| 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 | 48.8 | Very low | 73.7 | Confident | 241 Ų | 241 | 169.7 Ų | 169.7 | 100% | 1.187 | 82% | 0.821 | S | S | * | * | 0 | 114.8 | 0 | -68.8 | -178.8 | 171.1 | 0 | 0 | 108.5 | |||||
| 2 | S | 70.4 | Confident | 74.6 | Confident | 132 Ų | 132 | 160.5 Ų | 160.5 | 92% | 0.923 | 78% | 0.783 | S | S | * | * | trans | -87.2 | 117.9 | -174.9 | -151.8 | 0 | 0 | 0 | 0 | 109.8 | R4 | S2-R4 PolarHBondContact O-N 2.98Š| ||
| 3 | R | 73.4 | Confident | 75.5 | Confident | 241 Ų | 241 | 156.8 Ų | 156.8 | 91% | 0.909 | 76% | 0.763 | S | S | * | * | trans | -79.4 | 110.6 | 177.2 | -66.2 | -176.6 | -171.4 | -166.3 | 2.1 | 108.4 | K5 | R3-K5 PolarHBondContact O-N 3.14Š| ||
| 4 | R | 78.7 | Confident | 76.1 | Confident | 245 Ų | 245 | 156.4 Ų | 156.4 | 93% | 0.925 | 75% | 0.749 | S | S | * | * | trans | -64.2 | 123.8 | 171.8 | -154.6 | 170.7 | -145.6 | 154.5 | 4.9 | 107.8 | S2 Q6 | S2-R4 PolarHBondContact O-N 2.98Å; R4-Q6 PolarHBondContact O-N 2.91Å; R4-Q6 VanDerWaalsContact O-N 3.14Å | ||
| 5 | K | 78.6 | Confident | 76.9 | Confident | 196 Ų | 196 | 154.3 Ų | 154.3 | 85% | 0.852 | 74% | 0.743 | S | S | * | * | trans | -62.8 | 116.2 | 175.9 | -70.6 | -177 | 177.2 | -179 | 0 | 107.8 | R3 T7 | R3-K5 PolarHBondContact O-N 3.14Å; K5-T7 PolarHBondContact O-N 2.91Å; K5-T7 VanDerWaalsContact O-N 3.14Å | ||
| 6 | Q | 78.9 | Confident | 77.6 | Confident | 188 Ų | 188 | 154 Ų | 154 | 88% | 0.879 | 74% | 0.741 | S | S | * | * | trans | -63.6 | 111.7 | 171.9 | -173.9 | 178.4 | 29.3 | 0 | 0 | 107.9 | R4 | R4-Q6 PolarHBondContact O-N 2.91Å; R4-Q6 VanDerWaalsContact O-N 3.14Å | ||
| 7 | T | 71.3 | Confident | 78.1 | Confident | 124 Ų | 124 | 149.9 Ų | 149.9 | 76% | 0.761 | 73% | 0.727 | S | S | * | * | trans | -78.4 | 121.9 | 174.8 | 54.5 | 0 | 0 | 0 | 0 | 107.9 | K5 | K5-T7 PolarHBondContact O-N 2.91Å; K5-T7 VanDerWaalsContact O-N 3.14Å | ||
| 8 | N | 77.8 | Confident | 78.6 | Confident | 79 Ų | 79 | 147.7 Ų | 147.7 | 42% | 0.422 | 71% | 0.714 | S | S | . | * | trans | -79.3 | 121.7 | 179.8 | -166.8 | -69.5 | 0 | 0 | 0 | 109.1 | N10 K11 | N8-N10 PolarHBondContact O-N 3.41Å; N8-N10 VanDerWaalsContact O-N 3.17Å; N8-N10 VanDerWaalsContact OD1-CB 3.3Å; N8-N10 WeakPolarHBondContact OD1-CB 3.43Å; N8-N10 PolarHBondContact OD1-N 3.33Å; N8-K11 HydrophobicContact CB-CB 4.32Å; N8-K11 HydrophobicContact CB-CD 4.19Å; N8-K11 HydrophobicContact CB-CG 4.16Å; N8-K11 PolarHBondContact O-N 3.1Å | ||
| 9 | P | 72.9 | Confident | 79.2 | Confident | 91 Ų | 91 | 143.8 Ų | 143.8 | 59% | 0.591 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -63 | -22.7 | -177.8 | 24.9 | -33.5 | 0 | 0 | 0 | 112.8 | K11 V12 | P9-K11 VanDerWaalsContact C-N 3.29Å; P9-K11 PolarHBondContact O-N 3.4Å; P9-V12 WeakPolarHBondContact O-CG2 3.47Å |
| 10 | N | 78 | Confident | 79.6 | Confident | 150 Ų | 150 | 139 Ų | 139 | 80% | 0.802 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -81.9 | -3.5 | 175.9 | -59.9 | -65.9 | 0 | 0 | 0 | 113.8 | N8 | N8-N10 PolarHBondContact O-N 3.41Å; N8-N10 VanDerWaalsContact O-N 3.17Å; N8-N10 VanDerWaalsContact OD1-CB 3.3Å; N8-N10 WeakPolarHBondContact OD1-CB 3.43Å; N8-N10 PolarHBondContact OD1-N 3.33Å |
| 11 | K | 81.9 | Confident | 80.1 | Confident | 180 Ų | 180 | 136.4 Ų | 136.4 | 78% | 0.783 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -109.4 | 21.9 | 175.9 | -65.1 | -177 | 178.9 | -77.5 | 0 | 111.9 | N8 P9 | N8-K11 HydrophobicContact CB-CB 4.32Å; N8-K11 HydrophobicContact CB-CD 4.19Å; N8-K11 HydrophobicContact CB-CG 4.16Å; N8-K11 PolarHBondContact O-N 3.1Å; P9-K11 VanDerWaalsContact C-N 3.29Å; P9-K11 PolarHBondContact O-N 3.4Å |
| 12 | V | 84.9 | Confident | 82 | Confident | 59 Ų | 59 | 133 Ų | 133 | 36% | 0.358 | 67% | 0.666 | S | S | . | * | trans | -80.1 | 124 | 173.7 | 178.9 | 0 | 0 | 0 | 0 | 108.1 | P9 W14 V17 | P9-V12 WeakPolarHBondContact O-CG2 3.47Å; V12-W14 HydrophobicContact CG1-CD2 4.08Å; V12-W14 HydrophobicContact CG1-CE3 4.13Å; V12-W14 HydrophobicContact CG1-CZ2 4.44Å; V12-W14 HydrophobicContact CG1-CZ3 4.37Å; V12-W14 PolarHBondContact O-N 3.4Å; V12-V17 HydrophobicContact CG1-CG2 3.69Å | ||
| 13 | H | 85.2 | Confident | 82.9 | Confident | 113 Ų | 113 | 130.4 Ų | 130.4 | 52% | 0.523 | 64% | 0.64 | S | S | . | * | trans | -82 | 89.8 | 174 | -172.4 | -96.6 | 0 | 0 | 0 | 108.9 | D15 Q16 V17 | H13-D15 PolarHBondContact O-N 3.42Å; H13-Q16 HydrophobicContact CB-CB 4.33Å; H13-Q16 VanDerWaalsContact ND1-CB 3.31Å; H13-Q16 WeakPolarHBondContact ND1-CB 3.19Å; H13-Q16 PolarHBondContact ND1-N 3.17Å; H13-Q16 VanDerWaalsContact ND1-N 3.19Å; H13-Q16 WeakPolarHBondContact O-CB 3.03Å; H13-Q16 PolarHBondContact O-N 3.11Å; H13-V17 PolarHBondContact O-N 3.3Å | ||
| 14 | W | 84.8 | Confident | 83.6 | Confident | 150 Ų | 150 | 125.2 Ų | 125.2 | 57% | 0.568 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -57.9 | -34.5 | -173.6 | -69.5 | 112.6 | 0 | 0 | 0 | 113.5 | V12 Q16 V17 F18 | V12-W14 HydrophobicContact CG1-CD2 4.08Å; V12-W14 HydrophobicContact CG1-CE3 4.13Å; V12-W14 HydrophobicContact CG1-CZ2 4.44Å; V12-W14 HydrophobicContact CG1-CZ3 4.37Å; V12-W14 PolarHBondContact O-N 3.4Å; W14-Q16 PolarHBondContact O-N 3.19Å; W14-V17 HydrophobicContact CE3-CB 4.31Å; W14-V17 HydrophobicContact CE3-CG1 4.39Å; W14-V17 HydrophobicContact CE3-CG2 4.46Å; W14-V17 HydrophobicContact CZ3-CG1 4.5Å; W14-V17 PolarHBondContact O-N 3.38Å; W14-F18 HydrophobicContact CB-CD2 4.35Å; W14-F18 HydrophobicContact CB-CE2 4.47Å; W14-F18 HydrophobicContact CD2-CE2 4.27Å; W14-F18 HydrophobicContact CE3-CD2 4.19Å; W14-F18 AromaticContact CE3-CE2 3.4Å; W14-F18 HydrophobicContact CE3-CE2 3.4Å; W14-F18 VanDerWaalsContact CE3-CE2 3.4Å; W14-F18 HydrophobicContact CE3-CZ 4.03Å; W14-F18 AromaticContact CZ3-CE2 3.97Å; W14-F18 HydrophobicContact CZ3-CE2 3.97Å; W14-F18 HydrophobicContact CZ3-CZ 4.13Å; W14-F18 VanDerWaalsContact O-CD2 3.31Å; W14-F18 WeakPolarHBondContact O-CD2 3.38Å; W14-F18 PolarHBondContact O-N 3.2Å |
| 15 | D | 87.4 | Confident | 84.1 | Confident | 125 Ų | 125 | 115.8 Ų | 115.8 | 67% | 0.668 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -62.7 | -28.6 | 176.7 | -56 | -38.7 | 0 | 0 | 0 | 112.3 | H13 A19 | H13-D15 PolarHBondContact O-N 3.42Å; D15-A19 WeakPolarHBondContact O-CA 2.86Å; D15-A19 VanDerWaalsContact O-CB 3.29Å; D15-A19 WeakPolarHBondContact O-CB 3.17Å; D15-A19 PolarHBondContact O-N 2.76Å |
| 16 | Q | 87.7 | Confident | 84.7 | Confident | 150 Ų | 150 | 111.8 Ų | 111.8 | 70% | 0.701 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -78.7 | -35 | 174.2 | -174.3 | 112.6 | 50.7 | 0 | 0 | 111.5 | H13 W14 F18 | H13-Q16 HydrophobicContact CB-CB 4.33Å; H13-Q16 VanDerWaalsContact ND1-CB 3.31Å; H13-Q16 WeakPolarHBondContact ND1-CB 3.19Å; H13-Q16 PolarHBondContact ND1-N 3.17Å; H13-Q16 VanDerWaalsContact ND1-N 3.19Å; H13-Q16 WeakPolarHBondContact O-CB 3.03Å; H13-Q16 PolarHBondContact O-N 3.11Å; W14-Q16 PolarHBondContact O-N 3.19Å; Q16-F18 VanDerWaalsContact C-N 3.31Å |
| 17 | V | 86.6 | Confident | 85.3 | Confident | 85 Ų | 85 | 106.7 Ų | 106.7 | 52% | 0.515 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.5 | -35.9 | 179 | 177.2 | 0 | 0 | 0 | 0 | 111 | V12 H13 W14 | V12-V17 HydrophobicContact CG1-CG2 3.69Å; H13-V17 PolarHBondContact O-N 3.3Å; W14-V17 HydrophobicContact CE3-CB 4.31Å; W14-V17 HydrophobicContact CE3-CG1 4.39Å; W14-V17 HydrophobicContact CE3-CG2 4.46Å; W14-V17 HydrophobicContact CZ3-CG1 4.5Å; W14-V17 PolarHBondContact O-N 3.38Å |
| 18 | F | 87.6 | Confident | 86 | Confident | 109 Ų | 109 | 103.7 Ų | 103.7 | 48% | 0.478 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -103.7 | 5 | -178.6 | -60.5 | -61 | 0 | 0 | 0 | 113.9 | W14 Q16 G20 L21 | W14-F18 HydrophobicContact CB-CD2 4.35Å; W14-F18 HydrophobicContact CB-CE2 4.47Å; W14-F18 HydrophobicContact CD2-CE2 4.27Å; W14-F18 HydrophobicContact CE3-CD2 4.19Å; W14-F18 AromaticContact CE3-CE2 3.4Å; W14-F18 HydrophobicContact CE3-CE2 3.4Å; W14-F18 VanDerWaalsContact CE3-CE2 3.4Å; W14-F18 HydrophobicContact CE3-CZ 4.03Å; W14-F18 AromaticContact CZ3-CE2 3.97Å; W14-F18 HydrophobicContact CZ3-CE2 3.97Å; W14-F18 HydrophobicContact CZ3-CZ 4.13Å; W14-F18 VanDerWaalsContact O-CD2 3.31Å; W14-F18 WeakPolarHBondContact O-CD2 3.38Å; W14-F18 PolarHBondContact O-N 3.2Å; Q16-F18 VanDerWaalsContact C-N 3.31Å; F18-G20 PolarHBondContact O-N 2.87Å; F18-G20 VanDerWaalsContact O-N 3.13Å; F18-L21 HydrophobicContact CD1-CD2 3.67Å; F18-L21 HydrophobicContact CE1-CD2 4.31Å; F18-L21 VanDerWaalsContact O-CB 3.29Å; F18-L21 WeakPolarHBondContact O-CB 3.46Å; F18-L21 PolarHBondContact O-N 3.35Å |
| 19 | A | 89.8 | Confident | 86.2 | Confident | 74 Ų | 74 | 107.3 Ų | 107.3 | 61% | 0.612 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | 120.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | D15 L21 | D15-A19 WeakPolarHBondContact O-CA 2.86Å; D15-A19 VanDerWaalsContact O-CB 3.29Å; D15-A19 WeakPolarHBondContact O-CB 3.17Å; D15-A19 PolarHBondContact O-N 2.76Å; A19-L21 VanDerWaalsContact C-N 3.32Å; A19-L21 PolarHBondContact O-N 3.36Å |
| 20 | G | 87.3 | Confident | 86.7 | Confident | 48 Ų | 48 | 109.1 Ų | 109.1 | 50% | 0.495 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 83.5 | -4.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | F18 E22 E23 Q24 | F18-G20 PolarHBondContact O-N 2.87Å; F18-G20 VanDerWaalsContact O-N 3.13Å; G20-E22 VanDerWaalsContact C-N 3.34Å; G20-E23 PolarHBondContact O-N 2.9Å; G20-Q24 WeakPolarHBondContact O-CB 3.12Å; G20-Q24 PolarHBondContact O-N 3.49Å |
| 21 | L | 90.9 | Very high | 86.7 | Confident | 85 Ų | 85 | 107.9 Ų | 107.9 | 45% | 0.445 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -64.4 | -40 | 175.5 | -179.7 | 62.5 | 0 | 0 | 0 | 111.7 | F18 A19 Q24 A25 | F18-L21 HydrophobicContact CD1-CD2 3.67Å; F18-L21 HydrophobicContact CE1-CD2 4.31Å; F18-L21 VanDerWaalsContact O-CB 3.29Å; F18-L21 WeakPolarHBondContact O-CB 3.46Å; F18-L21 PolarHBondContact O-N 3.35Å; A19-L21 VanDerWaalsContact C-N 3.32Å; A19-L21 PolarHBondContact O-N 3.36Å; L21-Q24 WeakPolarHBondContact O-CB 3.11Å; L21-Q24 PolarHBondContact O-N 3.17Å; L21-A25 WeakPolarHBondContact O-CB 3.5Å; L21-A25 PolarHBondContact O-N 3.21Å |
| 22 | E | 87.1 | Confident | 86 | Confident | 168 Ų | 168 | 104.2 Ų | 104.2 | 79% | 0.785 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.6 | -46.3 | 177 | -177.3 | -178.6 | 176.8 | 0 | 0 | 111.6 | G20 Q24 A25 R26 | G20-E22 VanDerWaalsContact C-N 3.34Å; E22-Q24 VanDerWaalsContact C-N 3.33Å; E22-Q24 PolarHBondContact O-N 2.75Å; E22-A25 PolarHBondContact O-N 3.42Å; E22-R26 WeakPolarHBondContact O-CB 3.41Å; E22-R26 PolarHBondContact O-N 3.46Å |
| 23 | E | 89.9 | Confident | 85.1 | Confident | 78 Ų | 78 | 108 Ų | 108 | 36% | 0.364 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.6 | -37.4 | 178 | 176.5 | 53.2 | -152.5 | 0 | 0 | 111.5 | G20 R26 Q27 | G20-E23 PolarHBondContact O-N 2.9Å; E23-R26 IonicContact OE1-CZ 3.53Å; E23-R26 IonicContact OE1-NE 3.75Å; E23-R26 IonicContact OE1-NH2 2.63Å; E23-R26 PolarHBondContact OE1-NH2 3.46Å; E23-R26 IonicContact OE2-CZ 3.26Å; E23-R26 VanDerWaalsContact OE2-CZ 3.26Å; E23-R26 IonicContact OE2-NE 2.76Å; E23-R26 PolarHBondContact OE2-NE 3.33Å; E23-R26 IonicContact OE2-NH2 2.96Å; E23-R26 PolarHBondContact OE2-NH2 2.8Å; E23-Q27 WeakPolarHBondContact O-CB 3.34Å; E23-Q27 VanDerWaalsContact O-CG 3.28Å; E23-Q27 WeakPolarHBondContact O-CG 3.33Å; E23-Q27 PolarHBondContact O-N 3.05Å; E23-Q27 WeakPolarHBondContact OE1-CG 3.48Å; E23-Q27 PolarHBondContact OE1-NE2 3.14Å |
| 24 | Q | 88.6 | Confident | 84.1 | Confident | 132 Ų | 132 | 110 Ų | 110 | 62% | 0.617 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.2 | -44.1 | 172.5 | -177.2 | -176.6 | -40.3 | 0 | 0 | 111.9 | G20 L21 E22 Q27 A28 | G20-Q24 WeakPolarHBondContact O-CB 3.12Å; G20-Q24 PolarHBondContact O-N 3.49Å; L21-Q24 WeakPolarHBondContact O-CB 3.11Å; L21-Q24 PolarHBondContact O-N 3.17Å; E22-Q24 VanDerWaalsContact C-N 3.33Å; E22-Q24 PolarHBondContact O-N 2.75Å; Q24-Q27 PolarHBondContact O-N 3.18Å; Q24-A28 WeakPolarHBondContact O-CB 3.38Å; Q24-A28 PolarHBondContact O-N 3.1Å |
| 25 | A | 89.8 | Confident | 83 | Confident | 47 Ų | 47 | 109.6 Ų | 109.6 | 39% | 0.388 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64 | -44 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | L21 E22 Q27 A28 M29 | L21-A25 WeakPolarHBondContact O-CB 3.5Å; L21-A25 PolarHBondContact O-N 3.21Å; E22-A25 PolarHBondContact O-N 3.42Å; A25-Q27 PolarHBondContact O-N 3.07Å; A25-A28 PolarHBondContact O-N 3.48Å; A25-M29 WeakPolarHBondContact O-CG 3.17Å; A25-M29 PolarHBondContact O-N 2.77Å |
| 26 | R | 90.7 | Very high | 81.4 | Confident | 113 Ų | 113 | 105.8 Ų | 105.8 | 43% | 0.426 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -58 | -48.4 | 173.8 | -169.3 | -172.3 | 69 | 76.8 | -3 | 111.3 | E22 E23 A28 M29 M30 | E22-R26 WeakPolarHBondContact O-CB 3.41Å; E22-R26 PolarHBondContact O-N 3.46Å; E23-R26 IonicContact OE1-CZ 3.53Å; E23-R26 IonicContact OE1-NE 3.75Å; E23-R26 IonicContact OE1-NH2 2.63Å; E23-R26 PolarHBondContact OE1-NH2 3.46Å; E23-R26 IonicContact OE2-CZ 3.26Å; E23-R26 VanDerWaalsContact OE2-CZ 3.26Å; E23-R26 IonicContact OE2-NE 2.76Å; E23-R26 PolarHBondContact OE2-NE 3.33Å; E23-R26 IonicContact OE2-NH2 2.96Å; E23-R26 PolarHBondContact OE2-NH2 2.8Å; R26-A28 PolarHBondContact O-N 3.41Å; R26-M29 PolarHBondContact O-N 2.81Å; R26-M30 HydrophobicContact CG-SD 4.29Å; R26-M30 PolarHBondContact NH1-SD 3.42Å; R26-M30 VanDerWaalsContact O-CG 3.27Å; R26-M30 WeakPolarHBondContact O-CG 3.45Å; R26-M30 PolarHBondContact O-N 3.17Å; R26-M30 VanDerWaalsContact O-N 3.07Å |
| 27 | Q | 90.9 | Very high | 79.9 | Confident | 80 Ų | 80 | 106 Ų | 106 | 37% | 0.374 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63 | -39.4 | 176.4 | -75 | 179.3 | 43.6 | 0 | 0 | 112.6 | E23 Q24 A25 M30 K31 | E23-Q27 WeakPolarHBondContact O-CB 3.34Å; E23-Q27 VanDerWaalsContact O-CG 3.28Å; E23-Q27 WeakPolarHBondContact O-CG 3.33Å; E23-Q27 PolarHBondContact O-N 3.05Å; E23-Q27 WeakPolarHBondContact OE1-CG 3.48Å; E23-Q27 PolarHBondContact OE1-NE2 3.14Å; Q24-Q27 PolarHBondContact O-N 3.18Å; A25-Q27 PolarHBondContact O-N 3.07Å; Q27-M30 PolarHBondContact O-N 3.38Å; Q27-K31 WeakPolarHBondContact O-CB 3.46Å; Q27-K31 WeakPolarHBondContact O-CG 3.24Å; Q27-K31 PolarHBondContact O-N 3.06Å |
| 28 | A | 87.1 | Confident | 78.4 | Confident | 62 Ų | 62 | 106.3 Ų | 106.3 | 51% | 0.512 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.5 | -39.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q24 A25 R26 M30 K31 | Q24-A28 WeakPolarHBondContact O-CB 3.38Å; Q24-A28 PolarHBondContact O-N 3.1Å; A25-A28 PolarHBondContact O-N 3.48Å; R26-A28 PolarHBondContact O-N 3.41Å; A28-M30 VanDerWaalsContact C-N 3.31Å; A28-M30 PolarHBondContact O-N 3.25Å; A28-K31 PolarHBondContact O-N 3.46Å |
| 29 | M | 81.4 | Confident | 76.9 | Confident | 155 Ų | 155 | 103.8 Ų | 103.8 | 76% | 0.764 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -71.4 | -25 | 175.1 | -67.3 | -169.9 | -63.3 | 0 | 0 | 113.2 | A25 R26 | A25-M29 WeakPolarHBondContact O-CG 3.17Å; A25-M29 PolarHBondContact O-N 2.77Å; R26-M29 PolarHBondContact O-N 2.81Å |
| 30 | M | 82.6 | Confident | 75.3 | Confident | 128 Ų | 128 | 104.6 Ų | 104.6 | 63% | 0.631 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -87 | -22.2 | 175.5 | -67.4 | -178.7 | 87 | 0 | 0 | 113.5 | R26 Q27 A28 T32 | R26-M30 HydrophobicContact CG-SD 4.29Å; R26-M30 PolarHBondContact NH1-SD 3.42Å; R26-M30 VanDerWaalsContact O-CG 3.27Å; R26-M30 WeakPolarHBondContact O-CG 3.45Å; R26-M30 PolarHBondContact O-N 3.17Å; R26-M30 VanDerWaalsContact O-N 3.07Å; Q27-M30 PolarHBondContact O-N 3.38Å; A28-M30 VanDerWaalsContact C-N 3.31Å; A28-M30 PolarHBondContact O-N 3.25Å; M30-T32 PolarHBondContact O-N 3.07Å |
| 31 | K | 79.1 | Confident | 73.9 | Confident | 125 Ų | 125 | 107.8 Ų | 107.8 | 54% | 0.543 | 59% | 0.587 | S | S | . | * | trans | -72.9 | 94.7 | 175 | -79 | 168.9 | -178.2 | 176.9 | 0 | 109 | Q27 A28 D33 | Q27-K31 WeakPolarHBondContact O-CB 3.46Å; Q27-K31 WeakPolarHBondContact O-CG 3.24Å; Q27-K31 PolarHBondContact O-N 3.06Å; A28-K31 PolarHBondContact O-N 3.46Å; K31-D33 PolarHBondContact O-N 3.48Å | ||
| 32 | T | 65.9 | Low | 72.3 | Confident | 102 Ų | 102 | 112.4 Ų | 112.4 | 63% | 0.626 | 60% | 0.599 | S | S | * | * | trans | -85.1 | 23 | 170.4 | 51.1 | 0 | 0 | 0 | 0 | 112.1 | M30 F34 | M30-T32 PolarHBondContact O-N 3.07Å; T32-F34 PolarHBondContact O-N 3.28Å | ||
| 33 | D | 67.3 | Low | 70.9 | Confident | 138 Ų | 138 | 111.1 Ų | 111.1 | 74% | 0.738 | 59% | 0.593 | S | S | * | * | trans | -95.6 | 81.5 | 176.1 | -62.2 | -66.2 | 0 | 0 | 0 | 108.6 | K31 P35 | K31-D33 PolarHBondContact O-N 3.48Å; D33-P35 VanDerWaalsContact O-CD 3.28Å; D33-P35 WeakPolarHBondContact O-CD 3.21Å | ||
| 34 | F | 63.8 | Low | 69.4 | Low | 155 Ų | 155 | 110 Ų | 110 | 68% | 0.68 | 60% | 0.597 | S | S | * | * | trans | -75.4 | 116.5 | 164.9 | -65.6 | -82.8 | 0 | 0 | 0 | 107.5 | T32 G36 | T32-F34 PolarHBondContact O-N 3.28Å; F34-G36 PolarHBondContact O-N 3.03Å | ||
| 35 | P | 62.5 | Low | 68.1 | Low | 142 Ų | 142 | 107.9 Ų | 107.9 | 92% | 0.922 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -71.5 | 85.5 | 172.3 | 28.9 | -30.6 | 0 | 0 | 0 | 108.2 | D33 | D33-P35 VanDerWaalsContact O-CD 3.28Å; D33-P35 WeakPolarHBondContact O-CD 3.21Å |
| 36 | G | 53.5 | Low | 66.6 | Low | 46 Ų | 46 | 109.9 Ų | 109.9 | 47% | 0.474 | 59% | 0.59 | S | S | . | * | S | Bend | trans | 165.7 | 92.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | F34 L38 | F34-G36 PolarHBondContact O-N 3.03Å; G36-L38 VanDerWaalsContact C-N 3.26Å; G36-L38 WeakPolarHBondContact O-CG 3.27Å; G36-L38 PolarHBondContact O-N 3.47Å |
| 37 | D | 55 | Low | 65.1 | Low | 153 Ų | 153 | 110.9 Ų | 110.9 | 82% | 0.818 | 60% | 0.6 | S | S | * | * | S | Bend | trans | 49.7 | 3.4 | 147.1 | -155.1 | 34.7 | 0 | 0 | 0 | 122 | G39 | D37-G39 PolarHBondContact O-N 2.91Å; D37-G39 VanDerWaalsContact O-N 3.1Å |
| 38 | L | 55.8 | Low | 63.6 | Low | 93 Ų | 93 | 112.5 Ų | 112.5 | 49% | 0.487 | 61% | 0.61 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.7 | 6.5 | -178.8 | -62.7 | 179.1 | 0 | 0 | 0 | 114.7 | G36 S40 Q41 R42 | G36-L38 VanDerWaalsContact C-N 3.26Å; G36-L38 WeakPolarHBondContact O-CG 3.27Å; G36-L38 PolarHBondContact O-N 3.47Å; L38-S40 VanDerWaalsContact C-N 3.29Å; L38-S40 PolarHBondContact O-N 3.46Å; L38-Q41 HydrophobicContact CD2-CB 4.49Å; L38-Q41 PolarHBondContact O-N 3.47Å; L38-R42 PolarHBondContact O-N 3.25Å |
| 39 | G | 55.6 | Low | 62.1 | Low | 55 Ų | 55 | 117.9 Ų | 117.9 | 57% | 0.567 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -60.6 | -36.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | D37 | D37-G39 PolarHBondContact O-N 2.91Å; D37-G39 VanDerWaalsContact O-N 3.1Å |
| 40 | S | 57.3 | Low | 60.8 | Low | 91 Ų | 91 | 115.4 Ų | 115.4 | 64% | 0.636 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -73 | -35.1 | 176.9 | -89.2 | 0 | 0 | 0 | 0 | 113.2 | L38 A44 | L38-S40 VanDerWaalsContact C-N 3.29Å; L38-S40 PolarHBondContact O-N 3.46Å; S40-A44 PolarHBondContact O-N 3.3Å |
| 41 | Q | 57 | Low | 59.6 | Low | 115 Ų | 115 | 117.1 Ų | 117.1 | 54% | 0.537 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -71.8 | -36.5 | 179.6 | -173.1 | 179.4 | 78.9 | 0 | 0 | 111.8 | L38 Q43 A44 I45 | L38-Q41 HydrophobicContact CD2-CB 4.49Å; L38-Q41 PolarHBondContact O-N 3.47Å; Q41-Q43 VanDerWaalsContact C-N 3.32Å; Q41-Q43 PolarHBondContact O-N 2.79Å; Q41-A44 PolarHBondContact O-N 3.32Å; Q41-I45 HydrophobicContact CG-CD1 4.03Å; Q41-I45 WeakPolarHBondContact O-CG1 3.28Å; Q41-I45 PolarHBondContact O-N 3.2Å |
| 42 | R | 57.1 | Low | 58.5 | Low | 182 Ų | 182 | 117.9 Ų | 117.9 | 69% | 0.687 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -64.2 | -35.8 | 178.1 | -168.1 | 177 | 179.9 | -179.3 | 1.2 | 112.5 | L38 I45 Q46 | L38-R42 PolarHBondContact O-N 3.25Å; R42-I45 PolarHBondContact O-N 3.02Å; R42-Q46 PolarHBondContact O-N 3.18Å |
| 43 | Q | 59.1 | Low | 57.9 | Low | 142 Ų | 142 | 118.1 Ų | 118.1 | 66% | 0.664 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -68.1 | -37 | 174.4 | -70.1 | -172.6 | -20.2 | 0 | 0 | 112.2 | Q41 Q46 Q47 | Q41-Q43 VanDerWaalsContact C-N 3.32Å; Q41-Q43 PolarHBondContact O-N 2.79Å; Q43-Q46 PolarHBondContact O-N 3.3Å; Q43-Q47 WeakPolarHBondContact O-CG 3.29Å; Q43-Q47 PolarHBondContact O-N 3.36Å; Q43-Q47 VanDerWaalsContact O-N 3.11Å |
| 44 | A | 58.2 | Low | 57.3 | Low | 53 Ų | 53 | 117 Ų | 117 | 44% | 0.438 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -66 | -38 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S40 Q41 L48 | S40-A44 PolarHBondContact O-N 3.3Å; Q41-A44 PolarHBondContact O-N 3.32Å; A44-L48 WeakPolarHBondContact O-CG 3.37Å; A44-L48 PolarHBondContact O-N 3.25Å; A44-L48 VanDerWaalsContact O-N 3.17Å |
| 45 | I | 60.1 | Low | 56.8 | Low | 88 Ų | 88 | 115 Ų | 115 | 45% | 0.451 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -71 | -35.5 | 177.2 | -63 | 165.6 | 0 | 0 | 0 | 111.5 | Q41 R42 L48 R49 | Q41-I45 HydrophobicContact CG-CD1 4.03Å; Q41-I45 WeakPolarHBondContact O-CG1 3.28Å; Q41-I45 PolarHBondContact O-N 3.2Å; R42-I45 PolarHBondContact O-N 3.02Å; I45-L48 PolarHBondContact O-N 3.24Å; I45-R49 PolarHBondContact O-N 2.88Å; I45-R49 VanDerWaalsContact O-N 3.14Å |
| 46 | Q | 58.2 | Low | 56.1 | Low | 90 Ų | 90 | 114 Ų | 114 | 42% | 0.421 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -65 | -45.1 | 175.5 | -160.2 | 67.1 | 71.3 | 0 | 0 | 111.1 | R42 Q43 L48 R49 D50 | R42-Q46 PolarHBondContact O-N 3.18Å; Q43-Q46 PolarHBondContact O-N 3.3Å; Q46-L48 VanDerWaalsContact C-N 3.27Å; Q46-L48 PolarHBondContact O-N 2.94Å; Q46-R49 WeakPolarHBondContact O-CB 3.29Å; Q46-R49 PolarHBondContact O-N 3.37Å; Q46-D50 PolarHBondContact O-N 3.29Å; Q46-D50 VanDerWaalsContact O-N 3.1Å |
| 47 | Q | 60.1 | Low | 56.4 | Low | 133 Ų | 133 | 118.5 Ų | 118.5 | 62% | 0.621 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -61.2 | -31.1 | 175.8 | -69 | -93.7 | 25.8 | 0 | 0 | 113.6 | Q43 | Q43-Q47 WeakPolarHBondContact O-CG 3.29Å; Q43-Q47 PolarHBondContact O-N 3.36Å; Q43-Q47 VanDerWaalsContact O-N 3.11Å |
| 48 | L | 58.5 | Low | 56.5 | Low | 114 Ų | 114 | 116.5 Ų | 116.5 | 60% | 0.597 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -71.4 | -39.2 | 173.5 | -74.5 | 163.4 | 0 | 0 | 0 | 111.5 | A44 I45 Q46 D50 Q51 | A44-L48 WeakPolarHBondContact O-CG 3.37Å; A44-L48 PolarHBondContact O-N 3.25Å; A44-L48 VanDerWaalsContact O-N 3.17Å; I45-L48 PolarHBondContact O-N 3.24Å; Q46-L48 VanDerWaalsContact C-N 3.27Å; Q46-L48 PolarHBondContact O-N 2.94Å; L48-D50 VanDerWaalsContact C-N 3.33Å; L48-D50 PolarHBondContact O-N 2.9Å; L48-Q51 PolarHBondContact O-N 3.38Å |
| 49 | R | 55.6 | Low | 56.9 | Low | 176 Ų | 176 | 119.8 Ų | 119.8 | 66% | 0.664 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -66 | -34.6 | 177.6 | -175.1 | 174.2 | -67.6 | -179.8 | -1.5 | 112.7 | I45 Q46 Q51 D52 | I45-R49 PolarHBondContact O-N 2.88Å; I45-R49 VanDerWaalsContact O-N 3.14Å; Q46-R49 WeakPolarHBondContact O-CB 3.29Å; Q46-R49 PolarHBondContact O-N 3.37Å; R49-Q51 VanDerWaalsContact C-N 3.25Å; R49-Q51 PolarHBondContact O-N 3Å; R49-D52 PolarHBondContact O-N 3.26Å |
| 50 | D | 55.1 | Low | 56.8 | Low | 103 Ų | 103 | 120.7 Ų | 120.7 | 55% | 0.551 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -14.1 | 178.3 | -64.9 | -52.7 | 0 | 0 | 0 | 113.2 | Q46 L48 | Q46-D50 PolarHBondContact O-N 3.29Å; Q46-D50 VanDerWaalsContact O-N 3.1Å; L48-D50 VanDerWaalsContact C-N 3.33Å; L48-D50 PolarHBondContact O-N 2.9Å |
| 51 | Q | 57.1 | Low | 56.6 | Low | 164 Ų | 164 | 122.8 Ų | 122.8 | 77% | 0.766 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -11.4 | 175.6 | -84.8 | -170.4 | 86.9 | 0 | 0 | 115 | L48 R49 | L48-Q51 PolarHBondContact O-N 3.38Å; R49-Q51 VanDerWaalsContact C-N 3.25Å; R49-Q51 PolarHBondContact O-N 3Å |
| 52 | D | 55.8 | Low | 56.9 | Low | 140 Ų | 140 | 125.9 Ų | 125.9 | 75% | 0.749 | 69% | 0.686 | S | S | * | * | trans | -104.8 | 23.4 | 176.4 | -94 | -66.2 | 0 | 0 | 0 | 112.7 | R49 S54 | R49-D52 PolarHBondContact O-N 3.26Å; D52-S54 PolarHBondContact O-N 3.32Å | ||
| 53 | S | 53.7 | Low | 57.1 | Low | 108 Ų | 108 | 124.6 Ų | 124.6 | 76% | 0.755 | 69% | 0.688 | S | S | * | * | trans | -70.6 | 72.3 | 167.2 | -71 | 0 | 0 | 0 | 0 | 111 | ||||
| 54 | S | 53.3 | Low | 56.8 | Low | 114 Ų | 114 | 126 Ų | 126 | 80% | 0.797 | 70% | 0.695 | S | S | * | * | trans | -120.9 | 101.8 | 158.6 | -145.2 | 0 | 0 | 0 | 0 | 107 | D52 | D52-S54 PolarHBondContact O-N 3.32Š| ||
| 55 | S | 53.5 | Low | 56.9 | Low | 112 Ų | 112 | 129.1 Ų | 129.1 | 78% | 0.783 | 71% | 0.708 | S | S | * | * | trans | -65.7 | 129.8 | -172.4 | 51.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 56 | S | 47.8 | Very low | 56.7 | Low | 123 Ų | 123 | 129.8 Ų | 129.8 | 86% | 0.86 | 72% | 0.717 | S | S | * | * | trans | -132.2 | 104.5 | 151.5 | -97.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 57 | D | 60.8 | Low | 56.6 | Low | 140 Ų | 140 | 134 Ų | 134 | 75% | 0.749 | 74% | 0.737 | S | S | * | * | trans | -66.8 | 125.4 | 165.8 | -118.8 | -90.2 | 0 | 0 | 0 | 108.3 | ||||
| 58 | S | 56.3 | Low | 56.3 | Low | 111 Ų | 111 | 134.3 Ų | 134.3 | 78% | 0.776 | 74% | 0.742 | S | S | * | * | trans | -148.1 | 100.9 | 158 | -75.5 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 59 | E | 64.8 | Low | 56.5 | Low | 161 Ų | 161 | 137.6 Ų | 137.6 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | trans | -48.5 | 133 | 167.5 | 38.9 | -95.3 | 83.1 | 0 | 0 | 111.6 | ||||
| 60 | G | 52.5 | Low | 56.5 | Low | 75 Ų | 75 | 134.2 Ų | 134.2 | 77% | 0.773 | 75% | 0.753 | S | S | * | * | trans | -68 | 146.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 61 | D | 54.3 | Low | 56.3 | Low | 135 Ų | 135 | 134.3 Ų | 134.3 | 72% | 0.722 | 76% | 0.762 | S | S | * | * | trans | -113.9 | 137 | 162 | -159.3 | 175.6 | 0 | 0 | 0 | 109 | ||||
| 62 | E | 63.3 | Low | 56.3 | Low | 179 Ų | 179 | 132.2 Ų | 132.2 | 84% | 0.836 | 77% | 0.765 | S | S | * | * | trans | -104.2 | 115.8 | -169.3 | 48.2 | -171.6 | 93.6 | 0 | 0 | 107.6 | ||||
| 63 | E | 60.1 | Low | 56 | Low | 156 Ų | 156 | 132.6 Ų | 132.6 | 73% | 0.729 | 76% | 0.762 | S | S | * | * | trans | -146.8 | 98.9 | 166.4 | 44.8 | -160 | 120.6 | 0 | 0 | 112.6 | T65 | E63-T65 PolarHBondContact O-N 2.95Š| ||
| 64 | E | 54.7 | Low | 56 | Low | 172 Ų | 172 | 133.5 Ų | 133.5 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | trans | -39.3 | 119.3 | 147.7 | -175.1 | -148.1 | 135 | 0 | 0 | 111.8 | ||||
| 65 | T | 59.3 | Low | 56.1 | Low | 117 Ų | 117 | 132.6 Ų | 132.6 | 72% | 0.718 | 76% | 0.758 | S | S | * | * | trans | -148.5 | 99.9 | 151 | 49.6 | 0 | 0 | 0 | 0 | 109 | E63 | E63-T65 PolarHBondContact O-N 2.95Š| ||
| 66 | T | 56.5 | Low | 56.1 | Low | 103 Ų | 103 | 136.6 Ų | 136.6 | 63% | 0.632 | 76% | 0.764 | S | S | * | * | 49.1 | 112 | 106.5 | 63.5 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 67 | Q | 54.8 | Low | 56.1 | Low | 178 Ų | 178 | 139.7 Ų | 139.7 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | trans | 71.7 | 114.9 | 132.2 | -164.9 | 178.3 | -9 | 0 | 0 | 117.9 | ||||
| 68 | D | 54.4 | Low | 55.7 | Low | 139 Ų | 139 | 140.9 Ų | 140.9 | 74% | 0.743 | 77% | 0.771 | S | S | * | * | trans | -145.3 | 98.4 | 142.5 | -163.9 | -116.3 | 0 | 0 | 0 | 109.4 | V70 | D68-V70 WeakPolarHBondContact OD1-CG1 3.26Å; D68-V70 WeakPolarHBondContact OD2-CG1 3.41Å | ||
| 69 | E | 63 | Low | 55.1 | Low | 184 Ų | 184 | 138.8 Ų | 138.8 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | -98.8 | 104.6 | 158.6 | -66.4 | -140.6 | 109.7 | 0 | 0 | 106.8 | ||||
| 70 | V | 55.1 | Low | 53.8 | Low | 104 Ų | 104 | 134.6 Ų | 134.6 | 63% | 0.63 | 77% | 0.767 | S | S | * | * | trans | -158 | 126.6 | 160.9 | 51.5 | 0 | 0 | 0 | 0 | 113.5 | D68 | D68-V70 WeakPolarHBondContact OD1-CG1 3.26Å; D68-V70 WeakPolarHBondContact OD2-CG1 3.41Å | ||
| 71 | S | 52.2 | Low | 53.4 | Low | 106 Ų | 106 | 138 Ų | 138 | 74% | 0.741 | 77% | 0.773 | S | S | * | * | trans | 75.9 | 104.8 | 147.3 | -74.8 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 72 | S | 56.9 | Low | 52.9 | Low | 119 Ų | 119 | 137.9 Ų | 137.9 | 83% | 0.832 | 78% | 0.776 | S | S | * | * | -38.7 | 134.8 | 125 | -50.2 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 73 | H | 48.9 | Very low | 52.1 | Low | 148 Ų | 148 | 136.7 Ų | 136.7 | 69% | 0.685 | 77% | 0.768 | S | S | * | * | trans | -174.5 | 121.4 | 140.9 | 144.9 | -94.6 | 0 | 0 | 0 | 110.8 | S75 | H73-S75 WeakPolarHBondContact CE1-CB 3.41Å; H73-S75 PolarHBondContact CE1-OG 3.38Å; H73-S75 PolarHBondContact NE2-OG 3.49Å | ||
| 74 | T | 52.5 | Low | 51.2 | Low | 128 Ų | 128 | 135.3 Ų | 135.3 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | trans | -59.2 | 130.4 | 161.5 | 51.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 75 | S | 55.4 | Low | 50.6 | Low | 95 Ų | 95 | 134.3 Ų | 134.3 | 66% | 0.664 | 77% | 0.765 | S | S | * | * | trans | -146.6 | 126.2 | 157.3 | -103.9 | 0 | 0 | 0 | 0 | 111.7 | H73 | H73-S75 WeakPolarHBondContact CE1-CB 3.41Å; H73-S75 PolarHBondContact CE1-OG 3.38Å; H73-S75 PolarHBondContact NE2-OG 3.49Å | ||
| 76 | E | 54.1 | Low | 50.1 | Low | 195 Ų | 195 | 137.2 Ų | 137.2 | 91% | 0.911 | 77% | 0.768 | S | S | * | * | trans | -69.4 | 135.2 | 166.9 | -61.6 | 155.5 | 87.5 | 0 | 0 | 108.9 | ||||
| 77 | E | 47.8 | Very low | 49 | Very low | 188 Ų | 188 | 140.6 Ų | 140.6 | 88% | 0.879 | 78% | 0.777 | S | S | * | * | trans | -152.4 | 93.9 | 147.1 | -173.7 | 142.7 | 65.4 | 0 | 0 | 108.5 | ||||
| 78 | D | 52.6 | Low | 48.4 | Very low | 166 Ų | 166 | 139.5 Ų | 139.5 | 89% | 0.888 | 78% | 0.776 | S | S | * | * | trans | -81.9 | 129.3 | 158.1 | 173.4 | -114.5 | 0 | 0 | 0 | 107.9 | ||||
| 79 | G | 42.8 | Very low | 47.3 | Very low | 67 Ų | 67 | 141 Ų | 141 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | trans | 143.2 | 101 | 168.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 80 | G | 38.1 | Very low | 45.8 | Very low | 73 Ų | 73 | 139.5 Ų | 139.5 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | 173.2 | 70.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | V82 | G80-V82 PolarHBondContact O-N 3.46Š| ||
| 81 | V | 43.9 | Very low | 44.8 | Very low | 147 Ų | 147 | 138.4 Ų | 138.4 | 89% | 0.891 | 77% | 0.77 | S | S | * | * | trans | -49.5 | 115 | 172.2 | -73.7 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 82 | V | 43.6 | Very low | 44 | Very low | 131 Ų | 131 | 141.3 Ų | 141.3 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | trans | -119.9 | 92.4 | 157.8 | -171 | 0 | 0 | 0 | 0 | 109 | G80 V84 | G80-V82 PolarHBondContact O-N 3.46Å; V82-V84 PolarHBondContact O-N 3.22Å | ||
| 83 | K | 46.4 | Very low | 43 | Very low | 154 Ų | 154 | 144 Ų | 144 | 67% | 0.67 | 77% | 0.771 | S | S | * | * | trans | -39.2 | 109.2 | 159.6 | -170.9 | 176.7 | 171.9 | -173.8 | 0 | 111.2 | E85 | K83-E85 WeakPolarHBondContact CE-OE1 3.21Å; K83-E85 VanDerWaalsContact CE-OE2 3.29Å; K83-E85 WeakPolarHBondContact CE-OE2 3.43Å; K83-E85 HydrophobicContact CG-CG 4.18Å; K83-E85 IonicContact NZ-OE1 3.32Å; K83-E85 PolarHBondContact NZ-OE1 2.85Å; K83-E85 IonicContact NZ-OE2 3.84Å | ||
| 84 | V | 41.8 | Very low | 43.1 | Very low | 128 Ų | 128 | 142.1 Ų | 142.1 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | -120.3 | 95 | 154.8 | 176.7 | 0 | 0 | 0 | 0 | 106.8 | V82 K86 | V82-V84 PolarHBondContact O-N 3.22Å; V84-K86 PolarHBondContact O-N 3.46Å | ||
| 85 | E | 41.8 | Very low | 42.1 | Very low | 150 Ų | 150 | 143.1 Ų | 143.1 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | trans | -57.6 | 114.3 | 163.7 | -69.3 | 159.5 | 141.4 | 0 | 0 | 107.9 | K83 | K83-E85 WeakPolarHBondContact CE-OE1 3.21Å; K83-E85 VanDerWaalsContact CE-OE2 3.29Å; K83-E85 WeakPolarHBondContact CE-OE2 3.43Å; K83-E85 HydrophobicContact CG-CG 4.18Å; K83-E85 IonicContact NZ-OE1 3.32Å; K83-E85 PolarHBondContact NZ-OE1 2.85Å; K83-E85 IonicContact NZ-OE2 3.84Å | ||
| 86 | K | 49.3 | Very low | 40.9 | Very low | 178 Ų | 178 | 142 Ų | 142 | 77% | 0.774 | 78% | 0.782 | S | S | * | * | trans | -144 | 77.9 | 150.5 | -160 | 172.6 | -177.9 | -176.8 | 0 | 110 | V84 L88 | V84-K86 PolarHBondContact O-N 3.46Å; K86-L88 PolarHBondContact O-N 3.27Å | ||
| 87 | E | 33.3 | Very low | 40.1 | Very low | 174 Ų | 174 | 136.8 Ų | 136.8 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | trans | -46.9 | 116.4 | 148.4 | -178.7 | -178.5 | 100.5 | 0 | 0 | 109.7 | ||||
| 88 | L | 41.5 | Very low | 39.4 | Very low | 155 Ų | 155 | 135.4 Ų | 135.4 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | trans | -142.6 | 91.5 | 139.4 | -78.7 | -173.3 | 0 | 0 | 0 | 107.5 | K86 | K86-L88 PolarHBondContact O-N 3.27Š| ||
| 89 | E | 31.4 | Very low | 38.7 | Very low | 172 Ų | 172 | 135.8 Ų | 135.8 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -57.4 | 127 | 159.8 | 178.7 | 167.3 | 66.2 | 0 | 0 | 110.3 | ||||
| 90 | N | 33.3 | Very low | 38.4 | Very low | 152 Ų | 152 | 138.6 Ų | 138.6 | 81% | 0.813 | 78% | 0.778 | S | S | * | * | trans | -135.5 | 82.1 | 158.3 | -164.9 | -113.2 | 0 | 0 | 0 | 108.6 | ||||
| 91 | T | 33.4 | Very low | 38.8 | Very low | 81 Ų | 81 | 140.9 Ų | 140.9 | 50% | 0.497 | 78% | 0.778 | S | S | . | * | 40.1 | 106.3 | 125.6 | -39.2 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 92 | E | 36.2 | Very low | 38.3 | Very low | 166 Ų | 166 | 143.2 Ų | 143.2 | 78% | 0.776 | 78% | 0.779 | S | S | * | * | trans | 48 | 136.8 | 130.4 | -47.1 | 174.4 | 98.8 | 0 | 0 | 118.7 | ||||
| 93 | Q | 35 | Very low | 38.7 | Very low | 175 Ų | 175 | 144.5 Ų | 144.5 | 82% | 0.818 | 78% | 0.776 | S | S | * | * | cis | -175.6 | 175.9 | 15.1 | -118.8 | -169.2 | 27 | 0 | 0 | 107.9 | ||||
| 94 | P | 50.2 | Low | 38.2 | Very low | 109 Ų | 109 | 145.8 Ų | 145.8 | 71% | 0.708 | 78% | 0.784 | S | S | * | * | trans | -95 | 143.3 | -169.3 | 37 | -32.1 | 0 | 0 | 0 | 114.8 | ||||
| 95 | V | 32.1 | Very low | 38.8 | Very low | 150 Ų | 150 | 145.4 Ų | 145.4 | 91% | 0.909 | 78% | 0.782 | S | S | * | * | trans | -149 | 115.3 | 164.9 | 171.1 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 96 | G | 30.6 | Very low | 38.5 | Very low | 72 Ų | 72 | 145.1 Ų | 145.1 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | 105.4 | 118.5 | 75.4 | 0 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 97 | G | 37.7 | Very low | 38.1 | Very low | 85 Ų | 85 | 139.3 Ų | 139.3 | 88% | 0.876 | 78% | 0.781 | S | S | * | * | trans | -67.5 | 162.1 | -165.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 98 | N | 31.7 | Very low | 38.8 | Very low | 158 Ų | 158 | 138.7 Ų | 138.7 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | trans | -150.4 | 116.3 | 148.1 | -163.4 | 15.3 | 0 | 0 | 0 | 109 | ||||
| 99 | E | 39.5 | Very low | 39 | Very low | 174 Ų | 174 | 139.2 Ų | 139.2 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | trans | -67.9 | 153.5 | 158 | -93.2 | -178.9 | 91.5 | 0 | 0 | 109.4 | ||||
| 100 | V | 36.8 | Very low | 40 | Very low | 126 Ų | 126 | 135.4 Ų | 135.4 | 76% | 0.764 | 77% | 0.771 | S | S | * | * | trans | 146.3 | 96.5 | 138.3 | 178.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 101 | V | 45.9 | Very low | 40.9 | Very low | 122 Ų | 122 | 134.1 Ų | 134.1 | 74% | 0.739 | 78% | 0.775 | S | S | * | * | trans | 29.8 | 120.1 | 130.1 | -172.6 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 102 | E | 33.8 | Very low | 42 | Very low | 195 Ų | 195 | 133.4 Ų | 133.4 | 91% | 0.911 | 77% | 0.768 | S | S | * | * | -159.9 | 99.3 | 126.8 | -105.5 | 169.2 | 150.7 | 0 | 0 | 109.7 | |||||
| 103 | H | 51.8 | Low | 43.1 | Very low | 158 Ų | 158 | 129.9 Ų | 129.9 | 73% | 0.731 | 76% | 0.759 | S | S | * | * | trans | -81.7 | 114.5 | 162.6 | 165.9 | -107 | 0 | 0 | 0 | 106.6 | ||||
| 104 | E | 34.7 | Very low | 44.3 | Very low | 181 Ų | 181 | 127.1 Ų | 127.1 | 85% | 0.846 | 75% | 0.749 | S | S | * | * | trans | -168.8 | 94.3 | 152 | -105.8 | 163 | -179.5 | 0 | 0 | 112.8 | ||||
| 105 | V | 54.4 | Low | 44.7 | Very low | 120 Ų | 120 | 126.5 Ų | 126.5 | 73% | 0.727 | 74% | 0.74 | S | S | * | * | trans | 14.5 | 110.1 | 141.9 | -176.6 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 106 | T | 37 | Very low | 46.1 | Very low | 145 Ų | 145 | 126.6 Ų | 126.6 | 89% | 0.89 | 73% | 0.73 | S | S | * | * | trans | -138.9 | 98.6 | 143.1 | 29.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 107 | G | 39 | Very low | 47.9 | Very low | 56 Ų | 56 | 128.6 Ų | 128.6 | 58% | 0.577 | 72% | 0.723 | S | S | * | * | trans | 30.2 | 119 | 145.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 108 | N | 49.7 | Very low | 50.3 | Low | 161 Ų | 161 | 125.4 Ų | 125.4 | 86% | 0.861 | 69% | 0.687 | S | S | * | * | trans | 42.7 | 79.5 | 139.9 | -72.8 | 11 | 0 | 0 | 0 | 116.7 | ||||
| 109 | L | 45.9 | Very low | 53.1 | Low | 166 Ų | 166 | 121.9 Ų | 121.9 | 87% | 0.869 | 67% | 0.666 | S | S | * | * | trans | -141.7 | 45 | 158.7 | -66.7 | 178.6 | 0 | 0 | 0 | 112 | ||||
| 110 | N | 50.7 | Low | 55.6 | Low | 91 Ų | 91 | 113.7 Ų | 113.7 | 49% | 0.487 | 63% | 0.627 | S | S | . | * | trans | -153 | 82.4 | 160.2 | -133.6 | -86 | 0 | 0 | 0 | 111.6 | D112 L115 | N110-D112 PolarHBondContact O-N 2.9Å; N110-D112 WeakPolarHBondContact OD1-CB 2.99Å; N110-D112 PolarHBondContact OD1-N 3.48Å; N110-L115 HydrophobicContact CB-CD1 3.72Å; N110-L115 WeakPolarHBondContact OD1-CD1 3.49Å | ||
| 111 | S | 52.7 | Low | 58.1 | Low | 126 Ų | 126 | 113 Ų | 113 | 88% | 0.881 | 63% | 0.626 | S | S | * | * | trans | -73.8 | 48.9 | 157.8 | -51.8 | 0 | 0 | 0 | 0 | 109.6 | P113 | S111-P113 WeakPolarHBondContact O-CD 3.39Š| ||
| 112 | D | 55.7 | Low | 60.2 | Low | 65 Ų | 65 | 114 Ų | 114 | 35% | 0.348 | 63% | 0.626 | S | S | . | * | trans | -92.4 | 110.2 | 162.3 | -169.9 | -9.2 | 0 | 0 | 0 | 106.1 | N110 L114 L115 | N110-D112 PolarHBondContact O-N 2.9Å; N110-D112 WeakPolarHBondContact OD1-CB 2.99Å; N110-D112 PolarHBondContact OD1-N 3.48Å; D112-L114 PolarHBondContact O-N 3.36Å; D112-L114 WeakPolarHBondContact OD1-CB 3.4Å; D112-L114 PolarHBondContact OD1-N 3.21Å; D112-L114 VanDerWaalsContact OD1-N 3.14Å; D112-L115 HydrophobicContact CB-CD1 4.48Å; D112-L115 HydrophobicContact CB-CG 4.29Å; D112-L115 PolarHBondContact O-N 3.07Å | ||
| 113 | P | 59.6 | Low | 63.1 | Low | 93 Ų | 93 | 107.8 Ų | 107.8 | 60% | 0.604 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -13.2 | 177.8 | 21.1 | -30.9 | 0 | 0 | 0 | 112.9 | S111 L117 | S111-P113 WeakPolarHBondContact O-CD 3.39Å; P113-L117 WeakPolarHBondContact O-CD1 3.35Å |
| 114 | L | 60.9 | Low | 64.8 | Low | 116 Ų | 116 | 107.5 Ų | 107.5 | 61% | 0.607 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -23.6 | 173.8 | -62 | 177.6 | 0 | 0 | 0 | 114.7 | D112 L117 | D112-L114 PolarHBondContact O-N 3.36Å; D112-L114 WeakPolarHBondContact OD1-CB 3.4Å; D112-L114 PolarHBondContact OD1-N 3.21Å; D112-L114 VanDerWaalsContact OD1-N 3.14Å; L114-L117 WeakPolarHBondContact O-CB 3.27Å; L114-L117 PolarHBondContact O-N 3.42Å |
| 115 | L | 57.5 | Low | 67.5 | Low | 96 Ų | 96 | 103.2 Ų | 103.2 | 50% | 0.503 | 59% | 0.585 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82 | -31.9 | 177 | -72.9 | -177.1 | 0 | 0 | 0 | 112.3 | N110 D112 L117 C118 | N110-L115 HydrophobicContact CB-CD1 3.72Å; N110-L115 WeakPolarHBondContact OD1-CD1 3.49Å; D112-L115 HydrophobicContact CB-CD1 4.48Å; D112-L115 HydrophobicContact CB-CG 4.29Å; D112-L115 PolarHBondContact O-N 3.07Å; L115-L117 PolarHBondContact O-N 2.99Å; L115-C118 PolarHBondContact O-N 2.79Å |
| 116 | E | 61.8 | Low | 69.2 | Low | 152 Ų | 152 | 103.2 Ų | 103.2 | 71% | 0.71 | 58% | 0.581 | S | S | * | * | G | 310 helix | trans | -62.5 | -21.7 | 168.7 | -66.5 | -169.2 | 159.6 | 0 | 0 | 112.1 | C118 Q119 | E116-C118 PolarHBondContact O-N 2.87Å; E116-Q119 PolarHBondContact O-N 3.3Å |
| 117 | L | 70.1 | Confident | 71.8 | Confident | 115 Ų | 115 | 96.9 Ų | 96.9 | 60% | 0.602 | 54% | 0.543 | S | S | * | . | G | 310 helix | trans | -72.2 | -14.3 | 177.6 | -109.5 | 81.7 | 0 | 0 | 0 | 114 | P113 L114 L115 L133 | P113-L117 WeakPolarHBondContact O-CD1 3.35Å; L114-L117 WeakPolarHBondContact O-CB 3.27Å; L114-L117 PolarHBondContact O-N 3.42Å; L115-L117 PolarHBondContact O-N 2.99Å; L117-L133 WeakPolarHBondContact O-CD2 3.4Å |
| 118 | C | 86.6 | Confident | 74.1 | Confident | 17 Ų | 17 | 97.6 Ų | 97.6 | 12% | 0.115 | 55% | 0.55 | C | S | . | . | G | 310 helix | trans | -98.4 | 6.7 | -179.7 | -58.6 | 0 | 0 | 0 | 0 | 113.1 | L115 E116 C127 | L115-C118 PolarHBondContact O-N 2.79Å; E116-C118 PolarHBondContact O-N 2.87Å; C118-C127 WeakPolarHBondContact CB-O 3.48Å; C118-C127 WeakPolarHBondContact O-CA 3.38Å; C118-C127 WeakPolarHBondContact O-CB 3.47Å; C118-C127 PolarHBondContact O-N 3.48Å |
| 119 | Q | 91.4 | Very high | 75.9 | Confident | 85 Ų | 85 | 91.8 Ų | 91.8 | 40% | 0.397 | 52% | 0.521 | S | S | . | . | B | Isolated β-bridge | trans | -88.4 | 135.1 | 174.2 | -170.2 | 173.1 | 82.5 | 0 | 0 | 111.6 | E116 P121 D126 | E116-Q119 PolarHBondContact O-N 3.3Å; Q119-P121 WeakPolarHBondContact O-CD 3.49Å; Q119-D126 WeakPolarHBondContact CG-OD1 3.29Å; Q119-D126 PolarHBondContact NE2-OD1 3.08Å |
| 120 | C | 90.9 | Very high | 78.1 | Confident | 1 Ų | 1 | 92 Ų | 92 | 1% | 0.007 | 51% | 0.511 | C | S | . | . | trans | -75.5 | 121.6 | 177.6 | -179.4 | 0 | 0 | 0 | 0 | 111.5 | L122 C123 Q124 L125 L133 H136 | C120-L122 PolarHBondContact O-N 2.9Å; C120-C123 VanDerWaalsContact CB-SG 3.58Å; C120-Q124 WeakPolarHBondContact O-CA 3.28Å; C120-Q124 PolarHBondContact O-N 2.86Å; C120-L125 HydrophobicContact CB-CB 4.47Å; C120-L125 PolarHBondContact N-O 3.46Å; C120-L133 VanDerWaalsContact CA-CD1 3.49Å; C120-L133 HydrophobicContact CB-CD1 3.61Å; C120-H136 PolarHBondContact SG-CD2 2.63Å; C120-H136 PolarHBondContact SG-NE2 3.01Å; C120-H136 VanDerWaalsContact SG-NE2 3.42Å | ||
| 121 | P | 88.9 | Confident | 80.1 | Confident | 113 Ų | 113 | 93.8 Ų | 93.8 | 73% | 0.734 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -12.7 | -178.3 | 29.2 | -35.8 | 0 | 0 | 0 | 113.7 | Q119 | Q119-P121 WeakPolarHBondContact O-CD 3.49Š|
| 122 | L | 91.8 | Very high | 82 | Confident | 141 Ų | 141 | 93.2 Ų | 93.2 | 74% | 0.738 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.5 | -37.8 | -177.4 | -58.3 | 178.6 | 0 | 0 | 0 | 112.5 | C120 | C120-L122 PolarHBondContact O-N 2.9Š|
| 123 | C | 92.9 | Very high | 83.8 | Confident | 65 Ų | 65 | 91.2 Ų | 91.2 | 44% | 0.439 | 49% | 0.489 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -126.9 | -0.7 | -173.4 | 67.3 | 0 | 0 | 0 | 0 | 113.7 | C120 L125 H136 | C120-C123 VanDerWaalsContact CB-SG 3.58Å; C123-L125 PolarHBondContact O-N 3.23Å; C123-L125 WeakPolarHBondContact SG-CB 3.39Å; C123-H136 PolarHBondContact SG-NE2 3.17Å |
| 124 | Q | 88.8 | Confident | 85.4 | Confident | 152 Ų | 152 | 90.5 Ų | 90.5 | 71% | 0.71 | 48% | 0.479 | S | S | * | . | trans | 57.9 | 23.9 | -178 | -63.1 | 157.4 | 87.8 | 0 | 0 | 113.5 | C120 | C120-Q124 WeakPolarHBondContact O-CA 3.28Å; C120-Q124 PolarHBondContact O-N 2.86Å | ||
| 125 | L | 91.3 | Very high | 86.9 | Confident | 91 Ų | 91 | 87 Ų | 87 | 48% | 0.476 | 47% | 0.467 | S | S | . | . | trans | -75.7 | 126.6 | 174.2 | -172.9 | 71.2 | 0 | 0 | 0 | 109.9 | C120 C123 C127 | C120-L125 HydrophobicContact CB-CB 4.47Å; C120-L125 PolarHBondContact N-O 3.46Å; C123-L125 PolarHBondContact O-N 3.23Å; C123-L125 WeakPolarHBondContact SG-CB 3.39Å; L125-C127 PolarHBondContact O-N 3.02Å | ||
| 126 | D | 90.9 | Very high | 88.7 | Confident | 120 Ų | 120 | 85.7 Ų | 85.7 | 64% | 0.642 | 46% | 0.458 | S | S | * | . | B | Isolated β-bridge | trans | -74.6 | 113.3 | 171.5 | -66.5 | -38.5 | 0 | 0 | 0 | 109.6 | Q119 | Q119-D126 WeakPolarHBondContact CG-OD1 3.29Å; Q119-D126 PolarHBondContact NE2-OD1 3.08Å |
| 127 | C | 90.3 | Very high | 90.2 | Very high | 13 Ų | 13 | 81.5 Ų | 81.5 | 9% | 0.088 | 44% | 0.443 | C | S | . | . | trans | -91 | 141.6 | 172.8 | -52.7 | 0 | 0 | 0 | 0 | 108.9 | C118 L125 S129 Q132 L133 | C118-C127 WeakPolarHBondContact CB-O 3.48Å; C118-C127 WeakPolarHBondContact O-CA 3.38Å; C118-C127 WeakPolarHBondContact O-CB 3.47Å; C118-C127 PolarHBondContact O-N 3.48Å; L125-C127 PolarHBondContact O-N 3.02Å; C127-S129 PolarHBondContact O-N 2.96Å; C127-Q132 HydrophobicContact CB-CB 4.21Å; C127-Q132 HydrophobicContact CB-CG 4.38Å; C127-L133 HydrophobicContact CB-CB 3.83Å; C127-L133 VanDerWaalsContact SG-CA 3.58Å | ||
| 128 | G | 86.9 | Confident | 91.2 | Very high | 70 Ų | 70 | 85.5 Ų | 85.5 | 72% | 0.722 | 45% | 0.452 | S | S | * | . | S | Bend | trans | -73.3 | -13.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q132 | G128-Q132 VanDerWaalsContact N-OE1 3.1Š|
| 129 | S | 89 | Confident | 91 | Very high | 39 Ų | 39 | 95 Ų | 95 | 27% | 0.273 | 49% | 0.494 | S | S | . | . | S | Bend | trans | -153.9 | 166.8 | 175.2 | 88.4 | 0 | 0 | 0 | 0 | 111.8 | C127 E131 Q132 L133 | C127-S129 PolarHBondContact O-N 2.96Å; S129-E131 VanDerWaalsContact C-N 3.33Å; S129-E131 WeakPolarHBondContact CB-OE2 3.29Å; S129-E131 PolarHBondContact O-N 2.98Å; S129-E131 PolarHBondContact OG-N 3.34Å; S129-E131 PolarHBondContact OG-OE2 3.14Å; S129-Q132 PolarHBondContact O-N 3.13Å; S129-Q132 PolarHBondContact OG-N 3.02Å; S129-L133 PolarHBondContact O-N 3.22Å |
| 130 | R | 90.6 | Very high | 91 | Very high | 171 Ų | 171 | 95.5 Ų | 95.5 | 65% | 0.645 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.5 | -40 | 174.9 | -177.9 | -179.9 | 174.7 | -159.9 | -1.3 | 112 | Q132 L133 I134 | R130-Q132 VanDerWaalsContact C-N 3.3Å; R130-Q132 PolarHBondContact O-N 2.96Å; R130-L133 PolarHBondContact O-N 2.97Å; R130-I134 HydrophobicContact CG-CD1 4Å; R130-I134 VanDerWaalsContact O-CG1 3.27Å; R130-I134 WeakPolarHBondContact O-CG1 3.31Å; R130-I134 PolarHBondContact O-N 2.76Å |
| 131 | E | 92.8 | Very high | 91 | Very high | 129 Ų | 129 | 100.5 Ų | 100.5 | 60% | 0.603 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.6 | -39 | 179.3 | -59.8 | 68 | -143.4 | 0 | 0 | 110.6 | S129 I134 A135 | S129-E131 VanDerWaalsContact C-N 3.33Å; S129-E131 WeakPolarHBondContact CB-OE2 3.29Å; S129-E131 PolarHBondContact O-N 2.98Å; S129-E131 PolarHBondContact OG-N 3.34Å; S129-E131 PolarHBondContact OG-OE2 3.14Å; E131-I134 PolarHBondContact O-N 3.25Å; E131-A135 WeakPolarHBondContact O-CB 3.31Å; E131-A135 PolarHBondContact O-N 3.14Å |
| 132 | Q | 92.6 | Very high | 91.1 | Very high | 113 Ų | 113 | 99.8 Ų | 99.8 | 53% | 0.528 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.2 | -38.4 | 176.4 | -164.9 | 174.4 | 10.5 | 0 | 0 | 111.6 | C127 G128 S129 R130 A135 H136 | C127-Q132 HydrophobicContact CB-CB 4.21Å; C127-Q132 HydrophobicContact CB-CG 4.38Å; G128-Q132 VanDerWaalsContact N-OE1 3.1Å; S129-Q132 PolarHBondContact O-N 3.13Å; S129-Q132 PolarHBondContact OG-N 3.02Å; R130-Q132 VanDerWaalsContact C-N 3.3Å; R130-Q132 PolarHBondContact O-N 2.96Å; Q132-A135 PolarHBondContact O-N 3.28Å; Q132-H136 VanDerWaalsContact O-CB 3.24Å; Q132-H136 WeakPolarHBondContact O-CB 3.36Å; Q132-H136 PolarHBondContact O-N 3.17Å |
| 133 | L | 93.4 | Very high | 91 | Very high | 24 Ų | 24 | 97.4 Ų | 97.4 | 13% | 0.126 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -62.3 | -45.7 | 172 | 175 | 60.2 | 0 | 0 | 0 | 111.9 | L117 C120 C127 S129 R130 H136 V137 | L117-L133 WeakPolarHBondContact O-CD2 3.4Å; C120-L133 VanDerWaalsContact CA-CD1 3.49Å; C120-L133 HydrophobicContact CB-CD1 3.61Å; C127-L133 HydrophobicContact CB-CB 3.83Å; C127-L133 VanDerWaalsContact SG-CA 3.58Å; S129-L133 PolarHBondContact O-N 3.22Å; R130-L133 PolarHBondContact O-N 2.97Å; L133-H136 PolarHBondContact O-N 3.19Å; L133-V137 HydrophobicContact CD1-CG2 4.03Å; L133-V137 WeakPolarHBondContact O-CG2 3.3Å; L133-V137 PolarHBondContact O-N 3.46Å |
| 134 | I | 93 | Very high | 90.9 | Very high | 77 Ų | 77 | 99.4 Ų | 99.4 | 40% | 0.395 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.7 | -50.6 | 176.7 | -68 | 165.1 | 0 | 0 | 0 | 109.7 | R130 E131 H136 V137 Y138 | R130-I134 HydrophobicContact CG-CD1 4Å; R130-I134 VanDerWaalsContact O-CG1 3.27Å; R130-I134 WeakPolarHBondContact O-CG1 3.31Å; R130-I134 PolarHBondContact O-N 2.76Å; E131-I134 PolarHBondContact O-N 3.25Å; I134-H136 PolarHBondContact O-N 3.46Å; I134-V137 PolarHBondContact O-N 2.78Å; I134-Y138 HydrophobicContact CG2-CD2 3.85Å; I134-Y138 HydrophobicContact CG2-CE2 4.15Å; I134-Y138 VanDerWaalsContact O-CD2 3.29Å; I134-Y138 WeakPolarHBondContact O-CD2 3.41Å; I134-Y138 PolarHBondContact O-N 3.32Å |
| 135 | A | 94.2 | Very high | 91.1 | Very high | 44 Ų | 44 | 95.9 Ų | 95.9 | 36% | 0.364 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.1 | -34.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | E131 Q132 Q139 | E131-A135 WeakPolarHBondContact O-CB 3.31Å; E131-A135 PolarHBondContact O-N 3.14Å; Q132-A135 PolarHBondContact O-N 3.28Å; A135-Q139 WeakPolarHBondContact O-CB 3.47Å; A135-Q139 VanDerWaalsContact O-CG 3.26Å; A135-Q139 WeakPolarHBondContact O-CG 3.33Å; A135-Q139 PolarHBondContact O-N 2.97Å; A135-Q139 PolarHBondContact O-NE2 2.98Å |
| 136 | H | 93.8 | Very high | 91 | Very high | 67 Ų | 67 | 96.2 Ų | 96.2 | 31% | 0.31 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.1 | -38.7 | 176.6 | 169.9 | 69.9 | 0 | 0 | 0 | 112.9 | C120 C123 Q132 L133 I134 | C120-H136 PolarHBondContact SG-CD2 2.63Å; C120-H136 PolarHBondContact SG-NE2 3.01Å; C120-H136 VanDerWaalsContact SG-NE2 3.42Å; C123-H136 PolarHBondContact SG-NE2 3.17Å; Q132-H136 VanDerWaalsContact O-CB 3.24Å; Q132-H136 WeakPolarHBondContact O-CB 3.36Å; Q132-H136 PolarHBondContact O-N 3.17Å; L133-H136 PolarHBondContact O-N 3.19Å; I134-H136 PolarHBondContact O-N 3.46Å |
| 137 | V | 93.4 | Very high | 91 | Very high | 65 Ų | 65 | 94.4 Ų | 94.4 | 39% | 0.394 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -77 | -27.7 | -177.7 | 173.4 | 0 | 0 | 0 | 0 | 112.7 | L133 I134 | L133-V137 HydrophobicContact CD1-CG2 4.03Å; L133-V137 WeakPolarHBondContact O-CG2 3.3Å; L133-V137 PolarHBondContact O-N 3.46Å; I134-V137 PolarHBondContact O-N 2.78Å |
| 138 | Y | 92.3 | Very high | 91.1 | Very high | 199 Ų | 199 | 101.2 Ų | 101.2 | 78% | 0.78 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -101.6 | 0.2 | -174.7 | -74.1 | -74.9 | 0 | 0 | 0 | 115.4 | I134 | I134-Y138 HydrophobicContact CG2-CD2 3.85Å; I134-Y138 HydrophobicContact CG2-CE2 4.15Å; I134-Y138 VanDerWaalsContact O-CD2 3.29Å; I134-Y138 WeakPolarHBondContact O-CD2 3.41Å; I134-Y138 PolarHBondContact O-N 3.32Å |
| 139 | Q | 81.2 | Confident | 91.5 | Very high | 216 Ų | 216 | 104 Ų | 104 | 100% | 1.009 | 49% | 0.493 | S | S | * | . | trans | -100.9 | 0 | 173.2 | -75.4 | -179.2 | 103.4 | 0 | 0 | 111.3 | A135 | A135-Q139 WeakPolarHBondContact O-CB 3.47Å; A135-Q139 VanDerWaalsContact O-CG 3.26Å; A135-Q139 WeakPolarHBondContact O-CG 3.33Å; A135-Q139 PolarHBondContact O-N 2.97Å; A135-Q139 PolarHBondContact O-NE2 2.98Å |
Retrieved 139 of 139 residues in 255 ms
(Link to these results)