| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.4 | Very low | 56 | Low | 241 Ų | 241 | 151.2 Ų | 151.2 | 100% | 1.187 | 84% | 0.837 | S | S | * | * | 0 | 91.9 | 0 | -48.5 | 169.3 | -173.9 | 0 | 0 | 106 | |||||
| 2 | S | 52 | Low | 55.5 | Low | 131 Ų | 131 | 152.7 Ų | 152.7 | 92% | 0.916 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 132.1 | -169 | -63.5 | 0 | 0 | 0 | 0 | 111.7 | ||
| 3 | L | 59.3 | Low | 55.1 | Low | 165 Ų | 165 | 154.9 Ų | 154.9 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 136.1 | -172.1 | -67 | 154.9 | 0 | 0 | 0 | 111.9 | ||
| 4 | G | 58.7 | Low | 54.2 | Low | 77 Ų | 77 | 156.2 Ų | 156.2 | 79% | 0.794 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 135 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | S6 | G4-S6 PolarHBondContact O-N 3.45Š|
| 5 | M | 65.9 | Low | 53.7 | Low | 162 Ų | 162 | 156.5 Ų | 156.5 | 80% | 0.798 | 83% | 0.831 | S | S | * | * | trans | -83.2 | 108.2 | 172.5 | -65.5 | -62.6 | 176.9 | 0 | 0 | 109.4 | Y7 | M5-Y7 HydrophobicContact CB-CE2 4.31Š| ||
| 6 | S | 64.9 | Low | 53.3 | Low | 112 Ų | 112 | 153.2 Ų | 153.2 | 78% | 0.783 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 117.8 | 175.9 | -165.9 | 0 | 0 | 0 | 0 | 109.6 | G4 | G4-S6 PolarHBondContact O-N 3.45Š|
| 7 | Y | 54 | Low | 52.4 | Low | 209 Ų | 209 | 147.6 Ų | 147.6 | 82% | 0.82 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 118 | 173.3 | -71.5 | -85.3 | 0 | 0 | 0 | 110 | M5 | M5-Y7 HydrophobicContact CB-CE2 4.31Š|
| 8 | K | 68.4 | Low | 52 | Low | 189 Ų | 189 | 147.2 Ų | 147.2 | 82% | 0.822 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 132.7 | 171.6 | -72 | 164.1 | 60.1 | -171.5 | 0 | 109.9 | ||
| 9 | P | 50.2 | Low | 51.4 | Low | 114 Ų | 114 | 145.8 Ų | 145.8 | 74% | 0.74 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 130.4 | 168.1 | 31.3 | -29.3 | 0 | 0 | 0 | 109.6 | V11 | P9-V11 PolarHBondContact O-N 3.07Š|
| 10 | N | 44.8 | Very low | 50.8 | Low | 150 Ų | 150 | 142 Ų | 142 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | trans | -87.7 | 107.2 | 177 | -149.9 | 76.8 | 0 | 0 | 0 | 109.5 | ||||
| 11 | V | 54.4 | Low | 50.8 | Low | 113 Ų | 113 | 142.9 Ų | 142.9 | 69% | 0.685 | 81% | 0.81 | S | S | * | * | trans | -94.9 | 104.5 | 174.5 | 178.5 | 0 | 0 | 0 | 0 | 108.5 | P9 | P9-V11 PolarHBondContact O-N 3.07Š| ||
| 12 | H | 49.7 | Very low | 50.4 | Low | 169 Ų | 169 | 140.2 Ų | 140.2 | 78% | 0.782 | 80% | 0.795 | S | S | * | * | trans | -156.3 | 89.6 | 163.6 | -89.9 | 75.8 | 0 | 0 | 0 | 104.6 | ||||
| 13 | Q | 50 | Low | 49.8 | Very low | 182 Ų | 182 | 140.6 Ų | 140.6 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | 61.3 | 100 | 67.3 | -155.3 | 169.8 | 29 | 0 | 0 | 113.9 | |||||
| 14 | H | 43.2 | Very low | 48.7 | Very low | 173 Ų | 173 | 135.9 Ų | 135.9 | 80% | 0.801 | 78% | 0.782 | S | S | * | * | trans | -158.7 | 116.7 | 142.9 | -167.3 | -110.2 | 0 | 0 | 0 | 110.9 | P16 | H14-P16 WeakPolarHBondContact CE1-CD 3.5Š| ||
| 15 | I | 46.8 | Very low | 48.3 | Very low | 160 Ų | 160 | 140 Ų | 140 | 82% | 0.821 | 79% | 0.786 | S | S | * | * | trans | -129 | 126.2 | 162.7 | -60.1 | 159.7 | 0 | 0 | 0 | 104 | ||||
| 16 | P | 46.9 | Very low | 47.3 | Very low | 104 Ų | 104 | 140.2 Ų | 140.2 | 68% | 0.675 | 79% | 0.789 | S | S | * | * | -151.3 | 164.5 | 106.1 | 32.1 | -11.6 | 0 | 0 | 0 | 112.1 | H14 | H14-P16 WeakPolarHBondContact CE1-CD 3.5Š| |||
| 17 | G | 37.4 | Very low | 46.4 | Very low | 58 Ų | 58 | 140.1 Ų | 140.1 | 60% | 0.598 | 79% | 0.786 | S | S | * | * | cis | 166.9 | 158.6 | 8 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 18 | T | 46.1 | Very low | 46.1 | Very low | 141 Ų | 141 | 136 Ų | 136 | 87% | 0.865 | 79% | 0.788 | S | S | * | * | trans | 58.7 | 122.3 | 148.8 | 63.4 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 19 | S | 40.1 | Very low | 45.1 | Very low | 121 Ų | 121 | 132.1 Ų | 132.1 | 85% | 0.846 | 78% | 0.782 | S | S | * | * | 133.4 | 124.2 | 121.5 | -80.4 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 20 | G | 39.8 | Very low | 44.7 | Very low | 68 Ų | 68 | 131.8 Ų | 131.8 | 70% | 0.701 | 78% | 0.782 | S | S | * | * | trans | -76.3 | 166 | 179 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 21 | N | 50.1 | Low | 45.2 | Very low | 162 Ų | 162 | 129.6 Ų | 129.6 | 87% | 0.866 | 78% | 0.784 | S | S | * | * | trans | 36.6 | 120.7 | 157.2 | -68.3 | -23.8 | 0 | 0 | 0 | 117.7 | ||||
| 22 | Q | 35.2 | Very low | 44.8 | Very low | 185 Ų | 185 | 128.1 Ų | 128.1 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | -167.5 | 128.2 | 114.9 | -74.1 | -135.8 | 102.3 | 0 | 0 | 111.9 | |||||
| 23 | V | 38.9 | Very low | 44.8 | Very low | 139 Ų | 139 | 127.2 Ų | 127.2 | 84% | 0.842 | 79% | 0.785 | S | S | * | * | trans | 55.3 | 122 | 135.9 | 84.4 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 24 | G | 36.8 | Very low | 44.7 | Very low | 65 Ų | 65 | 127.3 Ų | 127.3 | 67% | 0.67 | 79% | 0.79 | S | S | * | * | trans | 169.6 | 74.5 | 165.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | I26 | G24-I26 PolarHBondContact O-N 3.14Š| ||
| 25 | N | 50.1 | Low | 45 | Very low | 163 Ų | 163 | 122.6 Ų | 122.6 | 87% | 0.872 | 78% | 0.781 | S | S | * | * | trans | -49 | 121.9 | 165.8 | -79.9 | 18.9 | 0 | 0 | 0 | 110.9 | ||||
| 26 | I | 44.8 | Very low | 45.3 | Very low | 168 Ų | 168 | 121.1 Ų | 121.1 | 86% | 0.862 | 78% | 0.78 | S | S | * | * | trans | -111.9 | 109.7 | 160 | 27.9 | 166.9 | 0 | 0 | 0 | 108.5 | G24 | G24-I26 PolarHBondContact O-N 3.14Š| ||
| 27 | P | 47.4 | Very low | 45.1 | Very low | 110 Ų | 110 | 123.1 Ų | 123.1 | 71% | 0.714 | 78% | 0.784 | S | S | * | * | trans | -75.5 | 140.5 | 174 | 29 | -30.8 | 0 | 0 | 0 | 111.1 | P29 | P27-P29 WeakPolarHBondContact O-CD 3.27Š| ||
| 28 | S | 47.4 | Very low | 45.8 | Very low | 123 Ų | 123 | 129.5 Ų | 129.5 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | trans | -61.3 | 140 | 156.6 | -69.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 29 | P | 47.3 | Very low | 46.1 | Very low | 107 Ų | 107 | 126.8 Ų | 126.8 | 70% | 0.695 | 79% | 0.786 | S | S | * | * | trans | -138 | 134.1 | 137.1 | 25.1 | -5.7 | 0 | 0 | 0 | 113.9 | P27 | P27-P29 WeakPolarHBondContact O-CD 3.27Š| ||
| 30 | S | 41.1 | Very low | 46 | Very low | 106 Ų | 106 | 131.3 Ų | 131.3 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | 76.8 | 112.8 | 142.4 | -50.8 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 31 | A | 55 | Low | 46.6 | Very low | 104 Ų | 104 | 138.9 Ų | 138.9 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | 49.2 | 87.9 | 65.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 32 | A | 46.4 | Very low | 46.5 | Very low | 83 Ų | 83 | 136.7 Ų | 136.7 | 69% | 0.686 | 79% | 0.787 | S | S | * | * | trans | -157.6 | 123.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 33 | N | 49.3 | Very low | 47.5 | Very low | 149 Ų | 149 | 135.4 Ų | 135.4 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | cis | -155.8 | 131.9 | 1.3 | -88.6 | -59.3 | 0 | 0 | 0 | 106.7 | ||||
| 34 | L | 49.4 | Very low | 48.3 | Very low | 184 Ų | 184 | 134.9 Ų | 134.9 | 96% | 0.963 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -87 | -3.3 | 173.6 | 178.6 | 59.9 | 0 | 0 | 0 | 113.4 | ||
| 35 | A | 49.5 | Very low | 48.9 | Very low | 74 Ų | 74 | 139.1 Ų | 139.1 | 61% | 0.612 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -145.2 | 142.9 | -175.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 36 | T | 53.2 | Low | 49.1 | Very low | 130 Ų | 130 | 138.5 Ų | 138.5 | 80% | 0.798 | 79% | 0.787 | S | S | * | * | trans | 99.8 | 44.1 | 164.9 | -44.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 37 | L | 42.3 | Very low | 49.9 | Very low | 145 Ų | 145 | 136.4 Ų | 136.4 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | trans | -136.5 | 62.9 | 141.4 | -126.5 | -121 | 0 | 0 | 0 | 112.5 | S39 | L37-S39 WeakPolarHBondContact CD1-O 3.42Å; L37-S39 PolarHBondContact O-N 3.07Å | ||
| 38 | Q | 52.1 | Low | 50.5 | Low | 193 Ų | 193 | 141.5 Ų | 141.5 | 90% | 0.902 | 79% | 0.788 | S | S | * | * | trans | -69.9 | 29.6 | 161.8 | -124.2 | -115.9 | -62.8 | 0 | 0 | 112.4 | ||||
| 39 | S | 53.1 | Low | 50.8 | Low | 84 Ų | 84 | 139.7 Ų | 139.7 | 59% | 0.587 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -161.9 | 82.3 | 179 | -87.2 | 0 | 0 | 0 | 0 | 111 | L37 | L37-S39 WeakPolarHBondContact CD1-O 3.42Å; L37-S39 PolarHBondContact O-N 3.07Å |
| 40 | Y | 36.3 | Very low | 51.7 | Low | 216 Ų | 216 | 139.7 Ų | 139.7 | 85% | 0.847 | 78% | 0.78 | S | S | * | * | trans | 175.3 | 94.4 | 134.8 | -114.5 | -97.9 | 0 | 0 | 0 | 107.4 | P42 | Y40-P42 VanDerWaalsContact O-CD 3.27Å; Y40-P42 WeakPolarHBondContact O-CD 3.42Å | ||
| 41 | R | 53 | Low | 52.7 | Low | 226 Ų | 226 | 140.4 Ų | 140.4 | 85% | 0.853 | 78% | 0.782 | S | S | * | * | trans | -89.7 | 112.3 | 167.4 | -85.8 | -167.4 | 126.6 | 144.2 | -0.9 | 109.1 | L43 | R41-L43 PolarHBondContact O-N 2.82Š| ||
| 42 | P | 47.3 | Very low | 52.9 | Low | 116 Ų | 116 | 141.1 Ų | 141.1 | 75% | 0.753 | 78% | 0.781 | S | S | * | * | trans | -74.6 | 116.2 | 153.1 | 21.7 | -16.9 | 0 | 0 | 0 | 108.9 | Y40 V44 | Y40-P42 VanDerWaalsContact O-CD 3.27Å; Y40-P42 WeakPolarHBondContact O-CD 3.42Å; P42-V44 VanDerWaalsContact C-N 3.32Å; P42-V44 PolarHBondContact O-N 3Å; P42-V44 VanDerWaalsContact O-N 3.14Å | ||
| 43 | L | 57 | Low | 53.2 | Low | 158 Ų | 158 | 144 Ų | 144 | 83% | 0.827 | 78% | 0.784 | S | S | * | * | trans | -81.8 | 39.3 | -167.1 | -165.8 | 124.3 | 0 | 0 | 0 | 114.3 | R41 | R41-L43 PolarHBondContact O-N 2.82Š| ||
| 44 | V | 54.9 | Low | 53.2 | Low | 128 Ų | 128 | 140 Ų | 140 | 78% | 0.776 | 78% | 0.778 | S | S | * | * | trans | -148 | 55.1 | -171.5 | -65.7 | 0 | 0 | 0 | 0 | 115.2 | P42 | P42-V44 VanDerWaalsContact C-N 3.32Å; P42-V44 PolarHBondContact O-N 3Å; P42-V44 VanDerWaalsContact O-N 3.14Å | ||
| 45 | N | 50.3 | Low | 52.9 | Low | 155 Ų | 155 | 139.9 Ų | 139.9 | 83% | 0.829 | 77% | 0.771 | S | S | * | * | trans | -152.6 | 42.1 | 159.1 | -148.7 | 49.4 | 0 | 0 | 0 | 115.4 | ||||
| 46 | D | 54.6 | Low | 52.8 | Low | 150 Ų | 150 | 142.7 Ų | 142.7 | 80% | 0.802 | 78% | 0.78 | S | S | * | * | trans | -104.8 | 45.1 | 175.2 | -104.2 | -68.4 | 0 | 0 | 0 | 111.7 | ||||
| 47 | V | 61.4 | Low | 52.8 | Low | 123 Ų | 123 | 145.6 Ų | 145.6 | 75% | 0.745 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -127.7 | -7 | -179.2 | -178.7 | 0 | 0 | 0 | 0 | 114.7 | ||
| 48 | Y | 58.7 | Low | 52.6 | Low | 218 Ų | 218 | 142.1 Ų | 142.1 | 86% | 0.855 | 78% | 0.784 | S | S | * | * | trans | -133 | 52.2 | 174 | -84.2 | -87.9 | 0 | 0 | 0 | 112.3 | P50 | Y48-P50 WeakPolarHBondContact O-CD 3.49Š| ||
| 49 | A | 55.2 | Low | 53 | Low | 84 Ų | 84 | 138 Ų | 138 | 69% | 0.694 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 120.8 | 159.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||
| 50 | P | 65.1 | Low | 52.5 | Low | 107 Ų | 107 | 138.8 Ų | 138.8 | 70% | 0.695 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 134.1 | 172.3 | 26 | -31.6 | 0 | 0 | 0 | 108.9 | Y48 S52 | Y48-P50 WeakPolarHBondContact O-CD 3.49Å; P50-S52 PolarHBondContact O-N 3.13Å; P50-S52 VanDerWaalsContact O-N 3.07Å |
| 51 | P | 62.5 | Low | 53 | Low | 122 Ų | 122 | 133.7 Ų | 133.7 | 79% | 0.792 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 118.6 | 175.8 | 27.3 | -31.5 | 0 | 0 | 0 | 107.7 | L53 | P51-L53 PolarHBondContact O-N 3.18Å; P51-L53 VanDerWaalsContact O-N 3.13Å |
| 52 | S | 59.6 | Low | 52.6 | Low | 119 Ų | 119 | 129.1 Ų | 129.1 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | trans | -64.3 | 112.6 | 170.6 | -66.4 | 0 | 0 | 0 | 0 | 107.9 | P50 G54 | P50-S52 PolarHBondContact O-N 3.13Å; P50-S52 VanDerWaalsContact O-N 3.07Å; S52-G54 PolarHBondContact O-N 3.04Å | ||
| 53 | L | 53.4 | Low | 52.4 | Low | 142 Ų | 142 | 129.4 Ų | 129.4 | 74% | 0.743 | 77% | 0.772 | S | S | * | * | trans | -65.1 | 82.3 | 172.2 | -89.1 | 155.6 | 0 | 0 | 0 | 109.5 | P51 F55 | P51-L53 PolarHBondContact O-N 3.18Å; P51-L53 VanDerWaalsContact O-N 3.13Å; L53-F55 HydrophobicContact CB-CD2 4.2Å; L53-F55 HydrophobicContact CB-CE2 3.97Å; L53-F55 HydrophobicContact CD1-CE2 4.41Å; L53-F55 HydrophobicContact CD2-CD2 4.45Å; L53-F55 HydrophobicContact CD2-CE2 3.8Å; L53-F55 HydrophobicContact CD2-CZ 3.91Å; L53-F55 HydrophobicContact CG-CE2 4.28Å; L53-F55 PolarHBondContact O-N 2.97Å | ||
| 54 | G | 47.5 | Very low | 52 | Low | 66 Ų | 66 | 127.6 Ų | 127.6 | 68% | 0.68 | 77% | 0.767 | S | S | * | * | trans | -73 | 93.3 | 161.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | S52 T56 | S52-G54 PolarHBondContact O-N 3.04Å; G54-T56 VanDerWaalsContact C-N 3.35Å; G54-T56 PolarHBondContact O-N 3.48Å | ||
| 55 | F | 44.3 | Very low | 52.1 | Low | 182 Ų | 182 | 123.6 Ų | 123.6 | 80% | 0.798 | 74% | 0.744 | S | S | * | * | trans | -71.7 | 92.2 | 168.9 | -79.6 | -85 | 0 | 0 | 0 | 109.4 | L53 | L53-F55 HydrophobicContact CB-CD2 4.2Å; L53-F55 HydrophobicContact CB-CE2 3.97Å; L53-F55 HydrophobicContact CD1-CE2 4.41Å; L53-F55 HydrophobicContact CD2-CD2 4.45Å; L53-F55 HydrophobicContact CD2-CE2 3.8Å; L53-F55 HydrophobicContact CD2-CZ 3.91Å; L53-F55 HydrophobicContact CG-CE2 4.28Å; L53-F55 PolarHBondContact O-N 2.97Å | ||
| 56 | T | 47.3 | Very low | 52.5 | Low | 133 Ų | 133 | 121.3 Ų | 121.3 | 82% | 0.816 | 73% | 0.728 | S | S | * | * | trans | -80.3 | 115.3 | 157 | 49 | 0 | 0 | 0 | 0 | 108.6 | G54 G58 | G54-T56 VanDerWaalsContact C-N 3.35Å; G54-T56 PolarHBondContact O-N 3.48Å; T56-G58 PolarHBondContact O-N 3.48Å | ||
| 57 | Q | 53 | Low | 53.7 | Low | 191 Ų | 191 | 118.7 Ų | 118.7 | 89% | 0.893 | 72% | 0.722 | S | S | * | * | trans | -63.6 | 97.5 | 170 | -179.7 | 173.4 | -9.7 | 0 | 0 | 109.6 | ||||
| 58 | G | 38.2 | Very low | 54.9 | Low | 72 Ų | 72 | 115.4 Ų | 115.4 | 74% | 0.742 | 70% | 0.697 | S | S | * | * | trans | -113.8 | 99.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110 | T56 | T56-G58 PolarHBondContact O-N 3.48Š| ||
| 59 | S | 61 | Low | 56.3 | Low | 106 Ų | 106 | 112.1 Ų | 112.1 | 74% | 0.741 | 68% | 0.684 | S | S | * | * | trans | -63.5 | 131.8 | 164.7 | -48.7 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 60 | S | 41.9 | Very low | 58.1 | Low | 100 Ų | 100 | 111 Ų | 111 | 70% | 0.699 | 67% | 0.671 | S | S | * | * | trans | 169.6 | 109.4 | 141.6 | -74.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 61 | S | 47.6 | Very low | 59.5 | Low | 109 Ų | 109 | 110.2 Ų | 110.2 | 76% | 0.762 | 66% | 0.658 | S | S | * | * | S | Bend | trans | 43 | 127.1 | 133.9 | 53.7 | 0 | 0 | 0 | 0 | 120.8 | ||
| 62 | S | 44.3 | Very low | 61 | Low | 131 Ų | 131 | 106.1 Ų | 106.1 | 92% | 0.916 | 63% | 0.629 | S | S | * | * | trans | 84.5 | 36.9 | -177.7 | -63.5 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 63 | Q | 42.2 | Very low | 62.8 | Low | 122 Ų | 122 | 103.8 Ų | 103.8 | 57% | 0.57 | 61% | 0.607 | S | S | * | * | trans | -93.3 | 120 | 167.7 | -56.4 | -132.3 | -52.8 | 0 | 0 | 108.1 | P65 Q66 | Q63-P65 VanDerWaalsContact O-N 3.12Å; Q63-Q66 VanDerWaalsContact CD-OE1 3.29Å; Q63-Q66 VanDerWaalsContact NE2-OE1 3.1Å | ||
| 64 | V | 49.8 | Very low | 64.8 | Low | 120 Ų | 120 | 99.3 Ų | 99.3 | 73% | 0.727 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -40.8 | 123.6 | 148.6 | -145.5 | 0 | 0 | 0 | 0 | 104.9 | Q66 | V64-Q66 VanDerWaalsContact C-N 3.29Å; V64-Q66 WeakPolarHBondContact O-CA 3.35Å; V64-Q66 PolarHBondContact O-N 3.1Å |
| 65 | P | 55.8 | Low | 67.1 | Low | 44 Ų | 44 | 97 Ų | 97 | 29% | 0.286 | 56% | 0.563 | S | S | . | * | trans | -55 | 97.5 | -160.3 | 1.8 | -10.8 | 0 | 0 | 0 | 109.5 | Q63 S67 K68 Y69 E114 | Q63-P65 VanDerWaalsContact O-N 3.12Å; P65-S67 PolarHBondContact O-N 3.17Å; P65-K68 HydrophobicContact CB-CB 4.31Å; P65-K68 HydrophobicContact CB-CG 3.97Å; P65-K68 HydrophobicContact CG-CG 4.2Å; P65-K68 PolarHBondContact O-N 3.17Å; P65-Y69 PolarHBondContact O-N 3.24Å; P65-E114 WeakPolarHBondContact CG-OE1 3.42Å | ||
| 66 | Q | 59.6 | Low | 69.6 | Low | 107 Ų | 107 | 92.9 Ų | 92.9 | 50% | 0.5 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65 | -25.7 | -167.3 | -167.5 | 165.9 | -45.6 | 0 | 0 | 108.4 | Q63 V64 S70 | Q63-Q66 VanDerWaalsContact CD-OE1 3.29Å; Q63-Q66 VanDerWaalsContact NE2-OE1 3.1Å; V64-Q66 VanDerWaalsContact C-N 3.29Å; V64-Q66 WeakPolarHBondContact O-CA 3.35Å; V64-Q66 PolarHBondContact O-N 3.1Å; Q66-S70 WeakPolarHBondContact O-CB 3.47Å; Q66-S70 PolarHBondContact O-N 3.08Å; Q66-S70 PolarHBondContact O-OG 2.93Å |
| 67 | S | 78.9 | Confident | 72 | Confident | 95 Ų | 95 | 92.7 Ų | 92.7 | 66% | 0.664 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -56.1 | -45.6 | 167.2 | -44 | 0 | 0 | 0 | 0 | 114 | P65 S70 E71 | P65-S67 PolarHBondContact O-N 3.17Å; S67-S70 PolarHBondContact O-N 3.14Å; S67-E71 WeakPolarHBondContact O-CB 3.43Å; S67-E71 PolarHBondContact O-N 3.42Å |
| 68 | K | 86.9 | Confident | 74 | Confident | 53 Ų | 53 | 88.5 Ų | 88.5 | 23% | 0.23 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -67.2 | -44.2 | -179.9 | -70.5 | -76.8 | -177.6 | -179.1 | 0 | 110.8 | P65 E71 L72 L107 E110 | P65-K68 HydrophobicContact CB-CB 4.31Å; P65-K68 HydrophobicContact CB-CG 3.97Å; P65-K68 HydrophobicContact CG-CG 4.2Å; P65-K68 PolarHBondContact O-N 3.17Å; K68-E71 PolarHBondContact O-N 3.29Å; K68-L72 PolarHBondContact O-N 2.61Å; K68-L107 HydrophobicContact CB-CD2 4.27Å; K68-L107 HydrophobicContact CD-CD1 4.28Å; K68-L107 HydrophobicContact CD-CD2 4.45Å; K68-L107 HydrophobicContact CD-CG 4.01Å; K68-L107 WeakPolarHBondContact O-CD2 3.48Å; K68-E110 IonicContact NZ-OE2 2.73Å; K68-E110 PolarHBondContact NZ-OE2 3.27Å |
| 69 | Y | 89.1 | Confident | 76.9 | Confident | 150 Ų | 150 | 86.5 Ų | 86.5 | 59% | 0.588 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -65.7 | -43.3 | 176 | -176.9 | -104.1 | 0 | 0 | 0 | 112.1 | P65 E71 L72 L73 | P65-Y69 PolarHBondContact O-N 3.24Å; Y69-E71 VanDerWaalsContact C-N 3.34Å; Y69-E71 PolarHBondContact O-N 3.46Å; Y69-L72 WeakPolarHBondContact O-CB 3.45Å; Y69-L72 PolarHBondContact O-N 3Å; Y69-L73 HydrophobicContact CD1-CD1 3.94Å; Y69-L73 HydrophobicContact CD1-CG 4.37Å; Y69-L73 HydrophobicContact CE1-CD1 3.49Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.49Å; Y69-L73 HydrophobicContact CE1-CD2 4.44Å; Y69-L73 HydrophobicContact CE1-CG 4.03Å; Y69-L73 WeakPolarHBondContact O-CG 3.49Å; Y69-L73 PolarHBondContact O-N 2.76Å |
| 70 | S | 91.8 | Very high | 78.6 | Confident | 59 Ų | 59 | 83.7 Ų | 83.7 | 41% | 0.413 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63 | -40 | 176.8 | -56.8 | 0 | 0 | 0 | 0 | 112 | Q66 S67 L73 A74 | Q66-S70 WeakPolarHBondContact O-CB 3.47Å; Q66-S70 PolarHBondContact O-N 3.08Å; Q66-S70 PolarHBondContact O-OG 2.93Å; S67-S70 PolarHBondContact O-N 3.14Å; S70-L73 PolarHBondContact O-N 2.96Å; S70-A74 PolarHBondContact O-N 3.27Å |
| 71 | E | 93.9 | Very high | 81.3 | Confident | 92 Ų | 92 | 85.2 Ų | 85.2 | 43% | 0.43 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -65.9 | -39.2 | 175.5 | -176 | 156.8 | 90.2 | 0 | 0 | 111.7 | S67 K68 Y69 L73 A74 I75 L107 | S67-E71 WeakPolarHBondContact O-CB 3.43Å; S67-E71 PolarHBondContact O-N 3.42Å; K68-E71 PolarHBondContact O-N 3.29Å; Y69-E71 VanDerWaalsContact C-N 3.34Å; Y69-E71 PolarHBondContact O-N 3.46Å; E71-L73 PolarHBondContact O-N 3.5Å; E71-A74 PolarHBondContact O-N 3.03Å; E71-I75 HydrophobicContact CG-CD1 4.27Å; E71-I75 VanDerWaalsContact O-CG1 3.27Å; E71-I75 WeakPolarHBondContact O-CG1 3.48Å; E71-I75 PolarHBondContact O-N 3.46Å; E71-L107 HydrophobicContact CB-CD1 3.94Å; E71-L107 HydrophobicContact CG-CD1 3.71Å; E71-L107 WeakPolarHBondContact OE1-CD1 3.28Å |
| 72 | L | 95.6 | Very high | 83.7 | Confident | 35 Ų | 35 | 81.4 Ų | 81.4 | 18% | 0.183 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -61.9 | -43.7 | 174.1 | -171.7 | 59.4 | 0 | 0 | 0 | 112.1 | K68 Y69 I75 I76 A104 L107 V108 | K68-L72 PolarHBondContact O-N 2.61Å; Y69-L72 WeakPolarHBondContact O-CB 3.45Å; Y69-L72 PolarHBondContact O-N 3Å; L72-I75 PolarHBondContact O-N 3.13Å; L72-I76 HydrophobicContact CG-CD1 4.11Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.19Å; L72-I76 PolarHBondContact O-N 2.85Å; L72-A104 HydrophobicContact CD1-CB 3.75Å; L72-L107 HydrophobicContact CB-CD2 3.97Å; L72-L107 HydrophobicContact CD1-CD2 4.39Å; L72-V108 HydrophobicContact CD1-CG2 4.27Å; L72-V108 HydrophobicContact CD2-CG2 4Å |
| 73 | L | 95.7 | Very high | 86.2 | Confident | 71 Ų | 71 | 79 Ų | 79 | 37% | 0.372 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -59.6 | -46.7 | 175.6 | -70.6 | 178.1 | 0 | 0 | 0 | 111.2 | Y69 S70 E71 I75 I76 E77 | Y69-L73 HydrophobicContact CD1-CD1 3.94Å; Y69-L73 HydrophobicContact CD1-CG 4.37Å; Y69-L73 HydrophobicContact CE1-CD1 3.49Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.49Å; Y69-L73 HydrophobicContact CE1-CD2 4.44Å; Y69-L73 HydrophobicContact CE1-CG 4.03Å; Y69-L73 WeakPolarHBondContact O-CG 3.49Å; Y69-L73 PolarHBondContact O-N 2.76Å; S70-L73 PolarHBondContact O-N 2.96Å; E71-L73 PolarHBondContact O-N 3.5Å; L73-I75 VanDerWaalsContact C-N 3.31Å; L73-I75 PolarHBondContact O-N 3.33Å; L73-I76 WeakPolarHBondContact O-CB 3.22Å; L73-I76 PolarHBondContact O-N 2.65Å; L73-I76 VanDerWaalsContact O-N 3.1Å; L73-E77 WeakPolarHBondContact O-CG 3.01Å; L73-E77 PolarHBondContact O-N 3.42Å |
| 74 | A | 96 | Very high | 88.9 | Confident | 48 Ų | 48 | 83.4 Ų | 83.4 | 40% | 0.397 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -59.6 | -41 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | S70 E71 E77 E78 | S70-A74 PolarHBondContact O-N 3.27Å; E71-A74 PolarHBondContact O-N 3.03Å; A74-E77 PolarHBondContact O-N 2.98Å; A74-E78 PolarHBondContact O-N 3.34Å |
| 75 | I | 96.5 | Very high | 91.1 | Very high | 18 Ų | 18 | 79.9 Ų | 79.9 | 9% | 0.092 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 175.5 | -64.8 | 161.2 | 0 | 0 | 0 | 110.7 | E71 L72 L73 E78 L79 G100 H103 A104 L107 | E71-I75 HydrophobicContact CG-CD1 4.27Å; E71-I75 VanDerWaalsContact O-CG1 3.27Å; E71-I75 WeakPolarHBondContact O-CG1 3.48Å; E71-I75 PolarHBondContact O-N 3.46Å; L72-I75 PolarHBondContact O-N 3.13Å; L73-I75 VanDerWaalsContact C-N 3.31Å; L73-I75 PolarHBondContact O-N 3.33Å; I75-E78 PolarHBondContact O-N 3.35Å; I75-L79 HydrophobicContact CG2-CD1 3.94Å; I75-L79 HydrophobicContact CG2-CG 4.23Å; I75-L79 WeakPolarHBondContact O-CB 3.32Å; I75-L79 VanDerWaalsContact O-CG 3.23Å; I75-L79 WeakPolarHBondContact O-CG 3.4Å; I75-L79 PolarHBondContact O-N 2.94Å; I75-G100 WeakPolarHBondContact CG2-O 3.48Å; I75-H103 HydrophobicContact CD1-CB 4.45Å; I75-H103 WeakPolarHBondContact CD1-ND1 3.25Å; I75-A104 HydrophobicContact CG2-CB 4.01Å; I75-L107 HydrophobicContact CD1-CD1 4.41Å |
| 76 | I | 96.6 | Very high | 93.2 | Very high | 95 Ų | 95 | 79 Ų | 79 | 49% | 0.487 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.1 | -43.7 | 179.1 | -67.7 | 163.6 | 0 | 0 | 0 | 110.9 | L72 L73 L79 G80 | L72-I76 HydrophobicContact CG-CD1 4.11Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.19Å; L72-I76 PolarHBondContact O-N 2.85Å; L73-I76 WeakPolarHBondContact O-CB 3.22Å; L73-I76 PolarHBondContact O-N 2.65Å; L73-I76 VanDerWaalsContact O-N 3.1Å; I76-L79 PolarHBondContact O-N 3.46Å; I76-G80 PolarHBondContact O-N 2.86Å |
| 77 | E | 96.8 | Very high | 95 | Very high | 128 Ų | 128 | 83.4 Ų | 83.4 | 60% | 0.598 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -61.2 | -44.2 | 177 | -71.2 | -176.3 | 86.9 | 0 | 0 | 112.1 | L73 A74 G80 K81 | L73-E77 WeakPolarHBondContact O-CG 3.01Å; L73-E77 PolarHBondContact O-N 3.42Å; A74-E77 PolarHBondContact O-N 2.98Å; E77-G80 PolarHBondContact O-N 2.8Å; E77-K81 PolarHBondContact O-N 3.06Å |
| 78 | E | 96.5 | Very high | 95.9 | Very high | 103 Ų | 103 | 83.1 Ų | 83.1 | 48% | 0.481 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.8 | -44.1 | 175.8 | -80.7 | -74.3 | 98.3 | 0 | 0 | 112.2 | A74 I75 G80 K81 E82 | A74-E78 PolarHBondContact O-N 3.34Å; I75-E78 PolarHBondContact O-N 3.35Å; E78-G80 VanDerWaalsContact C-N 3.27Å; E78-G80 PolarHBondContact O-N 3.35Å; E78-K81 PolarHBondContact O-N 3.1Å; E78-K81 IonicContact OE1-NZ 2.84Å; E78-K81 PolarHBondContact OE1-NZ 3.36Å; E78-E82 PolarHBondContact O-N 3.4Å |
| 79 | L | 97.8 | Very high | 96.4 | Very high | 31 Ų | 31 | 83.4 Ų | 83.4 | 16% | 0.162 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -59 | -40.5 | 176.1 | -73.8 | 175.5 | 0 | 0 | 0 | 111.4 | I75 I76 K81 E82 I83 I97 I101 | I75-L79 HydrophobicContact CG2-CD1 3.94Å; I75-L79 HydrophobicContact CG2-CG 4.23Å; I75-L79 WeakPolarHBondContact O-CB 3.32Å; I75-L79 VanDerWaalsContact O-CG 3.23Å; I75-L79 WeakPolarHBondContact O-CG 3.4Å; I75-L79 PolarHBondContact O-N 2.94Å; I76-L79 PolarHBondContact O-N 3.46Å; L79-K81 VanDerWaalsContact C-N 3.31Å; L79-K81 PolarHBondContact O-N 3.03Å; L79-E82 PolarHBondContact O-N 2.99Å; L79-I83 WeakPolarHBondContact O-CG1 3.41Å; L79-I83 PolarHBondContact O-N 3.49Å; L79-I97 HydrophobicContact CD2-CB 4.45Å; L79-I97 HydrophobicContact CD2-CD1 3.99Å; L79-I97 WeakPolarHBondContact CD2-O 3.45Å; L79-I97 WeakPolarHBondContact O-CD1 3.42Å; L79-I101 HydrophobicContact CD1-CG1 4.22Å; L79-I101 HydrophobicContact CD2-CG1 4.39Å |
| 80 | G | 97.5 | Very high | 96.8 | Very high | 47 Ų | 47 | 78.6 Ų | 78.6 | 49% | 0.485 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -59.8 | -37.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | I76 E77 E78 | I76-G80 PolarHBondContact O-N 2.86Å; E77-G80 PolarHBondContact O-N 2.8Å; E78-G80 VanDerWaalsContact C-N 3.27Å; E78-G80 PolarHBondContact O-N 3.35Å |
| 81 | K | 97.6 | Very high | 97.1 | Very high | 131 Ų | 131 | 84.3 Ų | 84.3 | 57% | 0.57 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -68.9 | -35.7 | 178 | -63.2 | 172.8 | -161.3 | 161.4 | 0 | 112.2 | E77 E78 L79 I83 P85 | E77-K81 PolarHBondContact O-N 3.06Å; E78-K81 PolarHBondContact O-N 3.1Å; E78-K81 IonicContact OE1-NZ 2.84Å; E78-K81 PolarHBondContact OE1-NZ 3.36Å; L79-K81 VanDerWaalsContact C-N 3.31Å; L79-K81 PolarHBondContact O-N 3.03Å; K81-I83 VanDerWaalsContact C-N 3.33Å; K81-I83 PolarHBondContact O-N 3.36Å; K81-P85 VanDerWaalsContact O-CD 3.22Å; K81-P85 WeakPolarHBondContact O-CD 3.47Å |
| 82 | E | 97.9 | Very high | 97.2 | Very high | 29 Ų | 29 | 83.3 Ų | 83.3 | 14% | 0.136 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -80.3 | -11.1 | -175.6 | -65.2 | -67.7 | 78.5 | 0 | 0 | 113.8 | E78 L79 P85 T86 A93 R96 I97 | E78-E82 PolarHBondContact O-N 3.4Å; L79-E82 PolarHBondContact O-N 2.99Å; E82-P85 WeakPolarHBondContact O-CD 3.34Å; E82-T86 VanDerWaalsContact O-CB 3.29Å; E82-T86 WeakPolarHBondContact O-CB 3.49Å; E82-T86 PolarHBondContact O-N 3.45Å; E82-T86 PolarHBondContact O-OG1 2.95Å; E82-A93 HydrophobicContact CB-CB 4.38Å; E82-A93 VanDerWaalsContact OE2-CA 3.27Å; E82-A93 WeakPolarHBondContact OE2-CA 3.42Å; E82-R96 HydrophobicContact CG-CB 4.06Å; E82-R96 WeakPolarHBondContact OE2-CD 3.5Å; E82-R96 WeakPolarHBondContact OE2-CG 3.29Å; E82-R96 IonicContact OE2-CZ 3.74Å; E82-R96 IonicContact OE2-NE 3.95Å; E82-R96 IonicContact OE2-NH1 2.82Å; E82-R96 PolarHBondContact OE2-NH1 3.29Å; E82-I97 HydrophobicContact CB-CD1 3.76Å; E82-I97 HydrophobicContact CB-CG1 3.85Å |
| 83 | I | 97.8 | Very high | 97.3 | Very high | 80 Ų | 80 | 81.7 Ų | 81.7 | 41% | 0.41 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -58.6 | -53.4 | 179.7 | -68.2 | -87.3 | 0 | 0 | 0 | 111.8 | L79 K81 T86 Y87 I97 | L79-I83 WeakPolarHBondContact O-CG1 3.41Å; L79-I83 PolarHBondContact O-N 3.49Å; K81-I83 VanDerWaalsContact C-N 3.33Å; K81-I83 PolarHBondContact O-N 3.36Å; I83-T86 WeakPolarHBondContact O-CB 3.5Å; I83-T86 PolarHBondContact O-N 3.31Å; I83-Y87 HydrophobicContact CG2-CD2 3.85Å; I83-Y87 HydrophobicContact CG2-CE2 3.6Å; I83-Y87 WeakPolarHBondContact O-CD2 3.46Å; I83-Y87 PolarHBondContact O-N 2.99Å; I83-Y87 VanDerWaalsContact O-N 3.14Å; I83-I97 HydrophobicContact CD1-CD1 4.33Å; I83-I97 HydrophobicContact CG1-CD1 4.35Å |
| 84 | R | 97.9 | Very high | 97.4 | Very high | 216 Ų | 216 | 82.3 Ų | 82.3 | 82% | 0.815 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -63.3 | -48.9 | -177.1 | -71.7 | 179.3 | 178.5 | -87.6 | 0.7 | 112.3 | T86 Y87 A88 | R84-T86 PolarHBondContact O-N 3.31Å; R84-Y87 PolarHBondContact O-N 3.5Å; R84-A88 PolarHBondContact O-N 3.4Å; R84-A88 VanDerWaalsContact O-N 3.16Å |
| 85 | P | 97.6 | Very high | 97.5 | Very high | 46 Ų | 46 | 84.9 Ų | 84.9 | 30% | 0.299 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -58.7 | -32.8 | 174.3 | -25.6 | 33.6 | 0 | 0 | 0 | 114 | K81 E82 A88 G89 S90 A93 | K81-P85 VanDerWaalsContact O-CD 3.22Å; K81-P85 WeakPolarHBondContact O-CD 3.47Å; E82-P85 WeakPolarHBondContact O-CD 3.34Å; P85-A88 PolarHBondContact O-N 3.28Å; P85-G89 PolarHBondContact O-N 3.07Å; P85-S90 WeakPolarHBondContact O-CB 3.27Å; P85-S90 PolarHBondContact O-N 2.98Å; P85-A93 HydrophobicContact CB-CB 3.76Å |
| 86 | T | 98.3 | Very high | 97.6 | Very high | 25 Ų | 25 | 90.7 Ų | 90.7 | 15% | 0.153 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -66.3 | -44.3 | 177.5 | -62.7 | 0 | 0 | 0 | 0 | 111.6 | E82 I83 R84 A88 G89 M94 | E82-T86 VanDerWaalsContact O-CB 3.29Å; E82-T86 WeakPolarHBondContact O-CB 3.49Å; E82-T86 PolarHBondContact O-N 3.45Å; E82-T86 PolarHBondContact O-OG1 2.95Å; I83-T86 WeakPolarHBondContact O-CB 3.5Å; I83-T86 PolarHBondContact O-N 3.31Å; R84-T86 PolarHBondContact O-N 3.31Å; T86-A88 PolarHBondContact O-N 3.25Å; T86-G89 PolarHBondContact O-N 3.38Å; T86-M94 HydrophobicContact CG2-CB 4.17Å; T86-M94 HydrophobicContact CG2-CE 3.53Å |
| 87 | Y | 97.7 | Very high | 97.7 | Very high | 199 Ų | 199 | 87.5 Ų | 87.5 | 78% | 0.78 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -65.6 | -27.5 | 174.4 | -75.5 | -65.7 | 0 | 0 | 0 | 113 | I83 R84 G89 | I83-Y87 HydrophobicContact CG2-CD2 3.85Å; I83-Y87 HydrophobicContact CG2-CE2 3.6Å; I83-Y87 WeakPolarHBondContact O-CD2 3.46Å; I83-Y87 PolarHBondContact O-N 2.99Å; I83-Y87 VanDerWaalsContact O-N 3.14Å; R84-Y87 PolarHBondContact O-N 3.5Å; Y87-G89 PolarHBondContact O-N 3.48Å |
| 88 | A | 97.8 | Very high | 97.7 | Very high | 89 Ų | 89 | 87.3 Ų | 87.3 | 74% | 0.736 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | 1.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | R84 P85 T86 | R84-A88 PolarHBondContact O-N 3.4Å; R84-A88 VanDerWaalsContact O-N 3.16Å; P85-A88 PolarHBondContact O-N 3.28Å; T86-A88 PolarHBondContact O-N 3.25Å |
| 89 | G | 96.9 | Very high | 97.8 | Very high | 60 Ų | 60 | 90.6 Ų | 90.6 | 62% | 0.619 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 87.2 | 14.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115 | P85 T86 Y87 K91 | P85-G89 PolarHBondContact O-N 3.07Å; T86-G89 PolarHBondContact O-N 3.38Å; Y87-G89 PolarHBondContact O-N 3.48Å; G89-K91 PolarHBondContact O-N 3.08Å |
| 90 | S | 97.9 | Very high | 97.8 | Very high | 49 Ų | 49 | 89.8 Ų | 89.8 | 34% | 0.343 | 45% | 0.453 | S | S | . | . | trans | -69.2 | 113.6 | 177.5 | -178.1 | 0 | 0 | 0 | 0 | 111.7 | P85 A93 M94 | P85-S90 WeakPolarHBondContact O-CB 3.27Å; P85-S90 PolarHBondContact O-N 2.98Å; S90-A93 PolarHBondContact O-N 2.84Å; S90-A93 PolarHBondContact OG-N 3Å; S90-M94 PolarHBondContact O-N 2.87Å; S90-M94 VanDerWaalsContact O-N 3.08Å | ||
| 91 | K | 98.2 | Very high | 97.8 | Very high | 179 Ų | 179 | 92 Ų | 92 | 78% | 0.778 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -63.9 | -42.1 | 178.9 | -66.6 | -176.5 | -179.8 | 178 | 0 | 112.2 | G89 M94 E95 | G89-K91 PolarHBondContact O-N 3.08Å; K91-M94 WeakPolarHBondContact O-CB 3.34Å; K91-M94 PolarHBondContact O-N 3.32Å; K91-E95 PolarHBondContact O-N 3.19Å |
| 92 | S | 97.6 | Very high | 97.8 | Very high | 71 Ų | 71 | 91.1 Ų | 91.1 | 50% | 0.497 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65 | -42.5 | 179.4 | -55.6 | 0 | 0 | 0 | 0 | 111.7 | M94 E95 R96 | S92-M94 VanDerWaalsContact C-N 3.32Å; S92-M94 PolarHBondContact O-N 2.73Å; S92-E95 PolarHBondContact O-N 3.35Å; S92-R96 WeakPolarHBondContact O-CG 3.23Å; S92-R96 PolarHBondContact O-N 2.92Å |
| 93 | A | 97.6 | Very high | 97.7 | Very high | 1 Ų | 1 | 94.2 Ų | 94.2 | 1% | 0.008 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -63.7 | -40.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E82 P85 S90 E95 R96 I97 | E82-A93 HydrophobicContact CB-CB 4.38Å; E82-A93 VanDerWaalsContact OE2-CA 3.27Å; E82-A93 WeakPolarHBondContact OE2-CA 3.42Å; P85-A93 HydrophobicContact CB-CB 3.76Å; S90-A93 PolarHBondContact O-N 2.84Å; S90-A93 PolarHBondContact OG-N 3Å; A93-E95 VanDerWaalsContact C-N 3.31Å; A93-E95 PolarHBondContact O-N 3.24Å; A93-R96 WeakPolarHBondContact O-CB 3.39Å; A93-R96 PolarHBondContact O-N 3.35Å; A93-R96 VanDerWaalsContact O-N 3.12Å; A93-I97 WeakPolarHBondContact O-CG1 3.36Å; A93-I97 PolarHBondContact O-N 3.38Å |
| 94 | M | 97.8 | Very high | 97.7 | Very high | 84 Ų | 84 | 91.2 Ų | 91.2 | 41% | 0.414 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.6 | -40.6 | 173.5 | 177.1 | 157.3 | -71.2 | 0 | 0 | 112.5 | T86 S90 K91 S92 R96 I97 K98 | T86-M94 HydrophobicContact CG2-CB 4.17Å; T86-M94 HydrophobicContact CG2-CE 3.53Å; S90-M94 PolarHBondContact O-N 2.87Å; S90-M94 VanDerWaalsContact O-N 3.08Å; K91-M94 WeakPolarHBondContact O-CB 3.34Å; K91-M94 PolarHBondContact O-N 3.32Å; S92-M94 VanDerWaalsContact C-N 3.32Å; S92-M94 PolarHBondContact O-N 2.73Å; M94-R96 VanDerWaalsContact C-N 3.35Å; M94-I97 PolarHBondContact O-N 3Å; M94-K98 HydrophobicContact CG-CD 4.41Å; M94-K98 WeakPolarHBondContact O-CG 3.42Å; M94-K98 PolarHBondContact O-N 3.38Å |
| 95 | E | 98.1 | Very high | 97.7 | Very high | 101 Ų | 101 | 88.5 Ų | 88.5 | 47% | 0.472 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -65 | -39 | 174.6 | -75 | -163.7 | 79.6 | 0 | 0 | 112.3 | K91 S92 A93 K98 R99 | K91-E95 PolarHBondContact O-N 3.19Å; S92-E95 PolarHBondContact O-N 3.35Å; A93-E95 VanDerWaalsContact C-N 3.31Å; A93-E95 PolarHBondContact O-N 3.24Å; E95-K98 PolarHBondContact O-N 3.46Å; E95-R99 WeakPolarHBondContact O-CB 3.22Å; E95-R99 WeakPolarHBondContact O-CG 3.43Å; E95-R99 PolarHBondContact O-N 2.92Å; E95-R99 IonicContact OE1-NH2 3.88Å |
| 96 | R | 98 | Very high | 97.6 | Very high | 141 Ų | 141 | 87.9 Ų | 87.9 | 53% | 0.532 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 175 | -62.9 | -151 | -173 | 95.5 | -5.3 | 111.8 | E82 S92 A93 M94 K98 R99 G100 | E82-R96 HydrophobicContact CG-CB 4.06Å; E82-R96 WeakPolarHBondContact OE2-CD 3.5Å; E82-R96 WeakPolarHBondContact OE2-CG 3.29Å; E82-R96 IonicContact OE2-CZ 3.74Å; E82-R96 IonicContact OE2-NE 3.95Å; E82-R96 IonicContact OE2-NH1 2.82Å; E82-R96 PolarHBondContact OE2-NH1 3.29Å; S92-R96 WeakPolarHBondContact O-CG 3.23Å; S92-R96 PolarHBondContact O-N 2.92Å; A93-R96 WeakPolarHBondContact O-CB 3.39Å; A93-R96 PolarHBondContact O-N 3.35Å; A93-R96 VanDerWaalsContact O-N 3.12Å; M94-R96 VanDerWaalsContact C-N 3.35Å; R96-K98 PolarHBondContact O-N 3.03Å; R96-R99 PolarHBondContact O-N 3.39Å; R96-G100 PolarHBondContact O-N 3.06Å |
| 97 | I | 97.9 | Very high | 97.4 | Very high | 28 Ų | 28 | 87 Ų | 87 | 14% | 0.144 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -55.5 | -51.5 | 173.6 | -69.1 | -76.9 | 0 | 0 | 0 | 110.5 | L79 E82 I83 A93 M94 R99 G100 I101 | L79-I97 HydrophobicContact CD2-CB 4.45Å; L79-I97 HydrophobicContact CD2-CD1 3.99Å; L79-I97 WeakPolarHBondContact CD2-O 3.45Å; L79-I97 WeakPolarHBondContact O-CD1 3.42Å; E82-I97 HydrophobicContact CB-CD1 3.76Å; E82-I97 HydrophobicContact CB-CG1 3.85Å; I83-I97 HydrophobicContact CD1-CD1 4.33Å; I83-I97 HydrophobicContact CG1-CD1 4.35Å; A93-I97 WeakPolarHBondContact O-CG1 3.36Å; A93-I97 PolarHBondContact O-N 3.38Å; M94-I97 PolarHBondContact O-N 3Å; I97-R99 PolarHBondContact O-N 3.33Å; I97-G100 PolarHBondContact O-N 3.35Å; I97-I101 HydrophobicContact CG2-CD1 3.66Å; I97-I101 HydrophobicContact CG2-CG1 4.49Å; I97-I101 VanDerWaalsContact O-CG1 3.25Å; I97-I101 WeakPolarHBondContact O-CG1 3.36Å; I97-I101 PolarHBondContact O-N 3.28Å |
| 98 | K | 97.9 | Very high | 97.2 | Very high | 123 Ų | 123 | 80.5 Ų | 80.5 | 54% | 0.535 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -59.3 | -46.2 | -179.8 | -71.1 | 173.4 | -174.9 | 176.7 | 0 | 111.7 | M94 E95 R96 I102 | M94-K98 HydrophobicContact CG-CD 4.41Å; M94-K98 WeakPolarHBondContact O-CG 3.42Å; M94-K98 PolarHBondContact O-N 3.38Å; E95-K98 PolarHBondContact O-N 3.46Å; R96-K98 PolarHBondContact O-N 3.03Å; K98-I102 WeakPolarHBondContact O-CD1 3.21Å; K98-I102 VanDerWaalsContact O-CG1 3.28Å; K98-I102 WeakPolarHBondContact O-CG1 3.37Å; K98-I102 PolarHBondContact O-N 2.88Å; K98-I102 VanDerWaalsContact O-N 3.16Å |
| 99 | R | 97.7 | Very high | 97.1 | Very high | 173 Ų | 173 | 84.2 Ų | 84.2 | 65% | 0.653 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -65.2 | -45.3 | 179.9 | -72.2 | 178.4 | -171.5 | -112.6 | 2.7 | 111.9 | E95 R96 I97 I101 I102 H103 | E95-R99 WeakPolarHBondContact O-CB 3.22Å; E95-R99 WeakPolarHBondContact O-CG 3.43Å; E95-R99 PolarHBondContact O-N 2.92Å; E95-R99 IonicContact OE1-NH2 3.88Å; R96-R99 PolarHBondContact O-N 3.39Å; I97-R99 PolarHBondContact O-N 3.33Å; R99-I101 PolarHBondContact O-N 2.98Å; R99-I102 PolarHBondContact O-N 3.16Å; R99-H103 WeakPolarHBondContact O-CB 3.43Å; R99-H103 PolarHBondContact O-N 3.26Å |
| 100 | G | 97.3 | Very high | 96.8 | Very high | 14 Ų | 14 | 86.7 Ų | 86.7 | 14% | 0.144 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | I75 R96 I97 H103 A104 | I75-G100 WeakPolarHBondContact CG2-O 3.48Å; R96-G100 PolarHBondContact O-N 3.06Å; I97-G100 PolarHBondContact O-N 3.35Å; G100-H103 PolarHBondContact O-N 3.12Å; G100-A104 WeakPolarHBondContact O-CB 3.44Å; G100-A104 PolarHBondContact O-N 3.46Å |
| 101 | I | 97.6 | Very high | 96.4 | Very high | 94 Ų | 94 | 86.4 Ų | 86.4 | 48% | 0.482 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 175.6 | -67.4 | 166.5 | 0 | 0 | 0 | 111.3 | L79 I97 R99 H103 R105 | L79-I101 HydrophobicContact CD1-CG1 4.22Å; L79-I101 HydrophobicContact CD2-CG1 4.39Å; I97-I101 HydrophobicContact CG2-CD1 3.66Å; I97-I101 HydrophobicContact CG2-CG1 4.49Å; I97-I101 VanDerWaalsContact O-CG1 3.25Å; I97-I101 WeakPolarHBondContact O-CG1 3.36Å; I97-I101 PolarHBondContact O-N 3.28Å; R99-I101 PolarHBondContact O-N 2.98Å; I101-H103 VanDerWaalsContact C-N 3.32Å; I101-H103 PolarHBondContact O-N 3.3Å; I101-R105 WeakPolarHBondContact O-CB 3.41Å; I101-R105 PolarHBondContact O-N 2.9Å |
| 102 | I | 97.9 | Very high | 96 | Very high | 111 Ų | 111 | 83 Ų | 83 | 57% | 0.569 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -62.8 | -43.3 | 178.1 | -66 | 162.8 | 0 | 0 | 0 | 110.2 | K98 R99 R105 G106 | K98-I102 WeakPolarHBondContact O-CD1 3.21Å; K98-I102 VanDerWaalsContact O-CG1 3.28Å; K98-I102 WeakPolarHBondContact O-CG1 3.37Å; K98-I102 PolarHBondContact O-N 2.88Å; K98-I102 VanDerWaalsContact O-N 3.16Å; R99-I102 PolarHBondContact O-N 3.16Å; I102-R105 PolarHBondContact O-N 3.01Å; I102-G106 PolarHBondContact O-N 3.39Å |
| 103 | H | 96.9 | Very high | 95.6 | Very high | 95 Ų | 95 | 81.7 Ų | 81.7 | 44% | 0.44 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.1 | -50.8 | -180 | -172.5 | -157.3 | 0 | 0 | 0 | 111.7 | I75 R99 G100 I101 R105 G106 L107 | I75-H103 HydrophobicContact CD1-CB 4.45Å; I75-H103 WeakPolarHBondContact CD1-ND1 3.25Å; R99-H103 WeakPolarHBondContact O-CB 3.43Å; R99-H103 PolarHBondContact O-N 3.26Å; G100-H103 PolarHBondContact O-N 3.12Å; I101-H103 VanDerWaalsContact C-N 3.32Å; I101-H103 PolarHBondContact O-N 3.3Å; H103-R105 VanDerWaalsContact C-N 3.26Å; H103-R105 PolarHBondContact O-N 3.46Å; H103-G106 PolarHBondContact O-N 3.14Å; H103-L107 PolarHBondContact O-N 3.25Å |
| 104 | A | 97.3 | Very high | 95.1 | Very high | 16 Ų | 16 | 86 Ų | 86 | 13% | 0.132 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -55.7 | -42.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L72 I75 G100 G106 L107 V108 | L72-A104 HydrophobicContact CD1-CB 3.75Å; I75-A104 HydrophobicContact CG2-CB 4.01Å; G100-A104 WeakPolarHBondContact O-CB 3.44Å; G100-A104 PolarHBondContact O-N 3.46Å; A104-G106 PolarHBondContact O-N 3.41Å; A104-L107 PolarHBondContact O-N 3.43Å; A104-V108 VanDerWaalsContact O-CG2 3.32Å; A104-V108 WeakPolarHBondContact O-CG2 3.41Å; A104-V108 PolarHBondContact O-N 3.3Å |
| 105 | R | 96.9 | Very high | 94.5 | Very high | 160 Ų | 160 | 85.7 Ų | 85.7 | 60% | 0.604 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -63.2 | -40.5 | 177.3 | -165.4 | -177.3 | 80.7 | 177.7 | 4.2 | 112.4 | I101 I102 H103 R109 | I101-R105 WeakPolarHBondContact O-CB 3.41Å; I101-R105 PolarHBondContact O-N 2.9Å; I102-R105 PolarHBondContact O-N 3.01Å; H103-R105 VanDerWaalsContact C-N 3.26Å; H103-R105 PolarHBondContact O-N 3.46Å; R105-R109 WeakPolarHBondContact O-CG 3.5Å; R105-R109 PolarHBondContact O-N 2.82Å |
| 106 | G | 95.4 | Very high | 93.9 | Very high | 33 Ų | 33 | 87.5 Ų | 87.5 | 34% | 0.34 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.6 | -48.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | I102 H103 A104 V108 R109 E110 | I102-G106 PolarHBondContact O-N 3.39Å; H103-G106 PolarHBondContact O-N 3.14Å; A104-G106 PolarHBondContact O-N 3.41Å; G106-V108 PolarHBondContact O-N 3.45Å; G106-R109 WeakPolarHBondContact O-CB 3.42Å; G106-R109 PolarHBondContact O-N 3.27Å; G106-R109 VanDerWaalsContact O-N 3.12Å; G106-E110 PolarHBondContact O-N 3.43Å; G106-E110 VanDerWaalsContact O-N 3.08Å |
| 107 | L | 94.3 | Very high | 93.2 | Very high | 7 Ų | 7 | 90.1 Ų | 90.1 | 4% | 0.037 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -61.3 | -41.8 | -178.8 | -170.3 | 150.3 | 0 | 0 | 0 | 112.4 | K68 E71 L72 I75 H103 A104 R109 E110 C111 | K68-L107 HydrophobicContact CB-CD2 4.27Å; K68-L107 HydrophobicContact CD-CD1 4.28Å; K68-L107 HydrophobicContact CD-CD2 4.45Å; K68-L107 HydrophobicContact CD-CG 4.01Å; K68-L107 WeakPolarHBondContact O-CD2 3.48Å; E71-L107 HydrophobicContact CB-CD1 3.94Å; E71-L107 HydrophobicContact CG-CD1 3.71Å; E71-L107 WeakPolarHBondContact OE1-CD1 3.28Å; L72-L107 HydrophobicContact CB-CD2 3.97Å; L72-L107 HydrophobicContact CD1-CD2 4.39Å; I75-L107 HydrophobicContact CD1-CD1 4.41Å; H103-L107 PolarHBondContact O-N 3.25Å; A104-L107 PolarHBondContact O-N 3.43Å; L107-R109 VanDerWaalsContact C-N 3.33Å; L107-R109 PolarHBondContact O-N 2.84Å; L107-E110 PolarHBondContact O-N 3.16Å; L107-C111 WeakPolarHBondContact O-CB 3.29Å; L107-C111 PolarHBondContact O-N 3.41Å |
| 108 | V | 94.3 | Very high | 92.4 | Very high | 62 Ų | 62 | 94.8 Ų | 94.8 | 38% | 0.376 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.4 | -38.8 | 175.9 | 172 | 0 | 0 | 0 | 0 | 111.6 | L72 A104 G106 E110 C111 L112 | L72-V108 HydrophobicContact CD1-CG2 4.27Å; L72-V108 HydrophobicContact CD2-CG2 4Å; A104-V108 VanDerWaalsContact O-CG2 3.32Å; A104-V108 WeakPolarHBondContact O-CG2 3.41Å; A104-V108 PolarHBondContact O-N 3.3Å; G106-V108 PolarHBondContact O-N 3.45Å; V108-E110 VanDerWaalsContact C-N 3.34Å; V108-E110 PolarHBondContact O-N 3.49Å; V108-C111 PolarHBondContact O-N 2.93Å; V108-L112 HydrophobicContact CG1-CD1 4.3Å; V108-L112 WeakPolarHBondContact O-CG 3.27Å; V108-L112 PolarHBondContact O-N 3.3Å |
| 109 | R | 94.7 | Very high | 91.3 | Very high | 167 Ų | 167 | 93 Ų | 93 | 63% | 0.63 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -63.3 | -41.6 | 176 | -73.9 | -179.4 | 175.1 | -141 | -3.1 | 112 | R105 G106 L107 L112 A113 | R105-R109 WeakPolarHBondContact O-CG 3.5Å; R105-R109 PolarHBondContact O-N 2.82Å; G106-R109 WeakPolarHBondContact O-CB 3.42Å; G106-R109 PolarHBondContact O-N 3.27Å; G106-R109 VanDerWaalsContact O-N 3.12Å; L107-R109 VanDerWaalsContact C-N 3.33Å; L107-R109 PolarHBondContact O-N 2.84Å; R109-L112 PolarHBondContact O-N 3.29Å; R109-A113 WeakPolarHBondContact O-CB 3.19Å; R109-A113 PolarHBondContact O-N 3.05Å |
| 110 | E | 91.1 | Very high | 90 | Very high | 112 Ų | 112 | 95.9 Ų | 95.9 | 52% | 0.523 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.7 | -43.7 | 175 | -65.4 | -151.6 | 115.2 | 0 | 0 | 111.6 | K68 G106 L107 V108 L112 A113 E114 | K68-E110 IonicContact NZ-OE2 2.73Å; K68-E110 PolarHBondContact NZ-OE2 3.27Å; G106-E110 PolarHBondContact O-N 3.43Å; G106-E110 VanDerWaalsContact O-N 3.08Å; L107-E110 PolarHBondContact O-N 3.16Å; V108-E110 VanDerWaalsContact C-N 3.34Å; V108-E110 PolarHBondContact O-N 3.49Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 3.36Å; E110-A113 PolarHBondContact O-N 3.48Å; E110-E114 WeakPolarHBondContact O-CB 3.4Å; E110-E114 PolarHBondContact O-N 2.96Å |
| 111 | C | 89.9 | Confident | 88 | Confident | 42 Ų | 42 | 102.5 Ų | 102.5 | 28% | 0.284 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62 | -38.8 | 179.4 | -163 | 0 | 0 | 0 | 0 | 112.3 | L107 V108 T115 | L107-C111 WeakPolarHBondContact O-CB 3.29Å; L107-C111 PolarHBondContact O-N 3.41Å; V108-C111 PolarHBondContact O-N 2.93Å; C111-T115 WeakPolarHBondContact O-CB 3.37Å; C111-T115 PolarHBondContact O-N 3.46Å; C111-T115 VanDerWaalsContact O-N 3.08Å; C111-T115 PolarHBondContact O-OG1 3.03Å |
| 112 | L | 90.4 | Very high | 87.5 | Confident | 107 Ų | 107 | 102.9 Ų | 102.9 | 56% | 0.56 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.5 | -50.6 | 174 | -72.6 | 173 | 0 | 0 | 0 | 111.2 | V108 R109 E110 E114 T115 E116 | V108-L112 HydrophobicContact CG1-CD1 4.3Å; V108-L112 WeakPolarHBondContact O-CG 3.27Å; V108-L112 PolarHBondContact O-N 3.3Å; R109-L112 PolarHBondContact O-N 3.29Å; E110-L112 VanDerWaalsContact C-N 3.31Å; E110-L112 PolarHBondContact O-N 3.36Å; L112-E114 VanDerWaalsContact C-N 3.29Å; L112-E114 PolarHBondContact O-N 2.67Å; L112-T115 WeakPolarHBondContact O-CB 3.46Å; L112-T115 PolarHBondContact O-N 3.08Å; L112-T115 VanDerWaalsContact O-N 3.14Å; L112-E116 WeakPolarHBondContact O-CG 3.49Å; L112-E116 PolarHBondContact O-N 3.12Å |
| 113 | A | 88.8 | Confident | 87 | Confident | 44 Ų | 44 | 102.5 Ų | 102.5 | 36% | 0.364 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.7 | -36.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | R109 E110 E116 R117 | R109-A113 WeakPolarHBondContact O-CB 3.19Å; R109-A113 PolarHBondContact O-N 3.05Å; E110-A113 PolarHBondContact O-N 3.48Å; A113-E116 PolarHBondContact O-N 3.02Å; A113-R117 WeakPolarHBondContact O-CG 3.15Å; A113-R117 PolarHBondContact O-N 3.38Å; A113-R117 VanDerWaalsContact O-N 3.13Å |
| 114 | E | 86.3 | Confident | 86.4 | Confident | 92 Ų | 92 | 102.9 Ų | 102.9 | 43% | 0.43 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.9 | -40.4 | 175.9 | -172.9 | 157.9 | 57.7 | 0 | 0 | 111.8 | P65 E110 L112 R117 N118 | P65-E114 WeakPolarHBondContact CG-OE1 3.42Å; E110-E114 WeakPolarHBondContact O-CB 3.4Å; E110-E114 PolarHBondContact O-N 2.96Å; L112-E114 VanDerWaalsContact C-N 3.29Å; L112-E114 PolarHBondContact O-N 2.67Å; E114-R117 PolarHBondContact O-N 3.02Å; E114-N118 WeakPolarHBondContact O-CB 3.36Å; E114-N118 PolarHBondContact O-N 3.31Å |
| 115 | T | 86.2 | Confident | 85.8 | Confident | 78 Ų | 78 | 108 Ų | 108 | 48% | 0.479 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64 | -42 | 175 | -54.5 | 0 | 0 | 0 | 0 | 111.3 | C111 L112 R117 N118 A119 | C111-T115 WeakPolarHBondContact O-CB 3.37Å; C111-T115 PolarHBondContact O-N 3.46Å; C111-T115 VanDerWaalsContact O-N 3.08Å; C111-T115 PolarHBondContact O-OG1 3.03Å; L112-T115 WeakPolarHBondContact O-CB 3.46Å; L112-T115 PolarHBondContact O-N 3.08Å; L112-T115 VanDerWaalsContact O-N 3.14Å; T115-R117 VanDerWaalsContact C-N 3.32Å; T115-R117 PolarHBondContact O-N 3.18Å; T115-N118 PolarHBondContact O-N 3.46Å; T115-A119 WeakPolarHBondContact O-CB 3.5Å; T115-A119 PolarHBondContact O-N 3.3Å |
| 116 | E | 85.3 | Confident | 85.1 | Confident | 139 Ų | 139 | 104.8 Ų | 104.8 | 65% | 0.65 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.8 | -35.9 | 176.2 | -70.6 | -179.6 | 93.5 | 0 | 0 | 112.6 | L112 A113 R120 | L112-E116 WeakPolarHBondContact O-CG 3.49Å; L112-E116 PolarHBondContact O-N 3.12Å; A113-E116 PolarHBondContact O-N 3.02Å; E116-R120 WeakPolarHBondContact O-CB 3.38Å |
| 117 | R | 83.6 | Confident | 84.4 | Confident | 195 Ų | 195 | 109.5 Ų | 109.5 | 74% | 0.736 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71.7 | -40.2 | 173.8 | -72.6 | -172.1 | -172 | -157.8 | 4.8 | 112.4 | A113 E114 T115 A119 R120 S121 | A113-R117 WeakPolarHBondContact O-CG 3.15Å; A113-R117 PolarHBondContact O-N 3.38Å; A113-R117 VanDerWaalsContact O-N 3.13Å; E114-R117 PolarHBondContact O-N 3.02Å; T115-R117 VanDerWaalsContact C-N 3.32Å; T115-R117 PolarHBondContact O-N 3.18Å; R117-A119 VanDerWaalsContact C-N 3.31Å; R117-A119 PolarHBondContact O-N 3.2Å; R117-R120 PolarHBondContact O-N 3.46Å; R117-R120 VanDerWaalsContact O-N 3.17Å; R117-S121 PolarHBondContact O-N 3.43Å; R117-S121 VanDerWaalsContact O-N 3.1Å; R117-S121 PolarHBondContact O-OG 3.05Å |
| 118 | N | 79.9 | Confident | 83.7 | Confident | 126 Ų | 126 | 116.9 Ų | 116.9 | 67% | 0.674 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -67.6 | -31.1 | 179.3 | -170.5 | 84.7 | 0 | 0 | 0 | 112.5 | E114 T115 R120 | E114-N118 WeakPolarHBondContact O-CB 3.36Å; E114-N118 PolarHBondContact O-N 3.31Å; T115-N118 PolarHBondContact O-N 3.46Å; N118-R120 VanDerWaalsContact C-N 3.25Å; N118-R120 PolarHBondContact O-N 2.93Å |
| 119 | A | 75.4 | Confident | 82.8 | Confident | 86 Ų | 86 | 121.1 Ų | 121.1 | 71% | 0.711 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -11.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | T115 R117 | T115-A119 WeakPolarHBondContact O-CB 3.5Å; T115-A119 PolarHBondContact O-N 3.3Å; R117-A119 VanDerWaalsContact C-N 3.31Å; R117-A119 PolarHBondContact O-N 3.2Å |
| 120 | R | 70.9 | Confident | 81.9 | Confident | 233 Ų | 233 | 117.3 Ų | 117.3 | 88% | 0.879 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.8 | -12.6 | -177.4 | -160.2 | 171 | -178 | 177 | 0.5 | 113 | E116 R117 N118 | E116-R120 WeakPolarHBondContact O-CB 3.38Å; R117-R120 PolarHBondContact O-N 3.46Å; R117-R120 VanDerWaalsContact O-N 3.17Å; N118-R120 VanDerWaalsContact C-N 3.25Å; N118-R120 PolarHBondContact O-N 2.93Å |
| 121 | S | 54.5 | Low | 81 | Confident | 153 Ų | 153 | 117.7 Ų | 117.7 | 100% | 1.07 | 62% | 0.621 | S | S | * | * | trans | -86.6 | 0 | 166.4 | -56.9 | 0 | 0 | 0 | 0 | 109.8 | R117 | R117-S121 PolarHBondContact O-N 3.43Å; R117-S121 VanDerWaalsContact O-N 3.1Å; R117-S121 PolarHBondContact O-OG 3.05Å |
Retrieved 121 of 121 residues in 377.2 ms
(Link to these results)