| 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 | 40.7 | Very low | 53.7 | Low | 239 Ų | 239 | 156.5 Ų | 156.5 | 100% | 1.177 | 84% | 0.838 | S | S | * | * | 0 | 85.8 | 0 | -150.7 | 168.1 | -163.4 | 0 | 0 | 104.2 | |||||
| 2 | E | 43.3 | Very low | 54.7 | Low | 189 Ų | 189 | 157.8 Ų | 157.8 | 88% | 0.883 | 84% | 0.835 | S | S | * | * | trans | -116.1 | 125.6 | -176.5 | -71.2 | 167.8 | 131 | 0 | 0 | 105.2 | ||||
| 3 | V | 45.7 | Very low | 55.6 | Low | 128 Ų | 128 | 162.4 Ų | 162.4 | 78% | 0.776 | 83% | 0.834 | S | S | * | * | trans | -92.9 | 108.2 | -177.4 | -165.9 | 0 | 0 | 0 | 0 | 105.9 | I5 | V3-I5 PolarHBondContact O-N 3.04Å; V3-I5 VanDerWaalsContact O-N 3.16Å | ||
| 4 | E | 52 | Low | 55.9 | Low | 190 Ų | 190 | 161.1 Ų | 161.1 | 89% | 0.888 | 83% | 0.827 | S | S | * | * | trans | -64.2 | 109.7 | 169.5 | -67.3 | 176.6 | 141.7 | 0 | 0 | 107.8 | A6 | E4-A6 PolarHBondContact O-N 2.8Š| ||
| 5 | I | 56.9 | Low | 55.7 | Low | 143 Ų | 143 | 158.2 Ų | 158.2 | 73% | 0.733 | 81% | 0.813 | S | S | * | * | trans | -90.1 | 101.1 | 172.3 | -53.4 | 169.2 | 0 | 0 | 0 | 105.9 | V3 F7 | V3-I5 PolarHBondContact O-N 3.04Å; V3-I5 VanDerWaalsContact O-N 3.16Å; I5-F7 PolarHBondContact O-N 3.44Å | ||
| 6 | A | 50.8 | Low | 55.6 | Low | 85 Ų | 85 | 156 Ų | 156 | 70% | 0.702 | 81% | 0.812 | S | S | * | * | trans | -60.5 | 115.5 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | E4 E8 | E4-A6 PolarHBondContact O-N 2.8Å; A6-E8 PolarHBondContact O-N 2.97Å | ||
| 7 | F | 54.6 | Low | 54.9 | Low | 210 Ų | 210 | 155.4 Ų | 155.4 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | trans | -85.8 | 91.5 | 169.8 | -116 | -93.1 | 0 | 0 | 0 | 108 | I5 | I5-F7 PolarHBondContact O-N 3.44Š| ||
| 8 | E | 56.3 | Low | 54.6 | Low | 169 Ų | 169 | 152.3 Ų | 152.3 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | -97.4 | 114.5 | 179.7 | -163 | 158.6 | 176.7 | 0 | 0 | 110.5 | A6 | A6-E8 PolarHBondContact O-N 2.97Š| ||
| 9 | M | 54.8 | Low | 54.3 | Low | 179 Ų | 179 | 155.4 Ų | 155.4 | 88% | 0.882 | 81% | 0.814 | S | S | * | * | S | Bend | trans | 61 | 83.3 | 147.4 | -57.7 | -72.7 | -87.9 | 0 | 0 | 119 | ||
| 10 | G | 68.9 | Low | 54 | Low | 61 Ų | 61 | 155.5 Ų | 155.5 | 63% | 0.629 | 81% | 0.81 | S | S | * | * | trans | -160 | 150.8 | 153 | 0 | 0 | 0 | 0 | 0 | 109.9 | E12 | G10-E12 PolarHBondContact O-N 2.72Š| ||
| 11 | P | 66.9 | Low | 53.3 | Low | 128 Ų | 128 | 155.8 Ų | 155.8 | 83% | 0.831 | 81% | 0.807 | S | S | * | * | trans | -60.8 | 128.1 | 178.4 | 24.3 | -31.7 | 0 | 0 | 0 | 110 | R13 | P11-R13 PolarHBondContact O-N 3.35Š| ||
| 12 | E | 65.2 | Low | 53.5 | Low | 172 Ų | 172 | 152.3 Ų | 152.3 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -56.5 | 120.9 | -177.8 | -65 | -170.6 | 154.4 | 0 | 0 | 110.7 | G10 I14 | G10-E12 PolarHBondContact O-N 2.72Å; E12-I14 VanDerWaalsContact C-N 3.33Å; E12-I14 PolarHBondContact O-N 3.39Å | ||
| 13 | R | 66.4 | Low | 53.1 | Low | 218 Ų | 218 | 146.4 Ų | 146.4 | 82% | 0.823 | 78% | 0.782 | S | S | * | * | trans | -77.4 | 89.8 | 169.1 | -65.9 | 179.5 | 67.2 | 146.3 | 1.4 | 107.4 | P11 L15 | P11-R13 PolarHBondContact O-N 3.35Å; R13-L15 PolarHBondContact O-N 2.71Å | ||
| 14 | I | 59.9 | Low | 52.6 | Low | 145 Ų | 145 | 148.3 Ų | 148.3 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | -69.2 | 84.8 | 168.2 | -55.8 | 163.7 | 0 | 0 | 0 | 106.6 | E12 P16 | E12-I14 VanDerWaalsContact C-N 3.33Å; E12-I14 PolarHBondContact O-N 3.39Å; I14-P16 VanDerWaalsContact O-CD 3.3Å; I14-P16 WeakPolarHBondContact O-CD 3.34Å | ||
| 15 | L | 53.3 | Low | 51.9 | Low | 117 Ų | 117 | 147 Ų | 147 | 61% | 0.613 | 78% | 0.777 | S | S | * | * | trans | -73.4 | 116.9 | 161.9 | -69.7 | 167.6 | 0 | 0 | 0 | 105.8 | R13 N17 | R13-L15 PolarHBondContact O-N 2.71Å; L15-N17 VanDerWaalsContact C-N 3.27Å; L15-N17 PolarHBondContact O-N 3.27Å | ||
| 16 | P | 54.4 | Low | 51 | Low | 123 Ų | 123 | 150.5 Ų | 150.5 | 80% | 0.799 | 78% | 0.781 | S | S | * | * | trans | -64 | 97.8 | 165.6 | 25.7 | -30.1 | 0 | 0 | 0 | 107.6 | I14 | I14-P16 VanDerWaalsContact O-CD 3.3Å; I14-P16 WeakPolarHBondContact O-CD 3.34Å | ||
| 17 | N | 43.2 | Very low | 50.5 | Low | 145 Ų | 145 | 152.2 Ų | 152.2 | 78% | 0.775 | 79% | 0.785 | S | S | * | * | trans | -77.4 | 120.3 | 157.7 | -82.1 | -63.9 | 0 | 0 | 0 | 106.8 | L15 | L15-N17 VanDerWaalsContact C-N 3.27Å; L15-N17 PolarHBondContact O-N 3.27Å | ||
| 18 | S | 48.9 | Very low | 50 | Low | 101 Ų | 101 | 146.3 Ų | 146.3 | 71% | 0.706 | 77% | 0.769 | S | S | * | * | trans | -167.5 | 79.1 | 145.2 | -86.4 | 0 | 0 | 0 | 0 | 108 | E20 | S18-E20 PolarHBondContact O-N 2.74Š| ||
| 19 | E | 49 | Very low | 49.1 | Very low | 211 Ų | 211 | 146 Ų | 146 | 99% | 0.986 | 77% | 0.773 | S | S | * | * | trans | -61.8 | 87.5 | 138.1 | -170.2 | 169.7 | 95.9 | 0 | 0 | 105.9 | ||||
| 20 | E | 47.8 | Very low | 48.5 | Very low | 156 Ų | 156 | 140.9 Ų | 140.9 | 73% | 0.729 | 77% | 0.766 | S | S | * | * | trans | -143.7 | 121.1 | 168.9 | -172.1 | 159.8 | 76 | 0 | 0 | 109 | S18 | S18-E20 PolarHBondContact O-N 2.74Š| ||
| 21 | E | 40.3 | Very low | 46.9 | Very low | 163 Ų | 163 | 141.1 Ų | 141.1 | 76% | 0.762 | 77% | 0.768 | S | S | * | * | trans | 77.5 | 83.5 | 155 | -146 | 104.8 | 82.3 | 0 | 0 | 118.9 | ||||
| 22 | L | 44.1 | Very low | 45.9 | Very low | 166 Ų | 166 | 142.5 Ų | 142.5 | 87% | 0.869 | 77% | 0.774 | S | S | * | * | 20.2 | 111.6 | 124.8 | -67.1 | 163.9 | 0 | 0 | 0 | 118.1 | |||||
| 23 | G | 35.3 | Very low | 44.8 | Very low | 65 Ų | 65 | 138.4 Ų | 138.4 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | trans | 128 | 141.3 | 137.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 24 | Q | 35.6 | Very low | 43.7 | Very low | 167 Ų | 167 | 130.8 Ų | 130.8 | 78% | 0.78 | 77% | 0.767 | S | S | * | * | trans | 96.8 | 93.7 | 156.2 | -62.5 | 158.9 | 55.1 | 0 | 0 | 116.2 | ||||
| 25 | E | 36.5 | Very low | 42.8 | Very low | 163 Ų | 163 | 132.3 Ų | 132.3 | 76% | 0.762 | 77% | 0.771 | S | S | * | * | trans | 53.4 | 114.3 | 131.6 | 60.6 | -134 | 51.4 | 0 | 0 | 121.9 | ||||
| 26 | R | 39.1 | Very low | 42.5 | Very low | 217 Ų | 217 | 138.6 Ų | 138.6 | 82% | 0.819 | 79% | 0.787 | S | S | * | * | trans | -50.5 | 141.5 | 152.9 | -176.2 | -177.5 | 177.8 | 159.6 | 4.4 | 111.1 | S28 | R26-S28 PolarHBondContact NE-OG 3Å; R26-S28 PolarHBondContact NH2-OG 2.72Å | ||
| 27 | P | 40.7 | Very low | 42.5 | Very low | 121 Ų | 121 | 138.2 Ų | 138.2 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | -130.8 | 148.9 | 116.9 | 31.8 | -19.8 | 0 | 0 | 0 | 112.8 | |||||
| 28 | S | 43.9 | Very low | 42.5 | Very low | 85 Ų | 85 | 134.8 Ų | 134.8 | 59% | 0.594 | 79% | 0.786 | S | S | * | * | trans | -63.9 | 139.8 | 168.6 | -51 | 0 | 0 | 0 | 0 | 111.1 | R26 | R26-S28 PolarHBondContact NE-OG 3Å; R26-S28 PolarHBondContact NH2-OG 2.72Å | ||
| 29 | D | 37.4 | Very low | 42.1 | Very low | 164 Ų | 164 | 138.5 Ų | 138.5 | 88% | 0.877 | 79% | 0.792 | S | S | * | * | -170.7 | 147.6 | 127.6 | -158 | -137.8 | 0 | 0 | 0 | 110.3 | |||||
| 30 | G | 42.4 | Very low | 41.9 | Very low | 71 Ų | 71 | 135.7 Ų | 135.7 | 73% | 0.732 | 78% | 0.784 | S | S | * | * | trans | -70 | 148.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 31 | G | 34.9 | Very low | 41.8 | Very low | 65 Ų | 65 | 136.9 Ų | 136.9 | 67% | 0.67 | 79% | 0.792 | S | S | * | * | trans | 166 | 114.1 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 32 | V | 46.3 | Very low | 42.2 | Very low | 158 Ų | 158 | 138 Ų | 138 | 96% | 0.958 | 80% | 0.797 | S | S | * | * | trans | 53.5 | 101.4 | 146.1 | -71 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 33 | G | 42.4 | Very low | 42.2 | Very low | 85 Ų | 85 | 139.5 Ų | 139.5 | 88% | 0.876 | 80% | 0.8 | S | S | * | * | trans | -130.7 | 114.7 | 157.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 34 | G | 42.4 | Very low | 42.5 | Very low | 59 Ų | 59 | 140.3 Ų | 140.3 | 61% | 0.608 | 81% | 0.808 | S | S | * | * | trans | 100.7 | 66 | 156.8 | 0 | 0 | 0 | 0 | 0 | 116.6 | W36 | G34-W36 PolarHBondContact O-N 3.38Š| ||
| 35 | E | 41.2 | Very low | 42.4 | Very low | 176 Ų | 176 | 136.1 Ų | 136.1 | 82% | 0.822 | 81% | 0.81 | S | S | * | * | trans | -25.6 | 111 | 146.9 | 59.2 | -149.5 | 74 | 0 | 0 | 114.5 | ||||
| 36 | W | 46.8 | Very low | 43 | Very low | 249 Ų | 249 | 135.9 Ų | 135.9 | 94% | 0.943 | 82% | 0.819 | S | S | * | * | trans | -92.7 | 107.4 | 148.2 | -72.8 | 36.7 | 0 | 0 | 0 | 103.7 | G34 G38 | G34-W36 PolarHBondContact O-N 3.38Å; W36-G38 PolarHBondContact O-N 3.32Å | ||
| 37 | S | 55.2 | Low | 42.9 | Very low | 115 Ų | 115 | 129 Ų | 129 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | -61 | 87.2 | 172.2 | -72.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 38 | G | 41.6 | Very low | 43.1 | Very low | 73 Ų | 73 | 130.9 Ų | 130.9 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | trans | -92.5 | 92.2 | 152.6 | 0 | 0 | 0 | 0 | 0 | 106.3 | W36 | W36-G38 PolarHBondContact O-N 3.32Š| ||
| 39 | E | 40.5 | Very low | 42.9 | Very low | 179 Ų | 179 | 133.3 Ų | 133.3 | 84% | 0.836 | 83% | 0.826 | S | S | * | * | trans | -50.8 | 133.4 | 174 | 53.4 | -176.9 | 94.8 | 0 | 0 | 112.3 | ||||
| 40 | D | 45.9 | Very low | 43.2 | Very low | 153 Ų | 153 | 132.8 Ų | 132.8 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | trans | -74.6 | 115.7 | 167.6 | 170.8 | -108.8 | 0 | 0 | 0 | 108.9 | ||||
| 41 | M | 45.4 | Very low | 43.2 | Very low | 180 Ų | 180 | 136.9 Ų | 136.9 | 89% | 0.887 | 82% | 0.823 | S | S | * | * | trans | -158.5 | 67 | 155.9 | -138.6 | 165.9 | -179.3 | 0 | 0 | 111 | ||||
| 42 | E | 48.4 | Very low | 43.9 | Very low | 186 Ų | 186 | 143.2 Ų | 143.2 | 87% | 0.869 | 84% | 0.835 | S | S | * | * | trans | -115.8 | 89.8 | 161.3 | -172.9 | -173.6 | 148.6 | 0 | 0 | 108.8 | ||||
| 43 | E | 44.8 | Very low | 43.7 | Very low | 198 Ų | 198 | 142.2 Ų | 142.2 | 93% | 0.925 | 82% | 0.824 | S | S | * | * | trans | -165.5 | 110.4 | 146 | -157.4 | 174.8 | 136.2 | 0 | 0 | 112 | ||||
| 44 | G | 40.9 | Very low | 44.2 | Very low | 82 Ų | 82 | 146 Ų | 146 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | 90.9 | 111.6 | 137 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 45 | G | 34.5 | Very low | 44.4 | Very low | 80 Ų | 80 | 148.4 Ų | 148.4 | 83% | 0.825 | 82% | 0.823 | S | S | * | * | trans | 168.1 | 92.8 | 155.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | G47 | G45-G47 PolarHBondContact O-N 2.92Š| ||
| 46 | V | 47.7 | Very low | 45.1 | Very low | 158 Ų | 158 | 142.4 Ų | 142.4 | 96% | 0.958 | 81% | 0.809 | S | S | * | * | trans | -63.8 | 121.2 | 162.2 | 170.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 47 | G | 38.5 | Very low | 45.6 | Very low | 72 Ų | 72 | 131.9 Ų | 131.9 | 74% | 0.742 | 78% | 0.777 | S | S | * | * | trans | -149.1 | 98.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | G45 | G45-G47 PolarHBondContact O-N 2.92Š| ||
| 48 | D | 44.6 | Very low | 45.9 | Very low | 161 Ų | 161 | 137.2 Ų | 137.2 | 86% | 0.861 | 78% | 0.781 | S | S | * | * | trans | -60.1 | 118.1 | 159.6 | 176 | -113.8 | 0 | 0 | 0 | 108.5 | ||||
| 49 | D | 39.3 | Very low | 47.5 | Very low | 136 Ų | 136 | 142.5 Ų | 142.5 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | -153.5 | 130.4 | 151.9 | -154 | -137.5 | 0 | 0 | 0 | 109.8 | ||||
| 50 | D | 44.4 | Very low | 49.4 | Very low | 153 Ų | 153 | 145 Ų | 145 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -84.9 | 99.3 | -175.2 | -179.4 | -128.3 | 0 | 0 | 0 | 108.6 | ||||
| 51 | E | 41 | Very low | 51.2 | Low | 157 Ų | 157 | 145.8 Ų | 145.8 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | trans | -140.2 | 126.9 | 167.6 | -64.5 | -162.3 | 136.5 | 0 | 0 | 111.8 | D53 | E51-D53 PolarHBondContact O-N 2.89Š| ||
| 52 | E | 50.1 | Low | 53 | Low | 197 Ų | 197 | 141.9 Ų | 141.9 | 92% | 0.921 | 77% | 0.77 | S | S | * | * | trans | -65 | 88.6 | 177.4 | -55.8 | 175.1 | 154.6 | 0 | 0 | 110.8 | ||||
| 53 | D | 42.2 | Very low | 54.5 | Low | 138 Ų | 138 | 140.6 Ų | 140.6 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | trans | -104.8 | 97.8 | 165.7 | -91.7 | -80.4 | 0 | 0 | 0 | 110.1 | E51 D55 | E51-D53 PolarHBondContact O-N 2.89Å; D53-D55 PolarHBondContact O-N 3.43Å | ||
| 54 | D | 51.9 | Low | 56.1 | Low | 163 Ų | 163 | 137.2 Ų | 137.2 | 87% | 0.872 | 76% | 0.757 | S | S | * | * | trans | -60.2 | 64.9 | 153.9 | -168.7 | -110.4 | 0 | 0 | 0 | 108.5 | G56 | D54-G56 PolarHBondContact O-N 3.45Š| ||
| 55 | D | 48.4 | Very low | 57.8 | Low | 110 Ų | 110 | 142.2 Ų | 142.2 | 59% | 0.588 | 76% | 0.758 | S | S | * | * | trans | -74.8 | 88 | 165.2 | -170.7 | -110.3 | 0 | 0 | 0 | 105.8 | D53 G57 Y59 | D53-D55 PolarHBondContact O-N 3.43Å; D55-G57 PolarHBondContact O-N 3.29Å; D55-Y59 PolarHBondContact OD1-OH 2.7Å | ||
| 56 | G | 55.4 | Low | 59.8 | Low | 50 Ų | 50 | 143.3 Ų | 143.3 | 52% | 0.515 | 75% | 0.745 | S | S | . | * | trans | -63 | 56.5 | 161.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | D54 Y58 | D54-G56 PolarHBondContact O-N 3.45Å; G56-Y58 VanDerWaalsContact O-CD2 3.28Å; G56-Y58 WeakPolarHBondContact O-CD2 3.28Å; G56-Y58 PolarHBondContact O-N 3.22Å | ||
| 57 | G | 56.3 | Low | 60.2 | Low | 28 Ų | 28 | 139.5 Ų | 139.5 | 29% | 0.289 | 72% | 0.724 | S | S | . | * | trans | -60.4 | 109.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | D55 Y59 | D55-G57 PolarHBondContact O-N 3.29Å; G57-Y59 WeakPolarHBondContact O-CD2 3.45Å; G57-Y59 PolarHBondContact O-N 2.87Å | ||
| 58 | Y | 62.4 | Low | 61.1 | Low | 227 Ų | 227 | 141.5 Ų | 141.5 | 89% | 0.89 | 72% | 0.718 | S | S | * | * | trans | -68.8 | 63.7 | 168 | -64.6 | -86.7 | 0 | 0 | 0 | 108.7 | G56 Y60 | G56-Y58 VanDerWaalsContact O-CD2 3.28Å; G56-Y58 WeakPolarHBondContact O-CD2 3.28Å; G56-Y58 PolarHBondContact O-N 3.22Å; Y58-Y60 PolarHBondContact O-N 3.07Å | ||
| 59 | Y | 75 | Confident | 61.4 | Low | 184 Ų | 184 | 136.1 Ų | 136.1 | 72% | 0.722 | 70% | 0.7 | S | S | * | * | trans | -68.3 | 114.6 | 170.3 | -60.4 | -75 | 0 | 0 | 0 | 106.3 | D55 G57 Q61 | D55-Y59 PolarHBondContact OD1-OH 2.7Å; G57-Y59 WeakPolarHBondContact O-CD2 3.45Å; G57-Y59 PolarHBondContact O-N 2.87Å; Y59-Q61 VanDerWaalsContact C-N 3.35Å; Y59-Q61 PolarHBondContact O-N 3.24Å | ||
| 60 | Y | 79.3 | Confident | 62 | Low | 231 Ų | 231 | 137.6 Ų | 137.6 | 91% | 0.906 | 71% | 0.707 | S | S | * | * | trans | -58.9 | 100.6 | 171.5 | -81.5 | -85.9 | 0 | 0 | 0 | 108.4 | Y58 P62 | Y58-Y60 PolarHBondContact O-N 3.07Å; Y60-P62 VanDerWaalsContact O-CD 3.28Å; Y60-P62 WeakPolarHBondContact O-CD 3.14Å | ||
| 61 | Q | 83.7 | Confident | 62.2 | Low | 171 Ų | 171 | 135.9 Ų | 135.9 | 80% | 0.799 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 117.9 | 171.4 | -170.9 | 72.2 | 55.8 | 0 | 0 | 107.7 | Y59 L63 | Y59-Q61 VanDerWaalsContact C-N 3.35Å; Y59-Q61 PolarHBondContact O-N 3.24Å; Q61-L63 PolarHBondContact O-N 3.2Å |
| 62 | P | 83.6 | Confident | 62.5 | Low | 98 Ų | 98 | 132.4 Ų | 132.4 | 64% | 0.636 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 136.6 | 172.5 | -21 | 33.1 | 0 | 0 | 0 | 109.7 | Y60 | Y60-P62 VanDerWaalsContact O-CD 3.28Å; Y60-P62 WeakPolarHBondContact O-CD 3.14Å |
| 63 | L | 79.4 | Confident | 62.1 | Low | 159 Ų | 159 | 126.8 Ų | 126.8 | 83% | 0.832 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 136.3 | 176.9 | -161.2 | 74.6 | 0 | 0 | 0 | 109.4 | Q61 Q65 | Q61-L63 PolarHBondContact O-N 3.2Å; L63-Q65 PolarHBondContact O-N 3Å |
| 64 | N | 78.5 | Confident | 62.1 | Low | 126 Ų | 126 | 124.9 Ų | 124.9 | 67% | 0.674 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 121.5 | 176.1 | -69.4 | -46.1 | 0 | 0 | 0 | 109.7 | ||
| 65 | Q | 77.8 | Confident | 61.8 | Low | 188 Ų | 188 | 120.4 Ų | 120.4 | 88% | 0.879 | 67% | 0.671 | S | S | * | * | trans | -95.4 | 3.3 | 178.7 | -62.6 | -164.4 | -48.7 | 0 | 0 | 112.6 | L63 | L63-Q65 PolarHBondContact O-N 3Š| ||
| 66 | D | 75.9 | Confident | 61.7 | Low | 102 Ų | 102 | 122.7 Ų | 122.7 | 55% | 0.545 | 68% | 0.683 | S | S | . | * | trans | -64.1 | 133 | 176.9 | -62.2 | -74.7 | 0 | 0 | 0 | 110 | D68 G69 | D66-D68 PolarHBondContact O-N 3.21Å; D66-D68 VanDerWaalsContact O-N 3.11Å; D66-G69 PolarHBondContact O-N 3.36Å | ||
| 67 | P | 56.8 | Low | 61.2 | Low | 79 Ų | 79 | 125 Ų | 125 | 51% | 0.513 | 68% | 0.68 | S | S | . | * | G | 310 helix | trans | -61.1 | -21 | 175.8 | 26.4 | -34.1 | 0 | 0 | 0 | 112.1 | ||
| 68 | D | 56.1 | Low | 61 | Low | 114 Ų | 114 | 128.1 Ų | 128.1 | 61% | 0.61 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -80.7 | -8.3 | 173.8 | -73.8 | -70.5 | 0 | 0 | 0 | 113.9 | D66 L70 N71 A72 | D66-D68 PolarHBondContact O-N 3.21Å; D66-D68 VanDerWaalsContact O-N 3.11Å; D68-L70 PolarHBondContact O-N 3.33Å; D68-N71 CarbonylContact O-C 3.59Å; D68-N71 VanDerWaalsContact O-CA 3.32Å; D68-N71 WeakPolarHBondContact O-CA 3.34Å; D68-N71 PolarHBondContact O-N 3.11Å; D68-A72 PolarHBondContact O-N 3.38Å |
| 69 | G | 52.2 | Low | 60.6 | Low | 48 Ų | 48 | 127.3 Ų | 127.3 | 50% | 0.495 | 70% | 0.7 | S | S | . | * | G | 310 helix | trans | -65.2 | -25.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | D66 | D66-G69 PolarHBondContact O-N 3.36Š|
| 70 | L | 52.3 | Low | 59.8 | Low | 166 Ų | 166 | 125.6 Ų | 125.6 | 87% | 0.869 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -86.8 | -10.4 | 168 | -75.6 | 104.3 | 0 | 0 | 0 | 113.2 | D68 | D68-L70 PolarHBondContact O-N 3.33Š|
| 71 | N | 47.1 | Very low | 58.7 | Low | 117 Ų | 117 | 118.4 Ų | 118.4 | 63% | 0.626 | 68% | 0.678 | S | S | * | * | trans | -114 | 37.1 | 174.7 | -87.1 | -77.7 | 0 | 0 | 0 | 111 | D68 A73 | D68-N71 CarbonylContact O-C 3.59Å; D68-N71 VanDerWaalsContact O-CA 3.32Å; D68-N71 WeakPolarHBondContact O-CA 3.34Å; D68-N71 PolarHBondContact O-N 3.11Å; N71-A73 VanDerWaalsContact C-N 3.31Å; N71-A73 PolarHBondContact O-N 2.86Å | ||
| 72 | A | 48.9 | Very low | 57.6 | Low | 85 Ų | 85 | 112.8 Ų | 112.8 | 70% | 0.702 | 66% | 0.657 | S | S | * | * | trans | -53.2 | 110 | 152 | 0 | 0 | 0 | 0 | 0 | 105.6 | D68 | D68-A72 PolarHBondContact O-N 3.38Š| ||
| 73 | A | 40.3 | Very low | 57.3 | Low | 79 Ų | 79 | 112 Ų | 112 | 65% | 0.653 | 65% | 0.652 | S | S | * | * | trans | -45.3 | 143.6 | -173.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | N71 G75 | N71-A73 VanDerWaalsContact C-N 3.31Å; N71-A73 PolarHBondContact O-N 2.86Å; A73-G75 PolarHBondContact O-N 3.34Å | ||
| 74 | P | 43.3 | Very low | 56.9 | Low | 98 Ų | 98 | 109.6 Ų | 109.6 | 64% | 0.636 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -70.7 | 51.1 | 168.7 | 31.6 | -33.8 | 0 | 0 | 0 | 110.3 | Q77 | P74-Q77 HydrophobicContact CB-CG 3.86Š|
| 75 | G | 45.1 | Very low | 56.6 | Low | 68 Ų | 68 | 107.1 Ų | 107.1 | 70% | 0.701 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -89.8 | -7.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | A73 | A73-G75 PolarHBondContact O-N 3.34Š|
| 76 | D | 46.4 | Very low | 56.7 | Low | 158 Ų | 158 | 103.6 Ų | 103.6 | 85% | 0.845 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -137.8 | 36.6 | 173.8 | -142.4 | -98.3 | 0 | 0 | 0 | 110.8 | P78 | D76-P78 WeakPolarHBondContact O-CD 3.39Š|
| 77 | Q | 45.2 | Very low | 56.9 | Low | 100 Ų | 100 | 102.8 Ų | 102.8 | 47% | 0.467 | 62% | 0.617 | S | S | . | * | trans | -76.3 | 118.5 | 162.8 | -72.2 | -168.6 | -53.6 | 0 | 0 | 107.4 | P74 E79 M81 | P74-Q77 HydrophobicContact CB-CG 3.86Å; Q77-E79 PolarHBondContact O-N 2.93Å; Q77-M81 HydrophobicContact CB-CE 4.21Å; Q77-M81 HydrophobicContact CG-CE 3.51Å; Q77-M81 PolarHBondContact NE2-SD 3.41Å | ||
| 78 | P | 52 | Low | 58.1 | Low | 92 Ų | 92 | 104.5 Ų | 104.5 | 60% | 0.597 | 62% | 0.621 | S | S | * | * | trans | -55.6 | 141.3 | 161.1 | 25 | -31.6 | 0 | 0 | 0 | 107.7 | D76 D80 M81 | D76-P78 WeakPolarHBondContact O-CD 3.39Å; P78-D80 PolarHBondContact O-N 2.94Å; P78-M81 PolarHBondContact O-N 2.84Å | ||
| 79 | E | 53.7 | Low | 59.4 | Low | 211 Ų | 211 | 104.7 Ų | 104.7 | 99% | 0.986 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | 17.8 | -178.4 | -63.1 | -161.1 | 106.5 | 0 | 0 | 114.7 | Q77 | Q77-E79 PolarHBondContact O-N 2.93Š|
| 80 | D | 58.2 | Low | 61.2 | Low | 148 Ų | 148 | 108.8 Ų | 108.8 | 79% | 0.791 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.2 | 33.4 | -175.8 | -148.5 | -108 | 0 | 0 | 0 | 110.5 | P78 P82 | P78-D80 PolarHBondContact O-N 2.94Å; D80-P82 WeakPolarHBondContact O-CD 3.35Å |
| 81 | M | 55.9 | Low | 62.9 | Low | 79 Ų | 79 | 104.2 Ų | 104.2 | 39% | 0.389 | 60% | 0.604 | S | S | . | * | P | Polyproline II helix | trans | -83.8 | 120.9 | 173.1 | -155.5 | -175.7 | -69.5 | 0 | 0 | 109.8 | Q77 P78 Q87 | Q77-M81 HydrophobicContact CB-CE 4.21Å; Q77-M81 HydrophobicContact CG-CE 3.51Å; Q77-M81 PolarHBondContact NE2-SD 3.41Å; P78-M81 PolarHBondContact O-N 2.84Å; M81-Q87 PolarHBondContact SD-NE2 2.93Å |
| 82 | P | 61.6 | Low | 64.8 | Low | 53 Ų | 53 | 103.4 Ų | 103.4 | 34% | 0.344 | 60% | 0.596 | S | S | . | * | P | Polyproline II helix | trans | -62.3 | 154.4 | 177.3 | 27.2 | -35 | 0 | 0 | 0 | 110.7 | D80 E86 | D80-P82 WeakPolarHBondContact O-CD 3.35Å; P82-E86 HydrophobicContact CB-CB 3.77Å; P82-E86 WeakPolarHBondContact CB-OE2 3.05Å; P82-E86 HydrophobicContact CG-CB 4.39Å |
| 83 | P | 75.8 | Confident | 66.7 | Low | 83 Ų | 83 | 104.7 Ų | 104.7 | 54% | 0.539 | 59% | 0.588 | S | S | . | * | P | Polyproline II helix | trans | -47 | 145.4 | 176.6 | 19.7 | -34.7 | 0 | 0 | 0 | 111.6 | A85 E86 Q87 | P83-A85 CarbonylContact O-C 3.01Å; P83-A85 PolarHBondContact O-N 3.18Å; P83-E86 VanDerWaalsContact CD-OE2 3.25Å; P83-E86 WeakPolarHBondContact CD-OE2 3.36Å; P83-E86 HydrophobicContact CG-CB 4.23Å; P83-E86 HydrophobicContact CG-CG 3.96Å; P83-E86 WeakPolarHBondContact O-CA 3.48Å; P83-E86 WeakPolarHBondContact O-CB 3.25Å; P83-E86 PolarHBondContact O-N 2.94Å; P83-Q87 PolarHBondContact O-N 2.89Å |
| 84 | V | 71 | Confident | 69.2 | Low | 107 Ų | 107 | 109 Ų | 109 | 65% | 0.648 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -47.9 | -30.4 | -179.5 | 176.5 | 0 | 0 | 0 | 0 | 112.8 | Q87 L88 | V84-Q87 PolarHBondContact O-N 3.43Å; V84-L88 HydrophobicContact CG1-CD1 4.41Å; V84-L88 HydrophobicContact CG1-CG 4.46Å; V84-L88 WeakPolarHBondContact O-CB 3.28Å; V84-L88 WeakPolarHBondContact O-CG 3.46Å; V84-L88 PolarHBondContact O-N 3.17Å |
| 85 | A | 73.2 | Confident | 71.3 | Confident | 75 Ų | 75 | 107 Ų | 107 | 62% | 0.62 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64 | -39.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | P83 H89 | P83-A85 CarbonylContact O-C 3.01Å; P83-A85 PolarHBondContact O-N 3.18Å; A85-H89 WeakPolarHBondContact O-CB 3.48Å; A85-H89 PolarHBondContact O-N 3.49Å |
| 86 | E | 79.3 | Confident | 73.4 | Confident | 114 Ų | 114 | 108.7 Ų | 108.7 | 53% | 0.533 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -72.9 | -36.4 | 175.3 | -78.6 | -172.2 | 148.8 | 0 | 0 | 111.3 | P82 P83 H89 E90 | P82-E86 HydrophobicContact CB-CB 3.77Å; P82-E86 WeakPolarHBondContact CB-OE2 3.05Å; P82-E86 HydrophobicContact CG-CB 4.39Å; P83-E86 VanDerWaalsContact CD-OE2 3.25Å; P83-E86 WeakPolarHBondContact CD-OE2 3.36Å; P83-E86 HydrophobicContact CG-CB 4.23Å; P83-E86 HydrophobicContact CG-CG 3.96Å; P83-E86 WeakPolarHBondContact O-CA 3.48Å; P83-E86 WeakPolarHBondContact O-CB 3.25Å; P83-E86 PolarHBondContact O-N 2.94Å; E86-H89 WeakPolarHBondContact O-CB 3.27Å; E86-H89 PolarHBondContact O-N 3.03Å; E86-H89 VanDerWaalsContact O-N 3.16Å; E86-E90 PolarHBondContact O-N 3.03Å |
| 87 | Q | 80.6 | Confident | 75.5 | Confident | 85 Ų | 85 | 105.8 Ų | 105.8 | 40% | 0.397 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.8 | -41.1 | 173.2 | -175.6 | 165.8 | 87.3 | 0 | 0 | 112 | M81 P83 V84 H89 E90 V91 | M81-Q87 PolarHBondContact SD-NE2 2.93Å; P83-Q87 PolarHBondContact O-N 2.89Å; V84-Q87 PolarHBondContact O-N 3.43Å; Q87-H89 VanDerWaalsContact C-N 3.28Å; Q87-H89 PolarHBondContact O-N 3.42Å; Q87-E90 PolarHBondContact O-N 3.16Å; Q87-V91 VanDerWaalsContact O-CG2 3.27Å; Q87-V91 WeakPolarHBondContact O-CG2 3.34Å; Q87-V91 PolarHBondContact O-N 3.46Å |
| 88 | L | 82.2 | Confident | 77.5 | Confident | 114 Ų | 114 | 105.7 Ų | 105.7 | 60% | 0.597 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.4 | -36.1 | 171.8 | -75.6 | 178.4 | 0 | 0 | 0 | 111.9 | V84 V91 Q92 | V84-L88 HydrophobicContact CG1-CD1 4.41Å; V84-L88 HydrophobicContact CG1-CG 4.46Å; V84-L88 WeakPolarHBondContact O-CB 3.28Å; V84-L88 WeakPolarHBondContact O-CG 3.46Å; V84-L88 PolarHBondContact O-N 3.17Å; L88-V91 PolarHBondContact O-N 2.91Å; L88-Q92 WeakPolarHBondContact O-CB 3.25Å; L88-Q92 PolarHBondContact O-N 3.06Å |
| 89 | H | 84.1 | Confident | 79.1 | Confident | 119 Ų | 119 | 103.9 Ų | 103.9 | 55% | 0.551 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -65.7 | -45.9 | 176.4 | -163.9 | 57.6 | 0 | 0 | 0 | 111.8 | A85 E86 Q87 V91 Q92 E93 | A85-H89 WeakPolarHBondContact O-CB 3.48Å; A85-H89 PolarHBondContact O-N 3.49Å; E86-H89 WeakPolarHBondContact O-CB 3.27Å; E86-H89 PolarHBondContact O-N 3.03Å; E86-H89 VanDerWaalsContact O-N 3.16Å; Q87-H89 VanDerWaalsContact C-N 3.28Å; Q87-H89 PolarHBondContact O-N 3.42Å; H89-V91 VanDerWaalsContact C-N 3.33Å; H89-V91 PolarHBondContact O-N 2.75Å; H89-Q92 WeakPolarHBondContact O-CB 3.38Å; H89-Q92 PolarHBondContact O-N 2.87Å; H89-Q92 VanDerWaalsContact O-N 3.17Å; H89-E93 PolarHBondContact O-N 3.32Å |
| 90 | E | 88.4 | Confident | 80.6 | Confident | 133 Ų | 133 | 99.5 Ų | 99.5 | 62% | 0.621 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61 | -41.1 | 176 | -173.5 | -176.7 | 102.7 | 0 | 0 | 111.8 | E86 Q87 E93 R94 | E86-E90 PolarHBondContact O-N 3.03Å; Q87-E90 PolarHBondContact O-N 3.16Å; E90-E93 PolarHBondContact O-N 2.86Å; E90-R94 WeakPolarHBondContact O-CB 3.46Å; E90-R94 PolarHBondContact O-N 3.47Å |
| 91 | V | 87.9 | Confident | 81.9 | Confident | 71 Ų | 71 | 97.5 Ų | 97.5 | 43% | 0.43 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 175.2 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | Q87 L88 H89 R94 I95 | Q87-V91 VanDerWaalsContact O-CG2 3.27Å; Q87-V91 WeakPolarHBondContact O-CG2 3.34Å; Q87-V91 PolarHBondContact O-N 3.46Å; L88-V91 PolarHBondContact O-N 2.91Å; H89-V91 VanDerWaalsContact C-N 3.33Å; H89-V91 PolarHBondContact O-N 2.75Å; V91-R94 PolarHBondContact O-N 3.18Å; V91-I95 HydrophobicContact CG1-CD1 3.89Å; V91-I95 VanDerWaalsContact O-CG1 3.25Å; V91-I95 WeakPolarHBondContact O-CG1 3.46Å; V91-I95 PolarHBondContact O-N 3.11Å |
| 92 | Q | 87.9 | Confident | 83.1 | Confident | 100 Ų | 100 | 101.1 Ų | 101.1 | 47% | 0.467 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.3 | -48 | 175.5 | -166.8 | 80.7 | 37 | 0 | 0 | 111.1 | L88 H89 R94 I95 E96 | L88-Q92 WeakPolarHBondContact O-CB 3.25Å; L88-Q92 PolarHBondContact O-N 3.06Å; H89-Q92 WeakPolarHBondContact O-CB 3.38Å; H89-Q92 PolarHBondContact O-N 2.87Å; H89-Q92 VanDerWaalsContact O-N 3.17Å; Q92-R94 VanDerWaalsContact C-N 3.29Å; Q92-R94 PolarHBondContact O-N 2.89Å; Q92-I95 WeakPolarHBondContact O-CB 3.39Å; Q92-I95 PolarHBondContact O-N 3.29Å; Q92-E96 WeakPolarHBondContact O-CG 3.35Å; Q92-E96 PolarHBondContact O-N 3.35Å |
| 93 | E | 89.6 | Confident | 84 | Confident | 112 Ų | 112 | 103.2 Ų | 103.2 | 52% | 0.523 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -60.9 | -38.9 | 176.3 | -72.4 | -160.8 | 113.2 | 0 | 0 | 111.6 | H89 E90 E96 S97 | H89-E93 PolarHBondContact O-N 3.32Å; E90-E93 PolarHBondContact O-N 2.86Å; E93-E96 PolarHBondContact O-N 3.07Å; E93-S97 WeakPolarHBondContact O-CB 3.32Å; E93-S97 PolarHBondContact O-N 2.93Å |
| 94 | R | 91 | Very high | 83.9 | Confident | 170 Ų | 170 | 108 Ų | 108 | 64% | 0.642 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.4 | -42.2 | 176.1 | -166.3 | -172.7 | 171.5 | 178.2 | -2.2 | 111.5 | E90 V91 Q92 E96 S97 M98 | E90-R94 WeakPolarHBondContact O-CB 3.46Å; E90-R94 PolarHBondContact O-N 3.47Å; V91-R94 PolarHBondContact O-N 3.18Å; Q92-R94 VanDerWaalsContact C-N 3.29Å; Q92-R94 PolarHBondContact O-N 2.89Å; R94-E96 VanDerWaalsContact C-N 3.35Å; R94-S97 PolarHBondContact O-N 3.17Å; R94-S97 PolarHBondContact O-OG 3.24Å; R94-M98 HydrophobicContact CG-CE 4.08Å; R94-M98 WeakPolarHBondContact O-CG 3.47Å; R94-M98 PolarHBondContact O-N 2.75Å; R94-M98 VanDerWaalsContact O-N 3.11Å |
| 95 | I | 88.8 | Confident | 84 | Confident | 54 Ų | 54 | 107.7 Ų | 107.7 | 28% | 0.277 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -62.7 | -42.5 | 175.6 | -71.2 | 165.6 | 0 | 0 | 0 | 110.8 | V91 Q92 M98 G99 L100 H101 | V91-I95 HydrophobicContact CG1-CD1 3.89Å; V91-I95 VanDerWaalsContact O-CG1 3.25Å; V91-I95 WeakPolarHBondContact O-CG1 3.46Å; V91-I95 PolarHBondContact O-N 3.11Å; Q92-I95 WeakPolarHBondContact O-CB 3.39Å; Q92-I95 PolarHBondContact O-N 3.29Å; I95-M98 PolarHBondContact O-N 3.45Å; I95-G99 PolarHBondContact O-N 2.97Å; I95-L100 HydrophobicContact CG2-CB 3.96Å; I95-L100 PolarHBondContact O-N 2.78Å; I95-H101 HydrophobicContact CG2-CB 4.21Å |
| 96 | E | 89.1 | Confident | 83.9 | Confident | 104 Ų | 104 | 109.5 Ų | 109.5 | 49% | 0.486 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.8 | -43.6 | 176.3 | -71.4 | 173.1 | 176.8 | 0 | 0 | 111.8 | Q92 E93 R94 M98 G99 H101 | Q92-E96 WeakPolarHBondContact O-CG 3.35Å; Q92-E96 PolarHBondContact O-N 3.35Å; E93-E96 PolarHBondContact O-N 3.07Å; R94-E96 VanDerWaalsContact C-N 3.35Å; E96-M98 VanDerWaalsContact C-N 3.25Å; E96-M98 PolarHBondContact O-N 3.45Å; E96-G99 PolarHBondContact O-N 3.14Å; E96-H101 HydrophobicContact CG-CB 4.18Å |
| 97 | S | 90.1 | Very high | 83.4 | Confident | 97 Ų | 97 | 108.8 Ų | 108.8 | 68% | 0.678 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -62.1 | -32.9 | 177.5 | 79.3 | 0 | 0 | 0 | 0 | 113 | E93 R94 G99 | E93-S97 WeakPolarHBondContact O-CB 3.32Å; E93-S97 PolarHBondContact O-N 2.93Å; R94-S97 PolarHBondContact O-N 3.17Å; R94-S97 PolarHBondContact O-OG 3.24Å; S97-G99 VanDerWaalsContact C-N 3.29Å |
| 98 | M | 86.9 | Confident | 82.5 | Confident | 99 Ų | 99 | 113.4 Ų | 113.4 | 49% | 0.488 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86 | -0.2 | 177.1 | -65.7 | -171 | -62.2 | 0 | 0 | 112.7 | R94 I95 E96 L100 | R94-M98 HydrophobicContact CG-CE 4.08Å; R94-M98 WeakPolarHBondContact O-CG 3.47Å; R94-M98 PolarHBondContact O-N 2.75Å; R94-M98 VanDerWaalsContact O-N 3.11Å; I95-M98 PolarHBondContact O-N 3.45Å; E96-M98 VanDerWaalsContact C-N 3.25Å; E96-M98 PolarHBondContact O-N 3.45Å; M98-L100 HydrophobicContact CB-CD1 4.09Å; M98-L100 HydrophobicContact CB-CG 3.94Å; M98-L100 HydrophobicContact CE-CD1 3.89Å; M98-L100 PolarHBondContact O-N 3.36Å |
| 99 | G | 85.6 | Confident | 81.1 | Confident | 53 Ų | 53 | 114.2 Ų | 114.2 | 55% | 0.546 | 61% | 0.61 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 63.9 | 21.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | I95 E96 S97 H101 | I95-G99 PolarHBondContact O-N 2.97Å; E96-G99 PolarHBondContact O-N 3.14Å; S97-G99 VanDerWaalsContact C-N 3.29Å; G99-H101 VanDerWaalsContact C-N 3.33Å |
| 100 | L | 86.4 | Confident | 79.7 | Confident | 120 Ų | 120 | 114.4 Ų | 114.4 | 63% | 0.628 | 63% | 0.625 | S | S | * | * | trans | -92.2 | 5.8 | -179.7 | -64.7 | -178.7 | 0 | 0 | 0 | 112.6 | I95 M98 L102 | I95-L100 HydrophobicContact CG2-CB 3.96Å; I95-L100 PolarHBondContact O-N 2.78Å; M98-L100 HydrophobicContact CB-CD1 4.09Å; M98-L100 HydrophobicContact CB-CG 3.94Å; M98-L100 HydrophobicContact CE-CD1 3.89Å; M98-L100 PolarHBondContact O-N 3.36Å; L100-L102 PolarHBondContact O-N 3.39Å | ||
| 101 | H | 84.3 | Confident | 77.6 | Confident | 106 Ų | 106 | 114 Ų | 114 | 49% | 0.491 | 63% | 0.627 | S | S | . | * | P | Polyproline II helix | trans | -69 | 133.3 | 177.2 | 72.1 | -91 | 0 | 0 | 0 | 109.6 | I95 E96 G99 | I95-H101 HydrophobicContact CG2-CB 4.21Å; E96-H101 HydrophobicContact CG-CB 4.18Å; G99-H101 VanDerWaalsContact C-N 3.33Å |
| 102 | L | 82.1 | Confident | 75.9 | Confident | 154 Ų | 154 | 120.1 Ų | 120.1 | 81% | 0.806 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -70 | 137.1 | 172 | -162.9 | 71.3 | 0 | 0 | 0 | 108.1 | L100 Q104 | L100-L102 PolarHBondContact O-N 3.39Å; L102-Q104 PolarHBondContact O-N 2.97Å |
| 103 | P | 78.7 | Confident | 73.9 | Confident | 98 Ų | 98 | 122.5 Ų | 122.5 | 64% | 0.636 | 66% | 0.662 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 133.1 | 172.6 | 22.4 | -32.9 | 0 | 0 | 0 | 109.4 | ||
| 104 | Q | 74.9 | Confident | 72.1 | Confident | 182 Ų | 182 | 127.1 Ų | 127.1 | 85% | 0.85 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 125.9 | 175.4 | -173.8 | 175.1 | 10.3 | 0 | 0 | 107.9 | L102 | L102-Q104 PolarHBondContact O-N 2.97Š|
| 105 | P | 72.8 | Confident | 70.1 | Confident | 102 Ų | 102 | 127.5 Ų | 127.5 | 66% | 0.662 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 138.6 | 178.1 | 23.6 | -32.8 | 0 | 0 | 0 | 108.6 | ||
| 106 | P | 71.7 | Confident | 67.8 | Low | 113 Ų | 113 | 130.4 Ų | 130.4 | 73% | 0.734 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -56 | 141.5 | -180 | 23.6 | -32.6 | 0 | 0 | 0 | 109.2 | L108 | P106-L108 PolarHBondContact O-N 3.28Š|
| 107 | P | 69 | Low | 66.1 | Low | 98 Ų | 98 | 135.2 Ų | 135.2 | 64% | 0.636 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 142.9 | 172.9 | 25.3 | -32.7 | 0 | 0 | 0 | 108.5 | D109 | P107-D109 PolarHBondContact O-N 3.16Š|
| 108 | L | 60.6 | Low | 64.2 | Low | 182 Ų | 182 | 134.1 Ų | 134.1 | 95% | 0.953 | 74% | 0.742 | S | S | * | * | trans | -70.3 | 59.8 | 168.8 | -65.8 | 165.2 | 0 | 0 | 0 | 108.8 | P106 | P106-L108 PolarHBondContact O-N 3.28Š| ||
| 109 | D | 52.1 | Low | 62.4 | Low | 132 Ų | 132 | 134.4 Ų | 134.4 | 71% | 0.706 | 76% | 0.759 | S | S | * | * | trans | -84.4 | 123.4 | 167.3 | -83.5 | -51.6 | 0 | 0 | 0 | 107.5 | P107 D111 | P107-D109 PolarHBondContact O-N 3.16Å; D109-D111 PolarHBondContact O-N 3.27Å; D109-D111 VanDerWaalsContact O-N 3.16Å | ||
| 110 | S | 55.2 | Low | 60.5 | Low | 123 Ų | 123 | 137.5 Ų | 137.5 | 86% | 0.86 | 77% | 0.773 | S | S | * | * | trans | -41.5 | 114.8 | 172.7 | -59.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 111 | D | 45.7 | Very low | 58.7 | Low | 123 Ų | 123 | 135.7 Ų | 135.7 | 66% | 0.658 | 78% | 0.775 | S | S | * | * | trans | -122.7 | 99.8 | 155.5 | -161.2 | -113.4 | 0 | 0 | 0 | 108.2 | D109 E113 | D109-D111 PolarHBondContact O-N 3.27Å; D109-D111 VanDerWaalsContact O-N 3.16Å; D111-E113 PolarHBondContact O-N 3.15Å; D111-E113 VanDerWaalsContact OD1-CB 3.26Å; D111-E113 WeakPolarHBondContact OD1-CB 3.38Å; D111-E113 WeakPolarHBondContact OD1-CG 3.46Å | ||
| 112 | E | 52.3 | Low | 56.9 | Low | 201 Ų | 201 | 139 Ų | 139 | 94% | 0.939 | 80% | 0.795 | S | S | * | * | trans | -78.6 | 75.8 | 165.2 | -167.7 | 163.2 | 87.3 | 0 | 0 | 105.6 | ||||
| 113 | E | 45 | Very low | 55.6 | Low | 150 Ų | 150 | 136.7 Ų | 136.7 | 70% | 0.701 | 79% | 0.792 | S | S | * | * | trans | -114.4 | 118.3 | 165.2 | -74 | -157.7 | 126.8 | 0 | 0 | 109.7 | D111 E115 | D111-E113 PolarHBondContact O-N 3.15Å; D111-E113 VanDerWaalsContact OD1-CB 3.26Å; D111-E113 WeakPolarHBondContact OD1-CB 3.38Å; D111-E113 WeakPolarHBondContact OD1-CG 3.46Å; E113-E115 VanDerWaalsContact C-N 3.33Å; E113-E115 PolarHBondContact O-N 3.01Å | ||
| 114 | E | 51.4 | Low | 54.5 | Low | 209 Ų | 209 | 137.5 Ų | 137.5 | 98% | 0.977 | 80% | 0.8 | S | S | * | * | trans | -55.1 | 90.9 | 169.3 | -77.2 | 171.2 | 48.3 | 0 | 0 | 110 | ||||
| 115 | E | 48.5 | Very low | 53.7 | Low | 177 Ų | 177 | 133.6 Ų | 133.6 | 83% | 0.827 | 80% | 0.799 | S | S | * | * | trans | -100.5 | 136 | 161.4 | -86.8 | -166.5 | 83.9 | 0 | 0 | 111.1 | E113 E117 | E113-E115 VanDerWaalsContact C-N 3.33Å; E113-E115 PolarHBondContact O-N 3.01Å; E115-E117 PolarHBondContact O-N 3.32Å | ||
| 116 | P | 42.1 | Very low | 52.9 | Low | 115 Ų | 115 | 132.7 Ų | 132.7 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | trans | -66.4 | 126.3 | -160.8 | 26.4 | -34.9 | 0 | 0 | 0 | 112.3 | G118 | P116-G118 PolarHBondContact O-N 3.27Š| ||
| 117 | E | 52.1 | Low | 52.5 | Low | 206 Ų | 206 | 132.6 Ų | 132.6 | 96% | 0.963 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -15.4 | 91.9 | 153.4 | -161.5 | -178.4 | 170.3 | 0 | 0 | 113.3 | E115 | E115-E117 PolarHBondContact O-N 3.32Š|
| 118 | G | 51.2 | Low | 52.5 | Low | 74 Ų | 74 | 134.9 Ų | 134.9 | 76% | 0.763 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -179.6 | 6.4 | -175.7 | 0 | 0 | 0 | 0 | 0 | 120.8 | P116 | P116-G118 PolarHBondContact O-N 3.27Š|
| 119 | A | 48.8 | Very low | 53 | Low | 104 Ų | 104 | 131.3 Ų | 131.3 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -162.6 | 6.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||
| 120 | S | 45.8 | Very low | 54.3 | Low | 119 Ų | 119 | 129.9 Ų | 129.9 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -102.6 | 116.1 | 178.4 | -97 | 0 | 0 | 0 | 0 | 112 | ||
| 121 | A | 47.6 | Very low | 55.9 | Low | 81 Ų | 81 | 129.6 Ų | 129.6 | 67% | 0.669 | 77% | 0.774 | S | S | * | * | trans | 69.6 | 35.4 | 149.3 | 0 | 0 | 0 | 0 | 0 | 120.3 | S123 | A121-S123 PolarHBondContact O-N 3.04Š| ||
| 122 | L | 47.4 | Very low | 58 | Low | 175 Ų | 175 | 131.6 Ų | 131.6 | 92% | 0.916 | 78% | 0.78 | S | S | * | * | trans | -72.3 | -8 | 165.4 | -70.5 | 174.7 | 0 | 0 | 0 | 114 | S124 | L122-S124 PolarHBondContact O-N 3.2Š| ||
| 123 | S | 55 | Low | 59.9 | Low | 107 Ų | 107 | 128.2 Ų | 128.2 | 75% | 0.748 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -99.5 | 63.9 | 177.7 | 63.9 | 0 | 0 | 0 | 0 | 111.7 | A121 | A121-S123 PolarHBondContact O-N 3.04Š|
| 124 | S | 55.6 | Low | 62.1 | Low | 115 Ų | 115 | 124.9 Ų | 124.9 | 80% | 0.804 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -174.1 | -12.8 | 160.8 | -83.8 | 0 | 0 | 0 | 0 | 115.6 | L122 | L122-S124 PolarHBondContact O-N 3.2Š|
| 125 | A | 57.1 | Low | 64.1 | Low | 99 Ų | 99 | 117.6 Ų | 117.6 | 82% | 0.818 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -90.2 | -11.2 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 126 | A | 57.2 | Low | 66.2 | Low | 84 Ų | 84 | 115.3 Ų | 115.3 | 69% | 0.694 | 71% | 0.711 | S | S | * | * | trans | -104 | 70.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110 | I128 | A126-I128 VanDerWaalsContact C-N 3.27Å; A126-I128 PolarHBondContact O-N 3.25Å | ||
| 127 | S | 62.1 | Low | 68.7 | Low | 111 Ų | 111 | 113.8 Ų | 113.8 | 78% | 0.776 | 70% | 0.697 | S | S | * | * | trans | -69.4 | 91.5 | 166 | -170.7 | 0 | 0 | 0 | 0 | 107.7 | P129 | S127-P129 WeakPolarHBondContact O-CD 3.33Š| ||
| 128 | I | 68.8 | Low | 70.7 | Confident | 145 Ų | 145 | 106.9 Ų | 106.9 | 74% | 0.744 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 117.9 | 169.2 | -58.6 | 172.5 | 0 | 0 | 0 | 105.2 | A126 M130 | A126-I128 VanDerWaalsContact C-N 3.27Å; A126-I128 PolarHBondContact O-N 3.25Å; I128-M130 PolarHBondContact O-N 3.04Å; I128-M130 VanDerWaalsContact O-N 3.13Å |
| 129 | P | 72.5 | Confident | 72.7 | Confident | 107 Ų | 107 | 110.1 Ų | 110.1 | 70% | 0.695 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 124.7 | 178.6 | 25 | -32.4 | 0 | 0 | 0 | 108.2 | S127 D131 | S127-P129 WeakPolarHBondContact O-CD 3.33Å; P129-D131 PolarHBondContact O-N 2.7Å |
| 130 | M | 79.3 | Confident | 74.9 | Confident | 103 Ų | 103 | 113.9 Ų | 113.9 | 51% | 0.507 | 65% | 0.653 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 128.2 | 173.3 | -161.9 | 86.2 | 126.2 | 0 | 0 | 108.2 | I128 H134 V135 V138 | I128-M130 PolarHBondContact O-N 3.04Å; I128-M130 VanDerWaalsContact O-N 3.13Å; M130-H134 WeakPolarHBondContact CE-CE1 3.46Å; M130-H134 WeakPolarHBondContact CE-NE2 3.11Å; M130-H134 HydrophobicContact CG-CB 3.92Å; M130-H134 PolarHBondContact SD-CE1 3.08Å; M130-H134 PolarHBondContact SD-ND1 3.34Å; M130-V135 HydrophobicContact CB-CG2 3.89Å; M130-V135 HydrophobicContact CG-CG2 3.92Å; M130-V138 HydrophobicContact CE-CG2 4.27Å |
| 131 | D | 87.8 | Confident | 77.2 | Confident | 116 Ų | 116 | 111.8 Ų | 111.8 | 62% | 0.62 | 64% | 0.635 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 145.9 | 177.9 | -57.7 | -77.1 | 0 | 0 | 0 | 111.1 | P129 D133 H134 V135 | P129-D131 PolarHBondContact O-N 2.7Å; D131-D133 VanDerWaalsContact C-N 3.27Å; D131-D133 PolarHBondContact O-N 3.12Å; D131-H134 HydrophobicContact CB-CB 4.3Å; D131-H134 WeakPolarHBondContact O-CA 3.3Å; D131-H134 WeakPolarHBondContact O-CB 3.39Å; D131-H134 PolarHBondContact O-N 3.48Å; D131-V135 PolarHBondContact O-N 2.93Å |
| 132 | E | 90.7 | Very high | 79.3 | Confident | 166 Ų | 166 | 113.5 Ų | 113.5 | 78% | 0.776 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -56.9 | -42.1 | -177 | -66.3 | -175.8 | 129.1 | 0 | 0 | 111.7 | H134 V135 E136 | E132-H134 VanDerWaalsContact C-N 3.26Å; E132-H134 PolarHBondContact O-N 2.94Å; E132-V135 PolarHBondContact O-N 3.26Å; E132-E136 WeakPolarHBondContact O-CG 3.26Å; E132-E136 PolarHBondContact O-N 2.92Å |
| 133 | D | 91.5 | Very high | 81.3 | Confident | 130 Ų | 130 | 109.4 Ų | 109.4 | 70% | 0.695 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -58.8 | -37.2 | 174.8 | -66.9 | -52.6 | 0 | 0 | 0 | 112.4 | D131 E136 L137 | D131-D133 VanDerWaalsContact C-N 3.27Å; D131-D133 PolarHBondContact O-N 3.12Å; D133-E136 PolarHBondContact O-N 2.94Å; D133-L137 WeakPolarHBondContact O-CB 3.44Å; D133-L137 PolarHBondContact O-N 3.37Å |
| 134 | H | 91.3 | Very high | 83 | Confident | 79 Ų | 79 | 108.5 Ų | 108.5 | 37% | 0.366 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -74.2 | -38 | 179.6 | -170.5 | 177.5 | 0 | 0 | 0 | 110.8 | M130 D131 E132 E136 L137 V138 | M130-H134 WeakPolarHBondContact CE-CE1 3.46Å; M130-H134 WeakPolarHBondContact CE-NE2 3.11Å; M130-H134 HydrophobicContact CG-CB 3.92Å; M130-H134 PolarHBondContact SD-CE1 3.08Å; M130-H134 PolarHBondContact SD-ND1 3.34Å; D131-H134 HydrophobicContact CB-CB 4.3Å; D131-H134 WeakPolarHBondContact O-CA 3.3Å; D131-H134 WeakPolarHBondContact O-CB 3.39Å; D131-H134 PolarHBondContact O-N 3.48Å; E132-H134 VanDerWaalsContact C-N 3.26Å; E132-H134 PolarHBondContact O-N 2.94Å; H134-E136 VanDerWaalsContact C-N 3.34Å; H134-E136 PolarHBondContact O-N 2.97Å; H134-L137 PolarHBondContact O-N 3.39Å; H134-V138 WeakPolarHBondContact O-CG2 3.32Å; H134-V138 PolarHBondContact O-N 2.8Å |
| 135 | V | 92.9 | Very high | 84.6 | Confident | 56 Ų | 56 | 106.8 Ų | 106.8 | 34% | 0.339 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -61.2 | -44 | 172.1 | 175.2 | 0 | 0 | 0 | 0 | 110.9 | M130 D131 E132 V138 K139 | M130-V135 HydrophobicContact CB-CG2 3.89Å; M130-V135 HydrophobicContact CG-CG2 3.92Å; D131-V135 PolarHBondContact O-N 2.93Å; E132-V135 PolarHBondContact O-N 3.26Å; V135-V138 PolarHBondContact O-N 3.22Å; V135-K139 HydrophobicContact CG1-CD 4.08Å; V135-K139 HydrophobicContact CG1-CG 4.5Å; V135-K139 WeakPolarHBondContact O-CB 3.36Å; V135-K139 VanDerWaalsContact O-CG 3.27Å; V135-K139 WeakPolarHBondContact O-CG 3.45Å; V135-K139 PolarHBondContact O-N 2.83Å |
| 136 | E | 94.6 | Very high | 85.8 | Confident | 129 Ų | 129 | 106.6 Ų | 106.6 | 60% | 0.603 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64 | -40 | 176.2 | -70.2 | -172.7 | 179.2 | 0 | 0 | 112.4 | E132 D133 H134 K139 R140 | E132-E136 WeakPolarHBondContact O-CG 3.26Å; E132-E136 PolarHBondContact O-N 2.92Å; D133-E136 PolarHBondContact O-N 2.94Å; H134-E136 VanDerWaalsContact C-N 3.34Å; H134-E136 PolarHBondContact O-N 2.97Å; E136-K139 PolarHBondContact O-N 2.83Å; E136-R140 WeakPolarHBondContact O-CB 3.22Å; E136-R140 PolarHBondContact O-N 3.35Å |
| 137 | L | 94.1 | Very high | 86.8 | Confident | 84 Ų | 84 | 109.5 Ų | 109.5 | 44% | 0.44 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -60.9 | -46.9 | 174.5 | 177.1 | 62.1 | 0 | 0 | 0 | 111.9 | D133 H134 R140 T141 | D133-L137 WeakPolarHBondContact O-CB 3.44Å; D133-L137 PolarHBondContact O-N 3.37Å; H134-L137 PolarHBondContact O-N 3.39Å; L137-R140 PolarHBondContact O-N 3.02Å; L137-T141 WeakPolarHBondContact O-CB 3.41Å; L137-T141 PolarHBondContact O-N 3.36Å; L137-T141 PolarHBondContact O-OG1 2.88Å |
| 138 | V | 93.7 | Very high | 87.9 | Confident | 61 Ų | 61 | 108.3 Ų | 108.3 | 37% | 0.37 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -62.5 | -46.6 | 176.9 | 171.6 | 0 | 0 | 0 | 0 | 109.8 | M130 H134 V135 R140 T141 M142 | M130-V138 HydrophobicContact CE-CG2 4.27Å; H134-V138 WeakPolarHBondContact O-CG2 3.32Å; H134-V138 PolarHBondContact O-N 2.8Å; V135-V138 PolarHBondContact O-N 3.22Å; V138-R140 PolarHBondContact O-N 3.45Å; V138-T141 PolarHBondContact O-N 3.19Å; V138-M142 HydrophobicContact CG1-CG 3.97Å; V138-M142 VanDerWaalsContact O-CB 3.28Å; V138-M142 WeakPolarHBondContact O-CB 3.33Å; V138-M142 VanDerWaalsContact O-CG 3.23Å; V138-M142 WeakPolarHBondContact O-CG 3.3Å; V138-M142 PolarHBondContact O-N 3.34Å |
| 139 | K | 93.6 | Very high | 87.9 | Confident | 141 Ų | 141 | 106 Ų | 106 | 61% | 0.613 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -56.8 | -47.7 | 176.1 | -75.8 | 171.9 | 178.2 | 173.9 | 0 | 112 | V135 E136 T141 A143 | V135-K139 HydrophobicContact CG1-CD 4.08Å; V135-K139 HydrophobicContact CG1-CG 4.5Å; V135-K139 WeakPolarHBondContact O-CB 3.36Å; V135-K139 VanDerWaalsContact O-CG 3.27Å; V135-K139 WeakPolarHBondContact O-CG 3.45Å; V135-K139 PolarHBondContact O-N 2.83Å; E136-K139 PolarHBondContact O-N 2.83Å; K139-T141 VanDerWaalsContact C-N 3.35Å; K139-T141 PolarHBondContact O-N 2.91Å; K139-A143 VanDerWaalsContact O-CB 3.26Å; K139-A143 WeakPolarHBondContact O-CB 3.39Å; K139-A143 PolarHBondContact O-N 3.41Å |
| 140 | R | 95.1 | Very high | 87.6 | Confident | 184 Ų | 184 | 109.1 Ų | 109.1 | 69% | 0.694 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62 | -43.4 | 178.7 | -172.7 | -174.3 | 75.9 | 174.8 | 1.8 | 111.7 | E136 L137 V138 A144 | E136-R140 WeakPolarHBondContact O-CB 3.22Å; E136-R140 PolarHBondContact O-N 3.35Å; L137-R140 PolarHBondContact O-N 3.02Å; V138-R140 PolarHBondContact O-N 3.45Å; R140-A144 PolarHBondContact O-N 3.1Å |
| 141 | T | 94.2 | Very high | 87.3 | Confident | 74 Ų | 74 | 107.4 Ų | 107.4 | 45% | 0.454 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -69.9 | -44.7 | -178.1 | -53.1 | 0 | 0 | 0 | 0 | 110.8 | L137 V138 K139 A143 A144 | L137-T141 WeakPolarHBondContact O-CB 3.41Å; L137-T141 PolarHBondContact O-N 3.36Å; L137-T141 PolarHBondContact O-OG1 2.88Å; V138-T141 PolarHBondContact O-N 3.19Å; K139-T141 VanDerWaalsContact C-N 3.35Å; K139-T141 PolarHBondContact O-N 2.91Å; T141-A143 VanDerWaalsContact C-N 3.33Å; T141-A143 PolarHBondContact O-N 3.48Å; T141-A144 WeakPolarHBondContact O-CB 3.36Å; T141-A144 PolarHBondContact O-N 3.45Å; T141-A144 VanDerWaalsContact O-N 3.1Å |
| 142 | M | 91.8 | Very high | 86.9 | Confident | 118 Ų | 118 | 106.3 Ų | 106.3 | 58% | 0.581 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.6 | -32.7 | 177.2 | -69.8 | -59.7 | -58.4 | 0 | 0 | 112.5 | V138 A144 V145 | V138-M142 HydrophobicContact CG1-CG 3.97Å; V138-M142 VanDerWaalsContact O-CB 3.28Å; V138-M142 WeakPolarHBondContact O-CB 3.33Å; V138-M142 VanDerWaalsContact O-CG 3.23Å; V138-M142 WeakPolarHBondContact O-CG 3.3Å; V138-M142 PolarHBondContact O-N 3.34Å; M142-A144 PolarHBondContact O-N 3.3Å; M142-V145 WeakPolarHBondContact O-CB 3.4Å; M142-V145 PolarHBondContact O-N 3.44Å |
| 143 | A | 89 | Confident | 86.4 | Confident | 88 Ų | 88 | 101 Ų | 101 | 73% | 0.727 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.2 | -22.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | K139 T141 V145 | K139-A143 VanDerWaalsContact O-CB 3.26Å; K139-A143 WeakPolarHBondContact O-CB 3.39Å; K139-A143 PolarHBondContact O-N 3.41Å; T141-A143 VanDerWaalsContact C-N 3.33Å; T141-A143 PolarHBondContact O-N 3.48Å; A143-V145 VanDerWaalsContact C-N 3.31Å |
| 144 | A | 89.6 | Confident | 85.9 | Confident | 88 Ų | 88 | 98.4 Ų | 98.4 | 73% | 0.727 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -10.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | R140 T141 M142 | R140-A144 PolarHBondContact O-N 3.1Å; T141-A144 WeakPolarHBondContact O-CB 3.36Å; T141-A144 PolarHBondContact O-N 3.45Å; T141-A144 VanDerWaalsContact O-N 3.1Å; M142-A144 PolarHBondContact O-N 3.3Å |
| 145 | V | 89.4 | Confident | 85.4 | Confident | 80 Ų | 80 | 102.2 Ų | 102.2 | 49% | 0.485 | 58% | 0.579 | S | S | . | * | trans | -89.9 | 109.3 | 177 | -178.2 | 0 | 0 | 0 | 0 | 108.7 | M142 A143 | M142-V145 WeakPolarHBondContact O-CB 3.4Å; M142-V145 PolarHBondContact O-N 3.44Å; A143-V145 VanDerWaalsContact C-N 3.31Å | ||
| 146 | A | 83 | Confident | 84.9 | Confident | 94 Ų | 94 | 101.2 Ų | 101.2 | 78% | 0.777 | 58% | 0.577 | S | S | * | * | trans | -86 | 115.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 147 | L | 78.6 | Confident | 84.3 | Confident | 145 Ų | 145 | 101.4 Ų | 101.4 | 76% | 0.759 | 58% | 0.578 | S | S | * | * | trans | -78.5 | 134.5 | 169.6 | -63.8 | 177.7 | 0 | 0 | 0 | 109.5 | S149 | L147-S149 PolarHBondContact O-N 2.91Š| ||
| 148 | P | 84.1 | Confident | 84 | Confident | 86 Ų | 86 | 104.7 Ų | 104.7 | 56% | 0.558 | 59% | 0.591 | S | S | * | * | trans | -62.4 | 135.2 | 173.9 | 24.2 | -30.4 | 0 | 0 | 0 | 109.9 | L150 A151 | P148-L150 PolarHBondContact O-N 2.81Å; P148-L150 VanDerWaalsContact O-N 3.14Å; P148-A151 HydrophobicContact CG-CB 4.18Å; P148-A151 WeakPolarHBondContact O-CB 3.23Å; P148-A151 PolarHBondContact O-N 3.48Å | ||
| 149 | S | 69 | Low | 83.7 | Confident | 98 Ų | 98 | 104.9 Ų | 104.9 | 69% | 0.685 | 59% | 0.589 | S | S | * | * | G | 310 helix | trans | -62.2 | -21 | -179.4 | 50.2 | 0 | 0 | 0 | 0 | 113.8 | L147 A151 | L147-S149 PolarHBondContact O-N 2.91Å; S149-A151 PolarHBondContact O-N 3.41Å |
| 150 | L | 67.1 | Low | 83.4 | Confident | 172 Ų | 172 | 100.8 Ų | 100.8 | 90% | 0.901 | 58% | 0.578 | S | S | * | * | G | 310 helix | trans | -69.7 | -13 | 173.4 | -72 | 156.3 | 0 | 0 | 0 | 113.3 | P148 I152 | P148-L150 PolarHBondContact O-N 2.81Å; P148-L150 VanDerWaalsContact O-N 3.14Å; L150-I152 VanDerWaalsContact C-N 3.34Å |
| 151 | A | 71.5 | Confident | 83.1 | Confident | 67 Ų | 67 | 97.8 Ų | 97.8 | 55% | 0.554 | 58% | 0.576 | S | S | * | * | G | 310 helix | trans | -87.7 | 1.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | P148 S149 P153 | P148-A151 HydrophobicContact CG-CB 4.18Å; P148-A151 WeakPolarHBondContact O-CB 3.23Å; P148-A151 PolarHBondContact O-N 3.48Å; S149-A151 PolarHBondContact O-N 3.41Å; A151-P153 VanDerWaalsContact O-CD 3.3Å; A151-P153 WeakPolarHBondContact O-CD 3.26Å |
| 152 | I | 79.4 | Confident | 83 | Confident | 93 Ų | 93 | 100 Ų | 100 | 48% | 0.477 | 59% | 0.585 | S | S | . | * | S | Bend | trans | -94.3 | 108.1 | 178.6 | -54.2 | 177.1 | 0 | 0 | 0 | 108.8 | L150 A156 Q157 | L150-I152 VanDerWaalsContact C-N 3.34Å; I152-A156 HydrophobicContact CG2-CB 3.92Å; I152-Q157 HydrophobicContact CG2-CG 3.85Å; I152-Q157 PolarHBondContact O-NE2 3.25Å |
| 153 | P | 81.2 | Confident | 83 | Confident | 54 Ų | 54 | 100 Ų | 100 | 35% | 0.351 | 58% | 0.584 | S | S | . | * | trans | -66.6 | 155.2 | 179.2 | 29 | -35.3 | 0 | 0 | 0 | 111.5 | A151 W155 A156 Q157 | A151-P153 VanDerWaalsContact O-CD 3.3Å; A151-P153 WeakPolarHBondContact O-CD 3.26Å; P153-W155 VanDerWaalsContact C-N 3.3Å; P153-W155 HydrophobicContact CB-CG 4.36Å; P153-W155 VanDerWaalsContact CB-NE1 3.32Å; P153-W155 HydrophobicContact CG-CD2 4.08Å; P153-W155 HydrophobicContact CG-CG 4.35Å; P153-W155 HydrophobicContact CG-CH2 4.45Å; P153-W155 HydrophobicContact CG-CZ2 3.51Å; P153-W155 PolarHBondContact O-N 3.39Å; P153-A156 HydrophobicContact CG-CB 4Å; P153-A156 WeakPolarHBondContact O-CB 3.28Å; P153-A156 PolarHBondContact O-N 2.88Å; P153-Q157 PolarHBondContact O-N 3.44Å | ||
| 154 | T | 80.6 | Confident | 83 | Confident | 76 Ų | 76 | 102 Ų | 102 | 47% | 0.466 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -56.7 | -40.6 | -176.2 | 51.3 | 0 | 0 | 0 | 0 | 112.9 | A156 Q157 E158 | T154-A156 PolarHBondContact O-N 2.85Å; T154-Q157 WeakPolarHBondContact O-CA 3.43Å; T154-Q157 WeakPolarHBondContact O-CB 3.42Å; T154-Q157 PolarHBondContact O-N 3.48Å; T154-E158 WeakPolarHBondContact O-CG 3.41Å; T154-E158 PolarHBondContact O-N 3.27Å; T154-E158 VanDerWaalsContact O-N 3.07Å |
| 155 | W | 80.3 | Confident | 83.2 | Confident | 158 Ų | 158 | 102.6 Ų | 102.6 | 60% | 0.598 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -59 | -30.8 | 176.7 | 66 | -104 | 0 | 0 | 0 | 113.1 | P153 Q157 | P153-W155 VanDerWaalsContact C-N 3.3Å; P153-W155 HydrophobicContact CB-CG 4.36Å; P153-W155 VanDerWaalsContact CB-NE1 3.32Å; P153-W155 HydrophobicContact CG-CD2 4.08Å; P153-W155 HydrophobicContact CG-CG 4.35Å; P153-W155 HydrophobicContact CG-CH2 4.45Å; P153-W155 HydrophobicContact CG-CZ2 3.51Å; P153-W155 PolarHBondContact O-N 3.39Å; W155-Q157 VanDerWaalsContact C-N 3.32Å |
| 156 | A | 82.9 | Confident | 83.5 | Confident | 35 Ų | 35 | 103.7 Ų | 103.7 | 29% | 0.289 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -79.1 | -20.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I152 P153 T154 | I152-A156 HydrophobicContact CG2-CB 3.92Å; P153-A156 HydrophobicContact CG-CB 4Å; P153-A156 WeakPolarHBondContact O-CB 3.28Å; P153-A156 PolarHBondContact O-N 2.88Å; T154-A156 PolarHBondContact O-N 2.85Å |
| 157 | Q | 81.3 | Confident | 83.9 | Confident | 134 Ų | 134 | 103.5 Ų | 103.5 | 63% | 0.626 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -82.4 | -27.1 | 173 | -57.8 | -178.8 | 7.7 | 0 | 0 | 112.1 | I152 P153 T154 W155 | I152-Q157 HydrophobicContact CG2-CG 3.85Å; I152-Q157 PolarHBondContact O-NE2 3.25Å; P153-Q157 PolarHBondContact O-N 3.44Å; T154-Q157 WeakPolarHBondContact O-CA 3.43Å; T154-Q157 WeakPolarHBondContact O-CB 3.42Å; T154-Q157 PolarHBondContact O-N 3.48Å; W155-Q157 VanDerWaalsContact C-N 3.32Å |
| 158 | E | 88.4 | Confident | 84.6 | Confident | 153 Ų | 153 | 98.8 Ų | 98.8 | 72% | 0.715 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -75.5 | -26.7 | 179.9 | -70.3 | -179.4 | 99.1 | 0 | 0 | 113.4 | T154 | T154-E158 WeakPolarHBondContact O-CG 3.41Å; T154-E158 PolarHBondContact O-N 3.27Å; T154-E158 VanDerWaalsContact O-N 3.07Å |
| 159 | I | 86.8 | Confident | 85.1 | Confident | 65 Ų | 65 | 99.7 Ų | 99.7 | 33% | 0.333 | 52% | 0.52 | S | S | . | . | S | Bend | trans | -94.5 | 126.6 | 178.3 | -62.7 | 174.5 | 0 | 0 | 0 | 109.1 | Q163 W164 | I159-Q163 HydrophobicContact CG2-CB 3.84Å; I159-W164 HydrophobicContact CG2-CB 3.94Å |
| 160 | S | 89 | Confident | 86.2 | Confident | 55 Ų | 55 | 100.5 Ų | 100.5 | 39% | 0.385 | 51% | 0.513 | S | S | . | . | trans | -71.6 | 152.2 | 174.8 | 73.7 | 0 | 0 | 0 | 0 | 111.8 | D162 Q163 W164 | S160-D162 PolarHBondContact O-N 3.02Å; S160-D162 VanDerWaalsContact O-N 3.15Å; S160-Q163 WeakPolarHBondContact O-CB 3.44Å; S160-Q163 PolarHBondContact O-N 3.48Å; S160-Q163 WeakPolarHBondContact OG-CG 3.22Å; S160-Q163 PolarHBondContact OG-N 3.02Å; S160-W164 PolarHBondContact O-N 3.47Å | ||
| 161 | D | 87.9 | Confident | 87.2 | Confident | 121 Ų | 121 | 95.3 Ų | 95.3 | 65% | 0.647 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -50.6 | -40 | 174.8 | -85.5 | -88.9 | 0 | 0 | 0 | 112.9 | K165 | D161-K165 WeakPolarHBondContact O-CB 3.36Å; D161-K165 VanDerWaalsContact O-CG 3.22Å; D161-K165 WeakPolarHBondContact O-CG 3.27Å; D161-K165 PolarHBondContact O-N 3.38Å |
| 162 | D | 91.7 | Very high | 88.3 | Confident | 120 Ų | 120 | 96.4 Ų | 96.4 | 64% | 0.642 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -69 | -39 | 179.4 | -63.2 | -53.2 | 0 | 0 | 0 | 112 | S160 D166 | S160-D162 PolarHBondContact O-N 3.02Å; S160-D162 VanDerWaalsContact O-N 3.15Å; D162-D166 PolarHBondContact O-N 3.41Å; D162-D166 VanDerWaalsContact O-N 3.08Å |
| 163 | Q | 92.6 | Very high | 88.8 | Confident | 118 Ų | 118 | 97.4 Ų | 97.4 | 55% | 0.551 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.3 | -42.4 | 174.7 | -76.9 | 178.4 | -15.5 | 0 | 0 | 111.8 | I159 S160 D166 M167 | I159-Q163 HydrophobicContact CG2-CB 3.84Å; S160-Q163 WeakPolarHBondContact O-CB 3.44Å; S160-Q163 PolarHBondContact O-N 3.48Å; S160-Q163 WeakPolarHBondContact OG-CG 3.22Å; S160-Q163 PolarHBondContact OG-N 3.02Å; Q163-D166 PolarHBondContact O-N 3Å; Q163-M167 PolarHBondContact O-N 2.85Å |
| 164 | W | 89.2 | Confident | 89.3 | Confident | 131 Ų | 131 | 98.5 Ų | 98.5 | 50% | 0.496 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.3 | -43.6 | 177.1 | 179.4 | 81.8 | 0 | 0 | 0 | 111.7 | I159 S160 D166 M167 V168 | I159-W164 HydrophobicContact CG2-CB 3.94Å; S160-W164 PolarHBondContact O-N 3.47Å; W164-D166 VanDerWaalsContact C-N 3.3Å; W164-D166 PolarHBondContact O-N 2.93Å; W164-M167 PolarHBondContact O-N 3.29Å; W164-V168 HydrophobicContact CD2-CG2 3.95Å; W164-V168 HydrophobicContact CE3-CG2 4.37Å; W164-V168 HydrophobicContact CG-CG2 4.49Å; W164-V168 HydrophobicContact CH2-CG2 4.14Å; W164-V168 HydrophobicContact CZ2-CG2 3.68Å; W164-V168 HydrophobicContact CZ3-CG2 4.46Å; W164-V168 WeakPolarHBondContact O-CG2 3.47Å; W164-V168 PolarHBondContact O-N 3.46Å |
| 165 | K | 93.6 | Very high | 89.5 | Confident | 100 Ų | 100 | 103.2 Ų | 103.2 | 44% | 0.435 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -58.6 | -41.7 | 175.2 | -78 | 171.1 | -173 | 166.6 | 0 | 112.3 | D161 Q169 | D161-K165 WeakPolarHBondContact O-CB 3.36Å; D161-K165 VanDerWaalsContact O-CG 3.22Å; D161-K165 WeakPolarHBondContact O-CG 3.27Å; D161-K165 PolarHBondContact O-N 3.38Å; K165-Q169 WeakPolarHBondContact O-CB 3.26Å; K165-Q169 VanDerWaalsContact O-CG 3.26Å; K165-Q169 WeakPolarHBondContact O-CG 3.37Å; K165-Q169 PolarHBondContact O-N 2.92Å; K165-Q169 PolarHBondContact O-NE2 3.11Å; K165-Q169 VanDerWaalsContact O-NE2 3.11Å |
| 166 | D | 94.8 | Very high | 89.6 | Confident | 102 Ų | 102 | 102.6 Ų | 102.6 | 55% | 0.545 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.2 | -47.1 | 177.1 | -171.1 | -105 | 0 | 0 | 0 | 110.9 | D162 Q163 W164 V168 Q169 Q170 | D162-D166 PolarHBondContact O-N 3.41Å; D162-D166 VanDerWaalsContact O-N 3.08Å; Q163-D166 PolarHBondContact O-N 3Å; W164-D166 VanDerWaalsContact C-N 3.3Å; W164-D166 PolarHBondContact O-N 2.93Å; D166-V168 PolarHBondContact O-N 2.82Å; D166-Q169 PolarHBondContact O-N 3.46Å; D166-Q170 WeakPolarHBondContact O-CB 3.36Å; D166-Q170 PolarHBondContact O-N 3.46Å |
| 167 | M | 91.6 | Very high | 89.4 | Confident | 90 Ų | 90 | 104.7 Ų | 104.7 | 44% | 0.443 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.1 | -42.6 | 177.2 | -175 | 179.6 | 66 | 0 | 0 | 112.8 | Q163 W164 Q170 T171 | Q163-M167 PolarHBondContact O-N 2.85Å; W164-M167 PolarHBondContact O-N 3.29Å; M167-Q170 PolarHBondContact O-N 2.82Å; M167-T171 PolarHBondContact O-N 2.98Å; M167-T171 PolarHBondContact O-OG1 3.07Å |
| 168 | V | 93.8 | Very high | 88.8 | Confident | 46 Ų | 46 | 101.6 Ų | 101.6 | 28% | 0.279 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.4 | -45.3 | 176.6 | 171.7 | 0 | 0 | 0 | 0 | 111.2 | W164 D166 Q170 T171 L172 | W164-V168 HydrophobicContact CD2-CG2 3.95Å; W164-V168 HydrophobicContact CE3-CG2 4.37Å; W164-V168 HydrophobicContact CG-CG2 4.49Å; W164-V168 HydrophobicContact CH2-CG2 4.14Å; W164-V168 HydrophobicContact CZ2-CG2 3.68Å; W164-V168 HydrophobicContact CZ3-CG2 4.46Å; W164-V168 WeakPolarHBondContact O-CG2 3.47Å; W164-V168 PolarHBondContact O-N 3.46Å; D166-V168 PolarHBondContact O-N 2.82Å; V168-Q170 VanDerWaalsContact C-N 3.31Å; V168-Q170 PolarHBondContact O-N 2.88Å; V168-T171 WeakPolarHBondContact CA-OG1 3.44Å; V168-T171 PolarHBondContact O-N 3.16Å; V168-T171 PolarHBondContact O-OG1 3.25Å; V168-T171 VanDerWaalsContact O-OG1 3.12Å; V168-L172 HydrophobicContact CG1-CD1 4Å; V168-L172 WeakPolarHBondContact O-CB 3.27Å; V168-L172 WeakPolarHBondContact O-CG 3.29Å; V168-L172 PolarHBondContact O-N 3.37Å |
| 169 | Q | 93.6 | Very high | 87.5 | Confident | 105 Ų | 105 | 96.1 Ų | 96.1 | 49% | 0.491 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.8 | -42 | 176.4 | -78.2 | 174 | 76.8 | 0 | 0 | 111.4 | K165 D166 L172 Q173 | K165-Q169 WeakPolarHBondContact O-CB 3.26Å; K165-Q169 VanDerWaalsContact O-CG 3.26Å; K165-Q169 WeakPolarHBondContact O-CG 3.37Å; K165-Q169 PolarHBondContact O-N 2.92Å; K165-Q169 PolarHBondContact O-NE2 3.11Å; K165-Q169 VanDerWaalsContact O-NE2 3.11Å; D166-Q169 PolarHBondContact O-N 3.46Å; Q169-L172 PolarHBondContact O-N 3.48Å; Q169-Q173 WeakPolarHBondContact O-CB 3.39Å; Q169-Q173 WeakPolarHBondContact O-CG 3.37Å; Q169-Q173 PolarHBondContact O-N 3.25Å; Q169-Q173 PolarHBondContact O-NE2 3.25Å |
| 170 | Q | 92.6 | Very high | 85.9 | Confident | 116 Ų | 116 | 94.6 Ų | 94.6 | 54% | 0.542 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.7 | -48.4 | 177.2 | -171 | -176 | 13.9 | 0 | 0 | 110.6 | D166 M167 V168 L172 Q173 T174 | D166-Q170 WeakPolarHBondContact O-CB 3.36Å; D166-Q170 PolarHBondContact O-N 3.46Å; M167-Q170 PolarHBondContact O-N 2.82Å; V168-Q170 VanDerWaalsContact C-N 3.31Å; V168-Q170 PolarHBondContact O-N 2.88Å; Q170-L172 VanDerWaalsContact C-N 3.34Å; Q170-L172 PolarHBondContact O-N 3.38Å; Q170-Q173 PolarHBondContact O-N 2.74Å; Q170-T174 WeakPolarHBondContact O-CB 3.44Å; Q170-T174 PolarHBondContact O-N 3.38Å; Q170-T174 PolarHBondContact O-OG1 3.3Å |
| 171 | T | 89.4 | Confident | 84.1 | Confident | 62 Ų | 62 | 98.4 Ų | 98.4 | 38% | 0.38 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65 | -34.9 | 178.7 | 32.3 | 0 | 0 | 0 | 0 | 113.3 | M167 V168 R175 | M167-T171 PolarHBondContact O-N 2.98Å; M167-T171 PolarHBondContact O-OG1 3.07Å; V168-T171 WeakPolarHBondContact CA-OG1 3.44Å; V168-T171 PolarHBondContact O-N 3.16Å; V168-T171 PolarHBondContact O-OG1 3.25Å; V168-T171 VanDerWaalsContact O-OG1 3.12Å; T171-R175 WeakPolarHBondContact O-CB 3.37Å; T171-R175 PolarHBondContact O-N 3.48Å |
| 172 | L | 93.1 | Very high | 82.4 | Confident | 91 Ų | 91 | 100.8 Ų | 100.8 | 48% | 0.476 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.1 | -48.4 | 172 | -78.2 | 169.1 | 0 | 0 | 0 | 111.3 | V168 Q169 Q170 T174 R175 Q176 | V168-L172 HydrophobicContact CG1-CD1 4Å; V168-L172 WeakPolarHBondContact O-CB 3.27Å; V168-L172 WeakPolarHBondContact O-CG 3.29Å; V168-L172 PolarHBondContact O-N 3.37Å; Q169-L172 PolarHBondContact O-N 3.48Å; Q170-L172 VanDerWaalsContact C-N 3.34Å; Q170-L172 PolarHBondContact O-N 3.38Å; L172-T174 PolarHBondContact O-N 2.92Å; L172-R175 PolarHBondContact O-N 3.27Å; L172-Q176 WeakPolarHBondContact O-CB 3.38Å; L172-Q176 VanDerWaalsContact O-CG 3.29Å; L172-Q176 WeakPolarHBondContact O-CG 3.45Å; L172-Q176 PolarHBondContact O-N 2.91Å |
| 173 | Q | 91.3 | Very high | 80.5 | Confident | 114 Ų | 114 | 102.3 Ų | 102.3 | 53% | 0.533 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 177.8 | -75.3 | 171.1 | 81.4 | 0 | 0 | 112.2 | Q169 Q170 Q176 S177 | Q169-Q173 WeakPolarHBondContact O-CB 3.39Å; Q169-Q173 WeakPolarHBondContact O-CG 3.37Å; Q169-Q173 PolarHBondContact O-N 3.25Å; Q169-Q173 PolarHBondContact O-NE2 3.25Å; Q170-Q173 PolarHBondContact O-N 2.74Å; Q173-Q176 PolarHBondContact O-N 3.05Å; Q173-S177 VanDerWaalsContact O-CB 3.27Å; Q173-S177 WeakPolarHBondContact O-CB 3.46Å; Q173-S177 PolarHBondContact O-N 2.93Å; Q173-S177 PolarHBondContact O-OG 3.4Å |
| 174 | T | 91 | Very high | 78.5 | Confident | 77 Ų | 77 | 105.1 Ų | 105.1 | 47% | 0.472 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -61.3 | -47.9 | 175.3 | -57.5 | 0 | 0 | 0 | 0 | 110.5 | Q170 L172 Q176 S177 S178 | Q170-T174 WeakPolarHBondContact O-CB 3.44Å; Q170-T174 PolarHBondContact O-N 3.38Å; Q170-T174 PolarHBondContact O-OG1 3.3Å; L172-T174 PolarHBondContact O-N 2.92Å; T174-Q176 PolarHBondContact O-N 3.19Å; T174-S177 PolarHBondContact O-N 3.13Å; T174-S178 WeakPolarHBondContact O-CB 3.47Å; T174-S178 PolarHBondContact O-N 3.49Å; T174-S178 PolarHBondContact O-OG 3.19Å |
| 175 | R | 84.6 | Confident | 76.6 | Confident | 175 Ų | 175 | 110.3 Ų | 110.3 | 66% | 0.66 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -62.2 | -40 | 176.8 | -84.4 | -170.4 | -92.2 | -126 | 0 | 113.1 | T171 L172 S178 G179 | T171-R175 WeakPolarHBondContact O-CB 3.37Å; T171-R175 PolarHBondContact O-N 3.48Å; L172-R175 PolarHBondContact O-N 3.27Å; R175-S178 PolarHBondContact O-N 2.84Å; R175-G179 PolarHBondContact O-N 3.36Å |
| 176 | Q | 81.9 | Confident | 74 | Confident | 145 Ų | 145 | 118.6 Ų | 118.6 | 68% | 0.678 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -66.2 | -39.1 | 176.3 | -72.9 | 180 | -47.1 | 0 | 0 | 112 | L172 Q173 T174 G179 G180 | L172-Q176 WeakPolarHBondContact O-CB 3.38Å; L172-Q176 VanDerWaalsContact O-CG 3.29Å; L172-Q176 WeakPolarHBondContact O-CG 3.45Å; L172-Q176 PolarHBondContact O-N 2.91Å; Q173-Q176 PolarHBondContact O-N 3.05Å; T174-Q176 PolarHBondContact O-N 3.19Å; Q176-G179 PolarHBondContact O-N 2.92Å; Q176-G180 PolarHBondContact O-N 3.31Å |
| 177 | S | 78.8 | Confident | 73 | Confident | 79 Ų | 79 | 119.4 Ų | 119.4 | 55% | 0.552 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -69.7 | -39.5 | 177.6 | -61.7 | 0 | 0 | 0 | 0 | 111.7 | Q173 T174 G180 L181 | Q173-S177 VanDerWaalsContact O-CB 3.27Å; Q173-S177 WeakPolarHBondContact O-CB 3.46Å; Q173-S177 PolarHBondContact O-N 2.93Å; Q173-S177 PolarHBondContact O-OG 3.4Å; T174-S177 PolarHBondContact O-N 3.13Å; S177-G180 PolarHBondContact O-N 2.94Å; S177-L181 PolarHBondContact O-N 2.93Å |
| 178 | S | 69.8 | Low | 72 | Confident | 68 Ų | 68 | 120.9 Ų | 120.9 | 48% | 0.476 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -70.4 | -34.9 | 174.3 | -59.6 | 0 | 0 | 0 | 0 | 112.9 | T174 R175 L181 M182 | T174-S178 WeakPolarHBondContact O-CB 3.47Å; T174-S178 PolarHBondContact O-N 3.49Å; T174-S178 PolarHBondContact O-OG 3.19Å; R175-S178 PolarHBondContact O-N 2.84Å; S178-L181 PolarHBondContact O-N 2.98Å; S178-M182 PolarHBondContact O-N 3.27Å |
| 179 | G | 60.1 | Low | 70.8 | Confident | 38 Ų | 38 | 125.1 Ų | 125.1 | 39% | 0.392 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -67.5 | -33.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | R175 Q176 | R175-G179 PolarHBondContact O-N 3.36Å; Q176-G179 PolarHBondContact O-N 2.92Å |
| 180 | G | 54.2 | Low | 69.5 | Low | 34 Ų | 34 | 126.3 Ų | 126.3 | 35% | 0.351 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -67.7 | -35.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q176 S177 M182 L183 | Q176-G180 PolarHBondContact O-N 3.31Å; S177-G180 PolarHBondContact O-N 2.94Å; G180-M182 VanDerWaalsContact C-N 3.31Å; G180-M182 PolarHBondContact O-N 3.36Å; G180-L183 PolarHBondContact O-N 2.97Å |
| 181 | L | 51.6 | Low | 68 | Low | 134 Ų | 134 | 126.9 Ų | 126.9 | 70% | 0.702 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -69.1 | -23.6 | 177.6 | -85.8 | 150.6 | 0 | 0 | 0 | 113.8 | S177 S178 | S177-L181 PolarHBondContact O-N 2.93Å; S178-L181 PolarHBondContact O-N 2.98Å |
| 182 | M | 51.1 | Low | 66.6 | Low | 172 Ų | 172 | 131.3 Ų | 131.3 | 85% | 0.847 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -78.1 | -18.6 | 174.5 | -85.1 | -170 | 144.7 | 0 | 0 | 113.7 | S178 G180 | S178-M182 PolarHBondContact O-N 3.27Å; G180-M182 VanDerWaalsContact C-N 3.31Å; G180-M182 PolarHBondContact O-N 3.36Å |
| 183 | L | 52.2 | Low | 64.7 | Low | 151 Ų | 151 | 134.1 Ų | 134.1 | 79% | 0.791 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -87 | -14.5 | -179.3 | -78.4 | 147.9 | 0 | 0 | 0 | 113.7 | G180 | G180-L183 PolarHBondContact O-N 2.97Å |
| 184 | E | 51.1 | Low | 62.6 | Low | 178 Ų | 178 | 135.7 Ų | 135.7 | 83% | 0.832 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -108.8 | 29 | -174.4 | -60.5 | -154 | 112.6 | 0 | 0 | 114.4 | ||
| 185 | R | 48 | Very low | 60.3 | Low | 239 Ų | 239 | 140.6 Ų | 140.6 | 90% | 0.902 | 70% | 0.698 | S | S | * | * | trans | -113 | 56.1 | 173.3 | -161.2 | -168.2 | 175.7 | 97.3 | -1.9 | 112.7 | ||||
| 186 | K | 40 | Very low | 58.1 | Low | 274 Ų | 274 | 137.5 Ų | 137.5 | 100% | 1.191 | 70% | 0.701 | S | S | * | * | trans | -115.2 | 0 | 173 | -151.7 | 172.8 | -179.7 | 173 | 0 | 111.4 |
Retrieved 186 of 186 residues in 627 ms
(Link to these results)