; V63-Y97 HydrophobicContact CG2-CE2 4.31Å; V63-L116 HydrophobicContact CG1-CD2 4.18Å; V63-L116 HydrophobicContact CG1-CG 4.33Å; V63-L116 HydrophobicContact CG2-CD2 4.04Å; V63-G117 WeakPolarHBondContact O-CA 3.48Å |
| 64 | Y | 93.5 | Very high | 91.1 | Very high | 53 Ų | 53 | 44.5 Ų | 44.5 | 21% | 0.208 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -72.4 | -33.5 | -177.3 | -77.4 | -72.8 | 0 | 0 | 0 | 112.9 | L60 I62 L67 T68 L267 | L60-Y64 VanDerWaalsContact O-CD2 3.29Å; L60-Y64 WeakPolarHBondContact O-CD2 3.38Å; L60-Y64 PolarHBondContact O-N 3.35Å; I62-Y64 PolarHBondContact O-N 2.93Å; Y64-L67 HydrophobicContact CD1-CD2 3.98Å; Y64-L67 HydrophobicContact CE1-CD2 4.3Å; Y64-T68 WeakPolarHBondContact O-CB 3.2Å; Y64-T68 PolarHBondContact O-N 3.44Å; Y64-T68 PolarHBondContact O-OG1 2.96Å; Y64-L267 HydrophobicContact CE1-CD2 4.34Å |
| 65 | G | 95.5 | Very high | 91.1 | Very high | 43 Ų | 43 | 43 Ų | 43 | 44% | 0.443 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63.8 | -49.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | A61 I62 T68 A69 | A61-G65 WeakPolarHBondContact O-CA 3.4Å; A61-G65 PolarHBondContact O-N 3.17Å; I62-G65 PolarHBondContact O-N 2.92Å; G65-T68 PolarHBondContact O-N 3.02Å; G65-A69 PolarHBondContact O-N 3.3Å; G65-A69 VanDerWaalsContact O-N 3.09Å |
| 66 | V | 97.5 | Very high | 90.8 | Very high | 39 Ų | 39 | 43.6 Ų | 43.6 | 24% | 0.236 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -69.4 | -41.1 | 177.5 | 178.9 | 0 | 0 | 0 | 0 | 111.2 | I62 T68 A69 C70 A114 F118 | I62-V66 HydrophobicContact CG2-CG2 4.24Å; I62-V66 WeakPolarHBondContact O-CB 3.03Å; I62-V66 WeakPolarHBondContact O-CG2 3.36Å; I62-V66 PolarHBondContact O-N 3.19Å; V66-T68 VanDerWaalsContact C-N 3.26Å; V66-T68 PolarHBondContact O-N 2.99Å; V66-A69 PolarHBondContact O-N 3.39Å; V66-C70 VanDerWaalsContact O-CB 3.31Å; V66-C70 WeakPolarHBondContact O-CB 3.31Å; V66-C70 PolarHBondContact O-N 3.48Å; V66-C70 PolarHBondContact O-SG 3.33Å; V66-A114 WeakPolarHBondContact CG1-O 3.05Å; V66-A114 HydrophobicContact CG2-CB 4.22Å; V66-F118 HydrophobicContact CG1-CB 4.41Å |
| 67 | L | 95.6 | Very high | 90.8 | Very high | 24 Ų | 24 | 46 Ų | 46 | 13% | 0.126 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -52.6 | -46.3 | 172.6 | 172.8 | 63.4 | 0 | 0 | 0 | 111.5 | V63 Y64 N71 G117 S121 | V63-L67 WeakPolarHBondContact O-CB 3.44Å; V63-L67 PolarHBondContact O-N 2.77Å; Y64-L67 HydrophobicContact CD1-CD2 3.98Å; Y64-L67 HydrophobicContact CE1-CD2 4.3Å; L67-N71 VanDerWaalsContact O-CB 3.32Å; L67-N71 WeakPolarHBondContact O-CB 3.26Å; L67-N71 VanDerWaalsContact O-CG 3.23Å; L67-N71 PolarHBondContact O-N 3.33Å; L67-G117 WeakPolarHBondContact CA-O 3.37Å; L67-S121 VanDerWaalsContact CD1-CA 3.48Å; L67-S121 VanDerWaalsContact CD1-N 3.31Å |
| 68 | T | 92.6 | Very high | 90.6 | Very high | 103 Ų | 103 | 43.6 Ų | 43.6 | 63% | 0.632 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -63.5 | -47.3 | 179.3 | -58.6 | 0 | 0 | 0 | 0 | 111.4 | Y64 G65 V66 | Y64-T68 WeakPolarHBondContact O-CB 3.2Å; Y64-T68 PolarHBondContact O-N 3.44Å; Y64-T68 PolarHBondContact O-OG1 2.96Å; G65-T68 PolarHBondContact O-N 3.02Å; V66-T68 VanDerWaalsContact C-N 3.26Å; V66-T68 PolarHBondContact O-N 2.99Å |
| 69 | A | 91 | Very high | 90.2 | Very high | 60 Ų | 60 | 45.5 Ų | 45.5 | 50% | 0.496 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -65.1 | -41.6 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | G65 V66 | G65-A69 PolarHBondContact O-N 3.3Å; G65-A69 VanDerWaalsContact O-N 3.09Å; V66-A69 PolarHBondContact O-N 3.39Å |
| 70 | C | 92.4 | Very high | 89.8 | Confident | 26 Ų | 26 | 51.4 Ų | 51.4 | 18% | 0.176 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -75 | -29.1 | -178 | -67.2 | 0 | 0 | 0 | 0 | 113.2 | V66 L72 F73 A74 F118 S121 | V66-C70 VanDerWaalsContact O-CB 3.31Å; V66-C70 WeakPolarHBondContact O-CB 3.31Å; V66-C70 PolarHBondContact O-N 3.48Å; V66-C70 PolarHBondContact O-SG 3.33Å; C70-L72 PolarHBondContact O-N 3.38Å; C70-L72 VanDerWaalsContact O-N 3.12Å; C70-F73 PolarHBondContact O-N 2.69Å; C70-A74 PolarHBondContact O-N 3.41Å; C70-F118 HydrophobicContact CB-CD2 4.25Å; C70-S121 WeakPolarHBondContact CB-OG 3.42Å |
| 71 | N | 90.2 | Very high | 89.5 | Confident | 71 Ų | 71 | 53.7 Ų | 53.7 | 38% | 0.38 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -56.9 | -27 | 176 | -89.4 | -10.4 | 0 | 0 | 0 | 113.2 | L67 F73 A74 S121 | L67-N71 VanDerWaalsContact O-CB 3.32Å; L67-N71 WeakPolarHBondContact O-CB 3.26Å; L67-N71 VanDerWaalsContact O-CG 3.23Å; L67-N71 PolarHBondContact O-N 3.33Å; N71-F73 PolarHBondContact O-N 2.88Å; N71-A74 PolarHBondContact O-N 3.37Å; N71-S121 VanDerWaalsContact OD1-CA 3.26Å; N71-S121 WeakPolarHBondContact OD1-CA 3.4Å; N71-S121 WeakPolarHBondContact OD1-CB 3.37Å |
| 72 | L | 85.3 | Confident | 89.2 | Confident | 80 Ų | 80 | 51.7 Ų | 51.7 | 42% | 0.419 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.2 | -30.3 | 174.6 | -177.8 | 60.6 | 0 | 0 | 0 | 112.9 | C70 T244 | C70-L72 PolarHBondContact O-N 3.38Å; C70-L72 VanDerWaalsContact O-N 3.12Å; L72-T244 HydrophobicContact CD1-CG2 4.36Å |
| 73 | F | 84.1 | Confident | 89 | Confident | 101 Ų | 101 | 49.3 Ų | 49.3 | 44% | 0.443 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -110.7 | -2.3 | -176.7 | -55 | -71.6 | 0 | 0 | 0 | 113.2 | C70 N71 S75 P76 I77 | C70-F73 PolarHBondContact O-N 2.69Å; N71-F73 PolarHBondContact O-N 2.88Å; F73-S75 PolarHBondContact O-N 3.11Å; F73-P76 WeakPolarHBondContact O-CD 3.45Å; F73-I77 HydrophobicContact CB-CD1 4.29Å; F73-I77 WeakPolarHBondContact O-CD1 3.36Å; F73-I77 VanDerWaalsContact O-CG1 3.3Å; F73-I77 WeakPolarHBondContact O-CG1 3.39Å; F73-I77 PolarHBondContact O-N 3.22Å |
| 74 | A | 88.2 | Confident | 88.9 | Confident | 0 Ų | 0 | 50.1 Ų | 50.1 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.8 | -43.4 | -173.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | C70 N71 I77 V78 L122 V125 | C70-A74 PolarHBondContact O-N 3.41Å; N71-A74 PolarHBondContact O-N 3.37Å; A74-I77 PolarHBondContact O-N 3.1Å; A74-V78 WeakPolarHBondContact O-CB 3.45Å; A74-V78 VanDerWaalsContact O-CG2 3.22Å; A74-V78 WeakPolarHBondContact O-CG2 3.42Å; A74-V78 PolarHBondContact O-N 3.27Å; A74-L122 HydrophobicContact CB-CD2 4.17Å; A74-V125 HydrophobicContact CB-CB 4.11Å; A74-V125 HydrophobicContact CB-CG1 4.45Å; A74-V125 HydrophobicContact CB-CG2 3.67Å |
| 75 | S | 85.2 | Confident | 88.9 | Confident | 48 Ų | 48 | 54.1 Ų | 54.1 | 34% | 0.336 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -56.5 | -53 | -178.6 | -66.5 | 0 | 0 | 0 | 0 | 113.2 | F73 I77 V78 L79 | F73-S75 PolarHBondContact O-N 3.11Å; S75-I77 VanDerWaalsContact C-N 3.34Å; S75-I77 PolarHBondContact O-N 3.04Å; S75-V78 PolarHBondContact O-N 3.25Å; S75-L79 WeakPolarHBondContact O-CG 3.36Å; S75-L79 PolarHBondContact O-N 3.46Å |
| 76 | P | 80.8 | Confident | 88.9 | Confident | 11 Ų | 11 | 52.1 Ų | 52.1 | 7% | 0.071 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.5 | -39.1 | 175.8 | -22.4 | 27 | 0 | 0 | 0 | 114.6 | F73 V78 L79 L80 V237 | F73-P76 WeakPolarHBondContact O-CD 3.45Å; P76-V78 VanDerWaalsContact C-N 3.32Å; P76-V78 PolarHBondContact O-N 2.96Å; P76-L79 PolarHBondContact O-N 2.87Å; P76-L80 PolarHBondContact O-N 2.9Å; P76-L80 VanDerWaalsContact O-N 3.1Å; P76-V237 HydrophobicContact CB-CB 3.94Å; P76-V237 HydrophobicContact CB-CG1 3.77Å; P76-V237 HydrophobicContact CB-CG2 3.43Å; P76-V237 VanDerWaalsContact CB-CG2 3.43Å; P76-V237 HydrophobicContact CG-CB 4.19Å; P76-V237 HydrophobicContact CG-CG1 3.81Å; P76-V237 HydrophobicContact CG-CG2 4.22Å |
| 77 | I | 86.1 | Confident | 88.8 | Confident | 52 Ų | 52 | 50.2 Ų | 50.2 | 27% | 0.267 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.9 | -40.6 | 177.8 | -64.3 | 167.8 | 0 | 0 | 0 | 110.3 | F73 A74 S75 L79 L80 L81 F118 L122 | F73-I77 HydrophobicContact CB-CD1 4.29Å; F73-I77 WeakPolarHBondContact O-CD1 3.36Å; F73-I77 VanDerWaalsContact O-CG1 3.3Å; F73-I77 WeakPolarHBondContact O-CG1 3.39Å; F73-I77 PolarHBondContact O-N 3.22Å; A74-I77 PolarHBondContact O-N 3.1Å; S75-I77 VanDerWaalsContact C-N 3.34Å; S75-I77 PolarHBondContact O-N 3.04Å; I77-L79 VanDerWaalsContact C-N 3.33Å; I77-L80 PolarHBondContact O-N 3.44Å; I77-L81 HydrophobicContact CG2-CD1 3.8Å; I77-L81 HydrophobicContact CG2-CG 4.36Å; I77-L81 PolarHBondContact O-N 3.14Å; I77-F118 HydrophobicContact CD1-CE2 4.27Å; I77-L122 HydrophobicContact CB-CD2 3.87Å; I77-L122 HydrophobicContact CD1-CD2 4.3Å; I77-L122 HydrophobicContact CG2-CD1 4.08Å; I77-L122 HydrophobicContact CG2-CD2 3.61Å |
| 78 | V | 87.7 | Confident | 88.9 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66 | -36.8 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 111.7 | A74 S75 P76 L80 T82 S86 L122 V125 N129 | A74-V78 WeakPolarHBondContact O-CB 3.45Å; A74-V78 VanDerWaalsContact O-CG2 3.22Å; A74-V78 WeakPolarHBondContact O-CG2 3.42Å; A74-V78 PolarHBondContact O-N 3.27Å; S75-V78 PolarHBondContact O-N 3.25Å; P76-V78 VanDerWaalsContact C-N 3.32Å; P76-V78 PolarHBondContact O-N 2.96Å; V78-L80 VanDerWaalsContact C-N 3.3Å; V78-L80 PolarHBondContact O-N 2.86Å; V78-T82 CarbonylContact O-C 3.59Å; V78-T82 VanDerWaalsContact O-CA 3.25Å; V78-T82 WeakPolarHBondContact O-CA 3.21Å; V78-T82 PolarHBondContact O-N 3.46Å; V78-S86 WeakPolarHBondContact CA-OG 3.35Å; V78-L122 HydrophobicContact CG2-CD2 4.25Å; V78-V125 HydrophobicContact CB-CG1 4.24Å; V78-V125 HydrophobicContact CG2-CB 4.06Å; V78-V125 HydrophobicContact CG2-CG1 3.82Å; V78-N129 HydrophobicContact CG1-CB 4.04Å |
| 79 | L | 82.2 | Confident | 89 | Confident | 110 Ų | 110 | 47.9 Ų | 47.9 | 58% | 0.576 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -64.2 | -35.6 | 173.6 | -68 | 173.5 | 0 | 0 | 0 | 111.9 | S75 P76 I77 | S75-L79 WeakPolarHBondContact O-CG 3.36Å; S75-L79 PolarHBondContact O-N 3.46Å; P76-L79 PolarHBondContact O-N 2.87Å; I77-L79 VanDerWaalsContact C-N 3.33Å |
| 80 | L | 83.2 | Confident | 89.3 | Confident | 124 Ų | 124 | 45 Ų | 45 | 65% | 0.649 | 23% | 0.23 | S | C | * | . | H | α-helix | trans | -73.6 | -49.3 | 176.6 | -177.3 | 67.5 | 0 | 0 | 0 | 112.8 | P76 I77 V78 T82 | P76-L80 PolarHBondContact O-N 2.9Å; P76-L80 VanDerWaalsContact O-N 3.1Å; I77-L80 PolarHBondContact O-N 3.44Å; V78-L80 VanDerWaalsContact C-N 3.3Å; V78-L80 PolarHBondContact O-N 2.86Å; L80-T82 VanDerWaalsContact C-N 3.33Å |
| 81 | L | 85 | Confident | 89.6 | Confident | 65 Ų | 65 | 43.8 Ų | 43.8 | 34% | 0.34 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -78.5 | -16.6 | -175.8 | -70.7 | 175.9 | 0 | 0 | 0 | 113.2 | I77 W85 L89 | I77-L81 HydrophobicContact CG2-CD1 3.8Å; I77-L81 HydrophobicContact CG2-CG 4.36Å; I77-L81 PolarHBondContact O-N 3.14Å; L81-W85 WeakPolarHBondContact O-CB 3.5Å; L81-L89 HydrophobicContact CD1-CD2 4.01Å |
| 82 | T | 87.5 | Confident | 89.9 | Confident | 22 Ų | 22 | 44.2 Ų | 44.2 | 14% | 0.135 | 22% | 0.223 | C | C | . | . | trans | 69.9 | 145.3 | -162.7 | -48.9 | 0 | 0 | 0 | 0 | 112.5 | V78 L80 K84 W85 S86 R203 | V78-T82 CarbonylContact O-C 3.59Å; V78-T82 VanDerWaalsContact O-CA 3.25Å; V78-T82 WeakPolarHBondContact O-CA 3.21Å; V78-T82 PolarHBondContact O-N 3.46Å; L80-T82 VanDerWaalsContact C-N 3.33Å; T82-K84 VanDerWaalsContact C-N 3.29Å; T82-K84 PolarHBondContact O-N 2.79Å; T82-K84 VanDerWaalsContact O-N 3.13Å; T82-W85 PolarHBondContact O-N 3.01Å; T82-W85 VanDerWaalsContact O-N 3.12Å; T82-S86 PolarHBondContact O-N 2.92Å; T82-S86 VanDerWaalsContact O-N 3.08Å; T82-S86 PolarHBondContact O-OG 3.23Å; T82-S86 VanDerWaalsContact O-OG 3.11Å; T82-R203 HydrophobicContact CG2-CG 4.32Å | ||
| 83 | A | 90.4 | Very high | 90.5 | Very high | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.008 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -48.7 | -43.8 | -178 | 0 | 0 | 0 | 0 | 0 | 114.3 | M87 N129 Y130 | A83-M87 WeakPolarHBondContact O-CE 3.35Å; A83-M87 WeakPolarHBondContact O-CG 3.37Å; A83-M87 PolarHBondContact O-N 3.28Å; A83-M87 VanDerWaalsContact O-N 3.1Å; A83-N129 HydrophobicContact CB-CB 4.11Å; A83-Y130 HydrophobicContact CB-CD2 4.21Å |
| 84 | K | 93.5 | Very high | 91.1 | Very high | 20 Ų | 20 | 36.1 Ų | 36.1 | 9% | 0.087 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -56.4 | -57 | 177.6 | 177.4 | -171.6 | 173.7 | 166.8 | 0 | 111.9 | T82 S86 M87 V88 A197 L199 P201 | T82-K84 VanDerWaalsContact C-N 3.29Å; T82-K84 PolarHBondContact O-N 2.79Å; T82-K84 VanDerWaalsContact O-N 3.13Å; K84-S86 VanDerWaalsContact C-N 3.32Å; K84-S86 PolarHBondContact O-N 3.26Å; K84-M87 PolarHBondContact O-N 3.35Å; K84-V88 WeakPolarHBondContact O-CG2 3.4Å; K84-V88 PolarHBondContact O-N 3.43Å; K84-A197 WeakPolarHBondContact CE-O 3.48Å; K84-A197 PolarHBondContact NZ-O 3.25Å; K84-L199 WeakPolarHBondContact CD-O 3.41Å; K84-L199 WeakPolarHBondContact CE-O 3.41Å; K84-L199 PolarHBondContact NZ-O 3.41Å; K84-P201 HydrophobicContact CD-CB 3.96Å |
| 85 | W | 93 | Very high | 91.6 | Very high | 137 Ų | 137 | 37.6 Ų | 37.6 | 52% | 0.519 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -72.9 | -28.4 | -172.7 | -61.9 | 115.5 | 0 | 0 | 0 | 112.2 | L81 T82 V88 L89 | L81-W85 WeakPolarHBondContact O-CB 3.5Å; T82-W85 PolarHBondContact O-N 3.01Å; T82-W85 VanDerWaalsContact O-N 3.12Å; W85-V88 HydrophobicContact CE3-CB 4.34Å; W85-V88 HydrophobicContact CE3-CG1 4.41Å; W85-V88 HydrophobicContact CE3-CG2 4.39Å; W85-V88 PolarHBondContact O-N 3.45Å; W85-L89 VanDerWaalsContact O-CB 3.31Å; W85-L89 WeakPolarHBondContact O-CB 3.23Å; W85-L89 PolarHBondContact O-N 3.23Å |
| 86 | S | 95 | Very high | 92.1 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.7 | -44.6 | 168.6 | -56 | 0 | 0 | 0 | 0 | 112.5 | V78 T82 K84 L89 G90 | V78-S86 WeakPolarHBondContact CA-OG 3.35Å; T82-S86 PolarHBondContact O-N 2.92Å; T82-S86 VanDerWaalsContact O-N 3.08Å; T82-S86 PolarHBondContact O-OG 3.23Å; T82-S86 VanDerWaalsContact O-OG 3.11Å; K84-S86 VanDerWaalsContact C-N 3.32Å; K84-S86 PolarHBondContact O-N 3.26Å; S86-L89 PolarHBondContact O-N 3.5Å; S86-G90 PolarHBondContact O-N 2.84Å |
| 87 | M | 95.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -65.8 | -41.6 | 175.4 | -69 | -176.6 | -63.6 | 0 | 0 | 112.2 | L19 F23 A83 K84 G90 A91 Q127 Y130 L196 L199 | L19-M87 HydrophobicContact CD1-CE 3.94Å; L19-M87 HydrophobicContact CD1-SD 3.46Å; L19-M87 WeakPolarHBondContact CD1-SD 3.37Å; F23-M87 HydrophobicContact CE2-CG 4.45Å; F23-M87 HydrophobicContact CE2-SD 3.81Å; F23-M87 HydrophobicContact CZ-CG 4.41Å; F23-M87 HydrophobicContact CZ-SD 4.14Å; A83-M87 WeakPolarHBondContact O-CE 3.35Å; A83-M87 WeakPolarHBondContact O-CG 3.37Å; A83-M87 PolarHBondContact O-N 3.28Å; A83-M87 VanDerWaalsContact O-N 3.1Å; K84-M87 PolarHBondContact O-N 3.35Å; M87-G90 PolarHBondContact O-N 3.12Å; M87-A91 WeakPolarHBondContact O-CB 3.38Å; M87-A91 PolarHBondContact O-N 2.98Å; M87-Q127 VanDerWaalsContact SD-CA 3.56Å; M87-Q127 HydrophobicContact SD-CB 4.14Å; M87-Y130 HydrophobicContact CE-CD2 3.71Å; M87-Y130 HydrophobicContact CE-CG 3.76Å; M87-L196 HydrophobicContact CB-CD1 4.37Å; M87-L199 HydrophobicContact CE-CD2 3.72Å |
| 88 | V | 97 | Very high | 93.2 | Very high | 14 Ų | 14 | 36.9 Ų | 36.9 | 9% | 0.085 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.6 | -45.2 | 176.9 | 173.4 | 0 | 0 | 0 | 0 | 111.1 | K84 W85 G90 A91 I92 L196 A197 | K84-V88 WeakPolarHBondContact O-CG2 3.4Å; K84-V88 PolarHBondContact O-N 3.43Å; W85-V88 HydrophobicContact CE3-CB 4.34Å; W85-V88 HydrophobicContact CE3-CG1 4.41Å; W85-V88 HydrophobicContact CE3-CG2 4.39Å; W85-V88 PolarHBondContact O-N 3.45Å; V88-G90 VanDerWaalsContact C-N 3.34Å; V88-G90 PolarHBondContact O-N 2.91Å; V88-A91 PolarHBondContact O-N 2.84Å; V88-A91 VanDerWaalsContact O-N 3.17Å; V88-I92 HydrophobicContact CG1-CD1 3.96Å; V88-I92 WeakPolarHBondContact O-CG1 3.24Å; V88-I92 PolarHBondContact O-N 3.39Å; V88-L196 HydrophobicContact CG2-CB 4.28Å; V88-A197 HydrophobicContact CG1-CB 4.37Å; V88-A197 HydrophobicContact CG2-CB 4.02Å |
| 89 | L | 96.3 | Very high | 93.5 | Very high | 63 Ų | 63 | 38.5 Ų | 38.5 | 33% | 0.33 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -60.1 | -45.1 | 176.8 | -178.9 | 60.1 | 0 | 0 | 0 | 111.2 | L81 W85 S86 A91 I92 T93 F118 L122 | L81-L89 HydrophobicContact CD1-CD2 4.01Å; W85-L89 VanDerWaalsContact O-CB 3.31Å; W85-L89 WeakPolarHBondContact O-CB 3.23Å; W85-L89 PolarHBondContact O-N 3.23Å; S86-L89 PolarHBondContact O-N 3.5Å; L89-A91 VanDerWaalsContact C-N 3.34Å; L89-A91 PolarHBondContact O-N 3.28Å; L89-I92 PolarHBondContact O-N 3.45Å; L89-T93 VanDerWaalsContact O-CG2 3.23Å; L89-T93 WeakPolarHBondContact O-CG2 3.46Å; L89-T93 PolarHBondContact O-N 3.14Å; L89-T93 VanDerWaalsContact O-N 3.13Å; L89-F118 HydrophobicContact CD2-CE1 4.42Å; L89-L122 HydrophobicContact CD2-CD1 3.75Å; L89-L122 HydrophobicContact CG-CD1 4.48Å |
| 90 | G | 97 | Very high | 93.9 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62 | -39.7 | 174 | 0 | 0 | 0 | 0 | 0 | 113.3 | S86 M87 V88 I92 T93 N94 G119 | S86-G90 PolarHBondContact O-N 2.84Å; M87-G90 PolarHBondContact O-N 3.12Å; V88-G90 VanDerWaalsContact C-N 3.34Å; V88-G90 PolarHBondContact O-N 2.91Å; G90-I92 PolarHBondContact O-N 3.34Å; G90-T93 PolarHBondContact O-N 3.31Å; G90-T93 PolarHBondContact O-OG1 3.44Å; G90-N94 PolarHBondContact O-N 2.74Å; G90-N94 VanDerWaalsContact O-N 3.14Å; G90-G119 WeakPolarHBondContact CA-O 3.41Å |
| 91 | A | 97.8 | Very high | 94.1 | Very high | 0 Ų | 0 | 28.2 Ų | 28.2 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -65.7 | -40 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | I26 M87 V88 L89 T93 N94 V95 L123 A193 L196 | I26-A91 HydrophobicContact CD1-CB 3.57Å; M87-A91 WeakPolarHBondContact O-CB 3.38Å; M87-A91 PolarHBondContact O-N 2.98Å; V88-A91 PolarHBondContact O-N 2.84Å; V88-A91 VanDerWaalsContact O-N 3.17Å; L89-A91 VanDerWaalsContact C-N 3.34Å; L89-A91 PolarHBondContact O-N 3.28Å; A91-T93 VanDerWaalsContact C-N 3.31Å; A91-T93 PolarHBondContact O-N 2.96Å; A91-N94 WeakPolarHBondContact O-CB 3.41Å; A91-N94 PolarHBondContact O-N 2.92Å; A91-N94 VanDerWaalsContact O-N 3.17Å; A91-V95 WeakPolarHBondContact O-CG2 3.46Å; A91-V95 PolarHBondContact O-N 2.98Å; A91-L123 HydrophobicContact CB-CD1 4.37Å; A91-A193 HydrophobicContact CB-CB 3.62Å; A91-L196 HydrophobicContact CB-CD1 4.09Å |
| 92 | I | 97.7 | Very high | 94.2 | Very high | 81 Ų | 81 | 28.2 Ų | 28.2 | 42% | 0.415 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -60.7 | -42.1 | 174.5 | -68.5 | 164.9 | 0 | 0 | 0 | 110.5 | V88 L89 G90 N94 V95 L96 | V88-I92 HydrophobicContact CG1-CD1 3.96Å; V88-I92 WeakPolarHBondContact O-CG1 3.24Å; V88-I92 PolarHBondContact O-N 3.39Å; L89-I92 PolarHBondContact O-N 3.45Å; G90-I92 PolarHBondContact O-N 3.34Å; I92-N94 VanDerWaalsContact C-N 3.26Å; I92-N94 PolarHBondContact O-N 3.42Å; I92-V95 WeakPolarHBondContact O-CB 3.44Å; I92-V95 PolarHBondContact O-N 3.39Å; I92-V95 VanDerWaalsContact O-N 3.13Å; I92-L96 HydrophobicContact CG2-CD1 4.32Å; I92-L96 WeakPolarHBondContact O-CG 3.35Å; I92-L96 PolarHBondContact O-N 3.1Å |
| 93 | T | 97.5 | Very high | 93.9 | Very high | 7 Ų | 7 | 34.4 Ų | 34.4 | 4% | 0.043 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64 | -32.6 | 177.7 | 70.5 | 0 | 0 | 0 | 0 | 112.3 | L89 G90 A91 L96 Y97 V115 G119 | L89-T93 VanDerWaalsContact O-CG2 3.23Å; L89-T93 WeakPolarHBondContact O-CG2 3.46Å; L89-T93 PolarHBondContact O-N 3.14Å; L89-T93 VanDerWaalsContact O-N 3.13Å; G90-T93 PolarHBondContact O-N 3.31Å; G90-T93 PolarHBondContact O-OG1 3.44Å; A91-T93 VanDerWaalsContact C-N 3.31Å; A91-T93 PolarHBondContact O-N 2.96Å; T93-L96 PolarHBondContact O-N 3.47Å; T93-Y97 WeakPolarHBondContact O-CB 3.48Å; T93-Y97 PolarHBondContact O-N 3.37Å; T93-V115 HydrophobicContact CG2-CG1 3.78Å; T93-G119 WeakPolarHBondContact OG1-CA 3.42Å |
| 94 | N | 96.6 | Very high | 93.4 | Very high | 4 Ų | 4 | 35.7 Ų | 35.7 | 2% | 0.021 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -68 | -39.4 | 172.7 | -168.3 | 45 | 0 | 0 | 0 | 112.5 | I26 G90 A91 I92 L96 Y97 L98 L116 S189 | I26-N94 HydrophobicContact CG2-CB 4.28Å; I26-N94 WeakPolarHBondContact CG2-ND2 3.31Å; I26-N94 PolarHBondContact O-ND2 2.9Å; G90-N94 PolarHBondContact O-N 2.74Å; G90-N94 VanDerWaalsContact O-N 3.14Å; A91-N94 WeakPolarHBondContact O-CB 3.41Å; A91-N94 PolarHBondContact O-N 2.92Å; A91-N94 VanDerWaalsContact O-N 3.17Å; I92-N94 VanDerWaalsContact C-N 3.26Å; I92-N94 PolarHBondContact O-N 3.42Å; N94-L96 VanDerWaalsContact C-N 3.34Å; N94-Y97 PolarHBondContact O-N 3.2Å; N94-L98 WeakPolarHBondContact O-CG 3.43Å; N94-L98 PolarHBondContact O-N 2.87Å; N94-L116 HydrophobicContact CB-CD1 3.95Å; N94-S189 PolarHBondContact ND2-OG 3.31Å |
| 95 | V | 97.3 | Very high | 92.9 | Very high | 30 Ų | 30 | 40.4 Ų | 40.4 | 18% | 0.182 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -61.1 | -45.5 | 173.6 | 177.9 | 0 | 0 | 0 | 0 | 110.6 | A91 I92 Y97 L98 A99 T186 A190 A193 | A91-V95 WeakPolarHBondContact O-CG2 3.46Å; A91-V95 PolarHBondContact O-N 2.98Å; I92-V95 WeakPolarHBondContact O-CB 3.44Å; I92-V95 PolarHBondContact O-N 3.39Å; I92-V95 VanDerWaalsContact O-N 3.13Å; V95-Y97 VanDerWaalsContact C-N 3.34Å; V95-Y97 PolarHBondContact O-N 3.31Å; V95-L98 PolarHBondContact O-N 3.38Å; V95-A99 VanDerWaalsContact O-CB 3.25Å; V95-A99 WeakPolarHBondContact O-CB 3.5Å; V95-A99 PolarHBondContact O-N 3.14Å; V95-T186 HydrophobicContact CG1-CG2 4.01Å; V95-A190 HydrophobicContact CG1-CB 4.28Å; V95-A190 HydrophobicContact CG2-CB 4.11Å; V95-A193 HydrophobicContact CG2-CB 4.38Å |
| 96 | L | 95.8 | Very high | 92.5 | Very high | 97 Ų | 97 | 35 Ų | 35 | 51% | 0.508 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -62.2 | -40.6 | 177.4 | -68.9 | 174 | 0 | 0 | 0 | 112.1 | I92 T93 N94 A99 S100 | I92-L96 HydrophobicContact CG2-CD1 4.32Å; I92-L96 WeakPolarHBondContact O-CG 3.35Å; I92-L96 PolarHBondContact O-N 3.1Å; T93-L96 PolarHBondContact O-N 3.47Å; N94-L96 VanDerWaalsContact C-N 3.34Å; L96-A99 PolarHBondContact O-N 2.99Å; L96-S100 PolarHBondContact O-N 2.96Å |
| 97 | Y | 95.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -61.5 | -50.1 | 175.2 | 177.3 | -106.4 | 0 | 0 | 0 | 112.5 | F30 Q37 S59 V63 T93 N94 V95 A99 S100 F101 L109 A112 L116 | F30-Y97 HydrophobicContact CD2-CD1 4.49Å; F30-Y97 HydrophobicContact CD2-CE1 4.35Å; F30-Y97 HydrophobicContact CE2-CE1 4.31Å; Q37-Y97 PolarHBondContact NE2-OH 3.5Å; Q37-Y97 PolarHBondContact OE1-OH 3Å; S59-Y97 PolarHBondContact OG-OH 2.8Å; V63-Y97 HydrophobicContact CG2-CE2 4.31Å; T93-Y97 WeakPolarHBondContact O-CB 3.48Å; T93-Y97 PolarHBondContact O-N 3.37Å; N94-Y97 PolarHBondContact O-N 3.2Å; V95-Y97 VanDerWaalsContact C-N 3.34Å; V95-Y97 PolarHBondContact O-N 3.31Å; Y97-A99 VanDerWaalsContact C-N 3.32Å; Y97-A99 PolarHBondContact O-N 3.37Å; Y97-S100 VanDerWaalsContact O-CB 3.31Å; Y97-S100 WeakPolarHBondContact O-CB 3.49Å; Y97-S100 PolarHBondContact O-N 3.38Å; Y97-S100 VanDerWaalsContact O-N 3.12Å; Y97-S100 PolarHBondContact O-OG 2.99Å; Y97-F101 HydrophobicContact CD1-CE2 4.29Å; Y97-F101 AromaticContact CE1-CE2 3.74Å; Y97-F101 HydrophobicContact CE1-CE2 3.74Å; Y97-F101 HydrophobicContact CE1-CZ 4.45Å; Y97-F101 HydrophobicContact CE2-CE2 4.05Å; Y97-F101 AromaticContact CZ-CE2 3.6Å; Y97-F101 AromaticContact CZ-CZ 3.99Å; Y97-F101 WeakPolarHBondContact O-CD2 3.38Å; Y97-L109 HydrophobicContact CE2-CD1 4.15Å; Y97-A112 HydrophobicContact CD2-CB 4.34Å; Y97-L116 HydrophobicContact CD1-CD2 3.45Å; Y97-L116 VanDerWaalsContact CD1-CD2 3.45Å; Y97-L116 HydrophobicContact CD2-CB 4.29Å; Y97-L116 HydrophobicContact CD2-CD2 3.86Å; Y97-L116 HydrophobicContact CE1-CD2 3.9Å; Y97-L116 HydrophobicContact CE2-CD2 4.28Å; Y97-L116 HydrophobicContact CG-CB 4.23Å; Y97-L116 HydrophobicContact CG-CD2 3.42Å; Y97-L116 VanDerWaalsContact CG-CD2 3.42Å; Y97-L116 HydrophobicContact CG-CG 4.36Å |
| 98 | L | 94.5 | Very high | 91.9 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.3 | -37.5 | 178.8 | -67.8 | 168.3 | 0 | 0 | 0 | 111.7 | A29 C33 N94 V95 S100 F101 F185 | A29-L98 HydrophobicContact CB-CD1 3.63Å; C33-L98 HydrophobicContact CB-CD2 3.73Å; N94-L98 WeakPolarHBondContact O-CG 3.43Å; N94-L98 PolarHBondContact O-N 2.87Å; V95-L98 PolarHBondContact O-N 3.38Å; L98-S100 PolarHBondContact O-N 3.48Å; L98-F101 PolarHBondContact O-N 3.19Å; L98-F185 HydrophobicContact CD1-CB 4.46Å; L98-F185 HydrophobicContact CD2-CB 4.39Å |
| 99 | A | 93.7 | Very high | 91.5 | Very high | 34 Ų | 34 | 43.1 Ų | 43.1 | 28% | 0.281 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -64.1 | -28.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | V95 L96 Y97 F101 L102 T186 | V95-A99 VanDerWaalsContact O-CB 3.25Å; V95-A99 WeakPolarHBondContact O-CB 3.5Å; V95-A99 PolarHBondContact O-N 3.14Å; L96-A99 PolarHBondContact O-N 2.99Å; Y97-A99 VanDerWaalsContact C-N 3.32Å; Y97-A99 PolarHBondContact O-N 3.37Å; A99-F101 PolarHBondContact O-N 3.39Å; A99-L102 VanDerWaalsContact O-CB 3.27Å; A99-L102 WeakPolarHBondContact O-CB 3.17Å; A99-L102 WeakPolarHBondContact O-CG 3.5Å; A99-L102 PolarHBondContact O-N 3.07Å; A99-T186 HydrophobicContact CB-CG2 4Å; A99-T186 PolarHBondContact N-OG1 3.17Å |
| 100 | S | 91 | Very high | 91.4 | Very high | 8 Ų | 8 | 42.2 Ų | 42.2 | 6% | 0.056 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.4 | -26.8 | 177.8 | 79.8 | 0 | 0 | 0 | 0 | 113.1 | L96 Y97 L98 L102 Y103 | L96-S100 PolarHBondContact O-N 2.96Å; Y97-S100 VanDerWaalsContact O-CB 3.31Å; Y97-S100 WeakPolarHBondContact O-CB 3.49Å; Y97-S100 PolarHBondContact O-N 3.38Å; Y97-S100 VanDerWaalsContact O-N 3.12Å; Y97-S100 PolarHBondContact O-OG 2.99Å; L98-S100 PolarHBondContact O-N 3.48Å; S100-L102 VanDerWaalsContact C-N 3.28Å; S100-L102 PolarHBondContact O-N 3.49Å; S100-Y103 CarbonylContact O-C 3.23Å; S100-Y103 VanDerWaalsContact O-C 3.23Å; S100-Y103 PolarHBondContact O-N 2.79Å; S100-Y103 VanDerWaalsContact O-O 3.13Å |
| 101 | F | 87.5 | Confident | 91.3 | Very high | 10 Ų | 10 | 46.4 Ų | 46.4 | 4% | 0.044 | 23% | 0.231 | C | C | . | . | G | 310 helix | trans | -74 | -16.8 | 175.6 | -72.3 | -86.5 | 0 | 0 | 0 | 113.5 | C33 Q37 Y97 L98 A99 Y103 I104 L109 F182 | C33-F101 VanDerWaalsContact SG-CE2 3.6Å; Q37-F101 HydrophobicContact CB-CE1 3.9Å; Q37-F101 HydrophobicContact CB-CZ 3.9Å; Y97-F101 HydrophobicContact CD1-CE2 4.29Å; Y97-F101 AromaticContact CE1-CE2 3.74Å; Y97-F101 HydrophobicContact CE1-CE2 3.74Å; Y97-F101 HydrophobicContact CE1-CZ 4.45Å; Y97-F101 HydrophobicContact CE2-CE2 4.05Å; Y97-F101 AromaticContact CZ-CE2 3.6Å; Y97-F101 AromaticContact CZ-CZ 3.99Å; Y97-F101 WeakPolarHBondContact O-CD2 3.38Å; L98-F101 PolarHBondContact O-N 3.19Å; A99-F101 PolarHBondContact O-N 3.39Å; F101-Y103 VanDerWaalsContact C-N 3.27Å; F101-Y103 PolarHBondContact O-N 3.2Å; F101-I104 HydrophobicContact CD1-CD1 4.32Å; F101-L109 HydrophobicContact CD2-CD1 4.49Å; F101-L109 HydrophobicContact CE1-CD1 3.98Å; F101-L109 HydrophobicContact CE2-CD1 3.85Å; F101-L109 HydrophobicContact CZ-CD1 3.57Å; F101-F182 HydrophobicContact CB-CB 4.24Å; F101-F182 HydrophobicContact CB-CD1 3.51Å; F101-F182 HydrophobicContact CB-CD2 3.78Å; F101-F182 HydrophobicContact CB-CE1 3.69Å; F101-F182 HydrophobicContact CB-CE2 3.95Å; F101-F182 HydrophobicContact CB-CG 3.57Å; F101-F182 HydrophobicContact CB-CZ 3.91Å; F101-F182 AromaticContact CD1-CE1 3.95Å; F101-F182 HydrophobicContact CD1-CE1 3.95Å; F101-F182 HydrophobicContact CD1-CE2 4.09Å; F101-F182 AromaticContact CD1-CZ 3.65Å; F101-F182 HydrophobicContact CD1-CZ 3.65Å; F101-F182 HydrophobicContact CD2-CD1 4.12Å; F101-F182 AromaticContact CD2-CE1 3.75Å; F101-F182 HydrophobicContact CD2-CE1 3.75Å; F101-F182 HydrophobicContact CD2-CZ 4.3Å; F101-F182 HydrophobicContact CE1-CZ 4.22Å; F101-F182 HydrophobicContact CE2-CE1 4.35Å; F101-F182 AromaticContact CG-CD1 3.86Å; F101-F182 HydrophobicContact CG-CD1 3.86Å; F101-F182 HydrophobicContact CG-CD2 4.47Å; F101-F182 AromaticContact CG-CE1 3.51Å; F101-F182 HydrophobicContact CG-CE1 3.51Å; F101-F182 HydrophobicContact CG-CE2 4.17Å; F101-F182 HydrophobicContact CG-CG 4.33Å; F101-F182 AromaticContact CG-CZ 3.69Å; F101-F182 HydrophobicContact CG-CZ 3.69Å |
| 102 | L | 86.8 | Confident | 91.2 | Very high | 65 Ų | 65 | 47 Ų | 47 | 34% | 0.34 | 24% | 0.236 | S | C | . | . | G | 310 helix | trans | -69.5 | -29.3 | 174.5 | -59 | -179.8 | 0 | 0 | 0 | 112 | A99 S100 F182 I183 | A99-L102 VanDerWaalsContact O-CB 3.27Å; A99-L102 WeakPolarHBondContact O-CB 3.17Å; A99-L102 WeakPolarHBondContact O-CG 3.5Å; A99-L102 PolarHBondContact O-N 3.07Å; S100-L102 VanDerWaalsContact C-N 3.28Å; S100-L102 PolarHBondContact O-N 3.49Å; L102-F182 HydrophobicContact CD2-CB 3.75Å; L102-I183 HydrophobicContact CD1-CG1 4.36Å; L102-I183 HydrophobicContact CD2-CB 4.46Å; L102-I183 HydrophobicContact CD2-CG1 3.54Å |
| 103 | Y | 82.7 | Confident | 91.1 | Very high | 152 Ų | 152 | 43.2 Ų | 43.2 | 60% | 0.596 | 22% | 0.216 | S | C | * | . | G | 310 helix | trans | -132.1 | 76.6 | 174.4 | -173 | -113.8 | 0 | 0 | 0 | 109.6 | S100 F101 R105 | S100-Y103 CarbonylContact O-C 3.23Å; S100-Y103 VanDerWaalsContact O-C 3.23Å; S100-Y103 PolarHBondContact O-N 2.79Å; S100-Y103 VanDerWaalsContact O-O 3.13Å; F101-Y103 VanDerWaalsContact C-N 3.27Å; F101-Y103 PolarHBondContact O-N 3.2Å; Y103-R105 HydrophobicContact CD1-CG 4.35Å; Y103-R105 HydrophobicContact CE1-CG 3.96Å; Y103-R105 PolarHBondContact O-N 3.36Å |
| 104 | I | 78.3 | Confident | 91.1 | Very high | 27 Ų | 27 | 44.6 Ų | 44.6 | 14% | 0.138 | 23% | 0.228 | C | C | . | . | trans | -69.8 | 115.5 | -172.7 | -160.2 | 168.4 | 0 | 0 | 0 | 111.4 | I44 V51 F101 | I44-I104 HydrophobicContact CD1-CD1 3.61Å; I44-I104 HydrophobicContact CD1-CG2 4.06Å; I44-I104 HydrophobicContact CG2-CG2 3.68Å; V51-I104 HydrophobicContact CG1-CD1 4.48Å; V51-I104 HydrophobicContact CG2-CB 4.39Å; V51-I104 HydrophobicContact CG2-CD1 4.13Å; V51-I104 HydrophobicContact CG2-CG1 3.79Å; V51-I104 HydrophobicContact CG2-CG2 4Å; F101-I104 HydrophobicContact CD1-CD1 4.32Å | ||
| 105 | R | 83.4 | Confident | 91.2 | Very high | 119 Ų | 119 | 47.1 Ų | 47.1 | 45% | 0.449 | 24% | 0.244 | S | C | . | . | trans | -142.5 | 144.8 | 167.9 | -66.9 | -169.6 | -60.8 | 167.2 | -4.5 | 107.5 | Y103 E107 V108 L109 | Y103-R105 HydrophobicContact CD1-CG 4.35Å; Y103-R105 HydrophobicContact CE1-CG 3.96Å; Y103-R105 PolarHBondContact O-N 3.36Å; R105-E107 VanDerWaalsContact C-N 3.32Å; R105-E107 PolarHBondContact O-N 3.32Å; R105-V108 HydrophobicContact CB-CB 4.43Å; R105-V108 HydrophobicContact CB-CG2 4.13Å; R105-V108 VanDerWaalsContact NH2-CG2 3.33Å; R105-V108 PolarHBondContact O-N 2.87Å; R105-L109 WeakPolarHBondContact O-CB 3.25Å; R105-L109 PolarHBondContact O-N 3.29Å | ||
| 106 | N | 84.7 | Confident | 91.2 | Very high | 24 Ų | 24 | 45.8 Ų | 45.8 | 13% | 0.128 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -49.9 | -51.7 | -179.6 | -70.8 | -22 | 0 | 0 | 0 | 112.2 | V51 D52 V108 L109 Y110 | V51-N106 VanDerWaalsContact CA-OD1 3.23Å; V51-N106 WeakPolarHBondContact CA-OD1 3.44Å; D52-N106 PolarHBondContact N-ND2 2.93Å; D52-N106 PolarHBondContact N-OD1 3.26Å; D52-N106 PolarHBondContact OD1-ND2 3.49Å; D52-N106 PolarHBondContact OD2-ND2 3.02Å; N106-V108 PolarHBondContact O-N 2.83Å; N106-L109 PolarHBondContact O-N 3.14Å; N106-Y110 HydrophobicContact CB-CD2 4.46Å; N106-Y110 HydrophobicContact CB-CE2 4.1Å; N106-Y110 WeakPolarHBondContact O-CB 3.21Å; N106-Y110 WeakPolarHBondContact O-CD2 3.46Å; N106-Y110 VanDerWaalsContact O-CG 3.23Å; N106-Y110 PolarHBondContact O-N 3.44Å |
| 107 | E | 87.2 | Confident | 91.2 | Very high | 137 Ų | 137 | 41.1 Ų | 41.1 | 64% | 0.64 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -60.6 | -42.9 | -177.5 | -52.8 | -51.1 | 145.1 | 0 | 0 | 113.1 | R105 T111 | R105-E107 VanDerWaalsContact C-N 3.32Å; R105-E107 PolarHBondContact O-N 3.32Å; E107-T111 VanDerWaalsContact O-CB 3.25Å; E107-T111 WeakPolarHBondContact O-CB 3.43Å; E107-T111 PolarHBondContact O-N 3.03Å; E107-T111 PolarHBondContact O-OG1 3.45Å |
| 108 | V | 90.6 | Very high | 91.3 | Very high | 47 Ų | 47 | 44.7 Ų | 44.7 | 29% | 0.285 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -70 | -43.9 | -178.8 | -177.5 | 0 | 0 | 0 | 0 | 109.9 | R105 N106 A112 | R105-V108 HydrophobicContact CB-CB 4.43Å; R105-V108 HydrophobicContact CB-CG2 4.13Å; R105-V108 VanDerWaalsContact NH2-CG2 3.33Å; R105-V108 PolarHBondContact O-N 2.87Å; N106-V108 PolarHBondContact O-N 2.83Å; V108-A112 WeakPolarHBondContact O-CB 3.44Å; V108-A112 PolarHBondContact O-N 3.46Å |
| 109 | L | 90.3 | Very high | 91.4 | Very high | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.005 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62.3 | -52.2 | 179.2 | 179.6 | 61.5 | 0 | 0 | 0 | 110.6 | A55 Y97 F101 R105 N106 T111 A112 S113 | A55-L109 HydrophobicContact CB-CD2 4.27Å; Y97-L109 HydrophobicContact CE2-CD1 4.15Å; F101-L109 HydrophobicContact CD2-CD1 4.49Å; F101-L109 HydrophobicContact CE1-CD1 3.98Å; F101-L109 HydrophobicContact CE2-CD1 3.85Å; F101-L109 HydrophobicContact CZ-CD1 3.57Å; R105-L109 WeakPolarHBondContact O-CB 3.25Å; R105-L109 PolarHBondContact O-N 3.29Å; N106-L109 PolarHBondContact O-N 3.14Å; L109-T111 PolarHBondContact O-N 3.19Å; L109-A112 CarbonylContact O-C 3.58Å; L109-A112 PolarHBondContact O-N 3.03Å; L109-A112 VanDerWaalsContact O-N 3.16Å; L109-S113 WeakPolarHBondContact O-CB 3.49Å; L109-S113 PolarHBondContact O-N 2.77Å; L109-S113 PolarHBondContact O-OG 2.86Å |
| 110 | Y | 93.8 | Very high | 91.6 | Very high | 43 Ų | 43 | 43.7 Ų | 43.7 | 17% | 0.169 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.9 | -38.5 | -177.8 | -62.6 | -18.8 | 0 | 0 | 0 | 112.8 | D52 A55 N58 I62 N106 S113 A114 | D52-Y110 PolarHBondContact OD2-OH 2.98Å; A55-Y110 HydrophobicContact CB-CE1 4.27Å; N58-Y110 HydrophobicContact CB-CE1 3.79Å; N58-Y110 PolarHBondContact ND2-OH 3.32Å; I62-Y110 HydrophobicContact CD1-CD1 3.78Å; I62-Y110 HydrophobicContact CD1-CG 3.82Å; N106-Y110 HydrophobicContact CB-CD2 4.46Å; N106-Y110 HydrophobicContact CB-CE2 4.1Å; N106-Y110 WeakPolarHBondContact O-CB 3.21Å; N106-Y110 WeakPolarHBondContact O-CD2 3.46Å; N106-Y110 VanDerWaalsContact O-CG 3.23Å; N106-Y110 PolarHBondContact O-N 3.44Å; Y110-S113 WeakPolarHBondContact O-CB 3.38Å; Y110-S113 PolarHBondContact O-N 3.06Å; Y110-A114 PolarHBondContact O-N 2.73Å |
| 111 | T | 95 | Very high | 91.8 | Very high | 89 Ų | 89 | 43.4 Ų | 43.4 | 55% | 0.546 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.4 | -45.5 | 173.2 | -56.9 | 0 | 0 | 0 | 0 | 110.8 | E107 L109 S113 A114 V115 | E107-T111 VanDerWaalsContact O-CB 3.25Å; E107-T111 WeakPolarHBondContact O-CB 3.43Å; E107-T111 PolarHBondContact O-N 3.03Å; E107-T111 PolarHBondContact O-OG1 3.45Å; L109-T111 PolarHBondContact O-N 3.19Å; T111-S113 VanDerWaalsContact C-N 3.34Å; T111-S113 PolarHBondContact O-N 3.13Å; T111-A114 PolarHBondContact O-N 3.09Å; T111-V115 VanDerWaalsContact O-CG2 3.32Å; T111-V115 WeakPolarHBondContact O-CG2 3.46Å; T111-V115 PolarHBondContact O-N 3.27Å |
| 112 | A | 95.5 | Very high | 92.2 | Very high | 13 Ų | 13 | 42.9 Ų | 42.9 | 11% | 0.107 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.5 | -35.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y97 V108 L109 V115 L116 | Y97-A112 HydrophobicContact CD2-CB 4.34Å; V108-A112 WeakPolarHBondContact O-CB 3.44Å; V108-A112 PolarHBondContact O-N 3.46Å; L109-A112 CarbonylContact O-C 3.58Å; L109-A112 PolarHBondContact O-N 3.03Å; L109-A112 VanDerWaalsContact O-N 3.16Å; A112-V115 PolarHBondContact O-N 3.2Å; A112-L116 WeakPolarHBondContact O-CB 3.43Å; A112-L116 PolarHBondContact O-N 2.9Å |
| 113 | S | 95.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60.7 | -44.2 | 173.1 | -59 | 0 | 0 | 0 | 0 | 111.9 | S59 L109 Y110 T111 L116 G117 | S59-S113 PolarHBondContact OG-OG 3.27Å; L109-S113 WeakPolarHBondContact O-CB 3.49Å; L109-S113 PolarHBondContact O-N 2.77Å; L109-S113 PolarHBondContact O-OG 2.86Å; Y110-S113 WeakPolarHBondContact O-CB 3.38Å; Y110-S113 PolarHBondContact O-N 3.06Å; T111-S113 VanDerWaalsContact C-N 3.34Å; T111-S113 PolarHBondContact O-N 3.13Å; S113-L116 PolarHBondContact O-N 3.17Å; S113-G117 PolarHBondContact O-N 3.13Å |
| 114 | A | 97.6 | Very high | 93.1 | Very high | 36 Ų | 36 | 36.8 Ų | 36.8 | 30% | 0.298 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -65.7 | -44.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | I62 V66 Y110 T111 L116 G117 F118 | I62-A114 HydrophobicContact CG2-CB 3.94Å; V66-A114 WeakPolarHBondContact CG1-O 3.05Å; V66-A114 HydrophobicContact CG2-CB 4.22Å; Y110-A114 PolarHBondContact O-N 2.73Å; T111-A114 PolarHBondContact O-N 3.09Å; A114-L116 VanDerWaalsContact C-N 3.3Å; A114-L116 PolarHBondContact O-N 2.97Å; A114-G117 PolarHBondContact O-N 3.11Å; A114-F118 PolarHBondContact O-N 2.92Å; A114-F118 VanDerWaalsContact O-N 3.15Å |
| 115 | V | 97.7 | Very high | 93.8 | Very high | 58 Ų | 58 | 37.3 Ų | 37.3 | 35% | 0.352 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -61 | -40.4 | 175.7 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | T93 T111 A112 F118 G119 | T93-V115 HydrophobicContact CG2-CG1 3.78Å; T111-V115 VanDerWaalsContact O-CG2 3.32Å; T111-V115 WeakPolarHBondContact O-CG2 3.46Å; T111-V115 PolarHBondContact O-N 3.27Å; A112-V115 PolarHBondContact O-N 3.2Å; V115-F118 PolarHBondContact O-N 2.79Å; V115-G119 PolarHBondContact O-N 2.97Å |
| 116 | L | 97.4 | Very high | 94.2 | Very high | 1 Ų | 1 | 31.7 Ų | 31.7 | 1% | 0.005 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.5 | -42.5 | 174.6 | 178.5 | 61.5 | 0 | 0 | 0 | 112.5 | F30 V63 N94 Y97 A112 S113 A114 F118 G119 S120 | F30-L116 HydrophobicContact CD2-CD2 3.96Å; F30-L116 HydrophobicContact CE2-CD2 3.55Å; V63-L116 HydrophobicContact CG1-CD2 4.18Å; V63-L116 HydrophobicContact CG1-CG 4.33Å; V63-L116 HydrophobicContact CG2-CD2 4.04Å; N94-L116 HydrophobicContact CB-CD1 3.95Å; Y97-L116 HydrophobicContact CD1-CD2 3.45Å; Y97-L116 VanDerWaalsContact CD1-CD2 3.45Å; Y97-L116 HydrophobicContact CD2-CB 4.29Å; Y97-L116 HydrophobicContact CD2-CD2 3.86Å; Y97-L116 HydrophobicContact CE1-CD2 3.9Å; Y97-L116 HydrophobicContact CE2-CD2 4.28Å; Y97-L116 HydrophobicContact CG-CB 4.23Å; Y97-L116 HydrophobicContact CG-CD2 3.42Å; Y97-L116 VanDerWaalsContact CG-CD2 3.42Å; Y97-L116 HydrophobicContact CG-CG 4.36Å; A112-L116 WeakPolarHBondContact O-CB 3.43Å; A112-L116 PolarHBondContact O-N 2.9Å; S113-L116 PolarHBondContact O-N 3.17Å; A114-L116 VanDerWaalsContact C-N 3.3Å; A114-L116 PolarHBondContact O-N 2.97Å; L116-F118 VanDerWaalsContact C-N 3.29Å; L116-F118 PolarHBondContact O-N 2.92Å; L116-G119 PolarHBondContact O-N 3.09Å; L116-S120 VanDerWaalsContact CD1-OG 3.32Å; L116-S120 WeakPolarHBondContact CD1-OG 3.22Å; L116-S120 WeakPolarHBondContact O-CB 3.38Å; L116-S120 PolarHBondContact O-N 2.77Å; L116-S120 PolarHBondContact O-OG 3.12Å |
| 117 | G | 97.5 | Very high | 94.6 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -57.2 | -45.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | V63 L67 S113 A114 S121 | V63-G117 WeakPolarHBondContact O-CA 3.48Å; L67-G117 WeakPolarHBondContact CA-O 3.37Å; S113-G117 PolarHBondContact O-N 3.13Å; A114-G117 PolarHBondContact O-N 3.11Å; G117-S121 PolarHBondContact O-N 3.08Å |
| 118 | F | 96.9 | Very high | 94.8 | Very high | 74 Ų | 74 | 26.6 Ų | 26.6 | 33% | 0.325 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -60.5 | -52 | 173.3 | 171.8 | -106.1 | 0 | 0 | 0 | 111.7 | V66 C70 I77 L89 A114 V115 L116 S120 S121 L122 | V66-F118 HydrophobicContact CG1-CB 4.41Å; C70-F118 HydrophobicContact CB-CD2 4.25Å; I77-F118 HydrophobicContact CD1-CE2 4.27Å; L89-F118 HydrophobicContact CD2-CE1 4.42Å; A114-F118 PolarHBondContact O-N 2.92Å; A114-F118 VanDerWaalsContact O-N 3.15Å; V115-F118 PolarHBondContact O-N 2.79Å; L116-F118 VanDerWaalsContact C-N 3.29Å; L116-F118 PolarHBondContact O-N 2.92Å; F118-S120 PolarHBondContact O-N 3.04Å; F118-S121 WeakPolarHBondContact O-CB 3.4Å; F118-S121 PolarHBondContact O-N 3.21Å; F118-S121 PolarHBondContact O-OG 2.93Å; F118-L122 HydrophobicContact CE1-CD1 3.85Å; F118-L122 HydrophobicContact CE2-CD1 4.25Å; F118-L122 HydrophobicContact CZ-CD1 3.67Å; F118-L122 HydrophobicContact CZ-CG 4.47Å; F118-L122 PolarHBondContact O-N 3.18Å |
| 119 | G | 97.2 | Very high | 94.6 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -66.9 | -34.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | G90 T93 V115 L116 S121 L122 L123 | G90-G119 WeakPolarHBondContact CA-O 3.41Å; T93-G119 WeakPolarHBondContact OG1-CA 3.42Å; V115-G119 PolarHBondContact O-N 2.97Å; L116-G119 PolarHBondContact O-N 3.09Å; G119-S121 VanDerWaalsContact C-N 3.3Å; G119-S121 PolarHBondContact O-N 3.36Å; G119-L122 PolarHBondContact O-N 3.12Å; G119-L123 WeakPolarHBondContact O-CB 3.3Å; G119-L123 PolarHBondContact O-N 3.4Å |
| 120 | S | 96.4 | Very high | 94.7 | Very high | 14 Ų | 14 | 26.3 Ų | 26.3 | 10% | 0.098 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -63.5 | -37.8 | 175.5 | -64.5 | 0 | 0 | 0 | 0 | 111.2 | L116 F118 L122 L123 W124 | L116-S120 VanDerWaalsContact CD1-OG 3.32Å; L116-S120 WeakPolarHBondContact CD1-OG 3.22Å; L116-S120 WeakPolarHBondContact O-CB 3.38Å; L116-S120 PolarHBondContact O-N 2.77Å; L116-S120 PolarHBondContact O-OG 3.12Å; F118-S120 PolarHBondContact O-N 3.04Å; S120-L122 VanDerWaalsContact C-N 3.3Å; S120-L122 PolarHBondContact O-N 2.88Å; S120-L123 PolarHBondContact O-N 3.36Å; S120-W124 PolarHBondContact O-N 3.22Å |
| 121 | S | 96.3 | Very high | 94.4 | Very high | 1 Ų | 1 | 24.8 Ų | 24.8 | 1% | 0.007 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -58 | -44.7 | 174.7 | 76.4 | 0 | 0 | 0 | 0 | 111.6 | L67 C70 N71 G117 F118 G119 V125 | L67-S121 VanDerWaalsContact CD1-CA 3.48Å; L67-S121 VanDerWaalsContact CD1-N 3.31Å; C70-S121 WeakPolarHBondContact CB-OG 3.42Å; N71-S121 VanDerWaalsContact OD1-CA 3.26Å; N71-S121 WeakPolarHBondContact OD1-CA 3.4Å; N71-S121 WeakPolarHBondContact OD1-CB 3.37Å; G117-S121 PolarHBondContact O-N 3.08Å; F118-S121 WeakPolarHBondContact O-CB 3.4Å; F118-S121 PolarHBondContact O-N 3.21Å; F118-S121 PolarHBondContact O-OG 2.93Å; G119-S121 VanDerWaalsContact C-N 3.3Å; G119-S121 PolarHBondContact O-N 3.36Å; S121-V125 WeakPolarHBondContact O-CB 3.41Å; S121-V125 WeakPolarHBondContact O-CG2 3.39Å; S121-V125 PolarHBondContact O-N 3.42Å; S121-V125 VanDerWaalsContact O-N 3.16Å |
| 122 | L | 95.7 | Very high | 93.9 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -72.1 | -34.1 | 178.5 | -58.6 | -175.8 | 0 | 0 | 0 | 112.4 | A74 I77 V78 L89 F118 G119 S120 G126 | A74-L122 HydrophobicContact CB-CD2 4.17Å; I77-L122 HydrophobicContact CB-CD2 3.87Å; I77-L122 HydrophobicContact CD1-CD2 4.3Å; I77-L122 HydrophobicContact CG2-CD1 4.08Å; I77-L122 HydrophobicContact CG2-CD2 3.61Å; V78-L122 HydrophobicContact CG2-CD2 4.25Å; L89-L122 HydrophobicContact CD2-CD1 3.75Å; L89-L122 HydrophobicContact CG-CD1 4.48Å; F118-L122 HydrophobicContact CE1-CD1 3.85Å; F118-L122 HydrophobicContact CE2-CD1 4.25Å; F118-L122 HydrophobicContact CZ-CD1 3.67Å; F118-L122 HydrophobicContact CZ-CG 4.47Å; F118-L122 PolarHBondContact O-N 3.18Å; G119-L122 PolarHBondContact O-N 3.12Å; S120-L122 VanDerWaalsContact C-N 3.3Å; S120-L122 PolarHBondContact O-N 2.88Å; L122-G126 VanDerWaalsContact O-CA 3.3Å; L122-G126 WeakPolarHBondContact O-CA 3.47Å; L122-G126 PolarHBondContact O-N 2.8Å |
| 123 | L | 95.6 | Very high | 93.4 | Very high | 6 Ų | 6 | 26.8 Ų | 26.8 | 3% | 0.031 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.7 | -49.5 | 178.6 | -172.8 | 140.8 | 0 | 0 | 0 | 111.3 | F23 I26 A91 G119 S120 Q127 | F23-L123 HydrophobicContact CD1-CD2 4.13Å; F23-L123 HydrophobicContact CE1-CD2 3.21Å; F23-L123 HydrophobicContact CE1-CG 4.06Å; F23-L123 HydrophobicContact CZ-CD2 3.47Å; F23-L123 VanDerWaalsContact CZ-CD2 3.47Å; F23-L123 HydrophobicContact CZ-CG 3.78Å; I26-L123 HydrophobicContact CG2-CD1 4.47Å; A91-L123 HydrophobicContact CB-CD1 4.37Å; G119-L123 WeakPolarHBondContact O-CB 3.3Å; G119-L123 PolarHBondContact O-N 3.4Å; S120-L123 PolarHBondContact O-N 3.36Å; L123-Q127 WeakPolarHBondContact O-CB 3.38Å; L123-Q127 PolarHBondContact O-N 3.48Å |
| 124 | W | 93.2 | Very high | 92.8 | Very high | 83 Ų | 83 | 27.3 Ų | 27.3 | 31% | 0.314 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -71.3 | -43.9 | -179 | -74.5 | 108.9 | 0 | 0 | 0 | 112.6 | L27 S120 Q127 G128 F151 | L27-W124 HydrophobicContact CD1-CH2 4.01Å; L27-W124 HydrophobicContact CD1-CZ2 4.04Å; L27-W124 HydrophobicContact CD2-CZ2 4.18Å; S120-W124 PolarHBondContact O-N 3.22Å; W124-Q127 VanDerWaalsContact CE3-OE1 3.31Å; W124-Q127 WeakPolarHBondContact O-CB 3.44Å; W124-Q127 PolarHBondContact O-N 3.04Å; W124-G128 PolarHBondContact O-N 3.43Å; W124-G128 VanDerWaalsContact O-N 3.07Å; W124-F151 HydrophobicContact CH2-CD1 4.36Å; W124-F151 AromaticContact CH2-CE1 3.89Å; W124-F151 HydrophobicContact CH2-CE1 3.89Å; W124-F151 HydrophobicContact CH2-CE2 4.48Å; W124-F151 AromaticContact CH2-CZ 3.95Å; W124-F151 HydrophobicContact CH2-CZ 3.95Å; W124-F151 HydrophobicContact CZ2-CZ 4.4Å |
| 125 | V | 92.1 | Very high | 92 | Very high | 38 Ų | 38 | 26.1 Ų | 26.1 | 23% | 0.23 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -67.6 | -39.5 | 176.3 | 178.1 | 0 | 0 | 0 | 0 | 111 | A74 V78 S121 Q127 G128 N129 | A74-V125 HydrophobicContact CB-CB 4.11Å; A74-V125 HydrophobicContact CB-CG1 4.45Å; A74-V125 HydrophobicContact CB-CG2 3.67Å; V78-V125 HydrophobicContact CB-CG1 4.24Å; V78-V125 HydrophobicContact CG2-CB 4.06Å; V78-V125 HydrophobicContact CG2-CG1 3.82Å; S121-V125 WeakPolarHBondContact O-CB 3.41Å; S121-V125 WeakPolarHBondContact O-CG2 3.39Å; S121-V125 PolarHBondContact O-N 3.42Å; S121-V125 VanDerWaalsContact O-N 3.16Å; V125-Q127 VanDerWaalsContact C-N 3.35Å; V125-Q127 PolarHBondContact O-N 3.33Å; V125-G128 PolarHBondContact O-N 3.45Å; V125-N129 WeakPolarHBondContact O-CB 3.35Å; V125-N129 PolarHBondContact O-N 3.32Å |
| 126 | G | 92.8 | Very high | 91.1 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.4 | -42.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L122 N129 Y130 | L122-G126 VanDerWaalsContact O-CA 3.3Å; L122-G126 WeakPolarHBondContact O-CA 3.47Å; L122-G126 PolarHBondContact O-N 2.8Å; G126-N129 PolarHBondContact O-N 3.48Å; G126-Y130 WeakPolarHBondContact O-CB 3.46Å; G126-Y130 PolarHBondContact O-N 2.88Å |
| 127 | Q | 93.3 | Very high | 89.9 | Confident | 23 Ų | 23 | 38 Ų | 38 | 11% | 0.107 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -60.7 | -50.5 | 175 | -174.9 | -131.5 | -5.3 | 0 | 0 | 112 | L19 F23 M87 L123 W124 V125 N129 Y130 I131 | L19-Q127 HydrophobicContact CD2-CG 4.33Å; F23-Q127 HydrophobicContact CD1-CG 4.39Å; F23-Q127 HydrophobicContact CE1-CB 3.85Å; F23-Q127 HydrophobicContact CE1-CG 3.76Å; F23-Q127 HydrophobicContact CE2-CB 4.21Å; F23-Q127 HydrophobicContact CE2-CG 4.09Å; F23-Q127 HydrophobicContact CZ-CB 3.48Å; F23-Q127 VanDerWaalsContact CZ-CB 3.48Å; F23-Q127 HydrophobicContact CZ-CG 3.65Å; M87-Q127 VanDerWaalsContact SD-CA 3.56Å; M87-Q127 HydrophobicContact SD-CB 4.14Å; L123-Q127 WeakPolarHBondContact O-CB 3.38Å; L123-Q127 PolarHBondContact O-N 3.48Å; W124-Q127 VanDerWaalsContact CE3-OE1 3.31Å; W124-Q127 WeakPolarHBondContact O-CB 3.44Å; W124-Q127 PolarHBondContact O-N 3.04Å; V125-Q127 VanDerWaalsContact C-N 3.35Å; V125-Q127 PolarHBondContact O-N 3.33Å; Q127-N129 VanDerWaalsContact C-N 3.3Å; Q127-N129 PolarHBondContact O-N 2.94Å; Q127-Y130 PolarHBondContact O-N 3.3Å; Q127-I131 HydrophobicContact CG-CD1 3.91Å; Q127-I131 VanDerWaalsContact O-CG1 3.32Å; Q127-I131 WeakPolarHBondContact O-CG1 3.35Å; Q127-I131 PolarHBondContact O-N 2.91Å |
| 128 | G | 89.6 | Confident | 88.6 | Confident | 32 Ų | 32 | 43 Ų | 43 | 33% | 0.33 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.7 | -42 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | W124 V125 T132 | W124-G128 PolarHBondContact O-N 3.43Å; W124-G128 VanDerWaalsContact O-N 3.07Å; V125-G128 PolarHBondContact O-N 3.45Å; G128-T132 WeakPolarHBondContact O-CB 2.96Å; G128-T132 PolarHBondContact O-N 3.02Å; G128-T132 VanDerWaalsContact O-N 3.12Å; G128-T132 PolarHBondContact O-OG1 3.05Å |
| 129 | N | 87.9 | Confident | 87.6 | Confident | 41 Ų | 41 | 40.1 Ų | 40.1 | 22% | 0.219 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.8 | -48.1 | 175.5 | -168.9 | -29.2 | 0 | 0 | 0 | 111.1 | V78 A83 V125 G126 Q127 I131 T132 L133 | V78-N129 HydrophobicContact CG1-CB 4.04Å; A83-N129 HydrophobicContact CB-CB 4.11Å; V125-N129 WeakPolarHBondContact O-CB 3.35Å; V125-N129 PolarHBondContact O-N 3.32Å; G126-N129 PolarHBondContact O-N 3.48Å; Q127-N129 VanDerWaalsContact C-N 3.3Å; Q127-N129 PolarHBondContact O-N 2.94Å; N129-I131 PolarHBondContact O-N 2.92Å; N129-T132 WeakPolarHBondContact O-CB 3.09Å; N129-T132 PolarHBondContact O-N 3.26Å; N129-T132 VanDerWaalsContact O-N 3.09Å; N129-L133 WeakPolarHBondContact O-CG 3.22Å; N129-L133 PolarHBondContact O-N 3.46Å; N129-L133 WeakPolarHBondContact OD1-CD1 3.36Å; N129-L133 WeakPolarHBondContact OD1-CG 3.02Å |
| 130 | Y | 90.8 | Very high | 86.5 | Confident | 1 Ų | 1 | 42.3 Ų | 42.3 | 0% | 0.004 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.6 | -46 | 179.6 | -167.7 | -84.7 | 0 | 0 | 0 | 112.4 | P15 L19 A83 M87 G126 Q127 T132 L133 V134 L199 K200 V202 | P15-Y130 HydrophobicContact CB-CE1 4.41Å; L19-Y130 HydrophobicContact CD2-CD1 3.93Å; A83-Y130 HydrophobicContact CB-CD2 4.21Å; M87-Y130 HydrophobicContact CE-CD2 3.71Å; M87-Y130 HydrophobicContact CE-CG 3.76Å; G126-Y130 WeakPolarHBondContact O-CB 3.46Å; G126-Y130 PolarHBondContact O-N 2.88Å; Q127-Y130 PolarHBondContact O-N 3.3Å; Y130-T132 PolarHBondContact O-N 3.43Å; Y130-L133 PolarHBondContact O-N 2.87Å; Y130-V134 HydrophobicContact CD1-CG1 4.2Å; Y130-V134 HydrophobicContact CE1-CB 4.2Å; Y130-V134 HydrophobicContact CE1-CG1 4.13Å; Y130-V134 WeakPolarHBondContact O-CG1 3.1Å; Y130-V134 PolarHBondContact O-N 3.19Å; Y130-L199 HydrophobicContact CD1-CD2 4.11Å; Y130-L199 HydrophobicContact CD2-CD2 3.92Å; Y130-L199 HydrophobicContact CE1-CD1 4.5Å; Y130-L199 HydrophobicContact CE1-CD2 3.68Å; Y130-L199 HydrophobicContact CE1-CG 4.21Å; Y130-L199 HydrophobicContact CE2-CD2 3.47Å; Y130-L199 VanDerWaalsContact CE2-CD2 3.47Å; Y130-L199 HydrophobicContact CE2-CG 3.93Å; Y130-L199 HydrophobicContact CG-CD2 4.23Å; Y130-L199 WeakPolarHBondContact OH-CG 3.41Å; Y130-K200 WeakPolarHBondContact CE2-O 3.34Å; Y130-K200 PolarHBondContact OH-O 3.24Å; Y130-K200 VanDerWaalsContact OH-O 3.09Å; Y130-V202 HydrophobicContact CE2-CB 4.43Å; Y130-V202 HydrophobicContact CE2-CG2 3.98Å |
| 131 | I | 88.1 | Confident | 85.3 | Confident | 11 Ų | 11 | 44.4 Ų | 44.4 | 6% | 0.056 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -59.2 | -41 | 176.9 | -68 | 166.6 | 0 | 0 | 0 | 110.2 | L19 Q127 N129 S135 N143 V147 | L19-I131 HydrophobicContact CD2-CD1 4.22Å; L19-I131 HydrophobicContact CD2-CG1 3.69Å; Q127-I131 HydrophobicContact CG-CD1 3.91Å; Q127-I131 VanDerWaalsContact O-CG1 3.32Å; Q127-I131 WeakPolarHBondContact O-CG1 3.35Å; Q127-I131 PolarHBondContact O-N 2.91Å; N129-I131 PolarHBondContact O-N 2.92Å; I131-S135 WeakPolarHBondContact O-CB 3.36Å; I131-S135 PolarHBondContact O-N 3.25Å; I131-S135 VanDerWaalsContact O-N 3.17Å; I131-S135 PolarHBondContact O-OG 3.46Å; I131-N143 HydrophobicContact CG2-CB 4.46Å; I131-V147 HydrophobicContact CD1-CB 4.17Å; I131-V147 HydrophobicContact CD1-CG1 4.27Å; I131-V147 HydrophobicContact CD1-CG2 3.91Å; I131-V147 HydrophobicContact CG1-CG2 4.31Å |
| 132 | T | 84.9 | Confident | 84.3 | Confident | 83 Ų | 83 | 51.3 Ų | 51.3 | 51% | 0.509 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -66.7 | -39.9 | 178.6 | -55.5 | 0 | 0 | 0 | 0 | 111.9 | G128 N129 Y130 | G128-T132 WeakPolarHBondContact O-CB 2.96Å; G128-T132 PolarHBondContact O-N 3.02Å; G128-T132 VanDerWaalsContact O-N 3.12Å; G128-T132 PolarHBondContact O-OG1 3.05Å; N129-T132 WeakPolarHBondContact O-CB 3.09Å; N129-T132 PolarHBondContact O-N 3.26Å; N129-T132 VanDerWaalsContact O-N 3.09Å; Y130-T132 PolarHBondContact O-N 3.43Å |
| 133 | L | 84.3 | Confident | 83.5 | Confident | 61 Ų | 61 | 51.5 Ų | 51.5 | 32% | 0.319 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -72.2 | -34.8 | 179.7 | -70.3 | 175.2 | 0 | 0 | 0 | 113.4 | N129 Y130 S135 V202 | N129-L133 WeakPolarHBondContact O-CG 3.22Å; N129-L133 PolarHBondContact O-N 3.46Å; N129-L133 WeakPolarHBondContact OD1-CD1 3.36Å; N129-L133 WeakPolarHBondContact OD1-CG 3.02Å; Y130-L133 PolarHBondContact O-N 2.87Å; L133-S135 VanDerWaalsContact C-N 3.32Å; L133-V202 HydrophobicContact CB-CB 4.39Å; L133-V202 HydrophobicContact CB-CG1 3.85Å |
| 134 | V | 83.5 | Confident | 82.8 | Confident | 11 Ų | 11 | 52.3 Ų | 52.3 | 7% | 0.067 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -87.4 | -2.8 | 179.9 | 78.5 | 0 | 0 | 0 | 0 | 112.9 | H11 P15 I16 Y130 | H11-V134 PolarHBondContact CE1-O 2.97Å; H11-V134 PolarHBondContact ND1-O 3.34Å; P15-V134 HydrophobicContact CB-CG2 4.17Å; P15-V134 HydrophobicContact CG-CG2 4.35Å; I16-V134 HydrophobicContact CD1-CG1 3.4Å; I16-V134 HydrophobicContact CG1-CG1 4.19Å; Y130-V134 HydrophobicContact CD1-CG1 4.2Å; Y130-V134 HydrophobicContact CE1-CB 4.2Å; Y130-V134 HydrophobicContact CE1-CG1 4.13Å; Y130-V134 WeakPolarHBondContact O-CG1 3.1Å; Y130-V134 PolarHBondContact O-N 3.19Å |
| 135 | S | 81.8 | Confident | 82.1 | Confident | 10 Ų | 10 | 51 Ų | 51 | 7% | 0.07 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -122.7 | 145.1 | -176 | -51.8 | 0 | 0 | 0 | 0 | 111.9 | I131 L133 N143 | I131-S135 WeakPolarHBondContact O-CB 3.36Å; I131-S135 PolarHBondContact O-N 3.25Å; I131-S135 VanDerWaalsContact O-N 3.17Å; I131-S135 PolarHBondContact O-OG 3.46Å; L133-S135 VanDerWaalsContact C-N 3.32Å; S135-N143 PolarHBondContact OG-ND2 2.79Å |
| 136 | N | 77.1 | Confident | 81.5 | Confident | 98 Ų | 98 | 51.2 Ų | 51.2 | 52% | 0.524 | 31% | 0.306 | S | S | . | . | trans | -81.4 | 160.4 | 169.7 | -63.3 | -36.5 | 0 | 0 | 0 | 111 | A138 S139 V140 | N136-A138 PolarHBondContact O-N 2.96Å; N136-S139 PolarHBondContact N-OG 2.95Å; N136-S139 CarbonylContact O-C 3.6Å; N136-S139 WeakPolarHBondContact O-CA 3.35Å; N136-S139 PolarHBondContact O-N 3.43Å; N136-S139 PolarHBondContact O-OG 3.26Å; N136-V140 WeakPolarHBondContact O-CG2 3.43Å; N136-V140 PolarHBondContact O-N 2.92Å | ||
| 137 | K | 73 | Confident | 81.2 | Confident | 211 Ų | 211 | 51.2 Ų | 51.2 | 92% | 0.917 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -46.6 | -40.7 | 179.5 | -66.7 | -176.4 | 179.6 | -179.9 | 0 | 114 | ||
| 138 | A | 69.4 | Low | 80.6 | Confident | 104 Ų | 104 | 52.8 Ų | 52.8 | 86% | 0.86 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.5 | -19.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | N136 | N136-A138 PolarHBondContact O-N 2.96Š|
| 139 | S | 76.3 | Confident | 80.1 | Confident | 15 Ų | 15 | 53.2 Ų | 53.2 | 11% | 0.105 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.5 | -14.9 | -173.9 | 60.9 | 0 | 0 | 0 | 0 | 114.9 | N136 G141 R142 N143 | N136-S139 PolarHBondContact N-OG 2.95Å; N136-S139 CarbonylContact O-C 3.6Å; N136-S139 WeakPolarHBondContact O-CA 3.35Å; N136-S139 PolarHBondContact O-N 3.43Å; N136-S139 PolarHBondContact O-OG 3.26Å; S139-G141 VanDerWaalsContact C-N 3.31Å; S139-G141 PolarHBondContact O-N 2.87Å; S139-R142 PolarHBondContact O-N 3.47Å; S139-N143 WeakPolarHBondContact O-CB 3.31Å; S139-N143 PolarHBondContact O-N 3.44Å |
| 140 | V | 75.1 | Confident | 80 | Confident | 46 Ų | 46 | 53.3 Ų | 53.3 | 28% | 0.279 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -53.1 | -48.3 | -179.9 | 167.8 | 0 | 0 | 0 | 0 | 110.9 | N136 N143 G144 | N136-V140 WeakPolarHBondContact O-CG2 3.43Å; N136-V140 PolarHBondContact O-N 2.92Å; V140-N143 PolarHBondContact O-N 3.07Å; V140-G144 PolarHBondContact O-N 3.15Å |
| 141 | G | 70.4 | Confident | 79.6 | Confident | 57 Ų | 57 | 53.8 Ų | 53.8 | 59% | 0.588 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -62.1 | -46 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | S139 G144 A145 | S139-G141 VanDerWaalsContact C-N 3.31Å; S139-G141 PolarHBondContact O-N 2.87Å; G141-G144 PolarHBondContact O-N 3.36Å; G141-A145 WeakPolarHBondContact O-CB 3.32Å; G141-A145 PolarHBondContact O-N 3.13Å |
| 142 | R | 74.9 | Confident | 79.5 | Confident | 147 Ų | 147 | 53.6 Ų | 53.6 | 56% | 0.555 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -60.9 | -47.9 | 176.9 | -177.1 | -171.4 | 68.6 | -171.6 | -0.3 | 111.7 | S139 A145 I146 | S139-R142 PolarHBondContact O-N 3.47Å; R142-A145 PolarHBondContact O-N 3.13Å; R142-I146 HydrophobicContact CG-CD1 4.21Å; R142-I146 WeakPolarHBondContact O-CG1 3.49Å; R142-I146 PolarHBondContact O-N 2.83Å |
| 143 | N | 79.9 | Confident | 79.6 | Confident | 4 Ų | 4 | 55 Ų | 55 | 2% | 0.021 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67.7 | -39.5 | -178.1 | -68.4 | -2.9 | 0 | 0 | 0 | 110.7 | I16 I131 S135 S139 V140 I146 V147 | I16-N143 HydrophobicContact CD1-CB 3.9Å; I16-N143 HydrophobicContact CG1-CB 4.13Å; I131-N143 HydrophobicContact CG2-CB 4.46Å; S135-N143 PolarHBondContact OG-ND2 2.79Å; S139-N143 WeakPolarHBondContact O-CB 3.31Å; S139-N143 PolarHBondContact O-N 3.44Å; V140-N143 PolarHBondContact O-N 3.07Å; N143-I146 PolarHBondContact O-N 2.64Å; N143-V147 VanDerWaalsContact O-CG2 3.31Å; N143-V147 WeakPolarHBondContact O-CG2 3.32Å; N143-V147 PolarHBondContact O-N 2.72Å; N143-V147 VanDerWaalsContact O-N 3.07Å |
| 144 | G | 80.6 | Confident | 79.9 | Confident | 23 Ų | 23 | 52.1 Ų | 52.1 | 24% | 0.237 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.6 | -44.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V140 G141 I146 V147 W148 | V140-G144 PolarHBondContact O-N 3.15Å; G141-G144 PolarHBondContact O-N 3.36Å; G144-I146 PolarHBondContact O-N 2.87Å; G144-V147 PolarHBondContact O-N 3.15Å; G144-W148 PolarHBondContact O-N 3.31Å |
| 145 | A | 78 | Confident | 80.3 | Confident | 54 Ų | 54 | 51.7 Ų | 51.7 | 45% | 0.446 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -64 | -38.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | G141 R142 V147 W148 A149 | G141-A145 WeakPolarHBondContact O-CB 3.32Å; G141-A145 PolarHBondContact O-N 3.13Å; R142-A145 PolarHBondContact O-N 3.13Å; A145-V147 VanDerWaalsContact C-N 3.35Å; A145-W148 PolarHBondContact O-N 3.39Å; A145-A149 WeakPolarHBondContact O-CB 3.3Å; A145-A149 PolarHBondContact O-N 3.22Å |
| 146 | I | 80.5 | Confident | 80.9 | Confident | 43 Ų | 43 | 52 Ų | 52 | 22% | 0.221 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.2 | -45.8 | 173.7 | -69 | 164.9 | 0 | 0 | 0 | 110.3 | I16 F17 R142 N143 G144 W148 A149 I150 | I16-I146 HydrophobicContact CG2-CB 4.49Å; I16-I146 HydrophobicContact CG2-CG2 4.13Å; F17-I146 HydrophobicContact CE1-CG2 4.22Å; R142-I146 HydrophobicContact CG-CD1 4.21Å; R142-I146 WeakPolarHBondContact O-CG1 3.49Å; R142-I146 PolarHBondContact O-N 2.83Å; N143-I146 PolarHBondContact O-N 2.64Å; G144-I146 PolarHBondContact O-N 2.87Å; I146-W148 VanDerWaalsContact C-N 3.34Å; I146-W148 PolarHBondContact O-N 2.98Å; I146-A149 PolarHBondContact O-N 3.1Å; I146-I150 HydrophobicContact CG2-CD1 3.84Å; I146-I150 WeakPolarHBondContact O-CG1 3.48Å; I146-I150 PolarHBondContact O-N 2.84Å |
| 147 | V | 86.1 | Confident | 81.6 | Confident | 1 Ų | 1 | 49.7 Ų | 49.7 | 1% | 0.006 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.7 | -43.6 | 178.5 | 179.9 | 0 | 0 | 0 | 0 | 110.9 | I16 L19 S20 I131 N143 G144 A145 F151 | I16-V147 HydrophobicContact CG2-CG2 3.82Å; L19-V147 HydrophobicContact CD2-CG2 4.35Å; S20-V147 WeakPolarHBondContact OG-CA 3.29Å; S20-V147 WeakPolarHBondContact OG-CG2 3.41Å; I131-V147 HydrophobicContact CD1-CB 4.17Å; I131-V147 HydrophobicContact CD1-CG1 4.27Å; I131-V147 HydrophobicContact CD1-CG2 3.91Å; I131-V147 HydrophobicContact CG1-CG2 4.31Å; N143-V147 VanDerWaalsContact O-CG2 3.31Å; N143-V147 WeakPolarHBondContact O-CG2 3.32Å; N143-V147 PolarHBondContact O-N 2.72Å; N143-V147 VanDerWaalsContact O-N 3.07Å; G144-V147 PolarHBondContact O-N 3.15Å; A145-V147 VanDerWaalsContact C-N 3.35Å; V147-F151 VanDerWaalsContact O-CB 3.25Å; V147-F151 WeakPolarHBondContact O-CB 3.35Å; V147-F151 PolarHBondContact O-N 3.5Å |
| 148 | W | 79.9 | Confident | 82.6 | Confident | 56 Ų | 56 | 39.6 Ų | 39.6 | 21% | 0.212 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -62.2 | -44.7 | 176.7 | -170.8 | -96.5 | 0 | 0 | 0 | 112.5 | G144 A145 I146 F151 Q152 N381 | G144-W148 PolarHBondContact O-N 3.31Å; A145-W148 PolarHBondContact O-N 3.39Å; I146-W148 VanDerWaalsContact C-N 3.34Å; I146-W148 PolarHBondContact O-N 2.98Å; W148-F151 HydrophobicContact CD2-CD1 4.29Å; W148-F151 AromaticContact CE3-CD1 3.96Å; W148-F151 HydrophobicContact CE3-CD1 3.96Å; W148-F151 HydrophobicContact CE3-CE1 4.36Å; W148-F151 HydrophobicContact CH2-CD1 4.34Å; W148-F151 AromaticContact CH2-CE1 3.97Å; W148-F151 HydrophobicContact CH2-CE1 3.97Å; W148-F151 HydrophobicContact CZ2-CE1 4.47Å; W148-F151 AromaticContact CZ3-CD1 3.99Å; W148-F151 HydrophobicContact CZ3-CD1 3.99Å; W148-F151 AromaticContact CZ3-CE1 3.92Å; W148-F151 HydrophobicContact CZ3-CE1 3.92Å; W148-F151 WeakPolarHBondContact O-CB 3.39Å; W148-F151 PolarHBondContact O-N 3.4Å; W148-Q152 WeakPolarHBondContact O-CG 3.46Å; W148-Q152 PolarHBondContact O-N 3.47Å; W148-N381 WeakPolarHBondContact CH2-ND2 3.46Å; W148-N381 VanDerWaalsContact CZ2-ND2 3.28Å; W148-N381 WeakPolarHBondContact CZ2-ND2 3.44Å |
| 149 | A | 80.1 | Confident | 83.7 | Confident | 41 Ų | 41 | 34.7 Ų | 34.7 | 34% | 0.339 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62.2 | -47.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112 | A145 I146 F151 Q152 F153 | A145-A149 WeakPolarHBondContact O-CB 3.3Å; A145-A149 PolarHBondContact O-N 3.22Å; I146-A149 PolarHBondContact O-N 3.1Å; A149-F151 VanDerWaalsContact C-N 3.27Å; A149-F151 PolarHBondContact O-N 2.93Å; A149-Q152 PolarHBondContact O-N 3.24Å; A149-F153 WeakPolarHBondContact O-CD2 3.49Å; A149-F153 PolarHBondContact O-N 2.84Å |
| 150 | I | 84.7 | Confident | 84.6 | Confident | 42 Ų | 42 | 38.6 Ų | 38.6 | 22% | 0.215 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -64 | -37.1 | 176.7 | -65 | 167.4 | 0 | 0 | 0 | 110.5 | F17 S20 I146 F153 | F17-I150 HydrophobicContact CD1-CD1 3.85Å; F17-I150 HydrophobicContact CE1-CD1 4.05Å; S20-I150 VanDerWaalsContact CB-CD1 3.49Å; I146-I150 HydrophobicContact CG2-CD1 3.84Å; I146-I150 WeakPolarHBondContact O-CG1 3.48Å; I146-I150 PolarHBondContact O-N 2.84Å; I150-F153 PolarHBondContact O-N 3.42Å |
| 151 | F | 83.5 | Confident | 85.4 | Confident | 12 Ų | 12 | 38.8 Ų | 38.8 | 5% | 0.053 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.6 | -43.2 | 173.5 | 165.6 | -123.8 | 0 | 0 | 0 | 112.3 | L27 W124 V147 W148 A149 F153 S154 | L27-F151 HydrophobicContact CB-CD2 3.84Å; L27-F151 HydrophobicContact CB-CE2 3.53Å; L27-F151 HydrophobicContact CD1-CD2 3.21Å; L27-F151 HydrophobicContact CD1-CE2 3.17Å; L27-F151 HydrophobicContact CD1-CG 4.15Å; L27-F151 HydrophobicContact CD1-CZ 4.02Å; L27-F151 HydrophobicContact CD2-CE2 4.14Å; L27-F151 HydrophobicContact CG-CD2 4.06Å; L27-F151 HydrophobicContact CG-CE2 3.74Å; W124-F151 HydrophobicContact CH2-CD1 4.36Å; W124-F151 AromaticContact CH2-CE1 3.89Å; W124-F151 HydrophobicContact CH2-CE1 3.89Å; W124-F151 HydrophobicContact CH2-CE2 4.48Å; W124-F151 AromaticContact CH2-CZ 3.95Å; W124-F151 HydrophobicContact CH2-CZ 3.95Å; W124-F151 HydrophobicContact CZ2-CZ 4.4Å; V147-F151 VanDerWaalsContact O-CB 3.25Å; V147-F151 WeakPolarHBondContact O-CB 3.35Å; V147-F151 PolarHBondContact O-N 3.5Å; W148-F151 HydrophobicContact CD2-CD1 4.29Å; W148-F151 AromaticContact CE3-CD1 3.96Å; W148-F151 HydrophobicContact CE3-CD1 3.96Å; W148-F151 HydrophobicContact CE3-CE1 4.36Å; W148-F151 HydrophobicContact CH2-CD1 4.34Å; W148-F151 AromaticContact CH2-CE1 3.97Å; W148-F151 HydrophobicContact CH2-CE1 3.97Å; W148-F151 HydrophobicContact CZ2-CE1 4.47Å; W148-F151 AromaticContact CZ3-CD1 3.99Å; W148-F151 HydrophobicContact CZ3-CD1 3.99Å; W148-F151 AromaticContact CZ3-CE1 3.92Å; W148-F151 HydrophobicContact CZ3-CE1 3.92Å; W148-F151 WeakPolarHBondContact O-CB 3.39Å; W148-F151 PolarHBondContact O-N 3.4Å; A149-F151 VanDerWaalsContact C-N 3.27Å; A149-F151 PolarHBondContact O-N 2.93Å; F151-F153 VanDerWaalsContact C-N 3.29Å; F151-F153 PolarHBondContact O-N 3.2Å; F151-S154 WeakPolarHBondContact O-CB 3.5Å; F151-S154 PolarHBondContact O-N 2.88Å; F151-S154 PolarHBondContact O-OG 2.95Å |
| 152 | Q | 84.9 | Confident | 86.4 | Confident | 7 Ų | 7 | 36.1 Ų | 36.1 | 3% | 0.033 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -67.3 | -26 | 180 | -61.9 | -52.8 | 45.1 | 0 | 0 | 114.2 | W148 A149 S154 L155 P156 E303 | W148-Q152 WeakPolarHBondContact O-CG 3.46Å; W148-Q152 PolarHBondContact O-N 3.47Å; A149-Q152 PolarHBondContact O-N 3.24Å; Q152-S154 PolarHBondContact O-N 3.02Å; Q152-L155 PolarHBondContact O-N 3.36Å; Q152-P156 VanDerWaalsContact O-CD 3.3Å; Q152-P156 WeakPolarHBondContact O-CD 3.32Å; Q152-E303 HydrophobicContact CB-CB 4.41Å; Q152-E303 HydrophobicContact CG-CB 4.31Å; Q152-E303 PolarHBondContact NE2-OE2 3.42Å |
| 153 | F | 87.2 | Confident | 87.1 | Confident | 113 Ų | 113 | 32.7 Ų | 32.7 | 50% | 0.496 | 18% | 0.177 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -13.3 | 170.5 | -78.8 | -72.6 | 0 | 0 | 0 | 113.8 | Y24 A149 I150 F151 L155 P156 T157 T304 | Y24-F153 HydrophobicContact CE2-CB 4.31Å; A149-F153 WeakPolarHBondContact O-CD2 3.49Å; A149-F153 PolarHBondContact O-N 2.84Å; I150-F153 PolarHBondContact O-N 3.42Å; F151-F153 VanDerWaalsContact C-N 3.29Å; F151-F153 PolarHBondContact O-N 3.2Å; F153-L155 VanDerWaalsContact C-N 3.29Å; F153-L155 PolarHBondContact O-N 3.34Å; F153-P156 WeakPolarHBondContact O-CD 3.35Å; F153-T157 PolarHBondContact O-N 3.35Å; F153-T157 PolarHBondContact O-OG1 3.16Å; F153-T304 HydrophobicContact CE1-CG2 4.02Å; F153-T304 HydrophobicContact CE2-CG2 3.93Å; F153-T304 HydrophobicContact CZ-CG2 3.67Å |
| 154 | S | 91.9 | Very high | 87.6 | Confident | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65 | -32.7 | 176.9 | 73 | 0 | 0 | 0 | 0 | 112.7 | T28 F151 Q152 G158 | T28-S154 VanDerWaalsContact OG1-CA 3.24Å; T28-S154 WeakPolarHBondContact OG1-CA 3.1Å; T28-S154 WeakPolarHBondContact OG1-CB 3.44Å; T28-S154 PolarHBondContact OG1-O 2.81Å; T28-S154 VanDerWaalsContact OG1-O 3.06Å; F151-S154 WeakPolarHBondContact O-CB 3.5Å; F151-S154 PolarHBondContact O-N 2.88Å; F151-S154 PolarHBondContact O-OG 2.95Å; Q152-S154 PolarHBondContact O-N 3.02Å; S154-G158 PolarHBondContact O-N 2.58Å |
| 155 | L | 91.5 | Very high | 87.9 | Confident | 2 Ų | 2 | 36 Ų | 36 | 1% | 0.01 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -66 | -56.6 | -179.3 | -76.6 | 166.8 | 0 | 0 | 0 | 111.8 | Q31 Q152 F153 T157 G158 G159 W270 I296 E303 | Q31-L155 HydrophobicContact CB-CD2 3.65Å; Q31-L155 HydrophobicContact CG-CD2 4.05Å; Q152-L155 PolarHBondContact O-N 3.36Å; F153-L155 VanDerWaalsContact C-N 3.29Å; F153-L155 PolarHBondContact O-N 3.34Å; L155-T157 VanDerWaalsContact C-N 3.28Å; L155-T157 PolarHBondContact O-N 2.92Å; L155-G158 PolarHBondContact O-N 3.4Å; L155-G158 VanDerWaalsContact O-N 3.14Å; L155-G159 PolarHBondContact O-N 3.07Å; L155-W270 HydrophobicContact CD1-CH2 3.92Å; L155-W270 HydrophobicContact CD1-CZ3 4.29Å; L155-W270 HydrophobicContact CD2-CH2 4.22Å; L155-W270 HydrophobicContact CD2-CZ3 4.09Å; L155-I296 HydrophobicContact CD2-CG2 4.28Å; L155-I296 WeakPolarHBondContact O-CG2 3.31Å; L155-E303 HydrophobicContact CD1-CB 4.49Å; L155-E303 HydrophobicContact CD1-CG 4.11Å |
| 156 | P | 93.2 | Very high | 88.3 | Confident | 16 Ų | 16 | 33.9 Ų | 33.9 | 10% | 0.104 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -58.7 | -39.2 | 176.7 | -25.2 | 36.3 | 0 | 0 | 0 | 113.5 | Q152 F153 G158 G159 I160 V297 | Q152-P156 VanDerWaalsContact O-CD 3.3Å; Q152-P156 WeakPolarHBondContact O-CD 3.32Å; F153-P156 WeakPolarHBondContact O-CD 3.35Å; P156-G158 VanDerWaalsContact C-N 3.32Å; P156-G158 PolarHBondContact O-N 3.45Å; P156-G159 PolarHBondContact O-N 3.48Å; P156-I160 WeakPolarHBondContact O-CB 3.36Å; P156-I160 WeakPolarHBondContact O-CD1 3.31Å; P156-I160 WeakPolarHBondContact O-CG1 3.44Å; P156-I160 PolarHBondContact O-N 3.01Å; P156-V297 HydrophobicContact CB-CG1 4.31Å |
| 157 | T | 93.5 | Very high | 88.5 | Confident | 49 Ų | 49 | 35.1 Ų | 35.1 | 30% | 0.301 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -59.5 | -46.2 | 177.5 | -52.4 | 0 | 0 | 0 | 0 | 111 | Y24 T28 F153 L155 I160 F161 | Y24-T157 VanDerWaalsContact OH-CB 3.31Å; Y24-T157 WeakPolarHBondContact OH-CB 3.4Å; Y24-T157 WeakPolarHBondContact OH-CG2 3.05Å; Y24-T157 PolarHBondContact OH-OG1 3.19Å; T28-T157 HydrophobicContact CG2-CG2 4.32Å; F153-T157 PolarHBondContact O-N 3.35Å; F153-T157 PolarHBondContact O-OG1 3.16Å; L155-T157 VanDerWaalsContact C-N 3.28Å; L155-T157 PolarHBondContact O-N 2.92Å; T157-I160 PolarHBondContact O-N 3.47Å; T157-F161 PolarHBondContact O-N 2.83Å |
| 158 | G | 92.3 | Very high | 88.1 | Confident | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.1 | -44.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | S32 S154 L155 P156 F161 L162 | S32-G158 WeakPolarHBondContact OG-CA 3.42Å; S154-G158 PolarHBondContact O-N 2.58Å; L155-G158 PolarHBondContact O-N 3.4Å; L155-G158 VanDerWaalsContact O-N 3.14Å; P156-G158 VanDerWaalsContact C-N 3.32Å; P156-G158 PolarHBondContact O-N 3.45Å; G158-F161 PolarHBondContact O-N 3.12Å; G158-L162 WeakPolarHBondContact O-CG 3.43Å; G158-L162 PolarHBondContact O-N 3.35Å |
| 159 | G | 93.1 | Very high | 87.6 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.6 | -43 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L155 P156 F161 L162 Y163 | L155-G159 PolarHBondContact O-N 3.07Å; P156-G159 PolarHBondContact O-N 3.48Å; G159-F161 VanDerWaalsContact C-N 3.34Å; G159-F161 PolarHBondContact O-N 2.95Å; G159-L162 PolarHBondContact O-N 2.94Å; G159-Y163 WeakPolarHBondContact O-CB 3.48Å; G159-Y163 PolarHBondContact O-N 3.34Å |
| 160 | I | 94.5 | Very high | 86.8 | Confident | 98 Ų | 98 | 43.8 Ų | 43.8 | 50% | 0.503 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -62.6 | -42.1 | 176.1 | -69.4 | 164.7 | 0 | 0 | 0 | 110.8 | P156 T157 Y163 S164 V297 | P156-I160 WeakPolarHBondContact O-CB 3.36Å; P156-I160 WeakPolarHBondContact O-CD1 3.31Å; P156-I160 WeakPolarHBondContact O-CG1 3.44Å; P156-I160 PolarHBondContact O-N 3.01Å; T157-I160 PolarHBondContact O-N 3.47Å; I160-Y163 WeakPolarHBondContact O-CB 3.42Å; I160-Y163 PolarHBondContact O-N 3.31Å; I160-S164 PolarHBondContact O-N 3.21Å; I160-V297 HydrophobicContact CG1-CG2 3.99Å |
| 161 | F | 92.4 | Very high | 85.9 | Confident | 50 Ų | 50 | 44.9 Ų | 44.9 | 22% | 0.219 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.5 | -48.1 | 175.4 | 175.1 | -100.6 | 0 | 0 | 0 | 111.3 | T157 G158 G159 Y163 S164 Q165 I181 A184 F185 | T157-F161 PolarHBondContact O-N 2.83Å; G158-F161 PolarHBondContact O-N 3.12Å; G159-F161 VanDerWaalsContact C-N 3.34Å; G159-F161 PolarHBondContact O-N 2.95Å; F161-Y163 VanDerWaalsContact C-N 3.32Å; F161-Y163 PolarHBondContact O-N 3.4Å; F161-S164 WeakPolarHBondContact O-CB 3.44Å; F161-S164 PolarHBondContact O-N 3.03Å; F161-S164 VanDerWaalsContact O-N 3.14Å; F161-S164 PolarHBondContact O-OG 3.46Å; F161-Q165 HydrophobicContact CE1-CG 4.06Å; F161-Q165 HydrophobicContact CE2-CG 4.21Å; F161-Q165 HydrophobicContact CZ-CG 3.88Å; F161-Q165 WeakPolarHBondContact O-CG 3.49Å; F161-Q165 PolarHBondContact O-N 3.14Å; F161-I181 HydrophobicContact CE1-CG2 4.38Å; F161-A184 HydrophobicContact CE1-CB 4.18Å; F161-A184 HydrophobicContact CE2-CB 4.32Å; F161-A184 HydrophobicContact CZ-CB 3.53Å; F161-F185 HydrophobicContact CD1-CD1 4.24Å; F161-F185 AromaticContact CD1-CE1 3.34Å; F161-F185 HydrophobicContact CD1-CE1 3.34Å; F161-F185 AromaticContact CD1-CZ 3.8Å; F161-F185 HydrophobicContact CD1-CZ 3.8Å; F161-F185 HydrophobicContact CE1-CD1 4.05Å; F161-F185 AromaticContact CE1-CE1 3.53Å; F161-F185 HydrophobicContact CE1-CE1 3.53Å; F161-F185 HydrophobicContact CE1-CZ 4.04Å; F161-F185 HydrophobicContact CG-CE1 4.39Å |
| 162 | L | 91.1 | Very high | 84.8 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61 | -40.5 | 177 | -72 | 174.7 | 0 | 0 | 0 | 112.5 | I36 G158 G159 S164 Q165 F166 I181 F185 A293 I296 | I36-L162 HydrophobicContact CD1-CD2 3.97Å; I36-L162 HydrophobicContact CG2-CD1 3.58Å; I36-L162 HydrophobicContact CG2-CD2 4.33Å; G158-L162 WeakPolarHBondContact O-CG 3.43Å; G158-L162 PolarHBondContact O-N 3.35Å; G159-L162 PolarHBondContact O-N 2.94Å; L162-S164 VanDerWaalsContact C-N 3.31Å; L162-S164 PolarHBondContact O-N 3.36Å; L162-Q165 PolarHBondContact O-N 3.35Å; L162-Q165 VanDerWaalsContact O-N 3.16Å; L162-F166 HydrophobicContact CB-CD2 4.29Å; L162-F166 HydrophobicContact CB-CE2 4.02Å; L162-F166 HydrophobicContact CD2-CE2 4.17Å; L162-F166 HydrophobicContact CD2-CZ 4.16Å; L162-F166 VanDerWaalsContact O-CD2 3.27Å; L162-F166 WeakPolarHBondContact O-CD2 3.26Å; L162-F166 WeakPolarHBondContact O-CG 3.14Å; L162-F166 PolarHBondContact O-N 2.9Å; L162-I181 HydrophobicContact CD2-CD1 4.21Å; L162-I181 HydrophobicContact CD2-CG1 4.45Å; L162-I181 HydrophobicContact CD2-CG2 3.77Å; L162-F185 HydrophobicContact CD2-CE2 4.14Å; L162-F185 HydrophobicContact CD2-CZ 3.81Å; L162-F185 HydrophobicContact CG-CZ 4.09Å; L162-A293 HydrophobicContact CB-CB 4.03Å; L162-I296 HydrophobicContact CD1-CD1 3.51Å |
| 163 | Y | 91.2 | Very high | 83.9 | Confident | 76 Ų | 76 | 52 Ų | 52 | 30% | 0.298 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -57.6 | -45.6 | 174.1 | 179.6 | -93.4 | 0 | 0 | 0 | 111.2 | G159 I160 F161 Q165 F166 V167 L290 W294 | G159-Y163 WeakPolarHBondContact O-CB 3.48Å; G159-Y163 PolarHBondContact O-N 3.34Å; I160-Y163 WeakPolarHBondContact O-CB 3.42Å; I160-Y163 PolarHBondContact O-N 3.31Å; F161-Y163 VanDerWaalsContact C-N 3.32Å; F161-Y163 PolarHBondContact O-N 3.4Å; Y163-Q165 PolarHBondContact O-N 3.43Å; Y163-F166 PolarHBondContact O-N 3.09Å; Y163-V167 HydrophobicContact CE1-CB 4.41Å; Y163-V167 WeakPolarHBondContact O-CB 3.46Å; Y163-V167 WeakPolarHBondContact O-CG1 3.33Å; Y163-V167 PolarHBondContact O-N 3.19Å; Y163-L290 HydrophobicContact CD2-CB 4.44Å; Y163-L290 HydrophobicContact CD2-CG 4.32Å; Y163-L290 HydrophobicContact CE2-CB 4.34Å; Y163-L290 HydrophobicContact CE2-CD2 3.99Å; Y163-L290 HydrophobicContact CE2-CG 4.11Å; Y163-W294 AromaticContact CD2-CE2 3.8Å; Y163-W294 HydrophobicContact CD2-CZ2 4.07Å; Y163-W294 AromaticContact CD2-NE1 3.62Å; Y163-W294 HydrophobicContact CE1-CZ2 4.45Å; Y163-W294 AromaticContact CE2-CE2 3.68Å; Y163-W294 AromaticContact CE2-CZ2 3.81Å; Y163-W294 HydrophobicContact CE2-CZ2 3.81Å; Y163-W294 AromaticContact CE2-NE1 3.32Å; Y163-W294 VanDerWaalsContact CE2-NE1 3.32Å |
| 164 | S | 89.4 | Confident | 83 | Confident | 45 Ų | 45 | 50.7 Ų | 50.7 | 32% | 0.315 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -61 | -30.6 | 178 | 81 | 0 | 0 | 0 | 0 | 113.8 | I160 F161 L162 N168 | I160-S164 PolarHBondContact O-N 3.21Å; F161-S164 WeakPolarHBondContact O-CB 3.44Å; F161-S164 PolarHBondContact O-N 3.03Å; F161-S164 VanDerWaalsContact O-N 3.14Å; F161-S164 PolarHBondContact O-OG 3.46Å; L162-S164 VanDerWaalsContact C-N 3.31Å; L162-S164 PolarHBondContact O-N 3.36Å; S164-N168 PolarHBondContact O-ND2 3.02Å |
| 165 | Q | 87.2 | Confident | 82.1 | Confident | 51 Ų | 51 | 54 Ų | 54 | 24% | 0.238 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -83.5 | -34.9 | 178.7 | -62.3 | -54.9 | -61.6 | 0 | 0 | 112 | F161 L162 Y163 S169 I181 | F161-Q165 HydrophobicContact CE1-CG 4.06Å; F161-Q165 HydrophobicContact CE2-CG 4.21Å; F161-Q165 HydrophobicContact CZ-CG 3.88Å; F161-Q165 WeakPolarHBondContact O-CG 3.49Å; F161-Q165 PolarHBondContact O-N 3.14Å; L162-Q165 PolarHBondContact O-N 3.35Å; L162-Q165 VanDerWaalsContact O-N 3.16Å; Y163-Q165 PolarHBondContact O-N 3.43Å; Q165-S169 PolarHBondContact O-OG 3.31Å; Q165-I181 HydrophobicContact CB-CD1 3.99Å; Q165-I181 HydrophobicContact CB-CG1 3.9Å; Q165-I181 HydrophobicContact CG-CG1 3.89Å |
| 166 | F | 85.9 | Confident | 81.6 | Confident | 10 Ų | 10 | 58.3 Ų | 58.3 | 4% | 0.044 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -83.3 | -28.4 | -178.4 | -63.5 | -33.9 | 0 | 0 | 0 | 113.9 | L162 Y163 N168 S169 I181 K289 L290 A293 | L162-F166 HydrophobicContact CB-CD2 4.29Å; L162-F166 HydrophobicContact CB-CE2 4.02Å; L162-F166 HydrophobicContact CD2-CE2 4.17Å; L162-F166 HydrophobicContact CD2-CZ 4.16Å; L162-F166 VanDerWaalsContact O-CD2 3.27Å; L162-F166 WeakPolarHBondContact O-CD2 3.26Å; L162-F166 WeakPolarHBondContact O-CG 3.14Å; L162-F166 PolarHBondContact O-N 2.9Å; Y163-F166 PolarHBondContact O-N 3.09Å; F166-N168 VanDerWaalsContact C-N 3.28Å; F166-N168 PolarHBondContact O-N 3.25Å; F166-S169 PolarHBondContact O-N 2.91Å; F166-S169 VanDerWaalsContact O-N 3.15Å; F166-I181 HydrophobicContact CD1-CD1 4.25Å; F166-I181 HydrophobicContact CE1-CD1 3.46Å; F166-I181 VanDerWaalsContact CE1-CD1 3.46Å; F166-I181 HydrophobicContact CZ-CD1 3.86Å; F166-K289 HydrophobicContact CB-CB 4.24Å; F166-K289 HydrophobicContact CD2-CB 4.08Å; F166-K289 WeakPolarHBondContact CD2-O 3.43Å; F166-K289 HydrophobicContact CG-CB 4.1Å; F166-L290 HydrophobicContact CB-CD1 4.08Å; F166-A293 HydrophobicContact CD2-CB 4.42Å |
| 167 | V | 85.4 | Confident | 81.1 | Confident | 69 Ų | 69 | 58.4 Ų | 58.4 | 42% | 0.418 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62 | -36.4 | 179.1 | 69.2 | 0 | 0 | 0 | 0 | 112.5 | Y163 S169 | Y163-V167 HydrophobicContact CE1-CB 4.41Å; Y163-V167 WeakPolarHBondContact O-CB 3.46Å; Y163-V167 WeakPolarHBondContact O-CG1 3.33Å; Y163-V167 PolarHBondContact O-N 3.19Å; V167-S169 VanDerWaalsContact C-N 3.33Å |
| 168 | N | 76.9 | Confident | 80.6 | Confident | 135 Ų | 135 | 56.6 Ų | 56.6 | 72% | 0.722 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | -6.8 | 179.7 | -65.5 | -43 | 0 | 0 | 0 | 113.3 | S164 F166 | S164-N168 PolarHBondContact O-ND2 3.02Å; F166-N168 VanDerWaalsContact C-N 3.28Å; F166-N168 PolarHBondContact O-N 3.25Å |
| 169 | S | 70.6 | Confident | 80.3 | Confident | 25 Ų | 25 | 63.3 Ų | 63.3 | 18% | 0.175 | 35% | 0.351 | C | S | . | . | trans | -101 | 94.8 | -177.4 | -63.8 | 0 | 0 | 0 | 0 | 110.1 | Q165 F166 V167 S177 | Q165-S169 PolarHBondContact O-OG 3.31Å; F166-S169 PolarHBondContact O-N 2.91Å; F166-S169 VanDerWaalsContact O-N 3.15Å; V167-S169 VanDerWaalsContact C-N 3.33Å; S169-S177 PolarHBondContact OG-OG 3.06Å | ||
| 170 | S | 61.6 | Low | 80.2 | Confident | 120 Ų | 120 | 67.7 Ų | 67.7 | 84% | 0.839 | 37% | 0.374 | S | S | * | . | trans | -73 | 141.3 | 174.7 | 29.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 171 | G | 65.7 | Low | 80 | Confident | 65 Ų | 65 | 63.1 Ų | 63.1 | 67% | 0.67 | 35% | 0.35 | S | S | * | . | S | Bend | trans | 81.4 | -147.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | K289 | G171-K289 WeakPolarHBondContact O-CE 3.25Å; G171-K289 PolarHBondContact O-NZ 3.33Å |
| 172 | D | 61.9 | Low | 80 | Confident | 149 Ų | 149 | 60.8 Ų | 60.8 | 80% | 0.797 | 34% | 0.34 | S | S | * | . | S | Bend | trans | -70.3 | 168.5 | 179.6 | -84.5 | -33.9 | 0 | 0 | 0 | 113.7 | N174 K289 | D172-N174 PolarHBondContact O-N 3.35Å; D172-K289 PolarHBondContact O-NZ 3.41Å |
| 173 | I | 64.5 | Low | 80.2 | Confident | 20 Ų | 20 | 64.8 Ų | 64.8 | 10% | 0.103 | 36% | 0.361 | C | S | . | . | trans | -66.9 | 101.6 | -175.7 | -59.1 | 175.2 | 0 | 0 | 0 | 108 | R39 L175 V178 K289 | R39-I173 VanDerWaalsContact CD-CD1 3.49Å; R39-I173 HydrophobicContact CG-CD1 3.52Å; I173-L175 PolarHBondContact O-N 2.75Å; I173-V178 HydrophobicContact CG2-CG2 3.12Å; I173-K289 HydrophobicContact CG1-CD 3.79Å; I173-K289 HydrophobicContact CG1-CG 4.45Å | ||
| 174 | N | 70 | Confident | 80.3 | Confident | 84 Ų | 84 | 62.5 Ų | 62.5 | 45% | 0.449 | 36% | 0.357 | S | S | . | . | trans | -63 | 122.2 | 172.5 | -169 | -23.4 | 0 | 0 | 0 | 108.7 | D172 N176 S177 V178 | D172-N174 PolarHBondContact O-N 3.35Å; N174-N176 PolarHBondContact O-N 3.15Å; N174-N176 VanDerWaalsContact O-N 3.13Å; N174-N176 WeakPolarHBondContact OD1-CB 3.36Å; N174-N176 PolarHBondContact OD1-N 3.47Å; N174-S177 WeakPolarHBondContact O-CB 3.43Å; N174-S177 PolarHBondContact O-N 3.2Å; N174-V178 PolarHBondContact O-N 3.1Å; N174-V178 VanDerWaalsContact O-N 3.15Å | ||
| 175 | L | 73.1 | Confident | 80.6 | Confident | 69 Ų | 69 | 60.3 Ų | 60.3 | 36% | 0.361 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -55.5 | -30 | 177.2 | -65.3 | 175.3 | 0 | 0 | 0 | 111.5 | I44 I173 V178 R179 | I44-L175 HydrophobicContact CG1-CD2 3.68Å; I173-L175 PolarHBondContact O-N 2.75Å; L175-V178 PolarHBondContact O-N 3.41Å; L175-R179 VanDerWaalsContact O-CG 3.28Å; L175-R179 WeakPolarHBondContact O-CG 3.49Å; L175-R179 PolarHBondContact O-N 2.94Å |
| 176 | N | 80.4 | Confident | 81 | Confident | 93 Ų | 93 | 58.9 Ų | 58.9 | 50% | 0.497 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.4 | -41.8 | 174.6 | -68.2 | -21.6 | 0 | 0 | 0 | 112.1 | N174 V178 R179 I180 | N174-N176 PolarHBondContact O-N 3.15Å; N174-N176 VanDerWaalsContact O-N 3.13Å; N174-N176 WeakPolarHBondContact OD1-CB 3.36Å; N174-N176 PolarHBondContact OD1-N 3.47Å; N176-V178 VanDerWaalsContact C-N 3.33Å; N176-V178 PolarHBondContact O-N 2.84Å; N176-R179 PolarHBondContact O-N 2.92Å; N176-I180 WeakPolarHBondContact O-CG1 3.44Å; N176-I180 PolarHBondContact O-N 3.1Å |
| 177 | S | 82.2 | Confident | 81.6 | Confident | 19 Ų | 19 | 62.1 Ų | 62.1 | 13% | 0.133 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 175.6 | -55.1 | 0 | 0 | 0 | 0 | 111.2 | S169 N174 I180 I181 | S169-S177 PolarHBondContact OG-OG 3.06Å; N174-S177 WeakPolarHBondContact O-CB 3.43Å; N174-S177 PolarHBondContact O-N 3.2Å; S177-I180 PolarHBondContact O-N 2.85Å; S177-I181 VanDerWaalsContact O-CG1 3.29Å; S177-I181 WeakPolarHBondContact O-CG1 3.43Å; S177-I181 PolarHBondContact O-N 3.32Å |
| 178 | V | 83.6 | Confident | 82 | Confident | 10 Ų | 10 | 60.8 Ų | 60.8 | 6% | 0.061 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -60.2 | -46.6 | 174.7 | 171.8 | 0 | 0 | 0 | 0 | 111.3 | T40 I173 N174 L175 N176 I180 I181 F182 | T40-V178 HydrophobicContact CG2-CG1 3.54Å; T40-V178 HydrophobicContact CG2-CG2 4.4Å; I173-V178 HydrophobicContact CG2-CG2 3.12Å; N174-V178 PolarHBondContact O-N 3.1Å; N174-V178 VanDerWaalsContact O-N 3.15Å; L175-V178 PolarHBondContact O-N 3.41Å; N176-V178 VanDerWaalsContact C-N 3.33Å; N176-V178 PolarHBondContact O-N 2.84Å; V178-I180 VanDerWaalsContact C-N 3.32Å; V178-I180 PolarHBondContact O-N 3.46Å; V178-I181 WeakPolarHBondContact O-CB 3.37Å; V178-I181 PolarHBondContact O-N 2.93Å; V178-F182 HydrophobicContact CG1-CD2 3.64Å; V178-F182 HydrophobicContact CG1-CE2 3.64Å; V178-F182 VanDerWaalsContact O-CD2 3.27Å; V178-F182 WeakPolarHBondContact O-CD2 3.42Å; V178-F182 PolarHBondContact O-N 3.06Å |
| 179 | R | 86.1 | Confident | 83 | Confident | 141 Ų | 141 | 54.3 Ų | 54.3 | 53% | 0.532 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -59.6 | -43.1 | 176.6 | -72.6 | 174.9 | 71.3 | -174 | 2.9 | 111.4 | L175 N176 I181 F182 I183 | L175-R179 VanDerWaalsContact O-CG 3.28Å; L175-R179 WeakPolarHBondContact O-CG 3.49Å; L175-R179 PolarHBondContact O-N 2.94Å; N176-R179 PolarHBondContact O-N 2.92Å; R179-I181 PolarHBondContact O-N 3.33Å; R179-F182 PolarHBondContact O-N 3.46Å; R179-I183 WeakPolarHBondContact O-CB 3.47Å; R179-I183 WeakPolarHBondContact O-CG1 3.19Å; R179-I183 PolarHBondContact O-N 3.35Å |
| 180 | I | 89.7 | Confident | 84.3 | Confident | 93 Ų | 93 | 55.1 Ų | 55.1 | 48% | 0.477 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.3 | -44.5 | 176.5 | -67.7 | 165.4 | 0 | 0 | 0 | 111.2 | N176 S177 V178 F182 I183 A184 | N176-I180 WeakPolarHBondContact O-CG1 3.44Å; N176-I180 PolarHBondContact O-N 3.1Å; S177-I180 PolarHBondContact O-N 2.85Å; V178-I180 VanDerWaalsContact C-N 3.32Å; V178-I180 PolarHBondContact O-N 3.46Å; I180-F182 PolarHBondContact O-N 3.23Å; I180-I183 PolarHBondContact O-N 3.04Å; I180-A184 WeakPolarHBondContact O-CB 3.24Å; I180-A184 PolarHBondContact O-N 2.85Å |
| 181 | I | 91.2 | Very high | 86 | Confident | 2 Ų | 2 | 53.8 Ų | 53.8 | 1% | 0.01 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -57.7 | -49.7 | 176.9 | -69.9 | 161.6 | 0 | 0 | 0 | 110.7 | I36 F161 L162 Q165 F166 S177 V178 R179 A184 F185 | I36-I181 HydrophobicContact CD1-CG2 3.97Å; F161-I181 HydrophobicContact CE1-CG2 4.38Å; L162-I181 HydrophobicContact CD2-CD1 4.21Å; L162-I181 HydrophobicContact CD2-CG1 4.45Å; L162-I181 HydrophobicContact CD2-CG2 3.77Å; Q165-I181 HydrophobicContact CB-CD1 3.99Å; Q165-I181 HydrophobicContact CB-CG1 3.9Å; Q165-I181 HydrophobicContact CG-CG1 3.89Å; F166-I181 HydrophobicContact CD1-CD1 4.25Å; F166-I181 HydrophobicContact CE1-CD1 3.46Å; F166-I181 VanDerWaalsContact CE1-CD1 3.46Å; F166-I181 HydrophobicContact CZ-CD1 3.86Å; S177-I181 VanDerWaalsContact O-CG1 3.29Å; S177-I181 WeakPolarHBondContact O-CG1 3.43Å; S177-I181 PolarHBondContact O-N 3.32Å; V178-I181 WeakPolarHBondContact O-CB 3.37Å; V178-I181 PolarHBondContact O-N 2.93Å; R179-I181 PolarHBondContact O-N 3.33Å; I181-A184 PolarHBondContact O-N 2.93Å; I181-F185 HydrophobicContact CG2-CD2 3.79Å; I181-F185 HydrophobicContact CG2-CE2 3.47Å; I181-F185 VanDerWaalsContact CG2-CE2 3.47Å; I181-F185 HydrophobicContact CG2-CG 4.48Å; I181-F185 HydrophobicContact CG2-CZ 3.93Å; I181-F185 WeakPolarHBondContact O-CB 3.45Å; I181-F185 WeakPolarHBondContact O-CG 3.34Å; I181-F185 PolarHBondContact O-N 3.48Å |
| 182 | F | 92.3 | Very high | 87.5 | Confident | 1 Ų | 1 | 50.7 Ų | 50.7 | 0% | 0.004 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -71 | -31.3 | -179.3 | -76.8 | -67.4 | 0 | 0 | 0 | 113.5 | C33 I36 T40 F101 L102 V178 R179 I180 F185 T186 | C33-F182 HydrophobicContact CB-CE1 4.34Å; I36-F182 HydrophobicContact CD1-CZ 4.11Å; I36-F182 HydrophobicContact CG1-CZ 4.36Å; T40-F182 HydrophobicContact CG2-CE2 4.12Å; F101-F182 HydrophobicContact CB-CB 4.24Å; F101-F182 HydrophobicContact CB-CD1 3.51Å; F101-F182 HydrophobicContact CB-CD2 3.78Å; F101-F182 HydrophobicContact CB-CE1 3.69Å; F101-F182 HydrophobicContact CB-CE2 3.95Å; F101-F182 HydrophobicContact CB-CG 3.57Å; F101-F182 HydrophobicContact CB-CZ 3.91Å; F101-F182 AromaticContact CD1-CE1 3.95Å; F101-F182 HydrophobicContact CD1-CE1 3.95Å; F101-F182 HydrophobicContact CD1-CE2 4.09Å; F101-F182 AromaticContact CD1-CZ 3.65Å; F101-F182 HydrophobicContact CD1-CZ 3.65Å; F101-F182 HydrophobicContact CD2-CD1 4.12Å; F101-F182 AromaticContact CD2-CE1 3.75Å; F101-F182 HydrophobicContact CD2-CE1 3.75Å; F101-F182 HydrophobicContact CD2-CZ 4.3Å; F101-F182 HydrophobicContact CE1-CZ 4.22Å; F101-F182 HydrophobicContact CE2-CE1 4.35Å; F101-F182 AromaticContact CG-CD1 3.86Å; F101-F182 HydrophobicContact CG-CD1 3.86Å; F101-F182 HydrophobicContact CG-CD2 4.47Å; F101-F182 AromaticContact CG-CE1 3.51Å; F101-F182 HydrophobicContact CG-CE1 3.51Å; F101-F182 HydrophobicContact CG-CE2 4.17Å; F101-F182 HydrophobicContact CG-CG 4.33Å; F101-F182 AromaticContact CG-CZ 3.69Å; F101-F182 HydrophobicContact CG-CZ 3.69Å; L102-F182 HydrophobicContact CD2-CB 3.75Å; V178-F182 HydrophobicContact CG1-CD2 3.64Å; V178-F182 HydrophobicContact CG1-CE2 3.64Å; V178-F182 VanDerWaalsContact O-CD2 3.27Å; V178-F182 WeakPolarHBondContact O-CD2 3.42Å; V178-F182 PolarHBondContact O-N 3.06Å; R179-F182 PolarHBondContact O-N 3.46Å; I180-F182 PolarHBondContact O-N 3.23Å; F182-F185 HydrophobicContact CD1-CD2 4.5Å; F182-T186 VanDerWaalsContact O-CB 3.27Å; F182-T186 WeakPolarHBondContact O-CB 3.33Å; F182-T186 PolarHBondContact O-N 2.89Å; F182-T186 PolarHBondContact O-OG1 3.47Å |
| 183 | I | 94.6 | Very high | 89.1 | Confident | 84 Ų | 84 | 44.1 Ų | 44.1 | 43% | 0.431 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.6 | -49.1 | 170.5 | -70.8 | 167.1 | 0 | 0 | 0 | 109.2 | L102 R179 I180 F185 T186 C187 | L102-I183 HydrophobicContact CD1-CG1 4.36Å; L102-I183 HydrophobicContact CD2-CB 4.46Å; L102-I183 HydrophobicContact CD2-CG1 3.54Å; R179-I183 WeakPolarHBondContact O-CB 3.47Å; R179-I183 WeakPolarHBondContact O-CG1 3.19Å; R179-I183 PolarHBondContact O-N 3.35Å; I180-I183 PolarHBondContact O-N 3.04Å; I183-F185 PolarHBondContact O-N 3.3Å; I183-T186 PolarHBondContact O-N 2.95Å; I183-C187 WeakPolarHBondContact O-CB 3.37Å; I183-C187 PolarHBondContact O-N 2.89Å; I183-C187 PolarHBondContact O-SG 3.46Å |
| 184 | A | 94.4 | Very high | 90.7 | Very high | 27 Ų | 27 | 48.2 Ų | 48.2 | 22% | 0.223 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.5 | -47 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | F161 I180 I181 T186 C187 M188 | F161-A184 HydrophobicContact CE1-CB 4.18Å; F161-A184 HydrophobicContact CE2-CB 4.32Å; F161-A184 HydrophobicContact CZ-CB 3.53Å; I180-A184 WeakPolarHBondContact O-CB 3.24Å; I180-A184 PolarHBondContact O-N 2.85Å; I181-A184 PolarHBondContact O-N 2.93Å; A184-T186 PolarHBondContact O-N 3.36Å; A184-C187 PolarHBondContact O-N 2.85Å; A184-M188 WeakPolarHBondContact O-CB 3.31Å; A184-M188 VanDerWaalsContact O-CG 3.29Å; A184-M188 WeakPolarHBondContact O-CG 3.39Å; A184-M188 PolarHBondContact O-N 3.36Å |
| 185 | F | 94.8 | Very high | 92 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.8 | -40.7 | 176.5 | -74.4 | -12.2 | 0 | 0 | 0 | 113.1 | A29 I36 L98 F161 L162 I181 F182 I183 M188 S189 | A29-F185 HydrophobicContact CB-CB 3.83Å; A29-F185 HydrophobicContact CB-CD1 4.2Å; A29-F185 HydrophobicContact CB-CG 4.07Å; I36-F185 HydrophobicContact CD1-CE2 4.11Å; L98-F185 HydrophobicContact CD1-CB 4.46Å; L98-F185 HydrophobicContact CD2-CB 4.39Å; F161-F185 HydrophobicContact CD1-CD1 4.24Å; F161-F185 AromaticContact CD1-CE1 3.34Å; F161-F185 HydrophobicContact CD1-CE1 3.34Å; F161-F185 AromaticContact CD1-CZ 3.8Å; F161-F185 HydrophobicContact CD1-CZ 3.8Å; F161-F185 HydrophobicContact CE1-CD1 4.05Å; F161-F185 AromaticContact CE1-CE1 3.53Å; F161-F185 HydrophobicContact CE1-CE1 3.53Å; F161-F185 HydrophobicContact CE1-CZ 4.04Å; F161-F185 HydrophobicContact CG-CE1 4.39Å; L162-F185 HydrophobicContact CD2-CE2 4.14Å; L162-F185 HydrophobicContact CD2-CZ 3.81Å; L162-F185 HydrophobicContact CG-CZ 4.09Å; I181-F185 HydrophobicContact CG2-CD2 3.79Å; I181-F185 HydrophobicContact CG2-CE2 3.47Å; I181-F185 VanDerWaalsContact CG2-CE2 3.47Å; I181-F185 HydrophobicContact CG2-CG 4.48Å; I181-F185 HydrophobicContact CG2-CZ 3.93Å; I181-F185 WeakPolarHBondContact O-CB 3.45Å; I181-F185 WeakPolarHBondContact O-CG 3.34Å; I181-F185 PolarHBondContact O-N 3.48Å; F182-F185 HydrophobicContact CD1-CD2 4.5Å; I183-F185 PolarHBondContact O-N 3.3Å; F185-M188 HydrophobicContact CD1-SD 4.28Å; F185-M188 PolarHBondContact O-N 3.48Å; F185-S189 WeakPolarHBondContact O-CB 3.23Å; F185-S189 PolarHBondContact O-N 3.35Å |
| 186 | T | 96.3 | Very high | 93 | Very high | 20 Ų | 20 | 42.3 Ų | 42.3 | 12% | 0.123 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63.4 | -45.7 | 175.8 | -57.1 | 0 | 0 | 0 | 0 | 110.8 | V95 A99 F182 I183 A184 S189 A190 | V95-T186 HydrophobicContact CG1-CG2 4.01Å; A99-T186 HydrophobicContact CB-CG2 4Å; A99-T186 PolarHBondContact N-OG1 3.17Å; F182-T186 VanDerWaalsContact O-CB 3.27Å; F182-T186 WeakPolarHBondContact O-CB 3.33Å; F182-T186 PolarHBondContact O-N 2.89Å; F182-T186 PolarHBondContact O-OG1 3.47Å; I183-T186 PolarHBondContact O-N 2.95Å; A184-T186 PolarHBondContact O-N 3.36Å; T186-S189 PolarHBondContact O-N 3Å; T186-A190 WeakPolarHBondContact O-CB 3.15Å; T186-A190 PolarHBondContact O-N 2.9Å |
| 187 | C | 97.5 | Very high | 93.7 | Very high | 79 Ų | 79 | 39.3 Ų | 39.3 | 53% | 0.534 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -62.5 | -43.4 | 176.2 | -70.7 | 0 | 0 | 0 | 0 | 112.4 | I183 A184 A190 M191 | I183-C187 WeakPolarHBondContact O-CB 3.37Å; I183-C187 PolarHBondContact O-N 2.89Å; I183-C187 PolarHBondContact O-SG 3.46Å; A184-C187 PolarHBondContact O-N 2.85Å; C187-A190 PolarHBondContact O-N 2.9Å; C187-M191 WeakPolarHBondContact O-CB 3.38Å; C187-M191 PolarHBondContact O-N 3.42Å |
| 188 | M | 95.3 | Very high | 94.3 | Very high | 40 Ų | 40 | 44.1 Ų | 44.1 | 20% | 0.197 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.7 | -46.5 | 175.6 | -74.7 | 174.6 | 60.1 | 0 | 0 | 111.7 | L25 T28 A184 F185 A190 M191 G192 | L25-M188 HydrophobicContact CD2-CE 4.49Å; T28-M188 HydrophobicContact CG2-CE 3.56Å; A184-M188 WeakPolarHBondContact O-CB 3.31Å; A184-M188 VanDerWaalsContact O-CG 3.29Å; A184-M188 WeakPolarHBondContact O-CG 3.39Å; A184-M188 PolarHBondContact O-N 3.36Å; F185-M188 HydrophobicContact CD1-SD 4.28Å; F185-M188 PolarHBondContact O-N 3.48Å; M188-A190 VanDerWaalsContact C-N 3.33Å; M188-A190 PolarHBondContact O-N 3.23Å; M188-M191 PolarHBondContact O-N 3.07Å; M188-G192 PolarHBondContact O-N 3.13Å |
| 189 | S | 96.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -66 | -36 | 177 | -173.5 | 0 | 0 | 0 | 0 | 112.1 | N94 F185 T186 G192 A193 | N94-S189 PolarHBondContact ND2-OG 3.31Å; F185-S189 WeakPolarHBondContact O-CB 3.23Å; F185-S189 PolarHBondContact O-N 3.35Å; T186-S189 PolarHBondContact O-N 3Å; S189-G192 PolarHBondContact O-N 3.45Å; S189-A193 WeakPolarHBondContact O-CB 3.36Å; S189-A193 PolarHBondContact O-N 3.22Å |
| 190 | A | 97.9 | Very high | 94.8 | Very high | 41 Ų | 41 | 44.5 Ų | 44.5 | 34% | 0.339 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -66.1 | -39.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | V95 T186 C187 M188 A193 L194 | V95-A190 HydrophobicContact CG1-CB 4.28Å; V95-A190 HydrophobicContact CG2-CB 4.11Å; T186-A190 WeakPolarHBondContact O-CB 3.15Å; T186-A190 PolarHBondContact O-N 2.9Å; C187-A190 PolarHBondContact O-N 2.9Å; M188-A190 VanDerWaalsContact C-N 3.33Å; M188-A190 PolarHBondContact O-N 3.23Å; A190-A193 PolarHBondContact O-N 2.87Å; A190-L194 PolarHBondContact O-N 3.03Å |
| 191 | M | 97.5 | Very high | 94.3 | Very high | 92 Ų | 92 | 43.3 Ų | 43.3 | 45% | 0.453 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -63.2 | -42.5 | 172.2 | -175.3 | 169.1 | 67.6 | 0 | 0 | 111.6 | L25 C187 M188 A193 L194 I195 | L25-M191 HydrophobicContact CD1-CB 4.47Å; L25-M191 HydrophobicContact CD1-CE 3.58Å; L25-M191 HydrophobicContact CD1-CG 4.11Å; L25-M191 HydrophobicContact CD2-CE 3.76Å; L25-M191 HydrophobicContact CG-CE 4.31Å; C187-M191 WeakPolarHBondContact O-CB 3.38Å; C187-M191 PolarHBondContact O-N 3.42Å; M188-M191 PolarHBondContact O-N 3.07Å; M191-A193 PolarHBondContact O-N 2.64Å; M191-L194 WeakPolarHBondContact O-CB 3.34Å; M191-L194 PolarHBondContact O-N 3.23Å; M191-I195 HydrophobicContact CG-CD1 4.13Å; M191-I195 WeakPolarHBondContact O-CD1 3.19Å; M191-I195 WeakPolarHBondContact O-CG1 3.32Å; M191-I195 PolarHBondContact O-N 3.23Å |
| 192 | G | 97 | Very high | 93.6 | Very high | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.4 | -43.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | M188 S189 L194 I195 L196 | M188-G192 PolarHBondContact O-N 3.13Å; S189-G192 PolarHBondContact O-N 3.45Å; G192-L194 VanDerWaalsContact C-N 3.34Å; G192-L194 PolarHBondContact O-N 3.13Å; G192-I195 PolarHBondContact O-N 3.02Å; G192-L196 WeakPolarHBondContact O-CG 3.26Å; G192-L196 PolarHBondContact O-N 2.73Å |
| 193 | A | 97.3 | Very high | 92.3 | Very high | 11 Ų | 11 | 51.7 Ų | 51.7 | 9% | 0.091 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.6 | -41.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | A91 V95 S189 A190 M191 L196 A197 | A91-A193 HydrophobicContact CB-CB 3.62Å; V95-A193 HydrophobicContact CG2-CB 4.38Å; S189-A193 WeakPolarHBondContact O-CB 3.36Å; S189-A193 PolarHBondContact O-N 3.22Å; A190-A193 PolarHBondContact O-N 2.87Å; M191-A193 PolarHBondContact O-N 2.64Å; A193-L196 PolarHBondContact O-N 3.14Å; A193-A197 WeakPolarHBondContact O-CB 3.43Å; A193-A197 PolarHBondContact O-N 3.23Å |
| 194 | L | 97.2 | Very high | 90.4 | Very high | 107 Ų | 107 | 49.6 Ų | 49.6 | 56% | 0.56 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -62.4 | -43.9 | 175.3 | -177.8 | 64.6 | 0 | 0 | 0 | 111.7 | A190 M191 G192 L196 A197 L198 | A190-L194 PolarHBondContact O-N 3.03Å; M191-L194 WeakPolarHBondContact O-CB 3.34Å; M191-L194 PolarHBondContact O-N 3.23Å; G192-L194 VanDerWaalsContact C-N 3.34Å; G192-L194 PolarHBondContact O-N 3.13Å; L194-L196 VanDerWaalsContact C-N 3.31Å; L194-L196 PolarHBondContact O-N 2.97Å; L194-A197 WeakPolarHBondContact O-CB 3.29Å; L194-A197 PolarHBondContact O-N 3.49Å; L194-A197 VanDerWaalsContact O-N 3.1Å; L194-L198 HydrophobicContact CG-CD1 4.46Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 3.4Å |
| 195 | I | 96.5 | Very high | 88.1 | Confident | 27 Ų | 27 | 53.6 Ų | 53.6 | 14% | 0.138 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -61 | -41 | 177.5 | -70.9 | 158.2 | 0 | 0 | 0 | 111.4 | Q18 F21 L25 M191 G192 L198 L199 | Q18-I195 HydrophobicContact CG-CG2 3.8Å; Q18-I195 PolarHBondContact NE2-O 3.42Å; Q18-I195 VanDerWaalsContact NE2-O 3.1Å; Q18-I195 WeakPolarHBondContact O-CG2 3.41Å; F21-I195 HydrophobicContact CD1-CD1 3.68Å; F21-I195 HydrophobicContact CE1-CD1 3.71Å; L25-I195 HydrophobicContact CD1-CD1 3.46Å; L25-I195 VanDerWaalsContact CD1-CD1 3.46Å; M191-I195 HydrophobicContact CG-CD1 4.13Å; M191-I195 WeakPolarHBondContact O-CD1 3.19Å; M191-I195 WeakPolarHBondContact O-CG1 3.32Å; M191-I195 PolarHBondContact O-N 3.23Å; G192-I195 PolarHBondContact O-N 3.02Å; I195-L198 PolarHBondContact O-N 3.15Å; I195-L199 PolarHBondContact O-N 2.97Å |
| 196 | L | 95.6 | Very high | 85.7 | Confident | 1 Ų | 1 | 58.5 Ų | 58.5 | 1% | 0.005 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -68.5 | -34.2 | 174.4 | -64.9 | -178.5 | 0 | 0 | 0 | 112.2 | L19 F23 I26 M87 V88 A91 G192 A193 L194 L198 L199 | L19-L196 HydrophobicContact CD1-CD2 3.86Å; F23-L196 HydrophobicContact CD2-CD1 4.27Å; F23-L196 HydrophobicContact CD2-CD2 4.01Å; F23-L196 HydrophobicContact CE2-CD1 3.99Å; F23-L196 HydrophobicContact CE2-CD2 4.04Å; I26-L196 HydrophobicContact CD1-CD1 3.51Å; I26-L196 HydrophobicContact CD1-CG 4.42Å; M87-L196 HydrophobicContact CB-CD1 4.37Å; V88-L196 HydrophobicContact CG2-CB 4.28Å; A91-L196 HydrophobicContact CB-CD1 4.09Å; G192-L196 WeakPolarHBondContact O-CG 3.26Å; G192-L196 PolarHBondContact O-N 2.73Å; A193-L196 PolarHBondContact O-N 3.14Å; L194-L196 VanDerWaalsContact C-N 3.31Å; L194-L196 PolarHBondContact O-N 2.97Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 3.21Å; L196-L199 WeakPolarHBondContact O-CB 3.34Å; L196-L199 PolarHBondContact O-N 3.28Å; L196-L199 VanDerWaalsContact O-N 3.15Å |
| 197 | A | 94.8 | Very high | 83.3 | Confident | 31 Ų | 31 | 62.1 Ų | 62.1 | 26% | 0.256 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67.8 | -29.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | K84 V88 A193 L194 L199 | K84-A197 WeakPolarHBondContact CE-O 3.48Å; K84-A197 PolarHBondContact NZ-O 3.25Å; V88-A197 HydrophobicContact CG1-CB 4.37Å; V88-A197 HydrophobicContact CG2-CB 4.02Å; A193-A197 WeakPolarHBondContact O-CB 3.43Å; A193-A197 PolarHBondContact O-N 3.23Å; L194-A197 WeakPolarHBondContact O-CB 3.29Å; L194-A197 PolarHBondContact O-N 3.49Å; L194-A197 VanDerWaalsContact O-N 3.1Å; A197-L199 VanDerWaalsContact C-N 3.26Å; A197-L199 PolarHBondContact O-N 3.41Å |
| 198 | L | 94.3 | Very high | 80.4 | Confident | 120 Ų | 120 | 60.2 Ų | 60.2 | 63% | 0.628 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.5 | -5.4 | 173.4 | -66.5 | 175.3 | 0 | 0 | 0 | 113.4 | Q18 L194 I195 L196 | Q18-L198 VanDerWaalsContact NE2-C 3.29Å; Q18-L198 PolarHBondContact NE2-O 2.83Å; L194-L198 HydrophobicContact CG-CD1 4.46Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 3.4Å; I195-L198 PolarHBondContact O-N 3.15Å; L196-L198 VanDerWaalsContact C-N 3.29Å; L196-L198 PolarHBondContact O-N 3.21Å |
| 199 | L | 91.9 | Very high | 77.6 | Confident | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 35% | 0.345 | C | S | . | . | S | Bend | trans | -64.9 | 140.5 | 179.7 | -158.1 | 67.4 | 0 | 0 | 0 | 110.2 | Q18 L19 K84 M87 Y130 I195 L196 A197 P201 | Q18-L199 HydrophobicContact CB-CD1 3.96Å; Q18-L199 HydrophobicContact CG-CD1 3.81Å; L19-L199 HydrophobicContact CB-CD2 4.47Å; L19-L199 HydrophobicContact CD1-CD2 4.15Å; K84-L199 WeakPolarHBondContact CD-O 3.41Å; K84-L199 WeakPolarHBondContact CE-O 3.41Å; K84-L199 PolarHBondContact NZ-O 3.41Å; M87-L199 HydrophobicContact CE-CD2 3.72Å; Y130-L199 HydrophobicContact CD1-CD2 4.11Å; Y130-L199 HydrophobicContact CD2-CD2 3.92Å; Y130-L199 HydrophobicContact CE1-CD1 4.5Å; Y130-L199 HydrophobicContact CE1-CD2 3.68Å; Y130-L199 HydrophobicContact CE1-CG 4.21Å; Y130-L199 HydrophobicContact CE2-CD2 3.47Å; Y130-L199 VanDerWaalsContact CE2-CD2 3.47Å; Y130-L199 HydrophobicContact CE2-CG 3.93Å; Y130-L199 HydrophobicContact CG-CD2 4.23Å; Y130-L199 WeakPolarHBondContact OH-CG 3.41Å; I195-L199 PolarHBondContact O-N 2.97Å; L196-L199 WeakPolarHBondContact O-CB 3.34Å; L196-L199 PolarHBondContact O-N 3.28Å; L196-L199 VanDerWaalsContact O-N 3.15Å; A197-L199 VanDerWaalsContact C-N 3.26Å; A197-L199 PolarHBondContact O-N 3.41Å; L199-P201 WeakPolarHBondContact O-CD 3.42Å |
| 200 | K | 88 | Confident | 74.7 | Confident | 159 Ų | 159 | 66.6 Ų | 66.6 | 69% | 0.691 | 37% | 0.367 | S | S | * | . | P | Polyproline II helix | trans | -65.5 | 124.4 | 177.9 | -175.2 | 176.3 | 179.3 | -179.9 | 0 | 109 | Y130 V202 | Y130-K200 WeakPolarHBondContact CE2-O 3.34Å; Y130-K200 PolarHBondContact OH-O 3.24Å; Y130-K200 VanDerWaalsContact OH-O 3.09Å; K200-V202 PolarHBondContact O-N 3.44Å |
| 201 | P | 80.6 | Confident | 71.8 | Confident | 68 Ų | 68 | 70.2 Ų | 70.2 | 44% | 0.442 | 38% | 0.38 | S | S | . | . | P | Polyproline II helix | trans | -64.3 | 126.5 | 174.4 | 26 | -31.4 | 0 | 0 | 0 | 109.2 | K84 L199 | K84-P201 HydrophobicContact CD-CB 3.96Å; L199-P201 WeakPolarHBondContact O-CD 3.42Å |
| 202 | V | 75.3 | Confident | 68.9 | Low | 34 Ų | 34 | 70.6 Ų | 70.6 | 21% | 0.206 | 38% | 0.384 | C | S | . | . | trans | -110.8 | 112 | 171.9 | -173.5 | 0 | 0 | 0 | 0 | 106.3 | Y130 L133 K200 | Y130-V202 HydrophobicContact CE2-CB 4.43Å; Y130-V202 HydrophobicContact CE2-CG2 3.98Å; L133-V202 HydrophobicContact CB-CB 4.39Å; L133-V202 HydrophobicContact CB-CG1 3.85Å; K200-V202 PolarHBondContact O-N 3.44Å | ||
| 203 | R | 64.7 | Low | 66.1 | Low | 144 Ų | 144 | 78.5 Ų | 78.5 | 54% | 0.543 | 42% | 0.421 | S | S | . | . | trans | -94.3 | 135.9 | 174 | -78.1 | -176 | 161.1 | 158.8 | -7 | 109.1 | T82 E205 N206 | T82-R203 HydrophobicContact CG2-CG 4.32Å; R203-E205 HydrophobicContact CB-CB 4.3Å; R203-E205 PolarHBondContact O-N 3.37Å; R203-N206 PolarHBondContact O-N 3.46Å; R203-N206 VanDerWaalsContact O-N 3.11Å | ||
| 204 | G | 55 | Low | 63.3 | Low | 41 Ų | 41 | 82.4 Ų | 82.4 | 42% | 0.423 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.7 | -22.7 | 168.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | N206 V207 A208 | G204-N206 VanDerWaalsContact C-N 3.29Å; G204-N206 PolarHBondContact O-N 2.94Å; G204-V207 WeakPolarHBondContact O-CB 3.11Å; G204-V207 PolarHBondContact O-N 3.1Å; G204-V207 VanDerWaalsContact O-N 3.1Å; G204-A208 PolarHBondContact O-N 3.41Å |
| 205 | E | 46.8 | Very low | 60.5 | Low | 111 Ų | 111 | 80.9 Ų | 80.9 | 52% | 0.519 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.4 | -26.4 | 172.4 | -98.2 | 170.4 | 165.7 | 0 | 0 | 113.8 | R203 V207 A208 E209 | R203-E205 HydrophobicContact CB-CB 4.3Å; R203-E205 PolarHBondContact O-N 3.37Å; E205-V207 CarbonylContact O-C 3.29Å; E205-V207 PolarHBondContact O-N 3.28Å; E205-A208 HydrophobicContact CG-CB 4.39Å; E205-A208 CarbonylContact O-C 3.49Å; E205-A208 WeakPolarHBondContact O-CA 3.16Å; E205-A208 PolarHBondContact O-N 2.88Å; E205-E209 WeakPolarHBondContact O-CA 3.46Å; E205-E209 VanDerWaalsContact O-CB 3.27Å; E205-E209 WeakPolarHBondContact O-CB 3.35Å; E205-E209 PolarHBondContact O-N 3.31Å |
| 206 | N | 44.3 | Very low | 57.4 | Low | 103 Ų | 103 | 82.7 Ų | 82.7 | 55% | 0.551 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -61.5 | -19.8 | 174.6 | -67.9 | 19.5 | 0 | 0 | 0 | 112 | R203 G204 S210 | R203-N206 PolarHBondContact O-N 3.46Å; R203-N206 VanDerWaalsContact O-N 3.11Å; G204-N206 VanDerWaalsContact C-N 3.29Å; G204-N206 PolarHBondContact O-N 2.94Å; N206-S210 VanDerWaalsContact O-CB 3.31Å; N206-S210 WeakPolarHBondContact O-CB 3.23Å; N206-S210 PolarHBondContact O-N 3.08Å; N206-S210 PolarHBondContact O-OG 3.32Å |
| 207 | V | 45.2 | Very low | 54.4 | Low | 95 Ų | 95 | 92.6 Ų | 92.6 | 58% | 0.576 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -84 | -42.4 | 169.1 | -173.6 | 0 | 0 | 0 | 0 | 110.9 | G204 E205 S210 L211 | G204-V207 WeakPolarHBondContact O-CB 3.11Å; G204-V207 PolarHBondContact O-N 3.1Å; G204-V207 VanDerWaalsContact O-N 3.1Å; E205-V207 CarbonylContact O-C 3.29Å; E205-V207 PolarHBondContact O-N 3.28Å; V207-S210 WeakPolarHBondContact CA-OG 3.46Å; V207-S210 PolarHBondContact O-N 3.35Å; V207-S210 PolarHBondContact O-OG 2.86Å; V207-L211 HydrophobicContact CG1-CD1 4.49Å; V207-L211 WeakPolarHBondContact O-CG 2.99Å; V207-L211 PolarHBondContact O-N 2.88Å; V207-L211 VanDerWaalsContact O-N 3.08Å |
| 208 | A | 36.8 | Very low | 51.5 | Low | 40 Ų | 40 | 99 Ų | 99 | 33% | 0.331 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -69.2 | -45.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | G204 E205 S210 L211 L212 | G204-A208 PolarHBondContact O-N 3.41Å; E205-A208 HydrophobicContact CG-CB 4.39Å; E205-A208 CarbonylContact O-C 3.49Å; E205-A208 WeakPolarHBondContact O-CA 3.16Å; E205-A208 PolarHBondContact O-N 2.88Å; A208-S210 VanDerWaalsContact C-N 3.33Å; A208-L211 CarbonylContact O-C 3.53Å; A208-L211 WeakPolarHBondContact O-CA 3.3Å; A208-L211 WeakPolarHBondContact O-CB 3.32Å; A208-L211 PolarHBondContact O-N 3.22Å; A208-L212 VanDerWaalsContact O-CB 3.29Å; A208-L212 WeakPolarHBondContact O-CB 3.02Å; A208-L212 PolarHBondContact O-N 2.72Å |
| 209 | E | 37.7 | Very low | 48.4 | Very low | 107 Ų | 107 | 101.5 Ų | 101.5 | 50% | 0.5 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -56.1 | -41.1 | 165.7 | -77 | 179.1 | 156.7 | 0 | 0 | 110.8 | E205 L211 L212 E213 | E205-E209 WeakPolarHBondContact O-CA 3.46Å; E205-E209 VanDerWaalsContact O-CB 3.27Å; E205-E209 WeakPolarHBondContact O-CB 3.35Å; E205-E209 PolarHBondContact O-N 3.31Å; E209-L211 PolarHBondContact O-N 2.97Å; E209-L212 CarbonylContact O-C 3.57Å; E209-L212 PolarHBondContact O-N 3.37Å; E209-L212 VanDerWaalsContact O-N 3.12Å; E209-E213 WeakPolarHBondContact O-CA 3.24Å; E209-E213 WeakPolarHBondContact O-CB 3.47Å; E209-E213 PolarHBondContact O-N 2.86Å |
| 210 | S | 34 | Very low | 45.3 | Very low | 66 Ų | 66 | 110.9 Ų | 110.9 | 46% | 0.462 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62.9 | -26.7 | 172.8 | 74.4 | 0 | 0 | 0 | 0 | 113.3 | N206 V207 A208 S214 | N206-S210 VanDerWaalsContact O-CB 3.31Å; N206-S210 WeakPolarHBondContact O-CB 3.23Å; N206-S210 PolarHBondContact O-N 3.08Å; N206-S210 PolarHBondContact O-OG 3.32Å; V207-S210 WeakPolarHBondContact CA-OG 3.46Å; V207-S210 PolarHBondContact O-N 3.35Å; V207-S210 PolarHBondContact O-OG 2.86Å; A208-S210 VanDerWaalsContact C-N 3.33Å; S210-S214 PolarHBondContact O-OG 3.45Å; S210-S214 VanDerWaalsContact O-OG 3.05Å |
| 211 | L | 37.5 | Very low | 42.7 | Very low | 117 Ų | 117 | 109 Ų | 109 | 61% | 0.613 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -87.9 | -23.8 | 174.2 | -65.5 | 170.2 | 0 | 0 | 0 | 113.2 | V207 A208 E209 S214 | V207-L211 HydrophobicContact CG1-CD1 4.49Å; V207-L211 WeakPolarHBondContact O-CG 2.99Å; V207-L211 PolarHBondContact O-N 2.88Å; V207-L211 VanDerWaalsContact O-N 3.08Å; A208-L211 CarbonylContact O-C 3.53Å; A208-L211 WeakPolarHBondContact O-CA 3.3Å; A208-L211 WeakPolarHBondContact O-CB 3.32Å; A208-L211 PolarHBondContact O-N 3.22Å; E209-L211 PolarHBondContact O-N 2.97Å; L211-S214 VanDerWaalsContact C-OG 3.23Å; L211-S214 WeakPolarHBondContact CA-OG 3.47Å; L211-S214 PolarHBondContact O-OG 3.46Å |
| 212 | L | 36.4 | Very low | 40.5 | Very low | 101 Ų | 101 | 110.4 Ų | 110.4 | 53% | 0.529 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -94.3 | -32 | -178.8 | -94 | 161.1 | 0 | 0 | 0 | 111.8 | A208 E209 S214 A215 S216 | A208-L212 VanDerWaalsContact O-CB 3.29Å; A208-L212 WeakPolarHBondContact O-CB 3.02Å; A208-L212 PolarHBondContact O-N 2.72Å; E209-L212 CarbonylContact O-C 3.57Å; E209-L212 PolarHBondContact O-N 3.37Å; E209-L212 VanDerWaalsContact O-N 3.12Å; L212-S214 PolarHBondContact O-N 2.9Å; L212-A215 CarbonylContact O-C 3.45Å; L212-A215 VanDerWaalsContact O-C 3.29Å; L212-A215 WeakPolarHBondContact O-CA 3.39Å; L212-A215 PolarHBondContact O-N 3.35Å; L212-S216 WeakPolarHBondContact O-CB 3.46Å; L212-S216 PolarHBondContact O-N 3.13Å; L212-S216 PolarHBondContact O-OG 3.36Å |
| 213 | E | 39.5 | Very low | 38.8 | Very low | 166 Ų | 166 | 115.2 Ų | 115.2 | 78% | 0.776 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | -23.5 | 169 | -158.1 | 173.3 | -144.8 | 0 | 0 | 109.7 | E209 A215 | E209-E213 WeakPolarHBondContact O-CA 3.24Å; E209-E213 WeakPolarHBondContact O-CB 3.47Å; E209-E213 PolarHBondContact O-N 2.86Å; E213-A215 VanDerWaalsContact C-N 3.33Å |
| 214 | S | 36.5 | Very low | 37.5 | Very low | 93 Ų | 93 | 110.3 Ų | 110.3 | 65% | 0.65 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.5 | -8 | 163.7 | 45.9 | 0 | 0 | 0 | 0 | 114.5 | S210 L211 L212 | S210-S214 PolarHBondContact O-OG 3.45Å; S210-S214 VanDerWaalsContact O-OG 3.05Å; L211-S214 VanDerWaalsContact C-OG 3.23Å; L211-S214 WeakPolarHBondContact CA-OG 3.47Å; L211-S214 PolarHBondContact O-OG 3.46Å; L212-S214 PolarHBondContact O-N 2.9Å |
| 215 | A | 38.9 | Very low | 36.8 | Very low | 75 Ų | 75 | 113.5 Ų | 113.5 | 62% | 0.62 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.4 | -4.4 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | L212 E213 | L212-A215 CarbonylContact O-C 3.45Å; L212-A215 VanDerWaalsContact O-C 3.29Å; L212-A215 WeakPolarHBondContact O-CA 3.39Å; L212-A215 PolarHBondContact O-N 3.35Å; E213-A215 VanDerWaalsContact C-N 3.33Å |
| 216 | S | 32.6 | Very low | 36.5 | Very low | 65 Ų | 65 | 113 Ų | 113 | 46% | 0.455 | 64% | 0.636 | S | S | . | * | trans | -128.8 | 64 | -172.2 | 60.2 | 0 | 0 | 0 | 0 | 112.5 | L212 Q218 | L212-S216 WeakPolarHBondContact O-CB 3.46Å; L212-S216 PolarHBondContact O-N 3.13Å; L212-S216 PolarHBondContact O-OG 3.36Å; S216-Q218 PolarHBondContact O-N 3.24Å | ||
| 217 | E | 31.9 | Very low | 36.1 | Very low | 209 Ų | 209 | 110.9 Ų | 110.9 | 98% | 0.977 | 63% | 0.633 | S | S | * | * | trans | -72.1 | 28.8 | 145.2 | -81.7 | -175.8 | 150.9 | 0 | 0 | 111.7 | ||||
| 218 | Q | 33.6 | Very low | 36.2 | Very low | 166 Ų | 166 | 110.7 Ų | 110.7 | 78% | 0.776 | 63% | 0.632 | S | S | * | * | trans | -137.4 | 102.2 | -176.8 | -147 | 166.3 | 1.1 | 0 | 0 | 111.7 | S216 | S216-Q218 PolarHBondContact O-N 3.24Š| ||
| 219 | E | 29 | Very low | 36.7 | Very low | 172 Ų | 172 | 112.7 Ų | 112.7 | 80% | 0.804 | 64% | 0.64 | S | S | * | * | trans | -47.3 | 143 | 168.5 | -78.6 | 174.1 | 125 | 0 | 0 | 112.8 | ||||
| 220 | F | 27.5 | Very low | 37.2 | Very low | 197 Ų | 197 | 110.9 Ų | 110.9 | 86% | 0.864 | 64% | 0.636 | S | S | * | * | -177.8 | 115.1 | 127.5 | -85.8 | -63.1 | 0 | 0 | 0 | 109.6 | |||||
| 221 | P | 33.1 | Very low | 38 | Very low | 118 Ų | 118 | 111.5 Ų | 111.5 | 77% | 0.766 | 64% | 0.637 | S | S | * | * | trans | -105.8 | 129.4 | 172.6 | 34.3 | -23.9 | 0 | 0 | 0 | 111.4 | ||||
| 222 | S | 35.1 | Very low | 38.7 | Very low | 99 Ų | 99 | 115.1 Ų | 115.1 | 69% | 0.692 | 64% | 0.643 | S | S | * | * | trans | -179.5 | 109.9 | 147.4 | 55.4 | 0 | 0 | 0 | 0 | 112.8 | G224 | S222-G224 VanDerWaalsContact C-N 3.25Å; S222-G224 PolarHBondContact O-N 3.47Å | ||
| 223 | V | 39 | Very low | 39.7 | Very low | 135 Ų | 135 | 112.4 Ų | 112.4 | 82% | 0.818 | 63% | 0.632 | S | S | * | * | S | Bend | trans | 56.6 | -32.7 | 149.7 | -165.9 | 0 | 0 | 0 | 0 | 120.2 | N225 | V223-N225 VanDerWaalsContact C-N 3.27Å; V223-N225 PolarHBondContact O-N 3.34Å |
| 224 | G | 38 | Very low | 40.5 | Very low | 40 Ų | 40 | 113.2 Ų | 113.2 | 41% | 0.412 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -68.4 | -22.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | S222 V226 A227 V228 | S222-G224 VanDerWaalsContact C-N 3.25Å; S222-G224 PolarHBondContact O-N 3.47Å; G224-V226 VanDerWaalsContact C-N 3.31Å; G224-V226 PolarHBondContact O-N 3.23Å; G224-A227 PolarHBondContact O-N 3.13Å; G224-V228 VanDerWaalsContact O-CG2 3.26Å; G224-V228 WeakPolarHBondContact O-CG2 3.35Å; G224-V228 PolarHBondContact O-N 3.5Å; G224-V228 VanDerWaalsContact O-N 3.09Å |
| 225 | N | 39.1 | Very low | 41.5 | Very low | 109 Ų | 109 | 113.4 Ų | 113.4 | 58% | 0.583 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -68 | -27.4 | -177.3 | -72.3 | -7.3 | 0 | 0 | 0 | 113.1 | V223 T229 | V223-N225 VanDerWaalsContact C-N 3.27Å; V223-N225 PolarHBondContact O-N 3.34Å; N225-T229 VanDerWaalsContact O-CB 3.22Å; N225-T229 WeakPolarHBondContact O-CB 3.5Å; N225-T229 WeakPolarHBondContact O-CG2 3.45Å; N225-T229 PolarHBondContact O-N 3.02Å; N225-T229 PolarHBondContact O-OG1 2.96Å |
| 226 | V | 41.1 | Very low | 42.8 | Very low | 100 Ų | 100 | 112.9 Ų | 112.9 | 61% | 0.606 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -71.7 | -44.6 | 179.3 | -175.5 | 0 | 0 | 0 | 0 | 111.1 | G224 T229 T230 | G224-V226 VanDerWaalsContact C-N 3.31Å; G224-V226 PolarHBondContact O-N 3.23Å; V226-T229 WeakPolarHBondContact CA-OG1 3.5Å; V226-T229 PolarHBondContact O-N 2.88Å; V226-T229 PolarHBondContact O-OG1 3.25Å; V226-T230 HydrophobicContact CG1-CG2 4.48Å; V226-T230 WeakPolarHBondContact O-CB 3.32Å; V226-T230 WeakPolarHBondContact O-CG2 3.25Å; V226-T230 PolarHBondContact O-N 3.26Å; V226-T230 PolarHBondContact O-OG1 2.94Å |
| 227 | A | 36.1 | Very low | 44.4 | Very low | 59 Ų | 59 | 111.5 Ų | 111.5 | 49% | 0.488 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -65.2 | -42.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111 | G224 T230 V231 | G224-A227 PolarHBondContact O-N 3.13Å; A227-T230 WeakPolarHBondContact CA-OG1 3.45Å; A227-T230 PolarHBondContact O-N 2.95Å; A227-T230 PolarHBondContact O-OG1 3.3Å; A227-V231 VanDerWaalsContact O-CB 3.32Å; A227-V231 WeakPolarHBondContact O-CB 3.34Å; A227-V231 WeakPolarHBondContact O-CG2 3.4Å; A227-V231 PolarHBondContact O-N 3.45Å |
| 228 | V | 47.9 | Very low | 46.2 | Very low | 90 Ų | 90 | 108.6 Ų | 108.6 | 55% | 0.545 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -65.9 | -41.2 | 178 | 174.9 | 0 | 0 | 0 | 0 | 111.6 | G224 R232 | G224-V228 VanDerWaalsContact O-CG2 3.26Å; G224-V228 WeakPolarHBondContact O-CG2 3.35Å; G224-V228 PolarHBondContact O-N 3.5Å; G224-V228 VanDerWaalsContact O-N 3.09Å; V228-R232 WeakPolarHBondContact O-CB 3.39Å; V228-R232 PolarHBondContact O-N 3.32Å |
| 229 | T | 47.3 | Very low | 48.1 | Very low | 83 Ų | 83 | 104.8 Ų | 104.8 | 51% | 0.509 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -68.5 | -40.3 | 176.9 | 49.8 | 0 | 0 | 0 | 0 | 112.1 | N225 V226 S233 | N225-T229 VanDerWaalsContact O-CB 3.22Å; N225-T229 WeakPolarHBondContact O-CB 3.5Å; N225-T229 WeakPolarHBondContact O-CG2 3.45Å; N225-T229 PolarHBondContact O-N 3.02Å; N225-T229 PolarHBondContact O-OG1 2.96Å; V226-T229 WeakPolarHBondContact CA-OG1 3.5Å; V226-T229 PolarHBondContact O-N 2.88Å; V226-T229 PolarHBondContact O-OG1 3.25Å; T229-S233 VanDerWaalsContact O-CB 3.22Å; T229-S233 WeakPolarHBondContact O-CB 3.34Å; T229-S233 PolarHBondContact O-N 2.86Å |
| 230 | T | 46.4 | Very low | 50.1 | Low | 68 Ų | 68 | 99.7 Ų | 99.7 | 42% | 0.417 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -68.4 | -41.4 | 176.4 | 49.5 | 0 | 0 | 0 | 0 | 112.6 | V226 A227 S233 R234 | V226-T230 HydrophobicContact CG1-CG2 4.48Å; V226-T230 WeakPolarHBondContact O-CB 3.32Å; V226-T230 WeakPolarHBondContact O-CG2 3.25Å; V226-T230 PolarHBondContact O-N 3.26Å; V226-T230 PolarHBondContact O-OG1 2.94Å; A227-T230 WeakPolarHBondContact CA-OG1 3.45Å; A227-T230 PolarHBondContact O-N 2.95Å; A227-T230 PolarHBondContact O-OG1 3.3Å; T230-S233 PolarHBondContact O-N 3.44Å; T230-R234 WeakPolarHBondContact O-CG 3.25Å; T230-R234 PolarHBondContact O-N 3.38Å |
| 231 | V | 51.4 | Low | 52.2 | Low | 79 Ų | 79 | 91 Ų | 91 | 48% | 0.479 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.1 | -45.9 | 173.7 | 172.1 | 0 | 0 | 0 | 0 | 110.7 | A227 S233 R234 I235 | A227-V231 VanDerWaalsContact O-CB 3.32Å; A227-V231 WeakPolarHBondContact O-CB 3.34Å; A227-V231 WeakPolarHBondContact O-CG2 3.4Å; A227-V231 PolarHBondContact O-N 3.45Å; V231-S233 VanDerWaalsContact C-N 3.3Å; V231-S233 PolarHBondContact O-N 3.4Å; V231-R234 PolarHBondContact O-N 3.27Å; V231-I235 HydrophobicContact CG1-CD1 3.7Å; V231-I235 HydrophobicContact CG1-CG1 4.39Å; V231-I235 WeakPolarHBondContact O-CG1 3.43Å; V231-I235 PolarHBondContact O-N 3.03Å |
| 232 | R | 52.7 | Low | 54.2 | Low | 194 Ų | 194 | 92.2 Ų | 92.2 | 73% | 0.732 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -59.2 | -41.7 | 174.9 | 178.5 | 177.2 | -92.9 | -163.1 | -4.6 | 111.3 | V228 S236 | V228-R232 WeakPolarHBondContact O-CB 3.39Å; V228-R232 PolarHBondContact O-N 3.32Å; R232-S236 VanDerWaalsContact O-CB 3.27Å; R232-S236 WeakPolarHBondContact O-CB 3.2Å; R232-S236 PolarHBondContact O-N 3.21Å |
| 233 | S | 57.2 | Low | 56 | Low | 43 Ų | 43 | 92.3 Ų | 92.3 | 30% | 0.301 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.7 | -49.7 | 175.7 | 176.1 | 0 | 0 | 0 | 0 | 111.5 | T229 T230 V231 I235 S236 V237 | T229-S233 VanDerWaalsContact O-CB 3.22Å; T229-S233 WeakPolarHBondContact O-CB 3.34Å; T229-S233 PolarHBondContact O-N 2.86Å; T230-S233 PolarHBondContact O-N 3.44Å; V231-S233 VanDerWaalsContact C-N 3.3Å; V231-S233 PolarHBondContact O-N 3.4Å; S233-I235 PolarHBondContact O-N 3.45Å; S233-S236 WeakPolarHBondContact O-CB 3.33Å; S233-S236 PolarHBondContact O-N 2.87Å; S233-S236 VanDerWaalsContact O-N 3.14Å; S233-V237 WeakPolarHBondContact O-CG2 3.28Å; S233-V237 PolarHBondContact O-N 2.83Å |
| 234 | R | 55.2 | Low | 57.8 | Low | 184 Ų | 184 | 88.9 Ų | 88.9 | 69% | 0.694 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -59.1 | -45.9 | 177.4 | -74.3 | -177.6 | -178.5 | -159.4 | 1.6 | 112.5 | T230 V231 S236 V237 F238 | T230-R234 WeakPolarHBondContact O-CG 3.25Å; T230-R234 PolarHBondContact O-N 3.38Å; V231-R234 PolarHBondContact O-N 3.27Å; R234-S236 VanDerWaalsContact C-N 3.3Å; R234-S236 PolarHBondContact O-N 3.06Å; R234-V237 WeakPolarHBondContact O-CB 3.37Å; R234-V237 PolarHBondContact O-N 3.37Å; R234-F238 VanDerWaalsContact O-CD2 3.26Å; R234-F238 WeakPolarHBondContact O-CD2 3.47Å; R234-F238 PolarHBondContact O-N 2.99Å |
| 235 | I | 58.2 | Low | 59.7 | Low | 97 Ų | 97 | 91.8 Ų | 91.8 | 50% | 0.497 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.1 | -41.1 | 176.6 | -67.4 | 170 | 0 | 0 | 0 | 110.2 | V231 S233 N239 | V231-I235 HydrophobicContact CG1-CD1 3.7Å; V231-I235 HydrophobicContact CG1-CG1 4.39Å; V231-I235 WeakPolarHBondContact O-CG1 3.43Å; V231-I235 PolarHBondContact O-N 3.03Å; S233-I235 PolarHBondContact O-N 3.45Å; I235-N239 WeakPolarHBondContact O-CB 3.46Å; I235-N239 PolarHBondContact O-N 3.45Å; I235-N239 VanDerWaalsContact O-N 3.12Å; I235-N239 PolarHBondContact O-ND2 2.88Å |
| 236 | S | 65.8 | Low | 61.4 | Low | 63 Ų | 63 | 93 Ų | 93 | 44% | 0.441 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.5 | -41.3 | 175.6 | -168 | 0 | 0 | 0 | 0 | 112.6 | R232 S233 R234 N239 E240 | R232-S236 VanDerWaalsContact O-CB 3.27Å; R232-S236 WeakPolarHBondContact O-CB 3.2Å; R232-S236 PolarHBondContact O-N 3.21Å; S233-S236 WeakPolarHBondContact O-CB 3.33Å; S233-S236 PolarHBondContact O-N 2.87Å; S233-S236 VanDerWaalsContact O-N 3.14Å; R234-S236 VanDerWaalsContact C-N 3.3Å; R234-S236 PolarHBondContact O-N 3.06Å; S236-N239 PolarHBondContact O-N 3.29Å; S236-E240 WeakPolarHBondContact O-CB 3.36Å; S236-E240 PolarHBondContact O-N 3.37Å |
| 237 | V | 68 | Low | 63 | Low | 36 Ų | 36 | 92.3 Ų | 92.3 | 22% | 0.218 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -58.2 | -53.8 | 179.2 | 174.6 | 0 | 0 | 0 | 0 | 110.9 | P76 S233 R234 N239 E240 A241 | P76-V237 HydrophobicContact CB-CB 3.94Å; P76-V237 HydrophobicContact CB-CG1 3.77Å; P76-V237 HydrophobicContact CB-CG2 3.43Å; P76-V237 VanDerWaalsContact CB-CG2 3.43Å; P76-V237 HydrophobicContact CG-CB 4.19Å; P76-V237 HydrophobicContact CG-CG1 3.81Å; P76-V237 HydrophobicContact CG-CG2 4.22Å; S233-V237 WeakPolarHBondContact O-CG2 3.28Å; S233-V237 PolarHBondContact O-N 2.83Å; R234-V237 WeakPolarHBondContact O-CB 3.37Å; R234-V237 PolarHBondContact O-N 3.37Å; V237-N239 VanDerWaalsContact C-N 3.3Å; V237-N239 PolarHBondContact O-N 3.48Å; V237-E240 PolarHBondContact O-N 2.95Å; V237-A241 PolarHBondContact O-N 2.87Å |
| 238 | F | 69.3 | Low | 64.9 | Low | 149 Ų | 149 | 93.5 Ų | 93.5 | 65% | 0.654 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -64.5 | -37.4 | -178.9 | -76.7 | -71.7 | 0 | 0 | 0 | 111.8 | R234 K242 | R234-F238 VanDerWaalsContact O-CD2 3.26Å; R234-F238 WeakPolarHBondContact O-CD2 3.47Å; R234-F238 PolarHBondContact O-N 2.99Å; F238-K242 WeakPolarHBondContact O-CB 3.28Å; F238-K242 PolarHBondContact O-N 3.17Å |
| 239 | N | 73.4 | Confident | 66.3 | Low | 85 Ų | 85 | 96.9 Ų | 96.9 | 46% | 0.455 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.8 | -43.4 | 175.4 | -70.9 | -19.6 | 0 | 0 | 0 | 111.6 | I235 S236 V237 K242 E243 | I235-N239 WeakPolarHBondContact O-CB 3.46Å; I235-N239 PolarHBondContact O-N 3.45Å; I235-N239 VanDerWaalsContact O-N 3.12Å; I235-N239 PolarHBondContact O-ND2 2.88Å; S236-N239 PolarHBondContact O-N 3.29Å; V237-N239 VanDerWaalsContact C-N 3.3Å; V237-N239 PolarHBondContact O-N 3.48Å; N239-K242 PolarHBondContact O-N 3.43Å; N239-E243 WeakPolarHBondContact O-CB 3.33Å; N239-E243 WeakPolarHBondContact O-CG 3.21Å; N239-E243 PolarHBondContact O-N 3.37Å |
| 240 | E | 71 | Confident | 67.7 | Low | 65 Ų | 65 | 96.5 Ų | 96.5 | 30% | 0.304 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -65.4 | -42.5 | 179.2 | -169.4 | 176.8 | -177.8 | 0 | 0 | 112.2 | S236 V237 K242 E243 T244 | S236-E240 WeakPolarHBondContact O-CB 3.36Å; S236-E240 PolarHBondContact O-N 3.37Å; V237-E240 PolarHBondContact O-N 2.95Å; E240-K242 VanDerWaalsContact C-N 3.35Å; E240-E243 PolarHBondContact O-N 3.07Å; E240-T244 WeakPolarHBondContact O-CB 3.37Å; E240-T244 PolarHBondContact O-N 3.36Å; E240-T244 PolarHBondContact O-OG1 2.93Å |
| 241 | A | 71.4 | Confident | 69.2 | Low | 16 Ų | 16 | 95.7 Ų | 95.7 | 13% | 0.132 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | V237 T244 L245 | V237-A241 PolarHBondContact O-N 2.87Å; A241-T244 PolarHBondContact O-N 2.97Å; A241-L245 WeakPolarHBondContact O-CB 3.47Å; A241-L245 PolarHBondContact O-N 3.3Å |
| 242 | K | 74.3 | Confident | 70.5 | Confident | 142 Ų | 142 | 96.1 Ų | 96.1 | 62% | 0.617 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -63.2 | -43.9 | 176.1 | -176.7 | -178.7 | 179.1 | -177.6 | 0 | 111.8 | F238 N239 E240 L245 K246 | F238-K242 WeakPolarHBondContact O-CB 3.28Å; F238-K242 PolarHBondContact O-N 3.17Å; N239-K242 PolarHBondContact O-N 3.43Å; E240-K242 VanDerWaalsContact C-N 3.35Å; K242-L245 PolarHBondContact O-N 2.83Å; K242-K246 WeakPolarHBondContact O-CB 3.4Å; K242-K246 PolarHBondContact O-N 3.48Å |
| 243 | E | 74.1 | Confident | 71.7 | Confident | 102 Ų | 102 | 87.6 Ų | 87.6 | 48% | 0.477 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -67.1 | -36.4 | 176.1 | -69.5 | -52 | 127.5 | 0 | 0 | 111.6 | N239 E240 K246 M247 | N239-E243 WeakPolarHBondContact O-CB 3.33Å; N239-E243 WeakPolarHBondContact O-CG 3.21Å; N239-E243 PolarHBondContact O-N 3.37Å; E240-E243 PolarHBondContact O-N 3.07Å; E243-K246 PolarHBondContact O-N 3.42Å; E243-K246 IonicContact OE2-NZ 3.54Å; E243-M247 WeakPolarHBondContact O-CB 3.36Å; E243-M247 PolarHBondContact O-N 3.23Å |
| 244 | T | 75.8 | Confident | 72.8 | Confident | 62 Ų | 62 | 89.9 Ų | 89.9 | 38% | 0.38 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.8 | -45 | 173 | -58.2 | 0 | 0 | 0 | 0 | 111.3 | L72 E240 A241 K246 M247 L248 | L72-T244 HydrophobicContact CD1-CG2 4.36Å; E240-T244 WeakPolarHBondContact O-CB 3.37Å; E240-T244 PolarHBondContact O-N 3.36Å; E240-T244 PolarHBondContact O-OG1 2.93Å; A241-T244 PolarHBondContact O-N 2.97Å; T244-K246 VanDerWaalsContact C-N 3.34Å; T244-K246 PolarHBondContact O-N 2.95Å; T244-M247 WeakPolarHBondContact O-CB 3.32Å; T244-M247 PolarHBondContact O-N 3.13Å; T244-L248 PolarHBondContact O-N 3.35Å |
| 245 | L | 77.2 | Confident | 73.9 | Confident | 101 Ų | 101 | 84.1 Ų | 84.1 | 53% | 0.529 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -68.1 | -33.9 | 177.1 | -171.9 | 64.7 | 0 | 0 | 0 | 112.3 | A241 K242 L248 | A241-L245 WeakPolarHBondContact O-CB 3.47Å; A241-L245 PolarHBondContact O-N 3.3Å; K242-L245 PolarHBondContact O-N 2.83Å; L245-L248 HydrophobicContact CD1-CD2 4.18Å; L245-L248 WeakPolarHBondContact O-CB 3.28Å; L245-L248 PolarHBondContact O-N 2.8Å |
| 246 | K | 76.5 | Confident | 75 | Confident | 134 Ų | 134 | 80.2 Ų | 80.2 | 58% | 0.583 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -66.6 | -40.6 | 172.9 | -172.5 | -178.2 | 175.1 | -170.2 | 0 | 111.1 | K242 E243 T244 L248 K249 | K242-K246 WeakPolarHBondContact O-CB 3.4Å; K242-K246 PolarHBondContact O-N 3.48Å; E243-K246 PolarHBondContact O-N 3.42Å; E243-K246 IonicContact OE2-NZ 3.54Å; T244-K246 VanDerWaalsContact C-N 3.34Å; T244-K246 PolarHBondContact O-N 2.95Å; K246-L248 VanDerWaalsContact C-N 3.31Å; K246-L248 PolarHBondContact O-N 3.42Å; K246-K249 WeakPolarHBondContact O-CB 3.17Å; K246-K249 PolarHBondContact O-N 3.41Å |
| 247 | M | 74.6 | Confident | 75.9 | Confident | 87 Ų | 87 | 79.6 Ų | 79.6 | 43% | 0.429 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.9 | -35.3 | 175.8 | -169.6 | -177.2 | 73.1 | 0 | 0 | 111.9 | E243 T244 K249 H250 M253 | E243-M247 WeakPolarHBondContact O-CB 3.36Å; E243-M247 PolarHBondContact O-N 3.23Å; T244-M247 WeakPolarHBondContact O-CB 3.32Å; T244-M247 PolarHBondContact O-N 3.13Å; M247-K249 PolarHBondContact O-N 2.99Å; M247-H250 WeakPolarHBondContact O-CB 3.42Å; M247-H250 PolarHBondContact O-N 3.17Å; M247-M253 HydrophobicContact CE-CE 4.2Å; M247-M253 HydrophobicContact CG-CE 4.14Å; M247-M253 HydrophobicContact CG-CG 4.19Å; M247-M253 WeakPolarHBondContact O-CB 3.31Å; M247-M253 WeakPolarHBondContact O-CG 3.25Å; M247-M253 HydrophobicContact SD-CE 3.92Å |
| 248 | L | 74.5 | Confident | 76.7 | Confident | 84 Ų | 84 | 82.7 Ų | 82.7 | 44% | 0.44 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -58.4 | -33.5 | 175.1 | -172 | 72.2 | 0 | 0 | 0 | 112.4 | T244 L245 K246 H250 L254 | T244-L248 PolarHBondContact O-N 3.35Å; L245-L248 HydrophobicContact CD1-CD2 4.18Å; L245-L248 WeakPolarHBondContact O-CB 3.28Å; L245-L248 PolarHBondContact O-N 2.8Å; K246-L248 VanDerWaalsContact C-N 3.31Å; K246-L248 PolarHBondContact O-N 3.42Å; L248-H250 PolarHBondContact O-N 3.33Å; L248-L254 WeakPolarHBondContact O-CD2 3.26Å; L248-L254 WeakPolarHBondContact O-CG 3.46Å |
| 249 | K | 77.4 | Confident | 77.4 | Confident | 161 Ų | 161 | 77.9 Ų | 77.9 | 70% | 0.7 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | -9.5 | 178.6 | -64.3 | -175.9 | 178.6 | -175.2 | 0 | 113.5 | K246 M247 S251 | K246-K249 WeakPolarHBondContact O-CB 3.17Å; K246-K249 PolarHBondContact O-N 3.41Å; M247-K249 PolarHBondContact O-N 2.99Å; K249-S251 PolarHBondContact O-N 2.92Å |
| 250 | H | 77.2 | Confident | 78 | Confident | 74 Ų | 74 | 77.8 Ų | 77.8 | 34% | 0.343 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -67.3 | 132.1 | 178.7 | -165.7 | -86.8 | 0 | 0 | 0 | 110.3 | M247 L248 K252 M253 L254 | M247-H250 WeakPolarHBondContact O-CB 3.42Å; M247-H250 PolarHBondContact O-N 3.17Å; L248-H250 PolarHBondContact O-N 3.33Å; H250-K252 VanDerWaalsContact C-N 3.29Å; H250-K252 PolarHBondContact ND1-N 2.88Å; H250-K252 PolarHBondContact O-N 3.42Å; H250-M253 HydrophobicContact CB-CB 4.28Å; H250-M253 HydrophobicContact CB-CG 4.13Å; H250-M253 WeakPolarHBondContact O-CA 3.37Å; H250-M253 WeakPolarHBondContact O-CB 3.18Å; H250-M253 PolarHBondContact O-N 3.38Å; H250-L254 PolarHBondContact O-N 3.23Å |
| 251 | S | 79 | Confident | 78.9 | Confident | 52 Ų | 52 | 81.6 Ų | 81.6 | 36% | 0.364 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -58.3 | -38.4 | -171 | -68.9 | 0 | 0 | 0 | 0 | 113.3 | K249 M253 L254 L255 R491 | K249-S251 PolarHBondContact O-N 2.92Å; S251-M253 VanDerWaalsContact C-N 3.33Å; S251-M253 PolarHBondContact O-N 2.91Å; S251-L254 PolarHBondContact O-N 3.44Å; S251-L255 PolarHBondContact O-N 3.16Å; S251-R491 PolarHBondContact OG-NH1 2.83Å |
| 252 | K | 78.7 | Confident | 79.8 | Confident | 88 Ų | 88 | 83.8 Ų | 83.8 | 38% | 0.383 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -66 | -31.6 | 174.7 | -60.9 | -178.1 | 180 | 176.2 | 0 | 113.1 | H250 L256 L391 | H250-K252 VanDerWaalsContact C-N 3.29Å; H250-K252 PolarHBondContact ND1-N 2.88Å; H250-K252 PolarHBondContact O-N 3.42Å; K252-L256 PolarHBondContact O-N 2.81Å; K252-L391 HydrophobicContact CB-CD1 3.68Å; K252-L391 HydrophobicContact CB-CD2 4.09Å; K252-L391 HydrophobicContact CD-CD1 3.69Å; K252-L391 HydrophobicContact CG-CD1 4.29Å |
| 253 | M | 76.8 | Confident | 80.5 | Confident | 14 Ų | 14 | 77.8 Ų | 77.8 | 7% | 0.069 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -74.8 | -38.9 | 177 | -71.2 | -68.9 | 176.6 | 0 | 0 | 111.6 | M247 H250 S251 L255 L256 C257 L388 L391 L395 | M247-M253 HydrophobicContact CE-CE 4.2Å; M247-M253 HydrophobicContact CG-CE 4.14Å; M247-M253 HydrophobicContact CG-CG 4.19Å; M247-M253 WeakPolarHBondContact O-CB 3.31Å; M247-M253 WeakPolarHBondContact O-CG 3.25Å; M247-M253 HydrophobicContact SD-CE 3.92Å; H250-M253 HydrophobicContact CB-CB 4.28Å; H250-M253 HydrophobicContact CB-CG 4.13Å; H250-M253 WeakPolarHBondContact O-CA 3.37Å; H250-M253 WeakPolarHBondContact O-CB 3.18Å; H250-M253 PolarHBondContact O-N 3.38Å; S251-M253 VanDerWaalsContact C-N 3.33Å; S251-M253 PolarHBondContact O-N 2.91Å; M253-L255 VanDerWaalsContact C-N 3.31Å; M253-L255 PolarHBondContact O-N 3.11Å; M253-L256 WeakPolarHBondContact O-CB 3.48Å; M253-L256 PolarHBondContact O-N 2.76Å; M253-L256 VanDerWaalsContact O-N 3.14Å; M253-C257 PolarHBondContact O-N 2.85Å; M253-C257 PolarHBondContact O-SG 3.29Å; M253-L388 HydrophobicContact CE-CD1 4.35Å; M253-L388 HydrophobicContact SD-CD1 4.35Å; M253-L391 HydrophobicContact CE-CD2 3.47Å; M253-L391 VanDerWaalsContact CE-CD2 3.47Å; M253-L391 HydrophobicContact CE-CG 3.8Å; M253-L391 HydrophobicContact CG-CD2 4.19Å; M253-L391 HydrophobicContact SD-CD2 3.58Å; M253-L391 VanDerWaalsContact SD-CD2 3.58Å; M253-L395 HydrophobicContact CE-CD1 3.37Å |
| 254 | L | 80.1 | Confident | 81.3 | Confident | 92 Ų | 92 | 74.5 Ų | 74.5 | 48% | 0.482 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 175 | -71.1 | 173.3 | 0 | 0 | 0 | 112.1 | L248 H250 S251 L256 C257 | L248-L254 WeakPolarHBondContact O-CD2 3.26Å; L248-L254 WeakPolarHBondContact O-CG 3.46Å; H250-L254 PolarHBondContact O-N 3.23Å; S251-L254 PolarHBondContact O-N 3.44Å; L254-L256 VanDerWaalsContact C-N 3.31Å; L254-L256 PolarHBondContact O-N 2.82Å; L254-C257 VanDerWaalsContact O-CB 3.31Å; L254-C257 WeakPolarHBondContact O-CB 3.48Å; L254-C257 PolarHBondContact O-N 2.71Å |
| 255 | L | 78.1 | Confident | 82 | Confident | 63 Ų | 63 | 76.5 Ų | 76.5 | 33% | 0.33 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.7 | -41.9 | 174.6 | -179.5 | 60.6 | 0 | 0 | 0 | 111.7 | S251 M253 C257 V258 L495 | S251-L255 PolarHBondContact O-N 3.16Å; M253-L255 VanDerWaalsContact C-N 3.31Å; M253-L255 PolarHBondContact O-N 3.11Å; L255-C257 PolarHBondContact O-N 3.06Å; L255-V258 PolarHBondContact O-N 3.05Å; L255-L495 HydrophobicContact CD1-CD1 3.78Å; L255-L495 HydrophobicContact CD1-CD2 4.08Å; L255-L495 HydrophobicContact CD1-CG 4.05Å; L255-L495 HydrophobicContact CD2-CD1 4.26Å; L255-L495 HydrophobicContact CD2-CG 4Å |
| 256 | L | 81.8 | Confident | 82.7 | Confident | 14 Ų | 14 | 71.8 Ų | 71.8 | 7% | 0.073 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -65.9 | -28.3 | 178.3 | -159.6 | 64.9 | 0 | 0 | 0 | 112.2 | K252 M253 L254 V258 V259 F260 L384 I387 L388 L391 | K252-L256 PolarHBondContact O-N 2.81Å; M253-L256 WeakPolarHBondContact O-CB 3.48Å; M253-L256 PolarHBondContact O-N 2.76Å; M253-L256 VanDerWaalsContact O-N 3.14Å; L254-L256 VanDerWaalsContact C-N 3.31Å; L254-L256 PolarHBondContact O-N 2.82Å; L256-V258 VanDerWaalsContact C-N 3.28Å; L256-V258 PolarHBondContact O-N 3.46Å; L256-V259 WeakPolarHBondContact O-CB 3.29Å; L256-V259 PolarHBondContact O-N 3.39Å; L256-V259 VanDerWaalsContact O-N 3.13Å; L256-F260 HydrophobicContact CB-CD2 4.46Å; L256-F260 HydrophobicContact CB-CE2 4.42Å; L256-F260 HydrophobicContact CD2-CD2 4.32Å; L256-F260 HydrophobicContact CD2-CE2 3.51Å; L256-F260 HydrophobicContact CD2-CZ 4.25Å; L256-F260 HydrophobicContact CG-CD2 3.84Å; L256-F260 HydrophobicContact CG-CE2 3.49Å; L256-F260 VanDerWaalsContact CG-CE2 3.49Å; L256-F260 HydrophobicContact CG-CZ 4.42Å; L256-F260 VanDerWaalsContact O-CD2 3.23Å; L256-F260 WeakPolarHBondContact O-CD2 3.45Å; L256-F260 PolarHBondContact O-N 3.27Å; L256-L384 HydrophobicContact CD1-CD1 3.5Å; L256-L384 VanDerWaalsContact CD1-CD1 3.5Å; L256-L384 HydrophobicContact CG-CD1 4.02Å; L256-I387 HydrophobicContact CD1-CG2 3.85Å; L256-L388 HydrophobicContact CD2-CB 4.3Å; L256-L388 HydrophobicContact CD2-CD1 3.81Å; L256-L391 HydrophobicContact CD2-CD2 4.39Å |
| 257 | C | 84.6 | Confident | 83.3 | Confident | 50 Ų | 50 | 67.9 Ų | 67.9 | 34% | 0.338 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.3 | -36.3 | 175.3 | -64.8 | 0 | 0 | 0 | 0 | 112.4 | M253 L254 L255 V259 F260 F261 | M253-C257 PolarHBondContact O-N 2.85Å; M253-C257 PolarHBondContact O-SG 3.29Å; L254-C257 VanDerWaalsContact O-CB 3.31Å; L254-C257 WeakPolarHBondContact O-CB 3.48Å; L254-C257 PolarHBondContact O-N 2.71Å; L255-C257 PolarHBondContact O-N 3.06Å; C257-V259 VanDerWaalsContact C-N 3.3Å; C257-V259 PolarHBondContact O-N 3.42Å; C257-F260 PolarHBondContact O-N 3.39Å; C257-F261 WeakPolarHBondContact O-CB 3.36Å; C257-F261 PolarHBondContact O-N 2.9Å |
| 258 | V | 84.9 | Confident | 84 | Confident | 102 Ų | 102 | 66.7 Ų | 66.7 | 62% | 0.618 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -63.5 | -39.7 | 176.1 | -178.8 | 0 | 0 | 0 | 0 | 110.9 | L255 L256 F261 Y262 | L255-V258 PolarHBondContact O-N 3.05Å; L256-V258 VanDerWaalsContact C-N 3.28Å; L256-V258 PolarHBondContact O-N 3.46Å; V258-F261 PolarHBondContact O-N 3.45Å; V258-Y262 PolarHBondContact O-N 2.95Å |
| 259 | V | 84.1 | Confident | 84.8 | Confident | 48 Ų | 48 | 65 Ų | 65 | 29% | 0.291 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -68.5 | -44.4 | 176.3 | 173.8 | 0 | 0 | 0 | 0 | 111.4 | L256 C257 F261 Y262 S263 W380 L384 | L256-V259 WeakPolarHBondContact O-CB 3.29Å; L256-V259 PolarHBondContact O-N 3.39Å; L256-V259 VanDerWaalsContact O-N 3.13Å; C257-V259 VanDerWaalsContact C-N 3.3Å; C257-V259 PolarHBondContact O-N 3.42Å; V259-F261 VanDerWaalsContact C-N 3.28Å; V259-F261 PolarHBondContact O-N 2.8Å; V259-Y262 PolarHBondContact O-N 2.92Å; V259-S263 PolarHBondContact O-N 2.84Å; V259-W380 HydrophobicContact CG1-CE3 4.05Å; V259-W380 HydrophobicContact CG1-CZ3 3.79Å; V259-L384 HydrophobicContact CB-CD1 4.38Å; V259-L384 HydrophobicContact CG1-CD1 3.64Å; V259-L384 HydrophobicContact CG1-CD2 4.09Å; V259-L384 HydrophobicContact CG1-CG 4.44Å |
| 260 | F | 86.4 | Confident | 85.4 | Confident | 83 Ų | 83 | 57.8 Ų | 57.8 | 36% | 0.364 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.7 | -36 | 175 | -81.8 | -64.2 | 0 | 0 | 0 | 112.5 | L256 C257 S263 G264 L384 L388 | L256-F260 HydrophobicContact CB-CD2 4.46Å; L256-F260 HydrophobicContact CB-CE2 4.42Å; L256-F260 HydrophobicContact CD2-CD2 4.32Å; L256-F260 HydrophobicContact CD2-CE2 3.51Å; L256-F260 HydrophobicContact CD2-CZ 4.25Å; L256-F260 HydrophobicContact CG-CD2 3.84Å; L256-F260 HydrophobicContact CG-CE2 3.49Å; L256-F260 VanDerWaalsContact CG-CE2 3.49Å; L256-F260 HydrophobicContact CG-CZ 4.42Å; L256-F260 VanDerWaalsContact O-CD2 3.23Å; L256-F260 WeakPolarHBondContact O-CD2 3.45Å; L256-F260 PolarHBondContact O-N 3.27Å; C257-F260 PolarHBondContact O-N 3.39Å; F260-S263 PolarHBondContact O-N 3.29Å; F260-G264 PolarHBondContact O-N 3Å; F260-L384 HydrophobicContact CD1-CD1 4.37Å; F260-L384 HydrophobicContact CD1-CD2 3.27Å; F260-L384 HydrophobicContact CD1-CG 3.92Å; F260-L384 HydrophobicContact CD2-CD1 4.43Å; F260-L384 HydrophobicContact CE1-CD1 3.98Å; F260-L384 HydrophobicContact CE1-CD2 3.26Å; F260-L384 HydrophobicContact CE1-CG 3.39Å; F260-L384 HydrophobicContact CE2-CD1 4.09Å; F260-L384 HydrophobicContact CE2-CG 4.38Å; F260-L384 HydrophobicContact CG-CD2 3.98Å; F260-L384 HydrophobicContact CZ-CD1 3.81Å; F260-L384 HydrophobicContact CZ-CD2 3.99Å; F260-L384 HydrophobicContact CZ-CG 3.64Å; F260-L388 HydrophobicContact CZ-CD2 4.3Å |
| 261 | F | 88.6 | Confident | 85.8 | Confident | 145 Ų | 145 | 54.4 Ų | 54.4 | 64% | 0.636 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -61.5 | -47.5 | 176.6 | -175.9 | -102 | 0 | 0 | 0 | 111.4 | C257 V258 V259 G264 M265 | C257-F261 WeakPolarHBondContact O-CB 3.36Å; C257-F261 PolarHBondContact O-N 2.9Å; V258-F261 PolarHBondContact O-N 3.45Å; V259-F261 VanDerWaalsContact C-N 3.28Å; V259-F261 PolarHBondContact O-N 2.8Å; F261-G264 PolarHBondContact O-N 3.25Å; F261-M265 HydrophobicContact CD1-SD 3.95Å; F261-M265 HydrophobicContact CE1-CG 4.21Å; F261-M265 HydrophobicContact CE1-SD 3.37Å; F261-M265 WeakPolarHBondContact CE1-SD 3.22Å; F261-M265 HydrophobicContact CZ-CG 4.37Å; F261-M265 HydrophobicContact CZ-SD 3.89Å; F261-M265 WeakPolarHBondContact O-CG 3.49Å; F261-M265 PolarHBondContact O-N 3.22Å |
| 262 | Y | 90.4 | Very high | 86.1 | Confident | 61 Ų | 61 | 52.1 Ų | 52.1 | 24% | 0.239 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.9 | -45.2 | 173.7 | 171.6 | -96.5 | 0 | 0 | 0 | 112.2 | V258 V259 G264 M265 L266 N333 W380 | V258-Y262 PolarHBondContact O-N 2.95Å; V259-Y262 PolarHBondContact O-N 2.92Å; Y262-G264 VanDerWaalsContact C-N 3.3Å; Y262-G264 PolarHBondContact O-N 3.15Å; Y262-M265 WeakPolarHBondContact O-CB 3.31Å; Y262-M265 PolarHBondContact O-N 3.2Å; Y262-L266 HydrophobicContact CE1-CD2 4.29Å; Y262-L266 WeakPolarHBondContact O-CB 3.33Å; Y262-L266 PolarHBondContact O-N 3.43Å; Y262-N333 WeakPolarHBondContact OH-CB 3.35Å; Y262-N333 PolarHBondContact OH-ND2 2.69Å; Y262-N333 VanDerWaalsContact OH-ND2 3.16Å; Y262-W380 AromaticContact CD1-CD2 3.98Å; Y262-W380 HydrophobicContact CD1-CD2 3.98Å; Y262-W380 AromaticContact CD1-CE2 3.85Å; Y262-W380 AromaticContact CD1-CE3 3.97Å; Y262-W380 HydrophobicContact CD1-CE3 3.97Å; Y262-W380 AromaticContact CD1-CH2 3.7Å; Y262-W380 HydrophobicContact CD1-CH2 3.7Å; Y262-W380 AromaticContact CD1-CZ2 3.69Å; Y262-W380 HydrophobicContact CD1-CZ2 3.69Å; Y262-W380 AromaticContact CD1-CZ3 3.86Å; Y262-W380 HydrophobicContact CD1-CZ3 3.86Å; Y262-W380 AromaticContact CE1-CD2 3.75Å; Y262-W380 HydrophobicContact CE1-CD2 3.75Å; Y262-W380 AromaticContact CE1-CE2 3.29Å; Y262-W380 HydrophobicContact CE1-CE3 4.22Å; Y262-W380 HydrophobicContact CE1-CG 4.26Å; Y262-W380 AromaticContact CE1-CH2 3.87Å; Y262-W380 HydrophobicContact CE1-CH2 3.87Å; Y262-W380 AromaticContact CE1-CZ2 3.33Å; Y262-W380 HydrophobicContact CE1-CZ2 3.33Å; Y262-W380 HydrophobicContact CE1-CZ3 4.29Å; Y262-W380 AromaticContact CE1-NE1 3.61Å |
| 263 | S | 89.3 | Confident | 86.6 | Confident | 16 Ų | 16 | 50 Ų | 50 | 11% | 0.112 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.9 | -39.4 | 178.3 | 179.9 | 0 | 0 | 0 | 0 | 112.1 | V259 F260 L266 L267 | V259-S263 PolarHBondContact O-N 2.84Å; F260-S263 PolarHBondContact O-N 3.29Å; S263-L266 PolarHBondContact O-N 3.36Å; S263-L267 WeakPolarHBondContact O-CB 3.24Å; S263-L267 PolarHBondContact O-N 3.06Å |
| 264 | G | 90.6 | Very high | 87.4 | Confident | 34 Ų | 34 | 49.3 Ų | 49.3 | 35% | 0.351 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -65.4 | -42.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F260 F261 Y262 L267 T268 | F260-G264 PolarHBondContact O-N 3Å; F261-G264 PolarHBondContact O-N 3.25Å; Y262-G264 VanDerWaalsContact C-N 3.3Å; Y262-G264 PolarHBondContact O-N 3.15Å; G264-L267 PolarHBondContact O-N 3.38Å; G264-T268 WeakPolarHBondContact O-CG2 3.43Å; G264-T268 PolarHBondContact O-N 3.43Å; G264-T268 PolarHBondContact O-OG1 3.32Å |
| 265 | M | 90.6 | Very high | 87.8 | Confident | 104 Ų | 104 | 45 Ų | 45 | 51% | 0.512 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -60.6 | -45.9 | 174.1 | -72.7 | -175.3 | 70.6 | 0 | 0 | 111.5 | F261 Y262 L267 T268 F269 | F261-M265 HydrophobicContact CD1-SD 3.95Å; F261-M265 HydrophobicContact CE1-CG 4.21Å; F261-M265 HydrophobicContact CE1-SD 3.37Å; F261-M265 WeakPolarHBondContact CE1-SD 3.22Å; F261-M265 HydrophobicContact CZ-CG 4.37Å; F261-M265 HydrophobicContact CZ-SD 3.89Å; F261-M265 WeakPolarHBondContact O-CG 3.49Å; F261-M265 PolarHBondContact O-N 3.22Å; Y262-M265 WeakPolarHBondContact O-CB 3.31Å; Y262-M265 PolarHBondContact O-N 3.2Å; M265-L267 PolarHBondContact O-N 3.39Å; M265-T268 PolarHBondContact O-N 3.32Å; M265-T268 PolarHBondContact O-OG1 3.4Å; M265-F269 WeakPolarHBondContact O-CB 3.5Å; M265-F269 PolarHBondContact O-N 2.84Å |
| 266 | L | 91.6 | Very high | 88.4 | Confident | 2 Ų | 2 | 42 Ų | 42 | 1% | 0.01 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -57.6 | -49 | 177.4 | -179.7 | 65.3 | 0 | 0 | 0 | 111.3 | Y262 S263 T268 F269 W270 N333 F337 L373 D377 | Y262-L266 HydrophobicContact CE1-CD2 4.29Å; Y262-L266 WeakPolarHBondContact O-CB 3.33Å; Y262-L266 PolarHBondContact O-N 3.43Å; S263-L266 PolarHBondContact O-N 3.36Å; L266-T268 PolarHBondContact O-N 3.01Å; L266-F269 PolarHBondContact O-N 2.9Å; L266-F269 VanDerWaalsContact O-N 3.15Å; L266-W270 PolarHBondContact O-N 2.85Å; L266-W270 VanDerWaalsContact O-N 3.09Å; L266-N333 WeakPolarHBondContact CD2-ND2 3.43Å; L266-F337 HydrophobicContact CD1-CE1 4.46Å; L266-F337 HydrophobicContact CD1-CZ 3.82Å; L266-L373 HydrophobicContact CD1-CD2 4.19Å; L266-D377 HydrophobicContact CD2-CB 3.74Å; L266-D377 HydrophobicContact CG-CB 4.23Å |
| 267 | L | 89.5 | Confident | 88.8 | Confident | 51 Ų | 51 | 41.8 Ų | 41.8 | 27% | 0.267 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -53.6 | -52 | 175.9 | 175.4 | 63.9 | 0 | 0 | 0 | 111.4 | Y64 S263 G264 M265 F269 W270 S271 | Y64-L267 HydrophobicContact CE1-CD2 4.34Å; S263-L267 WeakPolarHBondContact O-CB 3.24Å; S263-L267 PolarHBondContact O-N 3.06Å; G264-L267 PolarHBondContact O-N 3.38Å; M265-L267 PolarHBondContact O-N 3.39Å; L267-F269 VanDerWaalsContact C-N 3.28Å; L267-F269 PolarHBondContact O-N 3.33Å; L267-W270 HydrophobicContact CD1-CH2 4.49Å; L267-W270 HydrophobicContact CD1-CZ2 3.64Å; L267-S271 WeakPolarHBondContact O-CB 3.42Å; L267-S271 PolarHBondContact O-N 3Å; L267-S271 PolarHBondContact O-OG 3.28Å |
| 268 | T | 89.7 | Confident | 89.1 | Confident | 62 Ų | 62 | 39.4 Ų | 39.4 | 38% | 0.38 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -66.9 | -29.7 | -179.4 | 58.6 | 0 | 0 | 0 | 0 | 113.3 | G264 M265 L266 G272 V273 | G264-T268 WeakPolarHBondContact O-CG2 3.43Å; G264-T268 PolarHBondContact O-N 3.43Å; G264-T268 PolarHBondContact O-OG1 3.32Å; M265-T268 PolarHBondContact O-N 3.32Å; M265-T268 PolarHBondContact O-OG1 3.4Å; L266-T268 PolarHBondContact O-N 3.01Å; T268-G272 PolarHBondContact O-N 2.82Å; T268-G272 VanDerWaalsContact O-N 3.15Å; T268-V273 PolarHBondContact O-N 3.44Å |
| 269 | F | 91.7 | Very high | 89.2 | Confident | 48 Ų | 48 | 34.6 Ų | 34.6 | 21% | 0.211 | 18% | 0.182 | C | C | . | . | I | π-helix | trans | -69 | -54.8 | 179.5 | -175.4 | -96.7 | 0 | 0 | 0 | 111.2 | M265 L266 L267 V273 Y274 F337 I340 L373 | M265-F269 WeakPolarHBondContact O-CB 3.5Å; M265-F269 PolarHBondContact O-N 2.84Å; L266-F269 PolarHBondContact O-N 2.9Å; L266-F269 VanDerWaalsContact O-N 3.15Å; L267-F269 VanDerWaalsContact C-N 3.28Å; L267-F269 PolarHBondContact O-N 3.33Å; F269-V273 HydrophobicContact CD2-CB 4.05Å; F269-V273 HydrophobicContact CD2-CG1 4.11Å; F269-V273 HydrophobicContact CE2-CB 4.47Å; F269-V273 HydrophobicContact CE2-CG1 4.1Å; F269-V273 PolarHBondContact O-N 2.98Å; F269-Y274 HydrophobicContact CE1-CD2 4.44Å; F269-Y274 HydrophobicContact CE1-CG 4.41Å; F269-Y274 WeakPolarHBondContact O-CB 3.47Å; F269-Y274 PolarHBondContact O-N 2.95Å; F269-F337 HydrophobicContact CD1-CD1 4.28Å; F269-F337 AromaticContact CD1-CE1 3.61Å; F269-F337 HydrophobicContact CD1-CE1 3.61Å; F269-F337 AromaticContact CE1-CD1 3.84Å; F269-F337 HydrophobicContact CE1-CD1 3.84Å; F269-F337 AromaticContact CE1-CE1 3.65Å; F269-F337 HydrophobicContact CE1-CE1 3.65Å; F269-F337 HydrophobicContact CG-CE1 4.23Å; F269-F337 HydrophobicContact CZ-CD1 4.23Å; F269-F337 HydrophobicContact CZ-CE1 4.31Å; F269-I340 HydrophobicContact CE1-CD1 3.87Å; F269-I340 HydrophobicContact CZ-CD1 4.27Å; F269-I340 HydrophobicContact CZ-CG2 4.19Å; F269-L373 HydrophobicContact CD1-CD1 4.22Å; F269-L373 HydrophobicContact CD1-CD2 4.24Å; F269-L373 HydrophobicContact CE1-CD1 4.07Å; F269-L373 HydrophobicContact CE1-CD2 4.33Å |
| 270 | W | 89.2 | Confident | 89.4 | Confident | 10 Ų | 10 | 32.6 Ų | 32.6 | 4% | 0.038 | 17% | 0.169 | C | C | . | . | I | π-helix | trans | -72.8 | -34.5 | -178 | 72.2 | -108.6 | 0 | 0 | 0 | 112.5 | L155 L266 L267 V299 L373 D377 | L155-W270 HydrophobicContact CD1-CH2 3.92Å; L155-W270 HydrophobicContact CD1-CZ3 4.29Å; L155-W270 HydrophobicContact CD2-CH2 4.22Å; L155-W270 HydrophobicContact CD2-CZ3 4.09Å; L266-W270 PolarHBondContact O-N 2.85Å; L266-W270 VanDerWaalsContact O-N 3.09Å; L267-W270 HydrophobicContact CD1-CH2 4.49Å; L267-W270 HydrophobicContact CD1-CZ2 3.64Å; W270-V299 HydrophobicContact CD2-CG1 3.89Å; W270-V299 HydrophobicContact CE3-CB 4.43Å; W270-V299 HydrophobicContact CE3-CG1 3.45Å; W270-V299 VanDerWaalsContact CE3-CG1 3.45Å; W270-V299 HydrophobicContact CE3-CG2 4.48Å; W270-V299 HydrophobicContact CH2-CG1 4.33Å; W270-V299 HydrophobicContact CZ3-CG1 3.7Å; W270-L373 HydrophobicContact CB-CB 4.14Å; W270-L373 HydrophobicContact CB-CD1 4.15Å; W270-D377 PolarHBondContact NE1-OD1 3.04Å |
| 271 | S | 86.7 | Confident | 89.5 | Confident | 4 Ų | 4 | 28.6 Ų | 28.6 | 3% | 0.028 | 15% | 0.152 | C | C | . | . | I | π-helix | trans | -80.4 | -23.3 | -175.3 | 66 | 0 | 0 | 0 | 0 | 114.6 | V35 L267 | V35-S271 WeakPolarHBondContact CG2-O 3.19Å; L267-S271 WeakPolarHBondContact O-CB 3.42Å; L267-S271 PolarHBondContact O-N 3Å; L267-S271 PolarHBondContact O-OG 3.28Å |
| 272 | G | 84.5 | Confident | 89.3 | Confident | 3 Ų | 3 | 24.4 Ų | 24.4 | 3% | 0.031 | 14% | 0.14 | C | C | . | . | I | π-helix | trans | -125.2 | -66.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | T268 Y274 T276 | T268-G272 PolarHBondContact O-N 2.82Å; T268-G272 VanDerWaalsContact O-N 3.15Å; G272-Y274 PolarHBondContact O-N 2.98Å; G272-T276 WeakPolarHBondContact O-CG2 3.48Å; G272-T276 PolarHBondContact O-N 3.34Å |
| 273 | V | 89.9 | Confident | 89.1 | Confident | 43 Ų | 43 | 23 Ų | 23 | 26% | 0.261 | 14% | 0.136 | S | C | . | . | I | π-helix | trans | -63.3 | -48.9 | -168.6 | -177.5 | 0 | 0 | 0 | 0 | 111.8 | T268 F269 G275 T276 C277 P349 | T268-V273 PolarHBondContact O-N 3.44Å; F269-V273 HydrophobicContact CD2-CB 4.05Å; F269-V273 HydrophobicContact CD2-CG1 4.11Å; F269-V273 HydrophobicContact CE2-CB 4.47Å; F269-V273 HydrophobicContact CE2-CG1 4.1Å; F269-V273 PolarHBondContact O-N 2.98Å; V273-G275 PolarHBondContact O-N 3.37Å; V273-T276 PolarHBondContact O-N 2.92Å; V273-T276 VanDerWaalsContact O-N 3.08Å; V273-T276 PolarHBondContact O-OG1 2.92Å; V273-C277 PolarHBondContact O-N 3.12Å; V273-C277 PolarHBondContact O-SG 3.43Å; V273-C277 VanDerWaalsContact O-SG 3.35Å; V273-P349 HydrophobicContact CG1-CB 4.03Å |
| 274 | Y | 92.3 | Very high | 88.9 | Confident | 1 Ų | 1 | 22.9 Ų | 22.9 | 0% | 0.004 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -65.5 | -40.3 | -174.2 | -174 | -130 | 0 | 0 | 0 | 112.6 | F269 G272 T276 C277 I278 N295 I340 L344 A366 C369 S370 L373 | F269-Y274 HydrophobicContact CE1-CD2 4.44Å; F269-Y274 HydrophobicContact CE1-CG 4.41Å; F269-Y274 WeakPolarHBondContact O-CB 3.47Å; F269-Y274 PolarHBondContact O-N 2.95Å; G272-Y274 PolarHBondContact O-N 2.98Å; Y274-T276 VanDerWaalsContact C-N 3.3Å; Y274-T276 PolarHBondContact O-N 3.48Å; Y274-C277 PolarHBondContact O-N 3.1Å; Y274-I278 HydrophobicContact CD1-CD1 4.18Å; Y274-I278 HydrophobicContact CE1-CD1 3.69Å; Y274-I278 HydrophobicContact CE2-CD1 4.03Å; Y274-I278 HydrophobicContact CE2-CG1 4.1Å; Y274-I278 PolarHBondContact O-N 2.77Å; Y274-I278 VanDerWaalsContact O-N 3.09Å; Y274-N295 VanDerWaalsContact CD1-ND2 3.29Å; Y274-N295 WeakPolarHBondContact CD1-ND2 3.43Å; Y274-N295 WeakPolarHBondContact CE1-ND2 3.41Å; Y274-I340 HydrophobicContact CD2-CD1 3.72Å; Y274-I340 HydrophobicContact CD2-CG1 4.21Å; Y274-I340 HydrophobicContact CD2-CG2 4.47Å; Y274-I340 HydrophobicContact CE1-CD1 4.44Å; Y274-I340 HydrophobicContact CE2-CD1 3.45Å; Y274-I340 VanDerWaalsContact CE2-CD1 3.45Å; Y274-I340 HydrophobicContact CE2-CG1 3.55Å; Y274-I340 HydrophobicContact CE2-CG2 4.35Å; Y274-I340 HydrophobicContact CG-CD1 4.37Å; Y274-L344 HydrophobicContact CD2-CD1 4.06Å; Y274-L344 HydrophobicContact CE2-CD1 3.58Å; Y274-A366 WeakPolarHBondContact OH-CA 3.48Å; Y274-A366 PolarHBondContact OH-O 3.12Å; Y274-C369 WeakPolarHBondContact OH-CB 3.36Å; Y274-S370 WeakPolarHBondContact CE1-OG 3.09Å; Y274-L373 HydrophobicContact CD1-CD1 3.56Å; Y274-L373 HydrophobicContact CE1-CD1 3.87Å; Y274-L373 HydrophobicContact CG-CD1 3.98Å |
| 275 | G | 90.1 | Very high | 88.7 | Confident | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -57.4 | -43.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | V273 I278 S279 L292 | V273-G275 PolarHBondContact O-N 3.37Å; G275-I278 PolarHBondContact O-N 3Å; G275-S279 WeakPolarHBondContact O-CB 3.35Å; G275-S279 PolarHBondContact O-N 2.84Å; G275-L292 VanDerWaalsContact O-CD1 3.24Å; G275-L292 WeakPolarHBondContact O-CD1 3.24Å |
| 276 | T | 89.5 | Confident | 88.6 | Confident | 1 Ų | 1 | 24.3 Ų | 24.3 | 1% | 0.006 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -66.4 | -40.3 | 177.1 | 63.5 | 0 | 0 | 0 | 0 | 113.2 | V38 Y57 G272 V273 Y274 I278 S279 F280 | V38-T276 HydrophobicContact CB-CG2 3.57Å; V38-T276 HydrophobicContact CG1-CG2 3.64Å; V38-T276 HydrophobicContact CG2-CG2 3.96Å; Y57-T276 PolarHBondContact OH-OG1 2.88Å; G272-T276 WeakPolarHBondContact O-CG2 3.48Å; G272-T276 PolarHBondContact O-N 3.34Å; V273-T276 PolarHBondContact O-N 2.92Å; V273-T276 VanDerWaalsContact O-N 3.08Å; V273-T276 PolarHBondContact O-OG1 2.92Å; Y274-T276 VanDerWaalsContact C-N 3.3Å; Y274-T276 PolarHBondContact O-N 3.48Å; T276-I278 PolarHBondContact O-N 3.3Å; T276-S279 VanDerWaalsContact O-CB 3.31Å; T276-S279 WeakPolarHBondContact O-CB 3.48Å; T276-S279 PolarHBondContact O-N 3.02Å; T276-S279 VanDerWaalsContact O-N 3.15Å; T276-F280 WeakPolarHBondContact O-CB 3.45Å; T276-F280 PolarHBondContact O-N 3.37Å |
| 277 | C | 90.4 | Very high | 88.4 | Confident | 9 Ų | 9 | 28.1 Ų | 28.1 | 6% | 0.061 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -58.9 | -48.2 | 176.4 | -66.8 | 0 | 0 | 0 | 0 | 111.9 | V273 Y274 S279 F280 T281 L344 S348 | V273-C277 PolarHBondContact O-N 3.12Å; V273-C277 PolarHBondContact O-SG 3.43Å; V273-C277 VanDerWaalsContact O-SG 3.35Å; Y274-C277 PolarHBondContact O-N 3.1Å; C277-S279 VanDerWaalsContact C-N 3.28Å; C277-S279 PolarHBondContact O-N 3.18Å; C277-F280 PolarHBondContact O-N 3.21Å; C277-T281 WeakPolarHBondContact O-CB 3.33Å; C277-T281 PolarHBondContact O-N 3.37Å; C277-T281 PolarHBondContact O-OG1 2.92Å; C277-L344 HydrophobicContact CB-CD1 3.77Å; C277-L344 HydrophobicContact CB-CD2 4.41Å; C277-S348 WeakPolarHBondContact CB-OG 3.38Å; C277-S348 PolarHBondContact SG-OG 3.43Å |
| 278 | I | 90.7 | Very high | 88.3 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.9 | -43.4 | 175.8 | -69.9 | 175.8 | 0 | 0 | 0 | 110.5 | Y274 G275 T276 F284 L291 N295 A366 | Y274-I278 HydrophobicContact CD1-CD1 4.18Å; Y274-I278 HydrophobicContact CE1-CD1 3.69Å; Y274-I278 HydrophobicContact CE2-CD1 4.03Å; Y274-I278 HydrophobicContact CE2-CG1 4.1Å; Y274-I278 PolarHBondContact O-N 2.77Å; Y274-I278 VanDerWaalsContact O-N 3.09Å; G275-I278 PolarHBondContact O-N 3Å; T276-I278 PolarHBondContact O-N 3.3Å; I278-F284 HydrophobicContact CG2-CE2 4.44Å; I278-L291 HydrophobicContact CG2-CB 4.09Å; I278-L291 HydrophobicContact CG2-CD2 3.63Å; I278-L291 HydrophobicContact CG2-CG 3.6Å; I278-N295 HydrophobicContact CD1-CB 3.83Å; I278-N295 WeakPolarHBondContact CD1-ND2 3.47Å; I278-A366 HydrophobicContact CD1-CB 4.47Å |
| 279 | S | 87.5 | Confident | 88.2 | Confident | 2 Ų | 2 | 25 Ų | 25 | 1% | 0.014 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -61.6 | -45.5 | -179.2 | 149.3 | 0 | 0 | 0 | 0 | 112.7 | R39 G275 T276 C277 N288 | R39-S279 PolarHBondContact NE-OG 3.39Å; R39-S279 VanDerWaalsContact NH2-CB 3.33Å; R39-S279 PolarHBondContact NH2-O 2.96Å; R39-S279 PolarHBondContact NH2-OG 3.3Å; G275-S279 WeakPolarHBondContact O-CB 3.35Å; G275-S279 PolarHBondContact O-N 2.84Å; T276-S279 VanDerWaalsContact O-CB 3.31Å; T276-S279 WeakPolarHBondContact O-CB 3.48Å; T276-S279 PolarHBondContact O-N 3.02Å; T276-S279 VanDerWaalsContact O-N 3.15Å; C277-S279 VanDerWaalsContact C-N 3.28Å; C277-S279 PolarHBondContact O-N 3.18Å; S279-N288 VanDerWaalsContact O-CB 3.26Å; S279-N288 WeakPolarHBondContact O-CB 3.2Å; S279-N288 PolarHBondContact O-ND2 2.89Å |
| 280 | F | 87.6 | Confident | 88.1 | Confident | 5 Ų | 5 | 24.1 Ų | 24.1 | 2% | 0.022 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -91.5 | -3.6 | -171.4 | -72.1 | -19.8 | 0 | 0 | 0 | 114.3 | V38 R39 V42 T276 C277 S348 P352 T353 | V38-F280 HydrophobicContact CG1-CE2 4.35Å; V38-F280 HydrophobicContact CG1-CZ 4.43Å; R39-F280 HydrophobicContact CB-CE1 4.3Å; R39-F280 HydrophobicContact CG-CE1 4.42Å; V42-F280 HydrophobicContact CB-CZ 4.19Å; V42-F280 HydrophobicContact CG1-CZ 4.43Å; V42-F280 HydrophobicContact CG2-CZ 3.9Å; T276-F280 WeakPolarHBondContact O-CB 3.45Å; T276-F280 PolarHBondContact O-N 3.37Å; C277-F280 PolarHBondContact O-N 3.21Å; F280-S348 WeakPolarHBondContact CB-O 3.42Å; F280-S348 VanDerWaalsContact CD2-O 3.29Å; F280-S348 WeakPolarHBondContact CD2-O 3.42Å; F280-P352 HydrophobicContact CD1-CG 3.95Å; F280-P352 HydrophobicContact CE1-CG 4.29Å; F280-P352 HydrophobicContact CG-CG 4.39Å; F280-P352 WeakPolarHBondContact O-CA 3.45Å; F280-T353 PolarHBondContact O-N 3.42Å |
| 281 | T | 89.3 | Confident | 88.2 | Confident | 0 Ų | 0 | 23.7 Ų | 23.7 | 0% | 0 | 14% | 0.142 | C | C | . | . | B | Isolated β-bridge | trans | -87.7 | 108.4 | 174.8 | -57.4 | 0 | 0 | 0 | 0 | 110 | C277 Q283 F284 N288 L344 P361 | C277-T281 WeakPolarHBondContact O-CB 3.33Å; C277-T281 PolarHBondContact O-N 3.37Å; C277-T281 PolarHBondContact O-OG1 2.92Å; T281-Q283 VanDerWaalsContact C-N 3.25Å; T281-Q283 HydrophobicContact CG2-CB 4.25Å; T281-Q283 PolarHBondContact O-N 3.21Å; T281-F284 HydrophobicContact CG2-CD2 4.07Å; T281-F284 HydrophobicContact CG2-CE2 3.93Å; T281-F284 WeakPolarHBondContact O-CD2 3.07Å; T281-N288 VanDerWaalsContact O-CG 3.29Å; T281-N288 PolarHBondContact O-ND2 3.39Å; T281-N288 PolarHBondContact O-OD1 2.97Å; T281-L344 HydrophobicContact CG2-CD2 4.27Å; T281-L344 WeakPolarHBondContact OG1-CD2 3.44Å; T281-P361 HydrophobicContact CG2-CG 4Å |
| 282 | S | 84.5 | Confident | 88.4 | Confident | 57 Ų | 57 | 23.6 Ų | 23.6 | 40% | 0.399 | 14% | 0.141 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -12.7 | -177 | -50.1 | 0 | 0 | 0 | 0 | 114.7 | F284 T353 D354 | S282-F284 VanDerWaalsContact C-N 3.28Å; S282-F284 PolarHBondContact O-N 3.12Å; S282-T353 PolarHBondContact N-O 3.34Å; S282-D354 WeakPolarHBondContact CB-OD1 3.27Å; S282-D354 PolarHBondContact OG-OD1 2.78Å |
| 283 | Q | 84.9 | Confident | 88.8 | Confident | 32 Ų | 32 | 23.4 Ų | 23.4 | 15% | 0.15 | 14% | 0.14 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | -8.8 | -171.4 | -59.7 | -170.4 | -6.5 | 0 | 0 | 115.1 | T281 D354 D355 F356 P361 | T281-Q283 VanDerWaalsContact C-N 3.25Å; T281-Q283 HydrophobicContact CG2-CB 4.25Å; T281-Q283 PolarHBondContact O-N 3.21Å; Q283-D354 PolarHBondContact NE2-O 3.36Å; Q283-D355 PolarHBondContact NE2-O 3Å; Q283-D355 VanDerWaalsContact NE2-O 3.13Å; Q283-F356 HydrophobicContact CG-CE1 4.38Å; Q283-F356 VanDerWaalsContact NE2-CZ 3.33Å; Q283-F356 VanDerWaalsContact OE1-CE1 3.24Å; Q283-P361 HydrophobicContact CB-CG 4.01Å |
| 284 | F | 87 | Confident | 89 | Confident | 12 Ų | 12 | 25.4 Ų | 25.4 | 5% | 0.053 | 14% | 0.143 | C | C | . | . | trans | -66.3 | 148 | 175.7 | -73 | -68.5 | 0 | 0 | 0 | 111.1 | I278 T281 S282 L291 L344 P361 D363 A366 | I278-F284 HydrophobicContact CG2-CE2 4.44Å; T281-F284 HydrophobicContact CG2-CD2 4.07Å; T281-F284 HydrophobicContact CG2-CE2 3.93Å; T281-F284 WeakPolarHBondContact O-CD2 3.07Å; S282-F284 VanDerWaalsContact C-N 3.28Å; S282-F284 PolarHBondContact O-N 3.12Å; F284-L291 HydrophobicContact CB-CD2 3.76Å; F284-L291 HydrophobicContact CD1-CD2 3.57Å; F284-L291 HydrophobicContact CD2-CD2 3.59Å; F284-L291 HydrophobicContact CE1-CD2 3.97Å; F284-L291 HydrophobicContact CE2-CD2 4Å; F284-L291 HydrophobicContact CG-CD2 3.35Å; F284-L291 HydrophobicContact CZ-CD2 4.17Å; F284-L344 HydrophobicContact CE2-CD2 3.89Å; F284-L344 HydrophobicContact CZ-CD2 3.9Å; F284-P361 HydrophobicContact CD1-CB 3.7Å; F284-P361 HydrophobicContact CE1-CB 3.4Å; F284-P361 VanDerWaalsContact CE1-CB 3.4Å; F284-P361 HydrophobicContact CE2-CB 4.23Å; F284-P361 HydrophobicContact CG-CB 4.27Å; F284-P361 HydrophobicContact CZ-CB 3.69Å; F284-D363 VanDerWaalsContact CD1-OD1 3.28Å; F284-D363 WeakPolarHBondContact CD1-OD1 3.2Å; F284-A366 HydrophobicContact CE1-CB 3.9Å; F284-A366 HydrophobicContact CZ-CB 3.99Å | ||
| 285 | T | 85.4 | Confident | 89.1 | Confident | 126 Ų | 126 | 25.4 Ų | 25.4 | 77% | 0.773 | 14% | 0.143 | S | C | * | . | S | Bend | trans | -78.6 | -36.4 | -178 | 59.5 | 0 | 0 | 0 | 0 | 111.1 | D363 | T285-D363 PolarHBondContact N-OD1 3.02Å; T285-D363 PolarHBondContact OG1-OD1 2.9Å; T285-D363 PolarHBondContact OG1-OD2 3.38Å |
| 286 | T | 87.8 | Confident | 89.3 | Confident | 42 Ų | 42 | 25.5 Ų | 25.5 | 26% | 0.258 | 14% | 0.143 | S | C | . | . | S | Bend | trans | -76.1 | 139.5 | 170.6 | -62.5 | 0 | 0 | 0 | 0 | 110.5 | N288 L290 L291 D363 | T286-N288 PolarHBondContact O-N 3.46Å; T286-L290 HydrophobicContact CG2-CB 3.96Å; T286-L291 HydrophobicContact CG2-CB 4.39Å; T286-D363 WeakPolarHBondContact CB-OD2 3.34Å; T286-D363 PolarHBondContact N-OD2 3.43Å; T286-D363 PolarHBondContact OG1-OD2 3.36Å |
| 287 | P | 88 | Confident | 89.5 | Confident | 82 Ų | 82 | 25.9 Ų | 25.9 | 53% | 0.532 | 15% | 0.145 | S | C | . | . | trans | -53.6 | 128.9 | 174.6 | -24.5 | 32.2 | 0 | 0 | 0 | 112.3 | K289 L290 L291 | P287-K289 PolarHBondContact O-N 2.6Å; P287-L290 HydrophobicContact CB-CD1 4.24Å; P287-L290 WeakPolarHBondContact O-CB 3.46Å; P287-L290 PolarHBondContact O-N 3.29Å; P287-L291 PolarHBondContact O-N 2.83Å; P287-L291 VanDerWaalsContact O-N 3.14Å | ||
| 288 | N | 88.1 | Confident | 89.8 | Confident | 27 Ų | 27 | 28.4 Ų | 28.4 | 14% | 0.144 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -55.9 | -26.6 | -168.5 | -60 | -1.5 | 0 | 0 | 0 | 115 | S279 T281 T286 L292 | S279-N288 VanDerWaalsContact O-CB 3.26Å; S279-N288 WeakPolarHBondContact O-CB 3.2Å; S279-N288 PolarHBondContact O-ND2 2.89Å; T281-N288 VanDerWaalsContact O-CG 3.29Å; T281-N288 PolarHBondContact O-ND2 3.39Å; T281-N288 PolarHBondContact O-OD1 2.97Å; T286-N288 PolarHBondContact O-N 3.46Å; N288-L292 VanDerWaalsContact O-CB 3.28Å; N288-L292 WeakPolarHBondContact O-CB 3.31Å; N288-L292 PolarHBondContact O-N 3.33Å |
| 289 | K | 86.6 | Confident | 90 | Very high | 21 Ų | 21 | 28.4 Ų | 28.4 | 9% | 0.091 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -70.8 | -39.6 | 176.7 | -55.4 | -179.1 | -155.6 | 169.6 | 0 | 112.2 | F166 G171 D172 I173 P287 A293 | F166-K289 HydrophobicContact CB-CB 4.24Å; F166-K289 HydrophobicContact CD2-CB 4.08Å; F166-K289 WeakPolarHBondContact CD2-O 3.43Å; F166-K289 HydrophobicContact CG-CB 4.1Å; G171-K289 WeakPolarHBondContact O-CE 3.25Å; G171-K289 PolarHBondContact O-NZ 3.33Å; D172-K289 PolarHBondContact O-NZ 3.41Å; I173-K289 HydrophobicContact CG1-CD 3.79Å; I173-K289 HydrophobicContact CG1-CG 4.45Å; P287-K289 PolarHBondContact O-N 2.6Å; K289-A293 PolarHBondContact O-N 3.47Å; K289-A293 VanDerWaalsContact O-N 3.15Å |
| 290 | L | 90.3 | Very high | 90.2 | Very high | 30 Ų | 30 | 28.3 Ų | 28.3 | 16% | 0.157 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -71.1 | -40.8 | 177.2 | -79.9 | 68.6 | 0 | 0 | 0 | 109.3 | Y163 F166 T286 P287 L292 A293 W294 | Y163-L290 HydrophobicContact CD2-CB 4.44Å; Y163-L290 HydrophobicContact CD2-CG 4.32Å; Y163-L290 HydrophobicContact CE2-CB 4.34Å; Y163-L290 HydrophobicContact CE2-CD2 3.99Å; Y163-L290 HydrophobicContact CE2-CG 4.11Å; F166-L290 HydrophobicContact CB-CD1 4.08Å; T286-L290 HydrophobicContact CG2-CB 3.96Å; P287-L290 HydrophobicContact CB-CD1 4.24Å; P287-L290 WeakPolarHBondContact O-CB 3.46Å; P287-L290 PolarHBondContact O-N 3.29Å; L290-L292 VanDerWaalsContact C-N 3.34Å; L290-L292 PolarHBondContact O-N 2.6Å; L290-A293 WeakPolarHBondContact O-CB 3.24Å; L290-A293 PolarHBondContact O-N 3.49Å; L290-W294 PolarHBondContact O-N 3.41Å |
| 291 | L | 91.7 | Very high | 90.5 | Very high | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.005 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64 | -38.7 | 176 | -167.9 | 63.6 | 0 | 0 | 0 | 112.1 | I278 F284 T286 P287 A293 W294 N295 D363 L367 | I278-L291 HydrophobicContact CG2-CB 4.09Å; I278-L291 HydrophobicContact CG2-CD2 3.63Å; I278-L291 HydrophobicContact CG2-CG 3.6Å; F284-L291 HydrophobicContact CB-CD2 3.76Å; F284-L291 HydrophobicContact CD1-CD2 3.57Å; F284-L291 HydrophobicContact CD2-CD2 3.59Å; F284-L291 HydrophobicContact CE1-CD2 3.97Å; F284-L291 HydrophobicContact CE2-CD2 4Å; F284-L291 HydrophobicContact CG-CD2 3.35Å; F284-L291 HydrophobicContact CZ-CD2 4.17Å; T286-L291 HydrophobicContact CG2-CB 4.39Å; P287-L291 PolarHBondContact O-N 2.83Å; P287-L291 VanDerWaalsContact O-N 3.14Å; L291-A293 PolarHBondContact O-N 3.08Å; L291-W294 PolarHBondContact O-N 3.44Å; L291-N295 PolarHBondContact O-N 3Å; L291-D363 HydrophobicContact CD1-CB 4.12Å; L291-L367 HydrophobicContact CD1-CD1 4.31Å; L291-L367 HydrophobicContact CD1-CD2 4.09Å; L291-L367 HydrophobicContact CD1-CG 4.09Å |
| 292 | L | 91.1 | Very high | 90.7 | Very high | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.005 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -59.6 | -43.8 | 171.7 | -179.1 | 63.6 | 0 | 0 | 0 | 112.1 | V35 I36 G275 N288 L290 N295 I296 | V35-L292 HydrophobicContact CG1-CD1 3.46Å; V35-L292 VanDerWaalsContact CG1-CD1 3.46Å; V35-L292 HydrophobicContact CG1-CG 4.09Å; I36-L292 HydrophobicContact CG2-CD2 4.09Å; G275-L292 VanDerWaalsContact O-CD1 3.24Å; G275-L292 WeakPolarHBondContact O-CD1 3.24Å; N288-L292 VanDerWaalsContact O-CB 3.28Å; N288-L292 WeakPolarHBondContact O-CB 3.31Å; N288-L292 PolarHBondContact O-N 3.33Å; L290-L292 VanDerWaalsContact C-N 3.34Å; L290-L292 PolarHBondContact O-N 2.6Å; L292-N295 WeakPolarHBondContact O-CB 3.39Å; L292-N295 PolarHBondContact O-N 2.89Å; L292-I296 PolarHBondContact O-N 2.9Å |
| 293 | A | 92.6 | Very high | 91 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63.9 | -42.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | L162 F166 K289 L290 L291 N295 I296 V297 | L162-A293 HydrophobicContact CB-CB 4.03Å; F166-A293 HydrophobicContact CD2-CB 4.42Å; K289-A293 PolarHBondContact O-N 3.47Å; K289-A293 VanDerWaalsContact O-N 3.15Å; L290-A293 WeakPolarHBondContact O-CB 3.24Å; L290-A293 PolarHBondContact O-N 3.49Å; L291-A293 PolarHBondContact O-N 3.08Å; A293-N295 PolarHBondContact O-N 3.35Å; A293-I296 PolarHBondContact O-N 3.02Å; A293-V297 PolarHBondContact O-N 2.73Å |
| 294 | W | 94 | Very high | 91.1 | Very high | 85 Ų | 85 | 29 Ų | 29 | 32% | 0.322 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -63.3 | -38.5 | 174.1 | -75.5 | 124.7 | 0 | 0 | 0 | 113 | Y163 L290 L291 I296 V297 F298 L367 | Y163-W294 AromaticContact CD2-CE2 3.8Å; Y163-W294 HydrophobicContact CD2-CZ2 4.07Å; Y163-W294 AromaticContact CD2-NE1 3.62Å; Y163-W294 HydrophobicContact CE1-CZ2 4.45Å; Y163-W294 AromaticContact CE2-CE2 3.68Å; Y163-W294 AromaticContact CE2-CZ2 3.81Å; Y163-W294 HydrophobicContact CE2-CZ2 3.81Å; Y163-W294 AromaticContact CE2-NE1 3.32Å; Y163-W294 VanDerWaalsContact CE2-NE1 3.32Å; L290-W294 PolarHBondContact O-N 3.41Å; L291-W294 PolarHBondContact O-N 3.44Å; W294-I296 VanDerWaalsContact C-N 3.29Å; W294-I296 PolarHBondContact O-N 2.86Å; W294-V297 HydrophobicContact CE3-CB 4.21Å; W294-V297 HydrophobicContact CE3-CG1 4.37Å; W294-V297 HydrophobicContact CE3-CG2 4.28Å; W294-V297 HydrophobicContact CZ3-CG1 4.41Å; W294-V297 WeakPolarHBondContact O-CB 3.24Å; W294-V297 PolarHBondContact O-N 3.41Å; W294-V297 VanDerWaalsContact O-N 3.08Å; W294-F298 HydrophobicContact CD2-CE2 4.48Å; W294-F298 HydrophobicContact CE3-CD2 4.26Å; W294-F298 AromaticContact CE3-CE2 3.79Å; W294-F298 HydrophobicContact CE3-CE2 3.79Å; W294-F298 HydrophobicContact CZ3-CE2 4.38Å; W294-F298 VanDerWaalsContact O-CD2 3.24Å; W294-F298 WeakPolarHBondContact O-CD2 3.4Å; W294-F298 PolarHBondContact O-N 2.74Å; W294-L367 HydrophobicContact CB-CD1 4.16Å; W294-L367 HydrophobicContact CB-CD2 3.61Å |
| 295 | N | 93.7 | Very high | 91.1 | Very high | 1 Ų | 1 | 30.3 Ų | 30.3 | 1% | 0.005 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -53 | -47.9 | 175.1 | 164.9 | -99.6 | 0 | 0 | 0 | 111.5 | Y274 I278 L291 L292 A293 V297 F298 V299 S370 | Y274-N295 VanDerWaalsContact CD1-ND2 3.29Å; Y274-N295 WeakPolarHBondContact CD1-ND2 3.43Å; Y274-N295 WeakPolarHBondContact CE1-ND2 3.41Å; I278-N295 HydrophobicContact CD1-CB 3.83Å; I278-N295 WeakPolarHBondContact CD1-ND2 3.47Å; L291-N295 PolarHBondContact O-N 3Å; L292-N295 WeakPolarHBondContact O-CB 3.39Å; L292-N295 PolarHBondContact O-N 2.89Å; A293-N295 PolarHBondContact O-N 3.35Å; N295-V297 VanDerWaalsContact C-N 3.31Å; N295-V297 PolarHBondContact O-N 3.04Å; N295-F298 PolarHBondContact O-N 2.96Å; N295-V299 WeakPolarHBondContact O-CG2 3.39Å; N295-V299 PolarHBondContact O-N 2.9Å; N295-S370 PolarHBondContact ND2-OG 3.49Å |
| 296 | I | 93.8 | Very high | 91 | Very high | 2 Ų | 2 | 24.3 Ų | 24.3 | 1% | 0.01 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60 | -42.5 | 178.3 | -57 | 170.1 | 0 | 0 | 0 | 111.1 | V35 L155 L162 L292 A293 W294 G300 | V35-I296 HydrophobicContact CB-CD1 3.82Å; V35-I296 HydrophobicContact CB-CG1 4.07Å; V35-I296 HydrophobicContact CG1-CD1 3.68Å; V35-I296 HydrophobicContact CG1-CG1 3.72Å; V35-I296 HydrophobicContact CG2-CD1 4.21Å; V35-I296 HydrophobicContact CG2-CG1 4.02Å; L155-I296 HydrophobicContact CD2-CG2 4.28Å; L155-I296 WeakPolarHBondContact O-CG2 3.31Å; L162-I296 HydrophobicContact CD1-CD1 3.51Å; L292-I296 PolarHBondContact O-N 2.9Å; A293-I296 PolarHBondContact O-N 3.02Å; W294-I296 VanDerWaalsContact C-N 3.29Å; W294-I296 PolarHBondContact O-N 2.86Å; I296-G300 PolarHBondContact O-N 3.37Å |
| 297 | V | 95.4 | Very high | 90.6 | Very high | 8 Ų | 8 | 23.3 Ų | 23.3 | 5% | 0.048 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61 | -48.4 | 177.4 | 178.3 | 0 | 0 | 0 | 0 | 111.3 | P156 I160 A293 W294 N295 G300 I301 | P156-V297 HydrophobicContact CB-CG1 4.31Å; I160-V297 HydrophobicContact CG1-CG2 3.99Å; A293-V297 PolarHBondContact O-N 2.73Å; W294-V297 HydrophobicContact CE3-CB 4.21Å; W294-V297 HydrophobicContact CE3-CG1 4.37Å; W294-V297 HydrophobicContact CE3-CG2 4.28Å; W294-V297 HydrophobicContact CZ3-CG1 4.41Å; W294-V297 WeakPolarHBondContact O-CB 3.24Å; W294-V297 PolarHBondContact O-N 3.41Å; W294-V297 VanDerWaalsContact O-N 3.08Å; N295-V297 VanDerWaalsContact C-N 3.31Å; N295-V297 PolarHBondContact O-N 3.04Å; V297-G300 PolarHBondContact O-N 2.88Å; V297-I301 HydrophobicContact CG1-CD1 3.96Å; V297-I301 WeakPolarHBondContact O-CG1 3.41Å; V297-I301 PolarHBondContact O-N 3.3Å |
| 298 | F | 95.7 | Very high | 90 | Very high | 62 Ų | 62 | 26 Ų | 26 | 27% | 0.272 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -73.2 | -34.2 | -175.3 | -82 | -110.9 | 0 | 0 | 0 | 112.4 | W294 N295 G300 I301 G302 L367 V371 | W294-F298 HydrophobicContact CD2-CE2 4.48Å; W294-F298 HydrophobicContact CE3-CD2 4.26Å; W294-F298 AromaticContact CE3-CE2 3.79Å; W294-F298 HydrophobicContact CE3-CE2 3.79Å; W294-F298 HydrophobicContact CZ3-CE2 4.38Å; W294-F298 VanDerWaalsContact O-CD2 3.24Å; W294-F298 WeakPolarHBondContact O-CD2 3.4Å; W294-F298 PolarHBondContact O-N 2.74Å; N295-F298 PolarHBondContact O-N 2.96Å; F298-G300 VanDerWaalsContact C-N 3.35Å; F298-I301 PolarHBondContact O-N 2.92Å; F298-G302 PolarHBondContact O-N 2.87Å; F298-L367 HydrophobicContact CD1-CB 3.93Å; F298-L367 HydrophobicContact CD2-CD1 4.47Å; F298-L367 HydrophobicContact CD2-CD2 4.19Å; F298-L367 HydrophobicContact CE1-CB 4.18Å; F298-L367 HydrophobicContact CE2-CD1 4.16Å; F298-L367 HydrophobicContact CG-CB 4.15Å; F298-L367 HydrophobicContact CG-CD2 4.29Å; F298-L367 HydrophobicContact CZ-CD1 4.23Å; F298-V371 HydrophobicContact CB-CG2 3.91Å; F298-V371 HydrophobicContact CD1-CG2 3.6Å; F298-V371 HydrophobicContact CG-CG2 4.22Å |
| 299 | V | 94.1 | Very high | 89.5 | Confident | 1 Ų | 1 | 27.1 Ų | 27.1 | 1% | 0.006 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.1 | -47.3 | 167.8 | 175.2 | 0 | 0 | 0 | 0 | 110.3 | W270 N295 I301 G302 E303 S370 | W270-V299 HydrophobicContact CD2-CG1 3.89Å; W270-V299 HydrophobicContact CE3-CB 4.43Å; W270-V299 HydrophobicContact CE3-CG1 3.45Å; W270-V299 VanDerWaalsContact CE3-CG1 3.45Å; W270-V299 HydrophobicContact CE3-CG2 4.48Å; W270-V299 HydrophobicContact CH2-CG1 4.33Å; W270-V299 HydrophobicContact CZ3-CG1 3.7Å; N295-V299 WeakPolarHBondContact O-CG2 3.39Å; N295-V299 PolarHBondContact O-N 2.9Å; V299-I301 VanDerWaalsContact C-N 3.32Å; V299-I301 PolarHBondContact O-N 3.36Å; V299-G302 WeakPolarHBondContact O-CA 3.31Å; V299-G302 PolarHBondContact O-N 2.73Å; V299-E303 HydrophobicContact CG1-CG 4.34Å; V299-E303 PolarHBondContact O-N 3.19Å; V299-S370 WeakPolarHBondContact CA-O 3.28Å |
| 300 | G | 92.5 | Very high | 88.9 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.2 | -36.2 | 178 | 0 | 0 | 0 | 0 | 0 | 114.1 | I296 V297 F298 T304 | I296-G300 PolarHBondContact O-N 3.37Å; V297-G300 PolarHBondContact O-N 2.88Å; F298-G300 VanDerWaalsContact C-N 3.35Å; G300-T304 WeakPolarHBondContact O-CB 3.43Å; G300-T304 PolarHBondContact O-N 2.59Å; G300-T304 PolarHBondContact O-OG1 3.38Å |
| 301 | I | 93.7 | Very high | 87.9 | Confident | 81 Ų | 81 | 29 Ų | 29 | 42% | 0.415 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -64.5 | -44.1 | 171.7 | -69.8 | 167.2 | 0 | 0 | 0 | 110.5 | V297 F298 V299 S305 | V297-I301 HydrophobicContact CG1-CD1 3.96Å; V297-I301 WeakPolarHBondContact O-CG1 3.41Å; V297-I301 PolarHBondContact O-N 3.3Å; F298-I301 PolarHBondContact O-N 2.92Å; V299-I301 VanDerWaalsContact C-N 3.32Å; V299-I301 PolarHBondContact O-N 3.36Å; I301-S305 VanDerWaalsContact O-CB 3.25Å; I301-S305 WeakPolarHBondContact O-CB 3.36Å; I301-S305 PolarHBondContact O-N 3.17Å; I301-S305 PolarHBondContact O-OG 3.28Å |
| 302 | G | 93.3 | Very high | 86.8 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -57.2 | -50.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F298 V299 T304 S305 G306 V371 G374 F375 | F298-G302 PolarHBondContact O-N 2.87Å; V299-G302 WeakPolarHBondContact O-CA 3.31Å; V299-G302 PolarHBondContact O-N 2.73Å; G302-T304 PolarHBondContact O-N 3.07Å; G302-S305 PolarHBondContact O-N 3.25Å; G302-S305 PolarHBondContact O-OG 3.22Å; G302-G306 PolarHBondContact O-N 2.95Å; G302-V371 WeakPolarHBondContact CA-O 3.19Å; G302-G374 VanDerWaalsContact C-C 3.45Å; G302-F375 VanDerWaalsContact O-CA 3.3Å; G302-F375 WeakPolarHBondContact O-CA 3.24Å |
| 303 | E | 90.7 | Very high | 85.9 | Confident | 1 Ų | 1 | 37.8 Ų | 37.8 | 1% | 0.005 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -57.8 | -48.7 | 178.8 | -80.2 | -71.3 | 177.6 | 0 | 0 | 113 | Q152 L155 V299 G306 A307 G374 D377 S378 | Q152-E303 HydrophobicContact CB-CB 4.41Å; Q152-E303 HydrophobicContact CG-CB 4.31Å; Q152-E303 PolarHBondContact NE2-OE2 3.42Å; L155-E303 HydrophobicContact CD1-CB 4.49Å; L155-E303 HydrophobicContact CD1-CG 4.11Å; V299-E303 HydrophobicContact CG1-CG 4.34Å; V299-E303 PolarHBondContact O-N 3.19Å; E303-G306 PolarHBondContact O-N 3.18Å; E303-A307 PolarHBondContact O-N 3.41Å; E303-A307 VanDerWaalsContact O-N 3.08Å; E303-G374 WeakPolarHBondContact CA-O 3.31Å; E303-D377 VanDerWaalsContact OE1-CB 3.31Å; E303-D377 WeakPolarHBondContact OE1-CB 3.41Å; E303-S378 WeakPolarHBondContact O-CB 3.34Å; E303-S378 PolarHBondContact O-OG 3.24Å; E303-S378 WeakPolarHBondContact OE2-CB 3.22Å |
| 304 | T | 86.9 | Confident | 84.7 | Confident | 27 Ų | 27 | 40.5 Ų | 40.5 | 17% | 0.166 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.8 | -43.2 | -178.4 | -55.4 | 0 | 0 | 0 | 0 | 111.1 | F153 G300 G302 A307 F308 | F153-T304 HydrophobicContact CE1-CG2 4.02Å; F153-T304 HydrophobicContact CE2-CG2 3.93Å; F153-T304 HydrophobicContact CZ-CG2 3.67Å; G300-T304 WeakPolarHBondContact O-CB 3.43Å; G300-T304 PolarHBondContact O-N 2.59Å; G300-T304 PolarHBondContact O-OG1 3.38Å; G302-T304 PolarHBondContact O-N 3.07Å; T304-A307 PolarHBondContact O-N 3.11Å; T304-F308 WeakPolarHBondContact O-CB 3.5Å; T304-F308 PolarHBondContact O-N 2.91Å |
| 305 | S | 86.7 | Confident | 83.3 | Confident | 39 Ų | 39 | 44.8 Ų | 44.8 | 27% | 0.273 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67.2 | -38.9 | 177.8 | 60.2 | 0 | 0 | 0 | 0 | 112.1 | I301 G302 F308 V309 F375 | I301-S305 VanDerWaalsContact O-CB 3.25Å; I301-S305 WeakPolarHBondContact O-CB 3.36Å; I301-S305 PolarHBondContact O-N 3.17Å; I301-S305 PolarHBondContact O-OG 3.28Å; G302-S305 PolarHBondContact O-N 3.25Å; G302-S305 PolarHBondContact O-OG 3.22Å; S305-F308 PolarHBondContact O-N 3.35Å; S305-V309 WeakPolarHBondContact O-CB 3.42Å; S305-V309 VanDerWaalsContact O-CG2 3.24Å; S305-V309 WeakPolarHBondContact O-CG2 3.42Å; S305-V309 PolarHBondContact O-N 3.39Å; S305-F375 WeakPolarHBondContact OG-CD2 3.23Å |
| 306 | G | 83.4 | Confident | 82.1 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.3 | -47.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | G302 E303 F308 V309 V310 | G302-G306 PolarHBondContact O-N 2.95Å; E303-G306 PolarHBondContact O-N 3.18Å; G306-F308 VanDerWaalsContact C-N 3.32Å; G306-F308 PolarHBondContact O-N 3.32Å; G306-V309 PolarHBondContact O-N 2.84Å; G306-V310 WeakPolarHBondContact O-CB 3.38Å; G306-V310 VanDerWaalsContact O-CG2 3.31Å; G306-V310 WeakPolarHBondContact O-CG2 3.46Å; G306-V310 PolarHBondContact O-N 3.36Å |
| 307 | A | 79.5 | Confident | 80.8 | Confident | 20 Ų | 20 | 50 Ų | 50 | 17% | 0.165 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -64.3 | -40.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | E303 T304 S311 S378 | E303-A307 PolarHBondContact O-N 3.41Å; E303-A307 VanDerWaalsContact O-N 3.08Å; T304-A307 PolarHBondContact O-N 3.11Å; A307-S311 VanDerWaalsContact O-CB 3.28Å; A307-S311 WeakPolarHBondContact O-CB 3.48Å; A307-S311 PolarHBondContact O-N 3.33Å; A307-S378 WeakPolarHBondContact CA-OG 3.2Å; A307-S378 PolarHBondContact N-OG 3.19Å |
| 308 | F | 75.9 | Confident | 79.4 | Confident | 138 Ų | 138 | 56.6 Ų | 56.6 | 61% | 0.605 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -64.9 | -48 | 176.9 | -177.3 | -98.5 | 0 | 0 | 0 | 112.4 | T304 S305 G306 S311 M312 | T304-F308 WeakPolarHBondContact O-CB 3.5Å; T304-F308 PolarHBondContact O-N 2.91Å; S305-F308 PolarHBondContact O-N 3.35Å; G306-F308 VanDerWaalsContact C-N 3.32Å; G306-F308 PolarHBondContact O-N 3.32Å; F308-S311 PolarHBondContact O-N 2.89Å; F308-M312 HydrophobicContact CE1-SD 4.48Å; F308-M312 WeakPolarHBondContact O-CB 3.37Å; F308-M312 PolarHBondContact O-N 3.43Å |
| 309 | V | 78.5 | Confident | 78 | Confident | 51 Ų | 51 | 58.6 Ų | 58.6 | 31% | 0.309 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.6 | -45.5 | 179.7 | 170.3 | 0 | 0 | 0 | 0 | 110.6 | S305 G306 S311 M312 L313 F375 | S305-V309 WeakPolarHBondContact O-CB 3.42Å; S305-V309 VanDerWaalsContact O-CG2 3.24Å; S305-V309 WeakPolarHBondContact O-CG2 3.42Å; S305-V309 PolarHBondContact O-N 3.39Å; G306-V309 PolarHBondContact O-N 2.84Å; V309-S311 VanDerWaalsContact C-N 3.31Å; V309-S311 PolarHBondContact O-N 3.3Å; V309-M312 PolarHBondContact O-N 3.28Å; V309-L313 HydrophobicContact CG1-CD1 3.61Å; V309-L313 HydrophobicContact CG1-CG 4.13Å; V309-L313 WeakPolarHBondContact O-CB 3.48Å; V309-L313 VanDerWaalsContact O-CG 3.28Å; V309-L313 WeakPolarHBondContact O-CG 3.34Å; V309-L313 PolarHBondContact O-N 3.39Å; V309-F375 HydrophobicContact CB-CE2 4.35Å; V309-F375 HydrophobicContact CB-CZ 4.22Å; V309-F375 HydrophobicContact CG1-CZ 4.23Å; V309-F375 HydrophobicContact CG2-CE2 4.14Å; V309-F375 HydrophobicContact CG2-CZ 4.38Å |
| 310 | V | 73.3 | Confident | 76.7 | Confident | 11 Ų | 11 | 66.4 Ų | 66.4 | 7% | 0.067 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -63.2 | -38.4 | 176.9 | 174 | 0 | 0 | 0 | 0 | 111.5 | G306 S314 I317 V325 T382 Q383 | G306-V310 WeakPolarHBondContact O-CB 3.38Å; G306-V310 VanDerWaalsContact O-CG2 3.31Å; G306-V310 WeakPolarHBondContact O-CG2 3.46Å; G306-V310 PolarHBondContact O-N 3.36Å; V310-S314 PolarHBondContact O-N 3.36Å; V310-S314 VanDerWaalsContact O-N 3.17Å; V310-I317 HydrophobicContact CB-CD1 4.45Å; V310-I317 HydrophobicContact CG1-CD1 3.99Å; V310-I317 WeakPolarHBondContact O-CD1 3.43Å; V310-V325 HydrophobicContact CG2-CG1 3.84Å; V310-T382 HydrophobicContact CB-CG2 4.48Å; V310-T382 HydrophobicContact CG1-CG2 3.55Å; V310-Q383 VanDerWaalsContact CG1-NE2 3.34Å |
| 311 | S | 70.1 | Confident | 75.7 | Confident | 80 Ų | 80 | 67.8 Ų | 67.8 | 56% | 0.559 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -67.1 | -43.2 | 175.6 | -174.1 | 0 | 0 | 0 | 0 | 112.3 | A307 F308 V309 S314 | A307-S311 VanDerWaalsContact O-CB 3.28Å; A307-S311 WeakPolarHBondContact O-CB 3.48Å; A307-S311 PolarHBondContact O-N 3.33Å; F308-S311 PolarHBondContact O-N 2.89Å; V309-S311 VanDerWaalsContact C-N 3.31Å; V309-S311 PolarHBondContact O-N 3.3Å; S311-S314 VanDerWaalsContact O-CB 3.29Å; S311-S314 WeakPolarHBondContact O-CB 3.45Å; S311-S314 PolarHBondContact O-N 2.87Å; S311-S314 PolarHBondContact O-OG 3.04Å |
| 312 | M | 68 | Low | 74.7 | Confident | 128 Ų | 128 | 67.5 Ų | 67.5 | 63% | 0.631 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -69.1 | -44.7 | -178.4 | -171.4 | -162.3 | 139.7 | 0 | 0 | 111.6 | F308 V309 S314 | F308-M312 HydrophobicContact CE1-SD 4.48Å; F308-M312 WeakPolarHBondContact O-CB 3.37Å; F308-M312 PolarHBondContact O-N 3.43Å; V309-M312 PolarHBondContact O-N 3.28Å; M312-S314 PolarHBondContact O-N 3.47Å |
| 313 | L | 71.1 | Confident | 73.8 | Confident | 59 Ų | 59 | 68.8 Ų | 68.8 | 31% | 0.309 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.3 | 6.1 | 179.9 | -52.5 | -179.3 | 0 | 0 | 0 | 112.2 | V309 K315 Q316 I317 | V309-L313 HydrophobicContact CG1-CD1 3.61Å; V309-L313 HydrophobicContact CG1-CG 4.13Å; V309-L313 WeakPolarHBondContact O-CB 3.48Å; V309-L313 VanDerWaalsContact O-CG 3.28Å; V309-L313 WeakPolarHBondContact O-CG 3.34Å; V309-L313 PolarHBondContact O-N 3.39Å; L313-K315 VanDerWaalsContact C-N 3.28Å; L313-K315 PolarHBondContact O-N 2.87Å; L313-K315 VanDerWaalsContact O-N 3.13Å; L313-Q316 CarbonylContact O-C 3.6Å; L313-Q316 WeakPolarHBondContact O-CA 3.49Å; L313-Q316 WeakPolarHBondContact O-CB 3.19Å; L313-Q316 PolarHBondContact O-N 2.9Å; L313-I317 HydrophobicContact CB-CD1 4.1Å; L313-I317 HydrophobicContact CB-CG1 4.19Å; L313-I317 VanDerWaalsContact O-CG1 3.26Å; L313-I317 WeakPolarHBondContact O-CG1 3.4Å; L313-I317 PolarHBondContact O-N 2.97Å |
| 314 | S | 68.4 | Low | 73.4 | Confident | 57 Ų | 57 | 70.4 Ų | 70.4 | 40% | 0.399 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -47 | -46.2 | -176.7 | 53.1 | 0 | 0 | 0 | 0 | 113.8 | V310 S311 M312 Q316 I317 E318 | V310-S314 PolarHBondContact O-N 3.36Å; V310-S314 VanDerWaalsContact O-N 3.17Å; S311-S314 VanDerWaalsContact O-CB 3.29Å; S311-S314 WeakPolarHBondContact O-CB 3.45Å; S311-S314 PolarHBondContact O-N 2.87Å; S311-S314 PolarHBondContact O-OG 3.04Å; M312-S314 PolarHBondContact O-N 3.47Å; S314-Q316 PolarHBondContact O-N 3.09Å; S314-I317 WeakPolarHBondContact O-CB 3.3Å; S314-I317 PolarHBondContact O-N 3.15Å; S314-E318 PolarHBondContact O-N 3.16Å; S314-E318 VanDerWaalsContact O-N 3.1Å |
| 315 | K | 65.2 | Low | 73.2 | Confident | 175 Ų | 175 | 69.9 Ų | 69.9 | 76% | 0.761 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63.6 | -36.8 | 175.4 | -65.5 | -176.2 | 179.7 | -179.3 | 0 | 113.4 | L313 | L313-K315 VanDerWaalsContact C-N 3.28Å; L313-K315 PolarHBondContact O-N 2.87Å; L313-K315 VanDerWaalsContact O-N 3.13Å |
| 316 | Q | 67.2 | Low | 73 | Confident | 97 Ų | 97 | 69.1 Ų | 69.1 | 45% | 0.453 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -75.6 | -34.9 | 176.7 | -71.8 | 159.9 | -44.4 | 0 | 0 | 111 | L313 S314 E318 S319 Y320 | L313-Q316 CarbonylContact O-C 3.6Å; L313-Q316 WeakPolarHBondContact O-CA 3.49Å; L313-Q316 WeakPolarHBondContact O-CB 3.19Å; L313-Q316 PolarHBondContact O-N 2.9Å; S314-Q316 PolarHBondContact O-N 3.09Å; Q316-E318 PolarHBondContact O-N 2.82Å; Q316-S319 CarbonylContact O-C 3.55Å; Q316-S319 WeakPolarHBondContact O-CA 3.37Å; Q316-S319 WeakPolarHBondContact O-CB 3.38Å; Q316-S319 PolarHBondContact O-N 3.37Å; Q316-Y320 HydrophobicContact CB-CD2 4.19Å; Q316-Y320 HydrophobicContact CB-CE2 4.24Å; Q316-Y320 WeakPolarHBondContact O-CD2 3.48Å; Q316-Y320 PolarHBondContact O-N 3.19Å |
| 317 | I | 66.8 | Low | 73.1 | Confident | 14 Ų | 14 | 71.3 Ų | 71.3 | 7% | 0.072 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -62 | -34.8 | 175.5 | -66.6 | 165.3 | 0 | 0 | 0 | 110.5 | V310 L313 S314 S319 G321 R322 V325 | V310-I317 HydrophobicContact CB-CD1 4.45Å; V310-I317 HydrophobicContact CG1-CD1 3.99Å; V310-I317 WeakPolarHBondContact O-CD1 3.43Å; L313-I317 HydrophobicContact CB-CD1 4.1Å; L313-I317 HydrophobicContact CB-CG1 4.19Å; L313-I317 VanDerWaalsContact O-CG1 3.26Å; L313-I317 WeakPolarHBondContact O-CG1 3.4Å; L313-I317 PolarHBondContact O-N 2.97Å; S314-I317 WeakPolarHBondContact O-CB 3.3Å; S314-I317 PolarHBondContact O-N 3.15Å; I317-S319 VanDerWaalsContact C-N 3.26Å; I317-S319 PolarHBondContact O-N 3.34Å; I317-G321 CarbonylContact O-C 3.49Å; I317-G321 VanDerWaalsContact O-C 3.31Å; I317-G321 VanDerWaalsContact O-CA 3.32Å; I317-G321 WeakPolarHBondContact O-CA 3.49Å; I317-G321 PolarHBondContact O-N 3.07Å; I317-R322 HydrophobicContact CG2-CG 4.39Å; I317-V325 HydrophobicContact CB-CG2 4.24Å; I317-V325 HydrophobicContact CD1-CG2 3.67Å; I317-V325 HydrophobicContact CG1-CG2 3.52Å; I317-V325 HydrophobicContact CG2-CG2 3.72Å |
| 318 | E | 65.7 | Low | 73.4 | Confident | 148 Ų | 148 | 75.4 Ų | 75.4 | 69% | 0.692 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -60.7 | -35.4 | 170.6 | -72.7 | 175.6 | 178.4 | 0 | 0 | 112.3 | S314 Q316 | S314-E318 PolarHBondContact O-N 3.16Å; S314-E318 VanDerWaalsContact O-N 3.1Å; Q316-E318 PolarHBondContact O-N 2.82Å |
| 319 | S | 68.2 | Low | 74.1 | Confident | 103 Ų | 103 | 68.9 Ų | 68.9 | 72% | 0.72 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -78.7 | -43.4 | 177.6 | -179.4 | 0 | 0 | 0 | 0 | 113.4 | Q316 I317 G321 | Q316-S319 CarbonylContact O-C 3.55Å; Q316-S319 WeakPolarHBondContact O-CA 3.37Å; Q316-S319 WeakPolarHBondContact O-CB 3.38Å; Q316-S319 PolarHBondContact O-N 3.37Å; I317-S319 VanDerWaalsContact C-N 3.26Å; I317-S319 PolarHBondContact O-N 3.34Å; S319-G321 VanDerWaalsContact C-N 3.34Å |
| 320 | Y | 65.5 | Low | 74.6 | Confident | 166 Ų | 166 | 67.5 Ų | 67.5 | 65% | 0.651 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -79.5 | -16.4 | -179.4 | -72.5 | -71.6 | 0 | 0 | 0 | 113.7 | Q316 | Q316-Y320 HydrophobicContact CB-CD2 4.19Å; Q316-Y320 HydrophobicContact CB-CE2 4.24Å; Q316-Y320 WeakPolarHBondContact O-CD2 3.48Å; Q316-Y320 PolarHBondContact O-N 3.19Å |
| 321 | G | 70.9 | Confident | 75.4 | Confident | 28 Ų | 28 | 69.5 Ų | 69.5 | 29% | 0.289 | 37% | 0.371 | S | S | . | . | trans | 87 | 140.9 | -172.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I317 S319 P323 A324 | I317-G321 CarbonylContact O-C 3.49Å; I317-G321 VanDerWaalsContact O-C 3.31Å; I317-G321 VanDerWaalsContact O-CA 3.32Å; I317-G321 WeakPolarHBondContact O-CA 3.49Å; I317-G321 PolarHBondContact O-N 3.07Å; S319-G321 VanDerWaalsContact C-N 3.34Å; G321-P323 VanDerWaalsContact C-CD 3.46Å; G321-P323 VanDerWaalsContact C-N 3.35Å; G321-A324 WeakPolarHBondContact O-CB 3.32Å; G321-A324 PolarHBondContact O-N 3.37Å | ||
| 322 | R | 72.5 | Confident | 76.6 | Confident | 75 Ų | 75 | 67.3 Ų | 67.3 | 28% | 0.283 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -55.2 | -39.2 | 179.1 | -59.7 | 177 | 176.8 | -80 | -1.8 | 114 | I317 A324 V325 N386 | I317-R322 HydrophobicContact CG2-CG 4.39Å; R322-A324 PolarHBondContact O-N 3.46Å; R322-V325 PolarHBondContact O-N 3.46Å; R322-V325 VanDerWaalsContact O-N 3.15Å; R322-N386 PolarHBondContact NH1-ND2 2.81Å |
| 323 | P | 76.2 | Confident | 77.8 | Confident | 28 Ų | 28 | 61.2 Ų | 61.2 | 18% | 0.182 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -66.9 | -21.1 | -177.7 | -29.4 | 44.2 | 0 | 0 | 0 | 113.7 | G321 V325 V326 I327 M498 F499 | G321-P323 VanDerWaalsContact C-CD 3.46Å; G321-P323 VanDerWaalsContact C-N 3.35Å; P323-V325 VanDerWaalsContact C-N 3.27Å; P323-V325 PolarHBondContact O-N 2.98Å; P323-V326 PolarHBondContact O-N 2.84Å; P323-I327 WeakPolarHBondContact O-CD1 3.38Å; P323-I327 VanDerWaalsContact O-CG1 3.24Å; P323-I327 WeakPolarHBondContact O-CG1 3.35Å; P323-I327 PolarHBondContact O-N 3.08Å; P323-M498 HydrophobicContact CB-CB 4.41Å; P323-M498 WeakPolarHBondContact CB-O 3.49Å; P323-M498 HydrophobicContact CG-CB 4.13Å; P323-M498 WeakPolarHBondContact CG-O 3.29Å; P323-F499 HydrophobicContact CB-CD1 4.17Å; P323-F499 HydrophobicContact CB-CE1 4.42Å |
| 324 | A | 81.9 | Confident | 78.9 | Confident | 34 Ų | 34 | 62.9 Ų | 62.9 | 28% | 0.281 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.3 | -38.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | G321 R322 F328 | G321-A324 WeakPolarHBondContact O-CB 3.32Å; G321-A324 PolarHBondContact O-N 3.37Å; R322-A324 PolarHBondContact O-N 3.46Å; A324-F328 WeakPolarHBondContact O-CB 3.26Å; A324-F328 PolarHBondContact O-N 2.97Å |
| 325 | V | 82.1 | Confident | 80.2 | Confident | 17 Ų | 17 | 63.6 Ų | 63.6 | 10% | 0.103 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -68.1 | -41.6 | 177.2 | -179.5 | 0 | 0 | 0 | 0 | 111.1 | V310 I317 R322 P323 F328 G329 C379 Q383 | V310-V325 HydrophobicContact CG2-CG1 3.84Å; I317-V325 HydrophobicContact CB-CG2 4.24Å; I317-V325 HydrophobicContact CD1-CG2 3.67Å; I317-V325 HydrophobicContact CG1-CG2 3.52Å; I317-V325 HydrophobicContact CG2-CG2 3.72Å; R322-V325 PolarHBondContact O-N 3.46Å; R322-V325 VanDerWaalsContact O-N 3.15Å; P323-V325 VanDerWaalsContact C-N 3.27Å; P323-V325 PolarHBondContact O-N 2.98Å; V325-F328 PolarHBondContact O-N 3.42Å; V325-G329 PolarHBondContact O-N 2.81Å; V325-C379 HydrophobicContact CG1-CB 4.15Å; V325-Q383 HydrophobicContact CB-CG 3.96Å; V325-Q383 HydrophobicContact CG1-CG 3.84Å |
| 326 | V | 83.2 | Confident | 81.6 | Confident | 22 Ų | 22 | 55.2 Ų | 55.2 | 13% | 0.133 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.4 | -45.9 | 177.4 | 179.5 | 0 | 0 | 0 | 0 | 110.6 | P323 F328 G329 A330 W380 Q383 | P323-V326 PolarHBondContact O-N 2.84Å; V326-F328 VanDerWaalsContact C-N 3.32Å; V326-F328 PolarHBondContact O-N 2.86Å; V326-G329 PolarHBondContact O-N 3.46Å; V326-A330 VanDerWaalsContact O-CB 3.3Å; V326-A330 WeakPolarHBondContact O-CB 3.49Å; V326-A330 PolarHBondContact O-N 2.82Å; V326-W380 HydrophobicContact CG1-CD2 3.93Å; V326-W380 HydrophobicContact CG1-CE3 3.71Å; V326-W380 HydrophobicContact CG1-CH2 3.79Å; V326-W380 HydrophobicContact CG1-CZ2 4Å; V326-W380 HydrophobicContact CG1-CZ3 3.61Å; V326-Q383 HydrophobicContact CG2-CB 3.5Å; V326-Q383 HydrophobicContact CG2-CG 3.85Å |
| 327 | I | 84.4 | Confident | 82.9 | Confident | 47 Ų | 47 | 53.5 Ų | 53.5 | 24% | 0.241 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -63.3 | -41 | 177.2 | -64.7 | 156.9 | 0 | 0 | 0 | 111.3 | P323 A330 S331 F499 L503 | P323-I327 WeakPolarHBondContact O-CD1 3.38Å; P323-I327 VanDerWaalsContact O-CG1 3.24Å; P323-I327 WeakPolarHBondContact O-CG1 3.35Å; P323-I327 PolarHBondContact O-N 3.08Å; I327-A330 WeakPolarHBondContact O-CB 3.29Å; I327-A330 PolarHBondContact O-N 2.84Å; I327-S331 WeakPolarHBondContact O-CB 3.5Å; I327-S331 PolarHBondContact O-N 3.45Å; I327-S331 PolarHBondContact O-OG 3.39Å; I327-F499 HydrophobicContact CD1-CD1 3.15Å; I327-F499 HydrophobicContact CD1-CE1 3.44Å; I327-F499 VanDerWaalsContact CD1-CE1 3.44Å; I327-F499 HydrophobicContact CD1-CG 4.21Å; I327-F499 HydrophobicContact CG1-CD1 3.78Å; I327-F499 HydrophobicContact CG1-CE1 3.47Å; I327-F499 VanDerWaalsContact CG1-CE1 3.47Å; I327-L503 HydrophobicContact CD1-CD2 3.21Å; I327-L503 HydrophobicContact CG1-CD2 4.28Å; I327-L503 HydrophobicContact CG2-CD2 4.39Å |
| 328 | F | 87.2 | Confident | 84.2 | Confident | 106 Ų | 106 | 58.9 Ų | 58.9 | 47% | 0.465 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61 | -50.9 | 176.8 | -179 | -112.8 | 0 | 0 | 0 | 110.6 | A324 V325 V326 A330 S331 L332 F375 | A324-F328 WeakPolarHBondContact O-CB 3.26Å; A324-F328 PolarHBondContact O-N 2.97Å; V325-F328 PolarHBondContact O-N 3.42Å; V326-F328 VanDerWaalsContact C-N 3.32Å; V326-F328 PolarHBondContact O-N 2.86Å; F328-A330 VanDerWaalsContact C-N 3.32Å; F328-A330 PolarHBondContact O-N 3.32Å; F328-S331 PolarHBondContact O-N 2.87Å; F328-S331 VanDerWaalsContact O-N 3.14Å; F328-S331 PolarHBondContact O-OG 3.42Å; F328-L332 HydrophobicContact CD1-CD1 4.18Å; F328-L332 HydrophobicContact CE1-CD1 3.69Å; F328-L332 HydrophobicContact CE2-CD1 4.44Å; F328-L332 HydrophobicContact CE2-CD2 4.46Å; F328-L332 HydrophobicContact CE2-CG 4.48Å; F328-L332 HydrophobicContact CZ-CD1 3.84Å; F328-L332 HydrophobicContact CZ-CD2 4.38Å; F328-L332 HydrophobicContact CZ-CG 4.33Å; F328-L332 WeakPolarHBondContact O-CG 3.27Å; F328-L332 PolarHBondContact O-N 3.22Å; F328-L332 VanDerWaalsContact O-N 3.1Å; F328-F375 HydrophobicContact CD1-CE1 4.14Å; F328-F375 AromaticContact CE1-CE1 3.65Å; F328-F375 HydrophobicContact CE1-CE1 3.65Å; F328-F375 HydrophobicContact CE1-CZ 4.17Å |
| 329 | G | 89.3 | Confident | 85.5 | Confident | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -57.9 | -42.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | V325 V326 S331 L332 N333 | V325-G329 PolarHBondContact O-N 2.81Å; V326-G329 PolarHBondContact O-N 3.46Å; G329-S331 PolarHBondContact O-N 3.49Å; G329-L332 PolarHBondContact O-N 3.36Å; G329-N333 PolarHBondContact O-N 3.48Å; G329-N333 VanDerWaalsContact O-N 3.07Å |
| 330 | A | 89.1 | Confident | 86.6 | Confident | 22 Ų | 22 | 49.7 Ų | 49.7 | 18% | 0.182 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.9 | -43.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V326 I327 F328 L332 N333 V334 W380 | V326-A330 VanDerWaalsContact O-CB 3.3Å; V326-A330 WeakPolarHBondContact O-CB 3.49Å; V326-A330 PolarHBondContact O-N 2.82Å; I327-A330 WeakPolarHBondContact O-CB 3.29Å; I327-A330 PolarHBondContact O-N 2.84Å; F328-A330 VanDerWaalsContact C-N 3.32Å; F328-A330 PolarHBondContact O-N 3.32Å; A330-L332 PolarHBondContact O-N 3.48Å; A330-N333 PolarHBondContact O-N 3.32Å; A330-V334 WeakPolarHBondContact O-CG2 3.47Å; A330-V334 PolarHBondContact O-N 3.07Å; A330-W380 HydrophobicContact CB-CZ2 3.49Å; A330-W380 VanDerWaalsContact CB-CZ2 3.49Å |
| 331 | S | 91.3 | Very high | 87.8 | Confident | 54 Ų | 54 | 47.4 Ų | 47.4 | 38% | 0.378 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -64.4 | -40.3 | 180 | 70.9 | 0 | 0 | 0 | 0 | 112 | I327 F328 G329 V334 V335 | I327-S331 WeakPolarHBondContact O-CB 3.5Å; I327-S331 PolarHBondContact O-N 3.45Å; I327-S331 PolarHBondContact O-OG 3.39Å; F328-S331 PolarHBondContact O-N 2.87Å; F328-S331 VanDerWaalsContact O-N 3.14Å; F328-S331 PolarHBondContact O-OG 3.42Å; G329-S331 PolarHBondContact O-N 3.49Å; S331-V334 PolarHBondContact O-N 2.88Å; S331-V335 WeakPolarHBondContact O-CG2 3.03Å; S331-V335 PolarHBondContact O-N 3.4Å |
| 332 | L | 93.5 | Very high | 88.7 | Confident | 33 Ų | 33 | 48.2 Ų | 48.2 | 17% | 0.173 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.7 | -42.2 | 174.7 | -64.1 | 176.1 | 0 | 0 | 0 | 111.6 | F328 G329 A330 V335 A336 L372 F375 | F328-L332 HydrophobicContact CD1-CD1 4.18Å; F328-L332 HydrophobicContact CE1-CD1 3.69Å; F328-L332 HydrophobicContact CE2-CD1 4.44Å; F328-L332 HydrophobicContact CE2-CD2 4.46Å; F328-L332 HydrophobicContact CE2-CG 4.48Å; F328-L332 HydrophobicContact CZ-CD1 3.84Å; F328-L332 HydrophobicContact CZ-CD2 4.38Å; F328-L332 HydrophobicContact CZ-CG 4.33Å; F328-L332 WeakPolarHBondContact O-CG 3.27Å; F328-L332 PolarHBondContact O-N 3.22Å; F328-L332 VanDerWaalsContact O-N 3.1Å; G329-L332 PolarHBondContact O-N 3.36Å; A330-L332 PolarHBondContact O-N 3.48Å; L332-V335 PolarHBondContact O-N 2.89Å; L332-A336 WeakPolarHBondContact O-CB 3.31Å; L332-A336 PolarHBondContact O-N 2.8Å; L332-L372 HydrophobicContact CB-CD2 4.43Å; L332-L372 HydrophobicContact CD2-CD2 4.06Å; L332-F375 HydrophobicContact CD1-CD1 3.39Å; L332-F375 HydrophobicContact CD1-CE1 3.76Å; L332-F375 HydrophobicContact CD1-CG 4.28Å |
| 333 | N | 94.5 | Very high | 89.4 | Confident | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64 | -41.9 | 175.2 | -74.7 | -20.5 | 0 | 0 | 0 | 112.3 | Y262 L266 G329 A330 V335 A336 F337 | Y262-N333 WeakPolarHBondContact OH-CB 3.35Å; Y262-N333 PolarHBondContact OH-ND2 2.69Å; Y262-N333 VanDerWaalsContact OH-ND2 3.16Å; L266-N333 WeakPolarHBondContact CD2-ND2 3.43Å; G329-N333 PolarHBondContact O-N 3.48Å; G329-N333 VanDerWaalsContact O-N 3.07Å; A330-N333 PolarHBondContact O-N 3.32Å; N333-V335 VanDerWaalsContact C-N 3.32Å; N333-V335 PolarHBondContact O-N 2.86Å; N333-A336 WeakPolarHBondContact O-CB 3.39Å; N333-A336 PolarHBondContact O-N 3.41Å; N333-F337 HydrophobicContact CB-CD2 4.45Å; N333-F337 HydrophobicContact CB-CE2 3.95Å; N333-F337 HydrophobicContact CB-CZ 4.36Å; N333-F337 WeakPolarHBondContact O-CD2 3.24Å; N333-F337 WeakPolarHBondContact O-CG 3.48Å; N333-F337 PolarHBondContact O-N 2.72Å |
| 334 | V | 94.3 | Very high | 90 | Very high | 94 Ų | 94 | 44.2 Ų | 44.2 | 57% | 0.57 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -61.3 | -42.6 | 176.4 | 169.6 | 0 | 0 | 0 | 0 | 111 | A330 S331 F337 F338 | A330-V334 WeakPolarHBondContact O-CG2 3.47Å; A330-V334 PolarHBondContact O-N 3.07Å; S331-V334 PolarHBondContact O-N 2.88Å; V334-F337 PolarHBondContact O-N 3.3Å; V334-F338 WeakPolarHBondContact O-CB 3.19Å; V334-F338 PolarHBondContact O-N 3.29Å |
| 335 | V | 94.7 | Very high | 90.2 | Very high | 72 Ų | 72 | 43 Ų | 43 | 44% | 0.436 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.5 | -45.6 | 174 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | S331 L332 N333 F338 L339 L372 | S331-V335 WeakPolarHBondContact O-CG2 3.03Å; S331-V335 PolarHBondContact O-N 3.4Å; L332-V335 PolarHBondContact O-N 2.89Å; N333-V335 VanDerWaalsContact C-N 3.32Å; N333-V335 PolarHBondContact O-N 2.86Å; V335-F338 PolarHBondContact O-N 3.45Å; V335-L339 HydrophobicContact CG1-CD1 4.06Å; V335-L339 HydrophobicContact CG1-CG 4.45Å; V335-L339 WeakPolarHBondContact O-CG 3.48Å; V335-L339 PolarHBondContact O-N 2.95Å; V335-L372 HydrophobicContact CG1-CD1 4.17Å |
| 336 | A | 95.3 | Very high | 90.3 | Very high | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.4 | -47.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L332 N333 F338 L339 I340 L372 L373 | L332-A336 WeakPolarHBondContact O-CB 3.31Å; L332-A336 PolarHBondContact O-N 2.8Å; N333-A336 WeakPolarHBondContact O-CB 3.39Å; N333-A336 PolarHBondContact O-N 3.41Å; A336-F338 VanDerWaalsContact C-N 3.31Å; A336-F338 PolarHBondContact O-N 3.31Å; A336-L339 PolarHBondContact O-N 3.49Å; A336-I340 WeakPolarHBondContact O-CB 3.17Å; A336-I340 WeakPolarHBondContact O-CD1 3.3Å; A336-I340 WeakPolarHBondContact O-CG1 3.4Å; A336-I340 PolarHBondContact O-N 2.88Å; A336-L372 HydrophobicContact CB-CB 3.79Å; A336-L372 HydrophobicContact CB-CD1 4.16Å; A336-L373 HydrophobicContact CB-CD2 4.02Å; A336-L373 HydrophobicContact CB-CG 4.07Å |
| 337 | F | 94.5 | Very high | 90.4 | Very high | 61 Ų | 61 | 48.7 Ų | 48.7 | 27% | 0.268 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 177.6 | -63.8 | -40.1 | 0 | 0 | 0 | 112.3 | L266 F269 N333 V334 I340 F341 L373 | L266-F337 HydrophobicContact CD1-CE1 4.46Å; L266-F337 HydrophobicContact CD1-CZ 3.82Å; F269-F337 HydrophobicContact CD1-CD1 4.28Å; F269-F337 AromaticContact CD1-CE1 3.61Å; F269-F337 HydrophobicContact CD1-CE1 3.61Å; F269-F337 AromaticContact CE1-CD1 3.84Å; F269-F337 HydrophobicContact CE1-CD1 3.84Å; F269-F337 AromaticContact CE1-CE1 3.65Å; F269-F337 HydrophobicContact CE1-CE1 3.65Å; F269-F337 HydrophobicContact CG-CE1 4.23Å; F269-F337 HydrophobicContact CZ-CD1 4.23Å; F269-F337 HydrophobicContact CZ-CE1 4.31Å; N333-F337 HydrophobicContact CB-CD2 4.45Å; N333-F337 HydrophobicContact CB-CE2 3.95Å; N333-F337 HydrophobicContact CB-CZ 4.36Å; N333-F337 WeakPolarHBondContact O-CD2 3.24Å; N333-F337 WeakPolarHBondContact O-CG 3.48Å; N333-F337 PolarHBondContact O-N 2.72Å; V334-F337 PolarHBondContact O-N 3.3Å; F337-I340 PolarHBondContact O-N 3.46Å; F337-F341 VanDerWaalsContact O-CB 3.31Å; F337-F341 WeakPolarHBondContact O-CB 3.27Å; F337-F341 PolarHBondContact O-N 2.9Å; F337-L373 HydrophobicContact CD1-CD2 4.13Å; F337-L373 HydrophobicContact CE1-CD2 3.61Å; F337-L373 HydrophobicContact CZ-CD2 4.22Å |
| 338 | F | 93.4 | Very high | 90.4 | Very high | 126 Ų | 126 | 46.5 Ų | 46.5 | 55% | 0.553 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -65.2 | -45.7 | 176.8 | -176.6 | -108.5 | 0 | 0 | 0 | 111.8 | V334 V335 A336 I340 F341 L342 | V334-F338 WeakPolarHBondContact O-CB 3.19Å; V334-F338 PolarHBondContact O-N 3.29Å; V335-F338 PolarHBondContact O-N 3.45Å; A336-F338 VanDerWaalsContact C-N 3.31Å; A336-F338 PolarHBondContact O-N 3.31Å; F338-I340 PolarHBondContact O-N 3.47Å; F338-F341 PolarHBondContact O-N 3.14Å; F338-L342 HydrophobicContact CD1-CD1 4.07Å; F338-L342 HydrophobicContact CE1-CD1 3.57Å; F338-L342 HydrophobicContact CE1-CG 4.32Å; F338-L342 HydrophobicContact CZ-CD1 3.88Å; F338-L342 HydrophobicContact CZ-CD2 4.41Å; F338-L342 HydrophobicContact CZ-CG 4.29Å; F338-L342 WeakPolarHBondContact O-CG 3.34Å; F338-L342 PolarHBondContact O-N 2.8Å |
| 339 | L | 92.6 | Very high | 90.2 | Very high | 44 Ų | 44 | 42.8 Ų | 42.8 | 23% | 0.23 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.6 | -42.3 | 175.4 | -68.8 | 175.3 | 0 | 0 | 0 | 111.9 | V335 A336 F341 L342 M343 V365 F368 C369 | V335-L339 HydrophobicContact CG1-CD1 4.06Å; V335-L339 HydrophobicContact CG1-CG 4.45Å; V335-L339 WeakPolarHBondContact O-CG 3.48Å; V335-L339 PolarHBondContact O-N 2.95Å; A336-L339 PolarHBondContact O-N 3.49Å; L339-F341 PolarHBondContact O-N 3.43Å; L339-L342 PolarHBondContact O-N 3.41Å; L339-M343 VanDerWaalsContact O-CG 3.28Å; L339-M343 WeakPolarHBondContact O-CG 3.25Å; L339-M343 PolarHBondContact O-N 2.94Å; L339-M343 VanDerWaalsContact O-N 3.07Å; L339-V365 HydrophobicContact CD1-CG1 4.34Å; L339-F368 HydrophobicContact CD1-CD1 4.41Å; L339-C369 VanDerWaalsContact CB-SG 3.51Å |
| 340 | I | 92.6 | Very high | 89.8 | Confident | 15 Ų | 15 | 47.7 Ų | 47.7 | 8% | 0.077 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.5 | -45.2 | 175.7 | -73.2 | 167.7 | 0 | 0 | 0 | 111.1 | F269 Y274 A336 F337 F338 L342 M343 L344 C369 L373 | F269-I340 HydrophobicContact CE1-CD1 3.87Å; F269-I340 HydrophobicContact CZ-CD1 4.27Å; F269-I340 HydrophobicContact CZ-CG2 4.19Å; Y274-I340 HydrophobicContact CD2-CD1 3.72Å; Y274-I340 HydrophobicContact CD2-CG1 4.21Å; Y274-I340 HydrophobicContact CD2-CG2 4.47Å; Y274-I340 HydrophobicContact CE1-CD1 4.44Å; Y274-I340 HydrophobicContact CE2-CD1 3.45Å; Y274-I340 VanDerWaalsContact CE2-CD1 3.45Å; Y274-I340 HydrophobicContact CE2-CG1 3.55Å; Y274-I340 HydrophobicContact CE2-CG2 4.35Å; Y274-I340 HydrophobicContact CG-CD1 4.37Å; A336-I340 WeakPolarHBondContact O-CB 3.17Å; A336-I340 WeakPolarHBondContact O-CD1 3.3Å; A336-I340 WeakPolarHBondContact O-CG1 3.4Å; A336-I340 PolarHBondContact O-N 2.88Å; F337-I340 PolarHBondContact O-N 3.46Å; F338-I340 PolarHBondContact O-N 3.47Å; I340-L342 VanDerWaalsContact C-N 3.31Å; I340-L342 PolarHBondContact O-N 3.36Å; I340-M343 PolarHBondContact O-N 3.01Å; I340-L344 HydrophobicContact CG2-CD1 3.95Å; I340-L344 WeakPolarHBondContact O-CB 3.48Å; I340-L344 PolarHBondContact O-N 3.49Å; I340-C369 HydrophobicContact CD1-CB 4.13Å; I340-C369 HydrophobicContact CG1-CB 3.99Å; I340-L373 HydrophobicContact CD1-CD1 3.83Å; I340-L373 HydrophobicContact CD1-CG 4.48Å |
| 341 | F | 91.3 | Very high | 89.4 | Confident | 117 Ų | 117 | 48.9 Ų | 48.9 | 51% | 0.513 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -60.6 | -39 | 176.9 | 173.8 | -98.2 | 0 | 0 | 0 | 112.5 | F337 F338 L339 S357 Y358 | F337-F341 VanDerWaalsContact O-CB 3.31Å; F337-F341 WeakPolarHBondContact O-CB 3.27Å; F337-F341 PolarHBondContact O-N 2.9Å; F338-F341 PolarHBondContact O-N 3.14Å; L339-F341 PolarHBondContact O-N 3.43Å; F341-S357 PolarHBondContact O-OG 3.06Å; F341-Y358 HydrophobicContact CE1-CD2 4.17Å; F341-Y358 AromaticContact CE1-CE2 3.69Å; F341-Y358 HydrophobicContact CE1-CE2 3.69Å; F341-Y358 AromaticContact CZ-CE2 3.67Å; F341-Y358 HydrophobicContact CZ-CE2 3.67Å |
| 342 | L | 89.4 | Confident | 89 | Confident | 46 Ų | 46 | 50.3 Ų | 50.3 | 24% | 0.241 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -69.7 | -32.6 | 177.5 | -69.2 | 178.7 | 0 | 0 | 0 | 113.1 | F338 L339 I340 S357 Y358 L359 | F338-L342 HydrophobicContact CD1-CD1 4.07Å; F338-L342 HydrophobicContact CE1-CD1 3.57Å; F338-L342 HydrophobicContact CE1-CG 4.32Å; F338-L342 HydrophobicContact CZ-CD1 3.88Å; F338-L342 HydrophobicContact CZ-CD2 4.41Å; F338-L342 HydrophobicContact CZ-CG 4.29Å; F338-L342 WeakPolarHBondContact O-CG 3.34Å; F338-L342 PolarHBondContact O-N 2.8Å; L339-L342 PolarHBondContact O-N 3.41Å; I340-L342 VanDerWaalsContact C-N 3.31Å; I340-L342 PolarHBondContact O-N 3.36Å; L342-S357 WeakPolarHBondContact O-CB 3.46Å; L342-S357 PolarHBondContact O-OG 3.29Å; L342-Y358 HydrophobicContact CD2-CD2 4.47Å; L342-Y358 PolarHBondContact O-N 3.44Å; L342-L359 PolarHBondContact O-N 3.45Å |
| 343 | M | 87 | Confident | 88.6 | Confident | 5 Ų | 5 | 49.3 Ų | 49.3 | 3% | 0.025 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -95.6 | -42 | -172 | -67.7 | 172.9 | 71.9 | 0 | 0 | 114 | L339 I340 S357 P361 S362 V365 A366 | L339-M343 VanDerWaalsContact O-CG 3.28Å; L339-M343 WeakPolarHBondContact O-CG 3.25Å; L339-M343 PolarHBondContact O-N 2.94Å; L339-M343 VanDerWaalsContact O-N 3.07Å; I340-M343 PolarHBondContact O-N 3.01Å; M343-S357 VanDerWaalsContact O-CB 3.29Å; M343-S357 WeakPolarHBondContact O-CB 3.3Å; M343-P361 WeakPolarHBondContact O-CG 3.49Å; M343-S362 WeakPolarHBondContact CE-O 3.31Å; M343-V365 HydrophobicContact CE-CB 3.61Å; M343-V365 HydrophobicContact CE-CG1 4.05Å; M343-V365 HydrophobicContact SD-CB 3.56Å; M343-V365 VanDerWaalsContact SD-CB 3.56Å; M343-V365 HydrophobicContact SD-CG1 3.26Å; M343-V365 WeakPolarHBondContact SD-CG1 3.49Å; M343-A366 HydrophobicContact CE-CB 4.35Å |
| 344 | L | 88.8 | Confident | 88 | Confident | 13 Ų | 13 | 54.7 Ų | 54.7 | 7% | 0.068 | 31% | 0.312 | C | S | . | . | S | Bend | trans | -98.8 | 134.8 | -168.4 | -72 | 167.3 | 0 | 0 | 0 | 111.1 | Y274 C277 T281 F284 I340 S357 | Y274-L344 HydrophobicContact CD2-CD1 4.06Å; Y274-L344 HydrophobicContact CE2-CD1 3.58Å; C277-L344 HydrophobicContact CB-CD1 3.77Å; C277-L344 HydrophobicContact CB-CD2 4.41Å; T281-L344 HydrophobicContact CG2-CD2 4.27Å; T281-L344 WeakPolarHBondContact OG1-CD2 3.44Å; F284-L344 HydrophobicContact CE2-CD2 3.89Å; F284-L344 HydrophobicContact CZ-CD2 3.9Å; I340-L344 HydrophobicContact CG2-CD1 3.95Å; I340-L344 WeakPolarHBondContact O-CB 3.48Å; I340-L344 PolarHBondContact O-N 3.49Å; L344-S357 PolarHBondContact O-OG 3.38Å |
| 345 | P | 86.4 | Confident | 87.4 | Confident | 8 Ų | 8 | 54.8 Ų | 54.8 | 5% | 0.052 | 31% | 0.309 | C | S | . | . | trans | -71.6 | 148.8 | 178.4 | 28.1 | -31.4 | 0 | 0 | 0 | 110.6 | A347 S348 T353 D355 | P345-A347 PolarHBondContact O-N 3Å; P345-S348 VanDerWaalsContact O-CB 3.23Å; P345-S348 WeakPolarHBondContact O-CB 3.23Å; P345-S348 PolarHBondContact O-N 3.43Å; P345-S348 PolarHBondContact O-OG 3.27Å; P345-T353 HydrophobicContact CB-CG2 4.42Å; P345-T353 HydrophobicContact CG-CG2 3.65Å; P345-D355 HydrophobicContact CB-CB 4.16Å; P345-D355 WeakPolarHBondContact CG-O 3.43Å | ||
| 346 | S | 84.5 | Confident | 86.5 | Confident | 120 Ų | 120 | 58.4 Ų | 58.4 | 84% | 0.839 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.9 | -22.1 | -175.6 | 55.9 | 0 | 0 | 0 | 0 | 114 | P349 | S346-P349 WeakPolarHBondContact O-CD 3.18Š|
| 347 | A | 83.3 | Confident | 85.8 | Confident | 39 Ų | 39 | 59.9 Ų | 59.9 | 32% | 0.322 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.1 | -13.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | P345 L350 A351 | P345-A347 PolarHBondContact O-N 3Å; A347-L350 PolarHBondContact O-N 3.24Å; A347-L350 VanDerWaalsContact O-N 3.09Å; A347-A351 PolarHBondContact O-N 2.66Å |
| 348 | S | 84.7 | Confident | 85.3 | Confident | 2 Ų | 2 | 65.4 Ų | 65.4 | 1% | 0.014 | 35% | 0.349 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.3 | -30.2 | -176.5 | 63.7 | 0 | 0 | 0 | 0 | 116.6 | C277 F280 P345 L350 | C277-S348 WeakPolarHBondContact CB-OG 3.38Å; C277-S348 PolarHBondContact SG-OG 3.43Å; F280-S348 WeakPolarHBondContact CB-O 3.42Å; F280-S348 VanDerWaalsContact CD2-O 3.29Å; F280-S348 WeakPolarHBondContact CD2-O 3.42Å; P345-S348 VanDerWaalsContact O-CB 3.23Å; P345-S348 WeakPolarHBondContact O-CB 3.23Å; P345-S348 PolarHBondContact O-N 3.43Å; P345-S348 PolarHBondContact O-OG 3.27Å; S348-L350 VanDerWaalsContact C-N 3.31Å; S348-L350 PolarHBondContact O-N 3.22Å |
| 349 | P | 83.3 | Confident | 84.8 | Confident | 28 Ų | 28 | 64.1 Ų | 64.1 | 18% | 0.182 | 35% | 0.348 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -19.4 | 177.8 | 26.9 | -32.3 | 0 | 0 | 0 | 113.7 | Y57 V273 S346 | Y57-P349 WeakPolarHBondContact CE2-O 3.5Å; Y57-P349 PolarHBondContact OH-O 2.94Å; V273-P349 HydrophobicContact CG1-CB 4.03Å; S346-P349 WeakPolarHBondContact O-CD 3.18Å |
| 350 | L | 82.1 | Confident | 84.4 | Confident | 102 Ų | 102 | 67.3 Ų | 67.3 | 53% | 0.534 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97.4 | -44 | -170.3 | -66.2 | 174.3 | 0 | 0 | 0 | 113 | A347 S348 | A347-L350 PolarHBondContact O-N 3.24Å; A347-L350 VanDerWaalsContact O-N 3.09Å; S348-L350 VanDerWaalsContact C-N 3.31Å; S348-L350 PolarHBondContact O-N 3.22Å |
| 351 | A | 80.3 | Confident | 84 | Confident | 48 Ų | 48 | 66.9 Ų | 66.9 | 40% | 0.397 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -148.5 | 156.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | A347 T353 | A347-A351 PolarHBondContact O-N 2.66Å; A351-T353 PolarHBondContact O-N 3.25Å |
| 352 | P | 82.4 | Confident | 83.9 | Confident | 83 Ų | 83 | 63.4 Ų | 63.4 | 54% | 0.539 | 35% | 0.353 | S | S | . | . | trans | -51.5 | 129.9 | 167.3 | -24.4 | 34.6 | 0 | 0 | 0 | 110.9 | F280 | F280-P352 HydrophobicContact CD1-CG 3.95Å; F280-P352 HydrophobicContact CE1-CG 4.29Å; F280-P352 HydrophobicContact CG-CG 4.39Å; F280-P352 WeakPolarHBondContact O-CA 3.45Å | ||
| 353 | T | 85.3 | Confident | 84 | Confident | 12 Ų | 12 | 61.9 Ų | 61.9 | 7% | 0.074 | 35% | 0.345 | C | S | . | . | B | Isolated β-bridge | trans | -140.3 | 141.8 | -178.8 | 177.7 | 0 | 0 | 0 | 0 | 111.1 | F280 S282 P345 A351 D355 | F280-T353 PolarHBondContact O-N 3.42Å; S282-T353 PolarHBondContact N-O 3.34Å; P345-T353 HydrophobicContact CB-CG2 4.42Å; P345-T353 HydrophobicContact CG-CG2 3.65Å; A351-T353 PolarHBondContact O-N 3.25Å; T353-D355 VanDerWaalsContact OG1-CB 3.24Å; T353-D355 WeakPolarHBondContact OG1-CB 3.46Å; T353-D355 PolarHBondContact OG1-N 3.48Å; T353-D355 PolarHBondContact OG1-OD2 2.99Å |
| 354 | D | 81.8 | Confident | 84.3 | Confident | 114 Ų | 114 | 70.8 Ų | 70.8 | 61% | 0.61 | 38% | 0.38 | S | S | * | . | trans | -100.2 | 7.1 | 172 | -58.5 | -33.4 | 0 | 0 | 0 | 111.4 | S282 Q283 | S282-D354 WeakPolarHBondContact CB-OD1 3.27Å; S282-D354 PolarHBondContact OG-OD1 2.78Å; Q283-D354 PolarHBondContact NE2-O 3.36Å | ||
| 355 | D | 82.6 | Confident | 84.5 | Confident | 96 Ų | 96 | 72.4 Ų | 72.4 | 51% | 0.513 | 39% | 0.39 | S | S | . | . | trans | -68.2 | 140.3 | -178.6 | -63.8 | -37.2 | 0 | 0 | 0 | 111.8 | Q283 P345 T353 | Q283-D355 PolarHBondContact NE2-O 3Å; Q283-D355 VanDerWaalsContact NE2-O 3.13Å; P345-D355 HydrophobicContact CB-CB 4.16Å; P345-D355 WeakPolarHBondContact CG-O 3.43Å; T353-D355 VanDerWaalsContact OG1-CB 3.24Å; T353-D355 WeakPolarHBondContact OG1-CB 3.46Å; T353-D355 PolarHBondContact OG1-N 3.48Å; T353-D355 PolarHBondContact OG1-OD2 2.99Å | ||
| 356 | F | 75.7 | Confident | 84.8 | Confident | 148 Ų | 148 | 72 Ų | 72 | 65% | 0.649 | 39% | 0.388 | S | S | * | . | trans | -82.4 | 144.2 | 172.1 | -65.5 | -88.7 | 0 | 0 | 0 | 110.7 | Q283 L360 | Q283-F356 HydrophobicContact CG-CE1 4.38Å; Q283-F356 VanDerWaalsContact NE2-CZ 3.33Å; Q283-F356 VanDerWaalsContact OE1-CE1 3.24Å; F356-L360 HydrophobicContact CD1-CD1 3.82Å; F356-L360 HydrophobicContact CE1-CD1 3.47Å; F356-L360 VanDerWaalsContact CE1-CD1 3.47Å | ||
| 357 | S | 79.7 | Confident | 85.4 | Confident | 30 Ų | 30 | 67.4 Ų | 67.4 | 21% | 0.21 | 35% | 0.353 | C | S | . | . | trans | -89.3 | -159.4 | 161.1 | -163.4 | 0 | 0 | 0 | 0 | 110.2 | F341 L342 M343 L344 | F341-S357 PolarHBondContact O-OG 3.06Å; L342-S357 WeakPolarHBondContact O-CB 3.46Å; L342-S357 PolarHBondContact O-OG 3.29Å; M343-S357 VanDerWaalsContact O-CB 3.29Å; M343-S357 WeakPolarHBondContact O-CB 3.3Å; L344-S357 PolarHBondContact O-OG 3.38Å | ||
| 358 | Y | 84 | Confident | 86 | Confident | 177 Ų | 177 | 70.8 Ų | 70.8 | 69% | 0.694 | 36% | 0.361 | S | S | * | . | S | Bend | trans | -68.6 | -32.8 | 178.4 | -62.6 | -79.8 | 0 | 0 | 0 | 113.3 | F341 L342 | F341-Y358 HydrophobicContact CE1-CD2 4.17Å; F341-Y358 AromaticContact CE1-CE2 3.69Å; F341-Y358 HydrophobicContact CE1-CE2 3.69Å; F341-Y358 AromaticContact CZ-CE2 3.67Å; F341-Y358 HydrophobicContact CZ-CE2 3.67Å; L342-Y358 HydrophobicContact CD2-CD2 4.47Å; L342-Y358 PolarHBondContact O-N 3.44Å |
| 359 | L | 83.9 | Confident | 86.5 | Confident | 100 Ų | 100 | 70.7 Ų | 70.7 | 52% | 0.524 | 36% | 0.361 | S | S | . | . | S | Bend | trans | -124.4 | 145.3 | 178.4 | -171.7 | 64.7 | 0 | 0 | 0 | 110.1 | L342 | L342-L359 PolarHBondContact O-N 3.45Š|
| 360 | L | 83.6 | Confident | 87.1 | Confident | 110 Ų | 110 | 69.4 Ų | 69.4 | 58% | 0.576 | 35% | 0.352 | S | S | * | . | trans | -61.4 | 128.4 | 175.4 | -168.2 | 68.7 | 0 | 0 | 0 | 110.2 | F356 S362 | F356-L360 HydrophobicContact CD1-CD1 3.82Å; F356-L360 HydrophobicContact CE1-CD1 3.47Å; F356-L360 VanDerWaalsContact CE1-CD1 3.47Å; L360-S362 PolarHBondContact O-N 2.77Å | ||
| 361 | P | 83.8 | Confident | 87.7 | Confident | 7 Ų | 7 | 66.1 Ų | 66.1 | 5% | 0.045 | 34% | 0.336 | C | S | . | . | trans | -58.1 | 128.5 | 177.7 | -24.6 | 34.4 | 0 | 0 | 0 | 111.5 | T281 Q283 F284 M343 | T281-P361 HydrophobicContact CG2-CG 4Å; Q283-P361 HydrophobicContact CB-CG 4.01Å; F284-P361 HydrophobicContact CD1-CB 3.7Å; F284-P361 HydrophobicContact CE1-CB 3.4Å; F284-P361 VanDerWaalsContact CE1-CB 3.4Å; F284-P361 HydrophobicContact CE2-CB 4.23Å; F284-P361 HydrophobicContact CG-CB 4.27Å; F284-P361 HydrophobicContact CZ-CB 3.69Å; M343-P361 WeakPolarHBondContact O-CG 3.49Å | ||
| 362 | S | 89.9 | Confident | 88.5 | Confident | 44 Ų | 44 | 64.6 Ų | 64.6 | 31% | 0.308 | 32% | 0.321 | S | S | . | . | trans | -117.3 | 126.2 | 176.3 | 173.5 | 0 | 0 | 0 | 0 | 109.4 | M343 L360 Y364 V365 A366 | M343-S362 WeakPolarHBondContact CE-O 3.31Å; L360-S362 PolarHBondContact O-N 2.77Å; S362-Y364 PolarHBondContact O-N 2.92Å; S362-V365 PolarHBondContact O-N 2.96Å; S362-V365 VanDerWaalsContact O-N 3.16Å; S362-A366 PolarHBondContact O-N 2.89Å | ||
| 363 | D | 92 | Very high | 89.1 | Confident | 13 Ų | 13 | 60.7 Ų | 60.7 | 7% | 0.07 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -53.1 | -43.5 | 179.7 | -58.3 | 8.4 | 0 | 0 | 0 | 111.4 | F284 T285 T286 L291 V365 A366 L367 | F284-D363 VanDerWaalsContact CD1-OD1 3.28Å; F284-D363 WeakPolarHBondContact CD1-OD1 3.2Å; T285-D363 PolarHBondContact N-OD1 3.02Å; T285-D363 PolarHBondContact OG1-OD1 2.9Å; T285-D363 PolarHBondContact OG1-OD2 3.38Å; T286-D363 WeakPolarHBondContact CB-OD2 3.34Å; T286-D363 PolarHBondContact N-OD2 3.43Å; T286-D363 PolarHBondContact OG1-OD2 3.36Å; L291-D363 HydrophobicContact CD1-CB 4.12Å; D363-V365 PolarHBondContact O-N 3.4Å; D363-A366 PolarHBondContact O-N 3.18Å; D363-L367 WeakPolarHBondContact O-CG 3.32Å; D363-L367 PolarHBondContact O-N 3.19Å |
| 364 | Y | 93.1 | Very high | 89.4 | Confident | 192 Ų | 192 | 60.1 Ų | 60.1 | 75% | 0.753 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -64.4 | -42.6 | -178.7 | -60.7 | -73 | 0 | 0 | 0 | 112.5 | S362 L367 F368 | S362-Y364 PolarHBondContact O-N 2.92Å; Y364-L367 PolarHBondContact O-N 3.45Å; Y364-F368 VanDerWaalsContact O-CB 3.29Å; Y364-F368 WeakPolarHBondContact O-CB 3.34Å; Y364-F368 PolarHBondContact O-N 2.85Å |
| 365 | V | 92.8 | Very high | 90 | Very high | 47 Ų | 47 | 56 Ų | 56 | 29% | 0.285 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -72.7 | -34.4 | -178.9 | -172.8 | 0 | 0 | 0 | 0 | 110.4 | L339 M343 S362 D363 F368 C369 | L339-V365 HydrophobicContact CD1-CG1 4.34Å; M343-V365 HydrophobicContact CE-CB 3.61Å; M343-V365 HydrophobicContact CE-CG1 4.05Å; M343-V365 HydrophobicContact SD-CB 3.56Å; M343-V365 VanDerWaalsContact SD-CB 3.56Å; M343-V365 HydrophobicContact SD-CG1 3.26Å; M343-V365 WeakPolarHBondContact SD-CG1 3.49Å; S362-V365 PolarHBondContact O-N 2.96Å; S362-V365 VanDerWaalsContact O-N 3.16Å; D363-V365 PolarHBondContact O-N 3.4Å; V365-F368 PolarHBondContact O-N 3.48Å; V365-C369 PolarHBondContact O-N 2.88Å; V365-C369 PolarHBondContact O-SG 3.22Å |
| 366 | A | 93.1 | Very high | 90.4 | Very high | 1 Ų | 1 | 51.4 Ų | 51.4 | 1% | 0.008 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.3 | -45.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y274 I278 F284 M343 S362 D363 F368 C369 S370 | Y274-A366 WeakPolarHBondContact OH-CA 3.48Å; Y274-A366 PolarHBondContact OH-O 3.12Å; I278-A366 HydrophobicContact CD1-CB 4.47Å; F284-A366 HydrophobicContact CE1-CB 3.9Å; F284-A366 HydrophobicContact CZ-CB 3.99Å; M343-A366 HydrophobicContact CE-CB 4.35Å; S362-A366 PolarHBondContact O-N 2.89Å; D363-A366 PolarHBondContact O-N 3.18Å; A366-F368 VanDerWaalsContact C-N 3.32Å; A366-F368 PolarHBondContact O-N 3.26Å; A366-C369 PolarHBondContact O-N 3.48Å; A366-S370 PolarHBondContact O-N 3.11Å; A366-S370 PolarHBondContact O-OG 2.86Å |
| 367 | L | 95.2 | Very high | 91.1 | Very high | 22 Ų | 22 | 44.7 Ų | 44.7 | 12% | 0.115 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -66.7 | -34.5 | 175.3 | -65.4 | 180 | 0 | 0 | 0 | 112.3 | L291 W294 F298 D363 Y364 S370 V371 | L291-L367 HydrophobicContact CD1-CD1 4.31Å; L291-L367 HydrophobicContact CD1-CD2 4.09Å; L291-L367 HydrophobicContact CD1-CG 4.09Å; W294-L367 HydrophobicContact CB-CD1 4.16Å; W294-L367 HydrophobicContact CB-CD2 3.61Å; F298-L367 HydrophobicContact CD1-CB 3.93Å; F298-L367 HydrophobicContact CD2-CD1 4.47Å; F298-L367 HydrophobicContact CD2-CD2 4.19Å; F298-L367 HydrophobicContact CE1-CB 4.18Å; F298-L367 HydrophobicContact CE2-CD1 4.16Å; F298-L367 HydrophobicContact CG-CB 4.15Å; F298-L367 HydrophobicContact CG-CD2 4.29Å; F298-L367 HydrophobicContact CZ-CD1 4.23Å; D363-L367 WeakPolarHBondContact O-CG 3.32Å; D363-L367 PolarHBondContact O-N 3.19Å; Y364-L367 PolarHBondContact O-N 3.45Å; L367-S370 VanDerWaalsContact O-CB 3.22Å; L367-S370 WeakPolarHBondContact O-CB 3.23Å; L367-S370 PolarHBondContact O-N 3.43Å; L367-V371 PolarHBondContact O-N 3.07Å |
| 368 | F | 95.8 | Very high | 91.5 | Very high | 111 Ų | 111 | 43.2 Ų | 43.2 | 49% | 0.487 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -63.6 | -44.5 | 172.9 | -176.6 | -114.8 | 0 | 0 | 0 | 112 | L339 Y364 V365 A366 S370 V371 L372 | L339-F368 HydrophobicContact CD1-CD1 4.41Å; Y364-F368 VanDerWaalsContact O-CB 3.29Å; Y364-F368 WeakPolarHBondContact O-CB 3.34Å; Y364-F368 PolarHBondContact O-N 2.85Å; V365-F368 PolarHBondContact O-N 3.48Å; A366-F368 VanDerWaalsContact C-N 3.32Å; A366-F368 PolarHBondContact O-N 3.26Å; F368-S370 PolarHBondContact O-N 3.43Å; F368-V371 PolarHBondContact O-N 2.98Å; F368-V371 VanDerWaalsContact O-N 3.15Å; F368-L372 HydrophobicContact CD1-CD1 4Å; F368-L372 HydrophobicContact CD1-CG 4.38Å; F368-L372 HydrophobicContact CE1-CD1 3.61Å; F368-L372 HydrophobicContact CE1-CD2 4.4Å; F368-L372 HydrophobicContact CE1-CG 4.1Å; F368-L372 HydrophobicContact CE2-CD2 4.43Å; F368-L372 HydrophobicContact CZ-CD1 4.1Å; F368-L372 HydrophobicContact CZ-CD2 4.04Å; F368-L372 HydrophobicContact CZ-CG 4.18Å; F368-L372 WeakPolarHBondContact O-CG 3.48Å; F368-L372 PolarHBondContact O-N 3.15Å |
| 369 | C | 96.1 | Very high | 91.6 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.9 | -35.9 | 173.7 | -67.8 | 0 | 0 | 0 | 0 | 112 | Y274 L339 I340 V365 A366 V371 L372 L373 | Y274-C369 WeakPolarHBondContact OH-CB 3.36Å; L339-C369 VanDerWaalsContact CB-SG 3.51Å; I340-C369 HydrophobicContact CD1-CB 4.13Å; I340-C369 HydrophobicContact CG1-CB 3.99Å; V365-C369 PolarHBondContact O-N 2.88Å; V365-C369 PolarHBondContact O-SG 3.22Å; A366-C369 PolarHBondContact O-N 3.48Å; C369-V371 PolarHBondContact O-N 2.87Å; C369-L372 PolarHBondContact O-N 3.42Å; C369-L373 WeakPolarHBondContact O-CB 3.35Å; C369-L373 VanDerWaalsContact O-CG 3.31Å; C369-L373 WeakPolarHBondContact O-CG 3.35Å; C369-L373 PolarHBondContact O-N 2.9Å |
| 370 | S | 95.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -58.5 | -45.7 | 174.7 | -51.2 | 0 | 0 | 0 | 0 | 111.8 | Y274 N295 V299 A366 L367 F368 G374 | Y274-S370 WeakPolarHBondContact CE1-OG 3.09Å; N295-S370 PolarHBondContact ND2-OG 3.49Å; V299-S370 WeakPolarHBondContact CA-O 3.28Å; A366-S370 PolarHBondContact O-N 3.11Å; A366-S370 PolarHBondContact O-OG 2.86Å; L367-S370 VanDerWaalsContact O-CB 3.22Å; L367-S370 WeakPolarHBondContact O-CB 3.23Å; L367-S370 PolarHBondContact O-N 3.43Å; F368-S370 PolarHBondContact O-N 3.43Å; S370-G374 PolarHBondContact O-N 3.36Å; S370-G374 VanDerWaalsContact O-N 3.15Å |
| 371 | V | 95.9 | Very high | 91.6 | Very high | 34 Ų | 34 | 28 Ų | 28 | 21% | 0.206 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -63.7 | -44.5 | 175.7 | 179.2 | 0 | 0 | 0 | 0 | 111.2 | F298 G302 L367 F368 C369 L373 G374 F375 | F298-V371 HydrophobicContact CB-CG2 3.91Å; F298-V371 HydrophobicContact CD1-CG2 3.6Å; F298-V371 HydrophobicContact CG-CG2 4.22Å; G302-V371 WeakPolarHBondContact CA-O 3.19Å; L367-V371 PolarHBondContact O-N 3.07Å; F368-V371 PolarHBondContact O-N 2.98Å; F368-V371 VanDerWaalsContact O-N 3.15Å; C369-V371 PolarHBondContact O-N 2.87Å; V371-L373 PolarHBondContact O-N 2.87Å; V371-G374 PolarHBondContact O-N 3.15Å; V371-F375 VanDerWaalsContact O-CB 3.27Å; V371-F375 WeakPolarHBondContact O-CB 3.48Å; V371-F375 PolarHBondContact O-N 3.35Å |
| 372 | L | 95.9 | Very high | 91.4 | Very high | 16 Ų | 16 | 29.4 Ų | 29.4 | 8% | 0.084 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -61.8 | -43.7 | -179.7 | -67.9 | -176.6 | 0 | 0 | 0 | 112.2 | L332 V335 A336 F368 C369 F375 G376 | L332-L372 HydrophobicContact CB-CD2 4.43Å; L332-L372 HydrophobicContact CD2-CD2 4.06Å; V335-L372 HydrophobicContact CG1-CD1 4.17Å; A336-L372 HydrophobicContact CB-CB 3.79Å; A336-L372 HydrophobicContact CB-CD1 4.16Å; F368-L372 HydrophobicContact CD1-CD1 4Å; F368-L372 HydrophobicContact CD1-CG 4.38Å; F368-L372 HydrophobicContact CE1-CD1 3.61Å; F368-L372 HydrophobicContact CE1-CD2 4.4Å; F368-L372 HydrophobicContact CE1-CG 4.1Å; F368-L372 HydrophobicContact CE2-CD2 4.43Å; F368-L372 HydrophobicContact CZ-CD1 4.1Å; F368-L372 HydrophobicContact CZ-CD2 4.04Å; F368-L372 HydrophobicContact CZ-CG 4.18Å; F368-L372 WeakPolarHBondContact O-CG 3.48Å; F368-L372 PolarHBondContact O-N 3.15Å; C369-L372 PolarHBondContact O-N 3.42Å; L372-F375 PolarHBondContact O-N 3.2Å; L372-G376 PolarHBondContact O-N 2.91Å |
| 373 | L | 94.9 | Very high | 90.8 | Very high | 0 Ų | 0 | 27.4 Ų | 27.4 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -61.6 | -49 | 177.3 | -72.8 | 172.7 | 0 | 0 | 0 | 111.6 | L266 F269 W270 Y274 A336 F337 I340 C369 V371 G376 D377 | L266-L373 HydrophobicContact CD1-CD2 4.19Å; F269-L373 HydrophobicContact CD1-CD1 4.22Å; F269-L373 HydrophobicContact CD1-CD2 4.24Å; F269-L373 HydrophobicContact CE1-CD1 4.07Å; F269-L373 HydrophobicContact CE1-CD2 4.33Å; W270-L373 HydrophobicContact CB-CB 4.14Å; W270-L373 HydrophobicContact CB-CD1 4.15Å; Y274-L373 HydrophobicContact CD1-CD1 3.56Å; Y274-L373 HydrophobicContact CE1-CD1 3.87Å; Y274-L373 HydrophobicContact CG-CD1 3.98Å; A336-L373 HydrophobicContact CB-CD2 4.02Å; A336-L373 HydrophobicContact CB-CG 4.07Å; F337-L373 HydrophobicContact CD1-CD2 4.13Å; F337-L373 HydrophobicContact CE1-CD2 3.61Å; F337-L373 HydrophobicContact CZ-CD2 4.22Å; I340-L373 HydrophobicContact CD1-CD1 3.83Å; I340-L373 HydrophobicContact CD1-CG 4.48Å; C369-L373 WeakPolarHBondContact O-CB 3.35Å; C369-L373 VanDerWaalsContact O-CG 3.31Å; C369-L373 WeakPolarHBondContact O-CG 3.35Å; C369-L373 PolarHBondContact O-N 2.9Å; V371-L373 PolarHBondContact O-N 2.87Å; L373-G376 PolarHBondContact O-N 2.91Å; L373-D377 WeakPolarHBondContact O-CB 3.32Å; L373-D377 PolarHBondContact O-N 3.26Å |
| 374 | G | 92.9 | Very high | 90.2 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -65.6 | -39.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113 | G302 E303 S370 V371 S378 | G302-G374 VanDerWaalsContact C-C 3.45Å; E303-G374 WeakPolarHBondContact CA-O 3.31Å; S370-G374 PolarHBondContact O-N 3.36Å; S370-G374 VanDerWaalsContact O-N 3.15Å; V371-G374 PolarHBondContact O-N 3.15Å; G374-S378 WeakPolarHBondContact O-CB 3.4Å; G374-S378 PolarHBondContact O-N 2.86Å; G374-S378 VanDerWaalsContact O-N 3.11Å |
| 375 | F | 92.5 | Very high | 89.4 | Confident | 28 Ų | 28 | 22.2 Ų | 22.2 | 12% | 0.123 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -65.7 | -43.5 | 177 | -170.6 | -75.9 | 0 | 0 | 0 | 111.5 | G302 S305 V309 F328 L332 V371 L372 C379 | G302-F375 VanDerWaalsContact O-CA 3.3Å; G302-F375 WeakPolarHBondContact O-CA 3.24Å; S305-F375 WeakPolarHBondContact OG-CD2 3.23Å; V309-F375 HydrophobicContact CB-CE2 4.35Å; V309-F375 HydrophobicContact CB-CZ 4.22Å; V309-F375 HydrophobicContact CG1-CZ 4.23Å; V309-F375 HydrophobicContact CG2-CE2 4.14Å; V309-F375 HydrophobicContact CG2-CZ 4.38Å; F328-F375 HydrophobicContact CD1-CE1 4.14Å; F328-F375 AromaticContact CE1-CE1 3.65Å; F328-F375 HydrophobicContact CE1-CE1 3.65Å; F328-F375 HydrophobicContact CE1-CZ 4.17Å; L332-F375 HydrophobicContact CD1-CD1 3.39Å; L332-F375 HydrophobicContact CD1-CE1 3.76Å; L332-F375 HydrophobicContact CD1-CG 4.28Å; V371-F375 VanDerWaalsContact O-CB 3.27Å; V371-F375 WeakPolarHBondContact O-CB 3.48Å; V371-F375 PolarHBondContact O-N 3.35Å; L372-F375 PolarHBondContact O-N 3.2Å; F375-C379 WeakPolarHBondContact CE1-SG 3.27Å; F375-C379 PolarHBondContact O-N 3.02Å; F375-C379 PolarHBondContact O-SG 3.35Å; F375-C379 VanDerWaalsContact O-SG 3.36Å |
| 376 | G | 91.8 | Very high | 88.5 | Confident | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -59.4 | -52.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | L372 L373 S378 C379 W380 | L372-G376 PolarHBondContact O-N 2.91Å; L373-G376 PolarHBondContact O-N 2.91Å; G376-S378 PolarHBondContact O-N 2.99Å; G376-C379 WeakPolarHBondContact O-CB 3.43Å; G376-C379 PolarHBondContact O-N 3.18Å; G376-C379 VanDerWaalsContact O-N 3.11Å; G376-W380 PolarHBondContact O-N 2.78Å |
| 377 | D | 91.3 | Very high | 87.7 | Confident | 6 Ų | 6 | 24.8 Ų | 24.8 | 3% | 0.032 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -53.8 | -49.6 | 178.4 | -170.8 | 97.4 | 0 | 0 | 0 | 112.5 | L266 W270 E303 L373 C379 W380 N381 | L266-D377 HydrophobicContact CD2-CB 3.74Å; L266-D377 HydrophobicContact CG-CB 4.23Å; W270-D377 PolarHBondContact NE1-OD1 3.04Å; E303-D377 VanDerWaalsContact OE1-CB 3.31Å; E303-D377 WeakPolarHBondContact OE1-CB 3.41Å; L373-D377 WeakPolarHBondContact O-CB 3.32Å; L373-D377 PolarHBondContact O-N 3.26Å; D377-C379 VanDerWaalsContact C-N 3.26Å; D377-C379 PolarHBondContact O-N 3.13Å; D377-W380 WeakPolarHBondContact O-CB 3.19Å; D377-W380 PolarHBondContact O-N 2.81Å; D377-N381 WeakPolarHBondContact O-CB 3.46Å; D377-N381 PolarHBondContact O-N 3.46Å |
| 378 | S | 88.1 | Confident | 86.8 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -55.5 | -40.1 | 177.4 | -167.5 | 0 | 0 | 0 | 0 | 113.4 | E303 A307 G374 G376 T382 | E303-S378 WeakPolarHBondContact O-CB 3.34Å; E303-S378 PolarHBondContact O-OG 3.24Å; E303-S378 WeakPolarHBondContact OE2-CB 3.22Å; A307-S378 WeakPolarHBondContact CA-OG 3.2Å; A307-S378 PolarHBondContact N-OG 3.19Å; G374-S378 WeakPolarHBondContact O-CB 3.4Å; G374-S378 PolarHBondContact O-N 2.86Å; G374-S378 VanDerWaalsContact O-N 3.11Å; G376-S378 PolarHBondContact O-N 2.99Å; S378-T382 WeakPolarHBondContact O-CB 3.13Å; S378-T382 PolarHBondContact O-N 3.35Å; S378-T382 VanDerWaalsContact O-N 3.11Å; S378-T382 PolarHBondContact O-OG1 3.1Å |
| 379 | C | 85.7 | Confident | 85.6 | Confident | 2 Ų | 2 | 29 Ų | 29 | 1% | 0.014 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -65.3 | -44.1 | 175.3 | -75.3 | 0 | 0 | 0 | 0 | 111.9 | V325 F375 G376 D377 Q383 | V325-C379 HydrophobicContact CG1-CB 4.15Å; F375-C379 WeakPolarHBondContact CE1-SG 3.27Å; F375-C379 PolarHBondContact O-N 3.02Å; F375-C379 PolarHBondContact O-SG 3.35Å; F375-C379 VanDerWaalsContact O-SG 3.36Å; G376-C379 WeakPolarHBondContact O-CB 3.43Å; G376-C379 PolarHBondContact O-N 3.18Å; G376-C379 VanDerWaalsContact O-N 3.11Å; D377-C379 VanDerWaalsContact C-N 3.26Å; D377-C379 PolarHBondContact O-N 3.13Å; C379-Q383 VanDerWaalsContact O-CG 3.31Å; C379-Q383 WeakPolarHBondContact O-CG 3.47Å; C379-Q383 PolarHBondContact O-N 3.02Å |
| 380 | W | 85.5 | Confident | 84.5 | Confident | 31 Ų | 31 | 31.4 Ų | 31.4 | 12% | 0.117 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.1 | -51.4 | 176.6 | -79.9 | 91.2 | 0 | 0 | 0 | 111.4 | V259 Y262 V326 A330 G376 D377 T382 Q383 L384 | V259-W380 HydrophobicContact CG1-CE3 4.05Å; V259-W380 HydrophobicContact CG1-CZ3 3.79Å; Y262-W380 AromaticContact CD1-CD2 3.98Å; Y262-W380 HydrophobicContact CD1-CD2 3.98Å; Y262-W380 AromaticContact CD1-CE2 3.85Å; Y262-W380 AromaticContact CD1-CE3 3.97Å; Y262-W380 HydrophobicContact CD1-CE3 3.97Å; Y262-W380 AromaticContact CD1-CH2 3.7Å; Y262-W380 HydrophobicContact CD1-CH2 3.7Å; Y262-W380 AromaticContact CD1-CZ2 3.69Å; Y262-W380 HydrophobicContact CD1-CZ2 3.69Å; Y262-W380 AromaticContact CD1-CZ3 3.86Å; Y262-W380 HydrophobicContact CD1-CZ3 3.86Å; Y262-W380 AromaticContact CE1-CD2 3.75Å; Y262-W380 HydrophobicContact CE1-CD2 3.75Å; Y262-W380 AromaticContact CE1-CE2 3.29Å; Y262-W380 HydrophobicContact CE1-CE3 4.22Å; Y262-W380 HydrophobicContact CE1-CG 4.26Å; Y262-W380 AromaticContact CE1-CH2 3.87Å; Y262-W380 HydrophobicContact CE1-CH2 3.87Å; Y262-W380 AromaticContact CE1-CZ2 3.33Å; Y262-W380 HydrophobicContact CE1-CZ2 3.33Å; Y262-W380 HydrophobicContact CE1-CZ3 4.29Å; Y262-W380 AromaticContact CE1-NE1 3.61Å; V326-W380 HydrophobicContact CG1-CD2 3.93Å; V326-W380 HydrophobicContact CG1-CE3 3.71Å; V326-W380 HydrophobicContact CG1-CH2 3.79Å; V326-W380 HydrophobicContact CG1-CZ2 4Å; V326-W380 HydrophobicContact CG1-CZ3 3.61Å; A330-W380 HydrophobicContact CB-CZ2 3.49Å; A330-W380 VanDerWaalsContact CB-CZ2 3.49Å; G376-W380 PolarHBondContact O-N 2.78Å; D377-W380 WeakPolarHBondContact O-CB 3.19Å; D377-W380 PolarHBondContact O-N 2.81Å; W380-T382 PolarHBondContact O-N 3.5Å; W380-Q383 PolarHBondContact O-N 3.19Å; W380-L384 WeakPolarHBondContact O-CB 3.21Å; W380-L384 PolarHBondContact O-N 3.34Å |
| 381 | N | 82 | Confident | 83.4 | Confident | 35 Ų | 35 | 32 Ų | 32 | 19% | 0.187 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -61 | -47.7 | -174.3 | -164.5 | -17.3 | 0 | 0 | 0 | 111.8 | W148 D377 Q383 L384 L385 | W148-N381 WeakPolarHBondContact CH2-ND2 3.46Å; W148-N381 VanDerWaalsContact CZ2-ND2 3.28Å; W148-N381 WeakPolarHBondContact CZ2-ND2 3.44Å; D377-N381 WeakPolarHBondContact O-CB 3.46Å; D377-N381 PolarHBondContact O-N 3.46Å; N381-Q383 VanDerWaalsContact C-N 3.34Å; N381-Q383 PolarHBondContact O-N 3.28Å; N381-L384 PolarHBondContact O-N 2.91Å; N381-L385 WeakPolarHBondContact O-CG 3.27Å; N381-L385 PolarHBondContact O-N 3.14Å; N381-L385 VanDerWaalsContact O-N 3.08Å |
| 382 | T | 78.9 | Confident | 82.3 | Confident | 36 Ų | 36 | 36.8 Ų | 36.8 | 22% | 0.221 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.6 | -41.5 | 179.8 | -54.4 | 0 | 0 | 0 | 0 | 112.2 | V310 S378 W380 N386 | V310-T382 HydrophobicContact CB-CG2 4.48Å; V310-T382 HydrophobicContact CG1-CG2 3.55Å; S378-T382 WeakPolarHBondContact O-CB 3.13Å; S378-T382 PolarHBondContact O-N 3.35Å; S378-T382 VanDerWaalsContact O-N 3.11Å; S378-T382 PolarHBondContact O-OG1 3.1Å; W380-T382 PolarHBondContact O-N 3.5Å; T382-N386 VanDerWaalsContact O-CG 3.3Å; T382-N386 PolarHBondContact O-N 2.83Å; T382-N386 PolarHBondContact O-ND2 3.43Å |
| 383 | Q | 77.6 | Confident | 81.1 | Confident | 2 Ų | 2 | 38.2 Ų | 38.2 | 1% | 0.009 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -76.9 | -34.4 | -179.7 | -61.8 | -52.1 | -31.5 | 0 | 0 | 112.6 | V310 V325 V326 C379 W380 N381 N386 I387 | V310-Q383 VanDerWaalsContact CG1-NE2 3.34Å; V325-Q383 HydrophobicContact CB-CG 3.96Å; V325-Q383 HydrophobicContact CG1-CG 3.84Å; V326-Q383 HydrophobicContact CG2-CB 3.5Å; V326-Q383 HydrophobicContact CG2-CG 3.85Å; C379-Q383 VanDerWaalsContact O-CG 3.31Å; C379-Q383 WeakPolarHBondContact O-CG 3.47Å; C379-Q383 PolarHBondContact O-N 3.02Å; W380-Q383 PolarHBondContact O-N 3.19Å; N381-Q383 VanDerWaalsContact C-N 3.34Å; N381-Q383 PolarHBondContact O-N 3.28Å; Q383-N386 WeakPolarHBondContact O-CB 3.49Å; Q383-N386 PolarHBondContact O-N 3.35Å; Q383-I387 VanDerWaalsContact O-CG1 3.3Å; Q383-I387 WeakPolarHBondContact O-CG1 3.46Å; Q383-I387 PolarHBondContact O-N 2.99Å |
| 384 | L | 79.7 | Confident | 79.9 | Confident | 4 Ų | 4 | 40.6 Ų | 40.6 | 2% | 0.021 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.3 | -43.1 | 179.4 | -173.9 | 51.5 | 0 | 0 | 0 | 111.9 | L256 V259 F260 W380 N381 N386 I387 L388 | L256-L384 HydrophobicContact CD1-CD1 3.5Å; L256-L384 VanDerWaalsContact CD1-CD1 3.5Å; L256-L384 HydrophobicContact CG-CD1 4.02Å; V259-L384 HydrophobicContact CB-CD1 4.38Å; V259-L384 HydrophobicContact CG1-CD1 3.64Å; V259-L384 HydrophobicContact CG1-CD2 4.09Å; V259-L384 HydrophobicContact CG1-CG 4.44Å; F260-L384 HydrophobicContact CD1-CD1 4.37Å; F260-L384 HydrophobicContact CD1-CD2 3.27Å; F260-L384 HydrophobicContact CD1-CG 3.92Å; F260-L384 HydrophobicContact CD2-CD1 4.43Å; F260-L384 HydrophobicContact CE1-CD1 3.98Å; F260-L384 HydrophobicContact CE1-CD2 3.26Å; F260-L384 HydrophobicContact CE1-CG 3.39Å; F260-L384 HydrophobicContact CE2-CD1 4.09Å; F260-L384 HydrophobicContact CE2-CG 4.38Å; F260-L384 HydrophobicContact CG-CD2 3.98Å; F260-L384 HydrophobicContact CZ-CD1 3.81Å; F260-L384 HydrophobicContact CZ-CD2 3.99Å; F260-L384 HydrophobicContact CZ-CG 3.64Å; W380-L384 WeakPolarHBondContact O-CB 3.21Å; W380-L384 PolarHBondContact O-N 3.34Å; N381-L384 PolarHBondContact O-N 2.91Å; L384-N386 VanDerWaalsContact C-N 3.31Å; L384-N386 PolarHBondContact O-N 3.45Å; L384-I387 PolarHBondContact O-N 2.78Å; L384-L388 WeakPolarHBondContact O-CB 3.27Å; L384-L388 PolarHBondContact O-N 3.31Å |
| 385 | L | 75.8 | Confident | 78.7 | Confident | 91 Ų | 91 | 41.9 Ų | 41.9 | 48% | 0.476 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -61.1 | -40.4 | 173.1 | -70.3 | 174.7 | 0 | 0 | 0 | 112 | N381 L388 W389 | N381-L385 WeakPolarHBondContact O-CG 3.27Å; N381-L385 PolarHBondContact O-N 3.14Å; N381-L385 VanDerWaalsContact O-N 3.08Å; L385-L388 PolarHBondContact O-N 2.91Å; L385-W389 WeakPolarHBondContact O-CB 3.28Å; L385-W389 PolarHBondContact O-N 2.67Å |
| 386 | N | 74.3 | Confident | 77.4 | Confident | 58 Ų | 58 | 45.5 Ų | 45.5 | 31% | 0.31 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -66 | -42.7 | 177 | -75.1 | -35.1 | 0 | 0 | 0 | 112.5 | R322 T382 Q383 L384 W389 L390 | R322-N386 PolarHBondContact NH1-ND2 2.81Å; T382-N386 VanDerWaalsContact O-CG 3.3Å; T382-N386 PolarHBondContact O-N 2.83Å; T382-N386 PolarHBondContact O-ND2 3.43Å; Q383-N386 WeakPolarHBondContact O-CB 3.49Å; Q383-N386 PolarHBondContact O-N 3.35Å; L384-N386 VanDerWaalsContact C-N 3.31Å; L384-N386 PolarHBondContact O-N 3.45Å; N386-W389 PolarHBondContact O-N 3.49Å; N386-L390 WeakPolarHBondContact O-CG 3.46Å; N386-L390 PolarHBondContact O-N 3.32Å |
| 387 | I | 76.9 | Confident | 76.5 | Confident | 44 Ų | 44 | 46.6 Ų | 46.6 | 23% | 0.226 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.6 | -44.4 | 176.7 | -69.3 | 164.8 | 0 | 0 | 0 | 110.2 | L256 Q383 L384 W389 L390 L391 | L256-I387 HydrophobicContact CD1-CG2 3.85Å; Q383-I387 VanDerWaalsContact O-CG1 3.3Å; Q383-I387 WeakPolarHBondContact O-CG1 3.46Å; Q383-I387 PolarHBondContact O-N 2.99Å; L384-I387 PolarHBondContact O-N 2.78Å; I387-W389 VanDerWaalsContact C-N 3.3Å; I387-W389 PolarHBondContact O-N 2.88Å; I387-L390 PolarHBondContact O-N 2.87Å; I387-L391 WeakPolarHBondContact O-CB 3.34Å; I387-L391 PolarHBondContact O-N 3.19Å |
| 388 | L | 76 | Confident | 75.3 | Confident | 60 Ų | 60 | 48.9 Ų | 48.9 | 31% | 0.314 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -59.2 | -42.7 | 176.8 | -178.7 | 66.6 | 0 | 0 | 0 | 111.5 | M253 L256 F260 L384 L385 L391 K392 | M253-L388 HydrophobicContact CE-CD1 4.35Å; M253-L388 HydrophobicContact SD-CD1 4.35Å; L256-L388 HydrophobicContact CD2-CB 4.3Å; L256-L388 HydrophobicContact CD2-CD1 3.81Å; F260-L388 HydrophobicContact CZ-CD2 4.3Å; L384-L388 WeakPolarHBondContact O-CB 3.27Å; L384-L388 PolarHBondContact O-N 3.31Å; L385-L388 PolarHBondContact O-N 2.91Å; L388-L391 PolarHBondContact O-N 2.87Å; L388-K392 WeakPolarHBondContact O-CB 3.34Å; L388-K392 PolarHBondContact O-N 3.41Å |
| 389 | W | 70.3 | Confident | 74.2 | Confident | 161 Ų | 161 | 53 Ų | 53 | 61% | 0.61 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -64.5 | -44.4 | 177.9 | -172.5 | 85.2 | 0 | 0 | 0 | 112.4 | L385 N386 I387 K392 I393 | L385-W389 WeakPolarHBondContact O-CB 3.28Å; L385-W389 PolarHBondContact O-N 2.67Å; N386-W389 PolarHBondContact O-N 3.49Å; I387-W389 VanDerWaalsContact C-N 3.3Å; I387-W389 PolarHBondContact O-N 2.88Å; W389-K392 PolarHBondContact O-N 3.46Å; W389-I393 HydrophobicContact CD2-CD1 3.74Å; W389-I393 HydrophobicContact CE3-CD1 3.52Å; W389-I393 HydrophobicContact CH2-CD1 3.2Å; W389-I393 HydrophobicContact CZ2-CD1 3.43Å; W389-I393 VanDerWaalsContact CZ2-CD1 3.43Å; W389-I393 HydrophobicContact CZ3-CD1 3.24Å; W389-I393 PolarHBondContact O-N 3.48Å |
| 390 | L | 72.2 | Confident | 73.3 | Confident | 52 Ų | 52 | 59.1 Ų | 59.1 | 27% | 0.272 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -62.3 | -43.6 | 175.5 | -73 | 171.1 | 0 | 0 | 0 | 111.9 | N386 I387 K392 I393 Q394 | N386-L390 WeakPolarHBondContact O-CG 3.46Å; N386-L390 PolarHBondContact O-N 3.32Å; I387-L390 PolarHBondContact O-N 2.87Å; L390-K392 VanDerWaalsContact C-N 3.32Å; L390-K392 PolarHBondContact O-N 3.33Å; L390-I393 PolarHBondContact O-N 2.98Å; L390-Q394 WeakPolarHBondContact O-CG 3.47Å; L390-Q394 PolarHBondContact O-N 3.37Å |
| 391 | L | 72.7 | Confident | 72.5 | Confident | 13 Ų | 13 | 61.1 Ų | 61.1 | 7% | 0.068 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.4 | -38.7 | 178.1 | -176 | 62.8 | 0 | 0 | 0 | 111.5 | K252 M253 L256 I387 L388 I393 Q394 L395 | K252-L391 HydrophobicContact CB-CD1 3.68Å; K252-L391 HydrophobicContact CB-CD2 4.09Å; K252-L391 HydrophobicContact CD-CD1 3.69Å; K252-L391 HydrophobicContact CG-CD1 4.29Å; M253-L391 HydrophobicContact CE-CD2 3.47Å; M253-L391 VanDerWaalsContact CE-CD2 3.47Å; M253-L391 HydrophobicContact CE-CG 3.8Å; M253-L391 HydrophobicContact CG-CD2 4.19Å; M253-L391 HydrophobicContact SD-CD2 3.58Å; M253-L391 VanDerWaalsContact SD-CD2 3.58Å; L256-L391 HydrophobicContact CD2-CD2 4.39Å; I387-L391 WeakPolarHBondContact O-CB 3.34Å; I387-L391 PolarHBondContact O-N 3.19Å; L388-L391 PolarHBondContact O-N 2.87Å; L391-I393 VanDerWaalsContact C-N 3.33Å; L391-I393 PolarHBondContact O-N 3.26Å; L391-Q394 PolarHBondContact O-N 3.5Å; L391-L395 HydrophobicContact CD1-CD1 4.4Å; L391-L395 HydrophobicContact CG-CD1 4.02Å; L391-L395 WeakPolarHBondContact O-CB 3.34Å; L391-L395 WeakPolarHBondContact O-CG 3.41Å; L391-L395 PolarHBondContact O-N 2.96Å |
| 392 | K | 72.3 | Confident | 71.8 | Confident | 133 Ų | 133 | 63.7 Ų | 63.7 | 58% | 0.578 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -60.6 | -43 | 174 | -177.7 | 174.7 | -179.1 | 175.3 | 0 | 111.3 | L388 W389 L390 L395 Q396 | L388-K392 WeakPolarHBondContact O-CB 3.34Å; L388-K392 PolarHBondContact O-N 3.41Å; W389-K392 PolarHBondContact O-N 3.46Å; L390-K392 VanDerWaalsContact C-N 3.32Å; L390-K392 PolarHBondContact O-N 3.33Å; K392-L395 PolarHBondContact O-N 2.89Å; K392-Q396 WeakPolarHBondContact O-CB 3.46Å; K392-Q396 VanDerWaalsContact O-CG 3.24Å; K392-Q396 WeakPolarHBondContact O-CG 3.36Å; K392-Q396 PolarHBondContact O-N 2.96Å |
| 393 | I | 71.8 | Confident | 71.1 | Confident | 47 Ų | 47 | 67.4 Ų | 67.4 | 24% | 0.241 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.5 | -49.2 | 177.2 | -71.7 | 173.3 | 0 | 0 | 0 | 110.8 | W389 L390 L391 L395 Q396 V397 F478 | W389-I393 HydrophobicContact CD2-CD1 3.74Å; W389-I393 HydrophobicContact CE3-CD1 3.52Å; W389-I393 HydrophobicContact CH2-CD1 3.2Å; W389-I393 HydrophobicContact CZ2-CD1 3.43Å; W389-I393 VanDerWaalsContact CZ2-CD1 3.43Å; W389-I393 HydrophobicContact CZ3-CD1 3.24Å; W389-I393 PolarHBondContact O-N 3.48Å; L390-I393 PolarHBondContact O-N 2.98Å; L391-I393 VanDerWaalsContact C-N 3.33Å; L391-I393 PolarHBondContact O-N 3.26Å; I393-L395 VanDerWaalsContact C-N 3.32Å; I393-L395 PolarHBondContact O-N 3.42Å; I393-Q396 PolarHBondContact O-N 3.23Å; I393-Q396 VanDerWaalsContact O-N 3.14Å; I393-V397 HydrophobicContact CG2-CG2 4.32Å; I393-V397 WeakPolarHBondContact O-CG2 3.4Å; I393-V397 PolarHBondContact O-N 3.01Å; I393-F478 HydrophobicContact CG2-CE2 4.49Å; I393-F478 HydrophobicContact CG2-CZ 4.24Å |
| 394 | Q | 69.1 | Low | 70.5 | Confident | 49 Ų | 49 | 74.7 Ų | 74.7 | 23% | 0.229 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -55.9 | -48.4 | 177.9 | -73.5 | -178.2 | -27.6 | 0 | 0 | 111.2 | L390 L391 Q396 V397 E398 F478 | L390-Q394 WeakPolarHBondContact O-CG 3.47Å; L390-Q394 PolarHBondContact O-N 3.37Å; L391-Q394 PolarHBondContact O-N 3.5Å; Q394-Q396 VanDerWaalsContact C-N 3.34Å; Q394-Q396 PolarHBondContact O-N 3.28Å; Q394-V397 PolarHBondContact O-N 3.47Å; Q394-E398 WeakPolarHBondContact O-CG 3.43Å; Q394-E398 PolarHBondContact O-N 3.43Å; Q394-F478 HydrophobicContact CG-CD1 3.83Å; Q394-F478 HydrophobicContact CG-CE1 3.83Å |
| 395 | L | 68.4 | Low | 69.7 | Low | 27 Ų | 27 | 80.1 Ų | 80.1 | 14% | 0.141 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.3 | -39.2 | 177.7 | -77.7 | 164.1 | 0 | 0 | 0 | 113.1 | M253 L391 K392 I393 L399 | M253-L395 HydrophobicContact CE-CD1 3.37Å; L391-L395 HydrophobicContact CD1-CD1 4.4Å; L391-L395 HydrophobicContact CG-CD1 4.02Å; L391-L395 WeakPolarHBondContact O-CB 3.34Å; L391-L395 WeakPolarHBondContact O-CG 3.41Å; L391-L395 PolarHBondContact O-N 2.96Å; K392-L395 PolarHBondContact O-N 2.89Å; I393-L395 VanDerWaalsContact C-N 3.32Å; I393-L395 PolarHBondContact O-N 3.42Å; L395-L399 WeakPolarHBondContact O-CB 3.24Å; L395-L399 VanDerWaalsContact O-CG 3.23Å; L395-L399 WeakPolarHBondContact O-CG 3.29Å; L395-L399 PolarHBondContact O-N 2.9Å |
| 396 | Q | 65.6 | Low | 69.3 | Low | 105 Ų | 105 | 83.6 Ų | 83.6 | 49% | 0.491 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -67.9 | -39.6 | 177.2 | -71.9 | -65.3 | -64.3 | 0 | 0 | 111.8 | K392 I393 Q394 L399 Q400 | K392-Q396 WeakPolarHBondContact O-CB 3.46Å; K392-Q396 VanDerWaalsContact O-CG 3.24Å; K392-Q396 WeakPolarHBondContact O-CG 3.36Å; K392-Q396 PolarHBondContact O-N 2.96Å; I393-Q396 PolarHBondContact O-N 3.23Å; I393-Q396 VanDerWaalsContact O-N 3.14Å; Q394-Q396 VanDerWaalsContact C-N 3.34Å; Q394-Q396 PolarHBondContact O-N 3.28Å; Q396-L399 PolarHBondContact O-N 2.99Å; Q396-Q400 WeakPolarHBondContact O-CB 3.46Å; Q396-Q400 VanDerWaalsContact O-CG 3.26Å; Q396-Q400 WeakPolarHBondContact O-CG 3.45Å; Q396-Q400 PolarHBondContact O-N 3.35Å |
| 397 | V | 71.9 | Confident | 68.9 | Low | 22 Ų | 22 | 87.6 Ų | 87.6 | 13% | 0.133 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.4 | -48.8 | 175 | 166.9 | 0 | 0 | 0 | 0 | 110.8 | I393 Q394 L399 Q400 K401 L475 | I393-V397 HydrophobicContact CG2-CG2 4.32Å; I393-V397 WeakPolarHBondContact O-CG2 3.4Å; I393-V397 PolarHBondContact O-N 3.01Å; Q394-V397 PolarHBondContact O-N 3.47Å; V397-L399 PolarHBondContact O-N 3.32Å; V397-Q400 PolarHBondContact O-N 3Å; V397-Q400 VanDerWaalsContact O-N 3.17Å; V397-K401 HydrophobicContact CG1-CD 4.25Å; V397-K401 WeakPolarHBondContact O-CG 3.5Å; V397-K401 PolarHBondContact O-N 3.22Å; V397-L475 HydrophobicContact CB-CD2 4.04Å; V397-L475 HydrophobicContact CG1-CD2 3.28Å; V397-L475 HydrophobicContact CG2-CD2 3.53Å |
| 398 | E | 66.1 | Low | 68.6 | Low | 55 Ų | 55 | 89.7 Ų | 89.7 | 26% | 0.257 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.7 | -42 | 178.6 | -67.3 | -45.5 | 127.9 | 0 | 0 | 111.9 | Q394 Q400 K401 V402 | Q394-E398 WeakPolarHBondContact O-CG 3.43Å; Q394-E398 PolarHBondContact O-N 3.43Å; E398-Q400 VanDerWaalsContact C-N 3.32Å; E398-Q400 PolarHBondContact O-N 2.96Å; E398-K401 PolarHBondContact O-N 3.24Å; E398-K401 IonicContact OE1-NZ 3.72Å; E398-V402 WeakPolarHBondContact O-CG2 3.38Å; E398-V402 PolarHBondContact O-N 3.08Å |
| 399 | L | 66 | Low | 68 | Low | 86 Ų | 86 | 89.9 Ų | 89.9 | 45% | 0.45 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.9 | -39.2 | 174.8 | -75.8 | 170.8 | 0 | 0 | 0 | 112.3 | L395 Q396 V397 H403 | L395-L399 WeakPolarHBondContact O-CB 3.24Å; L395-L399 VanDerWaalsContact O-CG 3.23Å; L395-L399 WeakPolarHBondContact O-CG 3.29Å; L395-L399 PolarHBondContact O-N 2.9Å; Q396-L399 PolarHBondContact O-N 2.99Å; V397-L399 PolarHBondContact O-N 3.32Å; L399-H403 PolarHBondContact O-N 3.36Å; L399-H403 PolarHBondContact O-ND1 3.01Å |
| 400 | Q | 66.3 | Low | 67.8 | Low | 130 Ų | 130 | 86.6 Ų | 86.6 | 61% | 0.607 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -66.2 | -40.4 | 175.9 | -73.3 | -70.1 | -61.4 | 0 | 0 | 111.8 | Q396 V397 E398 H403 R404 | Q396-Q400 WeakPolarHBondContact O-CB 3.46Å; Q396-Q400 VanDerWaalsContact O-CG 3.26Å; Q396-Q400 WeakPolarHBondContact O-CG 3.45Å; Q396-Q400 PolarHBondContact O-N 3.35Å; V397-Q400 PolarHBondContact O-N 3Å; V397-Q400 VanDerWaalsContact O-N 3.17Å; E398-Q400 VanDerWaalsContact C-N 3.32Å; E398-Q400 PolarHBondContact O-N 2.96Å; Q400-H403 PolarHBondContact O-N 2.91Å; Q400-R404 WeakPolarHBondContact O-CB 3.37Å; Q400-R404 PolarHBondContact O-N 2.86Å |
| 401 | K | 69.3 | Low | 67.3 | Low | 73 Ų | 73 | 90.4 Ų | 90.4 | 32% | 0.317 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -61.7 | -46.2 | 175.4 | -72.1 | 175.4 | 177.5 | 178.5 | 0 | 111.6 | V397 E398 H403 R404 H405 D479 | V397-K401 HydrophobicContact CG1-CD 4.25Å; V397-K401 WeakPolarHBondContact O-CG 3.5Å; V397-K401 PolarHBondContact O-N 3.22Å; E398-K401 PolarHBondContact O-N 3.24Å; E398-K401 IonicContact OE1-NZ 3.72Å; K401-H403 PolarHBondContact O-N 3.34Å; K401-R404 WeakPolarHBondContact O-CB 3.46Å; K401-R404 PolarHBondContact O-N 2.94Å; K401-H405 PolarHBondContact O-N 3.37Å; K401-D479 WeakPolarHBondContact CE-OD1 3.42Å; K401-D479 IonicContact NZ-OD1 3.94Å; K401-D479 PolarHBondContact NZ-OD1 2.97Å |
| 402 | V | 66.9 | Low | 66.7 | Low | 90 Ų | 90 | 93.9 Ų | 93.9 | 55% | 0.545 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62 | -41.6 | 176.4 | 173.5 | 0 | 0 | 0 | 0 | 111.6 | E398 H405 R406 | E398-V402 WeakPolarHBondContact O-CG2 3.38Å; E398-V402 PolarHBondContact O-N 3.08Å; V402-H405 PolarHBondContact O-N 3.35Å; V402-R406 WeakPolarHBondContact O-CB 3.17Å; V402-R406 PolarHBondContact O-N 3.32Å |
| 403 | H | 62.9 | Low | 65.7 | Low | 114 Ų | 114 | 90.9 Ų | 90.9 | 53% | 0.528 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -66.3 | -37.7 | 176.2 | -79.7 | 71 | 0 | 0 | 0 | 112.4 | L399 Q400 K401 K407 | L399-H403 PolarHBondContact O-N 3.36Å; L399-H403 PolarHBondContact O-ND1 3.01Å; Q400-H403 PolarHBondContact O-N 2.91Å; K401-H403 PolarHBondContact O-N 3.34Å; H403-K407 PolarHBondContact O-N 3.19Å; H403-K407 VanDerWaalsContact O-N 3.08Å |
| 404 | R | 66.7 | Low | 64.9 | Low | 154 Ų | 154 | 94.2 Ų | 94.2 | 58% | 0.581 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -64.1 | -48.7 | 175.2 | -176.3 | 179.7 | -177 | 160.3 | 9.4 | 111 | Q400 K401 R406 K407 E408 | Q400-R404 WeakPolarHBondContact O-CB 3.37Å; Q400-R404 PolarHBondContact O-N 2.86Å; K401-R404 WeakPolarHBondContact O-CB 3.46Å; K401-R404 PolarHBondContact O-N 2.94Å; R404-R406 VanDerWaalsContact C-N 3.31Å; R404-R406 PolarHBondContact O-N 2.86Å; R404-K407 PolarHBondContact O-N 3.47Å; R404-E408 WeakPolarHBondContact CG-OE1 3.34Å; R404-E408 IonicContact NE-OE1 2.74Å; R404-E408 PolarHBondContact NE-OE1 3.05Å; R404-E408 WeakPolarHBondContact O-CG 3.34Å; R404-E408 PolarHBondContact O-N 2.98Å |
| 405 | H | 63.1 | Low | 64 | Low | 119 Ų | 119 | 96.2 Ų | 96.2 | 55% | 0.551 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.6 | -41.2 | 177.9 | -168.9 | 62.2 | 0 | 0 | 0 | 111.9 | K401 V402 K407 E408 C409 | K401-H405 PolarHBondContact O-N 3.37Å; V402-H405 PolarHBondContact O-N 3.35Å; H405-K407 PolarHBondContact O-N 3.15Å; H405-E408 PolarHBondContact O-N 3.46Å; H405-C409 PolarHBondContact O-N 3.4Å; H405-C409 PolarHBondContact O-SG 3.38Å; H405-C409 VanDerWaalsContact O-SG 3.36Å |
| 406 | R | 66 | Low | 63 | Low | 163 Ų | 163 | 101.9 Ų | 101.9 | 62% | 0.615 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.7 | -42.5 | 175.5 | -175.4 | 176.5 | 176.8 | 163.8 | 6.3 | 112.7 | V402 R404 C409 E410 | V402-R406 WeakPolarHBondContact O-CB 3.17Å; V402-R406 PolarHBondContact O-N 3.32Å; R404-R406 VanDerWaalsContact C-N 3.31Å; R404-R406 PolarHBondContact O-N 2.86Å; R406-C409 PolarHBondContact O-N 2.72Å; R406-E410 IonicContact CZ-OE1 2.93Å; R406-E410 IonicContact NE-OE1 3.64Å; R406-E410 PolarHBondContact NE-OE1 3.02Å; R406-E410 IonicContact NH2-OE1 3.2Å; R406-E410 WeakPolarHBondContact O-CG 3.33Å; R406-E410 PolarHBondContact O-N 2.87Å |
| 407 | K | 66.6 | Low | 62 | Low | 142 Ų | 142 | 103.9 Ų | 103.9 | 62% | 0.617 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.5 | -42.2 | 175.8 | -79.3 | -172.9 | 175.4 | -173.2 | 0 | 112 | H403 R404 H405 C409 E410 E411 | H403-K407 PolarHBondContact O-N 3.19Å; H403-K407 VanDerWaalsContact O-N 3.08Å; R404-K407 PolarHBondContact O-N 3.47Å; H405-K407 PolarHBondContact O-N 3.15Å; K407-C409 VanDerWaalsContact C-N 3.34Å; K407-C409 PolarHBondContact O-N 3.25Å; K407-E410 PolarHBondContact O-N 3.19Å; K407-E411 WeakPolarHBondContact O-CB 3.31Å; K407-E411 WeakPolarHBondContact O-CG 3.4Å; K407-E411 PolarHBondContact O-N 3.32Å |
| 408 | E | 69.7 | Low | 60.5 | Low | 88 Ų | 88 | 105.2 Ų | 105.2 | 41% | 0.411 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.6 | -40.5 | 176.2 | -70.8 | 169.1 | -175.2 | 0 | 0 | 111.1 | R404 H405 V412 | R404-E408 WeakPolarHBondContact CG-OE1 3.34Å; R404-E408 IonicContact NE-OE1 2.74Å; R404-E408 PolarHBondContact NE-OE1 3.05Å; R404-E408 WeakPolarHBondContact O-CG 3.34Å; R404-E408 PolarHBondContact O-N 2.98Å; H405-E408 PolarHBondContact O-N 3.46Å; E408-V412 VanDerWaalsContact O-CG2 3.23Å; E408-V412 WeakPolarHBondContact O-CG2 3.27Å; E408-V412 PolarHBondContact O-N 3.44Å |
| 409 | C | 64.5 | Low | 59.2 | Low | 65 Ų | 65 | 107 Ų | 107 | 44% | 0.439 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.9 | -39.6 | 174.1 | -68.2 | 0 | 0 | 0 | 0 | 113.5 | H405 R406 K407 V412 S413 | H405-C409 PolarHBondContact O-N 3.4Å; H405-C409 PolarHBondContact O-SG 3.38Å; H405-C409 VanDerWaalsContact O-SG 3.36Å; R406-C409 PolarHBondContact O-N 2.72Å; K407-C409 VanDerWaalsContact C-N 3.34Å; K407-C409 PolarHBondContact O-N 3.25Å; C409-V412 PolarHBondContact O-N 3.23Å; C409-S413 WeakPolarHBondContact O-CB 3.29Å; C409-S413 PolarHBondContact O-N 3.08Å |
| 410 | E | 66.7 | Low | 57.9 | Low | 92 Ų | 92 | 110 Ų | 110 | 43% | 0.43 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.3 | -42.6 | 176.8 | -77.5 | 171.6 | -170.6 | 0 | 0 | 110.9 | R406 K407 V412 S413 I414 | R406-E410 IonicContact CZ-OE1 2.93Å; R406-E410 IonicContact NE-OE1 3.64Å; R406-E410 PolarHBondContact NE-OE1 3.02Å; R406-E410 IonicContact NH2-OE1 3.2Å; R406-E410 WeakPolarHBondContact O-CG 3.33Å; R406-E410 PolarHBondContact O-N 2.87Å; K407-E410 PolarHBondContact O-N 3.19Å; E410-V412 PolarHBondContact O-N 3.4Å; E410-S413 PolarHBondContact O-N 2.88Å; E410-I414 VanDerWaalsContact O-CG1 3.25Å; E410-I414 WeakPolarHBondContact O-CG1 3.22Å; E410-I414 PolarHBondContact O-N 3.48Å |
| 411 | E | 60.8 | Low | 56.3 | Low | 132 Ų | 132 | 106.4 Ų | 106.4 | 62% | 0.617 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -61.3 | -42.5 | 173.7 | -77.5 | 178.1 | -177.2 | 0 | 0 | 111.8 | K407 S413 I414 T415 | K407-E411 WeakPolarHBondContact O-CB 3.31Å; K407-E411 WeakPolarHBondContact O-CG 3.4Å; K407-E411 PolarHBondContact O-N 3.32Å; E411-S413 PolarHBondContact O-N 3.32Å; E411-I414 PolarHBondContact O-N 3.4Å; E411-T415 PolarHBondContact O-N 2.86Å; E411-T415 PolarHBondContact O-OG1 3.01Å |
| 412 | V | 60.9 | Low | 54.6 | Low | 85 Ų | 85 | 108.5 Ų | 108.5 | 52% | 0.515 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.2 | -39.4 | 175.3 | 172.4 | 0 | 0 | 0 | 0 | 111.5 | E408 C409 E410 T415 K416 | E408-V412 VanDerWaalsContact O-CG2 3.23Å; E408-V412 WeakPolarHBondContact O-CG2 3.27Å; E408-V412 PolarHBondContact O-N 3.44Å; C409-V412 PolarHBondContact O-N 3.23Å; E410-V412 PolarHBondContact O-N 3.4Å; V412-T415 WeakPolarHBondContact CA-OG1 3.33Å; V412-T415 PolarHBondContact O-N 3.26Å; V412-T415 PolarHBondContact O-OG1 3.5Å; V412-K416 PolarHBondContact O-N 2.68Å; V412-K416 VanDerWaalsContact O-N 3.1Å |
| 413 | S | 50.3 | Low | 52.6 | Low | 70 Ų | 70 | 110.3 Ų | 110.3 | 49% | 0.49 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.8 | -40.9 | 177.9 | -157 | 0 | 0 | 0 | 0 | 112.1 | C409 E410 E411 T415 K416 E417 | C409-S413 WeakPolarHBondContact O-CB 3.29Å; C409-S413 PolarHBondContact O-N 3.08Å; E410-S413 PolarHBondContact O-N 2.88Å; E411-S413 PolarHBondContact O-N 3.32Å; S413-T415 VanDerWaalsContact C-N 3.31Å; S413-T415 PolarHBondContact O-N 3.04Å; S413-K416 PolarHBondContact O-N 3.23Å; S413-K416 VanDerWaalsContact O-N 3.16Å; S413-E417 PolarHBondContact O-N 3.1Å; S413-E417 VanDerWaalsContact O-N 3.09Å |
| 414 | I | 54.3 | Low | 50.9 | Low | 117 Ų | 117 | 111.2 Ų | 111.2 | 60% | 0.6 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.5 | -38.7 | 175.6 | -65.4 | 163.1 | 0 | 0 | 0 | 110.5 | E410 E411 K416 G418 | E410-I414 VanDerWaalsContact O-CG1 3.25Å; E410-I414 WeakPolarHBondContact O-CG1 3.22Å; E410-I414 PolarHBondContact O-N 3.48Å; E411-I414 PolarHBondContact O-N 3.4Å; I414-K416 VanDerWaalsContact C-N 3.32Å; I414-K416 PolarHBondContact O-N 2.83Å; I414-G418 PolarHBondContact O-N 2.77Å |
| 415 | T | 51.8 | Low | 49 | Very low | 92 Ų | 92 | 109 Ų | 109 | 56% | 0.564 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -67.2 | -29.4 | 175 | 53.7 | 0 | 0 | 0 | 0 | 113.7 | E411 V412 S413 C419 | E411-T415 PolarHBondContact O-N 2.86Å; E411-T415 PolarHBondContact O-OG1 3.01Å; V412-T415 WeakPolarHBondContact CA-OG1 3.33Å; V412-T415 PolarHBondContact O-N 3.26Å; V412-T415 PolarHBondContact O-OG1 3.5Å; S413-T415 VanDerWaalsContact C-N 3.31Å; S413-T415 PolarHBondContact O-N 3.04Å; T415-C419 PolarHBondContact O-N 3.32Å |
| 416 | K | 47.7 | Very low | 47.2 | Very low | 145 Ų | 145 | 111 Ų | 111 | 63% | 0.63 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -72.4 | -45.6 | 174.3 | -86.6 | -172.1 | 175 | 179.9 | 0 | 112.5 | V412 S413 I414 G418 C419 D420 | V412-K416 PolarHBondContact O-N 2.68Å; V412-K416 VanDerWaalsContact O-N 3.1Å; S413-K416 PolarHBondContact O-N 3.23Å; S413-K416 VanDerWaalsContact O-N 3.16Å; I414-K416 VanDerWaalsContact C-N 3.32Å; I414-K416 PolarHBondContact O-N 2.83Å; K416-G418 PolarHBondContact O-N 2.78Å; K416-C419 PolarHBondContact O-N 2.6Å; K416-C419 VanDerWaalsContact O-N 3.09Å; K416-D420 PolarHBondContact O-N 3.26Å |
| 417 | E | 44.7 | Very low | 45.2 | Very low | 148 Ų | 148 | 109.9 Ų | 109.9 | 69% | 0.692 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -64.9 | -31.3 | 174.9 | -75.4 | -173.7 | 165.2 | 0 | 0 | 112.1 | S413 C419 D420 | S413-E417 PolarHBondContact O-N 3.1Å; S413-E417 VanDerWaalsContact O-N 3.09Å; E417-C419 VanDerWaalsContact C-N 3.28Å; E417-C419 PolarHBondContact O-N 3.35Å; E417-D420 PolarHBondContact O-N 3.09Å |
| 418 | G | 38.8 | Very low | 43.1 | Very low | 49 Ų | 49 | 114.4 Ų | 114.4 | 51% | 0.505 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -64.2 | -28.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | I414 K416 | I414-G418 PolarHBondContact O-N 2.77Å; K416-G418 PolarHBondContact O-N 2.78Å |
| 419 | C | 39.2 | Very low | 41.1 | Very low | 93 Ų | 93 | 118 Ų | 118 | 63% | 0.628 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -79.3 | -30.3 | 178.1 | -80.4 | 0 | 0 | 0 | 0 | 113.1 | T415 K416 E417 G421 V422 | T415-C419 PolarHBondContact O-N 3.32Å; K416-C419 PolarHBondContact O-N 2.6Å; K416-C419 VanDerWaalsContact O-N 3.09Å; E417-C419 VanDerWaalsContact C-N 3.28Å; E417-C419 PolarHBondContact O-N 3.35Å; C419-G421 PolarHBondContact O-N 3.26Å; C419-V422 PolarHBondContact O-N 2.98Å |
| 420 | D | 39.3 | Very low | 39.1 | Very low | 148 Ų | 148 | 118.2 Ų | 118.2 | 79% | 0.791 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -74.5 | -12.5 | 176.7 | -70.3 | -19.7 | 0 | 0 | 0 | 112.6 | K416 E417 | K416-D420 PolarHBondContact O-N 3.26Å; E417-D420 PolarHBondContact O-N 3.09Å |
| 421 | G | 31.7 | Very low | 37.2 | Very low | 56 Ų | 56 | 123.6 Ų | 123.6 | 58% | 0.577 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -10.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115 | C419 T423 | C419-G421 PolarHBondContact O-N 3.26Å; G421-T423 VanDerWaalsContact C-N 3.28Å; G421-T423 PolarHBondContact O-N 3.43Å |
| 422 | V | 33.2 | Very low | 35.5 | Very low | 117 Ų | 117 | 123.8 Ų | 123.8 | 71% | 0.709 | 71% | 0.713 | S | S | * | * | trans | -86.8 | 76.9 | 176.9 | -172.3 | 0 | 0 | 0 | 0 | 108.7 | C419 T424 | C419-V422 PolarHBondContact O-N 2.98Å; V422-T424 PolarHBondContact O-N 2.85Å | ||
| 423 | T | 26.5 | Very low | 34 | Very low | 128 Ų | 128 | 122.8 Ų | 122.8 | 79% | 0.785 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 119.4 | 172.8 | -21.1 | 0 | 0 | 0 | 0 | 108.6 | G421 S425 | G421-T423 VanDerWaalsContact C-N 3.28Å; G421-T423 PolarHBondContact O-N 3.43Å; T423-S425 PolarHBondContact O-N 3.3Å |
| 424 | T | 27.2 | Very low | 32.7 | Very low | 132 Ų | 132 | 125.8 Ų | 125.8 | 81% | 0.81 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 129.4 | 173.2 | 36.7 | 0 | 0 | 0 | 0 | 110.2 | V422 N426 | V422-T424 PolarHBondContact O-N 2.85Å; T424-N426 PolarHBondContact O-N 2.97Å |
| 425 | S | 26.2 | Very low | 31.3 | Very low | 108 Ų | 108 | 127 Ų | 127 | 76% | 0.755 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -47.2 | 117.1 | 175.6 | 47.6 | 0 | 0 | 0 | 0 | 113.2 | T423 V427 | T423-S425 PolarHBondContact O-N 3.3Å; S425-V427 PolarHBondContact O-N 3.41Å |
| 426 | N | 24.6 | Very low | 29.9 | Very low | 161 Ų | 161 | 128 Ų | 128 | 86% | 0.861 | 75% | 0.749 | S | S | * | * | trans | 4.3 | 103.9 | 144.5 | -72.9 | -44 | 0 | 0 | 0 | 117 | T424 | T424-N426 PolarHBondContact O-N 2.97Š| ||
| 427 | V | 25.5 | Very low | 28.7 | Very low | 139 Ų | 139 | 125.9 Ų | 125.9 | 84% | 0.842 | 75% | 0.752 | S | S | * | * | trans | -114.6 | 115.3 | 145 | 176.8 | 0 | 0 | 0 | 0 | 107.7 | S425 I429 | S425-V427 PolarHBondContact O-N 3.41Å; V427-I429 PolarHBondContact O-N 3.32Å | ||
| 428 | R | 21.8 | Very low | 27.9 | Very low | 237 Ų | 237 | 125.6 Ų | 125.6 | 89% | 0.894 | 76% | 0.761 | S | S | * | * | trans | -61.7 | 125.8 | 176.5 | -77 | 175.7 | -174.8 | 170.9 | 2.1 | 111.1 | ||||
| 429 | I | 28.4 | Very low | 27 | Very low | 165 Ų | 165 | 132.2 Ų | 132.2 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | trans | -136.7 | 111.6 | 142.9 | -56.3 | -179.6 | 0 | 0 | 0 | 106.2 | V427 | V427-I429 PolarHBondContact O-N 3.32Š| ||
| 430 | G | 22.2 | Very low | 26.4 | Very low | 69 Ų | 69 | 132.9 Ų | 132.9 | 71% | 0.711 | 78% | 0.784 | S | S | * | * | trans | -72.9 | 148.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 431 | K | 27.1 | Very low | 25.7 | Very low | 204 Ų | 204 | 131.1 Ų | 131.1 | 89% | 0.887 | 78% | 0.784 | S | S | * | * | trans | -157.7 | 136.8 | 142.5 | -105.6 | 176.8 | -175.3 | -178.6 | 0 | 108.9 | ||||
| 432 | P | 25.3 | Very low | 25.5 | Very low | 136 Ų | 136 | 136.1 Ų | 136.1 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -88.1 | 137.6 | -171.8 | 33.8 | -31.6 | 0 | 0 | 0 | 112.1 | ||||
| 433 | G | 28.2 | Very low | 25.1 | Very low | 65 Ų | 65 | 135.5 Ų | 135.5 | 67% | 0.67 | 80% | 0.795 | S | S | * | * | trans | -164.5 | 100.4 | 170.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 434 | T | 22.5 | Very low | 25.2 | Very low | 132 Ų | 132 | 140.1 Ų | 140.1 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | trans | 8.8 | 130.5 | 137.4 | 5.8 | 0 | 0 | 0 | 0 | 116 | ||||
| 435 | L | 24.5 | Very low | 25.1 | Very low | 142 Ų | 142 | 141.7 Ų | 141.7 | 74% | 0.743 | 80% | 0.801 | S | S | * | * | cis | -178 | 152.7 | 46.4 | -119.2 | 130.4 | 0 | 0 | 0 | 108.8 | ||||
| 436 | T | 24.3 | Very low | 25.1 | Very low | 113 Ų | 113 | 143.2 Ų | 143.2 | 69% | 0.693 | 80% | 0.799 | S | S | * | * | trans | 66.7 | 106 | 147.7 | 48 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 437 | S | 21.1 | Very low | 25.1 | Very low | 101 Ų | 101 | 144.6 Ų | 144.6 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | trans | 2.8 | 122.2 | 133.5 | 60.3 | 0 | 0 | 0 | 0 | 120 | ||||
| 438 | V | 27.6 | Very low | 25.1 | Very low | 143 Ų | 143 | 147 Ų | 147 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -133.6 | 123 | 137.9 | 178.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 439 | Q | 21.2 | Very low | 25.3 | Very low | 188 Ų | 188 | 140.2 Ų | 140.2 | 88% | 0.879 | 79% | 0.791 | S | S | * | * | trans | -110.9 | 111.1 | -174.2 | -173.3 | 171.3 | -15.3 | 0 | 0 | 106.2 | ||||
| 440 | S | 26.4 | Very low | 25.2 | Very low | 106 Ų | 106 | 137.5 Ų | 137.5 | 74% | 0.741 | 79% | 0.787 | S | S | * | * | trans | -136.2 | 111.2 | 164.9 | 60.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 441 | S | 24.4 | Very low | 25.2 | Very low | 112 Ų | 112 | 141.5 Ų | 141.5 | 78% | 0.783 | 79% | 0.791 | S | S | * | * | trans | -75.3 | 124 | 176.6 | 47.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 442 | L | 26.6 | Very low | 25.1 | Very low | 161 Ų | 161 | 139.4 Ų | 139.4 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | trans | -123.4 | 112 | 162.7 | -97.9 | 137.5 | 0 | 0 | 0 | 108.4 | ||||
| 443 | P | 26.3 | Very low | 25.3 | Very low | 104 Ų | 104 | 138.8 Ų | 138.8 | 68% | 0.675 | 78% | 0.783 | S | S | * | * | trans | -103.8 | 97.9 | -175.3 | 34.8 | -25.4 | 0 | 0 | 0 | 111.2 | ||||
| 444 | W | 27.5 | Very low | 25.1 | Very low | 225 Ų | 225 | 138.6 Ų | 138.6 | 85% | 0.852 | 78% | 0.781 | S | S | * | * | trans | -149.9 | 60.1 | 159.3 | -69.2 | 104.7 | 0 | 0 | 0 | 110.3 | I446 | W444-I446 PolarHBondContact O-N 2.96Š| ||
| 445 | D | 25.6 | Very low | 25.3 | Very low | 165 Ų | 165 | 137.6 Ų | 137.6 | 88% | 0.882 | 79% | 0.786 | S | S | * | * | trans | -82.3 | 84.9 | 165.4 | -95.1 | -28.8 | 0 | 0 | 0 | 109.3 | K447 | D445-K447 PolarHBondContact O-N 3.09Š| ||
| 446 | I | 25.7 | Very low | 25.4 | Very low | 140 Ų | 140 | 134.2 Ų | 134.2 | 72% | 0.718 | 79% | 0.786 | S | S | * | * | trans | -79.9 | 94 | 161.8 | -61.6 | 176.6 | 0 | 0 | 0 | 106.5 | W444 M448 | W444-I446 PolarHBondContact O-N 2.96Å; I446-M448 PolarHBondContact O-N 3.45Å | ||
| 447 | K | 25.6 | Very low | 25.6 | Very low | 190 Ų | 190 | 134.5 Ų | 134.5 | 83% | 0.826 | 79% | 0.792 | S | S | * | * | trans | -55 | 105.3 | 165.7 | -82.3 | 177.2 | 174.1 | 174.8 | 0 | 108.7 | D445 S449 | D445-K447 PolarHBondContact O-N 3.09Å; K447-S449 PolarHBondContact O-N 2.88Å | ||
| 448 | M | 24.7 | Very low | 26 | Very low | 188 Ų | 188 | 132.9 Ų | 132.9 | 93% | 0.926 | 79% | 0.791 | S | S | * | * | trans | -65.6 | 91.4 | 156.8 | -79 | -173.8 | -161.8 | 0 | 0 | 107.2 | I446 S450 | I446-M448 PolarHBondContact O-N 3.45Å; M448-S450 PolarHBondContact O-N 2.82Å; M448-S450 VanDerWaalsContact O-N 3.17Å | ||
| 449 | S | 25.8 | Very low | 26.1 | Very low | 96 Ų | 96 | 135.4 Ų | 135.4 | 67% | 0.671 | 79% | 0.791 | S | S | * | * | trans | -58 | 118.5 | 164.4 | 51.5 | 0 | 0 | 0 | 0 | 107.9 | K447 L451 | K447-S449 PolarHBondContact O-N 2.88Å; S449-L451 PolarHBondContact O-N 3.5Å | ||
| 450 | S | 26.2 | Very low | 26.6 | Very low | 107 Ų | 107 | 131.6 Ų | 131.6 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | trans | -36.8 | 102.3 | 170.1 | 53.7 | 0 | 0 | 0 | 0 | 112 | M448 N452 | M448-S450 PolarHBondContact O-N 2.82Å; M448-S450 VanDerWaalsContact O-N 3.17Å; S450-N452 PolarHBondContact O-N 3.4Å; S450-N452 VanDerWaalsContact O-N 3.09Å | ||
| 451 | L | 23.5 | Very low | 27 | Very low | 153 Ų | 153 | 131 Ų | 131 | 80% | 0.801 | 78% | 0.777 | S | S | * | * | trans | -70.9 | 102.4 | 158.3 | -110.1 | 95.8 | 0 | 0 | 0 | 106.3 | S449 V453 | S449-L451 PolarHBondContact O-N 3.5Å; L451-V453 HydrophobicContact CB-CG2 4.44Å; L451-V453 PolarHBondContact O-N 3.4Å | ||
| 452 | N | 24.7 | Very low | 27.7 | Very low | 160 Ų | 160 | 129.7 Ų | 129.7 | 86% | 0.856 | 76% | 0.764 | S | S | * | * | trans | -60.9 | 84.9 | 161 | -103.3 | -18.4 | 0 | 0 | 0 | 107.5 | S450 G454 | S450-N452 PolarHBondContact O-N 3.4Å; S450-N452 VanDerWaalsContact O-N 3.09Å; N452-G454 VanDerWaalsContact C-N 3.3Å; N452-G454 PolarHBondContact O-N 2.79Å | ||
| 453 | V | 28.3 | Very low | 28.1 | Very low | 124 Ų | 124 | 125.5 Ų | 125.5 | 75% | 0.752 | 75% | 0.753 | S | S | * | * | trans | -72 | 98.8 | 165.3 | -179.1 | 0 | 0 | 0 | 0 | 105.3 | L451 A455 | L451-V453 HydrophobicContact CB-CG2 4.44Å; L451-V453 PolarHBondContact O-N 3.4Å; V453-A455 PolarHBondContact O-N 2.84Å | ||
| 454 | G | 25.7 | Very low | 28.6 | Very low | 61 Ų | 61 | 130 Ų | 130 | 63% | 0.629 | 76% | 0.756 | S | S | * | * | trans | -47.4 | 140.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | N452 G456 | N452-G454 VanDerWaalsContact C-N 3.3Å; N452-G454 PolarHBondContact O-N 2.79Å; G454-G456 PolarHBondContact O-N 3.36Å | ||
| 455 | A | 26.8 | Very low | 29.3 | Very low | 111 Ų | 111 | 124.4 Ų | 124.4 | 92% | 0.917 | 74% | 0.739 | S | S | * | * | trans | -58 | 76.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | V453 S457 | V453-A455 PolarHBondContact O-N 2.84Å; A455-S457 PolarHBondContact O-N 3.49Å | ||
| 456 | G | 25.6 | Very low | 30.2 | Very low | 71 Ų | 71 | 121 Ų | 121 | 73% | 0.732 | 72% | 0.721 | S | S | * | * | trans | -84.9 | 90.3 | 165.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | G454 G458 | G454-G456 PolarHBondContact O-N 3.36Å; G456-G458 PolarHBondContact O-N 3.34Å | ||
| 457 | S | 29.4 | Very low | 30.8 | Very low | 118 Ų | 118 | 120.9 Ų | 120.9 | 83% | 0.825 | 72% | 0.716 | S | S | * | * | trans | -52.4 | 120.3 | 172.7 | 59.1 | 0 | 0 | 0 | 0 | 111 | A455 | A455-S457 PolarHBondContact O-N 3.49Š| ||
| 458 | G | 28 | Very low | 31.6 | Very low | 67 Ų | 67 | 114.9 Ų | 114.9 | 69% | 0.691 | 69% | 0.693 | S | S | * | * | S | Bend | trans | 70.8 | 92.9 | 153.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | G456 | G456-G458 PolarHBondContact O-N 3.34Š|
| 459 | K | 29.8 | Very low | 32.6 | Very low | 197 Ų | 197 | 112.6 Ų | 112.6 | 86% | 0.857 | 68% | 0.677 | S | S | * | * | trans | -179.3 | 10.6 | 141.4 | -100.5 | 164.2 | -169.7 | -173.2 | 0 | 116.6 | ||||
| 460 | S | 31.6 | Very low | 33.5 | Very low | 108 Ų | 108 | 113.2 Ų | 113.2 | 76% | 0.755 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -91.8 | -2.2 | 178.4 | 78.7 | 0 | 0 | 0 | 0 | 115.5 | ||
| 461 | V | 36.3 | Very low | 34.2 | Very low | 94 Ų | 94 | 110.6 Ų | 110.6 | 57% | 0.57 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -84.4 | -27 | -174.4 | -178.8 | 0 | 0 | 0 | 0 | 112.6 | A463 R464 E465 | V461-A463 PolarHBondContact O-N 2.91Å; V461-R464 PolarHBondContact O-N 3.37Å; V461-E465 HydrophobicContact CG1-CG 4.38Å; V461-E465 PolarHBondContact O-N 3.3Å |
| 462 | T | 37.6 | Very low | 34.9 | Very low | 83 Ų | 83 | 107.9 Ų | 107.9 | 51% | 0.509 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -72.7 | -34.8 | -172.3 | 58.5 | 0 | 0 | 0 | 0 | 113.7 | R464 E465 D466 | T462-R464 VanDerWaalsContact C-N 3.27Å; T462-R464 PolarHBondContact O-N 3.23Å; T462-E465 PolarHBondContact O-N 3.12Å; T462-D466 WeakPolarHBondContact O-CB 3.39Å; T462-D466 PolarHBondContact O-N 3.26Å |
| 463 | A | 35.5 | Very low | 35.9 | Very low | 74 Ų | 74 | 108.2 Ų | 108.2 | 61% | 0.612 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -66.6 | -29.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113 | V461 F467 | V461-A463 PolarHBondContact O-N 2.91Å; A463-F467 PolarHBondContact O-N 3.2Å |
| 464 | R | 36.9 | Very low | 36.7 | Very low | 197 Ų | 197 | 107 Ų | 107 | 74% | 0.743 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -81.9 | -40.5 | 179.9 | -164.1 | 147.5 | -175.3 | 167.1 | -3.4 | 111.9 | V461 T462 D466 F467 D468 | V461-R464 PolarHBondContact O-N 3.37Å; T462-R464 VanDerWaalsContact C-N 3.27Å; T462-R464 PolarHBondContact O-N 3.23Å; R464-D466 VanDerWaalsContact C-N 3.34Å; R464-D466 PolarHBondContact O-N 3.16Å; R464-F467 PolarHBondContact O-N 3.14Å; R464-D468 PolarHBondContact O-N 3.48Å |
| 465 | E | 41.7 | Very low | 37.2 | Very low | 109 Ų | 109 | 105.9 Ų | 105.9 | 51% | 0.509 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -64.8 | -36.8 | 173.5 | -71.8 | -176.1 | 164.7 | 0 | 0 | 112.6 | V461 T462 D468 K469 | V461-E465 HydrophobicContact CG1-CG 4.38Å; V461-E465 PolarHBondContact O-N 3.3Å; T462-E465 PolarHBondContact O-N 3.12Å; E465-D468 PolarHBondContact O-N 3.29Å; E465-K469 WeakPolarHBondContact O-CB 3.39Å; E465-K469 PolarHBondContact O-N 3.18Å |
| 466 | D | 44.7 | Very low | 37.7 | Very low | 92 Ų | 92 | 107.1 Ų | 107.1 | 49% | 0.492 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -67.7 | -38.6 | 176.3 | -78.2 | -25.3 | 0 | 0 | 0 | 111.6 | T462 R464 I470 | T462-D466 WeakPolarHBondContact O-CB 3.39Å; T462-D466 PolarHBondContact O-N 3.26Å; R464-D466 VanDerWaalsContact C-N 3.34Å; R464-D466 PolarHBondContact O-N 3.16Å; D466-I470 WeakPolarHBondContact O-CB 3.33Å; D466-I470 WeakPolarHBondContact O-CD1 3.43Å; D466-I470 WeakPolarHBondContact O-CG1 3.48Å; D466-I470 PolarHBondContact O-N 2.63Å |
| 467 | F | 38.9 | Very low | 38.2 | Very low | 138 Ų | 138 | 108.6 Ų | 108.6 | 61% | 0.605 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -64.5 | -47.5 | 174.6 | -169.5 | -95 | 0 | 0 | 0 | 111.1 | A463 R464 K469 I470 V471 | A463-F467 PolarHBondContact O-N 3.2Å; R464-F467 PolarHBondContact O-N 3.14Å; F467-K469 PolarHBondContact O-N 3.42Å; F467-I470 PolarHBondContact O-N 2.99Å; F467-V471 HydrophobicContact CD1-CG2 3.93Å; F467-V471 HydrophobicContact CE1-CG2 3.68Å; F467-V471 HydrophobicContact CZ-CG2 4.1Å; F467-V471 WeakPolarHBondContact O-CB 3.45Å; F467-V471 WeakPolarHBondContact O-CG2 3.27Å; F467-V471 PolarHBondContact O-N 3.4Å |
| 468 | D | 42 | Very low | 38.9 | Very low | 65 Ų | 65 | 105.1 Ų | 105.1 | 35% | 0.348 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -65.1 | -37.2 | 178.6 | -77.2 | -24.3 | 0 | 0 | 0 | 112 | R464 E465 V471 L472 | R464-D468 PolarHBondContact O-N 3.48Å; E465-D468 PolarHBondContact O-N 3.29Å; D468-V471 PolarHBondContact O-N 2.98Å; D468-L472 WeakPolarHBondContact O-CB 3.5Å; D468-L472 WeakPolarHBondContact O-CD1 3.29Å; D468-L472 PolarHBondContact O-N 3.34Å |
| 469 | K | 44.9 | Very low | 39.3 | Very low | 139 Ų | 139 | 106.4 Ų | 106.4 | 60% | 0.604 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -66.3 | -39.6 | 173.5 | -87.1 | 178.6 | 179.1 | 165.1 | 0 | 113.1 | E465 F467 V471 K473 | E465-K469 WeakPolarHBondContact O-CB 3.39Å; E465-K469 PolarHBondContact O-N 3.18Å; F467-K469 PolarHBondContact O-N 3.42Å; K469-V471 VanDerWaalsContact C-N 3.35Å; K469-K473 WeakPolarHBondContact O-CB 3.47Å; K469-K473 PolarHBondContact O-N 3.13Å |
| 470 | I | 44.8 | Very low | 39.6 | Very low | 110 Ų | 110 | 106.1 Ų | 106.1 | 56% | 0.564 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.3 | -43.3 | 175.8 | -70.2 | 164.9 | 0 | 0 | 0 | 109.6 | D466 F467 K473 V474 | D466-I470 WeakPolarHBondContact O-CB 3.33Å; D466-I470 WeakPolarHBondContact O-CD1 3.43Å; D466-I470 WeakPolarHBondContact O-CG1 3.48Å; D466-I470 PolarHBondContact O-N 2.63Å; F467-I470 PolarHBondContact O-N 2.99Å; I470-K473 PolarHBondContact O-N 3.43Å; I470-V474 WeakPolarHBondContact O-CB 3.35Å; I470-V474 WeakPolarHBondContact O-CG2 3.5Å; I470-V474 PolarHBondContact O-N 3.15Å |
| 471 | V | 41 | Very low | 40 | Very low | 51 Ų | 51 | 107.1 Ų | 107.1 | 31% | 0.309 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.1 | -45 | 176.3 | 170.5 | 0 | 0 | 0 | 0 | 110.7 | F467 D468 K469 V474 L475 | F467-V471 HydrophobicContact CD1-CG2 3.93Å; F467-V471 HydrophobicContact CE1-CG2 3.68Å; F467-V471 HydrophobicContact CZ-CG2 4.1Å; F467-V471 WeakPolarHBondContact O-CB 3.45Å; F467-V471 WeakPolarHBondContact O-CG2 3.27Å; F467-V471 PolarHBondContact O-N 3.4Å; D468-V471 PolarHBondContact O-N 2.98Å; K469-V471 VanDerWaalsContact C-N 3.35Å; V471-V474 PolarHBondContact O-N 2.95Å; V471-L475 HydrophobicContact CG1-CD1 3.44Å; V471-L475 VanDerWaalsContact CG1-CD1 3.44Å; V471-L475 HydrophobicContact CG1-CG 4.36Å; V471-L475 VanDerWaalsContact O-CB 3.31Å; V471-L475 WeakPolarHBondContact O-CB 3.48Å; V471-L475 WeakPolarHBondContact O-CD1 3.28Å; V471-L475 WeakPolarHBondContact O-CG 3.24Å; V471-L475 PolarHBondContact O-N 2.93Å |
| 472 | L | 39.9 | Very low | 40.3 | Very low | 97 Ų | 97 | 110.7 Ų | 110.7 | 51% | 0.508 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.4 | -45.1 | 175.5 | -106.8 | 113.3 | 0 | 0 | 0 | 112.6 | D468 V474 L475 E476 | D468-L472 WeakPolarHBondContact O-CB 3.5Å; D468-L472 WeakPolarHBondContact O-CD1 3.29Å; D468-L472 PolarHBondContact O-N 3.34Å; L472-V474 PolarHBondContact O-N 2.88Å; L472-L475 CarbonylContact O-C 3.31Å; L472-L475 PolarHBondContact O-N 3.35Å; L472-E476 PolarHBondContact O-N 3.5Å |
| 473 | K | 44.3 | Very low | 40.4 | Very low | 166 Ų | 166 | 113.5 Ų | 113.5 | 72% | 0.722 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.2 | -30.3 | 175.9 | -103.5 | -176.1 | 174.4 | 177.1 | 0 | 113.1 | K469 I470 | K469-K473 WeakPolarHBondContact O-CB 3.47Å; K469-K473 PolarHBondContact O-N 3.13Å; I470-K473 PolarHBondContact O-N 3.43Å |
| 474 | V | 45.9 | Very low | 40.9 | Very low | 100 Ų | 100 | 117 Ų | 117 | 61% | 0.606 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -77.8 | -28.3 | 174.9 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | I470 V471 L472 | I470-V474 WeakPolarHBondContact O-CB 3.35Å; I470-V474 WeakPolarHBondContact O-CG2 3.5Å; I470-V474 PolarHBondContact O-N 3.15Å; V471-V474 PolarHBondContact O-N 2.95Å; L472-V474 PolarHBondContact O-N 2.88Å |
| 475 | L | 36.5 | Very low | 41.5 | Very low | 36 Ų | 36 | 115.6 Ų | 115.6 | 19% | 0.188 | 58% | 0.575 | C | S | . | * | H | α-helix | trans | -92.4 | -22.1 | -177.2 | -75 | 167.8 | 0 | 0 | 0 | 114.9 | V397 V471 L472 P477 F478 | V397-L475 HydrophobicContact CB-CD2 4.04Å; V397-L475 HydrophobicContact CG1-CD2 3.28Å; V397-L475 HydrophobicContact CG2-CD2 3.53Å; V471-L475 HydrophobicContact CG1-CD1 3.44Å; V471-L475 VanDerWaalsContact CG1-CD1 3.44Å; V471-L475 HydrophobicContact CG1-CG 4.36Å; V471-L475 VanDerWaalsContact O-CB 3.31Å; V471-L475 WeakPolarHBondContact O-CB 3.48Å; V471-L475 WeakPolarHBondContact O-CD1 3.28Å; V471-L475 WeakPolarHBondContact O-CG 3.24Å; V471-L475 PolarHBondContact O-N 2.93Å; L472-L475 CarbonylContact O-C 3.31Å; L472-L475 PolarHBondContact O-N 3.35Å; L475-P477 VanDerWaalsContact C-CD 3.43Å; L475-P477 VanDerWaalsContact C-N 3.3Å; L475-P477 VanDerWaalsContact O-N 3.14Å; L475-F478 WeakPolarHBondContact O-CA 3.41Å; L475-F478 WeakPolarHBondContact O-CB 3.33Å; L475-F478 PolarHBondContact O-N 3.15Å |
| 476 | E | 37.5 | Very low | 42.3 | Very low | 137 Ų | 137 | 114.4 Ų | 114.4 | 64% | 0.64 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.2 | -36.2 | -176.2 | -94.9 | 179.2 | 173.8 | 0 | 0 | 114.6 | L472 F478 | L472-E476 PolarHBondContact O-N 3.5Å; E476-F478 PolarHBondContact O-N 3.3Å |
| 477 | P | 35.9 | Very low | 43.3 | Very low | 102 Ų | 102 | 113.6 Ų | 113.6 | 66% | 0.662 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | -2.6 | 173.9 | -17.2 | 30.8 | 0 | 0 | 0 | 115.1 | L475 | L475-P477 VanDerWaalsContact C-CD 3.43Å; L475-P477 VanDerWaalsContact C-N 3.3Å; L475-P477 VanDerWaalsContact O-N 3.14Å |
| 478 | F | 42.8 | Very low | 44 | Very low | 45 Ų | 45 | 114.8 Ų | 114.8 | 20% | 0.197 | 57% | 0.573 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -122 | -7.8 | -165.1 | -71.8 | -80.5 | 0 | 0 | 0 | 115.9 | I393 Q394 L475 E476 F480 | I393-F478 HydrophobicContact CG2-CE2 4.49Å; I393-F478 HydrophobicContact CG2-CZ 4.24Å; Q394-F478 HydrophobicContact CG-CD1 3.83Å; Q394-F478 HydrophobicContact CG-CE1 3.83Å; L475-F478 WeakPolarHBondContact O-CA 3.41Å; L475-F478 WeakPolarHBondContact O-CB 3.33Å; L475-F478 PolarHBondContact O-N 3.15Å; E476-F478 PolarHBondContact O-N 3.3Å; F478-F480 VanDerWaalsContact C-N 3.25Å; F478-F480 PolarHBondContact O-N 3.5Å; F478-F480 VanDerWaalsContact O-N 3.14Å |
| 479 | D | 36.1 | Very low | 44.8 | Very low | 95 Ų | 95 | 114.5 Ų | 114.5 | 51% | 0.508 | 58% | 0.58 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79 | 11.5 | -173.2 | -83.7 | -24.1 | 0 | 0 | 0 | 116.2 | K401 | K401-D479 WeakPolarHBondContact CE-OD1 3.42Å; K401-D479 IonicContact NZ-OD1 3.94Å; K401-D479 PolarHBondContact NZ-OD1 2.97Å |
| 480 | F | 37 | Very low | 45.4 | Very low | 190 Ų | 190 | 112.6 Ų | 112.6 | 83% | 0.833 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | -6.3 | -178.7 | -144.2 | -94.9 | 0 | 0 | 0 | 115.9 | F478 Q482 | F478-F480 VanDerWaalsContact C-N 3.25Å; F478-F480 PolarHBondContact O-N 3.5Å; F478-F480 VanDerWaalsContact O-N 3.14Å; F480-Q482 PolarHBondContact O-N 3.2Å |
| 481 | F | 39.9 | Very low | 46.3 | Very low | 129 Ų | 129 | 112 Ų | 112 | 57% | 0.566 | 56% | 0.564 | S | S | * | * | trans | -104.1 | 70.3 | -178 | -62.7 | -76.2 | 0 | 0 | 0 | 111.1 | ||||
| 482 | Q | 42.1 | Very low | 46.9 | Very low | 170 Ų | 170 | 113.8 Ų | 113.8 | 79% | 0.794 | 57% | 0.572 | S | S | * | * | trans | -67.7 | 137 | 173.6 | -172.8 | 169.7 | -16.8 | 0 | 0 | 111 | F480 L484 | F480-Q482 PolarHBondContact O-N 3.2Å; Q482-L484 PolarHBondContact O-N 3.32Å | ||
| 483 | D | 40.3 | Very low | 48.2 | Very low | 142 Ų | 142 | 113.8 Ų | 113.8 | 76% | 0.759 | 57% | 0.571 | S | S | * | * | trans | -36.7 | 90.1 | 177.5 | -60.8 | -63.9 | 0 | 0 | 0 | 116.1 | ||||
| 484 | L | 46.4 | Very low | 48.8 | Very low | 146 Ų | 146 | 107.3 Ų | 107.3 | 76% | 0.764 | 55% | 0.551 | S | S | * | * | trans | -122.1 | 123.6 | 163.5 | -87.4 | 146.8 | 0 | 0 | 0 | 108.2 | Q482 E486 | Q482-L484 PolarHBondContact O-N 3.32Å; L484-E486 PolarHBondContact O-N 3.48Å | ||
| 485 | D | 49.7 | Very low | 49.1 | Very low | 168 Ų | 168 | 105.8 Ų | 105.8 | 90% | 0.898 | 54% | 0.539 | S | S | * | . | trans | -60.3 | 88.9 | 168.7 | -82.5 | -42.5 | 0 | 0 | 0 | 108.9 | T487 | D485-T487 PolarHBondContact O-N 2.94Š| ||
| 486 | E | 58.7 | Low | 50.1 | Low | 84 Ų | 84 | 106.8 Ų | 106.8 | 39% | 0.393 | 55% | 0.547 | S | S | . | . | trans | -63 | 125.9 | -176.8 | -69.1 | 176.3 | -169.9 | 0 | 0 | 110.1 | L484 E490 R491 | L484-E486 PolarHBondContact O-N 3.48Å; E486-E490 HydrophobicContact CB-CB 4.41Å; E486-R491 HydrophobicContact CB-CG 3.96Å; E486-R491 PolarHBondContact O-NE 3.3Å; E486-R491 PolarHBondContact O-NH2 3.45Å | ||
| 487 | T | 65.1 | Low | 51.3 | Low | 75 Ų | 75 | 107 Ų | 107 | 46% | 0.46 | 55% | 0.548 | S | S | . | . | trans | -66.2 | 157.7 | 171.6 | 61.3 | 0 | 0 | 0 | 0 | 110.9 | D485 A489 E490 R491 | D485-T487 PolarHBondContact O-N 2.94Å; T487-A489 PolarHBondContact O-N 2.86Å; T487-A489 VanDerWaalsContact O-N 3.15Å; T487-E490 PolarHBondContact N-OE2 3.22Å; T487-E490 PolarHBondContact O-N 3.23Å; T487-E490 VanDerWaalsContact O-N 3.07Å; T487-E490 WeakPolarHBondContact OG1-CG 3.22Å; T487-E490 PolarHBondContact OG1-N 2.9Å; T487-E490 PolarHBondContact OG1-OE2 2.91Å; T487-E490 VanDerWaalsContact OG1-OE2 3.13Å; T487-R491 WeakPolarHBondContact O-CG 3.12Å; T487-R491 PolarHBondContact O-N 3.26Å | ||
| 488 | F | 52.6 | Low | 52.2 | Low | 163 Ų | 163 | 106.5 Ų | 106.5 | 72% | 0.715 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -55.2 | -34.3 | 175.7 | -175.1 | -102.3 | 0 | 0 | 0 | 112.4 | R491 L492 | F488-R491 PolarHBondContact O-N 3.43Å; F488-L492 HydrophobicContact CD1-CD1 3.58Å; F488-L492 HydrophobicContact CE1-CD1 3.18Å; F488-L492 HydrophobicContact CE2-CD1 4.29Å; F488-L492 HydrophobicContact CG-CD1 4.29Å; F488-L492 HydrophobicContact CZ-CD1 3.59Å; F488-L492 WeakPolarHBondContact O-CD1 3.41Å; F488-L492 PolarHBondContact O-N 3.29Å |
| 489 | A | 60 | Low | 52.9 | Low | 60 Ų | 60 | 108.2 Ų | 108.2 | 50% | 0.496 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.3 | -45.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | T487 R491 L492 I493 | T487-A489 PolarHBondContact O-N 2.86Å; T487-A489 VanDerWaalsContact O-N 3.15Å; A489-R491 VanDerWaalsContact C-N 3.29Å; A489-R491 PolarHBondContact O-N 3.32Å; A489-L492 WeakPolarHBondContact O-CB 3.24Å; A489-L492 PolarHBondContact O-N 3.03Å; A489-I493 WeakPolarHBondContact O-CG1 3.41Å; A489-I493 PolarHBondContact O-N 2.98Å |
| 490 | E | 58.2 | Low | 54.5 | Low | 98 Ų | 98 | 106.2 Ų | 106.2 | 46% | 0.458 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.4 | -34.1 | 175.8 | -74.4 | 168.2 | 157.1 | 0 | 0 | 112.1 | E486 T487 I493 G494 | E486-E490 HydrophobicContact CB-CB 4.41Å; T487-E490 PolarHBondContact N-OE2 3.22Å; T487-E490 PolarHBondContact O-N 3.23Å; T487-E490 VanDerWaalsContact O-N 3.07Å; T487-E490 WeakPolarHBondContact OG1-CG 3.22Å; T487-E490 PolarHBondContact OG1-N 2.9Å; T487-E490 PolarHBondContact OG1-OE2 2.91Å; T487-E490 VanDerWaalsContact OG1-OE2 3.13Å; E490-I493 CarbonylContact O-C 3.32Å; E490-I493 WeakPolarHBondContact O-CA 3.41Å; E490-I493 WeakPolarHBondContact O-CB 3.5Å; E490-I493 PolarHBondContact O-N 2.86Å; E490-I493 VanDerWaalsContact O-N 3.15Å; E490-G494 PolarHBondContact O-N 3.15Å |
| 491 | R | 62 | Low | 55.9 | Low | 98 Ų | 98 | 99.1 Ų | 99.1 | 37% | 0.37 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.5 | -41.3 | 172.6 | -64.6 | 171.2 | -163.4 | -161.7 | -3.4 | 112.3 | S251 E486 T487 F488 A489 I493 G494 L495 | S251-R491 PolarHBondContact OG-NH1 2.83Å; E486-R491 HydrophobicContact CB-CG 3.96Å; E486-R491 PolarHBondContact O-NE 3.3Å; E486-R491 PolarHBondContact O-NH2 3.45Å; T487-R491 WeakPolarHBondContact O-CG 3.12Å; T487-R491 PolarHBondContact O-N 3.26Å; F488-R491 PolarHBondContact O-N 3.43Å; A489-R491 VanDerWaalsContact C-N 3.29Å; A489-R491 PolarHBondContact O-N 3.32Å; R491-I493 VanDerWaalsContact C-N 3.29Å; R491-G494 PolarHBondContact O-N 3.49Å; R491-L495 WeakPolarHBondContact O-CB 3.31Å; R491-L495 PolarHBondContact O-N 3.44Å |
| 492 | L | 55 | Low | 57.5 | Low | 89 Ų | 89 | 103.9 Ų | 103.9 | 47% | 0.466 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.7 | -36 | 171.7 | -100.9 | 112.4 | 0 | 0 | 0 | 111.8 | F488 A489 L495 T496 | F488-L492 HydrophobicContact CD1-CD1 3.58Å; F488-L492 HydrophobicContact CE1-CD1 3.18Å; F488-L492 HydrophobicContact CE2-CD1 4.29Å; F488-L492 HydrophobicContact CG-CD1 4.29Å; F488-L492 HydrophobicContact CZ-CD1 3.59Å; F488-L492 WeakPolarHBondContact O-CD1 3.41Å; F488-L492 PolarHBondContact O-N 3.29Å; A489-L492 WeakPolarHBondContact O-CB 3.24Å; A489-L492 PolarHBondContact O-N 3.03Å; L492-L495 VanDerWaalsContact O-CB 3.24Å; L492-L495 WeakPolarHBondContact O-CB 3.39Å; L492-T496 PolarHBondContact O-N 2.86Å; L492-T496 PolarHBondContact O-OG1 2.75Å |
| 493 | I | 65.5 | Low | 58.6 | Low | 97 Ų | 97 | 98.7 Ų | 98.7 | 50% | 0.497 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.4 | -44.5 | 174.2 | -67.3 | 165.3 | 0 | 0 | 0 | 110.4 | A489 E490 R491 L495 T496 E497 | A489-I493 WeakPolarHBondContact O-CG1 3.41Å; A489-I493 PolarHBondContact O-N 2.98Å; E490-I493 CarbonylContact O-C 3.32Å; E490-I493 WeakPolarHBondContact O-CA 3.41Å; E490-I493 WeakPolarHBondContact O-CB 3.5Å; E490-I493 PolarHBondContact O-N 2.86Å; E490-I493 VanDerWaalsContact O-N 3.15Å; R491-I493 VanDerWaalsContact C-N 3.29Å; I493-L495 VanDerWaalsContact C-N 3.32Å; I493-L495 PolarHBondContact O-N 3.35Å; I493-T496 CarbonylContact O-C 3.45Å; I493-T496 VanDerWaalsContact O-CA 3.26Å; I493-T496 WeakPolarHBondContact O-CA 3.35Å; I493-T496 WeakPolarHBondContact O-CB 3.29Å; I493-T496 PolarHBondContact O-N 2.95Å; I493-T496 PolarHBondContact O-OG1 3.44Å; I493-E497 PolarHBondContact O-N 3.46Å |
| 494 | G | 58.8 | Low | 59.9 | Low | 29 Ų | 29 | 98 Ų | 98 | 30% | 0.299 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.2 | -35.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | E490 R491 T496 E497 M498 | E490-G494 PolarHBondContact O-N 3.15Å; R491-G494 PolarHBondContact O-N 3.49Å; G494-T496 PolarHBondContact O-N 2.81Å; G494-E497 WeakPolarHBondContact O-CB 3.27Å; G494-E497 PolarHBondContact O-N 3.3Å; G494-M498 PolarHBondContact O-N 2.89Å |
| 495 | L | 51.5 | Low | 61.4 | Low | 68 Ų | 68 | 97.8 Ų | 97.8 | 36% | 0.356 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -54.5 | -39.2 | 166.1 | -108.2 | 145.3 | 0 | 0 | 0 | 112 | L255 R491 L492 I493 E497 | L255-L495 HydrophobicContact CD1-CD1 3.78Å; L255-L495 HydrophobicContact CD1-CD2 4.08Å; L255-L495 HydrophobicContact CD1-CG 4.05Å; L255-L495 HydrophobicContact CD2-CD1 4.26Å; L255-L495 HydrophobicContact CD2-CG 4Å; R491-L495 WeakPolarHBondContact O-CB 3.31Å; R491-L495 PolarHBondContact O-N 3.44Å; L492-L495 VanDerWaalsContact O-CB 3.24Å; L492-L495 WeakPolarHBondContact O-CB 3.39Å; I493-L495 VanDerWaalsContact C-N 3.32Å; I493-L495 PolarHBondContact O-N 3.35Å; L495-E497 VanDerWaalsContact C-N 3.33Å |
| 496 | T | 57.3 | Low | 62.5 | Low | 57 Ų | 57 | 96 Ų | 96 | 35% | 0.35 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -75.1 | -24.8 | 178 | -39.7 | 0 | 0 | 0 | 0 | 111.9 | L492 I493 G494 F499 R504 | L492-T496 PolarHBondContact O-N 2.86Å; L492-T496 PolarHBondContact O-OG1 2.75Å; I493-T496 CarbonylContact O-C 3.45Å; I493-T496 VanDerWaalsContact O-CA 3.26Å; I493-T496 WeakPolarHBondContact O-CA 3.35Å; I493-T496 WeakPolarHBondContact O-CB 3.29Å; I493-T496 PolarHBondContact O-N 2.95Å; I493-T496 PolarHBondContact O-OG1 3.44Å; G494-T496 PolarHBondContact O-N 2.81Å; T496-F499 PolarHBondContact O-N 2.96Å; T496-R504 HydrophobicContact CG2-CB 4.36Å; T496-R504 HydrophobicContact CG2-CG 3.49Å; T496-R504 VanDerWaalsContact CG2-CG 3.49Å |
| 497 | E | 62.1 | Low | 63.1 | Low | 143 Ų | 143 | 94.8 Ų | 94.8 | 67% | 0.668 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -75.9 | -20.2 | 176 | -66.7 | -165.3 | 162.6 | 0 | 0 | 114.1 | I493 G494 L495 F499 | I493-E497 PolarHBondContact O-N 3.46Å; G494-E497 WeakPolarHBondContact O-CB 3.27Å; G494-E497 PolarHBondContact O-N 3.3Å; L495-E497 VanDerWaalsContact C-N 3.33Å; E497-F499 PolarHBondContact O-N 3.37Å; E497-F499 VanDerWaalsContact O-N 3.13Å |
| 498 | M | 55.3 | Low | 63.7 | Low | 91 Ų | 91 | 100.9 Ų | 100.9 | 45% | 0.448 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.2 | -30.5 | 168.2 | -71.2 | -171.6 | 162.8 | 0 | 0 | 110.8 | P323 G494 | P323-M498 HydrophobicContact CB-CB 4.41Å; P323-M498 WeakPolarHBondContact CB-O 3.49Å; P323-M498 HydrophobicContact CG-CB 4.13Å; P323-M498 WeakPolarHBondContact CG-O 3.29Å; G494-M498 PolarHBondContact O-N 2.89Å |
| 499 | F | 58.5 | Low | 65.1 | Low | 81 Ų | 81 | 102 Ų | 102 | 36% | 0.355 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -92 | 139.4 | -177.5 | -57.2 | -56.3 | 0 | 0 | 0 | 112.4 | P323 I327 T496 E497 G501 L503 | P323-F499 HydrophobicContact CB-CD1 4.17Å; P323-F499 HydrophobicContact CB-CE1 4.42Å; I327-F499 HydrophobicContact CD1-CD1 3.15Å; I327-F499 HydrophobicContact CD1-CE1 3.44Å; I327-F499 VanDerWaalsContact CD1-CE1 3.44Å; I327-F499 HydrophobicContact CD1-CG 4.21Å; I327-F499 HydrophobicContact CG1-CD1 3.78Å; I327-F499 HydrophobicContact CG1-CE1 3.47Å; I327-F499 VanDerWaalsContact CG1-CE1 3.47Å; T496-F499 PolarHBondContact O-N 2.96Å; E497-F499 PolarHBondContact O-N 3.37Å; E497-F499 VanDerWaalsContact O-N 3.13Å; F499-G501 PolarHBondContact O-N 3.03Å; F499-L503 HydrophobicContact CB-CD2 4.12Å; F499-L503 HydrophobicContact CD1-CD2 4.25Å; F499-L503 HydrophobicContact CG-CD2 4.31Å |
| 500 | P | 68.2 | Low | 65.9 | Low | 53 Ų | 53 | 102 Ų | 102 | 34% | 0.344 | 49% | 0.488 | S | S | . | . | trans | -56.7 | 143.9 | 178.9 | 22.1 | -31.7 | 0 | 0 | 0 | 110.6 | R502 L503 R504 | P500-R502 PolarHBondContact O-N 3.48Å; P500-L503 HydrophobicContact CG-CB 4.03Å; P500-L503 WeakPolarHBondContact O-CA 3.42Å; P500-L503 WeakPolarHBondContact O-CB 3.35Å; P500-L503 PolarHBondContact O-N 3.47Å; P500-R504 PolarHBondContact O-N 3.15Å; P500-R504 VanDerWaalsContact O-N 3.1Å | ||
| 501 | G | 66.4 | Low | 66.8 | Low | 40 Ų | 40 | 99.3 Ų | 99.3 | 41% | 0.412 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -56.1 | -27.9 | -172.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | F499 K505 | F499-G501 PolarHBondContact O-N 3.03Å; G501-K505 WeakPolarHBondContact O-CG 3.29Å; G501-K505 PolarHBondContact O-N 3.1Å; G501-K505 VanDerWaalsContact O-N 3.12Å |
| 502 | R | 74.4 | Confident | 67.7 | Low | 229 Ų | 229 | 97.3 Ų | 97.3 | 86% | 0.864 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.5 | -44.4 | 172.7 | -64.4 | -176.1 | -174.6 | -177 | 2 | 111.8 | P500 K505 F506 | P500-R502 PolarHBondContact O-N 3.48Å; R502-K505 PolarHBondContact O-N 2.83Å; R502-F506 WeakPolarHBondContact O-CB 3.19Å; R502-F506 PolarHBondContact O-N 3.45Å |
| 503 | L | 64.2 | Low | 69.1 | Low | 61 Ų | 61 | 95.3 Ų | 95.3 | 32% | 0.319 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -71.2 | -40.1 | -180 | -163 | 80 | 0 | 0 | 0 | 111.4 | I327 F499 P500 K505 F506 A507 | I327-L503 HydrophobicContact CD1-CD2 3.21Å; I327-L503 HydrophobicContact CG1-CD2 4.28Å; I327-L503 HydrophobicContact CG2-CD2 4.39Å; F499-L503 HydrophobicContact CB-CD2 4.12Å; F499-L503 HydrophobicContact CD1-CD2 4.25Å; F499-L503 HydrophobicContact CG-CD2 4.31Å; P500-L503 HydrophobicContact CG-CB 4.03Å; P500-L503 WeakPolarHBondContact O-CA 3.42Å; P500-L503 WeakPolarHBondContact O-CB 3.35Å; P500-L503 PolarHBondContact O-N 3.47Å; L503-K505 VanDerWaalsContact C-N 3.3Å; L503-K505 PolarHBondContact O-N 2.7Å; L503-F506 CarbonylContact O-C 3.53Å; L503-F506 PolarHBondContact O-N 3.19Å; L503-F506 VanDerWaalsContact O-N 3.12Å; L503-A507 WeakPolarHBondContact O-CB 3.43Å; L503-A507 PolarHBondContact O-N 3.39Å |
| 504 | R | 68.5 | Low | 70 | Confident | 129 Ų | 129 | 93.5 Ų | 93.5 | 49% | 0.487 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56.9 | -44.3 | 173.3 | -178.3 | 168.1 | 69.9 | 101.1 | -5.6 | 112 | T496 P500 R508 | T496-R504 HydrophobicContact CG2-CB 4.36Å; T496-R504 HydrophobicContact CG2-CG 3.49Å; T496-R504 VanDerWaalsContact CG2-CG 3.49Å; P500-R504 PolarHBondContact O-N 3.15Å; P500-R504 VanDerWaalsContact O-N 3.1Å; R504-R508 WeakPolarHBondContact O-CB 3.35Å; R504-R508 PolarHBondContact O-N 3.35Å |
| 505 | K | 76.6 | Confident | 71.3 | Confident | 141 Ų | 141 | 100.9 Ų | 100.9 | 61% | 0.613 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65 | -41.5 | 174.9 | -73.3 | 179.2 | -176.3 | -177.9 | 0 | 111.8 | G501 R502 L503 R509 | G501-K505 WeakPolarHBondContact O-CG 3.29Å; G501-K505 PolarHBondContact O-N 3.1Å; G501-K505 VanDerWaalsContact O-N 3.12Å; R502-K505 PolarHBondContact O-N 2.83Å; L503-K505 VanDerWaalsContact C-N 3.3Å; L503-K505 PolarHBondContact O-N 2.7Å; K505-R509 WeakPolarHBondContact O-CB 3.23Å; K505-R509 VanDerWaalsContact O-CG 3.32Å; K505-R509 WeakPolarHBondContact O-CG 3.48Å; K505-R509 PolarHBondContact O-N 3.06Å |
| 506 | F | 73.5 | Confident | 73.1 | Confident | 130 Ų | 130 | 102.5 Ų | 102.5 | 57% | 0.57 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.8 | -50.1 | 177.6 | -178.1 | -103 | 0 | 0 | 0 | 112.2 | R502 L503 R508 R509 C510 | R502-F506 WeakPolarHBondContact O-CB 3.19Å; R502-F506 PolarHBondContact O-N 3.45Å; L503-F506 CarbonylContact O-C 3.53Å; L503-F506 PolarHBondContact O-N 3.19Å; L503-F506 VanDerWaalsContact O-N 3.12Å; F506-R508 VanDerWaalsContact C-N 3.33Å; F506-R508 PolarHBondContact O-N 2.66Å; F506-R509 WeakPolarHBondContact O-CA 3.39Å; F506-R509 WeakPolarHBondContact O-CB 3.29Å; F506-R509 PolarHBondContact O-N 3.22Å; F506-R509 VanDerWaalsContact O-N 3.08Å; F506-C510 PolarHBondContact O-N 3.4Å; F506-C510 PolarHBondContact O-SG 2.86Å |
| 507 | A | 71.8 | Confident | 74 | Confident | 59 Ų | 59 | 103 Ų | 103 | 49% | 0.488 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -58.9 | -42.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L503 R509 C510 G511 | L503-A507 WeakPolarHBondContact O-CB 3.43Å; L503-A507 PolarHBondContact O-N 3.39Å; A507-R509 PolarHBondContact O-N 3.24Å; A507-C510 PolarHBondContact O-N 3.42Å; A507-G511 PolarHBondContact O-N 2.69Å |
| 508 | R | 76.8 | Confident | 74.7 | Confident | 203 Ų | 203 | 99.8 Ų | 99.8 | 77% | 0.766 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -62.7 | -40.7 | 174.1 | -173 | -179.6 | 169.5 | 118.6 | -1.9 | 111.9 | R504 F506 G511 S512 | R504-R508 WeakPolarHBondContact O-CB 3.35Å; R504-R508 PolarHBondContact O-N 3.35Å; F506-R508 VanDerWaalsContact C-N 3.33Å; F506-R508 PolarHBondContact O-N 2.66Å; R508-G511 PolarHBondContact O-N 2.86Å; R508-S512 WeakPolarHBondContact O-CB 3.28Å; R508-S512 PolarHBondContact O-N 3.25Å; R508-S512 PolarHBondContact O-OG 3.06Å; R508-S512 VanDerWaalsContact O-OG 3.07Å |
| 509 | R | 82.5 | Confident | 76.1 | Confident | 186 Ų | 186 | 98.2 Ų | 98.2 | 70% | 0.702 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.9 | -50.2 | 174.5 | -78 | 177.5 | 179.7 | -172.1 | -0.9 | 111 | K505 F506 A507 G511 S512 A513 | K505-R509 WeakPolarHBondContact O-CB 3.23Å; K505-R509 VanDerWaalsContact O-CG 3.32Å; K505-R509 WeakPolarHBondContact O-CG 3.48Å; K505-R509 PolarHBondContact O-N 3.06Å; F506-R509 WeakPolarHBondContact O-CA 3.39Å; F506-R509 WeakPolarHBondContact O-CB 3.29Å; F506-R509 PolarHBondContact O-N 3.22Å; F506-R509 VanDerWaalsContact O-N 3.08Å; A507-R509 PolarHBondContact O-N 3.24Å; R509-G511 PolarHBondContact O-N 2.88Å; R509-S512 WeakPolarHBondContact CA-OG 3.3Å; R509-S512 PolarHBondContact O-N 3.49Å; R509-S512 PolarHBondContact O-OG 3.32Å; R509-A513 VanDerWaalsContact O-CB 3.29Å; R509-A513 WeakPolarHBondContact O-CB 3.24Å; R509-A513 PolarHBondContact O-N 3.49Å |
| 510 | C | 77.9 | Confident | 77.5 | Confident | 60 Ų | 60 | 97.2 Ų | 97.2 | 41% | 0.405 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59 | -45.2 | 176.8 | -69.2 | 0 | 0 | 0 | 0 | 112 | F506 A507 A513 A514 | F506-C510 PolarHBondContact O-N 3.4Å; F506-C510 PolarHBondContact O-SG 2.86Å; A507-C510 PolarHBondContact O-N 3.42Å; C510-A513 PolarHBondContact O-N 3.07Å; C510-A514 VanDerWaalsContact O-CB 3.31Å; C510-A514 WeakPolarHBondContact O-CB 3.4Å; C510-A514 PolarHBondContact O-N 3.21Å |
| 511 | G | 76.8 | Confident | 78.3 | Confident | 41 Ų | 41 | 100.3 Ų | 100.3 | 42% | 0.423 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | A507 R508 R509 A514 W515 | A507-G511 PolarHBondContact O-N 2.69Å; R508-G511 PolarHBondContact O-N 2.86Å; R509-G511 PolarHBondContact O-N 2.88Å; G511-A514 PolarHBondContact O-N 3.22Å; G511-W515 WeakPolarHBondContact O-CB 3.42Å; G511-W515 PolarHBondContact O-N 3.45Å |
| 512 | S | 81 | Confident | 79.3 | Confident | 56 Ų | 56 | 105.1 Ų | 105.1 | 39% | 0.392 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66 | -37.9 | 175.8 | 65.2 | 0 | 0 | 0 | 0 | 112.6 | R508 R509 W515 N516 | R508-S512 WeakPolarHBondContact O-CB 3.28Å; R508-S512 PolarHBondContact O-N 3.25Å; R508-S512 PolarHBondContact O-OG 3.06Å; R508-S512 VanDerWaalsContact O-OG 3.07Å; R509-S512 WeakPolarHBondContact CA-OG 3.3Å; R509-S512 PolarHBondContact O-N 3.49Å; R509-S512 PolarHBondContact O-OG 3.32Å; S512-W515 PolarHBondContact O-N 3.46Å; S512-N516 VanDerWaalsContact O-CB 3.26Å; S512-N516 WeakPolarHBondContact O-CB 3.32Å; S512-N516 PolarHBondContact O-N 2.79Å; S512-N516 PolarHBondContact O-ND2 3.43Å; S512-N516 PolarHBondContact O-OD1 3.07Å |
| 513 | A | 83.5 | Confident | 79.9 | Confident | 48 Ų | 48 | 97.9 Ų | 97.9 | 40% | 0.397 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.2 | -46.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | R509 C510 W515 N516 S517 | R509-A513 VanDerWaalsContact O-CB 3.29Å; R509-A513 WeakPolarHBondContact O-CB 3.24Å; R509-A513 PolarHBondContact O-N 3.49Å; C510-A513 PolarHBondContact O-N 3.07Å; A513-W515 PolarHBondContact O-N 3.36Å; A513-N516 PolarHBondContact O-N 2.75Å; A513-S517 VanDerWaalsContact O-CB 3.27Å; A513-S517 WeakPolarHBondContact O-CB 3.44Å; A513-S517 PolarHBondContact O-N 3Å; A513-S517 PolarHBondContact O-OG 3.36Å |
| 514 | A | 84 | Confident | 81.2 | Confident | 59 Ų | 59 | 102 Ų | 102 | 49% | 0.488 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.4 | -43.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | C510 G511 S517 S518 | C510-A514 VanDerWaalsContact O-CB 3.31Å; C510-A514 WeakPolarHBondContact O-CB 3.4Å; C510-A514 PolarHBondContact O-N 3.21Å; G511-A514 PolarHBondContact O-N 3.22Å; A514-S517 PolarHBondContact O-N 2.93Å; A514-S518 VanDerWaalsContact O-CB 3.24Å; A514-S518 WeakPolarHBondContact O-CB 3.41Å; A514-S518 PolarHBondContact O-N 3.38Å |
| 515 | W | 87.2 | Confident | 82.1 | Confident | 184 Ų | 184 | 98 Ų | 98 | 70% | 0.697 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63 | -46.4 | 175.9 | -178.1 | -97.2 | 0 | 0 | 0 | 112.2 | G511 S512 A513 S518 T519 | G511-W515 WeakPolarHBondContact O-CB 3.42Å; G511-W515 PolarHBondContact O-N 3.45Å; S512-W515 PolarHBondContact O-N 3.46Å; A513-W515 PolarHBondContact O-N 3.36Å; W515-S518 PolarHBondContact O-N 2.9Å; W515-T519 WeakPolarHBondContact O-CB 3.49Å; W515-T519 PolarHBondContact O-N 3.2Å; W515-T519 PolarHBondContact O-OG1 2.89Å |
| 516 | N | 88.9 | Confident | 82.5 | Confident | 101 Ų | 101 | 99.1 Ų | 99.1 | 54% | 0.54 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.9 | -42.7 | 177.6 | -68.7 | -14.3 | 0 | 0 | 0 | 111.1 | S512 A513 T519 A520 | S512-N516 VanDerWaalsContact O-CB 3.26Å; S512-N516 WeakPolarHBondContact O-CB 3.32Å; S512-N516 PolarHBondContact O-N 2.79Å; S512-N516 PolarHBondContact O-ND2 3.43Å; S512-N516 PolarHBondContact O-OD1 3.07Å; A513-N516 PolarHBondContact O-N 2.75Å; N516-T519 PolarHBondContact O-N 2.92Å; N516-A520 WeakPolarHBondContact O-CB 3.45Å; N516-A520 PolarHBondContact O-N 3.15Å |
| 517 | S | 76.7 | Confident | 83.1 | Confident | 68 Ų | 68 | 96.3 Ų | 96.3 | 48% | 0.476 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 174.9 | -67.3 | 0 | 0 | 0 | 0 | 112 | A513 A514 A520 L521 | A513-S517 VanDerWaalsContact O-CB 3.27Å; A513-S517 WeakPolarHBondContact O-CB 3.44Å; A513-S517 PolarHBondContact O-N 3Å; A513-S517 PolarHBondContact O-OG 3.36Å; A514-S517 PolarHBondContact O-N 2.93Å; S517-A520 PolarHBondContact O-N 3.04Å; S517-L521 VanDerWaalsContact O-CB 3.29Å; S517-L521 WeakPolarHBondContact O-CB 3.16Å; S517-L521 VanDerWaalsContact O-CG 3.27Å; S517-L521 WeakPolarHBondContact O-CG 3.38Å; S517-L521 PolarHBondContact O-N 3.35Å |
| 518 | S | 76 | Confident | 83.9 | Confident | 76 Ų | 76 | 94.8 Ų | 94.8 | 53% | 0.531 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.4 | -42.5 | 179 | -160.7 | 0 | 0 | 0 | 0 | 111.4 | A514 W515 L521 F522 | A514-S518 VanDerWaalsContact O-CB 3.24Å; A514-S518 WeakPolarHBondContact O-CB 3.41Å; A514-S518 PolarHBondContact O-N 3.38Å; W515-S518 PolarHBondContact O-N 2.9Å; S518-L521 PolarHBondContact O-N 3.25Å; S518-F522 WeakPolarHBondContact O-CB 3.26Å; S518-F522 PolarHBondContact O-N 3Å |
| 519 | T | 85.3 | Confident | 84.2 | Confident | 58 Ų | 58 | 89.1 Ų | 89.1 | 36% | 0.356 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.6 | -41.5 | 174.7 | -51.5 | 0 | 0 | 0 | 0 | 111.4 | W515 N516 F522 N523 | W515-T519 WeakPolarHBondContact O-CB 3.49Å; W515-T519 PolarHBondContact O-N 3.2Å; W515-T519 PolarHBondContact O-OG1 2.89Å; N516-T519 PolarHBondContact O-N 2.92Å; T519-F522 PolarHBondContact O-N 2.9Å; T519-N523 WeakPolarHBondContact O-CB 3.5Å; T519-N523 PolarHBondContact O-N 2.64Å; T519-N523 PolarHBondContact O-ND2 2.85Å |
| 520 | A | 87.1 | Confident | 84.4 | Confident | 59 Ų | 59 | 88.7 Ų | 88.7 | 49% | 0.488 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.2 | -45 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | N516 S517 F522 N523 F524 | N516-A520 WeakPolarHBondContact O-CB 3.45Å; N516-A520 PolarHBondContact O-N 3.15Å; S517-A520 PolarHBondContact O-N 3.04Å; A520-F522 VanDerWaalsContact C-N 3.34Å; A520-F522 PolarHBondContact O-N 3.14Å; A520-N523 PolarHBondContact O-N 2.92Å; A520-F524 WeakPolarHBondContact O-CB 3.28Å; A520-F524 PolarHBondContact O-N 2.6Å |
| 521 | L | 85.7 | Confident | 84.9 | Confident | 118 Ų | 118 | 92 Ų | 92 | 62% | 0.618 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.2 | -41.4 | 175.6 | -79.6 | 166.7 | 0 | 0 | 0 | 111.6 | S517 S518 F524 A525 | S517-L521 VanDerWaalsContact O-CB 3.29Å; S517-L521 WeakPolarHBondContact O-CB 3.16Å; S517-L521 VanDerWaalsContact O-CG 3.27Å; S517-L521 WeakPolarHBondContact O-CG 3.38Å; S517-L521 PolarHBondContact O-N 3.35Å; S518-L521 PolarHBondContact O-N 3.25Å; L521-F524 PolarHBondContact O-N 2.95Å; L521-A525 VanDerWaalsContact O-CB 3.22Å; L521-A525 WeakPolarHBondContact O-CB 3.48Å; L521-A525 PolarHBondContact O-N 3.24Å |
| 522 | F | 86.3 | Confident | 85.4 | Confident | 142 Ų | 142 | 95.1 Ų | 95.1 | 62% | 0.623 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.4 | -45.7 | 175.9 | -178 | -98 | 0 | 0 | 0 | 111.7 | S518 T519 A520 F524 A525 R526 | S518-F522 WeakPolarHBondContact O-CB 3.26Å; S518-F522 PolarHBondContact O-N 3Å; T519-F522 PolarHBondContact O-N 2.9Å; A520-F522 VanDerWaalsContact C-N 3.34Å; A520-F522 PolarHBondContact O-N 3.14Å; F522-F524 PolarHBondContact O-N 3.2Å; F522-A525 PolarHBondContact O-N 3.48Å; F522-R526 WeakPolarHBondContact O-CB 3.26Å; F522-R526 PolarHBondContact O-N 3.24Å |
| 523 | N | 87.8 | Confident | 85.9 | Confident | 77 Ų | 77 | 96.5 Ų | 96.5 | 41% | 0.412 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.6 | -40.8 | 176.3 | -76.9 | -34.4 | 0 | 0 | 0 | 112.2 | T519 A520 S527 | T519-N523 WeakPolarHBondContact O-CB 3.5Å; T519-N523 PolarHBondContact O-N 2.64Å; T519-N523 PolarHBondContact O-ND2 2.85Å; A520-N523 PolarHBondContact O-N 2.92Å; N523-S527 PolarHBondContact O-N 3.33Å; N523-S527 VanDerWaalsContact O-N 3.12Å; N523-S527 PolarHBondContact O-OG 2.97Å |
| 524 | F | 90.6 | Very high | 86.2 | Confident | 146 Ų | 146 | 95.8 Ų | 95.8 | 64% | 0.64 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.5 | -48.2 | 174.3 | 176.2 | -100.3 | 0 | 0 | 0 | 111.5 | A520 L521 F522 R526 S527 A528 | A520-F524 WeakPolarHBondContact O-CB 3.28Å; A520-F524 PolarHBondContact O-N 2.6Å; L521-F524 PolarHBondContact O-N 2.95Å; F522-F524 PolarHBondContact O-N 3.2Å; F524-R526 VanDerWaalsContact C-N 3.3Å; F524-R526 PolarHBondContact O-N 3.21Å; F524-S527 PolarHBondContact O-N 3.31Å; F524-A528 HydrophobicContact CE1-CB 4.39Å; F524-A528 HydrophobicContact CZ-CB 4.49Å; F524-A528 VanDerWaalsContact O-CB 3.3Å; F524-A528 WeakPolarHBondContact O-CB 3.28Å; F524-A528 PolarHBondContact O-N 2.88Å |
| 525 | A | 88.9 | Confident | 86.5 | Confident | 46 Ų | 46 | 95.4 Ų | 95.4 | 38% | 0.38 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.7 | -41 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | L521 F522 A528 T529 | L521-A525 VanDerWaalsContact O-CB 3.22Å; L521-A525 WeakPolarHBondContact O-CB 3.48Å; L521-A525 PolarHBondContact O-N 3.24Å; F522-A525 PolarHBondContact O-N 3.48Å; A525-A528 PolarHBondContact O-N 3.16Å; A525-T529 VanDerWaalsContact O-CB 3.29Å; A525-T529 WeakPolarHBondContact O-CB 3.49Å; A525-T529 PolarHBondContact O-N 3.2Å; A525-T529 PolarHBondContact O-OG1 2.66Å |
| 526 | R | 85.2 | Confident | 86.4 | Confident | 164 Ų | 164 | 89.9 Ų | 89.9 | 62% | 0.619 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -60.1 | -48.1 | 175.1 | -169.6 | 179.2 | 73 | 100.8 | 1.3 | 111.7 | F522 F524 W530 | F522-R526 WeakPolarHBondContact O-CB 3.26Å; F522-R526 PolarHBondContact O-N 3.24Å; F524-R526 VanDerWaalsContact C-N 3.3Å; F524-R526 PolarHBondContact O-N 3.21Å; R526-W530 PolarHBondContact O-N 2.9Å |
| 527 | S | 85.6 | Confident | 86.4 | Confident | 71 Ų | 71 | 89 Ų | 89 | 50% | 0.497 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -67.2 | -42.1 | 177.8 | -65.6 | 0 | 0 | 0 | 0 | 112.6 | N523 F524 W530 F531 | N523-S527 PolarHBondContact O-N 3.33Å; N523-S527 VanDerWaalsContact O-N 3.12Å; N523-S527 PolarHBondContact O-OG 2.97Å; F524-S527 PolarHBondContact O-N 3.31Å; S527-W530 PolarHBondContact O-N 2.96Å; S527-F531 PolarHBondContact O-N 3.11Å; S527-F531 VanDerWaalsContact O-N 3.07Å |
| 528 | A | 88.3 | Confident | 87.1 | Confident | 28 Ų | 28 | 91.9 Ų | 91.9 | 23% | 0.231 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -64.5 | -41.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | F524 A525 W530 F531 I532 | F524-A528 HydrophobicContact CE1-CB 4.39Å; F524-A528 HydrophobicContact CZ-CB 4.49Å; F524-A528 VanDerWaalsContact O-CB 3.3Å; F524-A528 WeakPolarHBondContact O-CB 3.28Å; F524-A528 PolarHBondContact O-N 2.88Å; A525-A528 PolarHBondContact O-N 3.16Å; A528-W530 VanDerWaalsContact C-N 3.34Å; A528-W530 PolarHBondContact O-N 3.13Å; A528-F531 PolarHBondContact O-N 2.88Å; A528-I532 VanDerWaalsContact O-CG1 3.28Å; A528-I532 WeakPolarHBondContact O-CG1 3.24Å; A528-I532 PolarHBondContact O-N 3.28Å |
| 529 | T | 84 | Confident | 87.6 | Confident | 83 Ų | 83 | 94.7 Ų | 94.7 | 51% | 0.509 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.4 | -45 | 176.5 | -57.3 | 0 | 0 | 0 | 0 | 110.8 | A525 F531 I532 V533 | A525-T529 VanDerWaalsContact O-CB 3.29Å; A525-T529 WeakPolarHBondContact O-CB 3.49Å; A525-T529 PolarHBondContact O-N 3.2Å; A525-T529 PolarHBondContact O-OG1 2.66Å; T529-F531 VanDerWaalsContact C-N 3.33Å; T529-F531 PolarHBondContact O-N 2.64Å; T529-I532 PolarHBondContact O-N 2.89Å; T529-V533 HydrophobicContact CG2-CG2 4.26Å; T529-V533 WeakPolarHBondContact O-CB 3.35Å; T529-V533 VanDerWaalsContact O-CG2 3.24Å; T529-V533 WeakPolarHBondContact O-CG2 3.25Å; T529-V533 PolarHBondContact O-N 3.5Å |
| 530 | W | 86.4 | Confident | 87.9 | Confident | 177 Ų | 177 | 96.7 Ų | 96.7 | 67% | 0.67 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60 | -43.9 | 176.3 | -175.2 | 93 | 0 | 0 | 0 | 111.9 | R526 S527 A528 T534 | R526-W530 PolarHBondContact O-N 2.9Å; S527-W530 PolarHBondContact O-N 2.96Å; A528-W530 VanDerWaalsContact C-N 3.34Å; A528-W530 PolarHBondContact O-N 3.13Å; W530-T534 HydrophobicContact CD2-CG2 3.99Å; W530-T534 HydrophobicContact CE3-CG2 4.23Å; W530-T534 HydrophobicContact CH2-CG2 4.02Å; W530-T534 HydrophobicContact CZ2-CG2 3.77Å; W530-T534 HydrophobicContact CZ3-CG2 4.24Å; W530-T534 WeakPolarHBondContact O-CB 3.29Å; W530-T534 VanDerWaalsContact O-CG2 3.32Å; W530-T534 WeakPolarHBondContact O-CG2 3.4Å; W530-T534 PolarHBondContact O-N 3.02Å; W530-T534 PolarHBondContact O-OG1 2.72Å |
| 531 | F | 86.8 | Confident | 88.1 | Confident | 131 Ų | 131 | 99.1 Ų | 99.1 | 58% | 0.575 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.2 | -43.3 | 178.9 | -171.3 | -93.1 | 0 | 0 | 0 | 112.4 | S527 A528 T529 T534 T535 | S527-F531 PolarHBondContact O-N 3.11Å; S527-F531 VanDerWaalsContact O-N 3.07Å; A528-F531 PolarHBondContact O-N 2.88Å; T529-F531 VanDerWaalsContact C-N 3.33Å; T529-F531 PolarHBondContact O-N 2.64Å; F531-T534 WeakPolarHBondContact CA-OG1 3.21Å; F531-T534 PolarHBondContact O-OG1 3.48Å; F531-T535 VanDerWaalsContact O-CB 3.27Å; F531-T535 WeakPolarHBondContact O-CB 3.27Å; F531-T535 PolarHBondContact O-N 2.97Å; F531-T535 PolarHBondContact O-OG1 3.34Å |
| 532 | I | 88.8 | Confident | 88.4 | Confident | 105 Ų | 105 | 97 Ų | 97 | 54% | 0.538 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65 | -46.3 | 178.5 | -68.5 | 165.5 | 0 | 0 | 0 | 110.4 | A528 T529 T535 T536 | A528-I532 VanDerWaalsContact O-CG1 3.28Å; A528-I532 WeakPolarHBondContact O-CG1 3.24Å; A528-I532 PolarHBondContact O-N 3.28Å; T529-I532 PolarHBondContact O-N 2.89Å; I532-T535 PolarHBondContact O-N 3.42Å; I532-T536 WeakPolarHBondContact O-CB 3.46Å; I532-T536 PolarHBondContact O-N 2.91Å; I532-T536 PolarHBondContact O-OG1 3.06Å |
| 533 | V | 90.4 | Very high | 88.6 | Confident | 86 Ų | 86 | 95.6 Ų | 95.6 | 52% | 0.521 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.3 | -46.4 | -179 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | T529 T536 T537 | T529-V533 HydrophobicContact CG2-CG2 4.26Å; T529-V533 WeakPolarHBondContact O-CB 3.35Å; T529-V533 VanDerWaalsContact O-CG2 3.24Å; T529-V533 WeakPolarHBondContact O-CG2 3.25Å; T529-V533 PolarHBondContact O-N 3.5Å; V533-T536 PolarHBondContact O-N 2.55Å; V533-T537 PolarHBondContact O-N 2.98Å; V533-T537 PolarHBondContact O-OG1 2.98Å |
| 534 | T | 91.4 | Very high | 88.6 | Confident | 33 Ų | 33 | 94.4 Ų | 94.4 | 20% | 0.202 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -65.2 | -44.3 | 179.2 | 48.6 | 0 | 0 | 0 | 0 | 112.4 | W530 F531 T536 T537 I538 | W530-T534 HydrophobicContact CD2-CG2 3.99Å; W530-T534 HydrophobicContact CE3-CG2 4.23Å; W530-T534 HydrophobicContact CH2-CG2 4.02Å; W530-T534 HydrophobicContact CZ2-CG2 3.77Å; W530-T534 HydrophobicContact CZ3-CG2 4.24Å; W530-T534 WeakPolarHBondContact O-CB 3.29Å; W530-T534 VanDerWaalsContact O-CG2 3.32Å; W530-T534 WeakPolarHBondContact O-CG2 3.4Å; W530-T534 PolarHBondContact O-N 3.02Å; W530-T534 PolarHBondContact O-OG1 2.72Å; F531-T534 WeakPolarHBondContact CA-OG1 3.21Å; F531-T534 PolarHBondContact O-OG1 3.48Å; T534-T536 VanDerWaalsContact C-N 3.34Å; T534-T536 PolarHBondContact O-N 3.3Å; T534-T537 WeakPolarHBondContact CA-OG1 3.35Å; T534-T537 PolarHBondContact O-N 3.46Å; T534-T537 PolarHBondContact O-OG1 3.35Å; T534-T537 VanDerWaalsContact O-OG1 3.11Å; T534-I538 VanDerWaalsContact O-CG1 3.25Å; T534-I538 WeakPolarHBondContact O-CG1 3.08Å; T534-I538 PolarHBondContact O-N 2.71Å |
| 535 | T | 88.8 | Confident | 88.7 | Confident | 51 Ų | 51 | 92.4 Ų | 92.4 | 31% | 0.313 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.8 | -42.8 | 177.2 | -54.2 | 0 | 0 | 0 | 0 | 111.1 | F531 I532 I538 M539 | F531-T535 VanDerWaalsContact O-CB 3.27Å; F531-T535 WeakPolarHBondContact O-CB 3.27Å; F531-T535 PolarHBondContact O-N 2.97Å; F531-T535 PolarHBondContact O-OG1 3.34Å; I532-T535 PolarHBondContact O-N 3.42Å; T535-I538 PolarHBondContact O-N 3.35Å; T535-M539 HydrophobicContact CG2-CG 4.49Å; T535-M539 WeakPolarHBondContact O-CB 2.96Å; T535-M539 VanDerWaalsContact O-CG 3.23Å; T535-M539 WeakPolarHBondContact O-CG 3.29Å; T535-M539 PolarHBondContact O-N 3.48Å |
| 536 | T | 86.6 | Confident | 88.7 | Confident | 68 Ų | 68 | 95.2 Ų | 95.2 | 42% | 0.417 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.9 | -40.2 | 177.9 | -55.3 | 0 | 0 | 0 | 0 | 111.5 | I532 V533 T534 M539 L540 | I532-T536 WeakPolarHBondContact O-CB 3.46Å; I532-T536 PolarHBondContact O-N 2.91Å; I532-T536 PolarHBondContact O-OG1 3.06Å; V533-T536 PolarHBondContact O-N 2.55Å; T534-T536 VanDerWaalsContact C-N 3.34Å; T534-T536 PolarHBondContact O-N 3.3Å; T536-M539 PolarHBondContact O-N 2.77Å; T536-L540 HydrophobicContact CG2-CD1 3.63Å; T536-L540 HydrophobicContact CG2-CG 4.23Å; T536-L540 WeakPolarHBondContact O-CB 3.42Å; T536-L540 VanDerWaalsContact O-CG 3.29Å; T536-L540 WeakPolarHBondContact O-CG 3.25Å; T536-L540 PolarHBondContact O-N 3.39Å |
| 537 | T | 88 | Confident | 89.1 | Confident | 82 Ų | 82 | 93.7 Ų | 93.7 | 50% | 0.503 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66 | -44.8 | 175.9 | 19.5 | 0 | 0 | 0 | 0 | 111.8 | V533 T534 M539 L540 L541 | V533-T537 PolarHBondContact O-N 2.98Å; V533-T537 PolarHBondContact O-OG1 2.98Å; T534-T537 WeakPolarHBondContact CA-OG1 3.35Å; T534-T537 PolarHBondContact O-N 3.46Å; T534-T537 PolarHBondContact O-OG1 3.35Å; T534-T537 VanDerWaalsContact O-OG1 3.11Å; T537-M539 VanDerWaalsContact C-N 3.3Å; T537-M539 PolarHBondContact O-N 3.01Å; T537-L540 PolarHBondContact O-N 3.41Å; T537-L541 VanDerWaalsContact O-CB 3.25Å; T537-L541 WeakPolarHBondContact O-CB 3.25Å; T537-L541 PolarHBondContact O-N 2.95Å |
| 538 | I | 91.3 | Very high | 89.4 | Confident | 128 Ų | 128 | 96.7 Ų | 96.7 | 66% | 0.656 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.8 | -39.1 | 178.4 | -67.3 | 165.5 | 0 | 0 | 0 | 111.3 | T534 T535 P542 | T534-I538 VanDerWaalsContact O-CG1 3.25Å; T534-I538 WeakPolarHBondContact O-CG1 3.08Å; T534-I538 PolarHBondContact O-N 2.71Å; T535-I538 PolarHBondContact O-N 3.35Å; I538-P542 VanDerWaalsContact O-CD 3.25Å; I538-P542 WeakPolarHBondContact O-CD 3.23Å |
| 539 | M | 87.3 | Confident | 89.6 | Confident | 135 Ų | 135 | 102.2 Ų | 102.2 | 67% | 0.665 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -70.7 | -40.3 | 178.1 | -73.4 | -92.1 | -158.3 | 0 | 0 | 113.1 | T535 T536 T537 | T535-M539 HydrophobicContact CG2-CG 4.49Å; T535-M539 WeakPolarHBondContact O-CB 2.96Å; T535-M539 VanDerWaalsContact O-CG 3.23Å; T535-M539 WeakPolarHBondContact O-CG 3.29Å; T535-M539 PolarHBondContact O-N 3.48Å; T536-M539 PolarHBondContact O-N 2.77Å; T537-M539 VanDerWaalsContact C-N 3.3Å; T537-M539 PolarHBondContact O-N 3.01Å |
| 540 | L | 90.6 | Very high | 89.9 | Confident | 100 Ų | 100 | 102.1 Ų | 102.1 | 52% | 0.524 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -85.3 | -23.9 | -174.4 | -68.1 | 178.5 | 0 | 0 | 0 | 113.7 | T536 T537 I543 A544 | T536-L540 HydrophobicContact CG2-CD1 3.63Å; T536-L540 HydrophobicContact CG2-CG 4.23Å; T536-L540 WeakPolarHBondContact O-CB 3.42Å; T536-L540 VanDerWaalsContact O-CG 3.29Å; T536-L540 WeakPolarHBondContact O-CG 3.25Å; T536-L540 PolarHBondContact O-N 3.39Å; T537-L540 PolarHBondContact O-N 3.41Å; L540-I543 PolarHBondContact O-N 3.49Å; L540-A544 PolarHBondContact O-N 3.44Å |
| 541 | L | 90.6 | Very high | 90.1 | Very high | 111 Ų | 111 | 96.6 Ų | 96.6 | 58% | 0.581 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.2 | -45.7 | -175.8 | -166.5 | 77.3 | 0 | 0 | 0 | 113.4 | T537 I543 A544 I545 | T537-L541 VanDerWaalsContact O-CB 3.25Å; T537-L541 WeakPolarHBondContact O-CB 3.25Å; T537-L541 PolarHBondContact O-N 2.95Å; L541-I543 VanDerWaalsContact C-N 3.34Å; L541-I543 PolarHBondContact O-N 3.33Å; L541-A544 PolarHBondContact O-N 3.27Å; L541-I545 HydrophobicContact CG-CD1 4.1Å; L541-I545 VanDerWaalsContact O-CG1 3.31Å; L541-I545 WeakPolarHBondContact O-CG1 3.35Å; L541-I545 PolarHBondContact O-N 3.03Å |
| 542 | P | 92.6 | Very high | 90.2 | Very high | 72 Ų | 72 | 96.5 Ų | 96.5 | 47% | 0.468 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.6 | -39.7 | 177.8 | -21.2 | 33.8 | 0 | 0 | 0 | 112.4 | I538 A544 I545 E546 | I538-P542 VanDerWaalsContact O-CD 3.25Å; I538-P542 WeakPolarHBondContact O-CD 3.23Å; P542-A544 VanDerWaalsContact C-N 3.34Å; P542-A544 PolarHBondContact O-N 3.44Å; P542-I545 PolarHBondContact O-N 2.89Å; P542-E546 WeakPolarHBondContact O-CB 3.31Å; P542-E546 PolarHBondContact O-N 3.35Å |
| 543 | I | 90.6 | Very high | 90.3 | Very high | 113 Ų | 113 | 96 Ų | 96 | 58% | 0.579 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65 | -41.4 | 179 | -60.1 | 172.4 | 0 | 0 | 0 | 110.4 | L540 L541 E546 K547 | L540-I543 PolarHBondContact O-N 3.49Å; L541-I543 VanDerWaalsContact C-N 3.34Å; L541-I543 PolarHBondContact O-N 3.33Å; I543-E546 PolarHBondContact O-N 2.95Å; I543-K547 WeakPolarHBondContact O-CB 3.36Å; I543-K547 PolarHBondContact O-N 2.97Å |
| 544 | A | 88.1 | Confident | 90.1 | Very high | 53 Ų | 53 | 96.9 Ų | 96.9 | 44% | 0.438 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L540 L541 P542 K547 E548 | L540-A544 PolarHBondContact O-N 3.44Å; L541-A544 PolarHBondContact O-N 3.27Å; P542-A544 VanDerWaalsContact C-N 3.34Å; P542-A544 PolarHBondContact O-N 3.44Å; A544-K547 PolarHBondContact O-N 3.45Å; A544-E548 WeakPolarHBondContact O-CG 3.47Å; A544-E548 PolarHBondContact O-N 2.93Å |
| 545 | I | 92 | Very high | 89.7 | Confident | 104 Ų | 104 | 100.7 Ų | 100.7 | 53% | 0.533 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.3 | -43.7 | 177.1 | -66.9 | 166 | 0 | 0 | 0 | 111.3 | L541 P542 K547 E548 R549 | L541-I545 HydrophobicContact CG-CD1 4.1Å; L541-I545 VanDerWaalsContact O-CG1 3.31Å; L541-I545 WeakPolarHBondContact O-CG1 3.35Å; L541-I545 PolarHBondContact O-N 3.03Å; P542-I545 PolarHBondContact O-N 2.89Å; I545-K547 VanDerWaalsContact C-N 3.3Å; I545-K547 PolarHBondContact O-N 3.42Å; I545-E548 PolarHBondContact O-N 3.49Å; I545-R549 WeakPolarHBondContact O-CB 3.47Å; I545-R549 PolarHBondContact O-N 3.19Å |
| 546 | E | 90.2 | Very high | 89.5 | Confident | 105 Ų | 105 | 102.7 Ų | 102.7 | 49% | 0.491 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.1 | -40.5 | 178.6 | -155.7 | 86.6 | -139.8 | 0 | 0 | 110.9 | P542 I543 R549 I550 | P542-E546 WeakPolarHBondContact O-CB 3.31Å; P542-E546 PolarHBondContact O-N 3.35Å; I543-E546 PolarHBondContact O-N 2.95Å; E546-R549 WeakPolarHBondContact O-CB 3.43Å; E546-R549 PolarHBondContact O-N 3.37Å; E546-I550 HydrophobicContact CG-CD1 4.36Å; E546-I550 VanDerWaalsContact O-CG1 3.29Å; E546-I550 WeakPolarHBondContact O-CG1 3.34Å; E546-I550 PolarHBondContact O-N 3.02Å |
| 547 | K | 91.9 | Very high | 89.2 | Confident | 131 Ų | 131 | 104 Ų | 104 | 57% | 0.57 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.3 | -49.7 | 176.2 | -172.7 | -168 | 172.1 | -163.5 | 0 | 111.5 | I543 A544 I545 R549 I550 D551 | I543-K547 WeakPolarHBondContact O-CB 3.36Å; I543-K547 PolarHBondContact O-N 2.97Å; A544-K547 PolarHBondContact O-N 3.45Å; I545-K547 VanDerWaalsContact C-N 3.3Å; I545-K547 PolarHBondContact O-N 3.42Å; K547-R549 VanDerWaalsContact C-N 3.25Å; K547-R549 PolarHBondContact O-N 2.88Å; K547-I550 PolarHBondContact O-N 2.93Å; K547-D551 WeakPolarHBondContact O-CB 3.29Å; K547-D551 PolarHBondContact O-N 3.27Å |
| 548 | E | 93.5 | Very high | 88.7 | Confident | 134 Ų | 134 | 106 Ų | 106 | 63% | 0.626 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.5 | -39.4 | 176.5 | -73.9 | -72.3 | 157.6 | 0 | 0 | 111.5 | A544 I545 D551 F552 | A544-E548 WeakPolarHBondContact O-CG 3.47Å; A544-E548 PolarHBondContact O-N 2.93Å; I545-E548 PolarHBondContact O-N 3.49Å; E548-D551 PolarHBondContact O-N 2.95Å; E548-F552 WeakPolarHBondContact O-CB 3.49Å; E548-F552 PolarHBondContact O-N 3.32Å |
| 549 | R | 91.1 | Very high | 88.1 | Confident | 145 Ų | 145 | 105.3 Ų | 105.3 | 55% | 0.547 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.8 | -46.6 | 175.9 | -177 | -175.1 | 172.4 | -165.4 | 1.5 | 111.9 | I545 E546 K547 F552 E553 | I545-R549 WeakPolarHBondContact O-CB 3.47Å; I545-R549 PolarHBondContact O-N 3.19Å; E546-R549 WeakPolarHBondContact O-CB 3.43Å; E546-R549 PolarHBondContact O-N 3.37Å; K547-R549 VanDerWaalsContact C-N 3.25Å; K547-R549 PolarHBondContact O-N 2.88Å; R549-F552 PolarHBondContact O-N 3.32Å; R549-E553 IonicContact CZ-OE1 3.69Å; R549-E553 IonicContact NE-OE1 3.19Å; R549-E553 PolarHBondContact NE-OE1 2.93Å; R549-E553 IonicContact NH2-OE1 3.45Å; R549-E553 PolarHBondContact NH2-OE1 3.45Å; R549-E553 WeakPolarHBondContact O-CG 3.47Å; R549-E553 PolarHBondContact O-N 3.43Å |
| 550 | I | 91.2 | Very high | 87.6 | Confident | 80 Ų | 80 | 104.3 Ų | 104.3 | 41% | 0.41 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.6 | -44.5 | 179 | -67.8 | 165 | 0 | 0 | 0 | 110.4 | E546 K547 F552 E553 Q554 | E546-I550 HydrophobicContact CG-CD1 4.36Å; E546-I550 VanDerWaalsContact O-CG1 3.29Å; E546-I550 WeakPolarHBondContact O-CG1 3.34Å; E546-I550 PolarHBondContact O-N 3.02Å; K547-I550 PolarHBondContact O-N 2.93Å; I550-F552 VanDerWaalsContact C-N 3.28Å; I550-F552 PolarHBondContact O-N 3.29Å; I550-E553 PolarHBondContact O-N 2.92Å; I550-Q554 WeakPolarHBondContact O-CG 3.44Å; I550-Q554 PolarHBondContact O-N 3.24Å |
| 551 | D | 90.9 | Very high | 86.6 | Confident | 62 Ų | 62 | 106 Ų | 106 | 33% | 0.332 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.9 | -39.6 | 177.8 | -72.2 | -18.9 | 0 | 0 | 0 | 110.7 | K547 E548 Q554 M555 | K547-D551 WeakPolarHBondContact O-CB 3.29Å; K547-D551 PolarHBondContact O-N 3.27Å; E548-D551 PolarHBondContact O-N 2.95Å; D551-Q554 PolarHBondContact O-N 3Å; D551-M555 WeakPolarHBondContact O-CG 3.47Å; D551-M555 PolarHBondContact O-N 3.45Å |
| 552 | F | 88.7 | Confident | 85.3 | Confident | 129 Ų | 129 | 105.8 Ų | 105.8 | 57% | 0.566 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.4 | -45.2 | 174.5 | -167.4 | -92.5 | 0 | 0 | 0 | 112.8 | E548 R549 I550 Q554 M555 H556 | E548-F552 WeakPolarHBondContact O-CB 3.49Å; E548-F552 PolarHBondContact O-N 3.32Å; R549-F552 PolarHBondContact O-N 3.32Å; I550-F552 VanDerWaalsContact C-N 3.28Å; I550-F552 PolarHBondContact O-N 3.29Å; F552-Q554 VanDerWaalsContact C-N 3.32Å; F552-Q554 PolarHBondContact O-N 2.98Å; F552-M555 HydrophobicContact CD2-CE 4.32Å; F552-M555 PolarHBondContact O-N 3.38Å; F552-H556 PolarHBondContact O-N 2.92Å |
| 553 | E | 90.4 | Very high | 84.2 | Confident | 94 Ų | 94 | 109.4 Ų | 109.4 | 44% | 0.439 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.9 | -39.8 | 176.2 | -74.2 | 178.3 | -172.5 | 0 | 0 | 111.6 | R549 I550 H556 L557 | R549-E553 IonicContact CZ-OE1 3.69Å; R549-E553 IonicContact NE-OE1 3.19Å; R549-E553 PolarHBondContact NE-OE1 2.93Å; R549-E553 IonicContact NH2-OE1 3.45Å; R549-E553 PolarHBondContact NH2-OE1 3.45Å; R549-E553 WeakPolarHBondContact O-CG 3.47Å; R549-E553 PolarHBondContact O-N 3.43Å; I550-E553 PolarHBondContact O-N 2.92Å; E553-H556 PolarHBondContact O-N 3.36Å; E553-L557 WeakPolarHBondContact O-CG 3.4Å; E553-L557 PolarHBondContact O-N 3.41Å |
| 554 | Q | 87.1 | Confident | 82.9 | Confident | 105 Ų | 105 | 110.3 Ų | 110.3 | 49% | 0.491 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.3 | -43.2 | 175.5 | -71.7 | -162.6 | 2.9 | 0 | 0 | 112.7 | I550 D551 F552 H556 L557 M558 | I550-Q554 WeakPolarHBondContact O-CG 3.44Å; I550-Q554 PolarHBondContact O-N 3.24Å; D551-Q554 PolarHBondContact O-N 3Å; F552-Q554 VanDerWaalsContact C-N 3.32Å; F552-Q554 PolarHBondContact O-N 2.98Å; Q554-H556 VanDerWaalsContact C-N 3.3Å; Q554-H556 PolarHBondContact O-N 3.39Å; Q554-L557 PolarHBondContact O-N 3.34Å; Q554-M558 WeakPolarHBondContact O-CG 3.44Å; Q554-M558 PolarHBondContact O-N 3.19Å |
| 555 | M | 83.5 | Confident | 81.7 | Confident | 112 Ų | 112 | 114.2 Ų | 114.2 | 55% | 0.552 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -59.7 | -42.1 | 174.9 | -76.3 | -169.8 | -71.1 | 0 | 0 | 111.6 | D551 F552 M558 Q559 | D551-M555 WeakPolarHBondContact O-CG 3.47Å; D551-M555 PolarHBondContact O-N 3.45Å; F552-M555 HydrophobicContact CD2-CE 4.32Å; F552-M555 PolarHBondContact O-N 3.38Å; M555-M558 PolarHBondContact O-N 2.95Å; M555-Q559 PolarHBondContact O-N 3Å |
| 556 | H | 84.1 | Confident | 80.1 | Confident | 94 Ų | 94 | 110.4 Ų | 110.4 | 44% | 0.435 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.6 | -40.9 | 178.4 | -137.9 | -105.1 | 0 | 0 | 0 | 112 | F552 E553 Q554 Q559 Q560 | F552-H556 PolarHBondContact O-N 2.92Å; E553-H556 PolarHBondContact O-N 3.36Å; Q554-H556 VanDerWaalsContact C-N 3.3Å; Q554-H556 PolarHBondContact O-N 3.39Å; H556-Q559 PolarHBondContact O-N 2.91Å; H556-Q560 PolarHBondContact O-N 3.01Å |
| 557 | L | 80 | Confident | 78.4 | Confident | 96 Ų | 96 | 110.1 Ų | 110.1 | 50% | 0.503 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.6 | -38.4 | 174 | -74.4 | 172.3 | 0 | 0 | 0 | 112.5 | E553 Q554 Q560 K561 | E553-L557 WeakPolarHBondContact O-CG 3.4Å; E553-L557 PolarHBondContact O-N 3.41Å; Q554-L557 PolarHBondContact O-N 3.34Å; L557-Q560 PolarHBondContact O-N 3.27Å; L557-K561 WeakPolarHBondContact O-CB 3.44Å; L557-K561 WeakPolarHBondContact O-CG 3.42Å; L557-K561 PolarHBondContact O-N 3.38Å |
| 558 | M | 78 | Confident | 76.3 | Confident | 123 Ų | 123 | 108.5 Ų | 108.5 | 61% | 0.606 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -64.8 | -41.5 | 174.7 | -71.4 | -165.4 | -160.3 | 0 | 0 | 111.7 | Q554 M555 K561 Q562 | Q554-M558 WeakPolarHBondContact O-CG 3.44Å; Q554-M558 PolarHBondContact O-N 3.19Å; M555-M558 PolarHBondContact O-N 2.95Å; M558-K561 PolarHBondContact O-N 2.94Å; M558-Q562 PolarHBondContact O-N 3.37Å |
| 559 | Q | 77.8 | Confident | 74.4 | Confident | 114 Ų | 114 | 104.3 Ų | 104.3 | 53% | 0.533 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 173.8 | -78.8 | -174.1 | -24 | 0 | 0 | 112 | M555 H556 K561 Q562 I563 | M555-Q559 PolarHBondContact O-N 3Å; H556-Q559 PolarHBondContact O-N 2.91Å; Q559-K561 VanDerWaalsContact C-N 3.33Å; Q559-K561 PolarHBondContact O-N 2.81Å; Q559-Q562 WeakPolarHBondContact O-CB 3.16Å; Q559-Q562 PolarHBondContact O-N 3.49Å; Q559-I563 WeakPolarHBondContact O-CG1 3.48Å; Q559-I563 PolarHBondContact O-N 3.32Å |
| 560 | Q | 76.9 | Confident | 72.4 | Confident | 113 Ų | 113 | 100 Ų | 100 | 53% | 0.528 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.6 | -41.5 | 175.1 | -79.5 | -174.1 | -16 | 0 | 0 | 112.2 | H556 L557 Q562 I563 L564 | H556-Q560 PolarHBondContact O-N 3.01Å; L557-Q560 PolarHBondContact O-N 3.27Å; Q560-Q562 VanDerWaalsContact C-N 3.34Å; Q560-Q562 PolarHBondContact O-N 3.47Å; Q560-I563 PolarHBondContact O-N 3.44Å; Q560-L564 WeakPolarHBondContact O-CB 3.33Å; Q560-L564 PolarHBondContact O-N 3.47Å |
| 561 | K | 69.1 | Low | 70.4 | Confident | 136 Ų | 136 | 102.3 Ų | 102.3 | 59% | 0.591 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -64 | -38.3 | 174.9 | -77.6 | -179.7 | 179.3 | 179.6 | 0 | 112.2 | L557 M558 Q559 L564 F565 | L557-K561 WeakPolarHBondContact O-CB 3.44Å; L557-K561 WeakPolarHBondContact O-CG 3.42Å; L557-K561 PolarHBondContact O-N 3.38Å; M558-K561 PolarHBondContact O-N 2.94Å; Q559-K561 VanDerWaalsContact C-N 3.33Å; Q559-K561 PolarHBondContact O-N 2.81Å; K561-L564 PolarHBondContact O-N 3.39Å; K561-F565 HydrophobicContact CB-CD2 4.46Å; K561-F565 WeakPolarHBondContact O-CB 3.37Å; K561-F565 PolarHBondContact O-N 3.15Å |
| 562 | Q | 62.8 | Low | 68.5 | Low | 107 Ų | 107 | 103.3 Ų | 103.3 | 50% | 0.5 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64.4 | -39.1 | 172.9 | -87.7 | -175.5 | -31.1 | 0 | 0 | 112.4 | M558 Q559 Q560 G566 | M558-Q562 PolarHBondContact O-N 3.37Å; Q559-Q562 WeakPolarHBondContact O-CB 3.16Å; Q559-Q562 PolarHBondContact O-N 3.49Å; Q560-Q562 VanDerWaalsContact C-N 3.34Å; Q560-Q562 PolarHBondContact O-N 3.47Å; Q562-G566 CarbonylContact O-C 3.56Å; Q562-G566 WeakPolarHBondContact O-CA 3.36Å; Q562-G566 PolarHBondContact O-N 3.17Å |
| 563 | I | 71.1 | Confident | 66.6 | Low | 147 Ų | 147 | 101.5 Ų | 101.5 | 75% | 0.754 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -66.6 | -41.3 | 175.5 | -66.2 | 165 | 0 | 0 | 0 | 110.6 | Q559 Q560 | Q559-I563 WeakPolarHBondContact O-CG1 3.48Å; Q559-I563 PolarHBondContact O-N 3.32Å; Q560-I563 PolarHBondContact O-N 3.44Å |
| 564 | L | 62.3 | Low | 64.6 | Low | 132 Ų | 132 | 100.6 Ų | 100.6 | 69% | 0.691 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -78.4 | -42.4 | -174.7 | -169.7 | 67.1 | 0 | 0 | 0 | 113.5 | Q560 K561 | Q560-L564 WeakPolarHBondContact O-CB 3.33Å; Q560-L564 PolarHBondContact O-N 3.47Å; K561-L564 PolarHBondContact O-N 3.39Å |
| 565 | F | 62.9 | Low | 62.4 | Low | 135 Ų | 135 | 98.5 Ų | 98.5 | 59% | 0.592 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -106.8 | -0.4 | -173.6 | -62.8 | -69 | 0 | 0 | 0 | 113.8 | K561 A569 | K561-F565 HydrophobicContact CB-CD2 4.46Å; K561-F565 WeakPolarHBondContact O-CB 3.37Å; K561-F565 PolarHBondContact O-N 3.15Å; F565-A569 HydrophobicContact CB-CB 3.64Å |
| 566 | G | 58.1 | Low | 60.3 | Low | 25 Ų | 25 | 104 Ų | 104 | 26% | 0.258 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | 68.7 | 169.2 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q562 S568 | Q562-G566 CarbonylContact O-C 3.56Å; Q562-G566 WeakPolarHBondContact O-CA 3.36Å; Q562-G566 PolarHBondContact O-N 3.17Å; G566-S568 PolarHBondContact O-N 2.91Å; G566-S568 VanDerWaalsContact O-N 3.17Å |
| 567 | P | 55.7 | Low | 58.3 | Low | 98 Ų | 98 | 104.6 Ų | 104.6 | 64% | 0.636 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -59.7 | -30.8 | -174 | -22.4 | 31.9 | 0 | 0 | 0 | 114.1 | A569 | P567-A569 PolarHBondContact O-N 3.48Å |
| 568 | S | 48.1 | Very low | 56.6 | Low | 97 Ų | 97 | 106.1 Ų | 106.1 | 68% | 0.678 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -73.1 | -29.5 | -170.1 | -57.2 | 0 | 0 | 0 | 0 | 113.8 | G566 A570 L571 | G566-S568 PolarHBondContact O-N 2.91Å; G566-S568 VanDerWaalsContact O-N 3.17Å; S568-A570 VanDerWaalsContact C-N 3.34Å; S568-A570 PolarHBondContact O-N 3.5Å; S568-L571 PolarHBondContact O-N 3.35Å |
| 569 | A | 51.8 | Low | 54.9 | Low | 47 Ų | 47 | 105.8 Ų | 105.8 | 39% | 0.388 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -70.9 | -30.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | F565 P567 L571 A572 | F565-A569 HydrophobicContact CB-CB 3.64Å; P567-A569 PolarHBondContact O-N 3.48Å; A569-L571 PolarHBondContact O-N 2.91Å; A569-A572 PolarHBondContact O-N 3.44Å |
| 570 | A | 50 | Low | 53.3 | Low | 54 Ų | 54 | 105.8 Ų | 105.8 | 45% | 0.446 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -68 | -34.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.5 | S568 A573 | S568-A570 VanDerWaalsContact C-N 3.34Å; S568-A570 PolarHBondContact O-N 3.5Å; A570-A573 PolarHBondContact O-N 3.18Å |
| 571 | L | 49.6 | Very low | 51.7 | Low | 128 Ų | 128 | 103.8 Ų | 103.8 | 67% | 0.67 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -67.9 | -37.3 | 178.4 | -80.1 | 161.1 | 0 | 0 | 0 | 112 | S568 A569 A573 S574 | S568-L571 PolarHBondContact O-N 3.35Å; A569-L571 PolarHBondContact O-N 2.91Å; L571-A573 VanDerWaalsContact C-N 3.3Å; L571-A573 PolarHBondContact O-N 3.42Å; L571-S574 PolarHBondContact O-N 3.01Å; L571-S574 VanDerWaalsContact O-N 3.15Å; L571-S574 PolarHBondContact O-OG 3.4Å |
| 572 | A | 50.3 | Low | 50.1 | Low | 84 Ų | 84 | 104.7 Ų | 104.7 | 69% | 0.694 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -63.1 | -34.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | A569 S574 | A569-A572 PolarHBondContact O-N 3.44Å; A572-S574 VanDerWaalsContact C-N 3.27Å; A572-S574 PolarHBondContact O-N 2.87Å |
| 573 | A | 49.1 | Very low | 49 | Very low | 91 Ų | 91 | 109 Ų | 109 | 75% | 0.752 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -70.7 | -21.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | A570 L571 G575 | A570-A573 PolarHBondContact O-N 3.18Å; L571-A573 VanDerWaalsContact C-N 3.3Å; L571-A573 PolarHBondContact O-N 3.42Å; A573-G575 VanDerWaalsContact C-N 3.26Å; A573-G575 PolarHBondContact O-N 2.87Å |
| 574 | S | 48.5 | Very low | 47.4 | Very low | 74 Ų | 74 | 109.4 Ų | 109.4 | 52% | 0.517 | 72% | 0.718 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.1 | 6.6 | -176.1 | 72.3 | 0 | 0 | 0 | 0 | 115.1 | L571 A572 R576 | L571-S574 PolarHBondContact O-N 3.01Å; L571-S574 VanDerWaalsContact O-N 3.15Å; L571-S574 PolarHBondContact O-OG 3.4Å; A572-S574 VanDerWaalsContact C-N 3.27Å; A572-S574 PolarHBondContact O-N 2.87Å; S574-R576 PolarHBondContact O-N 3.26Å |
| 575 | G | 41.3 | Very low | 46.6 | Very low | 61 Ų | 61 | 108.3 Ų | 108.3 | 63% | 0.629 | 72% | 0.719 | S | S | * | * | trans | 66.6 | 3.6 | 164.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | A573 S577 | A573-G575 VanDerWaalsContact C-N 3.26Å; A573-G575 PolarHBondContact O-N 2.87Å; G575-S577 VanDerWaalsContact C-N 3.33Å; G575-S577 PolarHBondContact O-N 3.24Å | ||
| 576 | R | 39.2 | Very low | 45.8 | Very low | 229 Ų | 229 | 106.8 Ų | 106.8 | 86% | 0.864 | 73% | 0.726 | S | S | * | * | trans | -79.2 | 84.2 | 172.3 | -81.8 | -179.8 | 174.9 | 171.1 | -0.9 | 109.8 | S574 | S574-R576 PolarHBondContact O-N 3.26Š| ||
| 577 | S | 42.5 | Very low | 45.1 | Very low | 106 Ų | 106 | 111.4 Ų | 111.4 | 74% | 0.741 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 128.5 | 161.4 | 43.7 | 0 | 0 | 0 | 0 | 108.8 | G575 S579 | G575-S577 VanDerWaalsContact C-N 3.33Å; G575-S577 PolarHBondContact O-N 3.24Å; S577-S579 PolarHBondContact O-N 3.34Å |
| 578 | P | 44.4 | Very low | 44.5 | Very low | 127 Ų | 127 | 112.2 Ų | 112.2 | 83% | 0.825 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 125.9 | 178.8 | -11.4 | 25.7 | 0 | 0 | 0 | 109.5 | S580 | P578-S580 PolarHBondContact O-N 3.29Š|
| 579 | S | 41.5 | Very low | 44.2 | Very low | 116 Ų | 116 | 113.1 Ų | 113.1 | 81% | 0.811 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 127.5 | 174.8 | 50.9 | 0 | 0 | 0 | 0 | 111.2 | S577 G581 | S577-S579 PolarHBondContact O-N 3.34Å; S579-G581 PolarHBondContact O-N 3.01Å |
| 580 | S | 45 | Very low | 43.7 | Very low | 115 Ų | 115 | 117.5 Ų | 117.5 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -46.9 | 115.7 | 177.8 | 52.1 | 0 | 0 | 0 | 0 | 113.4 | P578 | P578-S580 PolarHBondContact O-N 3.29Š| ||
| 581 | G | 42.4 | Very low | 43.3 | Very low | 70 Ų | 70 | 122.1 Ų | 122.1 | 72% | 0.722 | 81% | 0.813 | S | S | * | * | trans | -77.8 | 115.4 | 166 | 0 | 0 | 0 | 0 | 0 | 110.4 | S579 H583 | S579-G581 PolarHBondContact O-N 3.01Å; G581-H583 PolarHBondContact O-N 3.44Å | ||
| 582 | N | 36.6 | Very low | 42.8 | Very low | 156 Ų | 156 | 121.6 Ų | 121.6 | 83% | 0.834 | 82% | 0.824 | S | S | * | * | trans | -59.4 | 111.9 | 163.9 | -99.5 | -10.8 | 0 | 0 | 0 | 109.7 | ||||
| 583 | H | 39 | Very low | 42.2 | Very low | 196 Ų | 196 | 124.8 Ų | 124.8 | 91% | 0.907 | 84% | 0.835 | S | S | * | * | trans | -151 | 118.4 | 158.7 | -82.9 | -56.5 | 0 | 0 | 0 | 108.8 | G581 | G581-H583 PolarHBondContact O-N 3.44Š| ||
| 584 | G | 36.9 | Very low | 41.6 | Very low | 156 Ų | 156 | 127.8 Ų | 127.8 | 100% | 1.608 | 84% | 0.842 | S | S | * | * | trans | 136.7 | 0 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.2 |
Retrieved 584 of 584 residues in 554 ms
(Link to these results)