| 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 | 43.4 | Very low | 43.4 | Very low | 233 Ų | 233 | 161.1 Ų | 161.1 | 100% | 1.148 | 84% | 0.839 | S | S | * | * | 0 | 118 | 0 | -58.9 | 140.2 | 139.5 | 0 | 0 | 103.3 | |||||
| 2 | D | 39.6 | Very low | 44.1 | Very low | 148 Ų | 148 | 159.3 Ų | 159.3 | 79% | 0.791 | 84% | 0.84 | S | S | * | * | cis | -173 | 131 | 18.9 | 25.9 | -76.8 | 0 | 0 | 0 | 102.6 | ||||
| 3 | G | 47.3 | Very low | 44.7 | Very low | 71 Ų | 71 | 152.3 Ų | 152.3 | 73% | 0.732 | 83% | 0.83 | S | S | * | * | 81.6 | 83.4 | 66.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 4 | S | 46.9 | Very low | 45.3 | Very low | 129 Ų | 129 | 148.1 Ų | 148.1 | 90% | 0.902 | 83% | 0.825 | S | S | * | * | trans | -148 | 96.7 | 156.8 | -81.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 5 | L | 40.6 | Very low | 45.3 | Very low | 172 Ų | 172 | 144 Ų | 144 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | trans | -60.8 | 137.3 | 176.8 | -164.2 | 71.2 | 0 | 0 | 0 | 111.4 | ||||
| 6 | S | 45.1 | Very low | 45.9 | Very low | 109 Ų | 109 | 143.3 Ų | 143.3 | 76% | 0.762 | 82% | 0.817 | S | S | * | * | trans | -42.9 | 131.7 | 164.4 | 171.5 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 7 | R | 39.9 | Very low | 46 | Very low | 240 Ų | 240 | 146.2 Ų | 146.2 | 91% | 0.906 | 82% | 0.819 | S | S | * | * | trans | -97 | 96.7 | 169.2 | -166.9 | 155.7 | 76.6 | -166.5 | 5.9 | 109.2 | ||||
| 8 | A | 48.6 | Very low | 46.5 | Very low | 62 Ų | 62 | 143.1 Ų | 143.1 | 51% | 0.512 | 81% | 0.814 | S | S | . | * | trans | 18.6 | 113.2 | 144.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | Y10 | A8-Y10 HydrophobicContact CB-CD1 4.26Š| ||
| 9 | D | 42.9 | Very low | 46.9 | Very low | 164 Ų | 164 | 137.8 Ų | 137.8 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | -119.6 | 107.2 | 136 | -84 | -38.7 | 0 | 0 | 0 | 108.4 | R11 | D9-R11 PolarHBondContact O-N 3.44Š| ||
| 10 | Y | 42.5 | Very low | 47.2 | Very low | 187 Ų | 187 | 141 Ų | 141 | 73% | 0.733 | 80% | 0.798 | S | S | * | * | trans | -82.5 | 102.1 | -178.7 | 42.1 | -82 | 0 | 0 | 0 | 108.7 | A8 V12 | A8-Y10 HydrophobicContact CB-CD1 4.26Å; Y10-V12 PolarHBondContact O-N 3.41Å | ||
| 11 | R | 41 | Very low | 47.8 | Very low | 257 Ų | 257 | 138 Ų | 138 | 97% | 0.97 | 80% | 0.798 | S | S | * | * | trans | -88.7 | 90.6 | 155.3 | -90.2 | -170.1 | -173.1 | -143.6 | 3.2 | 108.5 | D9 | D9-R11 PolarHBondContact O-N 3.44Š| ||
| 12 | V | 51.7 | Low | 48.6 | Very low | 140 Ų | 140 | 133.2 Ų | 133.2 | 85% | 0.848 | 78% | 0.777 | S | S | * | * | trans | -71.7 | 122.8 | 165.8 | 166.8 | 0 | 0 | 0 | 0 | 108.5 | Y10 | Y10-V12 PolarHBondContact O-N 3.41Š| ||
| 13 | G | 51.3 | Low | 49.8 | Very low | 68 Ų | 68 | 131.3 Ų | 131.3 | 70% | 0.701 | 77% | 0.772 | S | S | * | * | S | Bend | trans | 147.1 | 98.5 | 164 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 14 | A | 53.8 | Low | 51 | Low | 93 Ų | 93 | 133.8 Ų | 133.8 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | 69.4 | 61.4 | 173 | 0 | 0 | 0 | 0 | 0 | 115.6 | V16 | A14-V16 PolarHBondContact O-N 2.87Š| ||
| 15 | A | 45.3 | Very low | 52.1 | Low | 87 Ų | 87 | 132.5 Ų | 132.5 | 72% | 0.719 | 76% | 0.758 | S | S | * | * | trans | -62.9 | 90.5 | 148.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | F17 | A15-F17 PolarHBondContact O-N 2.71Š| ||
| 16 | V | 54.8 | Low | 53.8 | Low | 132 Ų | 132 | 127.6 Ų | 127.6 | 80% | 0.8 | 74% | 0.737 | S | S | * | * | trans | -51.1 | 111.9 | 150.3 | -132 | 0 | 0 | 0 | 0 | 103.9 | A14 A18 | A14-V16 PolarHBondContact O-N 2.87Å; V16-A18 PolarHBondContact O-N 2.87Å | ||
| 17 | F | 47.8 | Very low | 55 | Low | 194 Ų | 194 | 131.9 Ų | 131.9 | 85% | 0.851 | 74% | 0.741 | S | S | * | * | trans | -63.2 | 82.5 | 167.1 | -79.3 | -90.3 | 0 | 0 | 0 | 106.6 | A15 A19 | A15-F17 PolarHBondContact O-N 2.71Å; F17-A19 PolarHBondContact O-N 2.94Å | ||
| 18 | A | 54.5 | Low | 56.5 | Low | 89 Ų | 89 | 124.7 Ų | 124.7 | 74% | 0.736 | 73% | 0.728 | S | S | * | * | trans | -72.4 | 73.3 | 152.7 | 0 | 0 | 0 | 0 | 0 | 105.1 | V16 E20 | V16-A18 PolarHBondContact O-N 2.87Å; A18-E20 PolarHBondContact O-N 3.06Å | ||
| 19 | A | 54.4 | Low | 57.2 | Low | 43 Ų | 43 | 125.7 Ų | 125.7 | 36% | 0.355 | 72% | 0.724 | S | S | . | * | trans | -68.4 | 86.8 | 168.1 | 0 | 0 | 0 | 0 | 0 | 106 | F17 G21 L22 | F17-A19 PolarHBondContact O-N 2.94Å; A19-G21 PolarHBondContact O-N 3.04Å; A19-L22 HydrophobicContact CB-CD1 3.77Å; A19-L22 HydrophobicContact CB-CG 4.06Å; A19-L22 PolarHBondContact O-N 2.92Å | ||
| 20 | E | 53.5 | Low | 58.5 | Low | 201 Ų | 201 | 120.5 Ų | 120.5 | 94% | 0.939 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.8 | 100.2 | 172.8 | -134.8 | 158.9 | 176.5 | 0 | 0 | 107.5 | A18 | A18-E20 PolarHBondContact O-N 3.06Š|
| 21 | G | 60.1 | Low | 59.5 | Low | 79 Ų | 79 | 113.6 Ų | 113.6 | 81% | 0.814 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 132 | -10.2 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | A19 | A19-G21 PolarHBondContact O-N 3.04Š|
| 22 | L | 59.7 | Low | 60.8 | Low | 132 Ų | 132 | 107 Ų | 107 | 69% | 0.691 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -93 | 140.1 | 171.5 | -66.3 | 179.6 | 0 | 0 | 0 | 111.2 | A19 | A19-L22 HydrophobicContact CB-CD1 3.77Å; A19-L22 HydrophobicContact CB-CG 4.06Å; A19-L22 PolarHBondContact O-N 2.92Å |
| 23 | P | 64.5 | Low | 61.5 | Low | 108 Ų | 108 | 106.5 Ų | 106.5 | 70% | 0.701 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 140.4 | 176.6 | 25.3 | -33.3 | 0 | 0 | 0 | 109.7 | L25 | P23-L25 PolarHBondContact O-N 2.66Š|
| 24 | P | 71.4 | Confident | 62 | Low | 123 Ų | 123 | 110 Ų | 110 | 80% | 0.799 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 137.7 | -179.5 | 24.7 | -33.8 | 0 | 0 | 0 | 109.5 | ||
| 25 | L | 71 | Confident | 62.1 | Low | 103 Ų | 103 | 109.6 Ų | 109.6 | 54% | 0.539 | 66% | 0.655 | S | S | . | * | P | Polyproline II helix | trans | -50.6 | 137.4 | 179.2 | -104.8 | 83.5 | 0 | 0 | 0 | 110 | P23 K27 L29 L33 | P23-L25 PolarHBondContact O-N 2.66Å; L25-K27 PolarHBondContact O-N 3.33Å; L25-L29 HydrophobicContact CD2-CB 4.5Å; L25-L33 HydrophobicContact CD2-CD1 3.66Å |
| 26 | P | 75.9 | Confident | 62.7 | Low | 69 Ų | 69 | 111 Ų | 111 | 45% | 0.448 | 66% | 0.66 | S | S | . | * | P | Polyproline II helix | trans | -57.9 | 139.1 | 178.2 | 23.8 | -33 | 0 | 0 | 0 | 110 | S28 L29 S30 | P26-S28 PolarHBondContact O-N 3.02Å; P26-S28 VanDerWaalsContact O-N 3.08Å; P26-L29 HydrophobicContact CG-CB 4.22Å; P26-L29 HydrophobicContact CG-CD1 3.68Å; P26-L29 HydrophobicContact CG-CG 3.89Å; P26-L29 PolarHBondContact O-N 3.38Å; P26-S30 PolarHBondContact O-N 3.4Å |
| 27 | K | 70.6 | Confident | 62.7 | Low | 198 Ų | 198 | 107.6 Ų | 107.6 | 86% | 0.861 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -56.3 | -28.8 | -175.9 | -64.6 | 166.6 | -177.5 | 162.9 | 0 | 112.6 | L25 L29 | L25-K27 PolarHBondContact O-N 3.33Å; K27-L29 VanDerWaalsContact C-N 3.26Å; K27-L29 PolarHBondContact O-N 3.19Å |
| 28 | S | 71.6 | Confident | 63.2 | Low | 90 Ų | 90 | 99.7 Ų | 99.7 | 63% | 0.629 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -61.5 | -31.3 | 174 | 54.1 | 0 | 0 | 0 | 0 | 113.2 | P26 | P26-S28 PolarHBondContact O-N 3.02Å; P26-S28 VanDerWaalsContact O-N 3.08Å |
| 29 | L | 62.4 | Low | 63.8 | Low | 82 Ų | 82 | 99.7 Ų | 99.7 | 43% | 0.429 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -99.3 | -25.5 | -178.8 | -58.5 | -176.2 | 0 | 0 | 0 | 112.5 | L25 P26 K27 G31 I32 L33 | L25-L29 HydrophobicContact CD2-CB 4.5Å; P26-L29 HydrophobicContact CG-CB 4.22Å; P26-L29 HydrophobicContact CG-CD1 3.68Å; P26-L29 HydrophobicContact CG-CG 3.89Å; P26-L29 PolarHBondContact O-N 3.38Å; K27-L29 VanDerWaalsContact C-N 3.26Å; K27-L29 PolarHBondContact O-N 3.19Å; L29-G31 VanDerWaalsContact C-N 3.28Å; L29-G31 PolarHBondContact O-N 3.27Å; L29-I32 HydrophobicContact CD2-CD1 4.02Å; L29-I32 PolarHBondContact O-N 3.44Å; L29-I32 VanDerWaalsContact O-N 3.13Å; L29-L33 PolarHBondContact O-N 3.22Å |
| 30 | S | 69.9 | Low | 63.8 | Low | 55 Ų | 55 | 107.2 Ų | 107.2 | 39% | 0.385 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -59 | -38.7 | 176.9 | -166.3 | 0 | 0 | 0 | 0 | 112.2 | P26 I32 N34 | P26-S30 PolarHBondContact O-N 3.4Å; S30-I32 VanDerWaalsContact C-N 3.34Å; S30-I32 PolarHBondContact O-N 2.93Å; S30-N34 WeakPolarHBondContact O-CB 3.19Å; S30-N34 PolarHBondContact O-N 3.13Å |
| 31 | G | 64.5 | Low | 64.7 | Low | 42 Ų | 42 | 106.1 Ų | 106.1 | 43% | 0.433 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -67.3 | -30.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | L29 S35 | L29-G31 VanDerWaalsContact C-N 3.28Å; L29-G31 PolarHBondContact O-N 3.27Å; G31-S35 WeakPolarHBondContact O-CB 3.11Å; G31-S35 PolarHBondContact O-N 3.35Å; G31-S35 PolarHBondContact O-OG 3.06Å |
| 32 | I | 68.1 | Low | 65.1 | Low | 118 Ų | 118 | 106.9 Ų | 106.9 | 61% | 0.605 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -76.9 | -39.5 | -176.8 | -54.8 | 176.6 | 0 | 0 | 0 | 110.7 | L29 S30 | L29-I32 HydrophobicContact CD2-CD1 4.02Å; L29-I32 PolarHBondContact O-N 3.44Å; L29-I32 VanDerWaalsContact O-N 3.13Å; S30-I32 VanDerWaalsContact C-N 3.34Å; S30-I32 PolarHBondContact O-N 2.93Å |
| 33 | L | 65.3 | Low | 65.5 | Low | 131 Ų | 131 | 104.6 Ų | 104.6 | 69% | 0.686 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -88.2 | -32.6 | -175.6 | -62.3 | 174.1 | 0 | 0 | 0 | 112.5 | L25 L29 | L25-L33 HydrophobicContact CD2-CD1 3.66Å; L29-L33 PolarHBondContact O-N 3.22Å |
| 34 | N | 63.1 | Low | 65.6 | Low | 142 Ų | 142 | 105.3 Ų | 105.3 | 76% | 0.759 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -90.4 | -17.9 | -176.9 | -142.5 | 33.4 | 0 | 0 | 0 | 113 | S30 S36 | S30-N34 WeakPolarHBondContact O-CB 3.19Å; S30-N34 PolarHBondContact O-N 3.13Å; N34-S36 PolarHBondContact O-N 3.4Å |
| 35 | S | 55 | Low | 65.7 | Low | 83 Ų | 83 | 105.8 Ų | 105.8 | 58% | 0.58 | 58% | 0.582 | S | S | * | * | S | Bend | trans | -85.1 | 96.4 | 165.8 | -67.6 | 0 | 0 | 0 | 0 | 109.6 | G31 G37 | G31-S35 WeakPolarHBondContact O-CB 3.11Å; G31-S35 PolarHBondContact O-N 3.35Å; G31-S35 PolarHBondContact O-OG 3.06Å; S35-G37 PolarHBondContact O-N 3.08Å |
| 36 | S | 57.6 | Low | 65.5 | Low | 118 Ų | 118 | 105.9 Ų | 105.9 | 83% | 0.825 | 58% | 0.58 | S | S | * | * | trans | -28.9 | 103.3 | 164.8 | -80.1 | 0 | 0 | 0 | 0 | 113.4 | N34 G38 | N34-S36 PolarHBondContact O-N 3.4Å; S36-G38 PolarHBondContact O-N 2.85Å | ||
| 37 | G | 56.5 | Low | 65.1 | Low | 59 Ų | 59 | 108.4 Ų | 108.4 | 61% | 0.608 | 59% | 0.586 | S | S | * | * | S | Bend | trans | 39.3 | 21.4 | 142.6 | 0 | 0 | 0 | 0 | 0 | 121.2 | S35 R41 | S35-G37 PolarHBondContact O-N 3.08Å; G37-R41 WeakPolarHBondContact O-CG 3.45Å |
| 38 | G | 57.8 | Low | 64.8 | Low | 28 Ų | 28 | 102.6 Ų | 102.6 | 29% | 0.289 | 57% | 0.57 | S | S | . | * | trans | -92.8 | -46.8 | -168.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | S36 W40 R41 D42 | S36-G38 PolarHBondContact O-N 2.85Å; G38-W40 PolarHBondContact O-N 3.35Å; G38-R41 PolarHBondContact O-N 3.09Å; G38-R41 VanDerWaalsContact O-N 3.09Å; G38-D42 WeakPolarHBondContact O-CB 3.48Å; G38-D42 VanDerWaalsContact O-CG 3.27Å; G38-D42 PolarHBondContact O-N 3.28Å; G38-D42 VanDerWaalsContact O-OD2 3.09Å | ||
| 39 | S | 65.9 | Low | 64.4 | Low | 90 Ų | 90 | 104.4 Ų | 104.4 | 63% | 0.629 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -57.9 | -45.3 | -173.3 | 180 | 0 | 0 | 0 | 0 | 113.3 | M43 | S39-M43 WeakPolarHBondContact O-CB 3.5Å; S39-M43 PolarHBondContact O-N 3.29Å |
| 40 | W | 56.1 | Low | 64.4 | Low | 201 Ų | 201 | 108.6 Ų | 108.6 | 76% | 0.761 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -69.4 | -36.1 | 177.5 | -90.2 | 100 | 0 | 0 | 0 | 113.4 | G38 M43 Q44 | G38-W40 PolarHBondContact O-N 3.35Å; W40-M43 HydrophobicContact CE3-SD 4.41Å; W40-M43 HydrophobicContact CZ3-SD 4.35Å; W40-Q44 WeakPolarHBondContact O-CB 3.37Å; W40-Q44 PolarHBondContact O-N 2.87Å |
| 41 | R | 71.4 | Confident | 64 | Low | 177 Ų | 177 | 109.2 Ų | 109.2 | 67% | 0.668 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -73.8 | -35.3 | 177.1 | -68 | -159.5 | -171 | -74.8 | 3.6 | 112 | G37 G38 Q44 K45 | G37-R41 WeakPolarHBondContact O-CG 3.45Å; G38-R41 PolarHBondContact O-N 3.09Å; G38-R41 VanDerWaalsContact O-N 3.09Å; R41-Q44 WeakPolarHBondContact O-CB 3.39Å; R41-Q44 PolarHBondContact O-N 2.91Å; R41-K45 WeakPolarHBondContact O-CB 3.34Å; R41-K45 PolarHBondContact O-N 2.81Å |
| 42 | D | 69.4 | Low | 63.9 | Low | 96 Ų | 96 | 116.8 Ų | 116.8 | 51% | 0.513 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -69.3 | -38.7 | 173.7 | -69.9 | -38.2 | 0 | 0 | 0 | 111.3 | G38 K45 M46 | G38-D42 WeakPolarHBondContact O-CB 3.48Å; G38-D42 VanDerWaalsContact O-CG 3.27Å; G38-D42 PolarHBondContact O-N 3.28Å; G38-D42 VanDerWaalsContact O-OD2 3.09Å; D42-K45 PolarHBondContact O-N 2.8Å; D42-M46 WeakPolarHBondContact O-CB 3.36Å; D42-M46 WeakPolarHBondContact O-CG 3.21Å; D42-M46 PolarHBondContact O-N 2.87Å |
| 43 | M | 66.8 | Low | 63.6 | Low | 84 Ų | 84 | 115.4 Ų | 115.4 | 41% | 0.414 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -61.5 | -43.1 | 170.3 | -169.8 | -178.9 | -56.1 | 0 | 0 | 111.2 | S39 W40 M46 H47 | S39-M43 WeakPolarHBondContact O-CB 3.5Å; S39-M43 PolarHBondContact O-N 3.29Å; W40-M43 HydrophobicContact CE3-SD 4.41Å; W40-M43 HydrophobicContact CZ3-SD 4.35Å; M43-M46 PolarHBondContact O-N 2.83Å; M43-H47 WeakPolarHBondContact O-CB 3.46Å; M43-H47 PolarHBondContact O-CD2 3.16Å; M43-H47 PolarHBondContact O-N 3.31Å |
| 44 | Q | 66.9 | Low | 63.5 | Low | 123 Ų | 123 | 115.7 Ų | 115.7 | 58% | 0.575 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -63.4 | -41.3 | 174.3 | -172.2 | 177.6 | -8.1 | 0 | 0 | 111.9 | W40 R41 H47 S48 | W40-Q44 WeakPolarHBondContact O-CB 3.37Å; W40-Q44 PolarHBondContact O-N 2.87Å; R41-Q44 WeakPolarHBondContact O-CB 3.39Å; R41-Q44 PolarHBondContact O-N 2.91Å; Q44-H47 CarbonylContact O-C 3.59Å; Q44-H47 WeakPolarHBondContact O-CB 3.36Å; Q44-H47 PolarHBondContact O-N 3.06Å; Q44-S48 PolarHBondContact O-N 3.25Å; Q44-S48 PolarHBondContact O-OG 3.13Å; Q44-S48 VanDerWaalsContact O-OG 3.06Å |
| 45 | K | 74.8 | Confident | 63.5 | Low | 132 Ų | 132 | 111.3 Ų | 111.3 | 57% | 0.574 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -68.7 | -36.7 | 178.1 | -151.2 | 173.9 | -169.8 | 178.6 | 0 | 112 | R41 D42 K49 | R41-K45 WeakPolarHBondContact O-CB 3.34Å; R41-K45 PolarHBondContact O-N 2.81Å; D42-K45 PolarHBondContact O-N 2.8Å; K45-K49 WeakPolarHBondContact O-CG 3.43Å; K45-K49 PolarHBondContact O-N 3.46Å; K45-K49 VanDerWaalsContact O-N 3.13Å |
| 46 | M | 66.2 | Low | 63.7 | Low | 105 Ų | 105 | 112.3 Ų | 112.3 | 52% | 0.517 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.1 | -40.6 | 169.7 | -83.9 | -71.6 | 167.1 | 0 | 0 | 111.6 | D42 M43 K49 R50 | D42-M46 WeakPolarHBondContact O-CB 3.36Å; D42-M46 WeakPolarHBondContact O-CG 3.21Å; D42-M46 PolarHBondContact O-N 2.87Å; M43-M46 PolarHBondContact O-N 2.83Å; M46-K49 PolarHBondContact O-N 2.8Å; M46-R50 WeakPolarHBondContact O-CB 3.32Å; M46-R50 WeakPolarHBondContact O-CG 3.39Å; M46-R50 PolarHBondContact O-N 3.33Å |
| 47 | H | 66.2 | Low | 63.8 | Low | 123 Ų | 123 | 112 Ų | 112 | 57% | 0.569 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.1 | -41.6 | 173.4 | -99.9 | -90.5 | 0 | 0 | 0 | 112 | M43 Q44 K49 R50 S51 | M43-H47 WeakPolarHBondContact O-CB 3.46Å; M43-H47 PolarHBondContact O-CD2 3.16Å; M43-H47 PolarHBondContact O-N 3.31Å; Q44-H47 CarbonylContact O-C 3.59Å; Q44-H47 WeakPolarHBondContact O-CB 3.36Å; Q44-H47 PolarHBondContact O-N 3.06Å; H47-K49 VanDerWaalsContact C-N 3.34Å; H47-K49 PolarHBondContact O-N 2.79Å; H47-R50 PolarHBondContact O-N 3.4Å; H47-S51 WeakPolarHBondContact O-CA 3.49Å; H47-S51 WeakPolarHBondContact O-CB 3.08Å; H47-S51 PolarHBondContact O-N 3.37Å |
| 48 | S | 65.2 | Low | 63.9 | Low | 75 Ų | 75 | 113.6 Ų | 113.6 | 52% | 0.524 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.3 | -39.4 | 174.8 | -57.2 | 0 | 0 | 0 | 0 | 112.2 | Q44 R52 | Q44-S48 PolarHBondContact O-N 3.25Å; Q44-S48 PolarHBondContact O-OG 3.13Å; Q44-S48 VanDerWaalsContact O-OG 3.06Å; S48-R52 PolarHBondContact O-N 2.87Å |
| 49 | K | 62.8 | Low | 63.7 | Low | 128 Ų | 128 | 115.8 Ų | 115.8 | 56% | 0.557 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -70.2 | -41.8 | 176.3 | -72 | 173.1 | -179.5 | 178.1 | 0 | 112.4 | K45 M46 H47 S51 | K45-K49 WeakPolarHBondContact O-CG 3.43Å; K45-K49 PolarHBondContact O-N 3.46Å; K45-K49 VanDerWaalsContact O-N 3.13Å; M46-K49 PolarHBondContact O-N 2.8Å; H47-K49 VanDerWaalsContact C-N 3.34Å; H47-K49 PolarHBondContact O-N 2.79Å; K49-S51 VanDerWaalsContact C-N 3.34Å |
| 50 | R | 63.4 | Low | 62.9 | Low | 170 Ų | 170 | 119.7 Ų | 119.7 | 64% | 0.642 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -68.1 | -32.1 | 173.5 | -76.1 | -173.1 | -160.9 | -169.5 | 5.7 | 112.3 | M46 H47 I53 Q54 | M46-R50 WeakPolarHBondContact O-CB 3.32Å; M46-R50 WeakPolarHBondContact O-CG 3.39Å; M46-R50 PolarHBondContact O-N 3.33Å; H47-R50 PolarHBondContact O-N 3.4Å; R50-I53 PolarHBondContact O-N 3.03Å; R50-Q54 WeakPolarHBondContact O-CB 3.35Å; R50-Q54 PolarHBondContact O-N 3.39Å |
| 51 | S | 61.9 | Low | 62.7 | Low | 68 Ų | 68 | 113.1 Ų | 113.1 | 48% | 0.476 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.4 | -39 | -178.9 | 176.4 | 0 | 0 | 0 | 0 | 112.1 | H47 K49 I53 Q54 A55 | H47-S51 WeakPolarHBondContact O-CA 3.49Å; H47-S51 WeakPolarHBondContact O-CB 3.08Å; H47-S51 PolarHBondContact O-N 3.37Å; K49-S51 VanDerWaalsContact C-N 3.34Å; S51-I53 VanDerWaalsContact C-N 3.33Å; S51-I53 PolarHBondContact O-N 3.28Å; S51-Q54 PolarHBondContact O-N 3.43Å; S51-A55 VanDerWaalsContact O-CB 3.23Å; S51-A55 WeakPolarHBondContact O-CB 3.47Å; S51-A55 PolarHBondContact O-N 3.05Å |
| 52 | R | 61.8 | Low | 61.8 | Low | 202 Ų | 202 | 106.6 Ų | 106.6 | 76% | 0.762 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64.4 | -42.1 | 175.3 | -156.9 | 179.1 | -159.4 | -171.5 | 4.9 | 111.4 | S48 E56 | S48-R52 PolarHBondContact O-N 2.87Å; R52-E56 PolarHBondContact O-N 3.42Å; R52-E56 VanDerWaalsContact O-N 3.1Å |
| 53 | I | 61.8 | Low | 60.8 | Low | 88 Ų | 88 | 111 Ų | 111 | 45% | 0.451 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -70 | -47.2 | 178 | -61.1 | 167.1 | 0 | 0 | 0 | 110.2 | R50 S51 A55 E56 I57 | R50-I53 PolarHBondContact O-N 3.03Å; S51-I53 VanDerWaalsContact C-N 3.33Å; S51-I53 PolarHBondContact O-N 3.28Å; I53-A55 VanDerWaalsContact C-N 3.31Å; I53-A55 PolarHBondContact O-N 3.13Å; I53-E56 VanDerWaalsContact CA-OE1 3.28Å; I53-E56 WeakPolarHBondContact CA-OE1 3.22Å; I53-E56 WeakPolarHBondContact CB-OE1 3.43Å; I53-E56 WeakPolarHBondContact CG1-OE1 3.16Å; I53-E56 WeakPolarHBondContact CG2-OE1 3.4Å; I53-E56 WeakPolarHBondContact O-CA 3.2Å; I53-E56 VanDerWaalsContact O-CG 3.23Å; I53-E56 WeakPolarHBondContact O-CG 3.45Å; I53-E56 PolarHBondContact O-N 3.16Å; I53-I57 HydrophobicContact CG2-CD1 4.05Å; I53-I57 HydrophobicContact CG2-CG1 4.26Å; I53-I57 WeakPolarHBondContact O-CG1 3.48Å; I53-I57 PolarHBondContact O-N 3.1Å |
| 54 | Q | 63.7 | Low | 59.9 | Low | 137 Ų | 137 | 114.6 Ų | 114.6 | 64% | 0.64 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -61 | -37.4 | 177.7 | -166.5 | 176.8 | 24.4 | 0 | 0 | 113.2 | R50 S51 E56 S58 | R50-Q54 WeakPolarHBondContact O-CB 3.35Å; R50-Q54 PolarHBondContact O-N 3.39Å; S51-Q54 PolarHBondContact O-N 3.43Å; Q54-E56 VanDerWaalsContact C-N 3.35Å; Q54-S58 WeakPolarHBondContact O-CB 3.41Å; Q54-S58 PolarHBondContact O-N 3.1Å |
| 55 | A | 61.6 | Low | 59.1 | Low | 51 Ų | 51 | 112 Ų | 112 | 42% | 0.421 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.4 | -37.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | S51 I53 C59 | S51-A55 VanDerWaalsContact O-CB 3.23Å; S51-A55 WeakPolarHBondContact O-CB 3.47Å; S51-A55 PolarHBondContact O-N 3.05Å; I53-A55 VanDerWaalsContact C-N 3.31Å; I53-A55 PolarHBondContact O-N 3.13Å; A55-C59 VanDerWaalsContact O-CB 3.23Å; A55-C59 WeakPolarHBondContact O-CB 3.49Å; A55-C59 PolarHBondContact O-N 3.39Å; A55-C59 PolarHBondContact O-SG 2.74Å |
| 56 | E | 59.7 | Low | 57.9 | Low | 104 Ų | 104 | 109.5 Ų | 109.5 | 49% | 0.486 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -71.9 | -34.1 | 178.5 | 94.2 | -150.6 | 159.3 | 0 | 0 | 112.9 | R52 I53 Q54 R60 | R52-E56 PolarHBondContact O-N 3.42Å; R52-E56 VanDerWaalsContact O-N 3.1Å; I53-E56 VanDerWaalsContact CA-OE1 3.28Å; I53-E56 WeakPolarHBondContact CA-OE1 3.22Å; I53-E56 WeakPolarHBondContact CB-OE1 3.43Å; I53-E56 WeakPolarHBondContact CG1-OE1 3.16Å; I53-E56 WeakPolarHBondContact CG2-OE1 3.4Å; I53-E56 WeakPolarHBondContact O-CA 3.2Å; I53-E56 VanDerWaalsContact O-CG 3.23Å; I53-E56 WeakPolarHBondContact O-CG 3.45Å; I53-E56 PolarHBondContact O-N 3.16Å; Q54-E56 VanDerWaalsContact C-N 3.35Å; E56-R60 VanDerWaalsContact O-CB 3.29Å; E56-R60 WeakPolarHBondContact O-CB 3.31Å; E56-R60 PolarHBondContact O-N 3.42Å |
| 57 | I | 59.8 | Low | 57.1 | Low | 111 Ų | 111 | 109 Ų | 109 | 57% | 0.569 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -72.3 | -41.9 | 173 | -39 | 150.8 | 0 | 0 | 0 | 110.8 | I53 C59 R60 G61 | I53-I57 HydrophobicContact CG2-CD1 4.05Å; I53-I57 HydrophobicContact CG2-CG1 4.26Å; I53-I57 WeakPolarHBondContact O-CG1 3.48Å; I53-I57 PolarHBondContact O-N 3.1Å; I57-C59 VanDerWaalsContact C-N 3.35Å; I57-R60 PolarHBondContact O-N 3.26Å; I57-G61 PolarHBondContact O-N 3.5Å |
| 58 | S | 59.6 | Low | 56.4 | Low | 93 Ų | 93 | 106.8 Ų | 106.8 | 65% | 0.65 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -63.1 | -40.6 | 176.6 | -172.1 | 0 | 0 | 0 | 0 | 111.4 | Q54 G62 | Q54-S58 WeakPolarHBondContact O-CB 3.41Å; Q54-S58 PolarHBondContact O-N 3.1Å; S58-G62 PolarHBondContact O-N 3.08Å |
| 59 | C | 52.6 | Low | 55.9 | Low | 74 Ų | 74 | 112.6 Ų | 112.6 | 50% | 0.5 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -76.4 | -34.1 | 175.4 | -67.1 | 0 | 0 | 0 | 0 | 113.3 | A55 I57 G62 R63 | A55-C59 VanDerWaalsContact O-CB 3.23Å; A55-C59 WeakPolarHBondContact O-CB 3.49Å; A55-C59 PolarHBondContact O-N 3.39Å; A55-C59 PolarHBondContact O-SG 2.74Å; I57-C59 VanDerWaalsContact C-N 3.35Å; C59-G62 CarbonylContact O-C 3.53Å; C59-G62 PolarHBondContact O-N 3.34Å; C59-R63 WeakPolarHBondContact O-CB 3.23Å; C59-R63 WeakPolarHBondContact O-CG 3.29Å; C59-R63 PolarHBondContact O-N 2.75Å |
| 60 | R | 49.1 | Very low | 55.2 | Low | 171 Ų | 171 | 112.6 Ų | 112.6 | 65% | 0.645 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -68.4 | -36.3 | 175.7 | -102.3 | -178.4 | 162.4 | -87.5 | 3.6 | 112.5 | E56 I57 G62 R63 | E56-R60 VanDerWaalsContact O-CB 3.29Å; E56-R60 WeakPolarHBondContact O-CB 3.31Å; E56-R60 PolarHBondContact O-N 3.42Å; I57-R60 PolarHBondContact O-N 3.26Å; R60-G62 PolarHBondContact O-N 3.28Å; R60-R63 PolarHBondContact O-N 3.19Å |
| 61 | G | 51.3 | Low | 54.9 | Low | 64 Ų | 64 | 108.3 Ų | 108.3 | 66% | 0.66 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -64 | -23.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | I57 | I57-G61 PolarHBondContact O-N 3.5Å |
| 62 | G | 54.1 | Low | 55.5 | Low | 39 Ų | 39 | 107.2 Ų | 107.2 | 40% | 0.402 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -96.1 | -20.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | S58 C59 R60 A65 A66 | S58-G62 PolarHBondContact O-N 3.08Å; C59-G62 CarbonylContact O-C 3.53Å; C59-G62 PolarHBondContact O-N 3.34Å; R60-G62 PolarHBondContact O-N 3.28Å; G62-A65 PolarHBondContact O-N 2.87Å; G62-A66 PolarHBondContact O-N 3.12Å; G62-A66 VanDerWaalsContact O-N 3.08Å |
| 63 | R | 48.6 | Very low | 56.9 | Low | 190 Ų | 190 | 104.5 Ų | 104.5 | 72% | 0.717 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -81.8 | -23.7 | -176.9 | -78.8 | 174.1 | 79.7 | -173.6 | 5 | 113.7 | C59 R60 A66 | C59-R63 WeakPolarHBondContact O-CB 3.23Å; C59-R63 WeakPolarHBondContact O-CG 3.29Å; C59-R63 PolarHBondContact O-N 2.75Å; R60-R63 PolarHBondContact O-N 3.19Å; R63-A66 PolarHBondContact O-N 3.21Å |
| 64 | E | 47.3 | Very low | 58.4 | Low | 159 Ų | 159 | 102.8 Ų | 102.8 | 74% | 0.743 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -81.9 | -19.7 | 169 | -57.5 | -149.2 | -178.4 | 0 | 0 | 112.5 | ||
| 65 | A | 49.8 | Very low | 59.7 | Low | 68 Ų | 68 | 99.1 Ų | 99.1 | 56% | 0.562 | 63% | 0.628 | S | S | * | * | G | 310 helix | trans | -82.4 | -12.8 | 167.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | G62 A67 | G62-A65 PolarHBondContact O-N 2.87Å; A65-A67 VanDerWaalsContact C-N 3.25Å; A65-A67 PolarHBondContact O-N 2.88Å |
| 66 | A | 49.3 | Very low | 61.1 | Low | 79 Ų | 79 | 99.5 Ų | 99.5 | 65% | 0.653 | 63% | 0.632 | S | S | * | * | G | 310 helix | trans | -78.2 | -6 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | G62 R63 | G62-A66 PolarHBondContact O-N 3.12Å; G62-A66 VanDerWaalsContact O-N 3.08Å; R63-A66 PolarHBondContact O-N 3.21Å |
| 67 | A | 50 | Low | 62.8 | Low | 96 Ų | 96 | 97.6 Ų | 97.6 | 79% | 0.793 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -86.3 | -2.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | A65 | A65-A67 VanDerWaalsContact C-N 3.25Å; A65-A67 PolarHBondContact O-N 2.88Å |
| 68 | A | 50.9 | Low | 64.5 | Low | 75 Ų | 75 | 94.9 Ų | 94.9 | 62% | 0.62 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -122.1 | 84.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 69 | K | 55.3 | Low | 66.1 | Low | 197 Ų | 197 | 95.5 Ų | 95.5 | 86% | 0.857 | 61% | 0.614 | S | S | * | * | trans | 56.6 | 131.8 | 173.1 | -96.1 | 94.3 | 168.7 | -179.1 | 0 | 116.6 | ||||
| 70 | P | 46.8 | Very low | 68.2 | Low | 128 Ų | 128 | 97 Ų | 97 | 83% | 0.831 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -71.5 | 133.6 | 172.1 | 30.8 | -31.3 | 0 | 0 | 0 | 110.8 | G72 | P70-G72 PolarHBondContact O-N 3.45Š|
| 71 | G | 57.7 | Low | 70.5 | Confident | 81 Ų | 81 | 96.8 Ų | 96.8 | 84% | 0.835 | 62% | 0.616 | S | S | * | * | trans | 73.6 | 35.1 | 141.9 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 72 | G | 75.6 | Confident | 72.7 | Confident | 45 Ų | 45 | 100.8 Ų | 100.8 | 46% | 0.464 | 62% | 0.615 | S | S | . | * | trans | -71.5 | 138.6 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112 | P70 G74 A75 A76 | P70-G72 PolarHBondContact O-N 3.45Å; G72-G74 PolarHBondContact O-N 3.31Å; G72-A75 WeakPolarHBondContact O-CB 3.35Å; G72-A75 PolarHBondContact O-N 2.99Å; G72-A76 PolarHBondContact O-N 2.97Å | ||
| 73 | L | 89.9 | Confident | 74.8 | Confident | 144 Ų | 144 | 104.9 Ų | 104.9 | 75% | 0.754 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -42.5 | -38.3 | 171.5 | 175.1 | 66.5 | 0 | 0 | 0 | 112.5 | A75 A76 L77 | L73-A75 PolarHBondContact O-N 3.03Å; L73-A76 PolarHBondContact O-N 3.1Å; L73-L77 WeakPolarHBondContact O-CB 3.33Å; L73-L77 PolarHBondContact O-N 2.9Å |
| 74 | G | 93.2 | Very high | 77.1 | Confident | 53 Ų | 53 | 100 Ų | 100 | 55% | 0.546 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -62.4 | -34.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | G72 A78 | G72-G74 PolarHBondContact O-N 3.31Å; G74-A78 WeakPolarHBondContact O-CB 3.5Å; G74-A78 PolarHBondContact O-N 3.11Å |
| 75 | A | 90.9 | Very high | 79.5 | Confident | 59 Ų | 59 | 96 Ų | 96 | 49% | 0.488 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -72.8 | -43.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.4 | G72 L73 L77 A78 L79 | G72-A75 WeakPolarHBondContact O-CB 3.35Å; G72-A75 PolarHBondContact O-N 2.99Å; L73-A75 PolarHBondContact O-N 3.03Å; A75-L77 VanDerWaalsContact C-N 3.27Å; A75-L77 PolarHBondContact O-N 2.94Å; A75-A78 PolarHBondContact O-N 3.3Å; A75-L79 PolarHBondContact O-N 3.31Å |
| 76 | A | 91.9 | Very high | 81.8 | Confident | 60 Ų | 60 | 94.3 Ų | 94.3 | 50% | 0.496 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -61.1 | -39.5 | 173 | 0 | 0 | 0 | 0 | 0 | 111.4 | G72 L73 L79 L80 | G72-A76 PolarHBondContact O-N 2.97Å; L73-A76 PolarHBondContact O-N 3.1Å; A76-L79 PolarHBondContact O-N 3.28Å; A76-L80 WeakPolarHBondContact O-CB 3.16Å; A76-L80 PolarHBondContact O-N 2.89Å |
| 77 | L | 94.9 | Very high | 84.1 | Confident | 64 Ų | 64 | 95.7 Ų | 95.7 | 34% | 0.335 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71.2 | -34.1 | 178.7 | -164.4 | 146 | 0 | 0 | 0 | 112.2 | L73 A75 R81 | L73-L77 WeakPolarHBondContact O-CB 3.33Å; L73-L77 PolarHBondContact O-N 2.9Å; A75-L77 VanDerWaalsContact C-N 3.27Å; A75-L77 PolarHBondContact O-N 2.94Å; L77-R81 HydrophobicContact CD2-CG 4.43Å; L77-R81 VanDerWaalsContact CD2-NE 3.3Å; L77-R81 VanDerWaalsContact CD2-NH2 3.29Å; L77-R81 WeakPolarHBondContact O-CB 3.19Å; L77-R81 VanDerWaalsContact O-CG 3.29Å; L77-R81 WeakPolarHBondContact O-CG 3.23Å; L77-R81 PolarHBondContact O-N 3.5Å |
| 78 | A | 95.3 | Very high | 86.4 | Confident | 53 Ų | 53 | 98.6 Ų | 98.6 | 44% | 0.438 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.9 | -42.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G74 A75 R81 K82 | G74-A78 WeakPolarHBondContact O-CB 3.5Å; G74-A78 PolarHBondContact O-N 3.11Å; A75-A78 PolarHBondContact O-N 3.3Å; A78-R81 PolarHBondContact O-N 3.08Å; A78-K82 PolarHBondContact O-N 2.85Å; A78-K82 VanDerWaalsContact O-N 3.07Å |
| 79 | L | 93.5 | Very high | 88.7 | Confident | 107 Ų | 107 | 101.2 Ų | 101.2 | 56% | 0.56 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -60.6 | -49.1 | 173.2 | -75.8 | 171.4 | 0 | 0 | 0 | 111.2 | A75 A76 R81 K82 E83 | A75-L79 PolarHBondContact O-N 3.31Å; A76-L79 PolarHBondContact O-N 3.28Å; L79-R81 VanDerWaalsContact C-N 3.32Å; L79-R81 PolarHBondContact O-N 3.37Å; L79-K82 WeakPolarHBondContact O-CB 3.28Å; L79-K82 PolarHBondContact O-N 3.16Å; L79-K82 VanDerWaalsContact O-N 3.08Å; L79-E83 WeakPolarHBondContact O-CG 3.47Å; L79-E83 PolarHBondContact O-N 3.33Å |
| 80 | L | 96.5 | Very high | 90.7 | Very high | 104 Ų | 104 | 96.6 Ų | 96.6 | 55% | 0.545 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -56.9 | -45.5 | 177.8 | 178.7 | 63.1 | 0 | 0 | 0 | 111.7 | A76 K82 E83 M84 | A76-L80 WeakPolarHBondContact O-CB 3.16Å; A76-L80 PolarHBondContact O-N 2.89Å; L80-K82 VanDerWaalsContact C-N 3.29Å; L80-K82 PolarHBondContact O-N 3.47Å; L80-E83 PolarHBondContact O-N 3.37Å; L80-M84 HydrophobicContact CD1-CG 4.06Å; L80-M84 HydrophobicContact CD1-SD 4.24Å; L80-M84 HydrophobicContact CG-CG 4.31Å; L80-M84 HydrophobicContact CG-SD 4.05Å; L80-M84 WeakPolarHBondContact O-CB 3.48Å; L80-M84 VanDerWaalsContact O-CG 3.26Å; L80-M84 WeakPolarHBondContact O-CG 3.39Å; L80-M84 PolarHBondContact O-N 2.82Å |
| 81 | R | 97.5 | Very high | 93.2 | Very high | 168 Ų | 168 | 93.9 Ų | 93.9 | 63% | 0.634 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -58.5 | -42.1 | 176.6 | -77.1 | 172.2 | 175.2 | 156.2 | -1 | 111.9 | L77 A78 L79 V85 | L77-R81 HydrophobicContact CD2-CG 4.43Å; L77-R81 VanDerWaalsContact CD2-NE 3.3Å; L77-R81 VanDerWaalsContact CD2-NH2 3.29Å; L77-R81 WeakPolarHBondContact O-CB 3.19Å; L77-R81 VanDerWaalsContact O-CG 3.29Å; L77-R81 WeakPolarHBondContact O-CG 3.23Å; L77-R81 PolarHBondContact O-N 3.5Å; A78-R81 PolarHBondContact O-N 3.08Å; L79-R81 VanDerWaalsContact C-N 3.32Å; L79-R81 PolarHBondContact O-N 3.37Å; R81-V85 VanDerWaalsContact O-CG2 3.28Å; R81-V85 WeakPolarHBondContact O-CG2 3.37Å; R81-V85 PolarHBondContact O-N 3.37Å; R81-V85 VanDerWaalsContact O-N 3.14Å |
| 82 | K | 97.3 | Very high | 95.1 | Very high | 147 Ų | 147 | 95.4 Ų | 95.4 | 64% | 0.639 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.4 | -49.5 | 177 | -179.4 | -177.5 | 173.4 | -177.2 | 0 | 111.5 | A78 L79 L80 M84 V85 G86 | A78-K82 PolarHBondContact O-N 2.85Å; A78-K82 VanDerWaalsContact O-N 3.07Å; L79-K82 WeakPolarHBondContact O-CB 3.28Å; L79-K82 PolarHBondContact O-N 3.16Å; L79-K82 VanDerWaalsContact O-N 3.08Å; L80-K82 VanDerWaalsContact C-N 3.29Å; L80-K82 PolarHBondContact O-N 3.47Å; K82-M84 PolarHBondContact O-N 3.49Å; K82-V85 PolarHBondContact O-N 3.18Å; K82-G86 PolarHBondContact O-N 2.89Å |
| 83 | E | 97.6 | Very high | 96.2 | Very high | 126 Ų | 126 | 96.3 Ų | 96.3 | 59% | 0.589 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.5 | -42.7 | 180 | -67.1 | -57.7 | 136.8 | 0 | 0 | 111.7 | L79 L80 V85 G86 L87 | L79-E83 WeakPolarHBondContact O-CG 3.47Å; L79-E83 PolarHBondContact O-N 3.33Å; L80-E83 PolarHBondContact O-N 3.37Å; E83-V85 VanDerWaalsContact C-N 3.31Å; E83-V85 PolarHBondContact O-N 3.46Å; E83-G86 PolarHBondContact O-N 3.03Å; E83-G86 VanDerWaalsContact O-N 3.15Å; E83-L87 PolarHBondContact O-N 2.83Å |
| 84 | M | 98.4 | Very high | 96.6 | Very high | 86 Ų | 86 | 93 Ų | 93 | 42% | 0.424 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.1 | -39.1 | 176.4 | -73.9 | -176.8 | 72.6 | 0 | 0 | 112.7 | L80 K82 R88 | L80-M84 HydrophobicContact CD1-CG 4.06Å; L80-M84 HydrophobicContact CD1-SD 4.24Å; L80-M84 HydrophobicContact CG-CG 4.31Å; L80-M84 HydrophobicContact CG-SD 4.05Å; L80-M84 WeakPolarHBondContact O-CB 3.48Å; L80-M84 VanDerWaalsContact O-CG 3.26Å; L80-M84 WeakPolarHBondContact O-CG 3.39Å; L80-M84 PolarHBondContact O-N 2.82Å; K82-M84 PolarHBondContact O-N 3.49Å; M84-R88 WeakPolarHBondContact O-CG 3.46Å; M84-R88 PolarHBondContact O-N 2.93Å |
| 85 | V | 97.9 | Very high | 96.9 | Very high | 75 Ų | 75 | 95.3 Ų | 95.3 | 46% | 0.455 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.8 | -41.4 | 175 | 173.1 | 0 | 0 | 0 | 0 | 110.5 | R81 K82 E83 R88 Q89 | R81-V85 VanDerWaalsContact O-CG2 3.28Å; R81-V85 WeakPolarHBondContact O-CG2 3.37Å; R81-V85 PolarHBondContact O-N 3.37Å; R81-V85 VanDerWaalsContact O-N 3.14Å; K82-V85 PolarHBondContact O-N 3.18Å; E83-V85 VanDerWaalsContact C-N 3.31Å; E83-V85 PolarHBondContact O-N 3.46Å; V85-R88 PolarHBondContact O-N 2.95Å; V85-Q89 WeakPolarHBondContact O-CG 3.45Å; V85-Q89 PolarHBondContact O-N 3.31Å |
| 86 | G | 97.6 | Very high | 97.2 | Very high | 34 Ų | 34 | 96.8 Ų | 96.8 | 35% | 0.351 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.9 | -43.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | K82 E83 R88 Q89 L90 | K82-G86 PolarHBondContact O-N 2.89Å; E83-G86 PolarHBondContact O-N 3.03Å; E83-G86 VanDerWaalsContact O-N 3.15Å; G86-R88 VanDerWaalsContact C-N 3.35Å; G86-R88 PolarHBondContact O-N 3.34Å; G86-Q89 WeakPolarHBondContact O-CB 3.49Å; G86-Q89 PolarHBondContact O-N 3.38Å; G86-L90 PolarHBondContact O-N 2.86Å |
| 87 | L | 98.1 | Very high | 97.5 | Very high | 107 Ų | 107 | 99.9 Ų | 99.9 | 56% | 0.56 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61 | -44.1 | 176.8 | -173.3 | 64.6 | 0 | 0 | 0 | 111.5 | E83 Q89 L90 D91 | E83-L87 PolarHBondContact O-N 2.83Å; L87-Q89 VanDerWaalsContact C-N 3.33Å; L87-Q89 PolarHBondContact O-N 3.2Å; L87-L90 WeakPolarHBondContact O-CB 3.18Å; L87-L90 PolarHBondContact O-N 3.46Å; L87-D91 PolarHBondContact O-N 3.03Å |
| 88 | R | 98.1 | Very high | 97.7 | Very high | 157 Ų | 157 | 101.3 Ų | 101.3 | 59% | 0.592 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.2 | -37.8 | 175.8 | -70.1 | 171.4 | -177.1 | -175.7 | -0.2 | 112.6 | M84 V85 G86 L90 D91 M92 | M84-R88 WeakPolarHBondContact O-CG 3.46Å; M84-R88 PolarHBondContact O-N 2.93Å; V85-R88 PolarHBondContact O-N 2.95Å; G86-R88 VanDerWaalsContact C-N 3.35Å; G86-R88 PolarHBondContact O-N 3.34Å; R88-L90 VanDerWaalsContact C-N 3.34Å; R88-D91 PolarHBondContact O-N 2.84Å; R88-M92 WeakPolarHBondContact O-CG 3.5Å; R88-M92 PolarHBondContact O-N 3.2Å |
| 89 | Q | 98.3 | Very high | 97.8 | Very high | 130 Ų | 130 | 107.1 Ų | 107.1 | 61% | 0.607 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65 | -40.8 | 175.6 | -73.3 | 176.3 | 3.3 | 0 | 0 | 111.6 | V85 G86 L87 M92 S93 | V85-Q89 WeakPolarHBondContact O-CG 3.45Å; V85-Q89 PolarHBondContact O-N 3.31Å; G86-Q89 WeakPolarHBondContact O-CB 3.49Å; G86-Q89 PolarHBondContact O-N 3.38Å; L87-Q89 VanDerWaalsContact C-N 3.33Å; L87-Q89 PolarHBondContact O-N 3.2Å; Q89-M92 PolarHBondContact O-N 3.46Å; Q89-S93 PolarHBondContact O-N 2.86Å |
| 90 | L | 98.4 | Very high | 98 | Very high | 100 Ų | 100 | 105.8 Ų | 105.8 | 52% | 0.524 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.5 | -50.1 | 173.4 | -171.7 | 169.8 | 0 | 0 | 0 | 110.2 | G86 L87 R88 M92 S93 L94 | G86-L90 PolarHBondContact O-N 2.86Å; L87-L90 WeakPolarHBondContact O-CB 3.18Å; L87-L90 PolarHBondContact O-N 3.46Å; R88-L90 VanDerWaalsContact C-N 3.34Å; L90-M92 VanDerWaalsContact C-N 3.28Å; L90-M92 PolarHBondContact O-N 3.07Å; L90-S93 WeakPolarHBondContact O-CB 3.36Å; L90-S93 PolarHBondContact O-N 2.98Å; L90-S93 VanDerWaalsContact O-N 3.11Å; L90-L94 HydrophobicContact CD2-CB 4.35Å; L90-L94 WeakPolarHBondContact O-CB 3.29Å; L90-L94 PolarHBondContact O-N 3.31Å |
| 91 | D | 98.6 | Very high | 98 | Very high | 72 Ų | 72 | 105.6 Ų | 105.6 | 39% | 0.385 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -55.1 | -45.4 | 178.5 | -74 | -10.3 | 0 | 0 | 0 | 111.4 | L87 R88 L94 L95 | L87-D91 PolarHBondContact O-N 3.03Å; R88-D91 PolarHBondContact O-N 2.84Å; D91-L94 PolarHBondContact O-N 3.22Å; D91-L95 WeakPolarHBondContact O-CG 3.23Å; D91-L95 PolarHBondContact O-N 3.42Å |
| 92 | M | 98.3 | Very high | 98 | Very high | 112 Ų | 112 | 101.9 Ų | 101.9 | 55% | 0.552 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63 | -46.7 | 177.1 | -69.5 | -55.7 | 99.4 | 0 | 0 | 111.9 | R88 Q89 L90 L94 L95 C96 | R88-M92 WeakPolarHBondContact O-CG 3.5Å; R88-M92 PolarHBondContact O-N 3.2Å; Q89-M92 PolarHBondContact O-N 3.46Å; L90-M92 VanDerWaalsContact C-N 3.28Å; L90-M92 PolarHBondContact O-N 3.07Å; M92-L94 VanDerWaalsContact C-N 3.28Å; M92-L94 PolarHBondContact O-N 3.42Å; M92-L95 HydrophobicContact CE-CD1 3.62Å; M92-L95 PolarHBondContact O-N 3.41Å; M92-C96 PolarHBondContact O-N 2.98Å; M92-C96 PolarHBondContact O-SG 2.9Å; M92-C96 VanDerWaalsContact O-SG 3.35Å |
| 93 | S | 98.1 | Very high | 97.9 | Very high | 64 Ų | 64 | 98.8 Ų | 98.8 | 45% | 0.448 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.9 | -41.4 | 176.6 | -178.2 | 0 | 0 | 0 | 0 | 111.8 | Q89 L90 C96 Q97 | Q89-S93 PolarHBondContact O-N 2.86Å; L90-S93 WeakPolarHBondContact O-CB 3.36Å; L90-S93 PolarHBondContact O-N 2.98Å; L90-S93 VanDerWaalsContact O-N 3.11Å; S93-C96 PolarHBondContact O-N 3.41Å; S93-Q97 WeakPolarHBondContact O-CG 3.42Å; S93-Q97 PolarHBondContact O-N 3.11Å; S93-Q97 VanDerWaalsContact O-N 3.07Å |
| 94 | L | 98.5 | Very high | 97.8 | Very high | 75 Ų | 75 | 94.7 Ų | 94.7 | 39% | 0.393 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.2 | -44.3 | 179.1 | 177.4 | 63.1 | 0 | 0 | 0 | 111.3 | L90 D91 M92 C96 Q97 L98 | L90-L94 HydrophobicContact CD2-CB 4.35Å; L90-L94 WeakPolarHBondContact O-CB 3.29Å; L90-L94 PolarHBondContact O-N 3.31Å; D91-L94 PolarHBondContact O-N 3.22Å; M92-L94 VanDerWaalsContact C-N 3.28Å; M92-L94 PolarHBondContact O-N 3.42Å; L94-C96 VanDerWaalsContact C-N 3.34Å; L94-C96 PolarHBondContact O-N 2.9Å; L94-Q97 WeakPolarHBondContact O-CB 3.47Å; L94-Q97 PolarHBondContact O-N 3.29Å; L94-L98 HydrophobicContact CD1-CD1 4.31Å; L94-L98 HydrophobicContact CD1-CG 4.34Å; L94-L98 HydrophobicContact CG-CD1 4.07Å; L94-L98 WeakPolarHBondContact O-CG 3.34Å; L94-L98 PolarHBondContact O-N 2.99Å |
| 95 | L | 98.4 | Very high | 97.6 | Very high | 101 Ų | 101 | 95.3 Ų | 95.3 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -43.1 | 176 | -73.5 | 174.1 | 0 | 0 | 0 | 111.5 | D91 M92 Q97 L98 W99 | D91-L95 WeakPolarHBondContact O-CG 3.23Å; D91-L95 PolarHBondContact O-N 3.42Å; M92-L95 HydrophobicContact CE-CD1 3.62Å; M92-L95 PolarHBondContact O-N 3.41Å; L95-Q97 VanDerWaalsContact C-N 3.31Å; L95-Q97 PolarHBondContact O-N 3.45Å; L95-L98 PolarHBondContact O-N 3.47Å; L95-W99 WeakPolarHBondContact O-CB 3.35Å; L95-W99 PolarHBondContact O-N 2.96Å |
| 96 | C | 98.1 | Very high | 97.3 | Very high | 90 Ų | 90 | 96.1 Ų | 96.1 | 61% | 0.608 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.1 | -42.3 | 174 | -67.8 | 0 | 0 | 0 | 0 | 112.1 | M92 S93 L94 S100 | M92-C96 PolarHBondContact O-N 2.98Å; M92-C96 PolarHBondContact O-SG 2.9Å; M92-C96 VanDerWaalsContact O-SG 3.35Å; S93-C96 PolarHBondContact O-N 3.41Å; L94-C96 VanDerWaalsContact C-N 3.34Å; L94-C96 PolarHBondContact O-N 2.9Å; C96-S100 WeakPolarHBondContact O-CB 3.49Å; C96-S100 PolarHBondContact O-N 3.35Å |
| 97 | Q | 98.3 | Very high | 96.8 | Very high | 125 Ų | 125 | 100.8 Ų | 100.8 | 58% | 0.584 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.8 | -46.4 | 177.5 | -74 | 174.2 | -26.2 | 0 | 0 | 112.3 | S93 L94 L95 W99 S100 L101 | S93-Q97 WeakPolarHBondContact O-CG 3.42Å; S93-Q97 PolarHBondContact O-N 3.11Å; S93-Q97 VanDerWaalsContact O-N 3.07Å; L94-Q97 WeakPolarHBondContact O-CB 3.47Å; L94-Q97 PolarHBondContact O-N 3.29Å; L95-Q97 VanDerWaalsContact C-N 3.31Å; L95-Q97 PolarHBondContact O-N 3.45Å; Q97-W99 VanDerWaalsContact C-N 3.34Å; Q97-W99 PolarHBondContact O-N 3.35Å; Q97-S100 PolarHBondContact O-N 3.08Å; Q97-L101 WeakPolarHBondContact O-CB 3.33Å; Q97-L101 PolarHBondContact O-N 3.44Å |
| 98 | L | 98.3 | Very high | 96.1 | Very high | 95 Ų | 95 | 99.6 Ų | 99.6 | 50% | 0.497 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.5 | -42.5 | 178.6 | -76.5 | 169.1 | 0 | 0 | 0 | 111.6 | L94 L95 L101 H102 | L94-L98 HydrophobicContact CD1-CD1 4.31Å; L94-L98 HydrophobicContact CD1-CG 4.34Å; L94-L98 HydrophobicContact CG-CD1 4.07Å; L94-L98 WeakPolarHBondContact O-CG 3.34Å; L94-L98 PolarHBondContact O-N 2.99Å; L95-L98 PolarHBondContact O-N 3.47Å; L98-L101 PolarHBondContact O-N 3.31Å; L98-H102 WeakPolarHBondContact O-CB 3.46Å; L98-H102 PolarHBondContact O-N 3.26Å |
| 99 | W | 97.9 | Very high | 95.2 | Very high | 174 Ų | 174 | 99 Ų | 99 | 66% | 0.659 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.2 | -45.9 | 179.5 | -147.7 | 86.8 | 0 | 0 | 0 | 111.3 | L95 Q97 L101 H102 E103 | L95-W99 WeakPolarHBondContact O-CB 3.35Å; L95-W99 PolarHBondContact O-N 2.96Å; Q97-W99 VanDerWaalsContact C-N 3.34Å; Q97-W99 PolarHBondContact O-N 3.35Å; W99-L101 VanDerWaalsContact C-N 3.26Å; W99-L101 PolarHBondContact O-N 3.01Å; W99-H102 WeakPolarHBondContact O-CB 3.4Å; W99-H102 PolarHBondContact O-N 3.37Å; W99-E103 HydrophobicContact CD2-CG 4.46Å; W99-E103 HydrophobicContact CE3-CG 3.72Å; W99-E103 HydrophobicContact CH2-CG 4.11Å; W99-E103 HydrophobicContact CZ3-CG 3.51Å; W99-E103 WeakPolarHBondContact O-CG 3.33Å; W99-E103 PolarHBondContact O-N 3.48Å |
| 100 | S | 97.9 | Very high | 93.7 | Very high | 80 Ų | 80 | 94.4 Ų | 94.4 | 56% | 0.559 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59 | -37.2 | 173.8 | 179.5 | 0 | 0 | 0 | 0 | 112.7 | C96 Q97 A104 | C96-S100 WeakPolarHBondContact O-CB 3.49Å; C96-S100 PolarHBondContact O-N 3.35Å; Q97-S100 PolarHBondContact O-N 3.08Å; S100-A104 PolarHBondContact O-N 2.88Å; S100-A104 VanDerWaalsContact O-N 3.08Å |
| 101 | L | 97.3 | Very high | 91.7 | Very high | 100 Ų | 100 | 94.8 Ų | 94.8 | 52% | 0.524 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -70.7 | -41.8 | 177.1 | 179.5 | 63.8 | 0 | 0 | 0 | 111.9 | Q97 L98 W99 E103 A104 I105 | Q97-L101 WeakPolarHBondContact O-CB 3.33Å; Q97-L101 PolarHBondContact O-N 3.44Å; L98-L101 PolarHBondContact O-N 3.31Å; W99-L101 VanDerWaalsContact C-N 3.26Å; W99-L101 PolarHBondContact O-N 3.01Å; L101-E103 VanDerWaalsContact C-N 3.29Å; L101-E103 PolarHBondContact O-N 3.3Å; L101-A104 PolarHBondContact O-N 2.93Å; L101-I105 HydrophobicContact CD1-CD1 4.12Å; L101-I105 HydrophobicContact CD1-CG1 4.3Å; L101-I105 HydrophobicContact CG-CD1 3.92Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.41Å; L101-I105 PolarHBondContact O-N 2.97Å |
| 102 | H | 96 | Very high | 89.7 | Confident | 90 Ų | 90 | 94.6 Ų | 94.6 | 42% | 0.417 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -54.6 | -49.8 | 174 | 171 | -90.1 | 0 | 0 | 0 | 110.4 | L98 W99 I105 Q106 | L98-H102 WeakPolarHBondContact O-CB 3.46Å; L98-H102 PolarHBondContact O-N 3.26Å; W99-H102 WeakPolarHBondContact O-CB 3.4Å; W99-H102 PolarHBondContact O-N 3.37Å; H102-I105 PolarHBondContact O-N 3.08Å; H102-Q106 PolarHBondContact NE2-NE2 3.34Å; H102-Q106 WeakPolarHBondContact O-CG 3.41Å; H102-Q106 PolarHBondContact O-N 3.15Å |
| 103 | E | 96.4 | Very high | 87.7 | Confident | 81 Ų | 81 | 94.1 Ų | 94.1 | 38% | 0.379 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.1 | -46.7 | 178.5 | -67.8 | -55.1 | 103.3 | 0 | 0 | 112 | W99 L101 I105 Q106 E107 | W99-E103 HydrophobicContact CD2-CG 4.46Å; W99-E103 HydrophobicContact CE3-CG 3.72Å; W99-E103 HydrophobicContact CH2-CG 4.11Å; W99-E103 HydrophobicContact CZ3-CG 3.51Å; W99-E103 WeakPolarHBondContact O-CG 3.33Å; W99-E103 PolarHBondContact O-N 3.48Å; L101-E103 VanDerWaalsContact C-N 3.29Å; L101-E103 PolarHBondContact O-N 3.3Å; E103-I105 VanDerWaalsContact C-N 3.3Å; E103-I105 PolarHBondContact O-N 3.35Å; E103-Q106 PolarHBondContact O-N 3.03Å; E103-Q106 VanDerWaalsContact O-N 3.11Å; E103-E107 WeakPolarHBondContact O-CB 3.32Å; E103-E107 PolarHBondContact O-N 3.38Å |
| 104 | A | 95 | Very high | 85.5 | Confident | 41 Ų | 41 | 97.7 Ų | 97.7 | 34% | 0.339 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.5 | -37.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | S100 L101 C108 | S100-A104 PolarHBondContact O-N 2.88Å; S100-A104 VanDerWaalsContact O-N 3.08Å; L101-A104 PolarHBondContact O-N 2.93Å; A104-C108 PolarHBondContact O-N 3.14Å; A104-C108 VanDerWaalsContact O-N 3.08Å; A104-C108 PolarHBondContact O-SG 3.48Å |
| 105 | I | 93.5 | Very high | 82.7 | Confident | 98 Ų | 98 | 99.2 Ų | 99.2 | 50% | 0.503 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.3 | -41.5 | 176 | -68.5 | 166.2 | 0 | 0 | 0 | 110.8 | L101 H102 E103 K109 | L101-I105 HydrophobicContact CD1-CD1 4.12Å; L101-I105 HydrophobicContact CD1-CG1 4.3Å; L101-I105 HydrophobicContact CG-CD1 3.92Å; L101-I105 VanDerWaalsContact O-CG1 3.29Å; L101-I105 WeakPolarHBondContact O-CG1 3.41Å; L101-I105 PolarHBondContact O-N 2.97Å; H102-I105 PolarHBondContact O-N 3.08Å; E103-I105 VanDerWaalsContact C-N 3.3Å; E103-I105 PolarHBondContact O-N 3.35Å; I105-K109 WeakPolarHBondContact O-CB 3.32Å; I105-K109 PolarHBondContact O-N 3.45Å; I105-K109 VanDerWaalsContact O-N 3.1Å |
| 106 | Q | 91.6 | Very high | 80.4 | Confident | 92 Ų | 92 | 100.3 Ų | 100.3 | 43% | 0.43 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67 | -38.9 | 178.1 | -67.7 | -67.6 | 6.8 | 0 | 0 | 111.6 | H102 E103 K109 G110 | H102-Q106 PolarHBondContact NE2-NE2 3.34Å; H102-Q106 WeakPolarHBondContact O-CG 3.41Å; H102-Q106 PolarHBondContact O-N 3.15Å; E103-Q106 PolarHBondContact O-N 3.03Å; E103-Q106 VanDerWaalsContact O-N 3.11Å; Q106-K109 PolarHBondContact O-N 3.41Å; Q106-G110 PolarHBondContact O-N 2.87Å |
| 107 | E | 88.6 | Confident | 78 | Confident | 133 Ų | 133 | 103.4 Ų | 103.4 | 62% | 0.621 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -59.1 | -53.9 | 174.4 | -158.4 | 178.7 | 179.7 | 0 | 0 | 110.1 | E103 K109 G110 E111 | E103-E107 WeakPolarHBondContact O-CB 3.32Å; E103-E107 PolarHBondContact O-N 3.38Å; E107-K109 PolarHBondContact O-N 2.99Å; E107-K109 VanDerWaalsContact O-N 3.1Å; E107-G110 PolarHBondContact O-N 2.88Å; E107-E111 WeakPolarHBondContact CG-OE1 3.48Å; E107-E111 WeakPolarHBondContact O-CG 3.49Å; E107-E111 PolarHBondContact O-N 3.42Å |
| 108 | C | 82.9 | Confident | 75.3 | Confident | 81 Ų | 81 | 104.5 Ų | 104.5 | 55% | 0.547 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -55.9 | -34.9 | 177.3 | -71.6 | 0 | 0 | 0 | 0 | 113.4 | A104 E111 A112 | A104-C108 PolarHBondContact O-N 3.14Å; A104-C108 VanDerWaalsContact O-N 3.08Å; A104-C108 PolarHBondContact O-SG 3.48Å; C108-E111 WeakPolarHBondContact CA-OE1 3.26Å; C108-E111 PolarHBondContact N-OE1 3.2Å; C108-A112 WeakPolarHBondContact O-CB 3.36Å; C108-A112 PolarHBondContact O-N 3.38Å |
| 109 | K | 79.3 | Confident | 73 | Confident | 146 Ų | 146 | 103.4 Ų | 103.4 | 64% | 0.635 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -78.1 | -35.5 | 179.6 | -166.7 | 176.4 | 169.5 | -171.4 | 0 | 112.2 | I105 Q106 E107 S113 | I105-K109 WeakPolarHBondContact O-CB 3.32Å; I105-K109 PolarHBondContact O-N 3.45Å; I105-K109 VanDerWaalsContact O-N 3.1Å; Q106-K109 PolarHBondContact O-N 3.41Å; E107-K109 PolarHBondContact O-N 2.99Å; E107-K109 VanDerWaalsContact O-N 3.1Å; K109-S113 PolarHBondContact O-N 3.38Å; K109-S113 VanDerWaalsContact O-N 3.13Å |
| 110 | G | 65.4 | Low | 70.3 | Confident | 33 Ų | 33 | 105 Ų | 105 | 34% | 0.34 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -63.6 | -43.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q106 E107 S113 I114 | Q106-G110 PolarHBondContact O-N 2.87Å; E107-G110 PolarHBondContact O-N 2.88Å; G110-S113 WeakPolarHBondContact O-CB 3.29Å; G110-S113 PolarHBondContact O-N 2.91Å; G110-S113 VanDerWaalsContact O-N 3.16Å; G110-I114 VanDerWaalsContact O-CD1 3.31Å; G110-I114 WeakPolarHBondContact O-CD1 3.28Å; G110-I114 WeakPolarHBondContact O-CG1 3.49Å; G110-I114 PolarHBondContact O-N 3.29Å |
| 111 | E | 57.2 | Low | 67.6 | Low | 107 Ų | 107 | 104.8 Ų | 104.8 | 50% | 0.5 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -63.3 | -41 | 176.3 | -64.5 | 170.2 | -107.3 | 0 | 0 | 112.7 | E107 C108 S113 I114 T115 | E107-E111 WeakPolarHBondContact CG-OE1 3.48Å; E107-E111 WeakPolarHBondContact O-CG 3.49Å; E107-E111 PolarHBondContact O-N 3.42Å; C108-E111 WeakPolarHBondContact CA-OE1 3.26Å; C108-E111 PolarHBondContact N-OE1 3.2Å; E111-S113 VanDerWaalsContact C-N 3.27Å; E111-S113 PolarHBondContact O-N 2.99Å; E111-I114 PolarHBondContact O-N 2.89Å; E111-I114 VanDerWaalsContact O-N 3.12Å; E111-T115 PolarHBondContact O-N 3.07Å; E111-T115 PolarHBondContact O-OG1 3.42Å |
| 112 | A | 56.8 | Low | 64.9 | Low | 69 Ų | 69 | 106.6 Ų | 106.6 | 57% | 0.57 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -68.8 | -23.2 | 175 | 0 | 0 | 0 | 0 | 0 | 113.3 | C108 | C108-A112 WeakPolarHBondContact O-CB 3.36Å; C108-A112 PolarHBondContact O-N 3.38Å |
| 113 | S | 55.7 | Low | 62.2 | Low | 101 Ų | 101 | 109.9 Ų | 109.9 | 71% | 0.706 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -81.4 | -15.7 | 171.3 | -175.9 | 0 | 0 | 0 | 0 | 113.1 | K109 G110 E111 | K109-S113 PolarHBondContact O-N 3.38Å; K109-S113 VanDerWaalsContact O-N 3.13Å; G110-S113 WeakPolarHBondContact O-CB 3.29Å; G110-S113 PolarHBondContact O-N 2.91Å; G110-S113 VanDerWaalsContact O-N 3.16Å; E111-S113 VanDerWaalsContact C-N 3.27Å; E111-S113 PolarHBondContact O-N 2.99Å |
| 114 | I | 52.9 | Low | 59.7 | Low | 140 Ų | 140 | 114 Ų | 114 | 72% | 0.718 | 64% | 0.636 | S | S | * | * | S | Bend | trans | -94.6 | -5.2 | -179.4 | -64.6 | 160.9 | 0 | 0 | 0 | 111.2 | G110 E111 P116 | G110-I114 VanDerWaalsContact O-CD1 3.31Å; G110-I114 WeakPolarHBondContact O-CD1 3.28Å; G110-I114 WeakPolarHBondContact O-CG1 3.49Å; G110-I114 PolarHBondContact O-N 3.29Å; E111-I114 PolarHBondContact O-N 2.89Å; E111-I114 VanDerWaalsContact O-N 3.12Å; I114-P116 WeakPolarHBondContact O-CD 3.15Å |
| 115 | T | 39.8 | Very low | 57.4 | Low | 106 Ų | 106 | 120.2 Ų | 120.2 | 65% | 0.65 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -84 | 114.9 | 168.7 | 0.7 | 0 | 0 | 0 | 0 | 109.6 | E111 D117 | E111-T115 PolarHBondContact O-N 3.07Å; E111-T115 PolarHBondContact O-OG1 3.42Å; T115-D117 PolarHBondContact O-N 3.01Å |
| 116 | P | 50.1 | Low | 54.8 | Low | 124 Ų | 124 | 123.9 Ų | 123.9 | 81% | 0.805 | 67% | 0.673 | S | S | * | * | trans | -89.5 | 100.3 | -160.6 | 34.8 | -32.5 | 0 | 0 | 0 | 111.2 | I114 | I114-P116 WeakPolarHBondContact O-CD 3.15Š| ||
| 117 | D | 46.4 | Very low | 52.4 | Low | 156 Ų | 156 | 127.3 Ų | 127.3 | 83% | 0.834 | 69% | 0.689 | S | S | * | * | trans | -147.6 | 68.6 | 157.8 | -173.9 | 27.4 | 0 | 0 | 0 | 109.2 | T115 | T115-D117 PolarHBondContact O-N 3.01Š| ||
| 118 | N | 41.6 | Very low | 50.5 | Low | 148 Ų | 148 | 129.3 Ų | 129.3 | 79% | 0.791 | 70% | 0.698 | S | S | * | * | trans | -132.4 | 80.2 | 156.1 | -171.4 | 82.6 | 0 | 0 | 0 | 106.7 | Y120 | N118-Y120 PolarHBondContact O-N 3.43Å; N118-Y120 VanDerWaalsContact O-N 3.16Å | ||
| 119 | G | 50.1 | Low | 48.6 | Very low | 71 Ų | 71 | 134 Ų | 134 | 73% | 0.732 | 71% | 0.712 | S | S | * | * | trans | -57.4 | 112.3 | 165.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 120 | Y | 40.8 | Very low | 47.4 | Very low | 207 Ų | 207 | 132.8 Ų | 132.8 | 81% | 0.812 | 72% | 0.716 | S | S | * | * | trans | -138 | 109.4 | 152.3 | -146.9 | -96.8 | 0 | 0 | 0 | 106.4 | N118 | N118-Y120 PolarHBondContact O-N 3.43Å; N118-Y120 VanDerWaalsContact O-N 3.16Å | ||
| 121 | S | 42.1 | Very low | 46.7 | Very low | 77 Ų | 77 | 139.7 Ų | 139.7 | 54% | 0.538 | 74% | 0.74 | S | S | . | * | trans | -55.9 | 164.7 | 158.6 | 57.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 122 | E | 41.5 | Very low | 46.6 | Very low | 138 Ų | 138 | 141.7 Ų | 141.7 | 65% | 0.645 | 75% | 0.754 | S | S | * | * | cis | -139.5 | 135.7 | 19.3 | -96.8 | 100.1 | 152.8 | 0 | 0 | 107.1 | E124 | E122-E124 HydrophobicContact CB-CG 4.48Å; E122-E124 HydrophobicContact CG-CG 4.21Å | ||
| 123 | D | 39 | Very low | 46.2 | Very low | 158 Ų | 158 | 145.5 Ų | 145.5 | 85% | 0.845 | 77% | 0.765 | S | S | * | * | trans | -104.7 | 84.2 | 153 | -148.7 | 1.4 | 0 | 0 | 0 | 103.6 | ||||
| 124 | E | 43.3 | Very low | 46.4 | Very low | 168 Ų | 168 | 148.3 Ų | 148.3 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | trans | -108.1 | 92.3 | 165.7 | -76.4 | -169.4 | 173.6 | 0 | 0 | 106.4 | E122 | E122-E124 HydrophobicContact CB-CG 4.48Å; E122-E124 HydrophobicContact CG-CG 4.21Å | ||
| 125 | E | 46.2 | Very low | 46.3 | Very low | 171 Ų | 171 | 150.6 Ų | 150.6 | 80% | 0.799 | 77% | 0.774 | S | S | * | * | trans | -67.4 | 139.9 | 153.3 | -64.5 | -177.6 | 158 | 0 | 0 | 108.5 | ||||
| 126 | E | 40.2 | Very low | 46.5 | Very low | 175 Ų | 175 | 158.2 Ų | 158.2 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | 132.3 | 128.2 | 168.3 | -80 | 180 | -176 | 0 | 0 | 109.2 | ||||
| 127 | E | 41.5 | Very low | 46.4 | Very low | 164 Ų | 164 | 159.9 Ų | 159.9 | 77% | 0.766 | 80% | 0.802 | S | S | * | * | cis | -157.6 | 157.9 | 14.7 | -103.3 | 169.4 | -177.1 | 0 | 0 | 108.5 | ||||
| 128 | E | 47.2 | Very low | 46.4 | Very low | 176 Ų | 176 | 160.1 Ų | 160.1 | 82% | 0.822 | 80% | 0.801 | S | S | * | * | trans | -60.3 | 130.5 | 168.3 | -67.7 | -163.5 | 162.5 | 0 | 0 | 111.4 | ||||
| 129 | E | 44.6 | Very low | 46.6 | Very low | 178 Ų | 178 | 160.8 Ų | 160.8 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -119.5 | 102 | 153.5 | -67.5 | -130.4 | 160.8 | 0 | 0 | 109.1 | ||||
| 130 | V | 52.4 | Low | 46.4 | Very low | 121 Ų | 121 | 166.1 Ų | 166.1 | 73% | 0.733 | 81% | 0.805 | S | S | * | * | trans | -81.4 | 108.6 | 161 | -159.8 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 131 | E | 51.5 | Low | 46.8 | Very low | 179 Ų | 179 | 163.5 Ų | 163.5 | 84% | 0.836 | 81% | 0.805 | S | S | * | * | trans | -126.3 | 106.6 | 157.2 | -83.3 | -154.2 | 154.5 | 0 | 0 | 109.7 | ||||
| 132 | D | 54.9 | Low | 47.1 | Very low | 148 Ų | 148 | 169.3 Ų | 169.3 | 79% | 0.791 | 82% | 0.823 | S | S | * | * | trans | -66 | 118.9 | 155.7 | -166.6 | 31.4 | 0 | 0 | 0 | 107.2 | ||||
| 133 | D | 48.9 | Very low | 47.5 | Very low | 149 Ų | 149 | 171.5 Ų | 171.5 | 80% | 0.797 | 84% | 0.835 | S | S | * | * | trans | -165.8 | 153.5 | 141.5 | -121.9 | -37.7 | 0 | 0 | 0 | 114.3 | ||||
| 134 | E | 58.9 | Low | 48.1 | Very low | 161 Ų | 161 | 172.5 Ų | 172.5 | 75% | 0.752 | 84% | 0.835 | S | S | * | * | trans | -82.6 | 178.8 | -160.4 | -58.2 | 178.6 | 138.1 | 0 | 0 | 115.6 | ||||
| 135 | E | 50.9 | Low | 48.5 | Very low | 187 Ų | 187 | 172.9 Ų | 172.9 | 87% | 0.874 | 84% | 0.839 | S | S | * | * | trans | 87.2 | 133.9 | 161.1 | -49.8 | -160.2 | 158.1 | 0 | 0 | 117.6 | ||||
| 136 | E | 45.2 | Very low | 48.7 | Very low | 266 Ų | 266 | 173.1 Ų | 173.1 | 100% | 1.243 | 84% | 0.842 | S | S | * | * | cis | -144.5 | 0 | 26.1 | -175.7 | -177 | -177.8 | 0 | 0 | 112 |
Retrieved 136 of 136 residues in 77.7 ms
(Link to these results)