| 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 | 45.4 | Very low | 43.3 | Very low | 247 Ų | 247 | 162.4 Ų | 162.4 | 100% | 1.217 | 85% | 0.852 | S | S | * | * | 0 | 84.3 | 0 | -69.6 | -82.3 | -105.1 | 0 | 0 | 107.3 | |||||
| 2 | A | 37.9 | Very low | 44.3 | Very low | 102 Ų | 102 | 157 Ų | 157 | 84% | 0.843 | 83% | 0.834 | S | S | * | * | trans | -163.4 | 137 | 167.5 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 3 | E | 37.5 | Very low | 45.2 | Very low | 193 Ų | 193 | 163.4 Ų | 163.4 | 90% | 0.902 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 149 | -159 | -64.2 | 162.6 | 162.5 | 0 | 0 | 113.6 | ||
| 4 | E | 36 | Very low | 46.1 | Very low | 184 Ų | 184 | 157.3 Ų | 157.3 | 86% | 0.86 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 134.7 | 168.6 | -64.9 | -174.6 | 160.5 | 0 | 0 | 110.2 | ||
| 5 | P | 44.8 | Very low | 47.5 | Very low | 123 Ų | 123 | 155.6 Ų | 155.6 | 80% | 0.799 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 122.8 | 162.4 | 30.2 | -28.7 | 0 | 0 | 0 | 109.6 | A7 | P5-A7 PolarHBondContact O-N 3.2Å; P5-A7 VanDerWaalsContact O-N 3.13Å |
| 6 | V | 41 | Very low | 49 | Very low | 134 Ų | 134 | 153.6 Ų | 153.6 | 81% | 0.812 | 82% | 0.815 | S | S | * | * | trans | -49.3 | 111.9 | 175.3 | 174.6 | 0 | 0 | 0 | 0 | 110.2 | E8 | V6-E8 PolarHBondContact O-N 3.31Å; V6-E8 VanDerWaalsContact O-N 3.15Å | ||
| 7 | A | 42.1 | Very low | 50.2 | Low | 87 Ų | 87 | 153.3 Ų | 153.3 | 72% | 0.719 | 81% | 0.805 | S | S | * | * | trans | -68.9 | 106 | 168.6 | 0 | 0 | 0 | 0 | 0 | 108.4 | P5 E9 | P5-A7 PolarHBondContact O-N 3.2Å; P5-A7 VanDerWaalsContact O-N 3.13Å; A7-E9 PolarHBondContact O-N 3.43Å | ||
| 8 | E | 47.1 | Very low | 51.6 | Low | 178 Ų | 178 | 152.7 Ų | 152.7 | 83% | 0.832 | 80% | 0.802 | S | S | * | * | trans | -61.7 | 103.8 | 163.8 | -74.4 | -174.6 | 161 | 0 | 0 | 108.1 | V6 I10 | V6-E8 PolarHBondContact O-N 3.31Å; V6-E8 VanDerWaalsContact O-N 3.15Å; E8-I10 PolarHBondContact O-N 2.83Å | ||
| 9 | E | 42 | Very low | 52.9 | Low | 173 Ų | 173 | 148.9 Ų | 148.9 | 81% | 0.808 | 78% | 0.783 | S | S | * | * | trans | -60.5 | 106.8 | 173.7 | -88.6 | -172.7 | 148.3 | 0 | 0 | 109.7 | A7 R11 | A7-E9 PolarHBondContact O-N 3.43Å; E9-R11 VanDerWaalsContact C-N 3.32Å; E9-R11 PolarHBondContact O-N 2.98Å | ||
| 10 | I | 53.3 | Low | 54.2 | Low | 146 Ų | 146 | 146.4 Ų | 146.4 | 75% | 0.749 | 76% | 0.762 | S | S | * | * | trans | -63.2 | 94.7 | 166.2 | -57.9 | 170.7 | 0 | 0 | 0 | 106.7 | E8 P12 | E8-I10 PolarHBondContact O-N 2.83Å; I10-P12 WeakPolarHBondContact O-CD 3.38Å | ||
| 11 | R | 49.2 | Very low | 55.4 | Low | 219 Ų | 219 | 143.6 Ų | 143.6 | 83% | 0.826 | 75% | 0.751 | S | S | * | * | trans | -67.1 | 115.6 | 177.5 | -61.3 | -170.6 | -151 | -156.5 | 5 | 108.8 | E9 R13 | E9-R11 VanDerWaalsContact C-N 3.32Å; E9-R11 PolarHBondContact O-N 2.98Å; R11-R13 PolarHBondContact O-N 2.75Å | ||
| 12 | P | 55.5 | Low | 56.8 | Low | 98 Ų | 98 | 137.3 Ų | 137.3 | 64% | 0.636 | 72% | 0.719 | S | S | * | * | trans | -62.6 | 132.1 | 171 | 26.6 | -31.6 | 0 | 0 | 0 | 107.9 | I10 G14 | I10-P12 WeakPolarHBondContact O-CD 3.38Å; P12-G14 PolarHBondContact O-N 3.25Å | ||
| 13 | R | 56.3 | Low | 58.6 | Low | 240 Ų | 240 | 138.2 Ų | 138.2 | 91% | 0.906 | 71% | 0.706 | S | S | * | * | trans | -56.5 | 105.1 | 173.4 | -68.5 | -175.9 | -176.7 | -124.2 | 1.3 | 107.2 | R11 I15 | R11-R13 PolarHBondContact O-N 2.75Å; R13-I15 PolarHBondContact O-N 3.29Å | ||
| 14 | G | 57.7 | Low | 60.4 | Low | 78 Ų | 78 | 135.1 Ų | 135.1 | 80% | 0.804 | 69% | 0.69 | S | S | * | * | trans | -77.6 | 44.9 | -163.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | P12 | P12-G14 PolarHBondContact O-N 3.25Š| ||
| 15 | I | 67.2 | Low | 62.3 | Low | 132 Ų | 132 | 129.7 Ų | 129.7 | 68% | 0.677 | 68% | 0.676 | S | S | * | * | trans | -134.9 | 116.7 | -179.7 | -49.4 | 179.3 | 0 | 0 | 0 | 108.8 | R13 K17 | R13-I15 PolarHBondContact O-N 3.29Å; I15-K17 HydrophobicContact CG2-CB 3.88Å; I15-K17 PolarHBondContact O-N 3.27Å | ||
| 16 | L | 70.2 | Confident | 63.6 | Low | 123 Ų | 123 | 125.9 Ų | 125.9 | 64% | 0.644 | 65% | 0.651 | S | S | * | * | trans | -76.8 | 65.3 | 175.1 | -70.2 | 158.2 | 0 | 0 | 0 | 109.9 | W20 | L16-W20 HydrophobicContact CD2-CD2 3.25Å; L16-W20 HydrophobicContact CD2-CE3 3.34Å; L16-W20 HydrophobicContact CD2-CG 3.92Å; L16-W20 HydrophobicContact CD2-CH2 3.58Å; L16-W20 HydrophobicContact CD2-CZ2 3.51Å; L16-W20 HydrophobicContact CD2-CZ3 3.51Å | ||
| 17 | K | 69.8 | Low | 65 | Low | 149 Ų | 149 | 122.4 Ų | 122.4 | 65% | 0.648 | 64% | 0.635 | S | S | * | * | trans | -130.6 | 142.7 | 179.2 | -163.1 | 175.2 | 179.4 | -175 | 0 | 108.9 | I15 | I15-K17 HydrophobicContact CG2-CB 3.88Å; I15-K17 PolarHBondContact O-N 3.27Å | ||
| 18 | D | 76.3 | Confident | 66.2 | Low | 142 Ų | 142 | 121.6 Ų | 121.6 | 76% | 0.759 | 63% | 0.629 | S | S | * | * | S | Bend | trans | 62.9 | -142.5 | -176.4 | -49.5 | -38.5 | 0 | 0 | 0 | 113.6 | W20 | D18-W20 PolarHBondContact O-N 3.16Š|
| 19 | N | 75.9 | Confident | 67.1 | Low | 82 Ų | 82 | 116.1 Ų | 116.1 | 44% | 0.439 | 61% | 0.605 | S | S | . | * | S | Bend | trans | -79.5 | 43.7 | -170.9 | -163.8 | 13.3 | 0 | 0 | 0 | 113.9 | V21 E22 E23 | N19-V21 PolarHBondContact O-N 3.38Å; N19-E22 WeakPolarHBondContact ND2-CB 3.37Å; N19-E22 PolarHBondContact ND2-OE2 3.03Å; N19-E22 PolarHBondContact O-N 3.1Å; N19-E22 VanDerWaalsContact OD1-CB 3.24Å; N19-E22 WeakPolarHBondContact OD1-CB 3.38Å; N19-E23 WeakPolarHBondContact O-CB 3.38Å; N19-E23 WeakPolarHBondContact O-CG 3.3Å; N19-E23 PolarHBondContact O-N 3.2Å |
| 20 | W | 78.2 | Confident | 68.1 | Low | 97 Ų | 97 | 111.7 Ų | 111.7 | 37% | 0.367 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.6 | -26.5 | -171.4 | 74.7 | -89.9 | 0 | 0 | 0 | 113.6 | L16 D18 K24 | L16-W20 HydrophobicContact CD2-CD2 3.25Å; L16-W20 HydrophobicContact CD2-CE3 3.34Å; L16-W20 HydrophobicContact CD2-CG 3.92Å; L16-W20 HydrophobicContact CD2-CH2 3.58Å; L16-W20 HydrophobicContact CD2-CZ2 3.51Å; L16-W20 HydrophobicContact CD2-CZ3 3.51Å; D18-W20 PolarHBondContact O-N 3.16Å; W20-K24 HydrophobicContact CE3-CD 3.85Å; W20-K24 HydrophobicContact CE3-CG 4.4Å; W20-K24 HydrophobicContact CZ3-CD 3.91Å; W20-K24 WeakPolarHBondContact O-CB 3.24Å; W20-K24 WeakPolarHBondContact O-CG 3.46Å; W20-K24 PolarHBondContact O-N 3.26Å |
| 21 | V | 78.9 | Confident | 68.5 | Low | 88 Ų | 88 | 110 Ų | 110 | 53% | 0.533 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -71.6 | -48.6 | -179.4 | 179.1 | 0 | 0 | 0 | 0 | 110.6 | N19 K24 A25 | N19-V21 PolarHBondContact O-N 3.38Å; V21-K24 PolarHBondContact O-N 3.4Å; V21-A25 WeakPolarHBondContact O-CB 3.24Å; V21-A25 PolarHBondContact O-N 3.38Å |
| 22 | E | 75.8 | Confident | 69 | Low | 115 Ų | 115 | 104.9 Ų | 104.9 | 54% | 0.537 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.8 | -40.1 | 177 | -167.8 | 170.8 | 179.5 | 0 | 0 | 110.7 | N19 K24 A25 V26 | N19-E22 WeakPolarHBondContact ND2-CB 3.37Å; N19-E22 PolarHBondContact ND2-OE2 3.03Å; N19-E22 PolarHBondContact O-N 3.1Å; N19-E22 VanDerWaalsContact OD1-CB 3.24Å; N19-E22 WeakPolarHBondContact OD1-CB 3.38Å; E22-K24 VanDerWaalsContact C-N 3.34Å; E22-K24 PolarHBondContact O-N 3.37Å; E22-A25 PolarHBondContact O-N 2.63Å; E22-A25 VanDerWaalsContact O-N 3.15Å; E22-V26 HydrophobicContact CG-CG2 4.31Å; E22-V26 WeakPolarHBondContact O-CB 3.47Å; E22-V26 WeakPolarHBondContact O-CG2 3.44Å; E22-V26 PolarHBondContact O-N 2.93Å |
| 23 | E | 74.6 | Confident | 69.1 | Low | 122 Ų | 122 | 105.7 Ų | 105.7 | 57% | 0.57 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -59.4 | -42.5 | 175.4 | -74.1 | -179.3 | -171.2 | 0 | 0 | 112.3 | N19 A27 | N19-E23 WeakPolarHBondContact O-CB 3.38Å; N19-E23 WeakPolarHBondContact O-CG 3.3Å; N19-E23 PolarHBondContact O-N 3.2Å; E23-A27 VanDerWaalsContact O-CB 3.28Å; E23-A27 WeakPolarHBondContact O-CB 3.39Å; E23-A27 PolarHBondContact O-N 3.42Å |
| 24 | K | 76.6 | Confident | 69.2 | Low | 128 Ų | 128 | 104 Ų | 104 | 56% | 0.557 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.3 | -37.2 | 174.6 | -82.8 | -166.7 | 176.4 | 179.1 | 0 | 113 | W20 V21 E22 | W20-K24 HydrophobicContact CE3-CD 3.85Å; W20-K24 HydrophobicContact CE3-CG 4.4Å; W20-K24 HydrophobicContact CZ3-CD 3.91Å; W20-K24 WeakPolarHBondContact O-CB 3.24Å; W20-K24 WeakPolarHBondContact O-CG 3.46Å; W20-K24 PolarHBondContact O-N 3.26Å; V21-K24 PolarHBondContact O-N 3.4Å; E22-K24 VanDerWaalsContact C-N 3.34Å; E22-K24 PolarHBondContact O-N 3.37Å |
| 25 | A | 75.4 | Confident | 69.1 | Low | 69 Ų | 69 | 107.5 Ų | 107.5 | 57% | 0.57 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -66.7 | -38.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | V21 E22 | V21-A25 WeakPolarHBondContact O-CB 3.24Å; V21-A25 PolarHBondContact O-N 3.38Å; E22-A25 PolarHBondContact O-N 2.63Å; E22-A25 VanDerWaalsContact O-N 3.15Å |
| 26 | V | 71.5 | Confident | 68.6 | Low | 44 Ų | 44 | 105 Ų | 105 | 27% | 0.267 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -82 | -22.5 | 179.6 | 177.8 | 0 | 0 | 0 | 0 | 112.4 | E22 A28 L29 N30 L40 | E22-V26 HydrophobicContact CG-CG2 4.31Å; E22-V26 WeakPolarHBondContact O-CB 3.47Å; E22-V26 WeakPolarHBondContact O-CG2 3.44Å; E22-V26 PolarHBondContact O-N 2.93Å; V26-A28 VanDerWaalsContact C-N 3.28Å; V26-A28 PolarHBondContact O-N 3.27Å; V26-L29 WeakPolarHBondContact O-CB 3.39Å; V26-L29 PolarHBondContact O-N 3.34Å; V26-N30 PolarHBondContact O-N 3.19Å; V26-L40 HydrophobicContact CG1-CD2 3.71Å |
| 27 | A | 71.8 | Confident | 68 | Low | 60 Ų | 60 | 103.1 Ų | 103.1 | 50% | 0.496 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -54.5 | -41.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | E23 L29 N30 | E23-A27 VanDerWaalsContact O-CB 3.28Å; E23-A27 WeakPolarHBondContact O-CB 3.39Å; E23-A27 PolarHBondContact O-N 3.42Å; A27-L29 VanDerWaalsContact C-N 3.28Å; A27-L29 PolarHBondContact O-N 3.15Å; A27-N30 PolarHBondContact O-N 3.01Å |
| 28 | A | 67.2 | Low | 67.4 | Low | 71 Ų | 71 | 101.3 Ų | 101.3 | 59% | 0.587 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -22.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | V26 I31 | V26-A28 VanDerWaalsContact C-N 3.28Å; V26-A28 PolarHBondContact O-N 3.27Å; A28-I31 VanDerWaalsContact O-CD1 3.24Å; A28-I31 WeakPolarHBondContact O-CD1 3.27Å; A28-I31 WeakPolarHBondContact O-CG1 2.91Å |
| 29 | L | 64.9 | Low | 66.7 | Low | 62 Ų | 62 | 100 Ų | 100 | 33% | 0.325 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.5 | -17.9 | 179.5 | -62.4 | 175.5 | 0 | 0 | 0 | 112.7 | V26 A27 I31 | V26-L29 WeakPolarHBondContact O-CB 3.39Å; V26-L29 PolarHBondContact O-N 3.34Å; A27-L29 VanDerWaalsContact C-N 3.28Å; A27-L29 PolarHBondContact O-N 3.15Å; L29-I31 VanDerWaalsContact C-N 3.35Å; L29-I31 PolarHBondContact O-N 2.84Å |
| 30 | N | 63.3 | Low | 66 | Low | 81 Ų | 81 | 100.7 Ų | 100.7 | 43% | 0.433 | 53% | 0.529 | S | S | . | . | trans | -90.8 | 16.1 | -170.7 | -151.4 | 21.7 | 0 | 0 | 0 | 114.5 | V26 A27 D32 K36 | V26-N30 PolarHBondContact O-N 3.19Å; A27-N30 PolarHBondContact O-N 3.01Å; N30-D32 VanDerWaalsContact C-N 3.34Å; N30-D32 PolarHBondContact O-N 2.97Å; N30-K36 VanDerWaalsContact OD1-CE 3.27Å; N30-K36 WeakPolarHBondContact OD1-CE 3.4Å | ||
| 31 | I | 62 | Low | 65.3 | Low | 110 Ų | 110 | 102.7 Ų | 102.7 | 56% | 0.564 | 55% | 0.547 | S | S | * | . | S | Bend | trans | -74.8 | -17.9 | -170.2 | -61 | 173.1 | 0 | 0 | 0 | 113.3 | A28 L29 | A28-I31 VanDerWaalsContact O-CD1 3.24Å; A28-I31 WeakPolarHBondContact O-CD1 3.27Å; A28-I31 WeakPolarHBondContact O-CG1 2.91Å; L29-I31 VanDerWaalsContact C-N 3.35Å; L29-I31 PolarHBondContact O-N 2.84Å |
| 32 | D | 58.9 | Low | 64.6 | Low | 112 Ų | 112 | 99.6 Ų | 99.6 | 60% | 0.599 | 53% | 0.533 | S | S | * | . | trans | -141.5 | 115.5 | -178.6 | -81.8 | -47.8 | 0 | 0 | 0 | 113.5 | N30 K34 | N30-D32 VanDerWaalsContact C-N 3.34Å; N30-D32 PolarHBondContact O-N 2.97Å; D32-K34 PolarHBondContact O-N 3.3Å | ||
| 33 | D | 57.7 | Low | 64.2 | Low | 115 Ų | 115 | 100.1 Ų | 100.1 | 62% | 0.615 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | -9.3 | -171.1 | -82 | 16.6 | 0 | 0 | 0 | 116.2 | K36 | D33-K36 WeakPolarHBondContact OD1-CE 3.18Å; D33-K36 IonicContact OD1-NZ 2.66Å; D33-K36 PolarHBondContact OD1-NZ 3.14Å; D33-K36 IonicContact OD2-NZ 2.97Å; D33-K36 PolarHBondContact OD2-NZ 2.87Å |
| 34 | K | 58.6 | Low | 63.8 | Low | 204 Ų | 204 | 102 Ų | 102 | 89% | 0.887 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.4 | -11.5 | -174.3 | -63.8 | -176.7 | -178.5 | 177 | 0 | 114.7 | D32 | D32-K34 PolarHBondContact O-N 3.3Š|
| 35 | K | 55.4 | Low | 63.2 | Low | 152 Ų | 152 | 98.9 Ų | 98.9 | 66% | 0.661 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -134.3 | 23.9 | -175.8 | -67.9 | -176.6 | -179 | 174.8 | 0 | 114.6 | S37 | K35-S37 VanDerWaalsContact C-N 3.3Å; K35-S37 PolarHBondContact O-N 2.87Å |
| 36 | K | 56.8 | Low | 62.8 | Low | 79 Ų | 79 | 101.9 Ų | 101.9 | 34% | 0.343 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -53.3 | -41.1 | -176.3 | -72.3 | 174.9 | 163.5 | 165.9 | 0 | 113.8 | N30 D33 V38 L40 | N30-K36 VanDerWaalsContact OD1-CE 3.27Å; N30-K36 WeakPolarHBondContact OD1-CE 3.4Å; D33-K36 WeakPolarHBondContact OD1-CE 3.18Å; D33-K36 IonicContact OD1-NZ 2.66Å; D33-K36 PolarHBondContact OD1-NZ 3.14Å; D33-K36 IonicContact OD2-NZ 2.97Å; D33-K36 PolarHBondContact OD2-NZ 2.87Å; K36-V38 PolarHBondContact O-N 3.39Å; K36-L40 HydrophobicContact CB-CD1 4.44Å; K36-L40 WeakPolarHBondContact O-CD1 3.41Å; K36-L40 VanDerWaalsContact O-CG 3.3Å; K36-L40 WeakPolarHBondContact O-CG 3.45Å; K36-L40 PolarHBondContact O-N 3.48Å |
| 37 | S | 57.7 | Low | 62.5 | Low | 84 Ų | 84 | 104.2 Ų | 104.2 | 59% | 0.587 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -67.3 | -35.2 | -170.8 | 164.1 | 0 | 0 | 0 | 0 | 115.4 | K35 | K35-S37 VanDerWaalsContact C-N 3.3Å; K35-S37 PolarHBondContact O-N 2.87Å |
| 38 | V | 58.4 | Low | 62.1 | Low | 110 Ų | 110 | 107.6 Ų | 107.6 | 67% | 0.667 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -82.6 | -30.9 | -173.2 | -179.4 | 0 | 0 | 0 | 0 | 111.8 | K36 | K36-V38 PolarHBondContact O-N 3.39Å |
| 39 | R | 60.7 | Low | 62.1 | Low | 114 Ų | 114 | 110.2 Ų | 110.2 | 43% | 0.43 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -80.1 | -32 | 179.9 | -67.3 | -177.8 | 178.1 | 175.2 | -1.9 | 113 | ||
| 40 | L | 61.8 | Low | 62 | Low | 97 Ų | 97 | 112 Ų | 112 | 51% | 0.508 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -72.7 | -32.2 | 177.6 | -71.2 | 167.8 | 0 | 0 | 0 | 112.4 | V26 K36 | V26-L40 HydrophobicContact CG1-CD2 3.71Å; K36-L40 HydrophobicContact CB-CD1 4.44Å; K36-L40 WeakPolarHBondContact O-CD1 3.41Å; K36-L40 VanDerWaalsContact O-CG 3.3Å; K36-L40 WeakPolarHBondContact O-CG 3.45Å; K36-L40 PolarHBondContact O-N 3.48Å |
| 41 | N | 62.7 | Low | 62 | Low | 140 Ų | 140 | 119.5 Ų | 119.5 | 75% | 0.749 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -104.8 | 10.5 | -171.6 | -63.9 | -2.6 | 0 | 0 | 0 | 113.6 | ||
| 42 | G | 64.1 | Low | 62.1 | Low | 23 Ų | 23 | 117.7 Ų | 117.7 | 24% | 0.237 | 62% | 0.622 | C | S | . | * | trans | -136.4 | 136.8 | -172 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 43 | H | 68.9 | Low | 62.2 | Low | 125 Ų | 125 | 115.1 Ų | 115.1 | 58% | 0.579 | 61% | 0.612 | S | S | * | * | trans | -90.2 | 116.9 | 174.8 | -172 | -77.5 | 0 | 0 | 0 | 110.4 | G45 L46 I47 | H43-G45 PolarHBondContact ND1-N 2.87Å; H43-G45 VanDerWaalsContact ND1-N 3.19Å; H43-G45 PolarHBondContact O-N 3.04Å; H43-G45 VanDerWaalsContact O-N 3.09Å; H43-L46 HydrophobicContact CB-CB 4.24Å; H43-L46 HydrophobicContact CB-CD1 4.1Å; H43-L46 HydrophobicContact CB-CG 4.37Å; H43-L46 PolarHBondContact O-N 3.43Å; H43-I47 PolarHBondContact O-N 3.03Å | ||
| 44 | E | 65.2 | Low | 62.6 | Low | 161 Ų | 161 | 117.1 Ų | 117.1 | 75% | 0.752 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.8 | -27.8 | -173 | -63 | -170.5 | 157.4 | 0 | 0 | 113.6 | ||
| 45 | G | 64.3 | Low | 62.7 | Low | 63 Ų | 63 | 116.1 Ų | 116.1 | 65% | 0.649 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | -12 | 177.6 | 0 | 0 | 0 | 0 | 0 | 116.2 | H43 | H43-G45 PolarHBondContact ND1-N 2.87Å; H43-G45 VanDerWaalsContact ND1-N 3.19Å; H43-G45 PolarHBondContact O-N 3.04Å; H43-G45 VanDerWaalsContact O-N 3.09Å |
| 46 | L | 66.2 | Low | 63 | Low | 133 Ų | 133 | 117.5 Ų | 117.5 | 70% | 0.696 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.4 | -24.6 | -176 | -69.4 | 173 | 0 | 0 | 0 | 112.8 | H43 T48 | H43-L46 HydrophobicContact CB-CB 4.24Å; H43-L46 HydrophobicContact CB-CD1 4.1Å; H43-L46 HydrophobicContact CB-CG 4.37Å; H43-L46 PolarHBondContact O-N 3.43Å; L46-T48 PolarHBondContact O-N 3.2Å |
| 47 | I | 65.8 | Low | 63.2 | Low | 92 Ų | 92 | 118.6 Ų | 118.6 | 47% | 0.472 | 64% | 0.639 | S | S | . | * | trans | -87.1 | 92.7 | 178.9 | -53.2 | 176.8 | 0 | 0 | 0 | 108.9 | H43 I49 | H43-I47 PolarHBondContact O-N 3.03Å; I47-I49 HydrophobicContact CG2-CD1 4.25Å; I47-I49 HydrophobicContact CG2-CG1 3.61Å; I47-I49 PolarHBondContact O-N 3.08Å | ||
| 48 | T | 64.8 | Low | 63.5 | Low | 132 Ų | 132 | 119.9 Ų | 119.9 | 81% | 0.81 | 64% | 0.638 | S | S | * | * | trans | -78.5 | 83.1 | 169.9 | 42.3 | 0 | 0 | 0 | 0 | 110.1 | L46 N50 | L46-T48 PolarHBondContact O-N 3.2Å; T48-N50 PolarHBondContact O-N 3.26Å | ||
| 49 | I | 65.3 | Low | 64.3 | Low | 125 Ų | 125 | 118 Ų | 118 | 64% | 0.641 | 63% | 0.63 | S | S | * | * | trans | -71.3 | 97.3 | 171.7 | -52.1 | 179.4 | 0 | 0 | 0 | 108.3 | I47 R51 | I47-I49 HydrophobicContact CG2-CD1 4.25Å; I47-I49 HydrophobicContact CG2-CG1 3.61Å; I47-I49 PolarHBondContact O-N 3.08Å; I49-R51 VanDerWaalsContact C-N 3.34Å; I49-R51 HydrophobicContact CG2-CG 4.15Å; I49-R51 PolarHBondContact O-N 2.66Å | ||
| 50 | N | 64.3 | Low | 64.8 | Low | 100 Ų | 100 | 120 Ų | 120 | 54% | 0.535 | 65% | 0.648 | S | S | . | * | trans | -76.6 | 87.2 | 175.4 | -155.1 | -18.5 | 0 | 0 | 0 | 109.5 | T48 G52 C53 | T48-N50 PolarHBondContact O-N 3.26Å; N50-G52 PolarHBondContact O-N 2.95Å; N50-C53 HydrophobicContact CB-CB 4.49Å; N50-C53 PolarHBondContact O-N 2.97Å | ||
| 51 | R | 63.4 | Low | 65.3 | Low | 238 Ų | 238 | 122.1 Ų | 122.1 | 90% | 0.898 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | -14.5 | -172.5 | -66 | -177 | -177.9 | 177.5 | 2.2 | 114.6 | I49 | I49-R51 VanDerWaalsContact C-N 3.34Å; I49-R51 HydrophobicContact CG2-CG 4.15Å; I49-R51 PolarHBondContact O-N 2.66Å |
| 52 | G | 63.1 | Low | 65.7 | Low | 73 Ų | 73 | 117.8 Ų | 117.8 | 75% | 0.753 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.4 | -6.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | N50 | N50-G52 PolarHBondContact O-N 2.95Š|
| 53 | C | 61.5 | Low | 66 | Low | 57 Ų | 57 | 120.2 Ų | 120.2 | 39% | 0.385 | 66% | 0.66 | S | S | . | * | S | Bend | trans | -114.8 | 133.7 | -176.3 | -66.5 | 0 | 0 | 0 | 0 | 111 | N50 M55 L58 | N50-C53 HydrophobicContact CB-CB 4.49Å; N50-C53 PolarHBondContact O-N 2.97Å; C53-M55 PolarHBondContact O-N 2.98Å; C53-L58 HydrophobicContact CB-CD1 3.64Å; C53-L58 HydrophobicContact CB-CD2 4.39Å; C53-L58 HydrophobicContact CB-CG 4Å |
| 54 | K | 65.2 | Low | 66.4 | Low | 157 Ų | 157 | 118.4 Ų | 118.4 | 68% | 0.683 | 66% | 0.662 | S | S | * | * | trans | -67.8 | 130.3 | 167.3 | -63.6 | -179.4 | -179.3 | -178.3 | 0 | 107.8 | E56 T57 | K54-E56 PolarHBondContact O-N 2.95Å; K54-E56 VanDerWaalsContact O-N 3.09Å; K54-T57 PolarHBondContact O-N 3.07Å; K54-T57 PolarHBondContact O-OG1 3.15Å | ||
| 55 | M | 61.4 | Low | 66.9 | Low | 183 Ų | 183 | 118.5 Ų | 118.5 | 90% | 0.901 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -54.7 | -32 | -177.1 | -155.9 | 98 | -178 | 0 | 0 | 112.2 | C53 T57 | C53-M55 PolarHBondContact O-N 2.98Å; M55-T57 PolarHBondContact O-N 2.76Å |
| 56 | E | 62 | Low | 67.5 | Low | 181 Ų | 181 | 121.5 Ų | 121.5 | 85% | 0.846 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -64 | -21.6 | 178.1 | -61.9 | 168.2 | -170.8 | 0 | 0 | 113.7 | K54 | K54-E56 PolarHBondContact O-N 2.95Å; K54-E56 VanDerWaalsContact O-N 3.09Å |
| 57 | T | 59.8 | Low | 68 | Low | 103 Ų | 103 | 120.5 Ų | 120.5 | 63% | 0.632 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -97.2 | -12.8 | -172.2 | -31.2 | 0 | 0 | 0 | 0 | 113.1 | K54 M55 S59 | K54-T57 PolarHBondContact O-N 3.07Å; K54-T57 PolarHBondContact O-OG1 3.15Å; M55-T57 PolarHBondContact O-N 2.76Å; T57-S59 PolarHBondContact O-N 2.74Å |
| 58 | L | 65.2 | Low | 68.4 | Low | 110 Ų | 110 | 124.5 Ų | 124.5 | 58% | 0.576 | 68% | 0.679 | S | S | * | * | trans | -97.2 | 73.2 | -178.7 | -66.8 | 177.7 | 0 | 0 | 0 | 110.8 | C53 | C53-L58 HydrophobicContact CB-CD1 3.64Å; C53-L58 HydrophobicContact CB-CD2 4.39Å; C53-L58 HydrophobicContact CB-CG 4Å | ||
| 59 | S | 74.1 | Confident | 68.7 | Low | 71 Ų | 71 | 128 Ų | 128 | 50% | 0.497 | 68% | 0.683 | S | S | . | * | trans | -91.4 | 142.2 | 166.9 | 177.6 | 0 | 0 | 0 | 0 | 110.5 | T57 F61 G62 A63 | T57-S59 PolarHBondContact O-N 2.74Å; S59-F61 PolarHBondContact O-N 3.11Å; S59-F61 VanDerWaalsContact O-N 3.11Å; S59-F61 PolarHBondContact OG-N 2.89Å; S59-G62 PolarHBondContact O-N 3.15Å; S59-A63 PolarHBondContact O-N 2.99Å | ||
| 60 | L | 71.3 | Confident | 68.9 | Low | 155 Ų | 155 | 124.5 Ų | 124.5 | 81% | 0.812 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -47.4 | -38.4 | 170.5 | -88.1 | 138.4 | 0 | 0 | 0 | 111.6 | A63 S64 | L60-A63 PolarHBondContact O-N 3.34Å; L60-S64 WeakPolarHBondContact O-CB 3.34Å; L60-S64 PolarHBondContact O-N 3.41Å; L60-S64 PolarHBondContact O-OG 2.99Å |
| 61 | F | 71.9 | Confident | 69.1 | Low | 142 Ų | 142 | 124.7 Ų | 124.7 | 62% | 0.623 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -63.9 | -44.2 | 178.4 | -174 | -97.1 | 0 | 0 | 0 | 112.8 | S59 A63 S64 Y65 | S59-F61 PolarHBondContact O-N 3.11Å; S59-F61 VanDerWaalsContact O-N 3.11Å; S59-F61 PolarHBondContact OG-N 2.89Å; F61-A63 VanDerWaalsContact C-N 3.29Å; F61-A63 PolarHBondContact O-N 2.85Å; F61-S64 PolarHBondContact O-N 3.42Å; F61-Y65 HydrophobicContact CD1-CD2 4.47Å; F61-Y65 AromaticContact CD2-CD2 3.37Å; F61-Y65 HydrophobicContact CD2-CD2 3.37Å; F61-Y65 AromaticContact CD2-CE2 3.5Å; F61-Y65 HydrophobicContact CD2-CE2 3.5Å; F61-Y65 HydrophobicContact CD2-CG 4.45Å; F61-Y65 HydrophobicContact CE1-CD2 4.45Å; F61-Y65 AromaticContact CE2-CD2 3.34Å; F61-Y65 HydrophobicContact CE2-CD2 3.34Å; F61-Y65 AromaticContact CE2-CE2 3.48Å; F61-Y65 HydrophobicContact CE2-CE2 3.48Å; F61-Y65 VanDerWaalsContact CE2-CE2 3.48Å; F61-Y65 HydrophobicContact CE2-CG 4.09Å; F61-Y65 AromaticContact CG-CD2 3.97Å; F61-Y65 HydrophobicContact CG-CD2 3.97Å; F61-Y65 HydrophobicContact CG-CE2 4.47Å; F61-Y65 AromaticContact CZ-CD2 3.92Å; F61-Y65 HydrophobicContact CZ-CD2 3.92Å; F61-Y65 HydrophobicContact CZ-CE2 4.43Å; F61-Y65 HydrophobicContact CZ-CG 4.29Å; F61-Y65 WeakPolarHBondContact O-CD2 3.36Å; F61-Y65 PolarHBondContact O-N 2.84Å |
| 62 | G | 71.8 | Confident | 68.9 | Low | 49 Ų | 49 | 121.5 Ų | 121.5 | 51% | 0.505 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -68.7 | -28.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | S59 | S59-G62 PolarHBondContact O-N 3.15Å |
| 63 | A | 70.8 | Confident | 68.8 | Low | 75 Ų | 75 | 123.2 Ų | 123.2 | 62% | 0.62 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -77.4 | -35.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | S59 L60 F61 | S59-A63 PolarHBondContact O-N 2.99Å; L60-A63 PolarHBondContact O-N 3.34Å; F61-A63 VanDerWaalsContact C-N 3.29Å; F61-A63 PolarHBondContact O-N 2.85Å |
| 64 | S | 76.5 | Confident | 68.6 | Low | 87 Ų | 87 | 128.1 Ų | 128.1 | 61% | 0.608 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -83.1 | -31.6 | -176.9 | -59.9 | 0 | 0 | 0 | 0 | 113.8 | L60 F61 | L60-S64 WeakPolarHBondContact O-CB 3.34Å; L60-S64 PolarHBondContact O-N 3.41Å; L60-S64 PolarHBondContact O-OG 2.99Å; F61-S64 PolarHBondContact O-N 3.42Å |
| 65 | Y | 75.5 | Confident | 68.2 | Low | 162 Ų | 162 | 127.1 Ų | 127.1 | 64% | 0.635 | 70% | 0.698 | S | S | * | * | trans | -108.8 | 74.7 | -175.4 | -64.8 | -80.5 | 0 | 0 | 0 | 111.3 | F61 | F61-Y65 HydrophobicContact CD1-CD2 4.47Å; F61-Y65 AromaticContact CD2-CD2 3.37Å; F61-Y65 HydrophobicContact CD2-CD2 3.37Å; F61-Y65 AromaticContact CD2-CE2 3.5Å; F61-Y65 HydrophobicContact CD2-CE2 3.5Å; F61-Y65 HydrophobicContact CD2-CG 4.45Å; F61-Y65 HydrophobicContact CE1-CD2 4.45Å; F61-Y65 AromaticContact CE2-CD2 3.34Å; F61-Y65 HydrophobicContact CE2-CD2 3.34Å; F61-Y65 AromaticContact CE2-CE2 3.48Å; F61-Y65 HydrophobicContact CE2-CE2 3.48Å; F61-Y65 VanDerWaalsContact CE2-CE2 3.48Å; F61-Y65 HydrophobicContact CE2-CG 4.09Å; F61-Y65 AromaticContact CG-CD2 3.97Å; F61-Y65 HydrophobicContact CG-CD2 3.97Å; F61-Y65 HydrophobicContact CG-CE2 4.47Å; F61-Y65 AromaticContact CZ-CD2 3.92Å; F61-Y65 HydrophobicContact CZ-CD2 3.92Å; F61-Y65 HydrophobicContact CZ-CE2 4.43Å; F61-Y65 HydrophobicContact CZ-CG 4.29Å; F61-Y65 WeakPolarHBondContact O-CD2 3.36Å; F61-Y65 PolarHBondContact O-N 2.84Å | ||
| 66 | I | 76.8 | Confident | 67.9 | Low | 126 Ų | 126 | 123.3 Ų | 123.3 | 65% | 0.646 | 68% | 0.677 | S | S | * | * | trans | -79.7 | 129.2 | 169 | -57.1 | 172.8 | 0 | 0 | 0 | 107.5 | L68 | I66-L68 PolarHBondContact O-N 2.99Å; I66-L68 VanDerWaalsContact O-N 3.13Å | ||
| 67 | P | 78.4 | Confident | 67.4 | Low | 112 Ų | 112 | 117.6 Ų | 117.6 | 73% | 0.727 | 67% | 0.666 | S | S | * | * | trans | -57.5 | 124 | 173.8 | 23.9 | -32.4 | 0 | 0 | 0 | 108.7 | K69 | P67-K69 PolarHBondContact O-N 3.42Š| ||
| 68 | L | 73.3 | Confident | 67.2 | Low | 176 Ų | 176 | 116.8 Ų | 116.8 | 92% | 0.921 | 68% | 0.678 | S | S | * | * | trans | -61.3 | 98.4 | 178.5 | -70 | 168.4 | 0 | 0 | 0 | 108.5 | I66 G70 | I66-L68 PolarHBondContact O-N 2.99Å; I66-L68 VanDerWaalsContact O-N 3.13Å; L68-G70 PolarHBondContact O-N 3.39Å; L68-G70 VanDerWaalsContact O-N 3.11Å | ||
| 69 | K | 71.6 | Confident | 67.1 | Low | 206 Ų | 206 | 112.3 Ų | 112.3 | 90% | 0.896 | 66% | 0.657 | S | S | * | * | trans | -67.7 | 108.3 | 163.4 | -130.9 | 175.7 | -177.2 | -179 | 0 | 104.7 | P67 | P67-K69 PolarHBondContact O-N 3.42Š| ||
| 70 | G | 68.6 | Low | 67.3 | Low | 52 Ų | 52 | 111.2 Ų | 111.2 | 54% | 0.536 | 66% | 0.657 | S | S | . | * | trans | -51.6 | 155.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | L68 D72 | L68-G70 PolarHBondContact O-N 3.39Å; L68-G70 VanDerWaalsContact O-N 3.11Å; G70-D72 PolarHBondContact O-N 2.91Å | ||
| 71 | P | 69.2 | Low | 67.9 | Low | 104 Ų | 104 | 109.5 Ų | 109.5 | 68% | 0.675 | 65% | 0.653 | S | S | * | * | trans | -49.3 | 119.8 | 175.1 | -20.6 | 29.2 | 0 | 0 | 0 | 108.7 | V73 | P71-V73 HydrophobicContact CB-CB 4.2Å; P71-V73 HydrophobicContact CB-CG2 4.37Å; P71-V73 PolarHBondContact O-N 3.43Å | ||
| 72 | D | 59.4 | Low | 68.5 | Low | 170 Ų | 170 | 113.3 Ų | 113.3 | 91% | 0.909 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -66.7 | 0.1 | 174.4 | -161.3 | 32.8 | 0 | 0 | 0 | 111.5 | G70 R74 | G70-D72 PolarHBondContact O-N 2.91Å; D72-R74 PolarHBondContact O-N 3.23Å |
| 73 | V | 59.6 | Low | 69.2 | Low | 110 Ų | 110 | 116.5 Ų | 116.5 | 67% | 0.667 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -64.3 | 101.3 | 161 | -173.1 | 0 | 0 | 0 | 0 | 107.3 | P71 V75 | P71-V73 HydrophobicContact CB-CB 4.2Å; P71-V73 HydrophobicContact CB-CG2 4.37Å; P71-V73 PolarHBondContact O-N 3.43Å; V73-V75 WeakPolarHBondContact O-CG2 3.46Å; V73-V75 PolarHBondContact O-N 3.05Å |
| 74 | R | 58.5 | Low | 69.9 | Low | 159 Ų | 159 | 114 Ų | 114 | 60% | 0.6 | 64% | 0.638 | S | S | * | * | trans | -37.2 | 103.4 | 166.6 | -158.4 | -169.8 | -60.5 | -144.2 | 1.2 | 107.9 | D72 K76 G77 E84 | D72-R74 PolarHBondContact O-N 3.23Å; R74-K76 HydrophobicContact CG-CB 4.22Å; R74-K76 PolarHBondContact O-N 3.36Å; R74-K76 VanDerWaalsContact O-N 3.1Å; R74-G77 VanDerWaalsContact O-CA 3.27Å; R74-G77 WeakPolarHBondContact O-CA 3.49Å; R74-G77 PolarHBondContact O-N 3.18Å; R74-E84 IonicContact NH1-OE2 2.74Å; R74-E84 PolarHBondContact NH1-OE2 2.89Å | ||
| 75 | V | 57 | Low | 70.5 | Confident | 136 Ų | 136 | 115.8 Ų | 115.8 | 82% | 0.824 | 64% | 0.64 | S | S | * | * | G | 310 helix | trans | -67 | -14.1 | -178.4 | -175.8 | 0 | 0 | 0 | 0 | 110.6 | V73 G77 | V73-V75 WeakPolarHBondContact O-CG2 3.46Å; V73-V75 PolarHBondContact O-N 3.05Å; V75-G77 PolarHBondContact O-N 3.14Å |
| 76 | K | 55.3 | Low | 71.3 | Confident | 104 Ų | 104 | 112.7 Ų | 112.7 | 45% | 0.452 | 64% | 0.635 | S | S | . | * | G | 310 helix | trans | -73.1 | 10.9 | 160.8 | -68 | -164.3 | 170.8 | -152.9 | 0 | 114.3 | R74 G78 A79 E87 | R74-K76 HydrophobicContact CG-CB 4.22Å; R74-K76 PolarHBondContact O-N 3.36Å; R74-K76 VanDerWaalsContact O-N 3.1Å; K76-G78 PolarHBondContact O-N 2.97Å; K76-A79 PolarHBondContact O-N 3.36Å; K76-A79 VanDerWaalsContact O-O 3.1Å; K76-E87 IonicContact NZ-OE2 3.81Å; K76-E87 PolarHBondContact NZ-OE2 2.76Å |
| 77 | G | 50.7 | Low | 72 | Confident | 61 Ų | 61 | 109.7 Ų | 109.7 | 63% | 0.629 | 62% | 0.618 | S | S | * | * | G | 310 helix | trans | -70.1 | -10.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | R74 V75 A79 | R74-G77 VanDerWaalsContact O-CA 3.27Å; R74-G77 WeakPolarHBondContact O-CA 3.49Å; R74-G77 PolarHBondContact O-N 3.18Å; V75-G77 PolarHBondContact O-N 3.14Å; G77-A79 VanDerWaalsContact C-N 3.32Å |
| 78 | G | 56.3 | Low | 72.6 | Confident | 85 Ų | 85 | 111.9 Ų | 111.9 | 88% | 0.876 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -80.6 | -13.6 | 166.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | K76 | K76-G78 PolarHBondContact O-N 2.97Š|
| 79 | A | 62.1 | Low | 73.7 | Confident | 16 Ų | 16 | 108.4 Ų | 108.4 | 13% | 0.132 | 59% | 0.59 | C | S | . | * | S | Bend | trans | -108.6 | 103.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | K76 G77 K83 | K76-A79 PolarHBondContact O-N 3.36Å; K76-A79 VanDerWaalsContact O-O 3.1Å; G77-A79 VanDerWaalsContact C-N 3.32Å; A79-K83 HydrophobicContact CB-CB 4.03Å; A79-K83 HydrophobicContact CB-CD 3.52Å; A79-K83 HydrophobicContact CB-CG 3.83Å |
| 80 | G | 79.3 | Confident | 74.8 | Confident | 49 Ų | 49 | 102.5 Ų | 102.5 | 51% | 0.505 | 57% | 0.568 | S | S | . | * | trans | -54.3 | 162.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | R82 K83 E84 | G80-R82 PolarHBondContact O-N 3.39Å; G80-K83 WeakPolarHBondContact O-CB 3.36Å; G80-K83 PolarHBondContact O-N 3.13Å; G80-E84 PolarHBondContact O-N 3.39Å | ||
| 81 | V | 83.4 | Confident | 76.1 | Confident | 119 Ų | 119 | 103.3 Ų | 103.3 | 72% | 0.721 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -46.5 | -38.1 | -176.7 | 179 | 0 | 0 | 0 | 0 | 112.8 | E84 L85 | V81-E84 PolarHBondContact O-N 2.93Å; V81-L85 WeakPolarHBondContact O-CB 3.3Å; V81-L85 PolarHBondContact O-N 3.22Å |
| 82 | R | 85.4 | Confident | 77.4 | Confident | 221 Ų | 221 | 103.7 Ų | 103.7 | 83% | 0.834 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60 | -45 | 176 | -177.7 | -178.7 | 174.8 | 97.1 | 0.5 | 113.1 | G80 L85 L86 | G80-R82 PolarHBondContact O-N 3.39Å; R82-L85 PolarHBondContact O-N 3.24Å; R82-L86 WeakPolarHBondContact O-CB 3.32Å; R82-L86 PolarHBondContact O-N 3.26Å |
| 83 | K | 85.4 | Confident | 79.2 | Confident | 117 Ų | 117 | 99.2 Ų | 99.2 | 51% | 0.509 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -69 | -39.7 | -179.7 | 178.6 | 170.7 | 166.2 | -174.5 | 0 | 110.7 | A79 G80 L86 E87 | A79-K83 HydrophobicContact CB-CB 4.03Å; A79-K83 HydrophobicContact CB-CD 3.52Å; A79-K83 HydrophobicContact CB-CG 3.83Å; G80-K83 WeakPolarHBondContact O-CB 3.36Å; G80-K83 PolarHBondContact O-N 3.13Å; K83-L86 PolarHBondContact O-N 3Å; K83-E87 WeakPolarHBondContact CE-OE1 3.49Å; K83-E87 WeakPolarHBondContact O-CB 3.24Å; K83-E87 WeakPolarHBondContact O-CG 3.46Å; K83-E87 PolarHBondContact O-N 3.15Å |
| 84 | E | 85.6 | Confident | 81 | Confident | 22 Ų | 22 | 99.2 Ų | 99.2 | 10% | 0.103 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -62.2 | -44.5 | 174.9 | -173.3 | 178.5 | 176.1 | 0 | 0 | 111.9 | R74 G80 V81 L86 E87 R88 | R74-E84 IonicContact NH1-OE2 2.74Å; R74-E84 PolarHBondContact NH1-OE2 2.89Å; G80-E84 PolarHBondContact O-N 3.39Å; V81-E84 PolarHBondContact O-N 2.93Å; E84-L86 VanDerWaalsContact C-N 3.34Å; E84-L86 PolarHBondContact O-N 2.87Å; E84-E87 PolarHBondContact O-N 3.38Å; E84-R88 WeakPolarHBondContact O-CG 3.28Å; E84-R88 PolarHBondContact O-N 3.09Å; E84-R88 IonicContact OE1-CZ 3.43Å; E84-R88 IonicContact OE1-NE 2.93Å; E84-R88 PolarHBondContact OE1-NE 3.3Å; E84-R88 IonicContact OE1-NH2 3.48Å; E84-R88 PolarHBondContact OE1-NH2 2.96Å |
| 85 | L | 89.4 | Confident | 82.7 | Confident | 124 Ų | 124 | 100.1 Ų | 100.1 | 65% | 0.649 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.2 | -42 | 177.4 | -167.2 | 74.4 | 0 | 0 | 0 | 111.4 | V81 R82 R88 H89 | V81-L85 WeakPolarHBondContact O-CB 3.3Å; V81-L85 PolarHBondContact O-N 3.22Å; R82-L85 PolarHBondContact O-N 3.24Å; L85-R88 PolarHBondContact O-N 3.27Å; L85-H89 WeakPolarHBondContact O-CB 3.2Å; L85-H89 PolarHBondContact O-N 3.19Å |
| 86 | L | 92.4 | Very high | 84.4 | Confident | 98 Ų | 98 | 98.6 Ų | 98.6 | 51% | 0.513 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.7 | -45.8 | 177.1 | -175.2 | 66 | 0 | 0 | 0 | 111.7 | R82 K83 E84 R88 H89 L90 | R82-L86 WeakPolarHBondContact O-CB 3.32Å; R82-L86 PolarHBondContact O-N 3.26Å; K83-L86 PolarHBondContact O-N 3Å; E84-L86 VanDerWaalsContact C-N 3.34Å; E84-L86 PolarHBondContact O-N 2.87Å; L86-R88 VanDerWaalsContact C-N 3.32Å; L86-R88 PolarHBondContact O-N 3.47Å; L86-H89 PolarHBondContact O-N 3.06Å; L86-L90 HydrophobicContact CD1-CD1 4.41Å; L86-L90 HydrophobicContact CD1-CG 4.41Å; L86-L90 HydrophobicContact CG-CD1 4.04Å; L86-L90 HydrophobicContact CG-CG 4.44Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.3Å; L86-L90 WeakPolarHBondContact O-CG 3.44Å; L86-L90 PolarHBondContact O-N 3.01Å |
| 87 | E | 91 | Very high | 86.3 | Confident | 62 Ų | 62 | 99.8 Ų | 99.8 | 29% | 0.29 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.2 | -43.8 | 176.1 | -77.5 | 174 | -167.1 | 0 | 0 | 111.7 | K76 K83 E84 S91 | K76-E87 IonicContact NZ-OE2 3.81Å; K76-E87 PolarHBondContact NZ-OE2 2.76Å; K83-E87 WeakPolarHBondContact CE-OE1 3.49Å; K83-E87 WeakPolarHBondContact O-CB 3.24Å; K83-E87 WeakPolarHBondContact O-CG 3.46Å; K83-E87 PolarHBondContact O-N 3.15Å; E84-E87 PolarHBondContact O-N 3.38Å; E87-S91 WeakPolarHBondContact O-CB 3.24Å; E87-S91 PolarHBondContact O-N 3.09Å; E87-S91 PolarHBondContact O-OG 3.45Å |
| 88 | R | 91 | Very high | 88.3 | Confident | 159 Ų | 159 | 101 Ų | 101 | 60% | 0.6 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.9 | -45.8 | 177 | -72.2 | 177.1 | -175.6 | -155.8 | 2.2 | 111.4 | E84 L85 L86 S91 Q92 | E84-R88 WeakPolarHBondContact O-CG 3.28Å; E84-R88 PolarHBondContact O-N 3.09Å; E84-R88 IonicContact OE1-CZ 3.43Å; E84-R88 IonicContact OE1-NE 2.93Å; E84-R88 PolarHBondContact OE1-NE 3.3Å; E84-R88 IonicContact OE1-NH2 3.48Å; E84-R88 PolarHBondContact OE1-NH2 2.96Å; L85-R88 PolarHBondContact O-N 3.27Å; L86-R88 VanDerWaalsContact C-N 3.32Å; L86-R88 PolarHBondContact O-N 3.47Å; R88-S91 PolarHBondContact O-N 3.36Å; R88-Q92 PolarHBondContact O-N 2.94Å |
| 89 | H | 95.6 | Very high | 89.8 | Confident | 102 Ų | 102 | 100.9 Ų | 100.9 | 47% | 0.472 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.9 | -46.9 | 179.3 | -178 | 58.9 | 0 | 0 | 0 | 112 | L85 L86 S91 Q92 M93 | L85-H89 WeakPolarHBondContact O-CB 3.2Å; L85-H89 PolarHBondContact O-N 3.19Å; L86-H89 PolarHBondContact O-N 3.06Å; H89-S91 VanDerWaalsContact C-N 3.32Å; H89-S91 PolarHBondContact O-N 2.97Å; H89-Q92 PolarHBondContact O-N 3.34Å; H89-M93 PolarHBondContact NE2-SD 3.06Å; H89-M93 VanDerWaalsContact NE2-SD 3.43Å; H89-M93 WeakPolarHBondContact O-CG 3.48Å; H89-M93 PolarHBondContact O-N 3Å |
| 90 | L | 96.3 | Very high | 91 | Very high | 83 Ų | 83 | 103.4 Ų | 103.4 | 44% | 0.435 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61 | -41.7 | 176.4 | -69.6 | 172.8 | 0 | 0 | 0 | 111.7 | L86 Q92 M93 M94 | L86-L90 HydrophobicContact CD1-CD1 4.41Å; L86-L90 HydrophobicContact CD1-CG 4.41Å; L86-L90 HydrophobicContact CG-CD1 4.04Å; L86-L90 HydrophobicContact CG-CG 4.44Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.3Å; L86-L90 WeakPolarHBondContact O-CG 3.44Å; L86-L90 PolarHBondContact O-N 3.01Å; L90-Q92 VanDerWaalsContact C-N 3.33Å; L90-Q92 PolarHBondContact O-N 3.2Å; L90-M93 PolarHBondContact O-N 3.38Å; L90-M94 HydrophobicContact CB-CE 4.36Å; L90-M94 WeakPolarHBondContact O-CE 3.44Å; L90-M94 WeakPolarHBondContact O-CG 3.46Å; L90-M94 PolarHBondContact O-N 3.21Å |
| 91 | S | 95.6 | Very high | 91.3 | Very high | 69 Ų | 69 | 108.7 Ų | 108.7 | 48% | 0.483 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.4 | -42 | 176.6 | -58.4 | 0 | 0 | 0 | 0 | 111.9 | E87 R88 H89 R95 | E87-S91 WeakPolarHBondContact O-CB 3.24Å; E87-S91 PolarHBondContact O-N 3.09Å; E87-S91 PolarHBondContact O-OG 3.45Å; R88-S91 PolarHBondContact O-N 3.36Å; H89-S91 VanDerWaalsContact C-N 3.32Å; H89-S91 PolarHBondContact O-N 2.97Å; S91-R95 WeakPolarHBondContact O-CB 3.38Å; S91-R95 PolarHBondContact O-N 3.35Å |
| 92 | Q | 96.6 | Very high | 91.3 | Very high | 112 Ų | 112 | 110.1 Ų | 110.1 | 52% | 0.523 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.5 | -47.9 | 176.2 | -178.5 | 176.6 | -3.1 | 0 | 0 | 111.5 | R88 H89 L90 M94 R95 E96 | R88-Q92 PolarHBondContact O-N 2.94Å; H89-Q92 PolarHBondContact O-N 3.34Å; L90-Q92 VanDerWaalsContact C-N 3.33Å; L90-Q92 PolarHBondContact O-N 3.2Å; Q92-M94 VanDerWaalsContact C-N 3.33Å; Q92-M94 PolarHBondContact O-N 3.11Å; Q92-R95 WeakPolarHBondContact O-CB 3.48Å; Q92-R95 PolarHBondContact O-N 2.99Å; Q92-E96 VanDerWaalsContact CG-OE1 3.31Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.32Å; Q92-E96 PolarHBondContact NE2-OE1 3.37Å; Q92-E96 WeakPolarHBondContact O-CG 3.41Å; Q92-E96 PolarHBondContact O-N 2.89Å |
| 93 | M | 97.1 | Very high | 90.8 | Very high | 76 Ų | 76 | 106.2 Ų | 106.2 | 37% | 0.374 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.8 | -43.5 | 177.7 | -72.3 | -173.8 | 73.4 | 0 | 0 | 112.3 | H89 L90 E96 K97 | H89-M93 PolarHBondContact NE2-SD 3.06Å; H89-M93 VanDerWaalsContact NE2-SD 3.43Å; H89-M93 WeakPolarHBondContact O-CG 3.48Å; H89-M93 PolarHBondContact O-N 3Å; L90-M93 PolarHBondContact O-N 3.38Å; M93-E96 PolarHBondContact O-N 3.32Å; M93-K97 WeakPolarHBondContact O-CG 3.4Å; M93-K97 PolarHBondContact O-N 3.41Å |
| 94 | M | 96.6 | Very high | 89.9 | Confident | 109 Ų | 109 | 105.4 Ų | 105.4 | 54% | 0.537 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 177 | -75.1 | -174.8 | -74.9 | 0 | 0 | 111.3 | L90 Q92 E96 K97 I98 | L90-M94 HydrophobicContact CB-CE 4.36Å; L90-M94 WeakPolarHBondContact O-CE 3.44Å; L90-M94 WeakPolarHBondContact O-CG 3.46Å; L90-M94 PolarHBondContact O-N 3.21Å; Q92-M94 VanDerWaalsContact C-N 3.33Å; Q92-M94 PolarHBondContact O-N 3.11Å; M94-E96 VanDerWaalsContact C-N 3.35Å; M94-E96 PolarHBondContact O-N 2.88Å; M94-K97 PolarHBondContact O-N 3.16Å; M94-I98 VanDerWaalsContact O-CG1 3.27Å; M94-I98 WeakPolarHBondContact O-CG1 3.48Å; M94-I98 PolarHBondContact O-N 3.04Å |
| 95 | R | 94.4 | Very high | 88.9 | Confident | 178 Ų | 178 | 111.7 Ų | 111.7 | 67% | 0.672 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60 | -44.9 | 176 | -178.6 | 179.3 | 178.8 | 170.5 | 0.4 | 111.7 | S91 Q92 I98 L99 | S91-R95 WeakPolarHBondContact O-CB 3.38Å; S91-R95 PolarHBondContact O-N 3.35Å; Q92-R95 WeakPolarHBondContact O-CB 3.48Å; Q92-R95 PolarHBondContact O-N 2.99Å; R95-I98 PolarHBondContact O-N 3.19Å; R95-L99 HydrophobicContact CG-CD1 3.94Å; R95-L99 HydrophobicContact CG-CG 4.39Å; R95-L99 WeakPolarHBondContact O-CB 3.31Å; R95-L99 VanDerWaalsContact O-CG 3.22Å; R95-L99 WeakPolarHBondContact O-CG 3.13Å; R95-L99 PolarHBondContact O-N 3.01Å |
| 96 | E | 93.8 | Very high | 87.9 | Confident | 105 Ų | 105 | 113.3 Ų | 113.3 | 49% | 0.491 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -63.5 | -42.3 | 178.9 | -73.4 | 170.2 | -171.1 | 0 | 0 | 111.8 | Q92 M93 M94 L99 A100 | Q92-E96 VanDerWaalsContact CG-OE1 3.31Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.32Å; Q92-E96 PolarHBondContact NE2-OE1 3.37Å; Q92-E96 WeakPolarHBondContact O-CG 3.41Å; Q92-E96 PolarHBondContact O-N 2.89Å; M93-E96 PolarHBondContact O-N 3.32Å; M94-E96 VanDerWaalsContact C-N 3.35Å; M94-E96 PolarHBondContact O-N 2.88Å; E96-L99 PolarHBondContact O-N 3.02Å; E96-A100 WeakPolarHBondContact O-CB 3.44Å; E96-A100 PolarHBondContact O-N 3.01Å |
| 97 | K | 93.6 | Very high | 87 | Confident | 128 Ų | 128 | 113.9 Ų | 113.9 | 56% | 0.557 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -62 | -48.5 | 174.6 | -74.5 | -177.7 | 178.3 | -173.8 | 0 | 112.4 | M93 M94 L99 A100 E101 | M93-K97 WeakPolarHBondContact O-CG 3.4Å; M93-K97 PolarHBondContact O-N 3.41Å; M94-K97 PolarHBondContact O-N 3.16Å; K97-L99 VanDerWaalsContact C-N 3.3Å; K97-L99 PolarHBondContact O-N 3.34Å; K97-A100 PolarHBondContact O-N 3.17Å; K97-A100 VanDerWaalsContact O-N 3.13Å; K97-E101 WeakPolarHBondContact O-CG 3.5Å; K97-E101 PolarHBondContact O-N 3.46Å |
| 98 | I | 92.6 | Very high | 86.1 | Confident | 87 Ų | 87 | 119.2 Ų | 119.2 | 45% | 0.446 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -61 | -42.4 | 177.7 | -67.7 | 165.4 | 0 | 0 | 0 | 110.4 | M94 R95 A100 E101 M102 | M94-I98 VanDerWaalsContact O-CG1 3.27Å; M94-I98 WeakPolarHBondContact O-CG1 3.48Å; M94-I98 PolarHBondContact O-N 3.04Å; R95-I98 PolarHBondContact O-N 3.19Å; I98-A100 VanDerWaalsContact C-N 3.32Å; I98-A100 PolarHBondContact O-N 3.08Å; I98-E101 PolarHBondContact O-N 3.45Å; I98-M102 HydrophobicContact CG2-CE 4.42Å; I98-M102 HydrophobicContact CG2-CG 4.22Å; I98-M102 HydrophobicContact CG2-SD 4.21Å; I98-M102 VanDerWaalsContact O-CB 3.25Å; I98-M102 WeakPolarHBondContact O-CB 3.3Å; I98-M102 WeakPolarHBondContact O-CG 3.45Å; I98-M102 PolarHBondContact O-N 3.14Å |
| 99 | L | 88.6 | Confident | 85.3 | Confident | 83 Ų | 83 | 117.3 Ų | 117.3 | 44% | 0.435 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -65.6 | -35.3 | 176.6 | -73.8 | 173.1 | 0 | 0 | 0 | 112.3 | R95 E96 K97 K103 | R95-L99 HydrophobicContact CG-CD1 3.94Å; R95-L99 HydrophobicContact CG-CG 4.39Å; R95-L99 WeakPolarHBondContact O-CB 3.31Å; R95-L99 VanDerWaalsContact O-CG 3.22Å; R95-L99 WeakPolarHBondContact O-CG 3.13Å; R95-L99 PolarHBondContact O-N 3.01Å; E96-L99 PolarHBondContact O-N 3.02Å; K97-L99 VanDerWaalsContact C-N 3.3Å; K97-L99 PolarHBondContact O-N 3.34Å; L99-K103 WeakPolarHBondContact O-CB 3.4Å; L99-K103 WeakPolarHBondContact O-CG 3.24Å; L99-K103 PolarHBondContact O-N 3.01Å |
| 100 | A | 87.1 | Confident | 84.7 | Confident | 69 Ų | 69 | 121.8 Ų | 121.8 | 57% | 0.57 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -70.5 | -36.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | E96 K97 I98 | E96-A100 WeakPolarHBondContact O-CB 3.44Å; E96-A100 PolarHBondContact O-N 3.01Å; K97-A100 PolarHBondContact O-N 3.17Å; K97-A100 VanDerWaalsContact O-N 3.13Å; I98-A100 VanDerWaalsContact C-N 3.32Å; I98-A100 PolarHBondContact O-N 3.08Å |
| 101 | E | 86.6 | Confident | 84 | Confident | 159 Ų | 159 | 121.7 Ų | 121.7 | 74% | 0.743 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -72.6 | -37.1 | 174.7 | -72 | 171.8 | -165.7 | 0 | 0 | 112.4 | K97 I98 | K97-E101 WeakPolarHBondContact O-CG 3.5Å; K97-E101 PolarHBondContact O-N 3.46Å; I98-E101 PolarHBondContact O-N 3.45Å |
| 102 | M | 81.9 | Confident | 83.5 | Confident | 150 Ų | 150 | 123.7 Ų | 123.7 | 74% | 0.739 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -78.7 | -25.1 | 178.9 | -78.7 | -161.6 | 166.8 | 0 | 0 | 113.6 | I98 P104 | I98-M102 HydrophobicContact CG2-CE 4.42Å; I98-M102 HydrophobicContact CG2-CG 4.22Å; I98-M102 HydrophobicContact CG2-SD 4.21Å; I98-M102 VanDerWaalsContact O-CB 3.25Å; I98-M102 WeakPolarHBondContact O-CB 3.3Å; I98-M102 WeakPolarHBondContact O-CG 3.45Å; I98-M102 PolarHBondContact O-N 3.14Å; M102-P104 WeakPolarHBondContact O-CD 3.41Å |
| 103 | K | 76.5 | Confident | 83.1 | Confident | 139 Ų | 139 | 128.1 Ų | 128.1 | 60% | 0.604 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -65.2 | 115.1 | 169.9 | -82.6 | 174.6 | -176.6 | -170.2 | 0 | 107.3 | L99 V105 | L99-K103 WeakPolarHBondContact O-CB 3.4Å; L99-K103 WeakPolarHBondContact O-CG 3.24Å; L99-K103 PolarHBondContact O-N 3.01Å; K103-V105 PolarHBondContact O-N 3.21Å |
| 104 | P | 66.6 | Low | 82.6 | Confident | 100 Ų | 100 | 132.2 Ų | 132.2 | 65% | 0.649 | 66% | 0.657 | S | S | * | * | trans | -54.8 | 133.2 | 172.1 | -18.5 | 31.2 | 0 | 0 | 0 | 108.2 | M102 E106 | M102-P104 WeakPolarHBondContact O-CD 3.41Å; P104-E106 HydrophobicContact CB-CB 4.3Å; P104-E106 PolarHBondContact O-N 3.23Å | ||
| 105 | V | 64.2 | Low | 82.1 | Confident | 153 Ų | 153 | 129.9 Ų | 129.9 | 93% | 0.927 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -61 | -11.1 | 172.7 | 172.2 | 0 | 0 | 0 | 0 | 111.6 | K103 | K103-V105 PolarHBondContact O-N 3.21Š|
| 106 | E | 67.6 | Low | 81.8 | Confident | 158 Ų | 158 | 126.7 Ų | 126.7 | 74% | 0.738 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -70.2 | 128.4 | 176.5 | -150.6 | 163.2 | -154.3 | 0 | 0 | 110 | P104 E108 | P104-E106 HydrophobicContact CB-CB 4.3Å; P104-E106 PolarHBondContact O-N 3.23Å; E106-E108 PolarHBondContact O-N 3.48Å; E106-E108 VanDerWaalsContact O-N 3.15Å |
| 107 | P | 73.8 | Confident | 81.3 | Confident | 111 Ų | 111 | 127.1 Ų | 127.1 | 72% | 0.721 | 65% | 0.654 | S | S | * | * | trans | -55.6 | 126.7 | 177.1 | 24 | -32.9 | 0 | 0 | 0 | 108.3 | ||||
| 108 | E | 71.6 | Confident | 80.8 | Confident | 173 Ų | 173 | 125.9 Ų | 125.9 | 81% | 0.808 | 65% | 0.65 | S | S | * | * | trans | -46 | 121.2 | 174.8 | -70.6 | -177.4 | -177.5 | 0 | 0 | 107.8 | E106 K110 | E106-E108 PolarHBondContact O-N 3.48Å; E106-E108 VanDerWaalsContact O-N 3.15Å; E108-K110 PolarHBondContact O-N 3.12Å | ||
| 109 | P | 75.5 | Confident | 80.3 | Confident | 119 Ų | 119 | 124.8 Ų | 124.8 | 77% | 0.773 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 119.7 | -177.4 | 21.9 | -31.5 | 0 | 0 | 0 | 106.8 | P111 | P109-P111 WeakPolarHBondContact O-CD 3.18Š|
| 110 | K | 81.6 | Confident | 80 | Confident | 197 Ų | 197 | 127.6 Ų | 127.6 | 86% | 0.857 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 120.7 | -178.4 | -70.9 | 179.5 | -178.9 | 175.4 | 0 | 107.2 | E108 D112 | E108-K110 PolarHBondContact O-N 3.12Å; K110-D112 PolarHBondContact O-N 3.29Å |
| 111 | P | 83.2 | Confident | 79.6 | Confident | 81 Ų | 81 | 131.8 Ų | 131.8 | 53% | 0.526 | 67% | 0.666 | S | S | . | * | P | Polyproline II helix | trans | -60 | 128.7 | -179.4 | 22.4 | -32 | 0 | 0 | 0 | 108.5 | P109 Y113 | P109-P111 WeakPolarHBondContact O-CD 3.18Å; P111-Y113 HydrophobicContact CG-CE1 4.35Å; P111-Y113 HydrophobicContact CG-CE2 3.9Å; P111-Y113 WeakPolarHBondContact CG-OH 3.43Å; P111-Y113 VanDerWaalsContact O-CD2 3.24Å; P111-Y113 WeakPolarHBondContact O-CD2 3.43Å; P111-Y113 WeakPolarHBondContact O-CE2 3.27Å; P111-Y113 PolarHBondContact O-N 2.81Å |
| 112 | D | 85.2 | Confident | 79.1 | Confident | 111 Ų | 111 | 127.3 Ų | 127.3 | 59% | 0.594 | 65% | 0.651 | S | S | * | * | trans | -74.9 | 113.5 | 173.5 | -167.1 | -0.3 | 0 | 0 | 0 | 108.2 | K110 R114 | K110-D112 PolarHBondContact O-N 3.29Å; D112-R114 PolarHBondContact O-N 3.13Å; D112-R114 WeakPolarHBondContact OD1-CB 3.22Å; D112-R114 VanDerWaalsContact OD1-CD 3.31Å; D112-R114 WeakPolarHBondContact OD1-CD 3.38Å; D112-R114 WeakPolarHBondContact OD1-CG 3.19Å; D112-R114 PolarHBondContact OD1-N 3.22Å; D112-R114 VanDerWaalsContact OD1-N 3.12Å; D112-R114 IonicContact OD1-NE 3.8Å | ||
| 113 | Y | 87 | Confident | 78.7 | Confident | 204 Ų | 204 | 123.1 Ų | 123.1 | 80% | 0.8 | 64% | 0.64 | S | S | * | * | trans | -84.7 | 3.4 | 179.5 | -64.2 | -78.4 | 0 | 0 | 0 | 112.7 | P111 | P111-Y113 HydrophobicContact CG-CE1 4.35Å; P111-Y113 HydrophobicContact CG-CE2 3.9Å; P111-Y113 WeakPolarHBondContact CG-OH 3.43Å; P111-Y113 VanDerWaalsContact O-CD2 3.24Å; P111-Y113 WeakPolarHBondContact O-CD2 3.43Å; P111-Y113 WeakPolarHBondContact O-CE2 3.27Å; P111-Y113 PolarHBondContact O-N 2.81Å | ||
| 114 | R | 86.8 | Confident | 78.9 | Confident | 162 Ų | 162 | 122.9 Ų | 122.9 | 61% | 0.611 | 65% | 0.653 | S | S | * | * | trans | -72.4 | 136.3 | 179.8 | -67.1 | 170.1 | -179.2 | -170.6 | 0.6 | 110.8 | D112 C119 | D112-R114 PolarHBondContact O-N 3.13Å; D112-R114 WeakPolarHBondContact OD1-CB 3.22Å; D112-R114 VanDerWaalsContact OD1-CD 3.31Å; D112-R114 WeakPolarHBondContact OD1-CD 3.38Å; D112-R114 WeakPolarHBondContact OD1-CG 3.19Å; D112-R114 PolarHBondContact OD1-N 3.22Å; D112-R114 VanDerWaalsContact OD1-N 3.12Å; D112-R114 IonicContact OD1-NE 3.8Å; R114-C119 WeakPolarHBondContact CB-SG 3.35Å | ||
| 115 | S | 86.9 | Confident | 79.6 | Confident | 61 Ų | 61 | 121.7 Ų | 121.7 | 43% | 0.427 | 66% | 0.659 | S | S | . | * | trans | -71.3 | 153 | 172.8 | 65.7 | 0 | 0 | 0 | 0 | 111 | H117 Q118 C119 | S115-H117 PolarHBondContact O-N 2.98Å; S115-Q118 PolarHBondContact O-N 2.98Å; S115-Q118 WeakPolarHBondContact OG-CB 3.36Å; S115-Q118 PolarHBondContact OG-N 2.68Å; S115-Q118 VanDerWaalsContact OG-N 3.16Å; S115-C119 PolarHBondContact O-N 2.79Å | ||
| 116 | T | 86.3 | Confident | 80.3 | Confident | 111 Ų | 111 | 122 Ų | 122 | 68% | 0.681 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -54.3 | -34.8 | 171.2 | 41.2 | 0 | 0 | 0 | 0 | 111.9 | H120 | T116-H120 WeakPolarHBondContact O-CB 3.25Å; T116-H120 PolarHBondContact O-CD2 2.69Å; T116-H120 PolarHBondContact O-N 3.11Å; T116-H120 VanDerWaalsContact O-N 3.08Å |
| 117 | H | 84.8 | Confident | 80.9 | Confident | 114 Ų | 114 | 119.9 Ų | 119.9 | 53% | 0.528 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -62.4 | -48.2 | 175 | -174 | 62.8 | 0 | 0 | 0 | 112.1 | S115 C119 H120 F121 C122 | S115-H117 PolarHBondContact O-N 2.98Å; H117-C119 VanDerWaalsContact C-N 3.34Å; H117-C119 PolarHBondContact O-N 2.98Å; H117-H120 PolarHBondContact O-N 3.15Å; H117-F121 AromaticContact ND1-CD2 3.66Å; H117-F121 AromaticContact ND1-CG 3.76Å; H117-F121 WeakPolarHBondContact O-CA 3.33Å; H117-F121 WeakPolarHBondContact O-CB 3.32Å; H117-F121 PolarHBondContact O-N 3.01Å; H117-C122 PolarHBondContact O-N 3.1Å |
| 118 | Q | 83.1 | Confident | 81.2 | Confident | 101 Ų | 101 | 119.4 Ų | 119.4 | 47% | 0.472 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -64.4 | -38.6 | -180 | -171.1 | 177.6 | 14.7 | 0 | 0 | 112.3 | S115 | S115-Q118 PolarHBondContact O-N 2.98Å; S115-Q118 WeakPolarHBondContact OG-CB 3.36Å; S115-Q118 PolarHBondContact OG-N 2.68Å; S115-Q118 VanDerWaalsContact OG-N 3.16Å |
| 119 | C | 81.3 | Confident | 81.7 | Confident | 64 Ų | 64 | 116.2 Ų | 116.2 | 43% | 0.432 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -70.9 | -38.2 | 179.5 | -69.5 | 0 | 0 | 0 | 0 | 113.4 | R114 S115 H117 | R114-C119 WeakPolarHBondContact CB-SG 3.35Å; S115-C119 PolarHBondContact O-N 2.79Å; H117-C119 VanDerWaalsContact C-N 3.34Å; H117-C119 PolarHBondContact O-N 2.98Å |
| 120 | H | 82.1 | Confident | 82 | Confident | 142 Ų | 142 | 121.9 Ų | 121.9 | 66% | 0.657 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -104.1 | -28.8 | -169.6 | -65.4 | -64.8 | 0 | 0 | 0 | 114.6 | T116 H117 | T116-H120 WeakPolarHBondContact O-CB 3.25Å; T116-H120 PolarHBondContact O-CD2 2.69Å; T116-H120 PolarHBondContact O-N 3.11Å; T116-H120 VanDerWaalsContact O-N 3.08Å; H117-H120 PolarHBondContact O-N 3.15Å |
| 121 | F | 78.1 | Confident | 82.1 | Confident | 157 Ų | 157 | 118.2 Ų | 118.2 | 69% | 0.689 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.4 | -20.9 | -170.3 | -58.7 | -89.3 | 0 | 0 | 0 | 113.2 | H117 | H117-F121 AromaticContact ND1-CD2 3.66Å; H117-F121 AromaticContact ND1-CG 3.76Å; H117-F121 WeakPolarHBondContact O-CA 3.33Å; H117-F121 WeakPolarHBondContact O-CB 3.32Å; H117-F121 PolarHBondContact O-N 3.01Å |
| 122 | C | 76.6 | Confident | 82.1 | Confident | 65 Ų | 65 | 124 Ų | 124 | 44% | 0.439 | 66% | 0.658 | S | S | . | * | trans | -102.6 | 63.2 | 175.7 | -58.2 | 0 | 0 | 0 | 0 | 110.8 | H117 P124 | H117-C122 PolarHBondContact O-N 3.1Å; C122-P124 VanDerWaalsContact O-CD 3.3Å; C122-P124 WeakPolarHBondContact O-CD 3.31Å | ||
| 123 | A | 74.1 | Confident | 81.9 | Confident | 62 Ų | 62 | 122.6 Ų | 122.6 | 51% | 0.512 | 66% | 0.663 | S | S | . | * | trans | -64.3 | 117.6 | 173 | 0 | 0 | 0 | 0 | 0 | 109.6 | G125 F126 | A123-G125 PolarHBondContact O-N 2.89Å; A123-F126 HydrophobicContact CB-CB 4.46Å; A123-F126 PolarHBondContact O-N 3.4Å | ||
| 124 | P | 80.4 | Confident | 81.6 | Confident | 134 Ų | 134 | 118.9 Ų | 118.9 | 87% | 0.87 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.6 | 125 | 175.9 | 25.4 | -31.7 | 0 | 0 | 0 | 109 | C122 | C122-P124 VanDerWaalsContact O-CD 3.3Å; C122-P124 WeakPolarHBondContact O-CD 3.31Å |
| 125 | G | 80.6 | Confident | 81.1 | Confident | 75 Ų | 75 | 114.9 Ų | 114.9 | 77% | 0.773 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 99.3 | -1.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | A123 V127 | A123-G125 PolarHBondContact O-N 2.89Å; G125-V127 PolarHBondContact O-N 3.39Å; G125-V127 VanDerWaalsContact O-N 3.14Å |
| 126 | F | 79.1 | Confident | 80.8 | Confident | 159 Ų | 159 | 119.6 Ų | 119.6 | 70% | 0.697 | 68% | 0.681 | S | S | * | * | trans | -73.6 | 104.9 | 167.7 | -175.5 | -102.9 | 0 | 0 | 0 | 110.1 | A123 P128 | A123-F126 HydrophobicContact CB-CB 4.46Å; A123-F126 PolarHBondContact O-N 3.4Å; F126-P128 HydrophobicContact CE1-CB 3.9Å; F126-P128 HydrophobicContact CE1-CG 4.44Å; F126-P128 HydrophobicContact CZ-CB 4.44Å; F126-P128 WeakPolarHBondContact O-CD 3.46Å | ||
| 127 | V | 81.4 | Confident | 80.5 | Confident | 115 Ų | 115 | 119.6 Ų | 119.6 | 70% | 0.697 | 67% | 0.672 | S | S | * | * | trans | -99.5 | 109.5 | 169.7 | -178.1 | 0 | 0 | 0 | 0 | 107.1 | G125 S129 | G125-V127 PolarHBondContact O-N 3.39Å; G125-V127 VanDerWaalsContact O-N 3.14Å; V127-S129 PolarHBondContact O-N 3.44Å | ||
| 128 | P | 79.3 | Confident | 80.3 | Confident | 100 Ų | 100 | 117 Ų | 117 | 65% | 0.649 | 66% | 0.663 | S | S | * | * | trans | -63.3 | 103.1 | 175.4 | 23.3 | -30.3 | 0 | 0 | 0 | 109.1 | F126 | F126-P128 HydrophobicContact CE1-CB 3.9Å; F126-P128 HydrophobicContact CE1-CG 4.44Å; F126-P128 HydrophobicContact CZ-CB 4.44Å; F126-P128 WeakPolarHBondContact O-CD 3.46Å | ||
| 129 | S | 82.3 | Confident | 80.1 | Confident | 106 Ų | 106 | 121 Ų | 121 | 74% | 0.741 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -94.1 | 125.6 | 172 | 63.6 | 0 | 0 | 0 | 0 | 108.7 | V127 | V127-S129 PolarHBondContact O-N 3.44Š|
| 130 | R | 82.8 | Confident | 80.1 | Confident | 238 Ų | 238 | 127 Ų | 127 | 90% | 0.898 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -76 | 131.5 | 168.8 | -65.2 | -173.2 | -171 | -156.1 | 2.4 | 107.4 | K132 | R130-K132 PolarHBondContact O-N 3.13Š|
| 131 | P | 83.7 | Confident | 80 | Confident | 120 Ų | 120 | 126.6 Ų | 126.6 | 78% | 0.779 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 141.8 | 172 | 25.6 | -32.3 | 0 | 0 | 0 | 108.7 | A133 | P131-A133 PolarHBondContact O-N 2.98Š|
| 132 | K | 82.3 | Confident | 80.2 | Confident | 202 Ų | 202 | 123.3 Ų | 123.3 | 88% | 0.878 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 130.3 | 172.9 | -169 | 175.7 | 179.4 | -178.5 | 0 | 107.8 | R130 S134 | R130-K132 PolarHBondContact O-N 3.13Å; K132-S134 PolarHBondContact O-N 2.87Å |
| 133 | A | 81.9 | Confident | 80.2 | Confident | 83 Ų | 83 | 126.8 Ų | 126.8 | 69% | 0.686 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 131 | 175.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | P131 T135 | P131-A133 PolarHBondContact O-N 2.98Å; A133-T135 PolarHBondContact O-N 3.47Å |
| 134 | S | 79.6 | Confident | 80.5 | Confident | 125 Ų | 125 | 127.6 Ų | 127.6 | 87% | 0.874 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -69.1 | -22.1 | -179 | -174.4 | 0 | 0 | 0 | 0 | 112.5 | K132 | K132-S134 PolarHBondContact O-N 2.87Š|
| 135 | T | 77.3 | Confident | 80.6 | Confident | 78 Ų | 78 | 127.2 Ų | 127.2 | 48% | 0.479 | 68% | 0.684 | S | S | . | * | S | Bend | trans | -146.7 | 139.5 | -171.2 | -32.3 | 0 | 0 | 0 | 0 | 108.8 | A133 H137 | A133-T135 PolarHBondContact O-N 3.47Å; T135-H137 VanDerWaalsContact C-N 3.3Å; T135-H137 VanDerWaalsContact CB-CD2 3.44Å; T135-H137 WeakPolarHBondContact CB-CD2 3.42Å; T135-H137 WeakPolarHBondContact CB-NE2 3.16Å; T135-H137 WeakPolarHBondContact CG2-NE2 3.41Å; T135-H137 PolarHBondContact O-N 3.05Å; T135-H137 VanDerWaalsContact O-N 3.14Å |
| 136 | D | 80.1 | Confident | 80.9 | Confident | 161 Ų | 161 | 126.7 Ų | 126.7 | 86% | 0.861 | 67% | 0.665 | S | S | * | * | trans | -87 | 70.4 | -179.2 | -164.9 | 19.8 | 0 | 0 | 0 | 109.4 | ||||
| 137 | H | 79.9 | Confident | 81.3 | Confident | 110 Ų | 110 | 125.7 Ų | 125.7 | 51% | 0.509 | 66% | 0.661 | S | S | . | * | trans | -89.3 | 121.6 | 178.5 | -69.9 | -59.5 | 0 | 0 | 0 | 110.4 | T135 E142 | T135-H137 VanDerWaalsContact C-N 3.3Å; T135-H137 VanDerWaalsContact CB-CD2 3.44Å; T135-H137 WeakPolarHBondContact CB-CD2 3.42Å; T135-H137 WeakPolarHBondContact CB-NE2 3.16Å; T135-H137 WeakPolarHBondContact CG2-NE2 3.41Å; T135-H137 PolarHBondContact O-N 3.05Å; T135-H137 VanDerWaalsContact O-N 3.14Å; H137-E142 WeakPolarHBondContact CA-OE1 3.27Å; H137-E142 IonicContact CE1-OE2 3.95Å; H137-E142 IonicContact CG-OE2 2.68Å; H137-E142 IonicContact ND1-OE1 3.39Å; H137-E142 IonicContact ND1-OE2 3Å; H137-E142 PolarHBondContact ND1-OE2 3.23Å | ||
| 138 | D | 79.9 | Confident | 81.5 | Confident | 61 Ų | 61 | 127 Ų | 127 | 33% | 0.326 | 65% | 0.654 | S | S | . | * | trans | -95.5 | 105.7 | 175.3 | -170.5 | -3.8 | 0 | 0 | 0 | 111.2 | R140 N141 E142 | D138-R140 PolarHBondContact O-N 3.35Å; D138-R140 PolarHBondContact OD1-N 2.8Å; D138-R140 VanDerWaalsContact OD1-N 3.15Å; D138-N141 HydrophobicContact CB-CB 4.45Å; D138-N141 PolarHBondContact O-N 3Å; D138-N141 VanDerWaalsContact O-N 3.07Å; D138-N141 PolarHBondContact OD2-ND2 3.27Å; D138-E142 PolarHBondContact N-OE1 2.93Å; D138-E142 VanDerWaalsContact N-OE1 3.11Å; D138-E142 WeakPolarHBondContact O-CB 3.39Å; D138-E142 PolarHBondContact O-N 3.43Å | ||
| 139 | Y | 80.1 | Confident | 81.8 | Confident | 184 Ų | 184 | 123.8 Ų | 123.8 | 72% | 0.722 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | -17 | -178.6 | 76.2 | -87.6 | 0 | 0 | 0 | 114.4 | ||
| 140 | R | 80.6 | Confident | 82 | Confident | 190 Ų | 190 | 124 Ų | 124 | 72% | 0.717 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -29.9 | 178.9 | -67.8 | -171.8 | 171 | -170.5 | -3.1 | 113.3 | D138 | D138-R140 PolarHBondContact O-N 3.35Å; D138-R140 PolarHBondContact OD1-N 2.8Å; D138-R140 VanDerWaalsContact OD1-N 3.15Å |
| 141 | N | 81 | Confident | 82.3 | Confident | 133 Ų | 133 | 114.7 Ų | 114.7 | 71% | 0.711 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | -25.7 | -169.4 | -68.1 | -41.9 | 0 | 0 | 0 | 112.1 | D138 | D138-N141 HydrophobicContact CB-CB 4.45Å; D138-N141 PolarHBondContact O-N 3Å; D138-N141 VanDerWaalsContact O-N 3.07Å; D138-N141 PolarHBondContact OD2-ND2 3.27Å |
| 142 | E | 81.2 | Confident | 82.4 | Confident | 89 Ų | 89 | 111.2 Ų | 111.2 | 42% | 0.416 | 57% | 0.567 | S | S | . | * | S | Bend | trans | -91.9 | 135.5 | 179.9 | -66.3 | 175.5 | -151.2 | 0 | 0 | 111.3 | H137 D138 | H137-E142 WeakPolarHBondContact CA-OE1 3.27Å; H137-E142 IonicContact CE1-OE2 3.95Å; H137-E142 IonicContact CG-OE2 2.68Å; H137-E142 IonicContact ND1-OE1 3.39Å; H137-E142 IonicContact ND1-OE2 3Å; H137-E142 PolarHBondContact ND1-OE2 3.23Å; D138-E142 PolarHBondContact N-OE1 2.93Å; D138-E142 VanDerWaalsContact N-OE1 3.11Å; D138-E142 WeakPolarHBondContact O-CB 3.39Å; D138-E142 PolarHBondContact O-N 3.43Å |
| 143 | E | 77.6 | Confident | 82.5 | Confident | 137 Ų | 137 | 109.4 Ų | 109.4 | 64% | 0.64 | 56% | 0.562 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 144.4 | 169.7 | -64.5 | -168.1 | 167.1 | 0 | 0 | 110 | I145 | E143-I145 PolarHBondContact O-N 2.98Š|
| 144 | A | 80.3 | Confident | 82.8 | Confident | 80 Ų | 80 | 113.4 Ų | 113.4 | 66% | 0.661 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 126.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | T146 | A144-T146 HydrophobicContact CB-CG2 4.34Å; A144-T146 PolarHBondContact O-N 3.26Å; A144-T146 VanDerWaalsContact O-N 3.08Å |
| 145 | I | 80.9 | Confident | 83.1 | Confident | 126 Ų | 126 | 109.1 Ų | 109.1 | 65% | 0.646 | 53% | 0.531 | S | S | * | . | trans | -68.1 | 109.9 | 171.1 | -56.5 | 174.2 | 0 | 0 | 0 | 107.3 | E143 D150 | E143-I145 PolarHBondContact O-N 2.98Å; I145-D150 WeakPolarHBondContact CG2-OD1 3.39Å | ||
| 146 | T | 87 | Confident | 83.4 | Confident | 63 Ų | 63 | 113.4 Ų | 113.4 | 39% | 0.387 | 55% | 0.545 | S | S | . | . | trans | -118.4 | 163.5 | 177.7 | 61.7 | 0 | 0 | 0 | 0 | 109.9 | A144 W148 S149 D150 | A144-T146 HydrophobicContact CB-CG2 4.34Å; A144-T146 PolarHBondContact O-N 3.26Å; A144-T146 VanDerWaalsContact O-N 3.08Å; T146-W148 PolarHBondContact O-N 2.93Å; T146-S149 PolarHBondContact N-OG 2.69Å; T146-S149 PolarHBondContact O-N 3.42Å; T146-S149 PolarHBondContact O-OG 2.95Å; T146-S149 PolarHBondContact OG1-N 3.39Å; T146-D150 PolarHBondContact O-N 3.41Å; T146-D150 VanDerWaalsContact O-N 3.14Å | ||
| 147 | F | 88.2 | Confident | 83.7 | Confident | 139 Ų | 139 | 117.8 Ų | 117.8 | 61% | 0.61 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -48.8 | -36.6 | 172.5 | 174.3 | -95 | 0 | 0 | 0 | 112.9 | N151 | F147-N151 WeakPolarHBondContact CE2-ND2 3.41Å; F147-N151 WeakPolarHBondContact O-CB 3.35Å; F147-N151 PolarHBondContact O-N 2.97Å; F147-N151 PolarHBondContact O-ND2 3.21Å |
| 148 | W | 86.6 | Confident | 83.8 | Confident | 142 Ų | 142 | 115.5 Ų | 115.5 | 54% | 0.538 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -72 | -41 | -179.5 | -59.2 | 102.2 | 0 | 0 | 0 | 112.6 | T146 D150 N151 F152 I155 F168 | T146-W148 PolarHBondContact O-N 2.93Å; W148-D150 VanDerWaalsContact C-N 3.3Å; W148-D150 PolarHBondContact O-N 3.49Å; W148-N151 PolarHBondContact O-N 3.04Å; W148-F152 PolarHBondContact O-N 3.47Å; W148-F152 VanDerWaalsContact O-N 3.15Å; W148-I155 HydrophobicContact CD2-CD1 4.45Å; W148-I155 HydrophobicContact CE3-CD1 3.46Å; W148-I155 VanDerWaalsContact CE3-CD1 3.46Å; W148-I155 HydrophobicContact CE3-CG1 4.27Å; W148-I155 HydrophobicContact CE3-CG2 4.44Å; W148-I155 HydrophobicContact CZ3-CD1 3.98Å; W148-I155 HydrophobicContact CZ3-CG1 4.31Å; W148-I155 HydrophobicContact CZ3-CG2 4.03Å; W148-F168 HydrophobicContact CB-CD2 4.46Å; W148-F168 HydrophobicContact CB-CE2 3.57Å; W148-F168 HydrophobicContact CB-CZ 3.74Å; W148-F168 HydrophobicContact CE3-CZ 4.49Å; W148-F168 WeakPolarHBondContact O-CE2 3.3Å; W148-F168 WeakPolarHBondContact O-CZ 3.47Å |
| 149 | S | 84.3 | Confident | 84 | Confident | 33 Ų | 33 | 115 Ų | 115 | 23% | 0.231 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -69 | -28.1 | 177.6 | 62.5 | 0 | 0 | 0 | 0 | 112.5 | T146 F152 | T146-S149 PolarHBondContact N-OG 2.69Å; T146-S149 PolarHBondContact O-N 3.42Å; T146-S149 PolarHBondContact O-OG 2.95Å; T146-S149 PolarHBondContact OG1-N 3.39Å; S149-F152 VanDerWaalsContact O-CD1 3.24Å; S149-F152 WeakPolarHBondContact O-CD1 3.47Å |
| 150 | D | 87.4 | Confident | 84 | Confident | 110 Ų | 110 | 111.5 Ų | 111.5 | 59% | 0.588 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -79.9 | -31.7 | 176.2 | -75.3 | -7.6 | 0 | 0 | 0 | 112.8 | I145 T146 W148 | I145-D150 WeakPolarHBondContact CG2-OD1 3.39Å; T146-D150 PolarHBondContact O-N 3.41Å; T146-D150 VanDerWaalsContact O-N 3.14Å; W148-D150 VanDerWaalsContact C-N 3.3Å; W148-D150 PolarHBondContact O-N 3.49Å |
| 151 | N | 88.8 | Confident | 84.1 | Confident | 42 Ų | 42 | 105 Ų | 105 | 23% | 0.225 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -106.7 | 11.3 | -171.2 | -67.7 | -79.8 | 0 | 0 | 0 | 114 | F147 W148 Q153 K154 I155 | F147-N151 WeakPolarHBondContact CE2-ND2 3.41Å; F147-N151 WeakPolarHBondContact O-CB 3.35Å; F147-N151 PolarHBondContact O-N 2.97Å; F147-N151 PolarHBondContact O-ND2 3.21Å; W148-N151 PolarHBondContact O-N 3.04Å; N151-Q153 PolarHBondContact O-N 3.26Å; N151-K154 PolarHBondContact O-N 2.97Å; N151-I155 HydrophobicContact CB-CD1 3.99Å; N151-I155 HydrophobicContact CB-CG1 4.18Å; N151-I155 WeakPolarHBondContact O-CD1 3.34Å; N151-I155 VanDerWaalsContact O-CG1 3.3Å; N151-I155 WeakPolarHBondContact O-CG1 3.5Å; N151-I155 PolarHBondContact O-N 3.34Å |
| 152 | F | 85.8 | Confident | 84 | Confident | 48 Ų | 48 | 106.2 Ų | 106.2 | 21% | 0.211 | 52% | 0.522 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -52.8 | -29.3 | -172.9 | 75.3 | -89.8 | 0 | 0 | 0 | 114.4 | W148 S149 I161 P167 F168 | W148-F152 PolarHBondContact O-N 3.47Å; W148-F152 VanDerWaalsContact O-N 3.15Å; S149-F152 VanDerWaalsContact O-CD1 3.24Å; S149-F152 WeakPolarHBondContact O-CD1 3.47Å; F152-I161 HydrophobicContact CB-CD1 3.69Å; F152-I161 HydrophobicContact CD2-CD1 3.47Å; F152-I161 VanDerWaalsContact CD2-CD1 3.47Å; F152-I161 HydrophobicContact CD2-CG2 4.44Å; F152-I161 HydrophobicContact CG-CD1 4.03Å; F152-I161 WeakPolarHBondContact O-CD1 3.48Å; F152-P167 HydrophobicContact CB-CB 3.88Å; F152-P167 HydrophobicContact CB-CG 4.32Å; F152-P167 HydrophobicContact CD2-CB 4.27Å; F152-P167 HydrophobicContact CG-CB 4.09Å; F152-F168 HydrophobicContact CB-CZ 4.19Å |
| 153 | Q | 84.4 | Confident | 84 | Confident | 163 Ų | 163 | 105.5 Ų | 105.5 | 76% | 0.762 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -24.7 | 177.5 | -61.8 | -177.4 | -3.4 | 0 | 0 | 114.1 | N151 | N151-Q153 PolarHBondContact O-N 3.26Š|
| 154 | K | 88.4 | Confident | 84 | Confident | 168 Ų | 168 | 103.4 Ų | 103.4 | 73% | 0.73 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.3 | -15.3 | -174.9 | -64.7 | 176.6 | -176.7 | 170.2 | 0 | 113 | N151 | N151-K154 PolarHBondContact O-N 2.97Š|
| 155 | I | 86 | Confident | 84 | Confident | 34 Ų | 34 | 104.5 Ų | 104.5 | 17% | 0.174 | 52% | 0.518 | C | S | . | . | trans | -75.3 | 131.4 | -176.7 | -67.1 | 156.6 | 0 | 0 | 0 | 110.1 | W148 N151 V158 F168 | W148-I155 HydrophobicContact CD2-CD1 4.45Å; W148-I155 HydrophobicContact CE3-CD1 3.46Å; W148-I155 VanDerWaalsContact CE3-CD1 3.46Å; W148-I155 HydrophobicContact CE3-CG1 4.27Å; W148-I155 HydrophobicContact CE3-CG2 4.44Å; W148-I155 HydrophobicContact CZ3-CD1 3.98Å; W148-I155 HydrophobicContact CZ3-CG1 4.31Å; W148-I155 HydrophobicContact CZ3-CG2 4.03Å; N151-I155 HydrophobicContact CB-CD1 3.99Å; N151-I155 HydrophobicContact CB-CG1 4.18Å; N151-I155 WeakPolarHBondContact O-CD1 3.34Å; N151-I155 VanDerWaalsContact O-CG1 3.3Å; N151-I155 WeakPolarHBondContact O-CG1 3.5Å; N151-I155 PolarHBondContact O-N 3.34Å; I155-V158 HydrophobicContact CG2-CG1 3.76Å; I155-V158 HydrophobicContact CG2-CG2 4.14Å; I155-F168 HydrophobicContact CD1-CZ 4.11Å | ||
| 156 | Q | 83.8 | Confident | 84 | Confident | 169 Ų | 169 | 99.8 Ų | 99.8 | 79% | 0.79 | 50% | 0.498 | S | S | * | . | trans | -98.2 | 164.7 | 176.2 | -62.2 | -179.3 | 0.6 | 0 | 0 | 111.1 | V158 | Q156-V158 VanDerWaalsContact C-N 3.29Å; Q156-V158 PolarHBondContact O-N 2.94Å | ||
| 157 | R | 85.2 | Confident | 83.7 | Confident | 253 Ų | 253 | 97.4 Ų | 97.4 | 96% | 0.955 | 48% | 0.484 | S | S | * | . | S | Bend | trans | 65 | 23.5 | 177.5 | -52.7 | 177.9 | 174.2 | -123.5 | -0.9 | 115.4 | ||
| 158 | V | 83.4 | Confident | 83.5 | Confident | 61 Ų | 61 | 95.2 Ų | 95.2 | 37% | 0.37 | 47% | 0.474 | S | S | . | . | S | Bend | trans | -108.5 | 158.5 | 171.5 | -67.2 | 0 | 0 | 0 | 0 | 110.4 | I155 Q156 F168 | I155-V158 HydrophobicContact CG2-CG1 3.76Å; I155-V158 HydrophobicContact CG2-CG2 4.14Å; Q156-V158 VanDerWaalsContact C-N 3.29Å; Q156-V158 PolarHBondContact O-N 2.94Å; V158-F168 HydrophobicContact CG1-CE1 4.37Å |
| 159 | S | 82.7 | Confident | 83.4 | Confident | 50 Ų | 50 | 96.2 Ų | 96.2 | 35% | 0.35 | 48% | 0.482 | S | S | . | . | trans | -61.3 | 143.6 | 172 | 52.4 | 0 | 0 | 0 | 0 | 110.3 | I161 | S159-I161 PolarHBondContact O-N 3.36Š| ||
| 160 | P | 81.5 | Confident | 83.4 | Confident | 112 Ų | 112 | 104.6 Ų | 104.6 | 73% | 0.727 | 52% | 0.515 | S | S | * | . | trans | -59 | 134.6 | 179.4 | 22.1 | -31.2 | 0 | 0 | 0 | 110.9 | K162 | P160-K162 PolarHBondContact O-N 2.91Š| ||
| 161 | I | 82.1 | Confident | 83.2 | Confident | 53 Ų | 53 | 102.4 Ų | 102.4 | 27% | 0.272 | 51% | 0.508 | S | S | . | . | trans | -82.5 | 112.8 | -172.1 | -62.9 | 172.9 | 0 | 0 | 0 | 108.4 | F152 S159 P167 | F152-I161 HydrophobicContact CB-CD1 3.69Å; F152-I161 HydrophobicContact CD2-CD1 3.47Å; F152-I161 VanDerWaalsContact CD2-CD1 3.47Å; F152-I161 HydrophobicContact CD2-CG2 4.44Å; F152-I161 HydrophobicContact CG-CD1 4.03Å; F152-I161 WeakPolarHBondContact O-CD1 3.48Å; S159-I161 PolarHBondContact O-N 3.36Å; I161-P167 HydrophobicContact CD1-CB 3.84Å; I161-P167 HydrophobicContact CG1-CB 4.32Å; I161-P167 WeakPolarHBondContact CG1-O 3.4Å; I161-P167 HydrophobicContact CG2-CB 3.99Å | ||
| 162 | K | 77.9 | Confident | 83.1 | Confident | 159 Ų | 159 | 103.6 Ų | 103.6 | 69% | 0.691 | 52% | 0.519 | S | S | * | . | S | Bend | trans | -86.6 | -31.8 | 177.4 | -67.4 | -168.7 | 175.8 | -164.6 | 0 | 113.1 | P160 | P160-K162 PolarHBondContact O-N 2.91Š|
| 163 | N | 81.5 | Confident | 82.9 | Confident | 74 Ų | 74 | 104.2 Ų | 104.2 | 40% | 0.396 | 52% | 0.524 | S | S | . | . | trans | -126.5 | 119.5 | -177.5 | -176.2 | -9 | 0 | 0 | 0 | 110 | T165 A166 | N163-T165 PolarHBondContact ND2-OG1 3.39Å; N163-T165 PolarHBondContact O-N 3.17Å; N163-T165 PolarHBondContact OD1-N 3.02Å; N163-T165 PolarHBondContact OD1-OG1 2.95Å; N163-A166 CarbonylContact O-C 3.35Å; N163-A166 PolarHBondContact O-N 3.46Å | ||
| 164 | P | 78.7 | Confident | 82.8 | Confident | 93 Ų | 93 | 105.8 Ų | 105.8 | 60% | 0.604 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.7 | -22.5 | 179.7 | 28 | -35.4 | 0 | 0 | 0 | 113.5 | A166 | P164-A166 VanDerWaalsContact C-N 3.31Š|
| 165 | T | 80.2 | Confident | 82.8 | Confident | 103 Ų | 103 | 102.3 Ų | 102.3 | 63% | 0.632 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.7 | -18 | 178.1 | 59.6 | 0 | 0 | 0 | 0 | 113.3 | N163 | N163-T165 PolarHBondContact ND2-OG1 3.39Å; N163-T165 PolarHBondContact O-N 3.17Å; N163-T165 PolarHBondContact OD1-N 3.02Å; N163-T165 PolarHBondContact OD1-OG1 2.95Å |
| 166 | A | 80.1 | Confident | 82.9 | Confident | 27 Ų | 27 | 102.7 Ų | 102.7 | 22% | 0.223 | 53% | 0.53 | C | S | . | . | S | Bend | trans | -144.9 | 72.9 | 179 | 0 | 0 | 0 | 0 | 0 | 109.6 | N163 P164 F168 K169 | N163-A166 CarbonylContact O-C 3.35Å; N163-A166 PolarHBondContact O-N 3.46Å; P164-A166 VanDerWaalsContact C-N 3.31Å; A166-F168 VanDerWaalsContact C-N 3.31Å; A166-F168 PolarHBondContact O-N 3.39Å; A166-K169 PolarHBondContact O-N 2.94Å |
| 167 | P | 80.6 | Confident | 83.1 | Confident | 12 Ų | 12 | 103.7 Ų | 103.7 | 8% | 0.078 | 53% | 0.527 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.1 | -32.7 | -166.6 | 20.7 | -30.5 | 0 | 0 | 0 | 113.6 | F152 I161 | F152-P167 HydrophobicContact CB-CB 3.88Å; F152-P167 HydrophobicContact CB-CG 4.32Å; F152-P167 HydrophobicContact CD2-CB 4.27Å; F152-P167 HydrophobicContact CG-CB 4.09Å; I161-P167 HydrophobicContact CD1-CB 3.84Å; I161-P167 HydrophobicContact CG1-CB 4.32Å; I161-P167 WeakPolarHBondContact CG1-O 3.4Å; I161-P167 HydrophobicContact CG2-CB 3.99Å |
| 168 | F | 84.3 | Confident | 83 | Confident | 94 Ų | 94 | 98.4 Ų | 98.4 | 41% | 0.412 | 52% | 0.516 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100 | 27.9 | -175.2 | -57.8 | -72.6 | 0 | 0 | 0 | 114.1 | W148 F152 I155 V158 A166 K170 | W148-F168 HydrophobicContact CB-CD2 4.46Å; W148-F168 HydrophobicContact CB-CE2 3.57Å; W148-F168 HydrophobicContact CB-CZ 3.74Å; W148-F168 HydrophobicContact CE3-CZ 4.49Å; W148-F168 WeakPolarHBondContact O-CE2 3.3Å; W148-F168 WeakPolarHBondContact O-CZ 3.47Å; F152-F168 HydrophobicContact CB-CZ 4.19Å; I155-F168 HydrophobicContact CD1-CZ 4.11Å; V158-F168 HydrophobicContact CG1-CE1 4.37Å; A166-F168 VanDerWaalsContact C-N 3.31Å; A166-F168 PolarHBondContact O-N 3.39Å; F168-K170 PolarHBondContact O-N 3.34Å |
| 169 | K | 84.6 | Confident | 83.1 | Confident | 163 Ų | 163 | 104.4 Ų | 104.4 | 71% | 0.709 | 54% | 0.54 | S | S | * | . | trans | -64.8 | 131 | 174.5 | -167.2 | 172.9 | -177.5 | 177.7 | 0 | 110.2 | A166 S171 | A166-K169 PolarHBondContact O-N 2.94Å; K169-S171 PolarHBondContact O-N 3.01Å | ||
| 170 | K | 84.4 | Confident | 83.2 | Confident | 209 Ų | 209 | 106.9 Ų | 106.9 | 91% | 0.909 | 55% | 0.549 | S | S | * | . | trans | -57 | 126 | 179.8 | -68.1 | -178.7 | -179.2 | 177.8 | 0 | 110.5 | F168 | F168-K170 PolarHBondContact O-N 3.34Š| ||
| 171 | S | 83.8 | Confident | 83.2 | Confident | 64 Ų | 64 | 106.8 Ų | 106.8 | 45% | 0.448 | 53% | 0.534 | S | S | . | . | trans | -106.7 | 123 | 170.1 | 178.8 | 0 | 0 | 0 | 0 | 109.2 | K169 | K169-S171 PolarHBondContact O-N 3.01Š| ||
| 172 | S | 84.9 | Confident | 83 | Confident | 66 Ų | 66 | 112.3 Ų | 112.3 | 46% | 0.462 | 56% | 0.563 | S | S | . | * | trans | -108.9 | 8.5 | 176.5 | 54.4 | 0 | 0 | 0 | 0 | 112.9 | F174 S175 T176 | S172-F174 VanDerWaalsContact C-N 3.25Å; S172-F174 PolarHBondContact O-N 2.87Å; S172-F174 VanDerWaalsContact O-N 3.16Å; S172-S175 PolarHBondContact O-N 2.96Å; S172-S175 PolarHBondContact O-OG 2.99Å; S172-T176 WeakPolarHBondContact O-CG2 3.44Å; S172-T176 PolarHBondContact O-N 3.42Å; S172-T176 PolarHBondContact O-OG1 3.23Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å | ||
| 173 | L | 82.6 | Confident | 82.4 | Confident | 61 Ų | 61 | 110 Ų | 110 | 32% | 0.319 | 56% | 0.559 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -57.2 | -36.6 | -173.3 | -71.8 | 170.1 | 0 | 0 | 0 | 114 | T176 R181 D183 | L173-T176 PolarHBondContact O-OG1 2.8Å; L173-R181 PolarHBondContact O-NE 2.9Å; L173-R181 PolarHBondContact O-NH2 3.43Å; L173-D183 VanDerWaalsContact CD2-OD2 3.24Å; L173-D183 WeakPolarHBondContact CD2-OD2 3.48Å |
| 174 | F | 83.1 | Confident | 81.4 | Confident | 196 Ų | 196 | 115 Ų | 115 | 86% | 0.86 | 58% | 0.58 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -34.7 | 178.4 | -179.3 | -101.7 | 0 | 0 | 0 | 112.7 | S172 | S172-F174 VanDerWaalsContact C-N 3.25Å; S172-F174 PolarHBondContact O-N 2.87Å; S172-F174 VanDerWaalsContact O-N 3.16Å |
| 175 | S | 87.9 | Confident | 80.1 | Confident | 95 Ų | 95 | 120 Ų | 120 | 66% | 0.664 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | -13.2 | -173.7 | 55 | 0 | 0 | 0 | 0 | 114.4 | S172 | S172-S175 PolarHBondContact O-N 2.96Å; S172-S175 PolarHBondContact O-OG 2.99Å |
| 176 | T | 88.3 | Confident | 78.6 | Confident | 42 Ų | 42 | 124.2 Ų | 124.2 | 26% | 0.258 | 61% | 0.607 | S | S | . | * | S | Bend | trans | -64.9 | 136.5 | 171.5 | 42.2 | 0 | 0 | 0 | 0 | 110.2 | S172 L173 | S172-T176 WeakPolarHBondContact O-CG2 3.44Å; S172-T176 PolarHBondContact O-N 3.42Å; S172-T176 PolarHBondContact O-OG1 3.23Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å; L173-T176 PolarHBondContact O-OG1 2.8Å |
| 177 | R | 88 | Confident | 76.5 | Confident | 191 Ų | 191 | 134.8 Ų | 134.8 | 72% | 0.721 | 66% | 0.659 | S | S | * | * | trans | -62.7 | 148.2 | 174.1 | -64.3 | 178.5 | 176 | 179.1 | -0.6 | 108.8 | Q179 D180 | R177-Q179 PolarHBondContact O-N 3.48Å; R177-D180 PolarHBondContact O-N 2.9Å | ||
| 178 | I | 82.9 | Confident | 76.3 | Confident | 142 Ų | 142 | 141 Ų | 141 | 73% | 0.728 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -56.5 | -39 | -175 | -61.2 | 168.9 | 0 | 0 | 0 | 111.4 | D180 R181 | I178-D180 VanDerWaalsContact C-N 3.25Å; I178-D180 PolarHBondContact O-N 3.34Å; I178-R181 PolarHBondContact O-N 3.01Å |
| 179 | Q | 84.9 | Confident | 75.8 | Confident | 187 Ų | 187 | 143.4 Ų | 143.4 | 87% | 0.874 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -67.2 | -21.8 | 179.8 | -66.2 | 176.9 | -18.6 | 0 | 0 | 114.2 | R177 | R177-Q179 PolarHBondContact O-N 3.48Š|
| 180 | D | 84 | Confident | 75.4 | Confident | 102 Ų | 102 | 142.3 Ų | 142.3 | 55% | 0.545 | 70% | 0.702 | S | S | . | * | G | 310 helix | trans | -101.6 | 5.7 | -174.9 | -57.4 | -36.4 | 0 | 0 | 0 | 112.2 | R177 I178 | R177-D180 PolarHBondContact O-N 2.9Å; I178-D180 VanDerWaalsContact C-N 3.25Å; I178-D180 PolarHBondContact O-N 3.34Å |
| 181 | R | 81.9 | Confident | 74.8 | Confident | 109 Ų | 109 | 138.4 Ų | 138.4 | 41% | 0.411 | 69% | 0.69 | S | S | . | * | trans | -77.3 | 125.8 | 178.2 | -74.8 | -175.3 | 169 | 151.2 | -1.1 | 109.8 | L173 I178 | L173-R181 PolarHBondContact O-NE 2.9Å; L173-R181 PolarHBondContact O-NH2 3.43Å; I178-R181 PolarHBondContact O-N 3.01Å | ||
| 182 | L | 77.9 | Confident | 74.3 | Confident | 169 Ų | 169 | 143.1 Ų | 143.1 | 89% | 0.885 | 71% | 0.705 | S | S | * | * | trans | -93.1 | -8.5 | 176.6 | -64.5 | 171.2 | 0 | 0 | 0 | 112.9 | E184 | L182-E184 PolarHBondContact O-N 3.41Š| ||
| 183 | D | 66.6 | Low | 73.6 | Confident | 112 Ų | 112 | 148.2 Ų | 148.2 | 60% | 0.599 | 72% | 0.722 | S | S | * | * | trans | -92.8 | 73.6 | -179.7 | -64 | -6.4 | 0 | 0 | 0 | 109 | L173 | L173-D183 VanDerWaalsContact CD2-OD2 3.24Å; L173-D183 WeakPolarHBondContact CD2-OD2 3.48Å | ||
| 184 | E | 59.3 | Low | 72.9 | Confident | 178 Ų | 178 | 154.4 Ų | 154.4 | 83% | 0.832 | 75% | 0.75 | S | S | * | * | trans | -111.6 | 98.7 | 161.6 | -76.4 | -107.5 | 159.7 | 0 | 0 | 107.3 | L182 | L182-E184 PolarHBondContact O-N 3.41Š| ||
| 185 | E | 52.3 | Low | 72.1 | Confident | 198 Ų | 198 | 151.2 Ų | 151.2 | 93% | 0.925 | 74% | 0.742 | S | S | * | * | trans | -124.2 | 124.1 | 152.7 | -78.6 | -167.5 | 170.4 | 0 | 0 | 108 | ||||
| 186 | E | 48.1 | Very low | 70.8 | Confident | 191 Ų | 191 | 155.9 Ų | 155.9 | 89% | 0.893 | 75% | 0.748 | S | S | * | * | trans | -7.9 | 131.4 | 176.8 | -66 | 174.5 | 148 | 0 | 0 | 120.8 | ||||
| 187 | L | 35.6 | Very low | 69.2 | Low | 250 Ų | 250 | 166.3 Ų | 166.3 | 100% | 1.309 | 79% | 0.793 | S | S | * | * | trans | 22.4 | 0 | 139.8 | -113.7 | 149 | 0 | 0 | 0 | 119.5 |
Retrieved 187 of 187 residues in 355.9 ms
(Link to these results)