| 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 | 42.4 | Very low | 46.4 | Very low | 247 Ų | 247 | 179.3 Ų | 179.3 | 100% | 1.217 | 90% | 0.898 | S | S | * | * | 0 | 101.2 | 0 | -94.4 | 161.8 | 176.3 | 0 | 0 | 108.8 | |||||
| 2 | T | 45.4 | Very low | 46.8 | Very low | 142 Ų | 142 | 173.8 Ų | 173.8 | 87% | 0.871 | 89% | 0.89 | S | S | * | * | trans | -120.6 | 118.9 | 176.4 | 35.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 3 | R | 41.3 | Very low | 47.2 | Very low | 250 Ų | 250 | 175.2 Ų | 175.2 | 94% | 0.943 | 89% | 0.89 | S | S | * | * | trans | -65 | 123.4 | -176.4 | -82.4 | 151.9 | 62 | 162.2 | -3.3 | 110.5 | A5 | R3-A5 PolarHBondContact O-N 2.98Š| ||
| 4 | W | 44.1 | Very low | 48.1 | Very low | 252 Ų | 252 | 176.4 Ų | 176.4 | 96% | 0.955 | 89% | 0.886 | S | S | * | * | trans | -80.1 | 108.8 | 162.4 | -105.8 | -53.7 | 0 | 0 | 0 | 109.6 | ||||
| 5 | A | 47.1 | Very low | 49.1 | Very low | 95 Ų | 95 | 170.8 Ų | 170.8 | 79% | 0.785 | 88% | 0.878 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 124.1 | 167.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | R3 | R3-A5 PolarHBondContact O-N 2.98Š|
| 6 | R | 50.7 | Low | 50.2 | Low | 238 Ų | 238 | 170.7 Ų | 170.7 | 90% | 0.898 | 88% | 0.879 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 118.4 | 166.7 | -67.4 | -176.8 | -179.4 | -173.9 | -0.1 | 107.8 | N8 | R6-N8 PolarHBondContact O-N 2.83Š|
| 7 | K | 45.1 | Very low | 51.2 | Low | 210 Ų | 210 | 170.1 Ų | 170.1 | 91% | 0.913 | 88% | 0.878 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 123.6 | 167.6 | -94.9 | 180 | 171.7 | 178.4 | 0 | 108.6 | A9 | K7-A9 PolarHBondContact O-N 3.09Š|
| 8 | N | 49.3 | Very low | 52.2 | Low | 160 Ų | 160 | 165.8 Ų | 165.8 | 86% | 0.856 | 87% | 0.872 | S | S | * | * | trans | -74.1 | 113 | 165.5 | -76.4 | -19 | 0 | 0 | 0 | 108.3 | R6 A10 | R6-N8 PolarHBondContact O-N 2.83Å; N8-A10 PolarHBondContact O-N 2.8Å | ||
| 9 | A | 46.2 | Very low | 53.5 | Low | 104 Ų | 104 | 162.4 Ų | 162.4 | 86% | 0.86 | 86% | 0.858 | S | S | * | * | trans | -85.7 | 92.2 | 169.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | K7 H11 | K7-A9 PolarHBondContact O-N 3.09Å; A9-H11 VanDerWaalsContact C-N 3.34Å; A9-H11 PolarHBondContact O-N 3.09Å | ||
| 10 | A | 51.8 | Low | 54.5 | Low | 87 Ų | 87 | 158.3 Ų | 158.3 | 72% | 0.719 | 84% | 0.841 | S | S | * | * | trans | -83.8 | 80.1 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109 | N8 | N8-A10 PolarHBondContact O-N 2.8Š| ||
| 11 | H | 46.9 | Very low | 54.5 | Low | 187 Ų | 187 | 160.1 Ų | 160.1 | 87% | 0.866 | 84% | 0.837 | S | S | * | * | trans | -143.1 | 97.8 | 155.5 | -87.1 | -67.3 | 0 | 0 | 0 | 107.3 | A9 E13 | A9-H11 VanDerWaalsContact C-N 3.34Å; A9-H11 PolarHBondContact O-N 3.09Å; H11-E13 PolarHBondContact O-N 2.97Å | ||
| 12 | S | 51.2 | Low | 55.6 | Low | 114 Ų | 114 | 154.8 Ų | 154.8 | 80% | 0.797 | 81% | 0.809 | S | S | * | * | trans | -78 | 93.9 | 176.6 | 54.9 | 0 | 0 | 0 | 0 | 109.8 | K14 | S12-K14 PolarHBondContact O-N 3.37Š| ||
| 13 | E | 52.5 | Low | 56.3 | Low | 192 Ų | 192 | 154.4 Ų | 154.4 | 90% | 0.897 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 119.8 | 150 | -75.5 | -166.4 | 164.2 | 0 | 0 | 106.9 | H11 A15 | H11-E13 PolarHBondContact O-N 2.97Å; E13-A15 PolarHBondContact O-N 3.19Å |
| 14 | K | 59.9 | Low | 57.2 | Low | 191 Ų | 191 | 150 Ų | 150 | 83% | 0.83 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 125.6 | 179.7 | -71.1 | 171 | 178.6 | 173.7 | 0 | 108.1 | S12 L16 | S12-K14 PolarHBondContact O-N 3.37Å; K14-L16 PolarHBondContact O-N 3.22Å |
| 15 | A | 62.6 | Low | 57.8 | Low | 93 Ų | 93 | 142 Ų | 142 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 124 | 166.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | E13 D17 | E13-A15 PolarHBondContact O-N 3.19Å; A15-D17 PolarHBondContact O-N 3.17Å |
| 16 | L | 66.6 | Low | 57.7 | Low | 169 Ų | 169 | 145.6 Ų | 145.6 | 89% | 0.885 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 136.3 | 171.7 | -65.1 | 172.4 | 0 | 0 | 0 | 108.3 | K14 | K14-L16 PolarHBondContact O-N 3.22Š|
| 17 | D | 68 | Low | 57.3 | Low | 161 Ų | 161 | 137.9 Ų | 137.9 | 86% | 0.861 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 137.8 | -178.7 | -73.9 | -42.2 | 0 | 0 | 0 | 110.7 | A15 T19 | A15-D17 PolarHBondContact O-N 3.17Å; D17-T19 PolarHBondContact O-N 2.9Å |
| 18 | A | 69.3 | Low | 57.4 | Low | 93 Ų | 93 | 133.2 Ų | 133.2 | 77% | 0.769 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 136.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 19 | T | 76.4 | Confident | 56.8 | Low | 100 Ų | 100 | 130.3 Ų | 130.3 | 61% | 0.613 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -58 | 129.1 | 177.1 | 37 | 0 | 0 | 0 | 0 | 110.7 | D17 | D17-T19 PolarHBondContact O-N 2.9Š|
| 20 | P | 73.8 | Confident | 56.1 | Low | 80 Ų | 80 | 137 Ų | 137 | 52% | 0.519 | 75% | 0.749 | S | S | . | * | P | Polyproline II helix | trans | -63.2 | 139.8 | -178.9 | -22.9 | 33.5 | 0 | 0 | 0 | 112.3 | E22 E23 | P20-E22 PolarHBondContact O-N 2.88Å; P20-E23 PolarHBondContact O-N 3.39Å; P20-E23 VanDerWaalsContact O-N 3.1Å |
| 21 | W | 53.3 | Low | 55.1 | Low | 198 Ų | 198 | 141.7 Ų | 141.7 | 75% | 0.75 | 76% | 0.756 | S | S | * | * | H | α-helix | trans | -53.6 | -27 | -175.7 | 128.7 | -84.8 | 0 | 0 | 0 | 114.5 | E23 M24 V25 | W21-E23 VanDerWaalsContact C-N 3.29Å; W21-E23 PolarHBondContact O-N 3.13Å; W21-M24 PolarHBondContact O-N 3.22Å; W21-V25 HydrophobicContact CD2-CG2 4.18Å; W21-V25 HydrophobicContact CE3-CG2 3.93Å; W21-V25 HydrophobicContact CH2-CG2 3.66Å; W21-V25 HydrophobicContact CZ2-CG2 3.9Å; W21-V25 HydrophobicContact CZ3-CG2 3.67Å |
| 22 | E | 65.5 | Low | 54.4 | Low | 134 Ų | 134 | 139.1 Ų | 139.1 | 63% | 0.626 | 75% | 0.754 | S | S | * | * | H | α-helix | trans | -70 | -23.9 | -177.1 | -61.5 | -178.4 | 167.2 | 0 | 0 | 113.3 | P20 | P20-E22 PolarHBondContact O-N 2.88Å |
| 23 | E | 61.1 | Low | 53.5 | Low | 135 Ų | 135 | 138 Ų | 138 | 63% | 0.631 | 75% | 0.751 | S | S | * | * | H | α-helix | trans | -80.7 | -30.3 | 179.3 | -65.6 | -173.2 | 162.4 | 0 | 0 | 112.3 | P20 W21 V25 | P20-E23 PolarHBondContact O-N 3.39Å; P20-E23 VanDerWaalsContact O-N 3.1Å; W21-E23 VanDerWaalsContact C-N 3.29Å; W21-E23 PolarHBondContact O-N 3.13Å; E23-V25 VanDerWaalsContact C-N 3.34Å; E23-V25 PolarHBondContact O-N 3.36Å |
| 24 | M | 60.1 | Low | 52.4 | Low | 158 Ų | 158 | 139.3 Ų | 139.3 | 78% | 0.778 | 75% | 0.754 | S | S | * | * | H | α-helix | trans | -71.6 | -26.9 | 175.8 | -96.9 | -173.9 | -178.8 | 0 | 0 | 113.3 | W21 | W21-M24 PolarHBondContact O-N 3.22Å |
| 25 | V | 55.6 | Low | 50.9 | Low | 83 Ų | 83 | 133.8 Ų | 133.8 | 50% | 0.503 | 75% | 0.751 | S | S | . | * | H | α-helix | trans | -79.7 | -27 | -178.4 | 178.3 | 0 | 0 | 0 | 0 | 112 | W21 E23 G27 | W21-V25 HydrophobicContact CD2-CG2 4.18Å; W21-V25 HydrophobicContact CE3-CG2 3.93Å; W21-V25 HydrophobicContact CH2-CG2 3.66Å; W21-V25 HydrophobicContact CZ2-CG2 3.9Å; W21-V25 HydrophobicContact CZ3-CG2 3.67Å; E23-V25 VanDerWaalsContact C-N 3.34Å; E23-V25 PolarHBondContact O-N 3.36Å; V25-G27 VanDerWaalsContact C-N 3.3Å; V25-G27 PolarHBondContact O-N 3.46Å |
| 26 | K | 46.1 | Very low | 49.3 | Very low | 171 Ų | 171 | 138.5 Ų | 138.5 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | G | 310 helix | trans | -77.8 | -9.7 | -179.9 | -76.5 | 175 | 179.6 | 168.6 | 0 | 114.3 | S28 | K26-S28 VanDerWaalsContact C-N 3.32Å; K26-S28 PolarHBondContact O-N 3.5Å |
| 27 | G | 43 | Very low | 47.4 | Very low | 75 Ų | 75 | 139.2 Ų | 139.2 | 77% | 0.773 | 75% | 0.753 | S | S | * | * | G | 310 helix | trans | -78.9 | -0.4 | -178 | 0 | 0 | 0 | 0 | 0 | 116.4 | V25 | V25-G27 VanDerWaalsContact C-N 3.3Å; V25-G27 PolarHBondContact O-N 3.46Å |
| 28 | S | 45.8 | Very low | 45.6 | Very low | 113 Ų | 113 | 135.2 Ų | 135.2 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -116.4 | 20.7 | -171.9 | -165.7 | 0 | 0 | 0 | 0 | 115.9 | K26 | K26-S28 VanDerWaalsContact C-N 3.32Å; K26-S28 PolarHBondContact O-N 3.5Å |
| 29 | S | 36.7 | Very low | 43.7 | Very low | 99 Ų | 99 | 138.6 Ų | 138.6 | 69% | 0.692 | 76% | 0.755 | S | S | * | * | trans | -150.7 | 101.6 | 175.3 | 66 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 30 | R | 31.8 | Very low | 41.6 | Very low | 245 Ų | 245 | 140.7 Ų | 140.7 | 93% | 0.925 | 76% | 0.763 | S | S | * | * | trans | -174.2 | 115.3 | 143 | -103.6 | 166.7 | 172.9 | -179 | -3.2 | 105 | ||||
| 31 | E | 31.5 | Very low | 39.6 | Very low | 185 Ų | 185 | 142.6 Ų | 142.6 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | -141.3 | 132.7 | 78.1 | -75.8 | 172.7 | 155.5 | 0 | 0 | 114.6 | |||||
| 32 | T | 31.4 | Very low | 38.7 | Very low | 133 Ų | 133 | 138.6 Ų | 138.6 | 82% | 0.816 | 78% | 0.78 | S | S | * | * | trans | 9.4 | 159.8 | 145.6 | 53.4 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 33 | A | 32.6 | Very low | 37.8 | Very low | 89 Ų | 89 | 137.5 Ų | 137.5 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | cis | 171.4 | 142.7 | -22 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 34 | K | 29.3 | Very low | 36.1 | Very low | 221 Ų | 221 | 138.1 Ų | 138.1 | 96% | 0.961 | 79% | 0.791 | S | S | * | * | trans | 140.4 | 131.8 | 159.1 | -87.1 | 175.7 | 175.9 | 177.5 | 0 | 109.3 | ||||
| 35 | G | 28.2 | Very low | 34.9 | Very low | 74 Ų | 74 | 135.2 Ų | 135.2 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | cis | 166.6 | 158.1 | 0.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 36 | K | 29.8 | Very low | 33.8 | Very low | 192 Ų | 192 | 138.7 Ų | 138.7 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | 87.8 | 107.1 | 162.2 | -73.8 | -173.1 | 169.5 | -174 | 0 | 122.5 | ||||
| 37 | E | 27.2 | Very low | 33.1 | Very low | 184 Ų | 184 | 139.6 Ų | 139.6 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | 54.2 | 130.7 | 119.9 | -64.5 | 179.8 | 153.2 | 0 | 0 | 122.5 | |||||
| 38 | G | 28.4 | Very low | 32.6 | Very low | 78 Ų | 78 | 145.3 Ų | 145.3 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | trans | 150.5 | 81.3 | 149.5 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 39 | N | 29.8 | Very low | 31.9 | Very low | 164 Ų | 164 | 148.5 Ų | 148.5 | 88% | 0.877 | 81% | 0.811 | S | S | * | * | trans | 50.8 | 148.5 | 140.5 | -111.8 | -21.7 | 0 | 0 | 0 | 125.7 | ||||
| 40 | N | 32.8 | Very low | 32.1 | Very low | 144 Ų | 144 | 151.2 Ų | 151.2 | 77% | 0.77 | 81% | 0.813 | S | S | * | * | trans | -68.7 | 145.3 | -172.6 | -69.3 | -57.6 | 0 | 0 | 0 | 116.6 | ||||
| 41 | S | 31.9 | Very low | 32.4 | Very low | 120 Ų | 120 | 147.3 Ų | 147.3 | 84% | 0.839 | 81% | 0.806 | S | S | * | * | 160 | 134.7 | 118.7 | 51.2 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 42 | S | 34.8 | Very low | 32.7 | Very low | 114 Ų | 114 | 147.2 Ų | 147.2 | 80% | 0.797 | 80% | 0.802 | S | S | * | * | trans | -87.3 | 175.4 | 166.2 | -53.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 43 | P | 46 | Very low | 33.1 | Very low | 110 Ų | 110 | 149.5 Ų | 149.5 | 71% | 0.714 | 80% | 0.801 | S | S | * | * | cis | -144.7 | -173.7 | 13.2 | 34.3 | -9.7 | 0 | 0 | 0 | 115.8 | ||||
| 44 | L | 26.2 | Very low | 33.4 | Very low | 149 Ų | 149 | 154.8 Ų | 154.8 | 78% | 0.78 | 81% | 0.807 | S | S | * | * | trans | 112.9 | 111.7 | 152.3 | -66.5 | 153.4 | 0 | 0 | 0 | 118.2 | ||||
| 45 | S | 35.2 | Very low | 34 | Very low | 97 Ų | 97 | 154 Ų | 154 | 68% | 0.678 | 80% | 0.804 | S | S | * | * | 50.7 | 124.5 | 129.6 | -56.5 | 0 | 0 | 0 | 0 | 119.7 | |||||
| 46 | L | 32.2 | Very low | 34.8 | Very low | 156 Ų | 156 | 159.7 Ų | 159.7 | 82% | 0.817 | 81% | 0.808 | S | S | * | * | -178.1 | 126.4 | 124.8 | -92.2 | 156.8 | 0 | 0 | 0 | 111.7 | |||||
| 47 | K | 31.1 | Very low | 35.7 | Very low | 190 Ų | 190 | 158.2 Ų | 158.2 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | trans | 36.3 | 100.8 | 149.9 | -67.7 | 173.6 | 178.3 | 174.7 | 0 | 118 | E49 | K47-E49 PolarHBondContact O-N 3.02Š| ||
| 48 | K | 31.1 | Very low | 36.9 | Very low | 194 Ų | 194 | 157.8 Ų | 157.8 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | trans | -83.6 | 88.9 | 161.5 | -159.7 | 169.1 | -170 | 168.5 | 0 | 109.1 | Q50 | K48-Q50 PolarHBondContact O-N 2.9Å; K48-Q50 VanDerWaalsContact O-N 3.16Å | ||
| 49 | E | 32.4 | Very low | 38.1 | Very low | 180 Ų | 180 | 163.2 Ų | 163.2 | 84% | 0.841 | 81% | 0.805 | S | S | * | * | trans | -59.6 | 113.9 | 159.6 | -81 | -155 | 131.8 | 0 | 0 | 108.1 | K47 E51 | K47-E49 PolarHBondContact O-N 3.02Å; E49-E51 PolarHBondContact O-N 3.28Å; E49-E51 VanDerWaalsContact O-N 3.16Å | ||
| 50 | Q | 40.2 | Very low | 39.2 | Very low | 156 Ų | 156 | 163.4 Ų | 163.4 | 73% | 0.729 | 80% | 0.799 | S | S | * | * | trans | -79.8 | 92.4 | 170.1 | -71.6 | -176.3 | -8.7 | 0 | 0 | 108 | K48 K52 | K48-Q50 PolarHBondContact O-N 2.9Å; K48-Q50 VanDerWaalsContact O-N 3.16Å; Q50-K52 VanDerWaalsContact C-N 3.27Å; Q50-K52 PolarHBondContact O-N 3.45Å | ||
| 51 | E | 37.3 | Very low | 40.4 | Very low | 164 Ų | 164 | 164.4 Ų | 164.4 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | trans | -57.8 | 95.4 | 157.4 | -83.1 | -165.8 | 133.8 | 0 | 0 | 108.6 | E49 K53 | E49-E51 PolarHBondContact O-N 3.28Å; E49-E51 VanDerWaalsContact O-N 3.16Å; E51-K53 PolarHBondContact O-N 3.42Å | ||
| 52 | K | 39.6 | Very low | 41.4 | Very low | 183 Ų | 183 | 166.1 Ų | 166.1 | 80% | 0.796 | 80% | 0.796 | S | S | * | * | trans | -69 | 86.3 | 164.6 | -80.1 | 179.4 | 178.7 | 170.3 | 0 | 107.7 | Q50 K54 | Q50-K52 VanDerWaalsContact C-N 3.27Å; Q50-K52 PolarHBondContact O-N 3.45Å; K52-K54 PolarHBondContact O-N 3.33Å | ||
| 53 | K | 38.4 | Very low | 42.4 | Very low | 180 Ų | 180 | 168.2 Ų | 168.2 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | trans | -50.9 | 109 | 166.5 | -79.7 | -178.4 | 177 | 174.5 | 0 | 108.5 | E51 K55 | E51-K53 PolarHBondContact O-N 3.42Å; K53-K55 PolarHBondContact O-N 3.45Å; K53-K55 VanDerWaalsContact O-N 3.08Å | ||
| 54 | K | 38.7 | Very low | 43.1 | Very low | 200 Ų | 200 | 168.9 Ų | 168.9 | 87% | 0.87 | 78% | 0.784 | S | S | * | * | trans | -47.5 | 115.6 | 172.2 | -77 | 177.3 | 174.9 | 176.3 | 0 | 108.2 | K52 K56 | K52-K54 PolarHBondContact O-N 3.33Å; K54-K56 PolarHBondContact O-N 3.37Å | ||
| 55 | K | 41.8 | Very low | 44.8 | Very low | 204 Ų | 204 | 165.4 Ų | 165.4 | 89% | 0.887 | 77% | 0.767 | S | S | * | * | trans | -60.7 | 100.5 | 168 | -84.9 | 179.8 | 176 | 173.7 | 0 | 106.8 | K53 N57 | K53-K55 PolarHBondContact O-N 3.45Å; K53-K55 VanDerWaalsContact O-N 3.08Å; K55-N57 PolarHBondContact O-N 2.96Å | ||
| 56 | K | 45.1 | Very low | 46.2 | Very low | 195 Ų | 195 | 167.1 Ų | 167.1 | 85% | 0.848 | 76% | 0.764 | S | S | * | * | trans | -53.2 | 127.1 | 169.9 | -69.5 | -177.6 | 177.7 | -180 | 0 | 107.3 | K54 K58 | K54-K56 PolarHBondContact O-N 3.37Å; K56-K58 PolarHBondContact O-N 3.12Å | ||
| 57 | N | 48.4 | Very low | 47.5 | Very low | 160 Ų | 160 | 162.8 Ų | 162.8 | 86% | 0.856 | 74% | 0.741 | S | S | * | * | trans | -49.5 | 111.3 | 174.1 | -78.8 | -23.4 | 0 | 0 | 0 | 107.8 | K55 K59 | K55-N57 PolarHBondContact O-N 2.96Å; N57-K59 PolarHBondContact O-N 2.96Å | ||
| 58 | K | 53.6 | Low | 48.8 | Very low | 176 Ų | 176 | 159 Ų | 159 | 77% | 0.765 | 73% | 0.734 | S | S | * | * | trans | -64.8 | 105.8 | -175.5 | -159.7 | 169.9 | -172.9 | 171.8 | 0 | 105.9 | K56 K60 | K56-K58 PolarHBondContact O-N 3.12Å; K58-K60 PolarHBondContact O-N 3.47Å | ||
| 59 | K | 53.1 | Low | 50.4 | Low | 191 Ų | 191 | 156.7 Ų | 156.7 | 83% | 0.83 | 73% | 0.731 | S | S | * | * | trans | -45.9 | 133.3 | 170.6 | -75.2 | -176.7 | 177.7 | -177.2 | 0 | 106.8 | N57 K61 | N57-K59 PolarHBondContact O-N 2.96Å; K59-K61 PolarHBondContact O-N 3.25Å | ||
| 60 | K | 52.5 | Low | 52.1 | Low | 169 Ų | 169 | 149 Ų | 149 | 74% | 0.735 | 70% | 0.699 | S | S | * | * | trans | -50.9 | 116.9 | 176.7 | -149.5 | 178.3 | -169.8 | 178.9 | 0 | 105.8 | K58 D62 | K58-K60 PolarHBondContact O-N 3.47Å; K60-D62 PolarHBondContact O-N 3.2Å | ||
| 61 | K | 57.9 | Low | 53.4 | Low | 165 Ų | 165 | 147.4 Ų | 147.4 | 72% | 0.717 | 69% | 0.69 | S | S | * | * | trans | -55.3 | 117 | -177.7 | -79.7 | -174.8 | 172.5 | -171.1 | 0 | 106.5 | K59 Y63 | K59-K61 PolarHBondContact O-N 3.25Å; K61-Y63 VanDerWaalsContact C-N 3.33Å; K61-Y63 PolarHBondContact O-N 3.32Å | ||
| 62 | D | 54.3 | Low | 54.8 | Low | 155 Ų | 155 | 143.5 Ų | 143.5 | 83% | 0.829 | 67% | 0.673 | S | S | * | * | trans | -58.7 | 108 | 167.2 | -74 | -37.3 | 0 | 0 | 0 | 105.4 | K60 L64 | K60-D62 PolarHBondContact O-N 3.2Å; D62-L64 PolarHBondContact O-N 3.15Å | ||
| 63 | Y | 54.5 | Low | 56.1 | Low | 158 Ų | 158 | 140.5 Ų | 140.5 | 62% | 0.62 | 66% | 0.662 | S | S | * | * | trans | -79.7 | 86.3 | -174.4 | -167.1 | -79.3 | 0 | 0 | 0 | 105 | K61 N65 R113 | K61-Y63 VanDerWaalsContact C-N 3.33Å; K61-Y63 PolarHBondContact O-N 3.32Å; Y63-N65 PolarHBondContact O-N 3.1Å; Y63-R113 VanDerWaalsContact CB-NH2 3.32Å; Y63-R113 PolarHBondContact O-NH2 2.86Å | ||
| 64 | L | 61.4 | Low | 57.6 | Low | 124 Ų | 124 | 139.1 Ų | 139.1 | 65% | 0.649 | 65% | 0.653 | S | S | * | * | trans | -54.4 | 127.3 | 168.9 | -77.1 | 161.6 | 0 | 0 | 0 | 106.7 | D62 E66 | D62-L64 PolarHBondContact O-N 3.15Å; L64-E66 HydrophobicContact CB-CG 4.14Å; L64-E66 PolarHBondContact O-N 3.09Å | ||
| 65 | N | 61.9 | Low | 58.9 | Low | 77 Ų | 77 | 131.9 Ų | 131.9 | 41% | 0.412 | 62% | 0.623 | S | S | . | * | trans | -75.6 | 61.7 | 175.4 | -166.1 | 38.4 | 0 | 0 | 0 | 108.5 | Y63 E110 | Y63-N65 PolarHBondContact O-N 3.1Å; N65-E110 VanDerWaalsContact CG-CD 3.41Å; N65-E110 WeakPolarHBondContact ND2-CG 3.47Å; N65-E110 PolarHBondContact ND2-OE1 3.33Å | ||
| 66 | E | 63.8 | Low | 60.1 | Low | 133 Ų | 133 | 128.3 Ų | 128.3 | 62% | 0.621 | 61% | 0.608 | S | S | * | * | trans | -76 | 139.4 | 168.9 | -75 | 168.1 | -170.7 | 0 | 0 | 107.4 | L64 V68 | L64-E66 HydrophobicContact CB-CG 4.14Å; L64-E66 PolarHBondContact O-N 3.09Å; E66-V68 VanDerWaalsContact O-CG2 3.23Å; E66-V68 WeakPolarHBondContact O-CG2 3.48Å; E66-V68 PolarHBondContact O-N 3.23Å | ||
| 67 | D | 60.1 | Low | 61.1 | Low | 64 Ų | 64 | 124.1 Ų | 124.1 | 34% | 0.342 | 59% | 0.591 | S | S | . | * | trans | -68.4 | 83 | 179.8 | -178.5 | 16.2 | 0 | 0 | 0 | 110 | N69 G70 F71 M72 | D67-N69 PolarHBondContact O-N 3.33Å; D67-N69 VanDerWaalsContact O-N 3.08Å; D67-G70 PolarHBondContact O-N 3.2Å; D67-G70 VanDerWaalsContact O-N 3.13Å; D67-G70 PolarHBondContact OD1-N 3.25Å; D67-G70 VanDerWaalsContact OD2-CA 3.27Å; D67-G70 WeakPolarHBondContact OD2-CA 3.44Å; D67-F71 PolarHBondContact OD1-N 3.26Å; D67-F71 PolarHBondContact OD2-N 2.91Å; D67-M72 WeakPolarHBondContact OD2-CA 3.33Å; D67-M72 VanDerWaalsContact OD2-CB 3.27Å; D67-M72 WeakPolarHBondContact OD2-CB 3.46Å; D67-M72 PolarHBondContact OD2-N 3.37Å | ||
| 68 | V | 59.5 | Low | 61.7 | Low | 112 Ų | 112 | 118.7 Ų | 118.7 | 68% | 0.679 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.3 | -23.2 | -173.5 | -172.2 | 0 | 0 | 0 | 0 | 112.4 | E66 | E66-V68 VanDerWaalsContact O-CG2 3.23Å; E66-V68 WeakPolarHBondContact O-CG2 3.48Å; E66-V68 PolarHBondContact O-N 3.23Å |
| 69 | N | 64.1 | Low | 61.7 | Low | 145 Ų | 145 | 112.4 Ų | 112.4 | 78% | 0.775 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.6 | 3.7 | -176 | -71.3 | 26.9 | 0 | 0 | 0 | 112.9 | D67 F71 | D67-N69 PolarHBondContact O-N 3.33Å; D67-N69 VanDerWaalsContact O-N 3.08Å; N69-F71 PolarHBondContact O-N 2.95Å |
| 70 | G | 68.4 | Low | 61.7 | Low | 17 Ų | 17 | 110.6 Ų | 110.6 | 18% | 0.175 | 54% | 0.541 | C | S | . | . | trans | 55.7 | 33 | -174.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | D67 E73 Y74 | D67-G70 PolarHBondContact O-N 3.2Å; D67-G70 VanDerWaalsContact O-N 3.13Å; D67-G70 PolarHBondContact OD1-N 3.25Å; D67-G70 VanDerWaalsContact OD2-CA 3.27Å; D67-G70 WeakPolarHBondContact OD2-CA 3.44Å; G70-E73 CarbonylContact O-C 3.53Å; G70-E73 PolarHBondContact O-N 2.94Å; G70-Y74 WeakPolarHBondContact O-CB 3.48Å; G70-Y74 PolarHBondContact O-N 2.88Å | ||
| 71 | F | 67.6 | Low | 61.7 | Low | 124 Ų | 124 | 105.4 Ų | 105.4 | 54% | 0.544 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.9 | -36 | -179.2 | -178.9 | -104 | 0 | 0 | 0 | 112.4 | D67 N69 L75 | D67-F71 PolarHBondContact OD1-N 3.26Å; D67-F71 PolarHBondContact OD2-N 2.91Å; N69-F71 PolarHBondContact O-N 2.95Å; F71-L75 HydrophobicContact CD1-CD1 4.09Å; F71-L75 HydrophobicContact CE1-CD1 3.65Å; F71-L75 HydrophobicContact CZ-CD1 4.05Å; F71-L75 PolarHBondContact O-N 3.28Å |
| 72 | M | 65.7 | Low | 61.1 | Low | 82 Ų | 82 | 103.2 Ų | 103.2 | 40% | 0.404 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -71.1 | -36.6 | 171.1 | -67.7 | -163.8 | 58.5 | 0 | 0 | 111.9 | D67 K76 L103 | D67-M72 WeakPolarHBondContact OD2-CA 3.33Å; D67-M72 VanDerWaalsContact OD2-CB 3.27Å; D67-M72 WeakPolarHBondContact OD2-CB 3.46Å; D67-M72 PolarHBondContact OD2-N 3.37Å; M72-K76 WeakPolarHBondContact O-CG 3.27Å; M72-K76 PolarHBondContact O-N 2.94Å; M72-K76 VanDerWaalsContact O-N 3.11Å; M72-L103 HydrophobicContact CE-CD2 3.68Å; M72-L103 HydrophobicContact SD-CD2 4.45Å |
| 73 | E | 67.3 | Low | 60.4 | Low | 119 Ų | 119 | 106 Ų | 106 | 56% | 0.556 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67.7 | -40.3 | 171.9 | -81.6 | -175.9 | 163.2 | 0 | 0 | 111.7 | G70 L75 K76 Q77 | G70-E73 CarbonylContact O-C 3.53Å; G70-E73 PolarHBondContact O-N 2.94Å; E73-L75 VanDerWaalsContact C-N 3.34Å; E73-L75 PolarHBondContact O-N 3.23Å; E73-K76 CarbonylContact O-C 3.58Å; E73-K76 WeakPolarHBondContact O-CB 3.48Å; E73-K76 PolarHBondContact O-N 3.49Å; E73-K76 VanDerWaalsContact O-N 3.15Å; E73-Q77 VanDerWaalsContact O-CB 3.3Å; E73-Q77 WeakPolarHBondContact O-CB 3.46Å; E73-Q77 VanDerWaalsContact O-CG 3.26Å; E73-Q77 WeakPolarHBondContact O-CG 3.4Å; E73-Q77 PolarHBondContact O-N 3.31Å |
| 74 | Y | 69.8 | Low | 59.8 | Low | 152 Ų | 152 | 108 Ų | 108 | 60% | 0.596 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.4 | -38.7 | 175.3 | 175.5 | -101.6 | 0 | 0 | 0 | 111.2 | G70 Q77 A78 | G70-Y74 WeakPolarHBondContact O-CB 3.48Å; G70-Y74 PolarHBondContact O-N 2.88Å; Y74-Q77 PolarHBondContact O-N 3.5Å; Y74-A78 WeakPolarHBondContact O-CA 3.44Å; Y74-A78 WeakPolarHBondContact O-CB 3.3Å; Y74-A78 PolarHBondContact O-N 3.45Å |
| 75 | L | 66 | Low | 59.1 | Low | 47 Ų | 47 | 106.4 Ų | 106.4 | 25% | 0.246 | 55% | 0.554 | C | S | . | * | H | α-helix | trans | -63.8 | -42.4 | 171.7 | -85.6 | 161.4 | 0 | 0 | 0 | 112 | F71 E73 S79 A102 | F71-L75 HydrophobicContact CD1-CD1 4.09Å; F71-L75 HydrophobicContact CE1-CD1 3.65Å; F71-L75 HydrophobicContact CZ-CD1 4.05Å; F71-L75 PolarHBondContact O-N 3.28Å; E73-L75 VanDerWaalsContact C-N 3.34Å; E73-L75 PolarHBondContact O-N 3.23Å; L75-S79 PolarHBondContact O-N 3.19Å; L75-S79 PolarHBondContact O-OG 3.5Å; L75-A102 HydrophobicContact CD1-CB 4.27Å |
| 76 | K | 66.8 | Low | 58.2 | Low | 130 Ų | 130 | 110.6 Ų | 110.6 | 57% | 0.565 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67.1 | -35.6 | 175.6 | -71.3 | 172.7 | -178.9 | 179.4 | 0 | 112.8 | M72 E73 S79 Q80 | M72-K76 WeakPolarHBondContact O-CG 3.27Å; M72-K76 PolarHBondContact O-N 2.94Å; M72-K76 VanDerWaalsContact O-N 3.11Å; E73-K76 CarbonylContact O-C 3.58Å; E73-K76 WeakPolarHBondContact O-CB 3.48Å; E73-K76 PolarHBondContact O-N 3.49Å; E73-K76 VanDerWaalsContact O-N 3.15Å; K76-S79 VanDerWaalsContact C-OG 3.29Å; K76-S79 WeakPolarHBondContact CA-OG 3.4Å; K76-S79 PolarHBondContact O-OG 3.38Å; K76-Q80 VanDerWaalsContact O-CG 3.3Å; K76-Q80 WeakPolarHBondContact O-CG 3.47Å; K76-Q80 PolarHBondContact O-N 3.16Å |
| 77 | Q | 65.6 | Low | 57.3 | Low | 106 Ų | 106 | 110.8 Ų | 110.8 | 50% | 0.495 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -80.3 | -35.2 | 178.5 | -73 | 173.9 | 16.8 | 0 | 0 | 111.5 | E73 Y74 S79 Q80 A81 | E73-Q77 VanDerWaalsContact O-CB 3.3Å; E73-Q77 WeakPolarHBondContact O-CB 3.46Å; E73-Q77 VanDerWaalsContact O-CG 3.26Å; E73-Q77 WeakPolarHBondContact O-CG 3.4Å; E73-Q77 PolarHBondContact O-N 3.31Å; Y74-Q77 PolarHBondContact O-N 3.5Å; Q77-S79 VanDerWaalsContact C-N 3.31Å; Q77-Q80 CarbonylContact O-C 3.56Å; Q77-Q80 WeakPolarHBondContact O-CA 3.45Å; Q77-Q80 WeakPolarHBondContact O-CB 3.49Å; Q77-Q80 PolarHBondContact O-N 2.88Å; Q77-A81 VanDerWaalsContact O-CB 3.29Å; Q77-A81 WeakPolarHBondContact O-CB 3.27Å; Q77-A81 PolarHBondContact O-N 3.01Å |
| 78 | A | 61.7 | Low | 56.8 | Low | 46 Ų | 46 | 112.6 Ų | 112.6 | 38% | 0.38 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69.5 | -29.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y74 Q80 | Y74-A78 WeakPolarHBondContact O-CA 3.44Å; Y74-A78 WeakPolarHBondContact O-CB 3.3Å; Y74-A78 PolarHBondContact O-N 3.45Å; A78-Q80 PolarHBondContact O-N 2.69Å |
| 79 | S | 54.7 | Low | 56.3 | Low | 44 Ų | 44 | 114.2 Ų | 114.2 | 31% | 0.308 | 59% | 0.59 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.2 | -21.2 | 165 | 58 | 0 | 0 | 0 | 0 | 113.4 | L75 K76 Q77 | L75-S79 PolarHBondContact O-N 3.19Å; L75-S79 PolarHBondContact O-OG 3.5Å; K76-S79 VanDerWaalsContact C-OG 3.29Å; K76-S79 WeakPolarHBondContact CA-OG 3.4Å; K76-S79 PolarHBondContact O-OG 3.38Å; Q77-S79 VanDerWaalsContact C-N 3.31Å |
| 80 | Q | 52.5 | Low | 55.6 | Low | 154 Ų | 154 | 110.4 Ų | 110.4 | 72% | 0.72 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | -23.2 | 177.5 | -71.2 | 172.5 | -4.6 | 0 | 0 | 113.2 | K76 Q77 A78 | K76-Q80 VanDerWaalsContact O-CG 3.3Å; K76-Q80 WeakPolarHBondContact O-CG 3.47Å; K76-Q80 PolarHBondContact O-N 3.16Å; Q77-Q80 CarbonylContact O-C 3.56Å; Q77-Q80 WeakPolarHBondContact O-CA 3.45Å; Q77-Q80 WeakPolarHBondContact O-CB 3.49Å; Q77-Q80 PolarHBondContact O-N 2.88Å; A78-Q80 PolarHBondContact O-N 2.69Å |
| 81 | A | 52.5 | Low | 55 | Low | 60 Ų | 60 | 114.4 Ų | 114.4 | 50% | 0.496 | 60% | 0.596 | S | S | . | * | S | Bend | trans | -125.1 | 100.4 | -171.1 | 0 | 0 | 0 | 0 | 0 | 111 | Q77 | Q77-A81 VanDerWaalsContact O-CB 3.29Å; Q77-A81 WeakPolarHBondContact O-CB 3.27Å; Q77-A81 PolarHBondContact O-N 3.01Å |
| 82 | V | 45.1 | Very low | 55.3 | Low | 118 Ų | 118 | 109.6 Ų | 109.6 | 72% | 0.715 | 58% | 0.578 | S | S | * | * | trans | 93.9 | 96.9 | 154.2 | -165.3 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 83 | R | 39.9 | Very low | 56 | Low | 213 Ų | 213 | 110.1 Ų | 110.1 | 80% | 0.804 | 59% | 0.587 | S | S | * | * | -125.9 | 138 | 117.1 | -68.3 | -65.1 | 175.7 | 147.8 | -0.9 | 109.6 | G85 | R83-G85 PolarHBondContact O-N 2.96Š| |||
| 84 | K | 41.7 | Very low | 56.5 | Low | 202 Ų | 202 | 111.1 Ų | 111.1 | 88% | 0.878 | 59% | 0.592 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.2 | 113.8 | -176.6 | -68 | 168.8 | 172.7 | 179 | 0 | 111 | E86 | K84-E86 PolarHBondContact O-N 2.79Š|
| 85 | G | 46.4 | Very low | 56.9 | Low | 89 Ų | 89 | 105.7 Ų | 105.7 | 92% | 0.918 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 80.2 | -3.9 | 157.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | R83 | R83-G85 PolarHBondContact O-N 2.96Š|
| 86 | E | 44 | Very low | 57.5 | Low | 166 Ų | 166 | 110.2 Ų | 110.2 | 78% | 0.776 | 59% | 0.588 | S | S | * | * | trans | -133.3 | 123.2 | 175.2 | -124.9 | 173.6 | 170.1 | 0 | 0 | 109.8 | K84 I88 | K84-E86 PolarHBondContact O-N 2.79Å; E86-I88 PolarHBondContact O-N 2.98Å; E86-I88 VanDerWaalsContact O-N 3.09Å | ||
| 87 | V | 43.3 | Very low | 58.5 | Low | 136 Ų | 136 | 110.6 Ų | 110.6 | 82% | 0.824 | 59% | 0.592 | S | S | * | * | trans | -75.1 | 96.8 | -177.9 | -172.5 | 0 | 0 | 0 | 0 | 107.8 | E89 | V87-E89 PolarHBondContact O-N 2.85Š| ||
| 88 | I | 50 | Low | 59.3 | Low | 103 Ų | 103 | 111.8 Ų | 111.8 | 53% | 0.528 | 60% | 0.598 | S | S | . | * | trans | -76.9 | 109 | 158.8 | -56.3 | 176.2 | 0 | 0 | 0 | 104.9 | E86 A90 | E86-I88 PolarHBondContact O-N 2.98Å; E86-I88 VanDerWaalsContact O-N 3.09Å; I88-A90 PolarHBondContact O-N 3.46Å | ||
| 89 | E | 48.8 | Very low | 60.3 | Low | 146 Ų | 146 | 112.2 Ų | 112.2 | 68% | 0.682 | 60% | 0.595 | S | S | * | * | trans | -49.3 | 139.7 | 176.6 | -83.8 | 177.5 | 146.8 | 0 | 0 | 110.3 | V87 D91 S92 | V87-E89 PolarHBondContact O-N 2.85Å; E89-D91 PolarHBondContact O-N 3.39Å; E89-S92 WeakPolarHBondContact O-CB 3.31Å; E89-S92 PolarHBondContact O-N 3.05Å | ||
| 90 | A | 50.4 | Low | 61.8 | Low | 65 Ų | 65 | 112.7 Ų | 112.7 | 54% | 0.537 | 60% | 0.602 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -56.3 | -9.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | I88 | I88-A90 PolarHBondContact O-N 3.46Š|
| 91 | D | 56 | Low | 63.5 | Low | 101 Ų | 101 | 108.5 Ų | 108.5 | 54% | 0.54 | 59% | 0.587 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -105.9 | 11.2 | 178.4 | -89 | -24.9 | 0 | 0 | 0 | 114.6 | E89 R96 | E89-D91 PolarHBondContact O-N 3.39Å; D91-R96 PolarHBondContact O-NE 3.26Å; D91-R96 IonicContact OD1-CZ 3.29Å; D91-R96 VanDerWaalsContact OD1-CZ 3.29Å; D91-R96 IonicContact OD1-NE 3.16Å; D91-R96 PolarHBondContact OD1-NE 2.93Å; D91-R96 VanDerWaalsContact OD1-NE 3.16Å; D91-R96 IonicContact OD1-NH2 2.69Å; D91-R96 PolarHBondContact OD1-NH2 3.11Å; D91-R96 IonicContact OD2-NH2 3.19Å; D91-R96 PolarHBondContact OD2-NH2 3.05Å |
| 92 | S | 74.1 | Confident | 65 | Low | 23 Ų | 23 | 107 Ų | 107 | 16% | 0.161 | 58% | 0.575 | C | S | . | * | trans | -54.2 | 134.6 | 172.7 | 173.5 | 0 | 0 | 0 | 0 | 110.7 | E89 E94 V95 R96 | E89-S92 WeakPolarHBondContact O-CB 3.31Å; E89-S92 PolarHBondContact O-N 3.05Å; S92-E94 PolarHBondContact O-N 3.43Å; S92-E94 VanDerWaalsContact O-N 3.12Å; S92-V95 PolarHBondContact O-N 3.46Å; S92-R96 PolarHBondContact O-N 2.73Å | ||
| 93 | P | 78.7 | Confident | 67 | Low | 93 Ų | 93 | 105.2 Ų | 105.2 | 60% | 0.604 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -57.2 | -29.7 | -177.7 | 22.2 | -33.4 | 0 | 0 | 0 | 112.8 | R96 E97 | P93-R96 PolarHBondContact O-N 3.27Å; P93-E97 WeakPolarHBondContact O-CB 3.38Å; P93-E97 WeakPolarHBondContact O-CG 3.39Å; P93-E97 PolarHBondContact O-N 3.4Å |
| 94 | E | 78.2 | Confident | 69.3 | Low | 140 Ų | 140 | 99.9 Ų | 99.9 | 65% | 0.654 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -68.8 | -43.1 | -179.6 | -61.6 | -177.5 | 172.5 | 0 | 0 | 112.4 | S92 R96 E97 E98 | S92-E94 PolarHBondContact O-N 3.43Å; S92-E94 VanDerWaalsContact O-N 3.12Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.28Å; E94-E97 WeakPolarHBondContact O-CB 3.46Å; E94-E97 PolarHBondContact O-N 2.87Å; E94-E98 WeakPolarHBondContact O-CG 3.34Å; E94-E98 PolarHBondContact O-N 3.26Å |
| 95 | V | 78 | Confident | 71.4 | Confident | 38 Ų | 38 | 96.5 Ų | 96.5 | 23% | 0.23 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -67.3 | -38.8 | 177.3 | -179.4 | 0 | 0 | 0 | 0 | 110.3 | S92 E98 V99 | S92-V95 PolarHBondContact O-N 3.46Å; V95-E98 PolarHBondContact O-N 3.17Å; V95-V99 HydrophobicContact CG1-CG2 4.45Å; V95-V99 WeakPolarHBondContact O-CB 3.47Å; V95-V99 VanDerWaalsContact O-CG2 3.27Å; V95-V99 WeakPolarHBondContact O-CG2 3.47Å; V95-V99 PolarHBondContact O-N 2.9Å |
| 96 | R | 79.3 | Confident | 73.2 | Confident | 141 Ų | 141 | 94.9 Ų | 94.9 | 53% | 0.532 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 174.9 | -70.2 | 174.1 | 168.3 | -175.5 | -2.9 | 111.7 | D91 S92 P93 E94 A100 | D91-R96 PolarHBondContact O-NE 3.26Å; D91-R96 IonicContact OD1-CZ 3.29Å; D91-R96 VanDerWaalsContact OD1-CZ 3.29Å; D91-R96 IonicContact OD1-NE 3.16Å; D91-R96 PolarHBondContact OD1-NE 2.93Å; D91-R96 VanDerWaalsContact OD1-NE 3.16Å; D91-R96 IonicContact OD1-NH2 2.69Å; D91-R96 PolarHBondContact OD1-NH2 3.11Å; D91-R96 IonicContact OD2-NH2 3.19Å; D91-R96 PolarHBondContact OD2-NH2 3.05Å; S92-R96 PolarHBondContact O-N 2.73Å; P93-R96 PolarHBondContact O-N 3.27Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.28Å; R96-A100 VanDerWaalsContact O-CB 3.27Å; R96-A100 WeakPolarHBondContact O-CB 3.04Å; R96-A100 PolarHBondContact O-N 3.38Å |
| 97 | E | 86.9 | Confident | 75.2 | Confident | 139 Ų | 139 | 94.7 Ų | 94.7 | 65% | 0.65 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.9 | -47.5 | 173.6 | -83.6 | -97.3 | 137.9 | 0 | 0 | 112 | P93 E94 V99 A100 V101 | P93-E97 WeakPolarHBondContact O-CB 3.38Å; P93-E97 WeakPolarHBondContact O-CG 3.39Å; P93-E97 PolarHBondContact O-N 3.4Å; E94-E97 WeakPolarHBondContact O-CB 3.46Å; E94-E97 PolarHBondContact O-N 2.87Å; E97-V99 PolarHBondContact O-N 3.35Å; E97-A100 PolarHBondContact O-N 2.9Å; E97-V101 WeakPolarHBondContact O-CG2 3.46Å; E97-V101 PolarHBondContact O-N 2.9Å |
| 98 | E | 83.6 | Confident | 77.4 | Confident | 131 Ų | 131 | 94.3 Ų | 94.3 | 61% | 0.612 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.8 | -45.2 | 178.9 | -74.3 | -171.4 | 173.2 | 0 | 0 | 112.5 | E94 V95 A100 V101 A102 | E94-E98 WeakPolarHBondContact O-CG 3.34Å; E94-E98 PolarHBondContact O-N 3.26Å; V95-E98 PolarHBondContact O-N 3.17Å; E98-A100 VanDerWaalsContact C-N 3.34Å; E98-A100 PolarHBondContact O-N 3.12Å; E98-V101 PolarHBondContact O-N 2.84Å; E98-A102 WeakPolarHBondContact O-CB 3.3Å; E98-A102 PolarHBondContact O-N 2.72Å |
| 99 | V | 82.9 | Confident | 79.1 | Confident | 54 Ų | 54 | 97.1 Ų | 97.1 | 33% | 0.327 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.7 | -42.1 | 175.3 | 173.2 | 0 | 0 | 0 | 0 | 110.4 | V95 E97 V101 A102 L103 | V95-V99 HydrophobicContact CG1-CG2 4.45Å; V95-V99 WeakPolarHBondContact O-CB 3.47Å; V95-V99 VanDerWaalsContact O-CG2 3.27Å; V95-V99 WeakPolarHBondContact O-CG2 3.47Å; V95-V99 PolarHBondContact O-N 2.9Å; E97-V99 PolarHBondContact O-N 3.35Å; V99-V101 PolarHBondContact O-N 2.99Å; V99-A102 PolarHBondContact O-N 3.15Å; V99-L103 HydrophobicContact CG1-CD1 4.07Å; V99-L103 HydrophobicContact CG1-CG 4.38Å; V99-L103 WeakPolarHBondContact O-CG 3.38Å; V99-L103 PolarHBondContact O-N 3.11Å |
| 100 | A | 86.6 | Confident | 80.9 | Confident | 55 Ų | 55 | 92 Ų | 92 | 46% | 0.455 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | R96 E97 E98 K104 | R96-A100 VanDerWaalsContact O-CB 3.27Å; R96-A100 WeakPolarHBondContact O-CB 3.04Å; R96-A100 PolarHBondContact O-N 3.38Å; E97-A100 PolarHBondContact O-N 2.9Å; E98-A100 VanDerWaalsContact C-N 3.34Å; E98-A100 PolarHBondContact O-N 3.12Å; A100-K104 VanDerWaalsContact O-CB 3.3Å; A100-K104 WeakPolarHBondContact O-CB 3.35Å; A100-K104 PolarHBondContact O-N 3.37Å |
| 101 | V | 87.9 | Confident | 82.9 | Confident | 66 Ų | 66 | 90.2 Ų | 90.2 | 40% | 0.4 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.2 | -41.3 | 174.8 | 172 | 0 | 0 | 0 | 0 | 111.1 | E97 E98 V99 K104 K105 | E97-V101 WeakPolarHBondContact O-CG2 3.46Å; E97-V101 PolarHBondContact O-N 2.9Å; E98-V101 PolarHBondContact O-N 2.84Å; V99-V101 PolarHBondContact O-N 2.99Å; V101-K104 PolarHBondContact O-N 3.47Å; V101-K105 HydrophobicContact CG1-CD 4.31Å; V101-K105 WeakPolarHBondContact O-CG 3.29Å; V101-K105 PolarHBondContact O-N 3.42Å |
| 102 | A | 83.3 | Confident | 84.7 | Confident | 29 Ų | 29 | 91.6 Ų | 91.6 | 24% | 0.24 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -61.9 | -49.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L75 E98 V99 K104 K105 D106 | L75-A102 HydrophobicContact CD1-CB 4.27Å; E98-A102 WeakPolarHBondContact O-CB 3.3Å; E98-A102 PolarHBondContact O-N 2.72Å; V99-A102 PolarHBondContact O-N 3.15Å; A102-K104 VanDerWaalsContact C-N 3.31Å; A102-K104 PolarHBondContact O-N 3.26Å; A102-K105 WeakPolarHBondContact O-CB 3.2Å; A102-K105 PolarHBondContact O-N 2.71Å; A102-K105 VanDerWaalsContact O-N 3.12Å; A102-D106 PolarHBondContact O-N 3.44Å |
| 103 | L | 86.6 | Confident | 85.5 | Confident | 79 Ų | 79 | 92.9 Ų | 92.9 | 41% | 0.414 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -61 | -38.2 | 175.8 | -69.5 | 174.2 | 0 | 0 | 0 | 112.2 | M72 V99 D106 R107 | M72-L103 HydrophobicContact CE-CD2 3.68Å; M72-L103 HydrophobicContact SD-CD2 4.45Å; V99-L103 HydrophobicContact CG1-CD1 4.07Å; V99-L103 HydrophobicContact CG1-CG 4.38Å; V99-L103 WeakPolarHBondContact O-CG 3.38Å; V99-L103 PolarHBondContact O-N 3.11Å; L103-D106 PolarHBondContact O-N 2.93Å; L103-R107 WeakPolarHBondContact O-CB 3.3Å; L103-R107 PolarHBondContact O-N 2.69Å |
| 104 | K | 88.9 | Confident | 86.2 | Confident | 101 Ų | 101 | 93.3 Ų | 93.3 | 44% | 0.439 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -66.2 | -37.9 | 175.4 | -167.7 | 176.3 | -170.7 | 173.2 | 0 | 111.8 | A100 V101 A102 R108 | A100-K104 VanDerWaalsContact O-CB 3.3Å; A100-K104 WeakPolarHBondContact O-CB 3.35Å; A100-K104 PolarHBondContact O-N 3.37Å; V101-K104 PolarHBondContact O-N 3.47Å; A102-K104 VanDerWaalsContact C-N 3.31Å; A102-K104 PolarHBondContact O-N 3.26Å; K104-R108 VanDerWaalsContact O-CG 3.31Å; K104-R108 WeakPolarHBondContact O-CG 3.43Å; K104-R108 PolarHBondContact O-N 3.2Å |
| 105 | K | 85.8 | Confident | 86.9 | Confident | 131 Ų | 131 | 94 Ų | 94 | 57% | 0.57 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -68.1 | -40.8 | 174.4 | -75.7 | 174.5 | -179.3 | 172 | 0 | 111.3 | V101 A102 R108 R109 | V101-K105 HydrophobicContact CG1-CD 4.31Å; V101-K105 WeakPolarHBondContact O-CG 3.29Å; V101-K105 PolarHBondContact O-N 3.42Å; A102-K105 WeakPolarHBondContact O-CB 3.2Å; A102-K105 PolarHBondContact O-N 2.71Å; A102-K105 VanDerWaalsContact O-N 3.12Å; K105-R108 PolarHBondContact O-N 3.46Å; K105-R109 PolarHBondContact O-N 3Å |
| 106 | D | 83.3 | Confident | 87.6 | Confident | 56 Ų | 56 | 100 Ų | 100 | 30% | 0.299 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -67.5 | -46.6 | 178.9 | -167.5 | 57.2 | 0 | 0 | 0 | 112 | A102 L103 R108 R109 E110 | A102-D106 PolarHBondContact O-N 3.44Å; L103-D106 PolarHBondContact O-N 2.93Å; D106-R108 PolarHBondContact O-N 3.14Å; D106-R108 VanDerWaalsContact O-N 3.17Å; D106-R109 CarbonylContact O-C 3.49Å; D106-R109 WeakPolarHBondContact O-CA 3.31Å; D106-R109 WeakPolarHBondContact O-CB 3.3Å; D106-R109 PolarHBondContact O-N 3.26Å; D106-E110 PolarHBondContact O-N 3.5Å |
| 107 | R | 87.6 | Confident | 88.1 | Confident | 162 Ų | 162 | 96.9 Ų | 96.9 | 61% | 0.611 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -54.7 | -38.9 | 172.7 | -174.6 | 173.1 | 66.5 | -113.7 | 9.2 | 112.7 | L103 G111 | L103-R107 WeakPolarHBondContact O-CB 3.3Å; L103-R107 PolarHBondContact O-N 2.69Å; R107-G111 PolarHBondContact O-N 3.42Å |
| 108 | R | 87.8 | Confident | 88.2 | Confident | 128 Ų | 128 | 95.8 Ų | 95.8 | 48% | 0.483 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -67.7 | -36.5 | 174.3 | -73.3 | 176.7 | -173 | 134 | -14.1 | 112.3 | K104 K105 D106 R112 | K104-R108 VanDerWaalsContact O-CG 3.31Å; K104-R108 WeakPolarHBondContact O-CG 3.43Å; K104-R108 PolarHBondContact O-N 3.2Å; K105-R108 PolarHBondContact O-N 3.46Å; D106-R108 PolarHBondContact O-N 3.14Å; D106-R108 VanDerWaalsContact O-N 3.17Å; R108-R112 WeakPolarHBondContact O-CG 3.4Å; R108-R112 PolarHBondContact O-N 3.49Å; R108-R112 VanDerWaalsContact O-N 3.11Å |
| 109 | R | 87.3 | Confident | 88.5 | Confident | 161 Ų | 161 | 92.4 Ų | 92.4 | 61% | 0.608 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -67.1 | -49.1 | 177 | -177.1 | -175.8 | -70 | -178.4 | -1.3 | 110.5 | K105 D106 R112 R113 | K105-R109 PolarHBondContact O-N 3Å; D106-R109 CarbonylContact O-C 3.49Å; D106-R109 WeakPolarHBondContact O-CA 3.31Å; D106-R109 WeakPolarHBondContact O-CB 3.3Å; D106-R109 PolarHBondContact O-N 3.26Å; R109-R112 PolarHBondContact O-N 3.04Å; R109-R113 PolarHBondContact O-N 3.34Å |
| 110 | E | 86.1 | Confident | 88.9 | Confident | 38 Ų | 38 | 96.6 Ų | 96.6 | 18% | 0.178 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 176.2 | -75.9 | -54.4 | 106.3 | 0 | 0 | 111.9 | N65 D106 R112 R113 L114 | N65-E110 VanDerWaalsContact CG-CD 3.41Å; N65-E110 WeakPolarHBondContact ND2-CG 3.47Å; N65-E110 PolarHBondContact ND2-OE1 3.33Å; D106-E110 PolarHBondContact O-N 3.5Å; E110-R112 VanDerWaalsContact C-N 3.33Å; E110-R112 PolarHBondContact O-N 3.02Å; E110-R113 WeakPolarHBondContact O-CA 3.5Å; E110-R113 WeakPolarHBondContact O-CB 3.15Å; E110-R113 PolarHBondContact O-N 3.21Å; E110-R113 WeakPolarHBondContact OE1-CD 3.36Å; E110-R113 IonicContact OE1-NH1 3.52Å; E110-R113 IonicContact OE2-CZ 3.92Å; E110-R113 IonicContact OE2-NH1 3.22Å; E110-R113 PolarHBondContact OE2-NH1 2.96Å; E110-L114 WeakPolarHBondContact O-CG 3.47Å; E110-L114 PolarHBondContact O-N 3.44Å |
| 111 | G | 92.9 | Very high | 88.9 | Confident | 29 Ų | 29 | 100.1 Ų | 100.1 | 30% | 0.299 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -56.5 | -43.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | R107 R113 K115 | R107-G111 PolarHBondContact O-N 3.42Å; G111-R113 VanDerWaalsContact C-N 3.34Å; G111-R113 PolarHBondContact O-N 3.04Å; G111-K115 WeakPolarHBondContact O-CB 3.27Å; G111-K115 VanDerWaalsContact O-CG 3.3Å; G111-K115 WeakPolarHBondContact O-CG 3.32Å; G111-K115 PolarHBondContact O-N 3.23Å |
| 112 | R | 93.1 | Very high | 88.9 | Confident | 130 Ų | 130 | 101 Ų | 101 | 49% | 0.491 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.7 | -38.3 | 174.3 | -74.5 | -174.9 | -66.3 | -107.2 | 0.5 | 112.2 | R108 R109 E110 R116 | R108-R112 WeakPolarHBondContact O-CG 3.4Å; R108-R112 PolarHBondContact O-N 3.49Å; R108-R112 VanDerWaalsContact O-N 3.11Å; R109-R112 PolarHBondContact O-N 3.04Å; E110-R112 VanDerWaalsContact C-N 3.33Å; E110-R112 PolarHBondContact O-N 3.02Å; R112-R116 WeakPolarHBondContact O-CG 3.46Å; R112-R116 PolarHBondContact O-N 3.31Å |
| 113 | R | 90.7 | Very high | 89.1 | Confident | 50 Ų | 50 | 103.3 Ų | 103.3 | 19% | 0.189 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -65.8 | -47.3 | 179.1 | -179.3 | -177 | 163.7 | -154 | -12.3 | 111.2 | Y63 R109 E110 G111 R116 Q117 | Y63-R113 VanDerWaalsContact CB-NH2 3.32Å; Y63-R113 PolarHBondContact O-NH2 2.86Å; R109-R113 PolarHBondContact O-N 3.34Å; E110-R113 WeakPolarHBondContact O-CA 3.5Å; E110-R113 WeakPolarHBondContact O-CB 3.15Å; E110-R113 PolarHBondContact O-N 3.21Å; E110-R113 WeakPolarHBondContact OE1-CD 3.36Å; E110-R113 IonicContact OE1-NH1 3.52Å; E110-R113 IonicContact OE2-CZ 3.92Å; E110-R113 IonicContact OE2-NH1 3.22Å; E110-R113 PolarHBondContact OE2-NH1 2.96Å; G111-R113 VanDerWaalsContact C-N 3.34Å; G111-R113 PolarHBondContact O-N 3.04Å; R113-R116 PolarHBondContact O-N 3.26Å; R113-Q117 WeakPolarHBondContact O-CG 3.27Å; R113-Q117 PolarHBondContact O-N 2.93Å |
| 114 | L | 92.6 | Very high | 89.1 | Confident | 101 Ų | 101 | 104.4 Ų | 104.4 | 53% | 0.529 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.5 | -46.5 | 175.4 | -69.7 | 175.8 | 0 | 0 | 0 | 111.1 | E110 R116 Q117 E118 | E110-L114 WeakPolarHBondContact O-CG 3.47Å; E110-L114 PolarHBondContact O-N 3.44Å; L114-R116 VanDerWaalsContact C-N 3.29Å; L114-R116 PolarHBondContact O-N 2.83Å; L114-Q117 WeakPolarHBondContact O-CB 3.32Å; L114-Q117 PolarHBondContact O-N 2.85Å; L114-E118 WeakPolarHBondContact O-CB 3.26Å; L114-E118 PolarHBondContact O-N 2.7Å |
| 115 | K | 93.1 | Very high | 88.9 | Confident | 154 Ų | 154 | 102.7 Ų | 102.7 | 67% | 0.67 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -55.9 | -40.7 | 174.4 | -76.5 | -178.2 | -179.9 | -168.4 | 0 | 113 | G111 A119 | G111-K115 WeakPolarHBondContact O-CB 3.27Å; G111-K115 VanDerWaalsContact O-CG 3.3Å; G111-K115 WeakPolarHBondContact O-CG 3.32Å; G111-K115 PolarHBondContact O-N 3.23Å; K115-A119 WeakPolarHBondContact O-CB 3.3Å; K115-A119 PolarHBondContact O-N 2.84Å |
| 116 | R | 92.6 | Very high | 88.9 | Confident | 166 Ų | 166 | 96.4 Ų | 96.4 | 63% | 0.626 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -67.7 | -38.6 | 175.3 | -70.7 | -177.9 | -148.8 | 128.7 | -4.1 | 112.4 | R112 R113 L114 K120 | R112-R116 WeakPolarHBondContact O-CG 3.46Å; R112-R116 PolarHBondContact O-N 3.31Å; R113-R116 PolarHBondContact O-N 3.26Å; L114-R116 VanDerWaalsContact C-N 3.29Å; L114-R116 PolarHBondContact O-N 2.83Å; R116-K120 WeakPolarHBondContact O-CB 3.15Å; R116-K120 PolarHBondContact O-N 2.79Å |
| 117 | Q | 89.9 | Confident | 88.7 | Confident | 75 Ų | 75 | 101.3 Ų | 101.3 | 35% | 0.35 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.7 | -45.6 | 176.7 | -70.1 | -177.8 | 43.7 | 0 | 0 | 111 | R113 L114 K120 K121 | R113-Q117 WeakPolarHBondContact O-CG 3.27Å; R113-Q117 PolarHBondContact O-N 2.93Å; L114-Q117 WeakPolarHBondContact O-CB 3.32Å; L114-Q117 PolarHBondContact O-N 2.85Å; Q117-K120 PolarHBondContact O-N 3.26Å; Q117-K121 WeakPolarHBondContact O-CG 3.26Å; Q117-K121 PolarHBondContact O-N 2.74Å |
| 118 | E | 90.2 | Very high | 88.2 | Confident | 116 Ų | 116 | 96 Ų | 96 | 54% | 0.542 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64.2 | -46.4 | 176.8 | -177.9 | 162.3 | -149.9 | 0 | 0 | 111.4 | L114 K120 K121 N122 | L114-E118 WeakPolarHBondContact O-CB 3.26Å; L114-E118 PolarHBondContact O-N 2.7Å; E118-K120 PolarHBondContact O-N 3.25Å; E118-K121 PolarHBondContact O-N 3.28Å; E118-K121 VanDerWaalsContact O-N 3.09Å; E118-N122 WeakPolarHBondContact CG-ND2 3.41Å; E118-N122 WeakPolarHBondContact O-CB 3.32Å; E118-N122 VanDerWaalsContact O-CG 3.25Å; E118-N122 PolarHBondContact O-N 2.7Å |
| 119 | A | 90.3 | Very high | 87.8 | Confident | 59 Ų | 59 | 92.6 Ų | 92.6 | 49% | 0.488 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -57.4 | -39.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | K115 A123 | K115-A119 WeakPolarHBondContact O-CB 3.3Å; K115-A119 PolarHBondContact O-N 2.84Å; A119-A123 WeakPolarHBondContact O-CB 3.09Å; A119-A123 PolarHBondContact O-N 3.21Å |
| 120 | K | 89.6 | Confident | 87.5 | Confident | 143 Ų | 143 | 89.1 Ų | 89.1 | 62% | 0.622 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -69.4 | -37.2 | 176.2 | -177.3 | 168.4 | -179.8 | 158.7 | 0 | 112.8 | R116 Q117 E118 M124 | R116-K120 WeakPolarHBondContact O-CB 3.15Å; R116-K120 PolarHBondContact O-N 2.79Å; Q117-K120 PolarHBondContact O-N 3.26Å; E118-K120 PolarHBondContact O-N 3.25Å; K120-M124 PolarHBondContact O-N 3.29Å |
| 121 | K | 87.3 | Confident | 87.4 | Confident | 129 Ų | 129 | 88.2 Ų | 88.2 | 56% | 0.561 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -69 | -46.4 | 174.9 | -72.9 | 179.1 | -179.2 | -178.5 | 0 | 110.6 | Q117 E118 A123 M124 G133 | Q117-K121 WeakPolarHBondContact O-CG 3.26Å; Q117-K121 PolarHBondContact O-N 2.74Å; E118-K121 PolarHBondContact O-N 3.28Å; E118-K121 VanDerWaalsContact O-N 3.09Å; K121-A123 VanDerWaalsContact C-N 3.34Å; K121-A123 PolarHBondContact O-N 3.2Å; K121-M124 VanDerWaalsContact O-CB 3.26Å; K121-M124 WeakPolarHBondContact O-CB 3.45Å; K121-M124 PolarHBondContact O-N 3.33Å; K121-G133 VanDerWaalsContact O-CA 3.24Å; K121-G133 WeakPolarHBondContact O-CA 3.35Å; K121-G133 PolarHBondContact O-N 2.76Å |
| 122 | N | 88.4 | Confident | 87.1 | Confident | 84 Ų | 84 | 91.2 Ų | 91.2 | 45% | 0.449 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -68.5 | -32.5 | 179.7 | -65.5 | -6 | 0 | 0 | 0 | 112.2 | E118 M124 P132 | E118-N122 WeakPolarHBondContact CG-ND2 3.41Å; E118-N122 WeakPolarHBondContact O-CB 3.32Å; E118-N122 VanDerWaalsContact O-CG 3.25Å; E118-N122 PolarHBondContact O-N 2.7Å; N122-M124 VanDerWaalsContact C-N 3.26Å; N122-M124 PolarHBondContact O-N 3.41Å; N122-P132 VanDerWaalsContact O-CB 3.25Å; N122-P132 WeakPolarHBondContact O-CB 3.22Å |
| 123 | A | 87.9 | Confident | 86.9 | Confident | 78 Ų | 78 | 86.8 Ų | 86.8 | 65% | 0.645 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -16.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A119 K121 V125 | A119-A123 WeakPolarHBondContact O-CB 3.09Å; A119-A123 PolarHBondContact O-N 3.21Å; K121-A123 VanDerWaalsContact C-N 3.34Å; K121-A123 PolarHBondContact O-N 3.2Å; A123-V125 PolarHBondContact O-N 3.14Å |
| 124 | M | 85.5 | Confident | 86.8 | Confident | 101 Ų | 101 | 86 Ų | 86 | 50% | 0.498 | 45% | 0.446 | S | S | . | . | trans | -74.8 | 121.8 | 172.1 | -178 | 174.9 | -71.2 | 0 | 0 | 108.7 | K120 K121 N122 P132 G133 | K120-M124 PolarHBondContact O-N 3.29Å; K121-M124 VanDerWaalsContact O-CB 3.26Å; K121-M124 WeakPolarHBondContact O-CB 3.45Å; K121-M124 PolarHBondContact O-N 3.33Å; N122-M124 VanDerWaalsContact C-N 3.26Å; N122-M124 PolarHBondContact O-N 3.41Å; M124-P132 CarbonylContact O-C 3.54Å; M124-P132 WeakPolarHBondContact O-CA 3.46Å; M124-G133 PolarHBondContact O-N 3.09Å | ||
| 125 | V | 85.9 | Confident | 86.4 | Confident | 65 Ų | 65 | 82 Ų | 82 | 39% | 0.394 | 43% | 0.428 | S | S | . | . | B | Isolated β-bridge | trans | -109.8 | 135.4 | 179.7 | 178.7 | 0 | 0 | 0 | 0 | 109.4 | A123 R130 H134 | A123-V125 PolarHBondContact O-N 3.14Å; V125-R130 HydrophobicContact CG1-CB 4.31Å; V125-R130 WeakPolarHBondContact CG1-O 3.45Å; V125-H134 CarbonylContact C-O 3.53Å |
| 126 | C | 84.9 | Confident | 85.8 | Confident | 0 Ų | 0 | 77 Ų | 77 | 0% | 0 | 41% | 0.409 | C | S | . | . | trans | -72.3 | 130 | 176.6 | 177.9 | 0 | 0 | 0 | 0 | 111.1 | H128 C129 R130 G131 H134 C139 | C126-H128 PolarHBondContact O-N 3.04Å; C126-H128 PolarHBondContact SG-N 3Å; C126-C129 VanDerWaalsContact SG-SG 3.67Å; C126-R130 WeakPolarHBondContact O-CA 3.41Å; C126-R130 PolarHBondContact O-N 3.26Å; C126-G131 PolarHBondContact N-O 2.83Å; C126-H134 WeakPolarHBondContact CA-O 3.41Å; C126-H134 WeakPolarHBondContact CB-NE2 3.23Å; C126-H134 WeakPolarHBondContact CB-O 3.19Å; C126-H134 PolarHBondContact N-O 2.81Å; C126-H134 VanDerWaalsContact N-O 3.16Å; C126-C139 VanDerWaalsContact SG-CB 3.58Å; C126-C139 PolarHBondContact SG-SG 2.95Å | ||
| 127 | F | 78.3 | Confident | 85.3 | Confident | 159 Ų | 159 | 73.5 Ų | 73.5 | 70% | 0.697 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.3 | -19.3 | -180 | -64.6 | -68.5 | 0 | 0 | 0 | 114.2 | I136 | F127-I136 HydrophobicContact CB-CD1 4.29Š|
| 128 | H | 77.3 | Confident | 84.9 | Confident | 49 Ų | 49 | 76 Ų | 76 | 23% | 0.227 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | -62.8 | -179.9 | -170.7 | 70.5 | 0 | 0 | 0 | 111.5 | C126 I136 V142 F183 | C126-H128 PolarHBondContact O-N 3.04Å; C126-H128 PolarHBondContact SG-N 3Å; H128-I136 HydrophobicContact CB-CD1 4.19Å; H128-I136 HydrophobicContact CB-CG1 4.24Å; H128-V142 HydrophobicContact CB-CG2 4.05Å; H128-F183 AromaticContact ND1-CD1 3.78Å |
| 129 | C | 80.1 | Confident | 84.6 | Confident | 58 Ų | 58 | 70.8 Ų | 70.8 | 39% | 0.392 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.4 | -5.7 | -177.6 | 67 | 0 | 0 | 0 | 0 | 114.3 | C126 G131 H134 | C126-C129 VanDerWaalsContact SG-SG 3.67Å; C129-G131 PolarHBondContact O-N 3.25Å; C129-G131 PolarHBondContact SG-N 2.86Å; C129-H134 PolarHBondContact SG-CE1 3.27Å; C129-H134 PolarHBondContact SG-NE2 3.25Å |
| 130 | R | 79.8 | Confident | 84.2 | Confident | 88 Ų | 88 | 72.5 Ų | 72.5 | 33% | 0.332 | 41% | 0.413 | S | S | . | . | trans | 55.2 | 17.1 | -173.2 | -59.5 | -170.2 | -178.7 | -153.4 | 4.2 | 115 | V125 C126 Y203 A204 | V125-R130 HydrophobicContact CG1-CB 4.31Å; V125-R130 WeakPolarHBondContact CG1-O 3.45Å; C126-R130 WeakPolarHBondContact O-CA 3.41Å; C126-R130 PolarHBondContact O-N 3.26Å; R130-Y203 PolarHBondContact NH1-O 3.28Å; R130-A204 PolarHBondContact NH1-O 3.32Å | ||
| 131 | G | 84 | Confident | 83.5 | Confident | 19 Ų | 19 | 67.5 Ų | 67.5 | 20% | 0.196 | 40% | 0.398 | C | S | . | . | trans | -75.3 | 142.6 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | C126 C129 | C126-G131 PolarHBondContact N-O 2.83Å; C129-G131 PolarHBondContact O-N 3.25Å; C129-G131 PolarHBondContact SG-N 2.86Å | ||
| 132 | P | 88.3 | Confident | 82.5 | Confident | 91 Ų | 91 | 62.5 Ų | 62.5 | 59% | 0.591 | 38% | 0.378 | S | S | * | . | B | Isolated β-bridge | trans | -72.1 | 163 | 173.1 | 30.4 | -34 | 0 | 0 | 0 | 111.8 | N122 M124 H134 | N122-P132 VanDerWaalsContact O-CB 3.25Å; N122-P132 WeakPolarHBondContact O-CB 3.22Å; M124-P132 CarbonylContact O-C 3.54Å; M124-P132 WeakPolarHBondContact O-CA 3.46Å; P132-H134 PolarHBondContact O-ND1 3.02Å |
| 133 | G | 88 | Confident | 81.2 | Confident | 38 Ų | 38 | 65.5 Ų | 65.5 | 39% | 0.392 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 95.5 | -14.2 | 168.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | K121 M124 | K121-G133 VanDerWaalsContact O-CA 3.24Å; K121-G133 WeakPolarHBondContact O-CA 3.35Å; K121-G133 PolarHBondContact O-N 2.76Å; M124-G133 PolarHBondContact O-N 3.09Å |
| 134 | H | 88.4 | Confident | 80 | Confident | 34 Ų | 34 | 70.2 Ų | 70.2 | 16% | 0.157 | 40% | 0.402 | C | S | . | . | trans | -147.2 | 157.8 | -174.9 | 67.3 | -81.6 | 0 | 0 | 0 | 113.2 | V125 C126 C129 P132 D138 C139 | V125-H134 CarbonylContact C-O 3.53Å; C126-H134 WeakPolarHBondContact CA-O 3.41Å; C126-H134 WeakPolarHBondContact CB-NE2 3.23Å; C126-H134 WeakPolarHBondContact CB-O 3.19Å; C126-H134 PolarHBondContact N-O 2.81Å; C126-H134 VanDerWaalsContact N-O 3.16Å; C129-H134 PolarHBondContact SG-CE1 3.27Å; C129-H134 PolarHBondContact SG-NE2 3.25Å; P132-H134 PolarHBondContact O-ND1 3.02Å; H134-D138 HydrophobicContact CB-CB 4.28Å; H134-C139 WeakPolarHBondContact CD2-CA 3.13Å | ||
| 135 | G | 84.9 | Confident | 78.9 | Confident | 16 Ų | 16 | 67.2 Ų | 67.2 | 17% | 0.165 | 39% | 0.391 | C | S | . | . | trans | -95 | 175.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A137 D138 C139 | G135-A137 PolarHBondContact O-N 3.35Å; G135-D138 CarbonylContact O-C 3.38Å; G135-D138 PolarHBondContact O-N 3.24Å; G135-D138 VanDerWaalsContact O-N 3.08Å; G135-C139 PolarHBondContact O-N 2.85Å | ||
| 136 | I | 79.6 | Confident | 77.7 | Confident | 50 Ų | 50 | 72.1 Ų | 72.1 | 26% | 0.256 | 41% | 0.41 | S | S | . | . | G | 310 helix | trans | -60.1 | -29.7 | -177.9 | -162.7 | 153.3 | 0 | 0 | 0 | 113.8 | F127 H128 C139 F183 | F127-I136 HydrophobicContact CB-CD1 4.29Å; H128-I136 HydrophobicContact CB-CD1 4.19Å; H128-I136 HydrophobicContact CB-CG1 4.24Å; I136-C139 WeakPolarHBondContact O-CB 3.05Å; I136-F183 HydrophobicContact CD1-CE1 3.94Å; I136-F183 HydrophobicContact CD1-CZ 3.81Å |
| 137 | A | 81.5 | Confident | 76.5 | Confident | 91 Ų | 91 | 78 Ų | 78 | 75% | 0.752 | 44% | 0.442 | S | S | * | . | G | 310 helix | trans | -73.2 | -28.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | G135 | G135-A137 PolarHBondContact O-N 3.35Š|
| 138 | D | 83.5 | Confident | 75.7 | Confident | 128 Ų | 128 | 73.1 Ų | 73.1 | 68% | 0.684 | 42% | 0.421 | S | S | * | . | G | 310 helix | trans | -105.2 | 20.3 | -178.5 | -54.8 | -48.6 | 0 | 0 | 0 | 110.6 | H134 G135 P140 | H134-D138 HydrophobicContact CB-CB 4.28Å; G135-D138 CarbonylContact O-C 3.38Å; G135-D138 PolarHBondContact O-N 3.24Å; G135-D138 VanDerWaalsContact O-N 3.08Å; D138-P140 WeakPolarHBondContact O-CD 3.29Å |
| 139 | C | 83.4 | Confident | 75 | Confident | 7 Ų | 7 | 72 Ų | 72 | 5% | 0.047 | 42% | 0.423 | C | S | . | . | trans | -78.7 | 120.1 | -177.4 | -174.3 | 0 | 0 | 0 | 0 | 110.6 | C126 H134 G135 I136 A141 V142 | C126-C139 VanDerWaalsContact SG-CB 3.58Å; C126-C139 PolarHBondContact SG-SG 2.95Å; H134-C139 WeakPolarHBondContact CD2-CA 3.13Å; G135-C139 PolarHBondContact O-N 2.85Å; I136-C139 WeakPolarHBondContact O-CB 3.05Å; C139-A141 PolarHBondContact O-N 2.69Å; C139-V142 HydrophobicContact CB-CB 4.06Å; C139-V142 HydrophobicContact CB-CG2 3.62Å; C139-V142 PolarHBondContact O-N 2.79Å; C139-V142 VanDerWaalsContact O-N 3.13Å | ||
| 140 | P | 81.6 | Confident | 74.4 | Confident | 95 Ų | 95 | 73.8 Ų | 73.8 | 62% | 0.617 | 43% | 0.432 | S | S | * | . | G | 310 helix | trans | -61.9 | -34.1 | -179.8 | 24.9 | -32.8 | 0 | 0 | 0 | 111.8 | D138 V142 L143 | D138-P140 WeakPolarHBondContact O-CD 3.29Å; P140-V142 VanDerWaalsContact C-N 3.32Å; P140-V142 PolarHBondContact O-N 3Å; P140-L143 WeakPolarHBondContact O-CB 3.35Å; P140-L143 PolarHBondContact O-N 3.22Å |
| 141 | A | 74.1 | Confident | 74.2 | Confident | 37 Ų | 37 | 72 Ų | 72 | 31% | 0.306 | 44% | 0.442 | S | S | . | . | G | 310 helix | trans | -69.6 | -25.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | C139 L143 E144 | C139-A141 PolarHBondContact O-N 2.69Å; A141-L143 VanDerWaalsContact C-N 3.27Å; A141-L143 PolarHBondContact O-N 3.27Å; A141-E144 PolarHBondContact O-N 2.82Å |
| 142 | V | 66.2 | Low | 74.4 | Confident | 24 Ų | 24 | 73.3 Ų | 73.3 | 15% | 0.145 | 44% | 0.444 | C | S | . | . | G | 310 helix | trans | -73.7 | -23.8 | 179.6 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | H128 C139 P140 E144 S145 T150 | H128-V142 HydrophobicContact CB-CG2 4.05Å; C139-V142 HydrophobicContact CB-CB 4.06Å; C139-V142 HydrophobicContact CB-CG2 3.62Å; C139-V142 PolarHBondContact O-N 2.79Å; C139-V142 VanDerWaalsContact O-N 3.13Å; P140-V142 VanDerWaalsContact C-N 3.32Å; P140-V142 PolarHBondContact O-N 3Å; V142-E144 PolarHBondContact O-N 3.13Å; V142-S145 CarbonylContact O-C 3.59Å; V142-S145 PolarHBondContact O-N 3.08Å; V142-T150 HydrophobicContact CG1-CG2 4.07Å |
| 143 | L | 62.3 | Low | 74.4 | Confident | 147 Ų | 147 | 69 Ų | 69 | 77% | 0.77 | 42% | 0.416 | S | S | * | . | G | 310 helix | trans | -66.2 | -24.7 | 176.7 | -153.1 | 74.4 | 0 | 0 | 0 | 112.2 | P140 A141 | P140-L143 WeakPolarHBondContact O-CB 3.35Å; P140-L143 PolarHBondContact O-N 3.22Å; A141-L143 VanDerWaalsContact C-N 3.27Å; A141-L143 PolarHBondContact O-N 3.27Å |
| 144 | E | 61.9 | Low | 74.4 | Confident | 177 Ų | 177 | 70.4 Ų | 70.4 | 83% | 0.827 | 41% | 0.41 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.2 | -23.9 | 178.1 | -71.3 | 173.2 | 173.4 | 0 | 0 | 112.7 | A141 V142 | A141-E144 PolarHBondContact O-N 2.82Å; V142-E144 PolarHBondContact O-N 3.13Å |
| 145 | S | 63.5 | Low | 74.4 | Confident | 38 Ų | 38 | 73.7 Ų | 73.7 | 27% | 0.266 | 42% | 0.421 | S | S | . | . | trans | -111.1 | 70.2 | -178.3 | 71.6 | 0 | 0 | 0 | 0 | 111.7 | V142 D147 M148 | V142-S145 CarbonylContact O-C 3.59Å; V142-S145 PolarHBondContact O-N 3.08Å; S145-D147 PolarHBondContact O-N 3.48Å; S145-M148 PolarHBondContact O-N 3.23Å | ||
| 146 | Q | 59.2 | Low | 74.6 | Confident | 169 Ų | 169 | 74.7 Ų | 74.7 | 79% | 0.79 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.2 | -14.2 | -176.8 | -131.4 | 105.6 | 10.8 | 0 | 0 | 115.3 | ||
| 147 | D | 60.9 | Low | 74.9 | Confident | 124 Ų | 124 | 73.5 Ų | 73.5 | 66% | 0.663 | 43% | 0.425 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | 0.4 | -168.2 | -62.4 | -41.8 | 0 | 0 | 0 | 115.4 | S145 G149 K181 | S145-D147 PolarHBondContact O-N 3.48Å; D147-G149 VanDerWaalsContact C-N 3.32Å; D147-G149 PolarHBondContact O-N 3.37Å; D147-K181 PolarHBondContact O-NZ 2.96Å |
| 148 | M | 61.7 | Low | 75.2 | Confident | 55 Ų | 55 | 70.7 Ų | 70.7 | 27% | 0.271 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -91.9 | 46.6 | -173.2 | -67.1 | -61.3 | -162.2 | 0 | 0 | 113.8 | S145 T150 K181 | S145-M148 PolarHBondContact O-N 3.23Å; M148-T150 WeakPolarHBondContact O-CG2 3.49Å; M148-T150 PolarHBondContact O-N 3.22Å; M148-K181 HydrophobicContact SD-CB 4.42Å; M148-K181 HydrophobicContact SD-CD 3.99Å |
| 149 | G | 62.2 | Low | 75.4 | Confident | 26 Ų | 26 | 69.7 Ų | 69.7 | 27% | 0.268 | 40% | 0.399 | S | S | . | . | trans | 36.7 | 42.4 | 157.6 | 0 | 0 | 0 | 0 | 0 | 116.5 | D147 G151 I152 | D147-G149 VanDerWaalsContact C-N 3.32Å; D147-G149 PolarHBondContact O-N 3.37Å; G149-G151 PolarHBondContact O-N 2.75Å; G149-G151 VanDerWaalsContact O-N 3.1Å; G149-I152 WeakPolarHBondContact O-CG1 3.4Å; G149-I152 PolarHBondContact O-N 2.86Å | ||
| 150 | T | 66.9 | Low | 75.7 | Confident | 95 Ų | 95 | 77.9 Ų | 77.9 | 58% | 0.583 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.8 | 112.6 | -175 | 51.8 | 0 | 0 | 0 | 0 | 107.9 | V142 M148 | V142-T150 HydrophobicContact CG1-CG2 4.07Å; M148-T150 WeakPolarHBondContact O-CG2 3.49Å; M148-T150 PolarHBondContact O-N 3.22Å |
| 151 | G | 76.7 | Confident | 76 | Confident | 52 Ų | 52 | 75.8 Ų | 75.8 | 54% | 0.536 | 42% | 0.418 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 93.9 | 9.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | G149 T159 | G149-G151 PolarHBondContact O-N 2.75Å; G149-G151 VanDerWaalsContact O-N 3.1Å; G151-T159 WeakPolarHBondContact O-CA 3.15Å |
| 152 | I | 86.8 | Confident | 76.7 | Confident | 46 Ų | 46 | 80.4 Ų | 80.4 | 24% | 0.236 | 43% | 0.433 | C | S | . | . | trans | -81.1 | 143.6 | 163.3 | 49.9 | 155 | 0 | 0 | 0 | 111.1 | G149 Y154 G157 T159 | G149-I152 WeakPolarHBondContact O-CG1 3.4Å; G149-I152 PolarHBondContact O-N 2.86Å; I152-Y154 HydrophobicContact CG1-CE1 4.46Å; I152-Y154 PolarHBondContact O-N 3.04Å; I152-G157 WeakPolarHBondContact CG2-O 3.25Å; I152-T159 HydrophobicContact CG2-CG2 3.55Å | ||
| 153 | C | 88.9 | Confident | 77.6 | Confident | 1 Ų | 1 | 81.5 Ų | 81.5 | 1% | 0.007 | 44% | 0.438 | C | S | . | . | trans | -68.3 | 115.7 | 168.1 | -176.9 | 0 | 0 | 0 | 0 | 109.3 | R155 C156 G157 S158 H161 C166 | C153-R155 PolarHBondContact O-N 3.43Å; C153-C156 PolarHBondContact O-N 3.46Å; C153-C156 VanDerWaalsContact SG-SG 3.62Å; C153-G157 VanDerWaalsContact O-CA 3.3Å; C153-G157 WeakPolarHBondContact O-CA 3.49Å; C153-G157 PolarHBondContact O-N 3.3Å; C153-S158 VanDerWaalsContact CB-O 3.3Å; C153-S158 WeakPolarHBondContact CB-O 3.44Å; C153-S158 PolarHBondContact N-O 3.09Å; C153-H161 WeakPolarHBondContact CB-O 3.35Å; C153-H161 PolarHBondContact SG-NE2 3.1Å; C153-C166 VanDerWaalsContact SG-CB 3.56Å | ||
| 154 | Y | 87.9 | Confident | 78.9 | Confident | 66 Ų | 66 | 79.8 Ų | 79.8 | 26% | 0.259 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -12.9 | -179.9 | -55.4 | -47.1 | 0 | 0 | 0 | 114.7 | I152 I163 F177 Y179 A180 L191 | I152-Y154 HydrophobicContact CG1-CE1 4.46Å; I152-Y154 PolarHBondContact O-N 3.04Å; Y154-I163 HydrophobicContact CD2-CD1 4.16Å; Y154-F177 CarbonylContact O-C 3.46Å; Y154-F177 WeakPolarHBondContact O-CA 3.36Å; Y154-Y179 PolarHBondContact O-N 3.16Å; Y154-A180 HydrophobicContact CD1-CB 4.19Å; Y154-A180 HydrophobicContact CG-CB 4.13Å; Y154-L191 HydrophobicContact CD2-CD2 4.27Å |
| 155 | R | 88.5 | Confident | 80.2 | Confident | 104 Ų | 104 | 78.4 Ų | 78.4 | 39% | 0.392 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | -47.8 | 178 | -89.2 | -179.2 | -172.5 | -150.6 | 1.5 | 112.6 | C153 I163 C166 I170 F177 Y179 | C153-R155 PolarHBondContact O-N 3.43Å; R155-I163 HydrophobicContact CB-CG1 4.28Å; R155-I163 HydrophobicContact CG-CD1 4.1Å; R155-I163 HydrophobicContact CG-CG1 3.74Å; R155-C166 HydrophobicContact CB-CB 4.37Å; R155-I170 VanDerWaalsContact C-CD1 3.42Å; R155-I170 HydrophobicContact CB-CD1 3.43Å; R155-I170 VanDerWaalsContact CB-CD1 3.43Å; R155-I170 HydrophobicContact CG-CD1 3.91Å; R155-I170 WeakPolarHBondContact O-CD1 3.26Å; R155-I170 VanDerWaalsContact O-CG1 3.25Å; R155-I170 WeakPolarHBondContact O-CG1 3.43Å; R155-F177 HydrophobicContact CG-CD1 4.16Å; R155-F177 HydrophobicContact CG-CE1 4.31Å; R155-Y179 VanDerWaalsContact O-CD2 3.31Å; R155-Y179 WeakPolarHBondContact O-CD2 3.37Å; R155-Y179 VanDerWaalsContact O-CE2 3.31Å; R155-Y179 WeakPolarHBondContact O-CE2 3.03Å |
| 156 | C | 88.5 | Confident | 81.4 | Confident | 36 Ų | 36 | 77.4 Ų | 77.4 | 24% | 0.243 | 42% | 0.418 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -126 | 4.8 | -173.2 | 65.3 | 0 | 0 | 0 | 0 | 115.1 | C153 S158 H161 A168 Y179 | C153-C156 PolarHBondContact O-N 3.46Å; C153-C156 VanDerWaalsContact SG-SG 3.62Å; C156-S158 PolarHBondContact O-N 2.9Å; C156-S158 VanDerWaalsContact O-N 3.11Å; C156-S158 PolarHBondContact SG-OG 3.45Å; C156-H161 VanDerWaalsContact SG-CE1 3.52Å; C156-H161 PolarHBondContact SG-NE2 2.99Å; C156-H161 VanDerWaalsContact SG-NE2 3.36Å; C156-A168 HydrophobicContact CB-CB 3.58Å; C156-Y179 VanDerWaalsContact CA-CE2 3.5Å |
| 157 | G | 86.3 | Confident | 82.9 | Confident | 25 Ų | 25 | 78.7 Ų | 78.7 | 26% | 0.258 | 42% | 0.421 | S | S | . | . | trans | 74.6 | -5.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | I152 C153 | I152-G157 WeakPolarHBondContact CG2-O 3.25Å; C153-G157 VanDerWaalsContact O-CA 3.3Å; C153-G157 WeakPolarHBondContact O-CA 3.49Å; C153-G157 PolarHBondContact O-N 3.3Å | ||
| 158 | S | 88.5 | Confident | 84 | Confident | 33 Ų | 33 | 74.9 Ų | 74.9 | 23% | 0.231 | 41% | 0.406 | C | S | . | . | trans | -71.9 | 141.1 | -179.2 | 65 | 0 | 0 | 0 | 0 | 112.2 | C153 C156 E160 H161 | C153-S158 VanDerWaalsContact CB-O 3.3Å; C153-S158 WeakPolarHBondContact CB-O 3.44Å; C153-S158 PolarHBondContact N-O 3.09Å; C156-S158 PolarHBondContact O-N 2.9Å; C156-S158 VanDerWaalsContact O-N 3.11Å; C156-S158 PolarHBondContact SG-OG 3.45Å; S158-E160 VanDerWaalsContact C-N 3.32Å; S158-H161 PolarHBondContact OG-CE1 2.9Å; S158-H161 PolarHBondContact OG-ND1 2.91Å; S158-H161 PolarHBondContact OG-NE2 3.06Å | ||
| 159 | T | 87.8 | Confident | 85 | Confident | 107 Ų | 107 | 82.1 Ų | 82.1 | 66% | 0.656 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.8 | -4.4 | 175.5 | 51.9 | 0 | 0 | 0 | 0 | 114.2 | G151 I152 | G151-T159 WeakPolarHBondContact O-CA 3.15Å; I152-T159 HydrophobicContact CG2-CG2 3.55Å |
| 160 | E | 88.7 | Confident | 85.8 | Confident | 179 Ų | 179 | 83.4 Ų | 83.4 | 84% | 0.836 | 44% | 0.436 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | -21.6 | -171.3 | -60 | -170.8 | 166.4 | 0 | 0 | 113.8 | S158 | S158-E160 VanDerWaalsContact C-N 3.32Š|
| 161 | H | 89.1 | Confident | 86.4 | Confident | 51 Ų | 51 | 84.6 Ų | 84.6 | 24% | 0.236 | 44% | 0.439 | C | S | . | . | S | Bend | trans | -147.4 | 156.6 | -174.7 | 63.6 | -95.3 | 0 | 0 | 0 | 113.1 | C153 C156 S158 K165 C166 | C153-H161 WeakPolarHBondContact CB-O 3.35Å; C153-H161 PolarHBondContact SG-NE2 3.1Å; C156-H161 VanDerWaalsContact SG-CE1 3.52Å; C156-H161 PolarHBondContact SG-NE2 2.99Å; C156-H161 VanDerWaalsContact SG-NE2 3.36Å; S158-H161 PolarHBondContact OG-CE1 2.9Å; S158-H161 PolarHBondContact OG-ND1 2.91Å; S158-H161 PolarHBondContact OG-NE2 3.06Å; H161-K165 HydrophobicContact CB-CB 4.28Å; H161-C166 VanDerWaalsContact CD2-CA 3.41Å; H161-C166 WeakPolarHBondContact CD2-CA 3.49Å; H161-C166 VanDerWaalsContact NE2-CA 3.32Å; H161-C166 WeakPolarHBondContact NE2-CA 3.25Å; H161-C166 WeakPolarHBondContact NE2-CB 3.38Å; H161-C166 PolarHBondContact NE2-SG 3.37Å |
| 162 | E | 87.7 | Confident | 86.3 | Confident | 133 Ų | 133 | 88 Ų | 88 | 62% | 0.621 | 45% | 0.452 | S | S | * | . | trans | -82.6 | 161.6 | 171.4 | -66.9 | 168 | -161.4 | 0 | 0 | 111.2 | T164 K165 C166 | E162-T164 PolarHBondContact O-N 3.34Å; E162-K165 PolarHBondContact O-N 2.86Å; E162-C166 PolarHBondContact O-N 3.19Å | ||
| 163 | I | 86.7 | Confident | 85.8 | Confident | 48 Ų | 48 | 90.7 Ų | 90.7 | 25% | 0.246 | 48% | 0.481 | C | S | . | . | G | 310 helix | trans | -52.4 | -31.4 | -177.5 | -148.6 | 167.7 | 0 | 0 | 0 | 114.4 | Y154 R155 K165 C166 F177 | Y154-I163 HydrophobicContact CD2-CD1 4.16Å; R155-I163 HydrophobicContact CB-CG1 4.28Å; R155-I163 HydrophobicContact CG-CD1 4.1Å; R155-I163 HydrophobicContact CG-CG1 3.74Å; I163-K165 VanDerWaalsContact C-N 3.3Å; I163-K165 PolarHBondContact O-N 3.13Å; I163-C166 WeakPolarHBondContact O-CB 3.41Å; I163-C166 PolarHBondContact O-N 2.84Å; I163-F177 HydrophobicContact CD1-CD1 3.49Å; I163-F177 VanDerWaalsContact CD1-CD1 3.49Å; I163-F177 HydrophobicContact CD1-CE1 3.24Å; I163-F177 HydrophobicContact CD1-CZ 4.3Å; I163-F177 HydrophobicContact CG1-CE1 4.29Å |
| 164 | T | 88.3 | Confident | 85 | Confident | 111 Ų | 111 | 95 Ų | 95 | 68% | 0.681 | 51% | 0.507 | S | S | * | . | G | 310 helix | trans | -70.2 | -26.5 | -179.5 | 54.7 | 0 | 0 | 0 | 0 | 112.9 | E162 | E162-T164 PolarHBondContact O-N 3.34Š|
| 165 | K | 89.4 | Confident | 84.4 | Confident | 147 Ų | 147 | 93.3 Ų | 93.3 | 64% | 0.639 | 51% | 0.51 | S | S | * | . | G | 310 helix | trans | -104.5 | 4.8 | -179.8 | -64.3 | 172.1 | -172.6 | 162.4 | 0 | 111.9 | H161 E162 I163 K167 | H161-K165 HydrophobicContact CB-CB 4.28Å; E162-K165 PolarHBondContact O-N 2.86Å; I163-K165 VanDerWaalsContact C-N 3.3Å; I163-K165 PolarHBondContact O-N 3.13Å; K165-K167 PolarHBondContact O-N 2.87Å |
| 166 | C | 89.8 | Confident | 84 | Confident | 18 Ų | 18 | 91.6 Ų | 91.6 | 12% | 0.122 | 52% | 0.518 | C | S | . | . | trans | -71.2 | 120.9 | 178.9 | -170.8 | 0 | 0 | 0 | 0 | 110.8 | C153 R155 H161 E162 I163 | C153-C166 VanDerWaalsContact SG-CB 3.56Å; R155-C166 HydrophobicContact CB-CB 4.37Å; H161-C166 VanDerWaalsContact CD2-CA 3.41Å; H161-C166 WeakPolarHBondContact CD2-CA 3.49Å; H161-C166 VanDerWaalsContact NE2-CA 3.32Å; H161-C166 WeakPolarHBondContact NE2-CA 3.25Å; H161-C166 WeakPolarHBondContact NE2-CB 3.38Å; H161-C166 PolarHBondContact NE2-SG 3.37Å; E162-C166 PolarHBondContact O-N 3.19Å; I163-C166 WeakPolarHBondContact O-CB 3.41Å; I163-C166 PolarHBondContact O-N 2.84Å | ||
| 167 | K | 89.2 | Confident | 83.8 | Confident | 196 Ų | 196 | 92.2 Ų | 92.2 | 85% | 0.852 | 52% | 0.516 | S | S | * | . | trans | -101.1 | -1.4 | 175 | -61.7 | -174.1 | 179.5 | -177.2 | 0 | 113 | K165 K169 | K165-K167 PolarHBondContact O-N 2.87Å; K167-K169 PolarHBondContact O-N 3.29Å | ||
| 168 | A | 85.4 | Confident | 83.9 | Confident | 43 Ų | 43 | 92.2 Ų | 92.2 | 36% | 0.355 | 51% | 0.512 | S | S | . | . | trans | -65.5 | 131.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | C156 I170 | C156-A168 HydrophobicContact CB-CB 3.58Å; A168-I170 HydrophobicContact CB-CD1 4.29Å | ||
| 169 | K | 82 | Confident | 83.8 | Confident | 208 Ų | 208 | 96.1 Ų | 96.1 | 90% | 0.904 | 52% | 0.523 | S | S | * | . | trans | -86.7 | 116.8 | 168 | -61.8 | 179.9 | -177.9 | -179.9 | 0 | 106 | K167 | K167-K169 PolarHBondContact O-N 3.29Š| ||
| 170 | I | 79.6 | Confident | 83.8 | Confident | 52 Ų | 52 | 91 Ų | 91 | 27% | 0.267 | 49% | 0.491 | S | S | . | . | trans | -104.5 | 139.9 | 175 | -63.4 | 114.6 | 0 | 0 | 0 | 107.4 | R155 A168 P178 | R155-I170 VanDerWaalsContact C-CD1 3.42Å; R155-I170 HydrophobicContact CB-CD1 3.43Å; R155-I170 VanDerWaalsContact CB-CD1 3.43Å; R155-I170 HydrophobicContact CG-CD1 3.91Å; R155-I170 WeakPolarHBondContact O-CD1 3.26Å; R155-I170 VanDerWaalsContact O-CG1 3.25Å; R155-I170 WeakPolarHBondContact O-CG1 3.43Å; A168-I170 HydrophobicContact CB-CD1 4.29Å; I170-P178 HydrophobicContact CG2-CG 4.19Å | ||
| 171 | D | 78.2 | Confident | 83.6 | Confident | 120 Ų | 120 | 86 Ų | 86 | 64% | 0.642 | 47% | 0.466 | S | S | * | . | trans | -63.4 | 126.3 | 177.8 | -64.3 | -48.5 | 0 | 0 | 0 | 109.8 | A173 V174 | D171-A173 PolarHBondContact O-N 3.4Å; D171-V174 HydrophobicContact CB-CG2 4.32Å; D171-V174 PolarHBondContact O-N 3.44Å; D171-V174 VanDerWaalsContact O-N 3.09Å | ||
| 172 | P | 75.5 | Confident | 83.4 | Confident | 124 Ų | 124 | 83.5 Ų | 83.5 | 81% | 0.805 | 46% | 0.455 | S | S | * | . | G | 310 helix | trans | -56.6 | -22.3 | -179.2 | -26.2 | 34.1 | 0 | 0 | 0 | 114.1 | V174 G175 | P172-V174 VanDerWaalsContact C-N 3.31Å; P172-V174 PolarHBondContact O-N 2.92Å; P172-G175 PolarHBondContact O-N 3.47Å |
| 173 | A | 75.4 | Confident | 83 | Confident | 102 Ų | 102 | 80.2 Ų | 80.2 | 84% | 0.843 | 44% | 0.439 | S | S | * | . | G | 310 helix | trans | -67.2 | -27 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | D171 G175 | D171-A173 PolarHBondContact O-N 3.4Å; A173-G175 PolarHBondContact O-N 2.82Å |
| 174 | V | 73.3 | Confident | 82.7 | Confident | 92 Ų | 92 | 80.6 Ų | 80.6 | 56% | 0.558 | 44% | 0.441 | S | S | * | . | G | 310 helix | trans | -85.4 | -1.2 | 179.2 | -161.2 | 0 | 0 | 0 | 0 | 111.3 | D171 P172 P178 | D171-V174 HydrophobicContact CB-CG2 4.32Å; D171-V174 PolarHBondContact O-N 3.44Å; D171-V174 VanDerWaalsContact O-N 3.09Å; P172-V174 VanDerWaalsContact C-N 3.31Å; P172-V174 PolarHBondContact O-N 2.92Å; V174-P178 HydrophobicContact CG1-CB 3.92Å |
| 175 | G | 75.1 | Confident | 82.4 | Confident | 31 Ų | 31 | 77.5 Ų | 77.5 | 32% | 0.32 | 42% | 0.423 | S | S | . | . | trans | 86.9 | 166.5 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113 | P172 A173 F177 | P172-G175 PolarHBondContact O-N 3.47Å; A173-G175 PolarHBondContact O-N 2.82Å; G175-F177 VanDerWaalsContact C-N 3.29Å; G175-F177 PolarHBondContact O-N 3.16Å | ||
| 176 | A | 78.6 | Confident | 82.1 | Confident | 68 Ų | 68 | 72.4 Ų | 72.4 | 56% | 0.562 | 41% | 0.412 | S | S | * | . | S | Bend | trans | -68 | -27.2 | -173 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 177 | F | 86.1 | Confident | 81.9 | Confident | 48 Ų | 48 | 76.8 Ų | 76.8 | 21% | 0.211 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 67.5 | -171.3 | -53.7 | -61.3 | 0 | 0 | 0 | 112.9 | Y154 R155 I163 G175 Y179 A180 G189 L191 | Y154-F177 CarbonylContact O-C 3.46Å; Y154-F177 WeakPolarHBondContact O-CA 3.36Å; R155-F177 HydrophobicContact CG-CD1 4.16Å; R155-F177 HydrophobicContact CG-CE1 4.31Å; I163-F177 HydrophobicContact CD1-CD1 3.49Å; I163-F177 VanDerWaalsContact CD1-CD1 3.49Å; I163-F177 HydrophobicContact CD1-CE1 3.24Å; I163-F177 HydrophobicContact CD1-CZ 4.3Å; I163-F177 HydrophobicContact CG1-CE1 4.29Å; G175-F177 VanDerWaalsContact C-N 3.29Å; G175-F177 PolarHBondContact O-N 3.16Å; F177-Y179 PolarHBondContact O-N 3.27Å; F177-A180 HydrophobicContact CB-CB 3.74Å; F177-A180 PolarHBondContact O-N 2.97Å; F177-A180 VanDerWaalsContact O-N 3.14Å; F177-G189 CarbonylContact O-C 3.17Å; F177-G189 WeakPolarHBondContact O-CA 3.47Å; F177-L191 HydrophobicContact CD2-CD1 3.84Å; F177-L191 HydrophobicContact CD2-CG 4.05Å; F177-L191 HydrophobicContact CE2-CD1 3.74Å; F177-L191 HydrophobicContact CE2-CG 4.45Å; F177-L191 HydrophobicContact CG-CD1 4.36Å; F177-L191 HydrophobicContact CG-CG 4.42Å; F177-L191 HydrophobicContact CZ-CD1 4.2Å |
| 178 | P | 86.8 | Confident | 81.7 | Confident | 25 Ų | 25 | 73.6 Ų | 73.6 | 16% | 0.162 | 42% | 0.421 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.7 | -30.9 | -174.7 | 22.1 | -32 | 0 | 0 | 0 | 113.9 | I170 V174 | I170-P178 HydrophobicContact CG2-CG 4.19Å; V174-P178 HydrophobicContact CG1-CB 3.92Å |
| 179 | Y | 87.2 | Confident | 81.8 | Confident | 116 Ų | 116 | 73 Ų | 73 | 46% | 0.455 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 3.8 | -177.8 | -52.3 | -82.6 | 0 | 0 | 0 | 113.3 | Y154 R155 C156 F177 | Y154-Y179 PolarHBondContact O-N 3.16Å; R155-Y179 VanDerWaalsContact O-CD2 3.31Å; R155-Y179 WeakPolarHBondContact O-CD2 3.37Å; R155-Y179 VanDerWaalsContact O-CE2 3.31Å; R155-Y179 WeakPolarHBondContact O-CE2 3.03Å; C156-Y179 VanDerWaalsContact CA-CE2 3.5Å; F177-Y179 PolarHBondContact O-N 3.27Å |
| 180 | A | 87.2 | Confident | 82 | Confident | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.7 | 123.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110 | Y154 F177 M188 G189 L191 | Y154-A180 HydrophobicContact CD1-CB 4.19Å; Y154-A180 HydrophobicContact CG-CB 4.13Å; F177-A180 HydrophobicContact CB-CB 3.74Å; F177-A180 PolarHBondContact O-N 2.97Å; F177-A180 VanDerWaalsContact O-N 3.14Å; A180-M188 CarbonylContact O-C 3.49Å; A180-M188 VanDerWaalsContact O-CA 3.25Å; A180-M188 WeakPolarHBondContact O-CA 3.09Å; A180-G189 PolarHBondContact O-N 3.49Å; A180-L191 HydrophobicContact CB-CD2 3.89Å; A180-L191 HydrophobicContact CB-CG 4.31Å |
| 181 | K | 85.6 | Confident | 82.3 | Confident | 72 Ų | 72 | 64.3 Ų | 64.3 | 31% | 0.313 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.8 | 127.9 | 164 | -73.5 | 178.6 | -179.1 | -173 | 0 | 109.1 | D147 M148 M188 | D147-K181 PolarHBondContact O-NZ 2.96Å; M148-K181 HydrophobicContact SD-CB 4.42Å; M148-K181 HydrophobicContact SD-CD 3.99Å; K181-M188 HydrophobicContact CG-CG 3.59Å; K181-M188 HydrophobicContact CG-SD 4.22Å |
| 182 | C | 84.3 | Confident | 82.4 | Confident | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 36% | 0.358 | C | S | . | . | P | Polyproline II helix | trans | -71.2 | 129.6 | 176.5 | -178.5 | 0 | 0 | 0 | 0 | 110.7 | I184 C185 G186 E187 H190 | C182-I184 PolarHBondContact O-N 3.38Å; C182-I184 PolarHBondContact SG-N 3.04Å; C182-I184 VanDerWaalsContact SG-N 3.41Å; C182-C185 VanDerWaalsContact CB-SG 3.51Å; C182-G186 WeakPolarHBondContact O-CA 3.41Å; C182-G186 PolarHBondContact O-N 3.47Å; C182-E187 WeakPolarHBondContact CB-O 3.24Å; C182-E187 PolarHBondContact N-O 3.49Å; C182-H190 VanDerWaalsContact CB-NE2 3.32Å; C182-H190 WeakPolarHBondContact CB-NE2 3.38Å; C182-H190 PolarHBondContact SG-NE2 3.43Å; C182-H190 VanDerWaalsContact SG-NE2 3.38Å |
| 183 | F | 79.9 | Confident | 82.6 | Confident | 63 Ų | 63 | 61.4 Ų | 61.4 | 28% | 0.276 | 35% | 0.349 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.9 | -0.1 | 177.6 | -56.6 | -70.3 | 0 | 0 | 0 | 114.2 | H128 I136 S192 | H128-F183 AromaticContact ND1-CD1 3.78Å; I136-F183 HydrophobicContact CD1-CE1 3.94Å; I136-F183 HydrophobicContact CD1-CZ 3.81Å; F183-S192 VanDerWaalsContact CB-OG 3.31Å; F183-S192 WeakPolarHBondContact CB-OG 3.4Å; F183-S192 WeakPolarHBondContact CD2-OG 3.23Å; F183-S192 PolarHBondContact N-OG 3.27Å |
| 184 | I | 80 | Confident | 82.8 | Confident | 57 Ų | 57 | 60.7 Ų | 60.7 | 29% | 0.292 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.8 | -58.8 | -177 | -56.3 | 173.3 | 0 | 0 | 0 | 110 | C182 S192 N198 | C182-I184 PolarHBondContact O-N 3.38Å; C182-I184 PolarHBondContact SG-N 3.04Å; C182-I184 VanDerWaalsContact SG-N 3.41Å; I184-S192 WeakPolarHBondContact CD1-O 3.38Å; I184-N198 HydrophobicContact CD1-CB 4.07Å; I184-N198 WeakPolarHBondContact CD1-ND2 3.49Å; I184-N198 WeakPolarHBondContact CD1-OD1 3.41Å |
| 185 | C | 82.8 | Confident | 83.4 | Confident | 45 Ų | 45 | 56.8 Ų | 56.8 | 30% | 0.304 | 31% | 0.314 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.5 | -12 | 179.6 | 65.1 | 0 | 0 | 0 | 0 | 114.1 | C182 E187 H190 | C182-C185 VanDerWaalsContact CB-SG 3.51Å; C185-E187 HydrophobicContact CB-CG 4.4Å; C185-E187 PolarHBondContact O-N 3.21Å; C185-H190 PolarHBondContact SG-CE1 3.31Å; C185-H190 PolarHBondContact SG-NE2 3.45Å |
| 186 | G | 81.2 | Confident | 83.7 | Confident | 40 Ų | 40 | 60.2 Ų | 60.2 | 41% | 0.412 | 33% | 0.33 | S | S | . | . | trans | 78 | -8.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | C182 | C182-G186 WeakPolarHBondContact O-CA 3.41Å; C182-G186 PolarHBondContact O-N 3.47Å | ||
| 187 | E | 86.3 | Confident | 83.8 | Confident | 110 Ų | 110 | 62.1 Ų | 62.1 | 51% | 0.514 | 33% | 0.331 | S | S | . | . | trans | -72.8 | 154 | -179.4 | -59.9 | -177.2 | 160.8 | 0 | 0 | 112.6 | C182 C185 H190 | C182-E187 WeakPolarHBondContact CB-O 3.24Å; C182-E187 PolarHBondContact N-O 3.49Å; C185-E187 HydrophobicContact CB-CG 4.4Å; C185-E187 PolarHBondContact O-N 3.21Å; E187-H190 IonicContact OE2-CE1 3.99Å | ||
| 188 | M | 85.8 | Confident | 83.3 | Confident | 130 Ų | 130 | 61 Ų | 61 | 64% | 0.64 | 33% | 0.327 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92 | 150.8 | 176.9 | -66.7 | -172.3 | -54 | 0 | 0 | 111.6 | A180 K181 | A180-M188 CarbonylContact O-C 3.49Å; A180-M188 VanDerWaalsContact O-CA 3.25Å; A180-M188 WeakPolarHBondContact O-CA 3.09Å; K181-M188 HydrophobicContact CG-CG 3.59Å; K181-M188 HydrophobicContact CG-SD 4.22Å |
| 189 | G | 87.3 | Confident | 82.7 | Confident | 29 Ų | 29 | 65.2 Ų | 65.2 | 30% | 0.299 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 112.6 | -10.3 | 173 | 0 | 0 | 0 | 0 | 0 | 114.9 | F177 A180 | F177-G189 CarbonylContact O-C 3.17Å; F177-G189 WeakPolarHBondContact O-CA 3.47Å; A180-G189 PolarHBondContact O-N 3.49Å |
| 190 | H | 86.9 | Confident | 81.9 | Confident | 29 Ų | 29 | 65.3 Ų | 65.3 | 13% | 0.134 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -145.2 | 160.3 | 179 | 66.3 | -90.8 | 0 | 0 | 0 | 112.7 | C182 C185 E187 C195 | C182-H190 VanDerWaalsContact CB-NE2 3.32Å; C182-H190 WeakPolarHBondContact CB-NE2 3.38Å; C182-H190 PolarHBondContact SG-NE2 3.43Å; C182-H190 VanDerWaalsContact SG-NE2 3.38Å; C185-H190 PolarHBondContact SG-CE1 3.31Å; C185-H190 PolarHBondContact SG-NE2 3.45Å; E187-H190 IonicContact OE2-CE1 3.99Å; H190-C195 VanDerWaalsContact CD2-CA 3.41Å; H190-C195 WeakPolarHBondContact CD2-CA 3.46Å; H190-C195 WeakPolarHBondContact NE2-CB 3.5Å; H190-C195 PolarHBondContact NE2-SG 3.17Å |
| 191 | L | 85.1 | Confident | 81.3 | Confident | 50 Ų | 50 | 65.5 Ų | 65.5 | 26% | 0.262 | 36% | 0.36 | S | S | . | . | trans | -91 | 156.5 | 172.6 | -67.9 | 168.4 | 0 | 0 | 0 | 109.9 | Y154 F177 A180 R193 S194 C195 | Y154-L191 HydrophobicContact CD2-CD2 4.27Å; F177-L191 HydrophobicContact CD2-CD1 3.84Å; F177-L191 HydrophobicContact CD2-CG 4.05Å; F177-L191 HydrophobicContact CE2-CD1 3.74Å; F177-L191 HydrophobicContact CE2-CG 4.45Å; F177-L191 HydrophobicContact CG-CD1 4.36Å; F177-L191 HydrophobicContact CG-CG 4.42Å; F177-L191 HydrophobicContact CZ-CD1 4.2Å; A180-L191 HydrophobicContact CB-CD2 3.89Å; A180-L191 HydrophobicContact CB-CG 4.31Å; L191-R193 PolarHBondContact O-N 2.84Å; L191-S194 CarbonylContact O-C 3.55Å; L191-S194 PolarHBondContact O-N 2.9Å; L191-C195 PolarHBondContact O-N 3.04Å | ||
| 192 | S | 80.4 | Confident | 80.8 | Confident | 22 Ų | 22 | 63.8 Ų | 63.8 | 15% | 0.154 | 35% | 0.354 | C | S | . | . | G | 310 helix | trans | -52.4 | -23.1 | 177.5 | -52.8 | 0 | 0 | 0 | 0 | 115.2 | F183 I184 N198 | F183-S192 VanDerWaalsContact CB-OG 3.31Å; F183-S192 WeakPolarHBondContact CB-OG 3.4Å; F183-S192 WeakPolarHBondContact CD2-OG 3.23Å; F183-S192 PolarHBondContact N-OG 3.27Å; I184-S192 WeakPolarHBondContact CD1-O 3.38Å; S192-N198 PolarHBondContact O-ND2 2.92Å |
| 193 | R | 79.9 | Confident | 80.3 | Confident | 161 Ų | 161 | 66.6 Ų | 66.6 | 61% | 0.608 | 37% | 0.365 | S | S | * | . | G | 310 helix | trans | -73.4 | -31.3 | 175.8 | 178.6 | 168.4 | 178.9 | 164.5 | 0.3 | 113.2 | L191 L202 | L191-R193 PolarHBondContact O-N 2.84Å; R193-L202 HydrophobicContact CG-CD1 4.31Å; R193-L202 HydrophobicContact CG-CD2 4.31Å; R193-L202 HydrophobicContact CG-CG 4.11Å |
| 194 | S | 80.3 | Confident | 79.9 | Confident | 86 Ų | 86 | 67.3 Ų | 67.3 | 60% | 0.601 | 38% | 0.382 | S | S | * | . | G | 310 helix | trans | -108.2 | 20.3 | -178.1 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | L191 | L191-S194 CarbonylContact O-C 3.55Å; L191-S194 PolarHBondContact O-N 2.9Å |
| 195 | C | 85.1 | Confident | 79.5 | Confident | 11 Ų | 11 | 73.8 Ų | 73.8 | 7% | 0.074 | 41% | 0.411 | C | S | . | . | trans | -74.2 | 124.9 | 176.1 | -174.7 | 0 | 0 | 0 | 0 | 108.9 | H190 L191 D197 N198 | H190-C195 VanDerWaalsContact CD2-CA 3.41Å; H190-C195 WeakPolarHBondContact CD2-CA 3.46Å; H190-C195 WeakPolarHBondContact NE2-CB 3.5Å; H190-C195 PolarHBondContact NE2-SG 3.17Å; L191-C195 PolarHBondContact O-N 3.04Å; C195-D197 VanDerWaalsContact C-N 3.28Å; C195-N198 HydrophobicContact CB-CB 4.33Å | ||
| 196 | P | 81.1 | Confident | 79.2 | Confident | 102 Ų | 102 | 73.1 Ų | 73.1 | 66% | 0.662 | 41% | 0.413 | S | S | * | . | S | Bend | trans | -65.2 | -35.9 | 177.3 | 26.2 | -32.8 | 0 | 0 | 0 | 111.2 | N198 | P196-N198 PolarHBondContact O-N 3.26Š|
| 197 | D | 80.5 | Confident | 79.2 | Confident | 109 Ų | 109 | 72.9 Ų | 72.9 | 58% | 0.583 | 41% | 0.41 | S | S | * | . | S | Bend | trans | -97.8 | 56.8 | -178.1 | -59.5 | -38.7 | 0 | 0 | 0 | 111.6 | C195 P199 | C195-D197 VanDerWaalsContact C-N 3.28Å; D197-P199 WeakPolarHBondContact O-CD 3.34Å |
| 198 | N | 75.6 | Confident | 79.2 | Confident | 24 Ų | 24 | 70.5 Ų | 70.5 | 13% | 0.128 | 41% | 0.405 | C | S | . | . | trans | -100.4 | 95 | 178.7 | -172.5 | -6.5 | 0 | 0 | 0 | 112.4 | I184 S192 C195 P196 K200 G201 | I184-N198 HydrophobicContact CD1-CB 4.07Å; I184-N198 WeakPolarHBondContact CD1-ND2 3.49Å; I184-N198 WeakPolarHBondContact CD1-OD1 3.41Å; S192-N198 PolarHBondContact O-ND2 2.92Å; C195-N198 HydrophobicContact CB-CB 4.33Å; P196-N198 PolarHBondContact O-N 3.26Å; N198-K200 PolarHBondContact O-N 2.92Å; N198-K200 PolarHBondContact OD1-N 3.38Å; N198-G201 WeakPolarHBondContact ND2-CA 3.5Å; N198-G201 PolarHBondContact ND2-O 3.37Å; N198-G201 PolarHBondContact O-N 3.08Å; N198-G201 VanDerWaalsContact O-N 3.13Å; N198-G201 WeakPolarHBondContact OD1-CA 3.31Å; N198-G201 PolarHBondContact OD1-N 3.41Å | ||
| 199 | P | 74 | Confident | 79.2 | Confident | 114 Ų | 114 | 64.3 Ų | 64.3 | 74% | 0.74 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | -19.9 | -179.4 | 28 | -36.2 | 0 | 0 | 0 | 113.5 | D197 | D197-P199 WeakPolarHBondContact O-CD 3.34Š|
| 200 | K | 70.8 | Confident | 79.1 | Confident | 117 Ų | 117 | 73.9 Ų | 73.9 | 51% | 0.509 | 40% | 0.402 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.1 | -9 | 178.3 | -65.3 | 178.9 | -179.5 | 177.5 | 0 | 112.5 | N198 G206 | N198-K200 PolarHBondContact O-N 2.92Å; N198-K200 PolarHBondContact OD1-N 3.38Å; K200-G206 WeakPolarHBondContact O-CA 3.43Å |
| 201 | G | 74.9 | Confident | 79.1 | Confident | 5 Ų | 5 | 76.2 Ų | 76.2 | 5% | 0.052 | 42% | 0.415 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 46.8 | -152.1 | -171 | 0 | 0 | 0 | 0 | 0 | 116.2 | N198 Y203 | N198-G201 WeakPolarHBondContact ND2-CA 3.5Å; N198-G201 PolarHBondContact ND2-O 3.37Å; N198-G201 PolarHBondContact O-N 3.08Å; N198-G201 VanDerWaalsContact O-N 3.13Å; N198-G201 WeakPolarHBondContact OD1-CA 3.31Å; N198-G201 PolarHBondContact OD1-N 3.41Å; G201-Y203 VanDerWaalsContact C-N 3.27Å; G201-Y203 PolarHBondContact O-N 3.46Å |
| 202 | L | 74.3 | Confident | 79.2 | Confident | 35 Ų | 35 | 76 Ų | 76 | 18% | 0.183 | 42% | 0.417 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.7 | -15.7 | -170.7 | -98.4 | 69.9 | 0 | 0 | 0 | 114.7 | R193 V215 E216 F218 | R193-L202 HydrophobicContact CG-CD1 4.31Å; R193-L202 HydrophobicContact CG-CD2 4.31Å; R193-L202 HydrophobicContact CG-CG 4.11Å; L202-V215 PolarHBondContact N-O 2.82Å; L202-V215 VanDerWaalsContact N-O 3.16Å; L202-E216 WeakPolarHBondContact CD1-O 3.48Å; L202-E216 WeakPolarHBondContact CD2-O 3.3Å; L202-F218 HydrophobicContact CB-CE1 4.15Å; L202-F218 HydrophobicContact CB-CE2 4.44Å; L202-F218 HydrophobicContact CB-CZ 3.99Å; L202-F218 HydrophobicContact CD2-CD2 4.13Å; L202-F218 HydrophobicContact CD2-CE2 3.76Å; L202-F218 HydrophobicContact CD2-CZ 4.15Å; L202-F218 HydrophobicContact CG-CZ 4.46Å |
| 203 | Y | 74.7 | Confident | 79.3 | Confident | 59 Ų | 59 | 77 Ų | 77 | 23% | 0.231 | 43% | 0.431 | C | S | . | . | S | Bend | trans | -82.8 | 139.2 | -177 | -66 | -92.8 | 0 | 0 | 0 | 111.5 | R130 G201 E205 G206 G207 F218 R219 | R130-Y203 PolarHBondContact NH1-O 3.28Å; G201-Y203 VanDerWaalsContact C-N 3.27Å; G201-Y203 PolarHBondContact O-N 3.46Å; Y203-E205 VanDerWaalsContact C-N 3.31Å; Y203-E205 PolarHBondContact O-N 3.36Å; Y203-G206 PolarHBondContact O-N 3.42Å; Y203-G207 WeakPolarHBondContact CD2-O 3.32Å; Y203-F218 HydrophobicContact CD1-CD1 4.25Å; Y203-F218 HydrophobicContact CD1-CE1 4.28Å; Y203-F218 AromaticContact CE1-CD1 3.8Å; Y203-F218 HydrophobicContact CE1-CD1 3.8Å; Y203-F218 HydrophobicContact CE1-CE1 4.29Å; Y203-F218 HydrophobicContact CE2-CD1 4.41Å; Y203-F218 AromaticContact CZ-CD1 3.91Å; Y203-F218 WeakPolarHBondContact OH-CA 3.19Å; Y203-R219 PolarHBondContact OH-N 3.3Å |
| 204 | A | 70.4 | Confident | 79.6 | Confident | 78 Ų | 78 | 70.8 Ų | 70.8 | 65% | 0.645 | 41% | 0.412 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -36.1 | -177 | 0 | 0 | 0 | 0 | 0 | 112.9 | R130 | R130-A204 PolarHBondContact NH1-O 3.32Š|
| 205 | E | 71.8 | Confident | 79.8 | Confident | 193 Ų | 193 | 69.2 Ų | 69.2 | 90% | 0.902 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -1.3 | 180 | -65.8 | 177.8 | 174.2 | 0 | 0 | 113.1 | Y203 | Y203-E205 VanDerWaalsContact C-N 3.31Å; Y203-E205 PolarHBondContact O-N 3.36Å |
| 206 | G | 76.5 | Confident | 79.7 | Confident | 32 Ų | 32 | 76.4 Ų | 76.4 | 33% | 0.33 | 43% | 0.431 | S | S | . | . | trans | 79.3 | 136 | -165.6 | 0 | 0 | 0 | 0 | 0 | 111 | K200 Y203 | K200-G206 WeakPolarHBondContact O-CA 3.43Å; Y203-G206 PolarHBondContact O-N 3.42Å | ||
| 207 | G | 82.4 | Confident | 79.8 | Confident | 35 Ų | 35 | 73.1 Ų | 73.1 | 36% | 0.361 | 41% | 0.407 | S | S | . | . | trans | 159.7 | 167.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y203 V215 | Y203-G207 WeakPolarHBondContact CD2-O 3.32Å; G207-V215 WeakPolarHBondContact O-CG1 3.04Å | ||
| 208 | C | 84.6 | Confident | 80 | Confident | 60 Ų | 60 | 71.1 Ų | 71.1 | 41% | 0.405 | 39% | 0.393 | S | S | . | . | trans | -116.5 | 165.4 | 178.4 | 58.4 | 0 | 0 | 0 | 0 | 111.4 | R210 G213 S214 | C208-R210 PolarHBondContact O-N 3.3Å; C208-G213 WeakPolarHBondContact CB-O 3.37Å; C208-S214 CarbonylContact C-O 3.47Å; C208-S214 VanDerWaalsContact CA-O 3.29Å; C208-S214 WeakPolarHBondContact CA-O 3.25Å; C208-S214 WeakPolarHBondContact CB-O 3.38Å | ||
| 209 | C | 86.9 | Confident | 80.5 | Confident | 0 Ų | 0 | 76.5 Ų | 76.5 | 0% | 0 | 41% | 0.411 | C | S | . | . | trans | -54.7 | 124 | 166.9 | -176.9 | 0 | 0 | 0 | 0 | 109.4 | L211 G213 S214 | C209-L211 PolarHBondContact O-N 3.44Å; C209-L211 VanDerWaalsContact O-N 3.14Å; C209-G213 WeakPolarHBondContact O-CA 3.48Å; C209-G213 PolarHBondContact O-N 3.13Å; C209-S214 WeakPolarHBondContact CB-O 3.22Å; C209-S214 PolarHBondContact N-O 2.98Å | ||
| 210 | R | 84.6 | Confident | 80.9 | Confident | 230 Ų | 230 | 79.5 Ų | 79.5 | 87% | 0.868 | 41% | 0.413 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71 | -6.4 | -177.7 | -61.1 | -177.2 | -173.3 | 174.2 | -0 | 114.3 | C208 | C208-R210 PolarHBondContact O-N 3.3Š|
| 211 | L | 86.8 | Confident | 81.6 | Confident | 78 Ų | 78 | 78.6 Ų | 78.6 | 41% | 0.408 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.3 | -61.8 | 178.4 | -62.5 | 171.7 | 0 | 0 | 0 | 109.8 | C209 R219 C222 N225 | C209-L211 PolarHBondContact O-N 3.44Å; C209-L211 VanDerWaalsContact O-N 3.14Å; L211-R219 HydrophobicContact CD1-CG 3.96Å; L211-R219 HydrophobicContact CG-CG 4.32Å; L211-C222 HydrophobicContact CD1-CB 4.38Å; L211-N225 HydrophobicContact CD1-CB 3.56Å |
| 212 | C | 86.8 | Confident | 82.3 | Confident | 45 Ų | 45 | 78.4 Ų | 78.4 | 30% | 0.304 | 41% | 0.411 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | -6.4 | -175.8 | 64.4 | 0 | 0 | 0 | 0 | 115.2 | S214 H217 C222 E224 | C212-S214 PolarHBondContact O-N 3.41Å; C212-S214 PolarHBondContact SG-OG 3.2Å; C212-S214 VanDerWaalsContact SG-OG 3.41Å; C212-H217 PolarHBondContact SG-CE1 3.38Å; C212-H217 PolarHBondContact SG-NE2 3.46Å; C212-C222 VanDerWaalsContact SG-SG 3.6Å; C212-E224 VanDerWaalsContact CB-OE2 3.3Å; C212-E224 WeakPolarHBondContact CB-OE2 3.41Å |
| 213 | G | 84.4 | Confident | 82.8 | Confident | 44 Ų | 44 | 80.6 Ų | 80.6 | 45% | 0.454 | 43% | 0.428 | S | S | . | . | trans | 73.6 | 4.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | C208 C209 | C208-G213 WeakPolarHBondContact CB-O 3.37Å; C209-G213 WeakPolarHBondContact O-CA 3.48Å; C209-G213 PolarHBondContact O-N 3.13Å | ||
| 214 | S | 84.8 | Confident | 83.2 | Confident | 30 Ų | 30 | 82.7 Ų | 82.7 | 21% | 0.21 | 44% | 0.439 | C | S | . | . | trans | -76.2 | 153.5 | 178.1 | 85.2 | 0 | 0 | 0 | 0 | 112.7 | C208 C209 C212 H217 | C208-S214 CarbonylContact C-O 3.47Å; C208-S214 VanDerWaalsContact CA-O 3.29Å; C208-S214 WeakPolarHBondContact CA-O 3.25Å; C208-S214 WeakPolarHBondContact CB-O 3.38Å; C209-S214 WeakPolarHBondContact CB-O 3.22Å; C209-S214 PolarHBondContact N-O 2.98Å; C212-S214 PolarHBondContact O-N 3.41Å; C212-S214 PolarHBondContact SG-OG 3.2Å; C212-S214 VanDerWaalsContact SG-OG 3.41Å; S214-H217 PolarHBondContact OG-CE1 3.38Å; S214-H217 PolarHBondContact OG-ND1 2.99Å; S214-H217 VanDerWaalsContact OG-ND1 3.09Å; S214-H217 PolarHBondContact OG-NE2 2.91Å | ||
| 215 | V | 83.9 | Confident | 83.6 | Confident | 52 Ų | 52 | 80.9 Ų | 80.9 | 32% | 0.315 | 42% | 0.419 | S | S | . | . | S | Bend | trans | -102.4 | -4.8 | -179.6 | -135.5 | 0 | 0 | 0 | 0 | 112.9 | L202 G207 | L202-V215 PolarHBondContact N-O 2.82Å; L202-V215 VanDerWaalsContact N-O 3.16Å; G207-V215 WeakPolarHBondContact O-CG1 3.04Å |
| 216 | E | 83.3 | Confident | 83.4 | Confident | 163 Ų | 163 | 79 Ų | 79 | 76% | 0.762 | 41% | 0.411 | S | S | * | . | S | Bend | trans | -83.6 | -23.2 | -171.8 | -63.7 | -178 | 168.8 | 0 | 0 | 113.8 | L202 | L202-E216 WeakPolarHBondContact CD1-O 3.48Å; L202-E216 WeakPolarHBondContact CD2-O 3.3Å |
| 217 | H | 83.4 | Confident | 82.8 | Confident | 32 Ų | 32 | 84.1 Ų | 84.1 | 15% | 0.148 | 43% | 0.43 | C | S | . | . | S | Bend | trans | -134 | 156.6 | -175.9 | 61.5 | -111.5 | 0 | 0 | 0 | 113.5 | C212 S214 D221 C222 P223 | C212-H217 PolarHBondContact SG-CE1 3.38Å; C212-H217 PolarHBondContact SG-NE2 3.46Å; S214-H217 PolarHBondContact OG-CE1 3.38Å; S214-H217 PolarHBondContact OG-ND1 2.99Å; S214-H217 VanDerWaalsContact OG-ND1 3.09Å; S214-H217 PolarHBondContact OG-NE2 2.91Å; H217-D221 HydrophobicContact CB-CB 4.37Å; H217-C222 VanDerWaalsContact CD2-CA 3.43Å; H217-C222 WeakPolarHBondContact CD2-CA 3.3Å; H217-C222 VanDerWaalsContact NE2-CA 3.32Å; H217-C222 WeakPolarHBondContact NE2-CA 3.35Å; H217-C222 VanDerWaalsContact NE2-CB 3.26Å; H217-C222 WeakPolarHBondContact NE2-CB 3.37Å; H217-C222 PolarHBondContact NE2-SG 2.83Å; H217-P223 VanDerWaalsContact CE1-CD 3.49Å; H217-P223 WeakPolarHBondContact CE1-CD 3.38Å |
| 218 | F | 85.7 | Confident | 81.8 | Confident | 67 Ų | 67 | 85.1 Ų | 85.1 | 29% | 0.294 | 43% | 0.432 | S | S | . | . | trans | -75.1 | 152 | 168.5 | -66.1 | -66.9 | 0 | 0 | 0 | 110 | L202 Y203 K220 D221 C222 | L202-F218 HydrophobicContact CB-CE1 4.15Å; L202-F218 HydrophobicContact CB-CE2 4.44Å; L202-F218 HydrophobicContact CB-CZ 3.99Å; L202-F218 HydrophobicContact CD2-CD2 4.13Å; L202-F218 HydrophobicContact CD2-CE2 3.76Å; L202-F218 HydrophobicContact CD2-CZ 4.15Å; L202-F218 HydrophobicContact CG-CZ 4.46Å; Y203-F218 HydrophobicContact CD1-CD1 4.25Å; Y203-F218 HydrophobicContact CD1-CE1 4.28Å; Y203-F218 AromaticContact CE1-CD1 3.8Å; Y203-F218 HydrophobicContact CE1-CD1 3.8Å; Y203-F218 HydrophobicContact CE1-CE1 4.29Å; Y203-F218 HydrophobicContact CE2-CD1 4.41Å; Y203-F218 AromaticContact CZ-CD1 3.91Å; Y203-F218 WeakPolarHBondContact OH-CA 3.19Å; F218-K220 PolarHBondContact O-N 3.26Å; F218-D221 CarbonylContact O-C 3.54Å; F218-D221 PolarHBondContact O-N 2.89Å; F218-C222 PolarHBondContact O-N 3.32Å | ||
| 219 | R | 84.9 | Confident | 80.8 | Confident | 137 Ų | 137 | 89.2 Ų | 89.2 | 52% | 0.517 | 45% | 0.45 | S | S | . | . | G | 310 helix | trans | -46.4 | -35.5 | 176.2 | -179.6 | -178.9 | 175.1 | -130.7 | -3.9 | 113.7 | Y203 L211 D221 C222 N225 | Y203-R219 PolarHBondContact OH-N 3.3Å; L211-R219 HydrophobicContact CD1-CG 3.96Å; L211-R219 HydrophobicContact CG-CG 4.32Å; R219-D221 VanDerWaalsContact C-N 3.33Å; R219-C222 WeakPolarHBondContact O-CB 3.32Å; R219-C222 PolarHBondContact O-N 3.24Å; R219-N225 WeakPolarHBondContact O-CB 3.44Å |
| 220 | K | 83.8 | Confident | 79.6 | Confident | 177 Ų | 177 | 96.2 Ų | 96.2 | 77% | 0.77 | 48% | 0.482 | S | S | * | . | G | 310 helix | trans | -65.3 | -36.8 | 179.4 | -63.5 | -175.5 | 178.2 | -174.6 | 0 | 113.1 | F218 C222 | F218-K220 PolarHBondContact O-N 3.26Å; K220-C222 VanDerWaalsContact C-N 3.28Å |
| 221 | D | 85.2 | Confident | 78.6 | Confident | 99 Ų | 99 | 91.6 Ų | 91.6 | 53% | 0.529 | 48% | 0.479 | S | S | . | . | G | 310 helix | trans | -95.7 | 12.7 | -177.4 | -49.9 | -42.4 | 0 | 0 | 0 | 110.8 | H217 F218 R219 | H217-D221 HydrophobicContact CB-CB 4.37Å; F218-D221 CarbonylContact O-C 3.54Å; F218-D221 PolarHBondContact O-N 2.89Å; R219-D221 VanDerWaalsContact C-N 3.33Å |
| 222 | C | 88.3 | Confident | 77.5 | Confident | 0 Ų | 0 | 93 Ų | 93 | 0% | 0 | 49% | 0.491 | C | S | . | . | trans | -71.2 | 127.2 | 178 | -176.1 | 0 | 0 | 0 | 0 | 109.4 | L211 C212 H217 F218 R219 K220 E224 N225 | L211-C222 HydrophobicContact CD1-CB 4.38Å; C212-C222 VanDerWaalsContact SG-SG 3.6Å; H217-C222 VanDerWaalsContact CD2-CA 3.43Å; H217-C222 WeakPolarHBondContact CD2-CA 3.3Å; H217-C222 VanDerWaalsContact NE2-CA 3.32Å; H217-C222 WeakPolarHBondContact NE2-CA 3.35Å; H217-C222 VanDerWaalsContact NE2-CB 3.26Å; H217-C222 WeakPolarHBondContact NE2-CB 3.37Å; H217-C222 PolarHBondContact NE2-SG 2.83Å; F218-C222 PolarHBondContact O-N 3.32Å; R219-C222 WeakPolarHBondContact O-CB 3.32Å; R219-C222 PolarHBondContact O-N 3.24Å; K220-C222 VanDerWaalsContact C-N 3.28Å; C222-E224 PolarHBondContact O-N 3.47Å; C222-N225 HydrophobicContact CB-CB 3.82Å; C222-N225 VanDerWaalsContact O-CB 3.31Å; C222-N225 WeakPolarHBondContact O-CB 3.31Å; C222-N225 PolarHBondContact O-N 2.88Å | ||
| 223 | P | 85.4 | Confident | 76.6 | Confident | 81 Ų | 81 | 96.4 Ų | 96.4 | 53% | 0.526 | 51% | 0.51 | S | S | . | . | G | 310 helix | trans | -59.9 | -34.2 | 179.4 | 24.4 | -33.1 | 0 | 0 | 0 | 111.5 | H217 N225 Q226 | H217-P223 VanDerWaalsContact CE1-CD 3.49Å; H217-P223 WeakPolarHBondContact CE1-CD 3.38Å; P223-N225 VanDerWaalsContact C-N 3.3Å; P223-N225 PolarHBondContact O-N 3.18Å; P223-Q226 PolarHBondContact O-N 2.73Å |
| 224 | E | 84 | Confident | 75.9 | Confident | 103 Ų | 103 | 97 Ų | 97 | 48% | 0.481 | 52% | 0.516 | S | S | . | . | G | 310 helix | trans | -70.6 | -24 | 175.9 | -65.2 | 172.7 | -171 | 0 | 0 | 113.2 | C212 C222 Q226 N227 | C212-E224 VanDerWaalsContact CB-OE2 3.3Å; C212-E224 WeakPolarHBondContact CB-OE2 3.41Å; C222-E224 PolarHBondContact O-N 3.47Å; E224-Q226 VanDerWaalsContact C-N 3.27Å; E224-Q226 PolarHBondContact O-N 3.32Å; E224-N227 PolarHBondContact O-N 3.14Å |
| 225 | N | 78.3 | Confident | 75.1 | Confident | 41 Ų | 41 | 107.5 Ų | 107.5 | 22% | 0.219 | 55% | 0.551 | C | S | . | * | G | 310 helix | trans | -74.4 | -17.5 | 177.1 | -170.1 | 66.6 | 0 | 0 | 0 | 112.6 | L211 R219 C222 P223 N227 S228 | L211-N225 HydrophobicContact CD1-CB 3.56Å; R219-N225 WeakPolarHBondContact O-CB 3.44Å; C222-N225 HydrophobicContact CB-CB 3.82Å; C222-N225 VanDerWaalsContact O-CB 3.31Å; C222-N225 WeakPolarHBondContact O-CB 3.31Å; C222-N225 PolarHBondContact O-N 2.88Å; P223-N225 VanDerWaalsContact C-N 3.3Å; P223-N225 PolarHBondContact O-N 3.18Å; N225-N227 PolarHBondContact O-N 3.19Å; N225-S228 PolarHBondContact O-N 3.31Å; N225-S228 PolarHBondContact O-OG 3.1Å; N225-S228 PolarHBondContact OD1-OG 3.45Å |
| 226 | Q | 67.3 | Low | 74.3 | Confident | 154 Ų | 154 | 112.2 Ų | 112.2 | 72% | 0.72 | 56% | 0.563 | S | S | * | * | G | 310 helix | trans | -71 | -22.6 | 172.1 | -63.9 | -174.6 | 5.3 | 0 | 0 | 112.1 | P223 E224 | P223-Q226 PolarHBondContact O-N 2.73Å; E224-Q226 VanDerWaalsContact C-N 3.27Å; E224-Q226 PolarHBondContact O-N 3.32Å |
| 227 | N | 64.6 | Low | 73.8 | Confident | 138 Ų | 138 | 107.4 Ų | 107.4 | 74% | 0.738 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -88.1 | -12.2 | 177.2 | -62 | -31.5 | 0 | 0 | 0 | 112.9 | E224 N225 D229 | E224-N227 PolarHBondContact O-N 3.14Å; N225-N227 PolarHBondContact O-N 3.19Å; N227-D229 PolarHBondContact O-N 3.22Å |
| 228 | S | 61.6 | Low | 73.1 | Confident | 57 Ų | 57 | 113.5 Ų | 113.5 | 40% | 0.399 | 59% | 0.591 | S | S | . | * | S | Bend | trans | -87.7 | 88.9 | 169.7 | 61.3 | 0 | 0 | 0 | 0 | 108.4 | N225 H230 | N225-S228 PolarHBondContact O-N 3.31Å; N225-S228 PolarHBondContact O-OG 3.1Å; N225-S228 PolarHBondContact OD1-OG 3.45Å; S228-H230 VanDerWaalsContact C-N 3.34Å; S228-H230 PolarHBondContact O-N 3.25Å |
| 229 | D | 63 | Low | 72.5 | Confident | 146 Ų | 146 | 114.2 Ų | 114.2 | 78% | 0.781 | 62% | 0.618 | S | S | * | * | trans | -52.9 | 102.5 | 166.5 | -73.6 | -34.7 | 0 | 0 | 0 | 108.1 | N227 V231 | N227-D229 PolarHBondContact O-N 3.22Å; D229-V231 PolarHBondContact O-N 3.46Å | ||
| 230 | H | 61.3 | Low | 72 | Confident | 146 Ų | 146 | 112.1 Ų | 112.1 | 68% | 0.676 | 62% | 0.615 | S | S | * | * | trans | -66.5 | 108.7 | 174.6 | 59.4 | -79.5 | 0 | 0 | 0 | 106.4 | S228 T232 | S228-H230 VanDerWaalsContact C-N 3.34Å; S228-H230 PolarHBondContact O-N 3.25Å; H230-T232 VanDerWaalsContact CD2-CG2 3.45Å; H230-T232 WeakPolarHBondContact CD2-CG2 3.31Å; H230-T232 PolarHBondContact O-N 3.34Å | ||
| 231 | V | 64.6 | Low | 71.3 | Confident | 133 Ų | 133 | 107 Ų | 107 | 81% | 0.806 | 60% | 0.602 | S | S | * | * | trans | -68.2 | 84.6 | 164.6 | -178.7 | 0 | 0 | 0 | 0 | 106.3 | D229 V233 | D229-V231 PolarHBondContact O-N 3.46Å; V231-V233 VanDerWaalsContact C-N 3.33Å; V231-V233 PolarHBondContact O-N 3.01Å | ||
| 232 | T | 62.2 | Low | 70.4 | Confident | 107 Ų | 107 | 105.6 Ų | 105.6 | 66% | 0.656 | 60% | 0.604 | S | S | * | * | trans | -67.3 | 98.2 | 167.7 | 27.8 | 0 | 0 | 0 | 0 | 107.4 | H230 G234 | H230-T232 VanDerWaalsContact CD2-CG2 3.45Å; H230-T232 WeakPolarHBondContact CD2-CG2 3.31Å; H230-T232 PolarHBondContact O-N 3.34Å; T232-G234 PolarHBondContact O-N 3.28Å; T232-G234 VanDerWaalsContact O-N 3.15Å | ||
| 233 | V | 67.5 | Low | 69.6 | Low | 118 Ų | 118 | 112.5 Ų | 112.5 | 72% | 0.715 | 64% | 0.641 | S | S | * | * | trans | -57 | 120.9 | 162.1 | -169.9 | 0 | 0 | 0 | 0 | 106.2 | V231 R235 | V231-V233 VanDerWaalsContact C-N 3.33Å; V231-V233 PolarHBondContact O-N 3.01Å; V233-R235 PolarHBondContact O-N 3.33Å | ||
| 234 | G | 71.4 | Confident | 68.8 | Low | 56 Ų | 56 | 116.3 Ų | 116.3 | 58% | 0.577 | 65% | 0.646 | S | S | * | * | trans | -51.5 | 135.5 | -175.7 | 0 | 0 | 0 | 0 | 0 | 111 | T232 W236 | T232-G234 PolarHBondContact O-N 3.28Å; T232-G234 VanDerWaalsContact O-N 3.15Å; G234-W236 PolarHBondContact O-N 2.76Å; G234-W236 VanDerWaalsContact O-N 3.1Å | ||
| 235 | R | 67.6 | Low | 68 | Low | 250 Ų | 250 | 119.3 Ų | 119.3 | 94% | 0.943 | 66% | 0.66 | S | S | * | * | trans | -63.7 | 114.7 | 177 | 179.2 | 170 | 169.6 | -176.9 | -4.5 | 108.7 | V233 A237 | V233-R235 PolarHBondContact O-N 3.33Å; R235-A237 PolarHBondContact O-N 2.78Å | ||
| 236 | W | 66.6 | Low | 67.2 | Low | 151 Ų | 151 | 125.2 Ų | 125.2 | 57% | 0.572 | 69% | 0.686 | S | S | * | * | trans | -57.3 | 129.2 | 177.5 | -64.9 | -8.3 | 0 | 0 | 0 | 110.5 | G234 M240 A242 | G234-W236 PolarHBondContact O-N 2.76Å; G234-W236 VanDerWaalsContact O-N 3.1Å; W236-M240 HydrophobicContact CB-CB 4.23Å; W236-A242 VanDerWaalsContact CH2-CA 3.41Å; W236-A242 HydrophobicContact CH2-CB 3.41Å; W236-A242 VanDerWaalsContact CH2-CB 3.41Å; W236-A242 HydrophobicContact CZ2-CB 4.32Å; W236-A242 HydrophobicContact CZ3-CB 3.83Å | ||
| 237 | A | 73.9 | Confident | 66.8 | Low | 62 Ų | 62 | 124.7 Ų | 124.7 | 51% | 0.512 | 69% | 0.687 | S | S | . | * | trans | -69 | 151.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | R235 G239 M240 | R235-A237 PolarHBondContact O-N 2.78Å; A237-G239 PolarHBondContact O-N 3.29Å; A237-M240 HydrophobicContact CB-CG 4.2Å; A237-M240 HydrophobicContact CB-SD 3.86Å; A237-M240 PolarHBondContact N-SD 3.36Å; A237-M240 PolarHBondContact O-N 3.48Å | ||
| 238 | T | 68.6 | Low | 66.3 | Low | 160 Ų | 160 | 123.6 Ų | 123.6 | 98% | 0.982 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.4 | 105.3 | 176.4 | -45.8 | 0 | 0 | 0 | 0 | 109.5 | ||
| 239 | G | 72.7 | Confident | 66 | Low | 83 Ų | 83 | 129 Ų | 129 | 86% | 0.856 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 122.2 | -5.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | A237 | A237-G239 PolarHBondContact O-N 3.29Š|
| 240 | M | 74 | Confident | 65.4 | Low | 92 Ų | 92 | 128.2 Ų | 128.2 | 45% | 0.453 | 71% | 0.705 | S | S | . | * | trans | -88.6 | 127.4 | 173.9 | -58.7 | -179.7 | 81.7 | 0 | 0 | 110.5 | W236 A237 Y244 | W236-M240 HydrophobicContact CB-CB 4.23Å; A237-M240 HydrophobicContact CB-CG 4.2Å; A237-M240 HydrophobicContact CB-SD 3.86Å; A237-M240 PolarHBondContact N-SD 3.36Å; A237-M240 PolarHBondContact O-N 3.48Å; M240-Y244 HydrophobicContact CE-CD1 4.37Å | ||
| 241 | S | 70.1 | Confident | 65.1 | Low | 70 Ų | 70 | 126.3 Ų | 126.3 | 49% | 0.49 | 71% | 0.708 | S | S | . | * | trans | -89.9 | 157.2 | 173.7 | 51.3 | 0 | 0 | 0 | 0 | 111.3 | D243 Y244 | S241-D243 PolarHBondContact O-N 3.47Å; S241-Y244 WeakPolarHBondContact O-CB 3.25Å; S241-Y244 PolarHBondContact O-N 3.42Å | ||
| 242 | A | 64.6 | Low | 64.6 | Low | 70 Ų | 70 | 129.2 Ų | 129.2 | 58% | 0.579 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.4 | -25.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | W236 | W236-A242 VanDerWaalsContact CH2-CA 3.41Å; W236-A242 HydrophobicContact CH2-CB 3.41Å; W236-A242 VanDerWaalsContact CH2-CB 3.41Å; W236-A242 HydrophobicContact CZ2-CB 4.32Å; W236-A242 HydrophobicContact CZ3-CB 3.83Å |
| 243 | D | 72 | Confident | 64.4 | Low | 145 Ų | 145 | 132 Ų | 132 | 78% | 0.775 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | 21.9 | -177.3 | -48.2 | -38.7 | 0 | 0 | 0 | 112.9 | S241 E245 | S241-D243 PolarHBondContact O-N 3.47Å; D243-E245 PolarHBondContact O-N 3.19Å |
| 244 | Y | 68.1 | Low | 64 | Low | 160 Ų | 160 | 135.4 Ų | 135.4 | 63% | 0.627 | 73% | 0.728 | S | S | * | * | trans | -75.7 | 90.5 | 179.2 | -169 | -99.2 | 0 | 0 | 0 | 110.6 | M240 S241 E246 | M240-Y244 HydrophobicContact CE-CD1 4.37Å; S241-Y244 WeakPolarHBondContact O-CB 3.25Å; S241-Y244 PolarHBondContact O-N 3.42Å; Y244-E246 PolarHBondContact O-N 3.36Å | ||
| 245 | E | 67.3 | Low | 63.5 | Low | 167 Ų | 167 | 142.4 Ų | 142.4 | 78% | 0.78 | 74% | 0.742 | S | S | * | * | trans | -65 | 117.9 | 166.3 | -73.3 | -95.1 | 149.9 | 0 | 0 | 109 | D243 I247 | D243-E245 PolarHBondContact O-N 3.19Å; E245-I247 VanDerWaalsContact C-N 3.32Å; E245-I247 PolarHBondContact O-N 2.93Å | ||
| 246 | E | 62.4 | Low | 63.2 | Low | 164 Ų | 164 | 135.1 Ų | 135.1 | 77% | 0.766 | 74% | 0.735 | S | S | * | * | trans | -69.5 | 89.9 | 173.9 | -171.2 | 176.1 | -168.2 | 0 | 0 | 108.7 | Y244 T248 | Y244-E246 PolarHBondContact O-N 3.36Å; E246-T248 PolarHBondContact O-N 3.08Å | ||
| 247 | I | 57.8 | Low | 63.1 | Low | 143 Ų | 143 | 137.5 Ų | 137.5 | 73% | 0.733 | 75% | 0.75 | S | S | * | * | trans | -62.4 | 102.5 | 170.2 | -59.4 | 165.9 | 0 | 0 | 0 | 106.1 | E245 E249 | E245-I247 VanDerWaalsContact C-N 3.32Å; E245-I247 PolarHBondContact O-N 2.93Å; I247-E249 PolarHBondContact O-N 3.09Å | ||
| 248 | T | 55.2 | Low | 62.7 | Low | 115 Ų | 115 | 143.2 Ų | 143.2 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | -63.9 | 92.5 | 169.4 | 48.6 | 0 | 0 | 0 | 0 | 107.5 | E246 T250 | E246-T248 PolarHBondContact O-N 3.08Å; T248-T250 VanDerWaalsContact C-N 3.33Å; T248-T250 PolarHBondContact O-N 2.76Å | ||
| 249 | E | 55.3 | Low | 62.9 | Low | 172 Ų | 172 | 145.4 Ų | 145.4 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | trans | -56.7 | 102.9 | 169 | -77.2 | -172.5 | 171.5 | 0 | 0 | 107 | I247 S251 | I247-E249 PolarHBondContact O-N 3.09Å; E249-S251 PolarHBondContact O-N 3.11Å; E249-S251 VanDerWaalsContact O-N 3.09Å | ||
| 250 | T | 49.8 | Very low | 62.9 | Low | 129 Ų | 129 | 147.7 Ų | 147.7 | 79% | 0.791 | 76% | 0.761 | S | S | * | * | trans | -44.4 | 120.4 | 177 | 50.9 | 0 | 0 | 0 | 0 | 109.1 | T248 K252 | T248-T250 VanDerWaalsContact C-N 3.33Å; T248-T250 PolarHBondContact O-N 2.76Å; T250-K252 PolarHBondContact O-N 3Å; T250-K252 VanDerWaalsContact O-N 3.09Å | ||
| 251 | S | 55.2 | Low | 62.9 | Low | 105 Ų | 105 | 148.7 Ų | 148.7 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | trans | -44.8 | 115.9 | -175.9 | 55.4 | 0 | 0 | 0 | 0 | 111.4 | E249 L253 | E249-S251 PolarHBondContact O-N 3.11Å; E249-S251 VanDerWaalsContact O-N 3.09Å; S251-L253 PolarHBondContact O-N 2.84Å | ||
| 252 | K | 54.4 | Low | 62.9 | Low | 195 Ų | 195 | 155 Ų | 155 | 85% | 0.848 | 79% | 0.793 | S | S | * | * | trans | -57.1 | 110.2 | 165.5 | -76 | 174 | -179.3 | 165.9 | 0 | 107.6 | T250 Q254 | T250-K252 PolarHBondContact O-N 3Å; T250-K252 VanDerWaalsContact O-N 3.09Å; K252-Q254 PolarHBondContact O-N 3.22Å; K252-Q254 VanDerWaalsContact O-N 3.13Å | ||
| 253 | L | 57.7 | Low | 63.3 | Low | 164 Ų | 164 | 158.9 Ų | 158.9 | 86% | 0.859 | 80% | 0.802 | S | S | * | * | trans | -47.8 | 118.8 | 175.6 | -74.3 | 163.4 | 0 | 0 | 0 | 109.5 | S251 K255 | S251-L253 PolarHBondContact O-N 2.84Å; L253-K255 PolarHBondContact O-N 2.87Å | ||
| 254 | Q | 58.7 | Low | 62.9 | Low | 191 Ų | 191 | 157.6 Ų | 157.6 | 89% | 0.893 | 80% | 0.8 | S | S | * | * | trans | -66.8 | 114.8 | 174.3 | -66 | -179.1 | -12.8 | 0 | 0 | 108.2 | K252 A256 | K252-Q254 PolarHBondContact O-N 3.22Å; K252-Q254 VanDerWaalsContact O-N 3.13Å; Q254-A256 PolarHBondContact O-N 2.84Å | ||
| 255 | K | 61.4 | Low | 62.8 | Low | 202 Ų | 202 | 156.7 Ų | 156.7 | 88% | 0.878 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -61 | 121.5 | 172.3 | -67.9 | -178.4 | 179.6 | -178.8 | 0 | 108.7 | L253 K257 | L253-K255 PolarHBondContact O-N 2.87Å; K255-K257 PolarHBondContact O-N 3.16Å |
| 256 | A | 62.3 | Low | 62.3 | Low | 97 Ų | 97 | 161.9 Ų | 161.9 | 80% | 0.802 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 126.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | Q254 M258 | Q254-A256 PolarHBondContact O-N 2.84Å; A256-M258 PolarHBondContact O-N 3.16Å |
| 257 | K | 63.9 | Low | 62.3 | Low | 202 Ų | 202 | 161.8 Ų | 161.8 | 88% | 0.878 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 120.6 | 174 | -67.5 | -178 | 179.2 | 178.6 | 0 | 109.2 | K255 | K255-K257 PolarHBondContact O-N 3.16Š|
| 258 | M | 65.6 | Low | 62.6 | Low | 182 Ų | 182 | 162.8 Ų | 162.8 | 90% | 0.897 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 132.1 | 172.8 | -63.4 | 171.2 | 70.5 | 0 | 0 | 109.6 | A256 | A256-M258 PolarHBondContact O-N 3.16Š|
| 259 | K | 71.4 | Confident | 63 | Low | 205 Ų | 205 | 165.4 Ų | 165.4 | 89% | 0.891 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -76.1 | 127.5 | 177 | -66.1 | 177.9 | -179 | 175.9 | 0 | 109.4 | ||
| 260 | V | 74 | Confident | 63.4 | Low | 132 Ų | 132 | 165.1 Ų | 165.1 | 80% | 0.8 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 133.5 | 171.4 | -177.5 | 0 | 0 | 0 | 0 | 108.7 | ||
| 261 | P | 72.8 | Confident | 64.3 | Low | 112 Ų | 112 | 167.3 Ų | 167.3 | 73% | 0.727 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 138.7 | 178.2 | 26.9 | -32.9 | 0 | 0 | 0 | 111.4 | I263 | P261-I263 PolarHBondContact O-N 3.24Š|
| 262 | K | 71.6 | Confident | 64.9 | Low | 203 Ų | 203 | 171.5 Ų | 171.5 | 88% | 0.883 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 121.6 | 174.6 | -83.6 | 176.3 | 175.5 | 175.8 | 0 | 109.6 | ||
| 263 | I | 72.4 | Confident | 65.6 | Low | 152 Ų | 152 | 169.8 Ų | 169.8 | 78% | 0.779 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 123.5 | 167.8 | -62.1 | 168.1 | 0 | 0 | 0 | 107 | P261 N265 | P261-I263 PolarHBondContact O-N 3.24Å; I263-N265 WeakPolarHBondContact CG2-OD1 3.06Å |
| 264 | V | 64.4 | Low | 66.2 | Low | 118 Ų | 118 | 170.2 Ų | 170.2 | 72% | 0.715 | 85% | 0.854 | S | S | * | * | P | Polyproline II helix | trans | -99.1 | 119.6 | 172.4 | -177.8 | 0 | 0 | 0 | 0 | 106.6 | ||
| 265 | N | 64.6 | Low | 66.9 | Low | 141 Ų | 141 | 168.5 Ų | 168.5 | 75% | 0.754 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 135.1 | 170.6 | -63.8 | -19.1 | 0 | 0 | 0 | 108 | I263 | I263-N265 WeakPolarHBondContact CG2-OD1 3.06Š|
| 266 | F | 58.1 | Low | 67.4 | Low | 276 Ų | 276 | 165.5 Ų | 165.5 | 100% | 1.211 | 85% | 0.849 | S | S | * | * | trans | -74.8 | 0 | 175.1 | -75.5 | -87.2 | 0 | 0 | 0 | 111.7 |
Retrieved 266 of 266 residues in 53.9 ms
(Link to these results)