| 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 | 49.4 | Very low | 60.5 | Low | 253 Ų | 253 | 170.5 Ų | 170.5 | 100% | 1.246 | 90% | 0.896 | S | S | * | * | 0 | 104.7 | 0 | -70.7 | 166 | 172.5 | 0 | 0 | 107.6 | |||||
| 2 | G | 55 | Low | 60.3 | Low | 90 Ų | 90 | 164.3 Ų | 164.3 | 93% | 0.928 | 87% | 0.874 | S | S | * | * | trans | 114.3 | -10.3 | 160.4 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 3 | A | 60.7 | Low | 60.2 | Low | 98 Ų | 98 | 162.9 Ų | 162.9 | 81% | 0.81 | 87% | 0.866 | S | S | * | * | trans | -122.1 | 24.7 | -163.2 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 4 | V | 65 | Low | 60.2 | Low | 136 Ų | 136 | 162.2 Ų | 162.2 | 82% | 0.824 | 86% | 0.855 | S | S | * | * | trans | -130.5 | 11 | -168.7 | -147.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 5 | E | 63.4 | Low | 60.2 | Low | 194 Ų | 194 | 160.1 Ų | 160.1 | 91% | 0.907 | 85% | 0.845 | S | S | * | * | trans | -111.3 | 26.5 | -174.5 | -72.9 | -140.5 | 139.6 | 0 | 0 | 116.2 | ||||
| 6 | L | 60.6 | Low | 59.9 | Low | 182 Ų | 182 | 157.8 Ų | 157.8 | 95% | 0.953 | 83% | 0.828 | S | S | * | * | S | Bend | trans | -108.7 | 31 | 176.1 | -71.5 | 177.1 | 0 | 0 | 0 | 114.3 | ||
| 7 | F | 59.5 | Low | 60.1 | Low | 185 Ų | 185 | 154.9 Ų | 154.9 | 81% | 0.811 | 82% | 0.818 | S | S | * | * | trans | -126.8 | 14.5 | -175.4 | -158.2 | -102.8 | 0 | 0 | 0 | 116.5 | ||||
| 8 | E | 63.8 | Low | 60.1 | Low | 172 Ų | 172 | 155.1 Ų | 155.1 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | -126.3 | 49.7 | -167.3 | -151.2 | 70.9 | -172.2 | 0 | 0 | 115.8 | ||||
| 9 | E | 61.5 | Low | 60.3 | Low | 176 Ų | 176 | 153.7 Ų | 153.7 | 82% | 0.822 | 81% | 0.806 | S | S | * | * | trans | -152.9 | 75.4 | 159.5 | -135.4 | 166.5 | 124.2 | 0 | 0 | 114.1 | ||||
| 10 | Q | 61.5 | Low | 60.4 | Low | 199 Ų | 199 | 151.8 Ų | 151.8 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | trans | -116.6 | 84 | 162 | -65.4 | -68.5 | -85 | 0 | 0 | 108.7 | ||||
| 11 | K | 64.8 | Low | 60.5 | Low | 190 Ų | 190 | 155.7 Ų | 155.7 | 83% | 0.826 | 81% | 0.805 | S | S | * | * | trans | -99 | 134.5 | 173.6 | -164.5 | 167.6 | -72.1 | -167 | 0 | 109.6 | ||||
| 12 | P | 58.1 | Low | 61 | Low | 96 Ų | 96 | 148.5 Ų | 148.5 | 62% | 0.623 | 78% | 0.78 | S | S | * | * | trans | -78.5 | 143.2 | -147.4 | 29.4 | -35.6 | 0 | 0 | 0 | 114.9 | Q14 | P12-Q14 PolarHBondContact O-N 3.43Å; P12-Q14 VanDerWaalsContact O-N 3.07Å | ||
| 13 | L | 59 | Low | 61.3 | Low | 147 Ų | 147 | 155.8 Ų | 155.8 | 77% | 0.77 | 78% | 0.779 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | 10.4 | 178.4 | -68.2 | 176.3 | 0 | 0 | 0 | 115.3 | N15 Q16 | L13-N15 VanDerWaalsContact C-N 3.29Å; L13-N15 PolarHBondContact O-N 3.19Å; L13-Q16 PolarHBondContact O-N 3.5Å |
| 14 | Q | 60 | Low | 61 | Low | 153 Ų | 153 | 155.2 Ų | 155.2 | 72% | 0.715 | 77% | 0.77 | S | S | * | * | H | α-helix | trans | -65.9 | -30.1 | -172.9 | -68.9 | -160.2 | 22.2 | 0 | 0 | 113.3 | P12 Q16 V17 | P12-Q14 PolarHBondContact O-N 3.43Å; P12-Q14 VanDerWaalsContact O-N 3.07Å; Q14-Q16 PolarHBondContact O-N 3.18Å; Q14-Q16 VanDerWaalsContact O-N 3.09Å; Q14-V17 PolarHBondContact O-N 2.78Å |
| 15 | N | 60.1 | Low | 60.6 | Low | 131 Ų | 131 | 156.3 Ų | 156.3 | 70% | 0.701 | 77% | 0.768 | S | S | * | * | H | α-helix | trans | -66.5 | -13.4 | 178.6 | -69 | -4.5 | 0 | 0 | 0 | 114.1 | L13 | L13-N15 VanDerWaalsContact C-N 3.29Å; L13-N15 PolarHBondContact O-N 3.19Å |
| 16 | Q | 56.5 | Low | 60.3 | Low | 123 Ų | 123 | 153.1 Ų | 153.1 | 58% | 0.575 | 77% | 0.767 | S | S | * | * | H | α-helix | trans | -86.8 | -24.7 | 178.4 | -68.2 | -69.3 | -49.2 | 0 | 0 | 113 | L13 Q14 E18 T20 | L13-Q16 PolarHBondContact O-N 3.5Å; Q14-Q16 PolarHBondContact O-N 3.18Å; Q14-Q16 VanDerWaalsContact O-N 3.09Å; Q16-E18 VanDerWaalsContact C-N 3.35Å; Q16-T20 PolarHBondContact O-OG1 2.93Å |
| 17 | V | 62.9 | Low | 60.1 | Low | 108 Ų | 108 | 151.8 Ų | 151.8 | 66% | 0.655 | 76% | 0.76 | S | S | * | * | H | α-helix | trans | -72.3 | -31.8 | 179.9 | 169.1 | 0 | 0 | 0 | 0 | 111.3 | Q14 T20 | Q14-V17 PolarHBondContact O-N 2.78Å; V17-T20 WeakPolarHBondContact O-CB 3.44Å; V17-T20 PolarHBondContact O-N 2.92Å |
| 18 | E | 61 | Low | 60.1 | Low | 158 Ų | 158 | 150 Ų | 150 | 74% | 0.738 | 76% | 0.764 | S | S | * | * | H | α-helix | trans | -74.8 | -32.7 | -177.8 | -142 | 154 | 157.9 | 0 | 0 | 113 | Q16 T20 R21 | Q16-E18 VanDerWaalsContact C-N 3.35Å; E18-T20 PolarHBondContact O-N 3.12Å; E18-R21 PolarHBondContact O-N 3.35Å |
| 19 | L | 62.4 | Low | 59.9 | Low | 130 Ų | 130 | 145.2 Ų | 145.2 | 68% | 0.681 | 76% | 0.761 | S | S | * | * | H | α-helix | trans | -67.9 | -24.5 | 170.1 | -91.2 | 152 | 0 | 0 | 0 | 113 | R21 | L19-R21 VanDerWaalsContact C-N 3.34Å |
| 20 | T | 62.1 | Low | 60.1 | Low | 115 Ų | 115 | 142.8 Ų | 142.8 | 71% | 0.706 | 76% | 0.764 | S | S | * | * | H | α-helix | trans | -78 | -20.5 | 179.6 | -57 | 0 | 0 | 0 | 0 | 112.2 | Q16 V17 E18 | Q16-T20 PolarHBondContact O-OG1 2.93Å; V17-T20 WeakPolarHBondContact O-CB 3.44Å; V17-T20 PolarHBondContact O-N 2.92Å; E18-T20 PolarHBondContact O-N 3.12Å |
| 21 | R | 63.3 | Low | 60.2 | Low | 233 Ų | 233 | 138.7 Ų | 138.7 | 88% | 0.879 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -83.7 | -13.8 | -174 | -152.9 | 171.7 | -176.7 | 147.6 | 0.4 | 114.4 | E18 L19 | E18-R21 PolarHBondContact O-N 3.35Å; L19-R21 VanDerWaalsContact C-N 3.34Å |
| 22 | S | 59 | Low | 60.4 | Low | 103 Ų | 103 | 139.3 Ų | 139.3 | 72% | 0.72 | 76% | 0.757 | S | S | * | * | S | Bend | trans | -103.4 | -9.6 | -167.6 | -138.9 | 0 | 0 | 0 | 0 | 116.3 | S24 | S22-S24 VanDerWaalsContact C-N 3.32Å; S22-S24 PolarHBondContact O-N 3.37Å; S22-S24 VanDerWaalsContact O-N 3.17Å |
| 23 | R | 62 | Low | 60.4 | Low | 242 Ų | 242 | 145.6 Ų | 145.6 | 91% | 0.913 | 77% | 0.768 | S | S | * | * | trans | -95.2 | 68 | 175.7 | -84.2 | 173.2 | 78 | 171.8 | 3.3 | 112.1 | ||||
| 24 | S | 55.3 | Low | 60.9 | Low | 87 Ų | 87 | 147.9 Ų | 147.9 | 61% | 0.608 | 77% | 0.772 | S | S | * | * | trans | -47.2 | 129.6 | 155.5 | -169.5 | 0 | 0 | 0 | 0 | 111.8 | S22 | S22-S24 VanDerWaalsContact C-N 3.32Å; S22-S24 PolarHBondContact O-N 3.37Å; S22-S24 VanDerWaalsContact O-N 3.17Å | ||
| 25 | M | 55.3 | Low | 60.7 | Low | 159 Ų | 159 | 151.4 Ų | 151.4 | 78% | 0.783 | 78% | 0.779 | S | S | * | * | trans | 63.7 | 98.6 | 137.9 | -62.7 | 169.1 | 67 | 0 | 0 | 118.7 | ||||
| 26 | S | 58.3 | Low | 61 | Low | 127 Ų | 127 | 150.2 Ų | 150.2 | 89% | 0.888 | 78% | 0.78 | S | S | * | * | trans | -151.7 | 110.4 | 137.6 | -47.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 27 | L | 56.5 | Low | 61.7 | Low | 154 Ų | 154 | 151.6 Ų | 151.6 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | -68.2 | 166.2 | 172.2 | -73.2 | 123.3 | 0 | 0 | 0 | 110.7 | ||||
| 28 | T | 59.1 | Low | 62.2 | Low | 146 Ų | 146 | 157.1 Ų | 157.1 | 90% | 0.896 | 80% | 0.8 | S | S | * | * | trans | 90.7 | 123.2 | 173.7 | 85.9 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 29 | G | 60 | Low | 62.6 | Low | 72 Ų | 72 | 157.5 Ų | 157.5 | 74% | 0.742 | 80% | 0.802 | S | S | * | * | trans | 120.1 | 84.8 | 170.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | P31 | G29-P31 WeakPolarHBondContact O-CD 3.44Š| ||
| 30 | S | 64.1 | Low | 63.3 | Low | 126 Ų | 126 | 155.7 Ų | 155.7 | 88% | 0.881 | 80% | 0.798 | S | S | * | * | trans | -65.2 | 112.7 | 166.9 | -58.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 31 | P | 65 | Low | 63.8 | Low | 112 Ų | 112 | 159.8 Ų | 159.8 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | -89.9 | 126.6 | 175.9 | 30.4 | -19.3 | 0 | 0 | 0 | 109.1 | G29 R33 | G29-P31 WeakPolarHBondContact O-CD 3.44Å; P31-R33 PolarHBondContact O-N 3.07Å; P31-R33 VanDerWaalsContact O-N 3.11Å | ||
| 32 | K | 68.1 | Low | 64.5 | Low | 204 Ų | 204 | 154.9 Ų | 154.9 | 89% | 0.887 | 79% | 0.792 | S | S | * | * | trans | -53.2 | 116.9 | 174.5 | -63.7 | -169.7 | 178 | -172.2 | 0 | 109 | K34 | K32-K34 VanDerWaalsContact C-N 3.26Å; K32-K34 PolarHBondContact O-N 3.03Å | ||
| 33 | R | 58.5 | Low | 65.7 | Low | 227 Ų | 227 | 156.1 Ų | 156.1 | 86% | 0.857 | 79% | 0.79 | S | S | * | * | trans | -67 | 86.8 | 175.6 | -63.4 | -172.6 | 173.6 | 108.4 | 0.2 | 108.7 | P31 W35 | P31-R33 PolarHBondContact O-N 3.07Å; P31-R33 VanDerWaalsContact O-N 3.11Å; R33-W35 PolarHBondContact O-N 3.16Å | ||
| 34 | K | 70.5 | Confident | 66.7 | Low | 196 Ų | 196 | 149.7 Ų | 149.7 | 85% | 0.852 | 78% | 0.779 | S | S | * | * | trans | -73.4 | 107.1 | 165.1 | -175.6 | 176.2 | -178.3 | -178.4 | 0 | 105.6 | K32 S36 | K32-K34 VanDerWaalsContact C-N 3.26Å; K32-K34 PolarHBondContact O-N 3.03Å; K34-S36 PolarHBondContact O-N 3Å | ||
| 35 | W | 54.9 | Low | 68 | Low | 227 Ų | 227 | 156.3 Ų | 156.3 | 86% | 0.86 | 79% | 0.791 | S | S | * | * | trans | -61.2 | 89.7 | 168.9 | -66.8 | 104.7 | 0 | 0 | 0 | 107.8 | R33 L37 | R33-W35 PolarHBondContact O-N 3.16Å; W35-L37 PolarHBondContact O-N 3.3Å | ||
| 36 | S | 67.1 | Low | 69.4 | Low | 105 Ų | 105 | 158 Ų | 158 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | trans | -69.7 | 88.7 | 158.5 | -173.6 | 0 | 0 | 0 | 0 | 104.8 | K34 R38 | K34-S36 PolarHBondContact O-N 3Å; S36-R38 PolarHBondContact O-N 3.3Å | ||
| 37 | L | 71.2 | Confident | 70.6 | Confident | 153 Ų | 153 | 158 Ų | 158 | 80% | 0.801 | 79% | 0.791 | S | S | * | * | trans | -52.5 | 104.5 | 157 | -87.7 | 154.5 | 0 | 0 | 0 | 104.6 | W35 Q39 | W35-L37 PolarHBondContact O-N 3.3Å; L37-Q39 VanDerWaalsContact C-N 3.27Å; L37-Q39 PolarHBondContact O-N 3.36Å | ||
| 38 | R | 72.3 | Confident | 72 | Confident | 224 Ų | 224 | 158 Ų | 158 | 85% | 0.845 | 78% | 0.781 | S | S | * | * | trans | -50.5 | 104.3 | 166.1 | 172.7 | 179.7 | -72.4 | -94.3 | 1.2 | 104 | S36 P40 | S36-R38 PolarHBondContact O-N 3.3Å; R38-P40 VanDerWaalsContact O-CD 3.23Å; R38-P40 WeakPolarHBondContact O-CD 3.26Å | ||
| 39 | Q | 70.8 | Confident | 73.1 | Confident | 165 Ų | 165 | 155.4 Ų | 155.4 | 77% | 0.771 | 77% | 0.774 | S | S | * | * | trans | -55.4 | 115.1 | 176.9 | -65.8 | -175.5 | 9.6 | 0 | 0 | 104.3 | L37 Y41 | L37-Q39 VanDerWaalsContact C-N 3.27Å; L37-Q39 PolarHBondContact O-N 3.36Å; Q39-Y41 PolarHBondContact O-N 2.84Å | ||
| 40 | P | 75.6 | Confident | 74.3 | Confident | 93 Ų | 93 | 154.4 Ų | 154.4 | 60% | 0.604 | 76% | 0.756 | S | S | * | * | trans | -55.1 | 140.7 | 171.8 | 25.6 | -32.1 | 0 | 0 | 0 | 105.2 | R38 L42 | R38-P40 VanDerWaalsContact O-CD 3.23Å; R38-P40 WeakPolarHBondContact O-CD 3.26Å; P40-L42 VanDerWaalsContact C-N 3.25Å; P40-L42 HydrophobicContact CG-CD2 4.09Å; P40-L42 WeakPolarHBondContact O-CG 3.27Å; P40-L42 PolarHBondContact O-N 2.61Å | ||
| 41 | Y | 72.5 | Confident | 75.3 | Confident | 200 Ų | 200 | 153.3 Ų | 153.3 | 78% | 0.784 | 75% | 0.745 | S | S | * | * | trans | -51.9 | 98.1 | 173.4 | 175.1 | -95.1 | 0 | 0 | 0 | 107.6 | Q39 I43 | Q39-Y41 PolarHBondContact O-N 2.84Å; Y41-I43 HydrophobicContact CD1-CG1 3.89Å; Y41-I43 HydrophobicContact CE1-CG1 3.79Å; Y41-I43 PolarHBondContact O-N 3.3Å | ||
| 42 | L | 77.8 | Confident | 76.4 | Confident | 130 Ų | 130 | 155.8 Ų | 155.8 | 68% | 0.681 | 74% | 0.744 | S | S | * | * | trans | -77 | 98.5 | -179.4 | -68 | -179.9 | 0 | 0 | 0 | 104 | P40 P44 | P40-L42 VanDerWaalsContact C-N 3.25Å; P40-L42 HydrophobicContact CG-CD2 4.09Å; P40-L42 WeakPolarHBondContact O-CG 3.27Å; P40-L42 PolarHBondContact O-N 2.61Å; L42-P44 WeakPolarHBondContact O-CD 3.44Å | ||
| 43 | I | 84.1 | Confident | 77.2 | Confident | 130 Ų | 130 | 150.7 Ų | 150.7 | 67% | 0.667 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -51 | 118.1 | 169.5 | -59.6 | 149.4 | 0 | 0 | 0 | 105.5 | Y41 R45 | Y41-I43 HydrophobicContact CD1-CG1 3.89Å; Y41-I43 HydrophobicContact CE1-CG1 3.79Å; Y41-I43 PolarHBondContact O-N 3.3Å; I43-R45 PolarHBondContact O-N 2.85Å |
| 44 | P | 83 | Confident | 78.6 | Confident | 106 Ų | 106 | 144.6 Ų | 144.6 | 69% | 0.688 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -58 | 120.8 | -179.4 | 22 | -30.7 | 0 | 0 | 0 | 107.2 | L42 E46 | L42-P44 WeakPolarHBondContact O-CD 3.44Å; P44-E46 PolarHBondContact O-N 3.34Å |
| 45 | R | 82.8 | Confident | 79.5 | Confident | 226 Ų | 226 | 138.9 Ų | 138.9 | 85% | 0.853 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 130.1 | 177.5 | -80.8 | -170 | -84.1 | -86.1 | 4 | 108.2 | I43 T47 | I43-R45 PolarHBondContact O-N 2.85Å; R45-T47 PolarHBondContact O-N 3.27Å |
| 46 | E | 85.2 | Confident | 80.9 | Confident | 195 Ų | 195 | 134 Ų | 134 | 91% | 0.911 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 124.9 | 168.8 | 62.9 | -162.9 | 119.6 | 0 | 0 | 109 | P44 | P44-E46 PolarHBondContact O-N 3.34Š|
| 47 | T | 84 | Confident | 81.8 | Confident | 126 Ų | 126 | 131.7 Ų | 131.7 | 77% | 0.773 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 141.5 | 176 | 54.6 | 0 | 0 | 0 | 0 | 108.5 | R45 A49 | R45-T47 PolarHBondContact O-N 3.27Å; T47-A49 PolarHBondContact O-N 3.1Å |
| 48 | W | 86.5 | Confident | 82.5 | Confident | 154 Ų | 154 | 127.1 Ų | 127.1 | 58% | 0.583 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 135.4 | 171 | -59.5 | 94 | 0 | 0 | 0 | 110.3 | S50 E53 F54 | W48-S50 PolarHBondContact O-N 2.71Å; W48-E53 HydrophobicContact CE3-CB 4.3Å; W48-F54 HydrophobicContact CB-CB 4.45Å; W48-F54 HydrophobicContact CD2-CB 4.22Å; W48-F54 HydrophobicContact CD2-CD2 4.49Å; W48-F54 HydrophobicContact CG-CB 4.07Å; W48-F54 HydrophobicContact CZ2-CD2 4.45Å; W48-F54 AromaticContact NE1-CD2 3.8Å |
| 49 | A | 81.7 | Confident | 83.1 | Confident | 92 Ų | 92 | 120.4 Ų | 120.4 | 76% | 0.76 | 62% | 0.615 | S | S | * | * | S | Bend | trans | -67.6 | -25.8 | -177 | 0 | 0 | 0 | 0 | 0 | 111.8 | T47 E53 | T47-A49 PolarHBondContact O-N 3.1Å; A49-E53 WeakPolarHBondContact CB-OE2 3.11Å; A49-E53 PolarHBondContact N-OE2 3.47Å |
| 50 | S | 84.5 | Confident | 83.6 | Confident | 52 Ų | 52 | 115 Ų | 115 | 36% | 0.364 | 60% | 0.604 | S | S | . | * | trans | -151.4 | 147.8 | 174.4 | 178.9 | 0 | 0 | 0 | 0 | 111.3 | W48 F52 E53 F54 | W48-S50 PolarHBondContact O-N 2.71Å; S50-F52 PolarHBondContact O-N 2.77Å; S50-F52 VanDerWaalsContact O-N 3.14Å; S50-F52 PolarHBondContact OG-N 3.2Å; S50-E53 WeakPolarHBondContact O-CB 3.35Å; S50-E53 PolarHBondContact O-N 3.31Å; S50-F54 PolarHBondContact O-N 2.78Å | ||
| 51 | T | 85.6 | Confident | 83.7 | Confident | 103 Ų | 103 | 120.5 Ų | 120.5 | 63% | 0.632 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -54.4 | -31.4 | 171.6 | -50.3 | 0 | 0 | 0 | 0 | 111.8 | E53 F54 I55 | T51-E53 VanDerWaalsContact C-N 3.35Å; T51-E53 PolarHBondContact O-N 3.28Å; T51-F54 PolarHBondContact O-N 2.97Å; T51-I55 HydrophobicContact CG2-CD1 3.94Å; T51-I55 HydrophobicContact CG2-CG1 4.41Å; T51-I55 WeakPolarHBondContact O-CG1 3.35Å; T51-I55 PolarHBondContact O-N 2.88Å |
| 52 | F | 87.7 | Confident | 83.8 | Confident | 164 Ų | 164 | 114.6 Ų | 114.6 | 72% | 0.719 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -64.6 | -35.2 | 176.4 | -78.1 | -79.6 | 0 | 0 | 0 | 112.9 | S50 I55 L56 | S50-F52 PolarHBondContact O-N 2.77Å; S50-F52 VanDerWaalsContact O-N 3.14Å; S50-F52 PolarHBondContact OG-N 3.2Å; F52-I55 PolarHBondContact O-N 3.26Å; F52-L56 WeakPolarHBondContact O-CB 3.26Å; F52-L56 PolarHBondContact O-N 2.94Å |
| 53 | E | 85.9 | Confident | 83.3 | Confident | 96 Ų | 96 | 110.3 Ų | 110.3 | 45% | 0.449 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -68.7 | -38.1 | 176.9 | -65.5 | -171.9 | 149.8 | 0 | 0 | 111.8 | W48 A49 S50 T51 S57 | W48-E53 HydrophobicContact CE3-CB 4.3Å; A49-E53 WeakPolarHBondContact CB-OE2 3.11Å; A49-E53 PolarHBondContact N-OE2 3.47Å; S50-E53 WeakPolarHBondContact O-CB 3.35Å; S50-E53 PolarHBondContact O-N 3.31Å; T51-E53 VanDerWaalsContact C-N 3.35Å; T51-E53 PolarHBondContact O-N 3.28Å; E53-S57 WeakPolarHBondContact O-CB 3.39Å; E53-S57 PolarHBondContact O-N 3.34Å; E53-S57 PolarHBondContact O-OG 3.4Å |
| 54 | F | 87.8 | Confident | 82.4 | Confident | 100 Ų | 100 | 105.8 Ų | 105.8 | 44% | 0.439 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.8 | -50.4 | 173.7 | 172.6 | -106.8 | 0 | 0 | 0 | 111 | W48 S50 T51 L56 S57 C58 | W48-F54 HydrophobicContact CB-CB 4.45Å; W48-F54 HydrophobicContact CD2-CB 4.22Å; W48-F54 HydrophobicContact CD2-CD2 4.49Å; W48-F54 HydrophobicContact CG-CB 4.07Å; W48-F54 HydrophobicContact CZ2-CD2 4.45Å; W48-F54 AromaticContact NE1-CD2 3.8Å; S50-F54 PolarHBondContact O-N 2.78Å; T51-F54 PolarHBondContact O-N 2.97Å; F54-L56 VanDerWaalsContact C-N 3.35Å; F54-L56 PolarHBondContact O-N 3.5Å; F54-S57 PolarHBondContact O-N 3.45Å; F54-C58 PolarHBondContact O-N 3.21Å; F54-C58 PolarHBondContact O-SG 3.46Å; F54-C58 VanDerWaalsContact O-SG 3.34Å |
| 55 | I | 89.6 | Confident | 81.1 | Confident | 75 Ų | 75 | 109 Ų | 109 | 39% | 0.385 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -61.6 | -44.6 | 178.4 | -67.4 | 169.1 | 0 | 0 | 0 | 110.5 | T51 F52 S57 C58 I59 | T51-I55 HydrophobicContact CG2-CD1 3.94Å; T51-I55 HydrophobicContact CG2-CG1 4.41Å; T51-I55 WeakPolarHBondContact O-CG1 3.35Å; T51-I55 PolarHBondContact O-N 2.88Å; F52-I55 PolarHBondContact O-N 3.26Å; I55-S57 VanDerWaalsContact C-N 3.3Å; I55-S57 PolarHBondContact O-N 3.44Å; I55-C58 PolarHBondContact O-N 2.77Å; I55-I59 HydrophobicContact CG2-CD1 3.51Å; I55-I59 HydrophobicContact CG2-CG1 4.08Å; I55-I59 WeakPolarHBondContact O-CB 3.43Å; I55-I59 VanDerWaalsContact O-CG1 3.25Å; I55-I59 WeakPolarHBondContact O-CG1 2.84Å; I55-I59 PolarHBondContact O-N 2.8Å |
| 56 | L | 84.3 | Confident | 80 | Confident | 124 Ų | 124 | 99.9 Ų | 99.9 | 65% | 0.649 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -62.8 | -37.6 | 179 | -175.3 | 62.8 | 0 | 0 | 0 | 111.7 | F52 F54 I59 G60 | F52-L56 WeakPolarHBondContact O-CB 3.26Å; F52-L56 PolarHBondContact O-N 2.94Å; F54-L56 VanDerWaalsContact C-N 3.35Å; F54-L56 PolarHBondContact O-N 3.5Å; L56-I59 PolarHBondContact O-N 3.24Å; L56-G60 PolarHBondContact O-N 3.45Å |
| 57 | S | 86 | Confident | 78.8 | Confident | 57 Ų | 57 | 95.7 Ų | 95.7 | 40% | 0.399 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.4 | -43.1 | 174.2 | -60 | 0 | 0 | 0 | 0 | 111.8 | E53 F54 I55 G60 Y61 | E53-S57 WeakPolarHBondContact O-CB 3.39Å; E53-S57 PolarHBondContact O-N 3.34Å; E53-S57 PolarHBondContact O-OG 3.4Å; F54-S57 PolarHBondContact O-N 3.45Å; I55-S57 VanDerWaalsContact C-N 3.3Å; I55-S57 PolarHBondContact O-N 3.44Å; S57-G60 PolarHBondContact O-N 2.94Å; S57-Y61 VanDerWaalsContact O-CB 3.26Å; S57-Y61 WeakPolarHBondContact O-CB 3.13Å; S57-Y61 PolarHBondContact O-N 2.83Å |
| 58 | C | 84.9 | Confident | 77.7 | Confident | 57 Ų | 57 | 95.8 Ų | 95.8 | 39% | 0.385 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.8 | -41 | 174.9 | -68.8 | 0 | 0 | 0 | 0 | 112.6 | F54 I55 Y61 S62 | F54-C58 PolarHBondContact O-N 3.21Å; F54-C58 PolarHBondContact O-SG 3.46Å; F54-C58 VanDerWaalsContact O-SG 3.34Å; I55-C58 PolarHBondContact O-N 2.77Å; C58-Y61 PolarHBondContact O-N 2.98Å; C58-S62 VanDerWaalsContact O-CB 3.27Å; C58-S62 WeakPolarHBondContact O-CB 3.07Å; C58-S62 PolarHBondContact O-N 3.14Å; C58-S62 PolarHBondContact O-OG 2.85Å |
| 59 | I | 85.1 | Confident | 76.7 | Confident | 83 Ų | 83 | 96.3 Ų | 96.3 | 43% | 0.426 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -67.1 | -47.3 | 175.2 | -67.4 | 173.7 | 0 | 0 | 0 | 109.2 | I55 L56 Y61 S62 V63 | I55-I59 HydrophobicContact CG2-CD1 3.51Å; I55-I59 HydrophobicContact CG2-CG1 4.08Å; I55-I59 WeakPolarHBondContact O-CB 3.43Å; I55-I59 VanDerWaalsContact O-CG1 3.25Å; I55-I59 WeakPolarHBondContact O-CG1 2.84Å; I55-I59 PolarHBondContact O-N 2.8Å; L56-I59 PolarHBondContact O-N 3.24Å; I59-Y61 PolarHBondContact O-N 3.33Å; I59-S62 WeakPolarHBondContact CA-OG 3.26Å; I59-S62 PolarHBondContact O-N 3.48Å; I59-S62 PolarHBondContact O-OG 2.81Å; I59-V63 HydrophobicContact CG2-CB 4.39Å; I59-V63 HydrophobicContact CG2-CG2 3.61Å; I59-V63 WeakPolarHBondContact O-CA 3.25Å; I59-V63 WeakPolarHBondContact O-CB 3.41Å; I59-V63 WeakPolarHBondContact O-CG2 3.36Å; I59-V63 PolarHBondContact O-N 3.46Å |
| 60 | G | 80.6 | Confident | 75.5 | Confident | 51 Ų | 51 | 99 Ų | 99 | 53% | 0.526 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.2 | -35.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | L56 S57 | L56-G60 PolarHBondContact O-N 3.45Å; S57-G60 PolarHBondContact O-N 2.94Å |
| 61 | Y | 78.9 | Confident | 74.1 | Confident | 210 Ų | 210 | 103.6 Ų | 103.6 | 82% | 0.824 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -72.6 | -45.9 | 175.2 | -179 | -101 | 0 | 0 | 0 | 113.1 | S57 C58 I59 | S57-Y61 VanDerWaalsContact O-CB 3.26Å; S57-Y61 WeakPolarHBondContact O-CB 3.13Å; S57-Y61 PolarHBondContact O-N 2.83Å; C58-Y61 PolarHBondContact O-N 2.98Å; I59-Y61 PolarHBondContact O-N 3.33Å |
| 62 | S | 73.5 | Confident | 72.7 | Confident | 75 Ų | 75 | 102.4 Ų | 102.4 | 52% | 0.524 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -76.2 | -33.7 | -178.1 | 57.2 | 0 | 0 | 0 | 0 | 112.8 | C58 I59 G64 | C58-S62 VanDerWaalsContact O-CB 3.27Å; C58-S62 WeakPolarHBondContact O-CB 3.07Å; C58-S62 PolarHBondContact O-N 3.14Å; C58-S62 PolarHBondContact O-OG 2.85Å; I59-S62 WeakPolarHBondContact CA-OG 3.26Å; I59-S62 PolarHBondContact O-N 3.48Å; I59-S62 PolarHBondContact O-OG 2.81Å; S62-G64 PolarHBondContact O-N 3.36Å; S62-G64 VanDerWaalsContact O-N 3.1Å |
| 63 | V | 67.2 | Low | 71.1 | Confident | 40 Ų | 40 | 100.9 Ų | 100.9 | 24% | 0.242 | 52% | 0.523 | C | S | . | . | S | Bend | trans | -90.4 | 63.3 | 175.6 | -164.7 | 0 | 0 | 0 | 0 | 107.8 | I59 L65 N67 I68 | I59-V63 HydrophobicContact CG2-CB 4.39Å; I59-V63 HydrophobicContact CG2-CG2 3.61Å; I59-V63 WeakPolarHBondContact O-CA 3.25Å; I59-V63 WeakPolarHBondContact O-CB 3.41Å; I59-V63 WeakPolarHBondContact O-CG2 3.36Å; I59-V63 PolarHBondContact O-N 3.46Å; V63-L65 PolarHBondContact O-N 3.35Å; V63-N67 HydrophobicContact CG1-CB 4.49Å; V63-I68 HydrophobicContact CB-CD1 4.3Å; V63-I68 HydrophobicContact CG1-CB 4.36Å; V63-I68 HydrophobicContact CG1-CD1 3.21Å; V63-I68 HydrophobicContact CG1-CG1 3.37Å |
| 64 | G | 65 | Low | 69.6 | Low | 36 Ų | 36 | 100.8 Ų | 100.8 | 37% | 0.371 | 52% | 0.524 | S | S | . | . | trans | -47.1 | 134.4 | 163.3 | 0 | 0 | 0 | 0 | 0 | 107.9 | S62 G66 N67 | S62-G64 PolarHBondContact O-N 3.36Å; S62-G64 VanDerWaalsContact O-N 3.1Å; G64-G66 PolarHBondContact O-N 2.68Å; G64-N67 PolarHBondContact O-N 2.99Å | ||
| 65 | L | 55.9 | Low | 68 | Low | 172 Ų | 172 | 99 Ų | 99 | 90% | 0.901 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -46.9 | -3.3 | -173.1 | -74.4 | 95 | 0 | 0 | 0 | 116 | V63 W69 | V63-L65 PolarHBondContact O-N 3.35Å; L65-W69 VanDerWaalsContact O-CD1 3.25Å |
| 66 | G | 59.8 | Low | 66.4 | Low | 36 Ų | 36 | 105 Ų | 105 | 37% | 0.371 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -23.5 | 170.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | G64 R70 | G64-G66 PolarHBondContact O-N 2.68Å; G66-R70 VanDerWaalsContact O-CB 3.26Å; G66-R70 WeakPolarHBondContact O-CB 3.32Å |
| 67 | N | 60.8 | Low | 65 | Low | 107 Ų | 107 | 104.7 Ų | 104.7 | 57% | 0.572 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -91.8 | -31.5 | -167.1 | -74.5 | -25.6 | 0 | 0 | 0 | 115.2 | V63 G64 W69 F71 | V63-N67 HydrophobicContact CG1-CB 4.49Å; G64-N67 PolarHBondContact O-N 2.99Å; N67-W69 PolarHBondContact O-N 3.04Å; N67-F71 WeakPolarHBondContact O-CB 3.19Å; N67-F71 PolarHBondContact O-N 3.06Å |
| 68 | I | 61.4 | Low | 63.7 | Low | 127 Ų | 127 | 107.6 Ų | 107.6 | 65% | 0.651 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -72.6 | -25.9 | -179.5 | -79.4 | 161.8 | 0 | 0 | 0 | 113.5 | V63 P72 | V63-I68 HydrophobicContact CB-CD1 4.3Å; V63-I68 HydrophobicContact CG1-CB 4.36Å; V63-I68 HydrophobicContact CG1-CD1 3.21Å; V63-I68 HydrophobicContact CG1-CG1 3.37Å; I68-P72 WeakPolarHBondContact O-CD 3.38Å; I68-P72 VanDerWaalsContact O-CG 3.26Å; I68-P72 WeakPolarHBondContact O-CG 3.42Å |
| 69 | W | 64.2 | Low | 62 | Low | 166 Ų | 166 | 107.4 Ų | 107.4 | 63% | 0.629 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -103.4 | -21.3 | -176 | 83.1 | -70.3 | 0 | 0 | 0 | 113.7 | L65 N67 P72 | L65-W69 VanDerWaalsContact O-CD1 3.25Å; N67-W69 PolarHBondContact O-N 3.04Å; W69-P72 VanDerWaalsContact C-CD 3.46Å; W69-P72 WeakPolarHBondContact O-CD 3.41Å; W69-P72 WeakPolarHBondContact O-CG 3.48Å |
| 70 | R | 57.4 | Low | 60.3 | Low | 147 Ų | 147 | 106.5 Ų | 106.5 | 56% | 0.555 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -78.9 | -34.7 | 171.5 | -147.2 | 87.6 | 169.4 | 156.5 | -0.1 | 111.8 | G66 Y73 L74 | G66-R70 VanDerWaalsContact O-CB 3.26Å; G66-R70 WeakPolarHBondContact O-CB 3.32Å; R70-Y73 PolarHBondContact O-N 3.34Å; R70-L74 HydrophobicContact CG-CD1 3.96Å; R70-L74 PolarHBondContact O-N 3.09Å |
| 71 | F | 54.4 | Low | 59.1 | Low | 150 Ų | 150 | 107.2 Ų | 107.2 | 66% | 0.658 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -66.4 | -33.5 | 178.8 | -165.5 | -106.2 | 0 | 0 | 0 | 115.4 | N67 C75 | N67-F71 WeakPolarHBondContact O-CB 3.19Å; N67-F71 PolarHBondContact O-N 3.06Å; F71-C75 WeakPolarHBondContact O-CB 3.23Å; F71-C75 PolarHBondContact O-N 3.29Å |
| 72 | P | 55.9 | Low | 57.8 | Low | 77 Ų | 77 | 106.9 Ų | 106.9 | 50% | 0.5 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -74.8 | -28.5 | 172.3 | 24.8 | -34 | 0 | 0 | 0 | 113 | I68 W69 Y76 | I68-P72 WeakPolarHBondContact O-CD 3.38Å; I68-P72 VanDerWaalsContact O-CG 3.26Å; I68-P72 WeakPolarHBondContact O-CG 3.42Å; W69-P72 VanDerWaalsContact C-CD 3.46Å; W69-P72 WeakPolarHBondContact O-CD 3.41Å; W69-P72 WeakPolarHBondContact O-CG 3.48Å; P72-Y76 PolarHBondContact O-N 3.07Å |
| 73 | Y | 53.7 | Low | 57 | Low | 133 Ų | 133 | 112.5 Ų | 112.5 | 52% | 0.522 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -78.2 | -39.9 | 177.6 | -173.6 | -103.8 | 0 | 0 | 0 | 112.6 | R70 Y76 Q77 | R70-Y73 PolarHBondContact O-N 3.34Å; Y73-Y76 PolarHBondContact O-N 3.27Å; Y73-Q77 VanDerWaalsContact CE1-CD 3.5Å; Y73-Q77 HydrophobicContact CE1-CG 4.34Å; Y73-Q77 HydrophobicContact CE2-CG 4.46Å; Y73-Q77 VanDerWaalsContact CZ-CD 3.42Å; Y73-Q77 PolarHBondContact O-N 3.21Å; Y73-Q77 PolarHBondContact OH-NE2 3.22Å |
| 74 | L | 55 | Low | 56.3 | Low | 93 Ų | 93 | 119.8 Ų | 119.8 | 49% | 0.487 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -67.8 | -34.4 | 175.5 | -102.2 | 102.3 | 0 | 0 | 0 | 113.1 | R70 Y76 N78 | R70-L74 HydrophobicContact CG-CD1 3.96Å; R70-L74 PolarHBondContact O-N 3.09Å; L74-Y76 VanDerWaalsContact C-N 3.32Å; L74-N78 WeakPolarHBondContact O-CB 3.43Å; L74-N78 PolarHBondContact O-N 3.11Å; L74-N78 VanDerWaalsContact O-N 3.16Å; L74-N78 PolarHBondContact O-ND2 2.8Å; L74-N78 VanDerWaalsContact O-ND2 3.07Å |
| 75 | C | 54.6 | Low | 55.6 | Low | 63 Ų | 63 | 123.1 Ų | 123.1 | 43% | 0.426 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -69.2 | -28.5 | 174 | -93.1 | 0 | 0 | 0 | 0 | 113 | F71 G80 | F71-C75 WeakPolarHBondContact O-CB 3.23Å; F71-C75 PolarHBondContact O-N 3.29Å; C75-G80 PolarHBondContact O-N 2.76Å |
| 76 | Y | 56.9 | Low | 55.5 | Low | 202 Ų | 202 | 123 Ų | 123 | 79% | 0.792 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -80.6 | -36.6 | 176.5 | -169.4 | -103.3 | 0 | 0 | 0 | 112.4 | P72 Y73 L74 | P72-Y76 PolarHBondContact O-N 3.07Å; Y73-Y76 PolarHBondContact O-N 3.27Å; L74-Y76 VanDerWaalsContact C-N 3.32Å |
| 77 | Q | 54.5 | Low | 55.4 | Low | 117 Ų | 117 | 125.5 Ų | 125.5 | 55% | 0.547 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -86 | -22.5 | -176.9 | -73 | -161.5 | -10.2 | 0 | 0 | 115.9 | Y73 | Y73-Q77 VanDerWaalsContact CE1-CD 3.5Å; Y73-Q77 HydrophobicContact CE1-CG 4.34Å; Y73-Q77 HydrophobicContact CE2-CG 4.46Å; Y73-Q77 VanDerWaalsContact CZ-CD 3.42Å; Y73-Q77 PolarHBondContact O-N 3.21Å; Y73-Q77 PolarHBondContact OH-NE2 3.22Å |
| 78 | N | 57.7 | Low | 55.2 | Low | 117 Ų | 117 | 124.4 Ų | 124.4 | 63% | 0.626 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -103.6 | 11.8 | -176.7 | -67.4 | -73.9 | 0 | 0 | 0 | 114.5 | L74 | L74-N78 WeakPolarHBondContact O-CB 3.43Å; L74-N78 PolarHBondContact O-N 3.11Å; L74-N78 VanDerWaalsContact O-N 3.16Å; L74-N78 PolarHBondContact O-ND2 2.8Å; L74-N78 VanDerWaalsContact O-ND2 3.07Å |
| 79 | G | 49 | Very low | 55.1 | Low | 54 Ų | 54 | 130 Ų | 130 | 56% | 0.557 | 66% | 0.658 | S | S | * | * | trans | 67.3 | 101.4 | -173.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | G81 | G79-G81 PolarHBondContact O-N 3.28Š| ||
| 80 | G | 49.1 | Very low | 55.4 | Low | 63 Ų | 63 | 129.8 Ų | 129.8 | 65% | 0.649 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -43.8 | 134 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | C75 | C75-G80 PolarHBondContact O-N 2.76Š|
| 81 | G | 57.1 | Low | 56 | Low | 66 Ų | 66 | 128.6 Ų | 128.6 | 68% | 0.68 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 111.7 | 12.5 | 155 | 0 | 0 | 0 | 0 | 0 | 119.1 | G79 K83 | G79-G81 PolarHBondContact O-N 3.28Å; G81-K83 PolarHBondContact O-N 3.31Å |
| 82 | K | 51.3 | Low | 56.6 | Low | 204 Ų | 204 | 129.5 Ų | 129.5 | 89% | 0.887 | 69% | 0.685 | S | S | * | * | trans | -78.1 | 69.1 | 168.6 | -67.2 | -170.8 | -177.5 | 178.7 | 0 | 111.6 | F84 | K82-F84 PolarHBondContact O-N 2.98Š| ||
| 83 | K | 56.1 | Low | 57.1 | Low | 192 Ų | 192 | 130.9 Ų | 130.9 | 84% | 0.835 | 70% | 0.696 | S | S | * | * | trans | -55.1 | 122.4 | 156.9 | -71.5 | 176.3 | 178.7 | 164.8 | 0 | 107.7 | G81 S85 | G81-K83 PolarHBondContact O-N 3.31Å; K83-S85 PolarHBondContact O-N 3.35Å | ||
| 84 | F | 51.9 | Low | 57.3 | Low | 193 Ų | 193 | 134.5 Ų | 134.5 | 85% | 0.846 | 73% | 0.733 | S | S | * | * | trans | 28 | 64.4 | 149.8 | -138.2 | -93.1 | 0 | 0 | 0 | 115.3 | K82 F86 | K82-F84 PolarHBondContact O-N 2.98Å; F84-F86 HydrophobicContact CD1-CB 4.23Å; F84-F86 HydrophobicContact CE1-CB 4.25Å; F84-F86 PolarHBondContact O-N 3.45Å; F84-F86 VanDerWaalsContact O-N 3.12Å | ||
| 85 | S | 51.3 | Low | 57.5 | Low | 107 Ų | 107 | 136.6 Ų | 136.6 | 75% | 0.748 | 75% | 0.745 | S | S | * | * | trans | -83.6 | 84.7 | 163 | -168.6 | 0 | 0 | 0 | 0 | 107.2 | K83 S87 | K83-S85 PolarHBondContact O-N 3.35Å; S85-S87 PolarHBondContact O-N 3.36Å | ||
| 86 | F | 53.6 | Low | 57.6 | Low | 168 Ų | 168 | 140.5 Ų | 140.5 | 74% | 0.737 | 76% | 0.762 | S | S | * | * | trans | -66.4 | 75.4 | 156.2 | -175 | -97.5 | 0 | 0 | 0 | 106.7 | F84 S88 | F84-F86 HydrophobicContact CD1-CB 4.23Å; F84-F86 HydrophobicContact CE1-CB 4.25Å; F84-F86 PolarHBondContact O-N 3.45Å; F84-F86 VanDerWaalsContact O-N 3.12Å; F86-S88 WeakPolarHBondContact CE1-OG 3.21Å | ||
| 87 | S | 57.7 | Low | 57.6 | Low | 90 Ų | 90 | 137.1 Ų | 137.1 | 63% | 0.629 | 76% | 0.76 | S | S | * | * | trans | -94.6 | 94.3 | 164.9 | -162.8 | 0 | 0 | 0 | 0 | 105.8 | S85 R89 | S85-S87 PolarHBondContact O-N 3.36Å; S87-R89 PolarHBondContact O-N 3Å | ||
| 88 | S | 56.6 | Low | 57.8 | Low | 83 Ų | 83 | 138.2 Ų | 138.2 | 58% | 0.58 | 77% | 0.773 | S | S | * | * | trans | -39.2 | 121 | 164.3 | -57.5 | 0 | 0 | 0 | 0 | 109.2 | F86 E90 | F86-S88 WeakPolarHBondContact CE1-OG 3.21Å; S88-E90 PolarHBondContact O-N 3.22Å | ||
| 89 | R | 58.2 | Low | 57.8 | Low | 244 Ų | 244 | 139.6 Ų | 139.6 | 92% | 0.921 | 78% | 0.782 | S | S | * | * | trans | -56.3 | 120.1 | 177.6 | -64.7 | -178.4 | -168.1 | -158.2 | 2.8 | 109 | S87 | S87-R89 PolarHBondContact O-N 3Š| ||
| 90 | E | 71.1 | Confident | 58.4 | Low | 162 Ų | 162 | 145.3 Ų | 145.3 | 76% | 0.757 | 80% | 0.797 | S | S | * | * | trans | 19 | 121.2 | 149.6 | -46.9 | -63 | 137.8 | 0 | 0 | 117.9 | S88 I92 | S88-E90 PolarHBondContact O-N 3.22Å; E90-I92 PolarHBondContact O-N 3.39Å | ||
| 91 | P | 69.7 | Low | 59.1 | Low | 122 Ų | 122 | 151.1 Ų | 151.1 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | trans | -74.8 | 116.7 | 156.7 | 30.3 | -29.3 | 0 | 0 | 0 | 110.3 | S93 | P91-S93 PolarHBondContact O-N 3.17Š| ||
| 92 | I | 68.2 | Low | 59.2 | Low | 170 Ų | 170 | 157.7 Ų | 157.7 | 87% | 0.872 | 82% | 0.817 | S | S | * | * | trans | -53.2 | 126.8 | 157.8 | 44.4 | 149.6 | 0 | 0 | 0 | 110.7 | E90 | E90-I92 PolarHBondContact O-N 3.39Š| ||
| 93 | S | 66.1 | Low | 59.9 | Low | 105 Ų | 105 | 153.8 Ų | 153.8 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -157.6 | 120.9 | 163.4 | -172.7 | 0 | 0 | 0 | 0 | 112.3 | P91 | P91-S93 PolarHBondContact O-N 3.17Š| ||
| 94 | T | 58.4 | Low | 60.3 | Low | 210 Ų | 210 | 150.4 Ų | 150.4 | 100% | 1.288 | 81% | 0.81 | S | S | * | * | trans | 70.3 | 0 | 153.8 | -41.4 | 0 | 0 | 0 | 0 | 119 |
Retrieved 94 of 94 residues in 88.3 ms
(Link to these results)