| 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 | 41.2 | Very low | 42.6 | Very low | 241 Ų | 241 | 149 Ų | 149 | 100% | 1.187 | 80% | 0.8 | S | S | * | * | 0 | 118.6 | 0 | -61.7 | 172.7 | -176.7 | 0 | 0 | 106 | |||||
| 2 | T | 47.1 | Very low | 42.8 | Very low | 139 Ų | 139 | 150.2 Ų | 150.2 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | cis | -126.2 | 150 | 16.1 | -64.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 3 | E | 42.4 | Very low | 42.5 | Very low | 160 Ų | 160 | 148.7 Ų | 148.7 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | trans | -89.8 | 153.2 | 176.1 | -59.7 | -161.2 | 170.3 | 0 | 0 | 112.2 | ||||
| 4 | M | 56.5 | Low | 42.2 | Very low | 189 Ų | 189 | 143.8 Ų | 143.8 | 93% | 0.931 | 81% | 0.806 | S | S | * | * | trans | -134.5 | 120.8 | 158.2 | -76 | -71.9 | -76.4 | 0 | 0 | 107 | ||||
| 5 | S | 45.2 | Very low | 41.6 | Very low | 73 Ų | 73 | 143.3 Ų | 143.3 | 51% | 0.51 | 80% | 0.8 | S | S | . | * | trans | -128.9 | 178.1 | -173.5 | -74.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 6 | F | 43.4 | Very low | 41.7 | Very low | 193 Ų | 193 | 144.6 Ų | 144.6 | 85% | 0.846 | 80% | 0.804 | S | S | * | * | trans | 76.1 | 151.7 | 170.1 | -51.9 | -86.7 | 0 | 0 | 0 | 117.4 | ||||
| 7 | L | 42.3 | Very low | 41.4 | Very low | 138 Ų | 138 | 145.1 Ų | 145.1 | 72% | 0.723 | 80% | 0.801 | S | S | * | * | cis | -171.3 | 143.7 | -44.4 | -126.5 | 161.8 | 0 | 0 | 0 | 111 | ||||
| 8 | S | 37.7 | Very low | 41.3 | Very low | 103 Ų | 103 | 142.8 Ų | 142.8 | 72% | 0.72 | 80% | 0.797 | S | S | * | * | trans | 64.5 | 155.4 | 146.9 | 55.4 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 9 | S | 33.6 | Very low | 42 | Very low | 101 Ų | 101 | 140.7 Ų | 140.7 | 71% | 0.706 | 79% | 0.79 | S | S | * | * | trans | 72 | 154.3 | 166.1 | -115.3 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 10 | E | 41.1 | Very low | 41.5 | Very low | 180 Ų | 180 | 143.6 Ų | 143.6 | 84% | 0.841 | 79% | 0.794 | S | S | * | * | cis | -146.8 | 177.4 | 11.1 | -161.2 | 136 | -108.2 | 0 | 0 | 113.9 | ||||
| 11 | V | 37.8 | Very low | 41.6 | Very low | 122 Ų | 122 | 142.9 Ų | 142.9 | 74% | 0.739 | 79% | 0.789 | S | S | * | * | trans | -103.5 | 135.6 | -176.5 | 171.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 12 | L | 45.2 | Very low | 41.7 | Very low | 163 Ų | 163 | 141 Ų | 141 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | trans | -139.1 | 105.3 | 156 | -86.4 | 166.6 | 0 | 0 | 0 | 107.4 | ||||
| 13 | V | 39 | Very low | 41.4 | Very low | 131 Ų | 131 | 140.1 Ų | 140.1 | 79% | 0.794 | 78% | 0.777 | S | S | * | * | 68 | 112.4 | 86.9 | 175.5 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 14 | G | 38.2 | Very low | 40.8 | Very low | 80 Ų | 80 | 136.4 Ų | 136.4 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | trans | 177 | 52 | -176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 15 | D | 32.8 | Very low | 39.8 | Very low | 136 Ų | 136 | 136.2 Ų | 136.2 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | trans | -78.7 | 140.5 | 179.3 | 176.1 | 32.6 | 0 | 0 | 0 | 111.9 | ||||
| 16 | L | 44.3 | Very low | 39.1 | Very low | 165 Ų | 165 | 136.1 Ų | 136.1 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -169.8 | 110.6 | 134.9 | -104.3 | 173.8 | 0 | 0 | 0 | 111 | ||||
| 17 | M | 35.5 | Very low | 38.8 | Very low | 153 Ų | 153 | 130.9 Ų | 130.9 | 75% | 0.754 | 79% | 0.786 | S | S | * | * | trans | -76.2 | 176 | 158.9 | -54.3 | -133.3 | 75 | 0 | 0 | 109.7 | ||||
| 18 | S | 39.3 | Very low | 38.9 | Very low | 104 Ų | 104 | 132.5 Ų | 132.5 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | cis | -164.7 | 158.4 | 23.3 | -176.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 19 | P | 56.3 | Low | 39 | Very low | 102 Ų | 102 | 136 Ų | 136 | 66% | 0.662 | 80% | 0.795 | S | S | * | * | trans | -83.5 | 155 | 164.8 | 34.7 | -35.8 | 0 | 0 | 0 | 112.9 | ||||
| 20 | F | 32 | Very low | 39.4 | Very low | 199 Ų | 199 | 134.8 Ų | 134.8 | 87% | 0.873 | 79% | 0.787 | S | S | * | * | trans | -171 | 162.3 | 139.1 | -127.3 | -88.3 | 0 | 0 | 0 | 112.9 | ||||
| 21 | D | 42.9 | Very low | 39.4 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 69% | 0.69 | 79% | 0.789 | S | S | * | * | trans | -79 | 164.9 | -173.2 | -52.4 | -89.4 | 0 | 0 | 0 | 116.9 | ||||
| 22 | Q | 42.3 | Very low | 39.3 | Very low | 201 Ų | 201 | 132.3 Ų | 132.3 | 94% | 0.939 | 79% | 0.793 | S | S | * | * | trans | -152.3 | 146.2 | 139.9 | -123.3 | 169.5 | 57.8 | 0 | 0 | 113.2 | ||||
| 23 | S | 40.7 | Very low | 39.2 | Very low | 121 Ų | 121 | 132.4 Ų | 132.4 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | -113.6 | 150.3 | -174.1 | -42.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 24 | G | 31.6 | Very low | 39.1 | Very low | 81 Ų | 81 | 134.1 Ų | 134.1 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | trans | -172.5 | 102.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 25 | L | 34.7 | Very low | 39 | Very low | 185 Ų | 185 | 138 Ų | 138 | 97% | 0.969 | 80% | 0.799 | S | S | * | * | trans | -30.9 | 155.9 | 163.9 | -65 | 155.8 | 0 | 0 | 0 | 120.5 | ||||
| 26 | G | 29.9 | Very low | 39.4 | Very low | 71 Ų | 71 | 138.2 Ų | 138.2 | 73% | 0.732 | 80% | 0.8 | S | S | * | * | trans | 104 | 103.7 | 151.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 27 | A | 37.1 | Very low | 39.1 | Very low | 84 Ų | 84 | 139.2 Ų | 139.2 | 69% | 0.694 | 79% | 0.794 | S | S | * | * | 93.2 | 157.1 | 79.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 28 | E | 45.5 | Very low | 39.7 | Very low | 172 Ų | 172 | 140.3 Ų | 140.3 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | cis | -133.7 | 178.7 | 17.1 | -38.5 | -70.4 | 153.5 | 0 | 0 | 112.7 | ||||
| 29 | E | 38.8 | Very low | 40.3 | Very low | 175 Ų | 175 | 141.3 Ų | 141.3 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | 3.6 | 157.2 | 149 | -73.2 | -156.3 | 80.6 | 0 | 0 | 124.1 | ||||
| 30 | S | 42.4 | Very low | 39.5 | Very low | 76 Ų | 76 | 141.8 Ų | 141.8 | 53% | 0.531 | 80% | 0.796 | S | S | . | * | cis | -159.5 | 146.8 | -2.1 | -124.7 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 31 | L | 40.9 | Very low | 39.9 | Very low | 172 Ų | 172 | 137 Ų | 137 | 90% | 0.901 | 79% | 0.793 | S | S | * | * | trans | 41.1 | 125.2 | 145.2 | -59.2 | 171.8 | 0 | 0 | 0 | 122.6 | ||||
| 32 | G | 36.4 | Very low | 40.1 | Very low | 79 Ų | 79 | 137.5 Ų | 137.5 | 81% | 0.814 | 79% | 0.789 | S | S | * | * | trans | -150.5 | 16.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 33 | L | 42.5 | Very low | 39.7 | Very low | 164 Ų | 164 | 137.1 Ų | 137.1 | 86% | 0.859 | 79% | 0.787 | S | S | * | * | trans | 24.7 | 96.6 | 160.5 | -156.9 | 166.9 | 0 | 0 | 0 | 119.2 | ||||
| 34 | L | 37.3 | Very low | 39.6 | Very low | 168 Ų | 168 | 141.3 Ų | 141.3 | 88% | 0.88 | 79% | 0.79 | S | S | * | * | trans | -157.9 | 101.1 | 139.3 | -166.9 | 64.4 | 0 | 0 | 0 | 110.8 | ||||
| 35 | D | 36.2 | Very low | 40.2 | Very low | 162 Ų | 162 | 146.7 Ų | 146.7 | 87% | 0.866 | 79% | 0.791 | S | S | * | * | trans | -123.9 | 102.7 | 171.7 | 178.5 | 31.7 | 0 | 0 | 0 | 108.6 | ||||
| 36 | D | 41.3 | Very low | 40.9 | Very low | 139 Ų | 139 | 143.7 Ų | 143.7 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | trans | -163.9 | 166.1 | 161 | -142.2 | -27.6 | 0 | 0 | 0 | 109.4 | ||||
| 37 | Y | 38.4 | Very low | 41.2 | Very low | 187 Ų | 187 | 148.8 Ų | 148.8 | 73% | 0.733 | 79% | 0.787 | S | S | * | * | trans | 65.7 | 61 | 179.3 | -84.8 | -82.4 | 0 | 0 | 0 | 117.9 | E39 | Y37-E39 HydrophobicContact CD1-CB 4.36Š| ||
| 38 | L | 47.5 | Very low | 41.2 | Very low | 176 Ų | 176 | 147.7 Ų | 147.7 | 92% | 0.921 | 78% | 0.784 | S | S | * | * | trans | -103.7 | 61 | 146.5 | -157.8 | 78.9 | 0 | 0 | 0 | 110.7 | V40 | L38-V40 PolarHBondContact O-N 2.89Š| ||
| 39 | E | 50.8 | Low | 40.9 | Very low | 124 Ų | 124 | 149.4 Ų | 149.4 | 58% | 0.579 | 79% | 0.788 | S | S | * | * | trans | -73.1 | 119.8 | -176.4 | -175.7 | 161.9 | -157.6 | 0 | 0 | 112.7 | Y37 A41 K42 | Y37-E39 HydrophobicContact CD1-CB 4.36Å; E39-A41 PolarHBondContact O-N 2.75Å; E39-K42 IonicContact OE1-NZ 2.75Å; E39-K42 PolarHBondContact OE1-NZ 3.29Å | ||
| 40 | V | 41.2 | Very low | 41.2 | Very low | 113 Ų | 113 | 146.7 Ų | 146.7 | 69% | 0.685 | 79% | 0.789 | S | S | * | * | trans | -59.5 | 120.3 | 174 | 174.4 | 0 | 0 | 0 | 0 | 110.9 | L38 K42 | L38-V40 PolarHBondContact O-N 2.89Å; V40-K42 PolarHBondContact O-N 3.31Å | ||
| 41 | A | 40 | Very low | 41 | Very low | 99 Ų | 99 | 148.3 Ų | 148.3 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -65.1 | 91.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E39 | E39-A41 PolarHBondContact O-N 2.75Š| ||
| 42 | K | 46 | Very low | 41.3 | Very low | 139 Ų | 139 | 147.6 Ų | 147.6 | 60% | 0.604 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 143.2 | 178.8 | -67 | 147.1 | -167.8 | 156.3 | 0 | 110.9 | E39 V40 F44 | E39-K42 IonicContact OE1-NZ 2.75Å; E39-K42 PolarHBondContact OE1-NZ 3.29Å; V40-K42 PolarHBondContact O-N 3.31Å; K42-F44 PolarHBondContact O-N 3.07Å |
| 43 | H | 35.5 | Very low | 41.8 | Very low | 193 Ų | 193 | 153 Ų | 153 | 89% | 0.894 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 123 | -176.5 | -52.9 | -79.4 | 0 | 0 | 0 | 112.7 | K45 | H43-K45 PolarHBondContact O-N 3.36Š|
| 44 | F | 37.3 | Very low | 41.8 | Very low | 208 Ų | 208 | 150.2 Ų | 150.2 | 91% | 0.912 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 121.9 | 172.9 | -88.8 | -94.8 | 0 | 0 | 0 | 111.1 | K42 | K42-F44 PolarHBondContact O-N 3.07Š|
| 45 | K | 45.6 | Very low | 42 | Very low | 195 Ų | 195 | 152.1 Ų | 152.1 | 85% | 0.848 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 127.6 | 174.5 | -173.9 | 175.7 | -178 | 176.5 | 0 | 109.1 | H43 | H43-K45 PolarHBondContact O-N 3.36Š|
| 46 | P | 47.4 | Very low | 42 | Very low | 121 Ų | 121 | 149.3 Ų | 149.3 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 140.9 | -177.8 | 25.4 | -33.6 | 0 | 0 | 0 | 111.7 | G48 | P46-G48 PolarHBondContact O-N 3.3Š|
| 47 | H | 37.5 | Very low | 41.7 | Very low | 179 Ų | 179 | 146.4 Ų | 146.4 | 83% | 0.829 | 80% | 0.803 | S | S | * | * | trans | -73.5 | 111.6 | -176.8 | -161.2 | -41.6 | 0 | 0 | 0 | 110.2 | ||||
| 48 | G | 36.7 | Very low | 41.6 | Very low | 61 Ų | 61 | 143.1 Ų | 143.1 | 63% | 0.629 | 81% | 0.807 | S | S | * | * | trans | -65.8 | 133.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | P46 | P46-G48 PolarHBondContact O-N 3.3Š| ||
| 49 | F | 39.6 | Very low | 41.2 | Very low | 207 Ų | 207 | 139.3 Ų | 139.3 | 91% | 0.908 | 80% | 0.795 | S | S | * | * | trans | -76.6 | 137.6 | 169.7 | -88.1 | -94.7 | 0 | 0 | 0 | 110.3 | S51 | F49-S51 PolarHBondContact O-N 3.41Š| ||
| 50 | S | 44.1 | Very low | 40.9 | Very low | 119 Ų | 119 | 141.2 Ų | 141.2 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -79.9 | 108.8 | 178.7 | 179.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 51 | S | 38.2 | Very low | 40.8 | Very low | 110 Ų | 110 | 146.2 Ų | 146.2 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | trans | -81.9 | 120.4 | 163.1 | 44.4 | 0 | 0 | 0 | 0 | 110.2 | F49 | F49-S51 PolarHBondContact O-N 3.41Š| ||
| 52 | D | 48.2 | Very low | 40.9 | Very low | 157 Ų | 157 | 148.7 Ų | 148.7 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | trans | -77.4 | 157.7 | -177.8 | -160.6 | 5.2 | 0 | 0 | 0 | 112.4 | A54 | D52-A54 PolarHBondContact O-N 3.5Š| ||
| 53 | K | 47.1 | Very low | 40.8 | Very low | 191 Ų | 191 | 146.8 Ų | 146.8 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | trans | -93.5 | 100.2 | -160.9 | -64 | -164.5 | 178.8 | -171.3 | 0 | 114.3 | ||||
| 54 | A | 42.4 | Very low | 41.1 | Very low | 107 Ų | 107 | 144.2 Ų | 144.2 | 88% | 0.884 | 82% | 0.818 | S | S | * | * | trans | -70 | 140.9 | 151.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | D52 | D52-A54 PolarHBondContact O-N 3.5Š| ||
| 55 | K | 41.3 | Very low | 41.5 | Very low | 207 Ų | 207 | 142.4 Ų | 142.4 | 90% | 0.9 | 82% | 0.817 | S | S | * | * | trans | -127.9 | 100.7 | -165.2 | 178 | -170.6 | 176.1 | -176.7 | 0 | 111.9 | ||||
| 56 | A | 37.1 | Very low | 41.2 | Very low | 104 Ų | 104 | 136.5 Ų | 136.5 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -159.7 | 138.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 57 | G | 33.9 | Very low | 41.3 | Very low | 77 Ų | 77 | 138.8 Ų | 138.8 | 79% | 0.794 | 82% | 0.817 | S | S | * | * | trans | 88.6 | 110.8 | 150.1 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 58 | S | 35.6 | Very low | 41.4 | Very low | 118 Ų | 118 | 136.3 Ų | 136.3 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | 4.8 | 139.8 | 127.3 | -154.9 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 59 | S | 40.2 | Very low | 41.8 | Very low | 97 Ų | 97 | 138.4 Ų | 138.4 | 68% | 0.678 | 82% | 0.819 | S | S | * | * | cis | -160.6 | 156.2 | 3.4 | 26 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 60 | E | 43.6 | Very low | 42 | Very low | 164 Ų | 164 | 134.3 Ų | 134.3 | 77% | 0.766 | 81% | 0.813 | S | S | * | * | trans | -19.1 | 129.5 | 144.7 | 174.5 | 177.6 | -159.3 | 0 | 0 | 116.2 | ||||
| 61 | W | 39.5 | Very low | 42 | Very low | 217 Ų | 217 | 133.2 Ų | 133.2 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | trans | -166.5 | 129.3 | 133.6 | -89.1 | 116.5 | 0 | 0 | 0 | 111.4 | ||||
| 62 | L | 42.7 | Very low | 42.5 | Very low | 151 Ų | 151 | 135.2 Ų | 135.2 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | trans | 56.1 | 118.8 | 158 | -52.7 | -177.8 | 0 | 0 | 0 | 120.3 | ||||
| 63 | A | 43.8 | Very low | 42.8 | Very low | 99 Ų | 99 | 134 Ų | 134 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -93.5 | 145.3 | 154.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 64 | V | 40.8 | Very low | 43.2 | Very low | 140 Ų | 140 | 128.2 Ų | 128.2 | 85% | 0.848 | 80% | 0.795 | S | S | * | * | trans | -141.9 | 127 | 162.6 | 169.3 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 65 | D | 45.8 | Very low | 43.9 | Very low | 169 Ų | 169 | 132.4 Ų | 132.4 | 90% | 0.904 | 79% | 0.794 | S | S | * | * | trans | -72.3 | 139.7 | 173.6 | -77.7 | -62.2 | 0 | 0 | 0 | 111.6 | ||||
| 66 | G | 40 | Very low | 45 | Very low | 72 Ų | 72 | 131.3 Ų | 131.3 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | trans | -147.9 | 78 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112 | V68 | G66-V68 PolarHBondContact O-N 3.38Š| ||
| 67 | L | 48.2 | Very low | 46.7 | Very low | 169 Ų | 169 | 131.4 Ų | 131.4 | 89% | 0.885 | 78% | 0.778 | S | S | * | * | trans | -70.5 | 99 | 179.9 | 178.5 | 64.2 | 0 | 0 | 0 | 111.5 | ||||
| 68 | V | 40.7 | Very low | 48.5 | Very low | 126 Ų | 126 | 132.2 Ų | 132.2 | 76% | 0.764 | 78% | 0.777 | S | S | * | * | trans | -133 | 116.6 | 164.1 | 177 | 0 | 0 | 0 | 0 | 108.8 | G66 P70 | G66-V68 PolarHBondContact O-N 3.38Å; V68-P70 WeakPolarHBondContact O-CD 3.37Å | ||
| 69 | S | 45.7 | Very low | 49.8 | Very low | 105 Ų | 105 | 133.5 Ų | 133.5 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 118.6 | 172.8 | -57.7 | 0 | 0 | 0 | 0 | 110 | S71 | S69-S71 PolarHBondContact O-N 3.47Š|
| 70 | P | 42.2 | Very low | 51.2 | Low | 121 Ų | 121 | 133.4 Ų | 133.4 | 79% | 0.786 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 132.3 | 170.7 | 29.2 | -32.8 | 0 | 0 | 0 | 109.6 | V68 N72 | V68-P70 WeakPolarHBondContact O-CD 3.37Å; P70-N72 PolarHBondContact O-N 2.98Å |
| 71 | S | 45.4 | Very low | 52.7 | Low | 96 Ų | 96 | 128.1 Ų | 128.1 | 67% | 0.671 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 133.8 | 172.7 | -167.3 | 0 | 0 | 0 | 0 | 109.8 | S69 N73 | S69-S71 PolarHBondContact O-N 3.47Å; S71-N73 VanDerWaalsContact CB-OD1 3.31Å; S71-N73 WeakPolarHBondContact CB-OD1 3.31Å; S71-N73 PolarHBondContact O-N 3.31Å; S71-N73 PolarHBondContact OG-OD1 3.2Å |
| 72 | N | 47.9 | Very low | 54.5 | Low | 152 Ų | 152 | 120.4 Ų | 120.4 | 81% | 0.813 | 73% | 0.734 | S | S | * | * | trans | -77.7 | 67.2 | -176.1 | -176.1 | 45.6 | 0 | 0 | 0 | 111.6 | P70 | P70-N72 PolarHBondContact O-N 2.98Š| ||
| 73 | N | 55.6 | Low | 55.9 | Low | 132 Ų | 132 | 119.2 Ų | 119.2 | 71% | 0.706 | 73% | 0.728 | S | S | * | * | trans | -109.6 | 122.8 | 179.3 | -57.1 | 27 | 0 | 0 | 0 | 107.7 | S71 | S71-N73 VanDerWaalsContact CB-OD1 3.31Å; S71-N73 WeakPolarHBondContact CB-OD1 3.31Å; S71-N73 PolarHBondContact O-N 3.31Å; S71-N73 PolarHBondContact OG-OD1 3.2Å | ||
| 74 | G | 55.5 | Low | 57.6 | Low | 69 Ų | 69 | 123.1 Ų | 123.1 | 71% | 0.711 | 72% | 0.722 | S | S | * | * | trans | 114.4 | 61 | 176.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 75 | K | 55.7 | Low | 59.1 | Low | 196 Ų | 196 | 122.3 Ų | 122.3 | 85% | 0.852 | 71% | 0.711 | S | S | * | * | trans | -136.6 | 65.5 | 151.1 | -71.6 | -166.4 | -178.9 | -179 | 0 | 109.1 | D77 | K75-D77 PolarHBondContact O-N 3.28Š| ||
| 76 | E | 64.7 | Low | 60.3 | Low | 183 Ų | 183 | 119.8 Ų | 119.8 | 86% | 0.855 | 70% | 0.697 | S | S | * | * | trans | -58.5 | 118.1 | 155.4 | 57.1 | -156.3 | -169.3 | 0 | 0 | 107.6 | ||||
| 77 | D | 72.3 | Confident | 62.2 | Low | 106 Ų | 106 | 123.5 Ų | 123.5 | 57% | 0.567 | 69% | 0.694 | S | S | * | * | trans | -71 | 138.7 | 179.1 | -178.4 | 21.7 | 0 | 0 | 0 | 109.3 | K75 F79 S80 | K75-D77 PolarHBondContact O-N 3.28Å; D77-F79 PolarHBondContact O-N 2.65Å; D77-S80 WeakPolarHBondContact O-CB 3.28Å; D77-S80 PolarHBondContact O-N 2.8Å | ||
| 78 | A | 73.1 | Confident | 63.4 | Low | 94 Ų | 94 | 124.1 Ų | 124.1 | 78% | 0.777 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -15.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 79 | F | 62.3 | Low | 65 | Low | 145 Ų | 145 | 124.6 Ų | 124.6 | 64% | 0.636 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | 1.7 | 175.3 | -61.1 | -81 | 0 | 0 | 0 | 114 | D77 G81 T82 | D77-F79 PolarHBondContact O-N 2.65Å; F79-G81 PolarHBondContact O-N 3.44Å; F79-T82 HydrophobicContact CD1-CG2 4.34Å; F79-T82 PolarHBondContact O-N 2.83Å; F79-T82 VanDerWaalsContact O-N 3.09Å; F79-T82 PolarHBondContact O-OG1 3.06Å; F79-T82 VanDerWaalsContact O-OG1 3.09Å |
| 80 | S | 70.7 | Confident | 66.2 | Low | 96 Ų | 96 | 123.4 Ų | 123.4 | 67% | 0.671 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -4.3 | 178.2 | -168.2 | 0 | 0 | 0 | 0 | 114.3 | D77 | D77-S80 WeakPolarHBondContact O-CB 3.28Å; D77-S80 PolarHBondContact O-N 2.8Å |
| 81 | G | 74.6 | Confident | 67.5 | Low | 53 Ų | 53 | 122.9 Ų | 122.9 | 55% | 0.546 | 66% | 0.661 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.5 | 15 | 176 | 0 | 0 | 0 | 0 | 0 | 115.3 | F79 W84 | F79-G81 PolarHBondContact O-N 3.44Å; G81-W84 PolarHBondContact O-NE1 3.22Å |
| 82 | T | 76.8 | Confident | 68.6 | Low | 55 Ų | 55 | 125.4 Ų | 125.4 | 34% | 0.337 | 66% | 0.66 | S | S | . | * | trans | -99.9 | 2.7 | 178.8 | 63 | 0 | 0 | 0 | 0 | 114.9 | F79 W84 M85 | F79-T82 HydrophobicContact CD1-CG2 4.34Å; F79-T82 PolarHBondContact O-N 2.83Å; F79-T82 VanDerWaalsContact O-N 3.09Å; F79-T82 PolarHBondContact O-OG1 3.06Å; F79-T82 VanDerWaalsContact O-OG1 3.09Å; T82-W84 VanDerWaalsContact C-N 3.34Å; T82-W84 PolarHBondContact O-N 2.82Å; T82-M85 HydrophobicContact CG2-SD 4.38Å; T82-M85 VanDerWaalsContact O-CB 3.31Å; T82-M85 WeakPolarHBondContact O-CB 3.41Å; T82-M85 PolarHBondContact O-N 3.49Å | ||
| 83 | D | 73.1 | Confident | 69.5 | Low | 126 Ų | 126 | 125 Ų | 125 | 67% | 0.674 | 65% | 0.653 | S | S | * | * | G | 310 helix | trans | -60.7 | -40 | -175.3 | -163.9 | 42.4 | 0 | 0 | 0 | 112.9 | M85 L86 E87 | D83-M85 PolarHBondContact O-N 3.45Å; D83-L86 WeakPolarHBondContact O-CB 3.25Å; D83-L86 PolarHBondContact O-N 2.89Å; D83-E87 PolarHBondContact O-N 3Å |
| 84 | W | 79.5 | Confident | 70.1 | Confident | 181 Ų | 181 | 124.5 Ų | 124.5 | 69% | 0.686 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -60.1 | -16.2 | 173 | 70.9 | -88.7 | 0 | 0 | 0 | 114.4 | G81 T82 | G81-W84 PolarHBondContact O-NE1 3.22Å; T82-W84 VanDerWaalsContact C-N 3.34Å; T82-W84 PolarHBondContact O-N 2.82Å |
| 85 | M | 71.6 | Confident | 70.8 | Confident | 123 Ų | 123 | 126 Ų | 126 | 61% | 0.606 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -86.1 | -15.1 | 173.5 | -59.3 | 179.1 | 56.2 | 0 | 0 | 112.8 | T82 D83 | T82-M85 HydrophobicContact CG2-SD 4.38Å; T82-M85 VanDerWaalsContact O-CB 3.31Å; T82-M85 WeakPolarHBondContact O-CB 3.41Å; T82-M85 PolarHBondContact O-N 3.49Å; D83-M85 PolarHBondContact O-N 3.45Å |
| 86 | L | 71.4 | Confident | 71.5 | Confident | 116 Ų | 116 | 121.6 Ų | 121.6 | 61% | 0.607 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.8 | -19.1 | 177.1 | -61.3 | 177.2 | 0 | 0 | 0 | 112 | D83 K88 | D83-L86 WeakPolarHBondContact O-CB 3.25Å; D83-L86 PolarHBondContact O-N 2.89Å; L86-K88 PolarHBondContact O-N 3.3Å; L86-K88 VanDerWaalsContact O-N 3.1Å |
| 87 | E | 78.6 | Confident | 71.5 | Confident | 149 Ų | 149 | 118 Ų | 118 | 70% | 0.696 | 60% | 0.604 | S | S | * | * | trans | -50 | 112.3 | 171.5 | -171.8 | 172.6 | -162.6 | 0 | 0 | 111 | D83 M89 | D83-E87 PolarHBondContact O-N 3Å; E87-M89 PolarHBondContact O-N 3.02Å; E87-M89 VanDerWaalsContact O-N 3.08Å | ||
| 88 | K | 74.6 | Confident | 71.2 | Confident | 183 Ų | 183 | 116.6 Ų | 116.6 | 80% | 0.796 | 61% | 0.608 | S | S | * | * | trans | -80 | 93 | 179.6 | -63.4 | -56 | -176.1 | -172.5 | 0 | 109 | L86 D90 | L86-K88 PolarHBondContact O-N 3.3Å; L86-K88 VanDerWaalsContact O-N 3.1Å; K88-D90 PolarHBondContact O-N 2.62Å | ||
| 89 | M | 74.3 | Confident | 70.7 | Confident | 135 Ų | 135 | 118.4 Ų | 118.4 | 67% | 0.665 | 60% | 0.603 | S | S | * | * | trans | -49.7 | 111.3 | 167.7 | -66.9 | -163.8 | 74.9 | 0 | 0 | 109.6 | E87 L91 | E87-M89 PolarHBondContact O-N 3.02Å; E87-M89 VanDerWaalsContact O-N 3.08Å; M89-L91 PolarHBondContact O-N 2.9Å | ||
| 90 | D | 70.2 | Confident | 70.6 | Confident | 80 Ų | 80 | 117.5 Ų | 117.5 | 43% | 0.428 | 60% | 0.604 | S | S | . | * | trans | -84.4 | 102.5 | -175.9 | -158.2 | -30.2 | 0 | 0 | 0 | 110.2 | K88 K92 E93 | K88-D90 PolarHBondContact O-N 2.62Å; D90-K92 VanDerWaalsContact CG-NZ 3.34Å; D90-K92 PolarHBondContact O-N 2.83Å; D90-K92 VanDerWaalsContact O-N 3.13Å; D90-K92 WeakPolarHBondContact OD1-CB 3.43Å; D90-K92 WeakPolarHBondContact OD1-CD 3.27Å; D90-K92 VanDerWaalsContact OD1-CG 3.23Å; D90-K92 WeakPolarHBondContact OD1-CG 2.98Å; D90-K92 PolarHBondContact OD1-N 3.38Å; D90-K92 IonicContact OD1-NZ 3.85Å; D90-K92 WeakPolarHBondContact OD2-CD 3.29Å; D90-K92 IonicContact OD2-NZ 2.65Å; D90-K92 PolarHBondContact OD2-NZ 3.05Å; D90-E93 PolarHBondContact O-N 3.46Å | ||
| 91 | L | 70.4 | Confident | 69.9 | Low | 111 Ų | 111 | 114.8 Ų | 114.8 | 58% | 0.581 | 59% | 0.592 | S | S | * | * | G | 310 helix | trans | -69.6 | -8 | -173.8 | -63.5 | 174.8 | 0 | 0 | 0 | 113.3 | M89 E93 F94 | M89-L91 PolarHBondContact O-N 2.9Å; L91-E93 PolarHBondContact O-N 3.4Å; L91-F94 HydrophobicContact CD2-CD2 4.41Å; L91-F94 PolarHBondContact O-N 3.25Å |
| 92 | K | 68 | Low | 69 | Low | 148 Ų | 148 | 116.1 Ų | 116.1 | 64% | 0.643 | 59% | 0.586 | S | S | * | * | G | 310 helix | trans | -65.2 | -19.2 | 173.8 | 83.3 | -168.9 | -175.3 | -120.9 | 0 | 113.3 | D90 | D90-K92 VanDerWaalsContact CG-NZ 3.34Å; D90-K92 PolarHBondContact O-N 2.83Å; D90-K92 VanDerWaalsContact O-N 3.13Å; D90-K92 WeakPolarHBondContact OD1-CB 3.43Å; D90-K92 WeakPolarHBondContact OD1-CD 3.27Å; D90-K92 VanDerWaalsContact OD1-CG 3.23Å; D90-K92 WeakPolarHBondContact OD1-CG 2.98Å; D90-K92 PolarHBondContact OD1-N 3.38Å; D90-K92 IonicContact OD1-NZ 3.85Å; D90-K92 WeakPolarHBondContact OD2-CD 3.29Å; D90-K92 IonicContact OD2-NZ 2.65Å; D90-K92 PolarHBondContact OD2-NZ 3.05Å |
| 93 | E | 65.9 | Low | 68.1 | Low | 144 Ų | 144 | 120.8 Ų | 120.8 | 67% | 0.673 | 61% | 0.608 | S | S | * | * | G | 310 helix | trans | -92.1 | -3.1 | 179.5 | -73.4 | 155 | -146.2 | 0 | 0 | 112.2 | D90 L91 | D90-E93 PolarHBondContact O-N 3.46Å; L91-E93 PolarHBondContact O-N 3.4Å |
| 94 | F | 69.3 | Low | 67 | Low | 122 Ų | 122 | 121 Ų | 121 | 54% | 0.535 | 61% | 0.609 | S | S | . | * | S | Bend | trans | -93.4 | 103.1 | 164.1 | -81 | -90.8 | 0 | 0 | 0 | 109.5 | L91 F96 | L91-F94 HydrophobicContact CD2-CD2 4.41Å; L91-F94 PolarHBondContact O-N 3.25Å; F94-F96 HydrophobicContact CB-CD2 4.21Å; F94-F96 HydrophobicContact CB-CE2 3.63Å; F94-F96 HydrophobicContact CB-CZ 3.94Å; F94-F96 WeakPolarHBondContact O-CD2 3.47Å; F94-F96 WeakPolarHBondContact O-CE2 3.47Å; F94-F96 PolarHBondContact O-N 2.89Å; F94-F96 VanDerWaalsContact O-N 3.13Å |
| 95 | D | 69.6 | Low | 65.8 | Low | 101 Ų | 101 | 117.6 Ų | 117.6 | 54% | 0.54 | 60% | 0.604 | S | S | . | * | trans | -66.3 | 106.2 | 166.4 | -174.6 | -17.8 | 0 | 0 | 0 | 109.3 | D97 A98 | D95-D97 PolarHBondContact OD1-N 3.27Å; D95-A98 HydrophobicContact CB-CB 4.34Å; D95-A98 VanDerWaalsContact CG-CB 3.47Å; D95-A98 WeakPolarHBondContact OD1-CB 3.49Å; D95-A98 PolarHBondContact OD1-N 3.1Å; D95-A98 WeakPolarHBondContact OD2-CB 3.34Å | ||
| 96 | F | 70 | Confident | 64.9 | Low | 103 Ų | 103 | 120.5 Ų | 120.5 | 45% | 0.452 | 62% | 0.616 | S | S | . | * | S | Bend | trans | -86.7 | -19.5 | 177 | -73 | -82.7 | 0 | 0 | 0 | 112.5 | F94 L99 L100 | F94-F96 HydrophobicContact CB-CD2 4.21Å; F94-F96 HydrophobicContact CB-CE2 3.63Å; F94-F96 HydrophobicContact CB-CZ 3.94Å; F94-F96 WeakPolarHBondContact O-CD2 3.47Å; F94-F96 WeakPolarHBondContact O-CE2 3.47Å; F94-F96 PolarHBondContact O-N 2.89Å; F94-F96 VanDerWaalsContact O-N 3.13Å; F96-L99 HydrophobicContact CD1-CD2 4.31Å; F96-L99 PolarHBondContact O-N 3.3Å; F96-L100 WeakPolarHBondContact O-CG 3.27Å; F96-L100 PolarHBondContact O-N 2.87Å |
| 97 | D | 65.4 | Low | 64.1 | Low | 107 Ų | 107 | 120.6 Ų | 120.6 | 57% | 0.572 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -75.9 | -43.9 | -177.5 | -57.9 | -41.6 | 0 | 0 | 0 | 109.3 | D95 L99 L100 G101 | D95-D97 PolarHBondContact OD1-N 3.27Å; D97-L99 PolarHBondContact O-N 2.88Å; D97-L100 PolarHBondContact O-N 2.96Å; D97-G101 PolarHBondContact O-N 3.02Å |
| 98 | A | 66.1 | Low | 62.7 | Low | 77 Ų | 77 | 117.4 Ų | 117.4 | 64% | 0.636 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -64.9 | -20.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | D95 | D95-A98 HydrophobicContact CB-CB 4.34Å; D95-A98 VanDerWaalsContact CG-CB 3.47Å; D95-A98 WeakPolarHBondContact OD1-CB 3.49Å; D95-A98 PolarHBondContact OD1-N 3.1Å; D95-A98 WeakPolarHBondContact OD2-CB 3.34Å |
| 99 | L | 62.7 | Low | 61.9 | Low | 131 Ų | 131 | 112.1 Ų | 112.1 | 69% | 0.686 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -84.9 | -32.3 | 175.7 | -179.2 | 61.3 | 0 | 0 | 0 | 112.8 | F96 D97 | F96-L99 HydrophobicContact CD1-CD2 4.31Å; F96-L99 PolarHBondContact O-N 3.3Å; D97-L99 PolarHBondContact O-N 2.88Å |
| 100 | L | 60 | Low | 61.1 | Low | 126 Ų | 126 | 111.9 Ų | 111.9 | 66% | 0.66 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -88.6 | -20.5 | 177.6 | -71.1 | 170.7 | 0 | 0 | 0 | 112.9 | F96 D97 I102 | F96-L100 WeakPolarHBondContact O-CG 3.27Å; F96-L100 PolarHBondContact O-N 2.87Å; D97-L100 PolarHBondContact O-N 2.96Å; L100-I102 VanDerWaalsContact C-N 3.27Å; L100-I102 HydrophobicContact CB-CG2 3.99Å; L100-I102 PolarHBondContact O-N 3.28Å |
| 101 | G | 56.6 | Low | 60.6 | Low | 39 Ų | 39 | 114.3 Ų | 114.3 | 40% | 0.402 | 61% | 0.607 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 64.3 | 30.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | D97 D103 D104 | D97-G101 PolarHBondContact O-N 3.02Å; G101-D103 PolarHBondContact O-N 3.4Å; G101-D103 VanDerWaalsContact O-N 3.15Å; G101-D104 PolarHBondContact O-N 3.3Å |
| 102 | I | 55.5 | Low | 59.9 | Low | 82 Ų | 82 | 113.5 Ų | 113.5 | 42% | 0.421 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -61.7 | -23.7 | -171 | 52.2 | 175.4 | 0 | 0 | 0 | 114 | L100 D104 L105 | L100-I102 VanDerWaalsContact C-N 3.27Å; L100-I102 HydrophobicContact CB-CG2 3.99Å; L100-I102 PolarHBondContact O-N 3.28Å; I102-D104 PolarHBondContact O-N 2.89Å; I102-L105 VanDerWaalsContact O-CB 3.23Å; I102-L105 WeakPolarHBondContact O-CB 3.4Å; I102-L105 PolarHBondContact O-N 2.96Å |
| 103 | D | 56.8 | Low | 59.5 | Low | 152 Ų | 152 | 111.7 Ų | 111.7 | 81% | 0.813 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -64.1 | -23.3 | 173.6 | -64.7 | -14.8 | 0 | 0 | 0 | 113.4 | G101 | G101-D103 PolarHBondContact O-N 3.4Å; G101-D103 VanDerWaalsContact O-N 3.15Å |
| 104 | D | 50.7 | Low | 59.1 | Low | 131 Ų | 131 | 109.3 Ų | 109.3 | 70% | 0.701 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -86.3 | -14.9 | 174 | -158.2 | 38.2 | 0 | 0 | 0 | 111.6 | G101 I102 E106 T107 | G101-D104 PolarHBondContact O-N 3.3Å; I102-D104 PolarHBondContact O-N 2.89Å; D104-E106 VanDerWaalsContact C-N 3.33Å; D104-E106 PolarHBondContact O-N 3.06Å; D104-T107 PolarHBondContact O-N 3.07Å |
| 105 | L | 54.3 | Low | 58.5 | Low | 110 Ų | 110 | 107.4 Ų | 107.4 | 58% | 0.576 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -75 | -20.8 | -178.7 | -154.8 | 77 | 0 | 0 | 0 | 112.8 | I102 T107 M108 | I102-L105 VanDerWaalsContact O-CB 3.23Å; I102-L105 WeakPolarHBondContact O-CB 3.4Å; I102-L105 PolarHBondContact O-N 2.96Å; L105-T107 PolarHBondContact O-N 2.94Å; L105-M108 HydrophobicContact CD1-CG 3.54Å; L105-M108 HydrophobicContact CD1-SD 4.01Å; L105-M108 HydrophobicContact CG-CG 3.81Å; L105-M108 WeakPolarHBondContact O-CB 3.34Å; L105-M108 VanDerWaalsContact O-CG 3.26Å; L105-M108 WeakPolarHBondContact O-CG 3.16Å; L105-M108 PolarHBondContact O-N 3.28Å; L105-M108 VanDerWaalsContact O-N 3.17Å |
| 106 | E | 53.3 | Low | 57.8 | Low | 184 Ų | 184 | 108.1 Ų | 108.1 | 86% | 0.86 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.5 | -9 | 170.5 | -69.8 | -158.1 | 139.8 | 0 | 0 | 113.2 | D104 | D104-E106 VanDerWaalsContact C-N 3.33Å; D104-E106 PolarHBondContact O-N 3.06Å |
| 107 | T | 53.2 | Low | 57.2 | Low | 118 Ų | 118 | 109.3 Ų | 109.3 | 72% | 0.724 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | 20.9 | 172.8 | -44.7 | 0 | 0 | 0 | 0 | 112.5 | D104 L105 | D104-T107 PolarHBondContact O-N 3.07Å; L105-T107 PolarHBondContact O-N 2.94Å |
| 108 | M | 50.1 | Low | 56.7 | Low | 82 Ų | 82 | 111.2 Ų | 111.2 | 40% | 0.404 | 62% | 0.618 | S | S | . | * | trans | -65.6 | 130.4 | 170.6 | -77.1 | -64.8 | -62.2 | 0 | 0 | 111.3 | L105 L112 | L105-M108 HydrophobicContact CD1-CG 3.54Å; L105-M108 HydrophobicContact CD1-SD 4.01Å; L105-M108 HydrophobicContact CG-CG 3.81Å; L105-M108 WeakPolarHBondContact O-CB 3.34Å; L105-M108 VanDerWaalsContact O-CG 3.26Å; L105-M108 WeakPolarHBondContact O-CG 3.16Å; L105-M108 PolarHBondContact O-N 3.28Å; L105-M108 VanDerWaalsContact O-N 3.17Å; M108-L112 HydrophobicContact CE-CB 3.99Å; M108-L112 HydrophobicContact CE-CD1 3.85Å; M108-L112 HydrophobicContact CE-CG 4.46Å | ||
| 109 | P | 56.6 | Low | 55.9 | Low | 72 Ų | 72 | 112.5 Ų | 112.5 | 47% | 0.468 | 62% | 0.617 | S | S | . | * | trans | -70 | 132.7 | 175.3 | 28.4 | -33.6 | 0 | 0 | 0 | 110.8 | D111 L112 | P109-D111 PolarHBondContact O-N 3.29Å; P109-L112 PolarHBondContact O-N 2.9Å | ||
| 110 | D | 59.1 | Low | 55.4 | Low | 130 Ų | 130 | 109.8 Ų | 109.8 | 70% | 0.695 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -50.7 | -33.7 | -177.4 | -64.5 | -64 | 0 | 0 | 0 | 113.4 | L112 L113 T114 | D110-L112 PolarHBondContact O-N 2.95Å; D110-L112 VanDerWaalsContact O-N 3.1Å; D110-L113 PolarHBondContact O-N 3.02Å; D110-T114 PolarHBondContact O-N 2.9Å |
| 111 | D | 59.5 | Low | 54.8 | Low | 131 Ų | 131 | 110.8 Ų | 110.8 | 70% | 0.701 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -46.8 | -40.1 | 175.2 | -66.3 | -26.5 | 0 | 0 | 0 | 112.7 | P109 T114 | P109-D111 PolarHBondContact O-N 3.29Å; D111-T114 PolarHBondContact O-OG1 3.38Å |
| 112 | L | 55.1 | Low | 54.5 | Low | 94 Ų | 94 | 116 Ų | 116 | 49% | 0.492 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -76.9 | -31.2 | -176.3 | -117.2 | 164.9 | 0 | 0 | 0 | 112.8 | M108 P109 D110 T114 T115 L116 | M108-L112 HydrophobicContact CE-CB 3.99Å; M108-L112 HydrophobicContact CE-CD1 3.85Å; M108-L112 HydrophobicContact CE-CG 4.46Å; P109-L112 PolarHBondContact O-N 2.9Å; D110-L112 PolarHBondContact O-N 2.95Å; D110-L112 VanDerWaalsContact O-N 3.1Å; L112-T114 VanDerWaalsContact C-N 3.33Å; L112-T114 PolarHBondContact O-N 2.9Å; L112-T115 PolarHBondContact O-N 3.38Å; L112-T115 PolarHBondContact O-OG1 3.44Å; L112-L116 PolarHBondContact O-N 3.38Å |
| 113 | L | 59.6 | Low | 54 | Low | 109 Ų | 109 | 120.9 Ų | 120.9 | 57% | 0.571 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -63.7 | -39.9 | 174.3 | -71.7 | 169.4 | 0 | 0 | 0 | 111 | D110 T115 L116 D117 | D110-L113 PolarHBondContact O-N 3.02Å; L113-T115 VanDerWaalsContact C-N 3.25Å; L113-T115 PolarHBondContact O-N 3.01Å; L113-L116 PolarHBondContact O-N 3.01Å; L113-L116 VanDerWaalsContact O-N 3.08Å; L113-D117 PolarHBondContact O-N 3.15Å; L113-D117 VanDerWaalsContact O-N 3.13Å |
| 114 | T | 58.3 | Low | 53.4 | Low | 95 Ų | 95 | 117.7 Ų | 117.7 | 58% | 0.583 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -60.4 | -33.3 | 178.2 | 72 | 0 | 0 | 0 | 0 | 113.2 | D110 D111 L112 D118 | D110-T114 PolarHBondContact O-N 2.9Å; D111-T114 PolarHBondContact O-OG1 3.38Å; L112-T114 VanDerWaalsContact C-N 3.33Å; L112-T114 PolarHBondContact O-N 2.9Å; T114-D118 PolarHBondContact O-N 2.85Å |
| 115 | T | 56.6 | Low | 52.8 | Low | 82 Ų | 82 | 117.5 Ų | 117.5 | 50% | 0.503 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -77 | -20.6 | 178.1 | 65.4 | 0 | 0 | 0 | 0 | 114 | L112 L113 T119 | L112-T115 PolarHBondContact O-N 3.38Å; L112-T115 PolarHBondContact O-OG1 3.44Å; L113-T115 VanDerWaalsContact C-N 3.25Å; L113-T115 PolarHBondContact O-N 3.01Å; T115-T119 PolarHBondContact O-OG1 3.09Å; T115-T119 VanDerWaalsContact O-OG1 3.08Å |
| 116 | L | 54.1 | Low | 52 | Low | 115 Ų | 115 | 120 Ų | 120 | 60% | 0.602 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -86.7 | -36.1 | 179.1 | -159.5 | 146.3 | 0 | 0 | 0 | 111 | L112 L113 T119 C120 | L112-L116 PolarHBondContact O-N 3.38Å; L113-L116 PolarHBondContact O-N 3.01Å; L113-L116 VanDerWaalsContact O-N 3.08Å; L116-T119 WeakPolarHBondContact O-CB 3.41Å; L116-T119 PolarHBondContact O-N 3.5Å; L116-T119 VanDerWaalsContact O-N 3.12Å; L116-C120 PolarHBondContact O-SG 2.89Å; L116-C120 VanDerWaalsContact O-SG 3.38Å |
| 117 | D | 56.8 | Low | 51.1 | Low | 128 Ų | 128 | 116.2 Ų | 116.2 | 68% | 0.684 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -62.2 | -44.2 | 175.4 | -152.7 | 49 | 0 | 0 | 0 | 111.9 | L113 T119 C120 | L113-D117 PolarHBondContact O-N 3.15Å; L113-D117 VanDerWaalsContact O-N 3.13Å; D117-T119 PolarHBondContact O-N 3.13Å; D117-C120 WeakPolarHBondContact O-CB 3.35Å; D117-C120 PolarHBondContact O-N 3.09Å |
| 118 | D | 55.7 | Low | 50.1 | Low | 148 Ų | 148 | 118.2 Ų | 118.2 | 79% | 0.791 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -12.9 | 174.8 | -161.4 | 52.5 | 0 | 0 | 0 | 113.5 | T114 | T114-D118 PolarHBondContact O-N 2.85Š|
| 119 | T | 50.4 | Low | 49.3 | Very low | 103 Ų | 103 | 122.5 Ų | 122.5 | 63% | 0.632 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.2 | -13 | 176.3 | -53.5 | 0 | 0 | 0 | 0 | 112.9 | T115 L116 D117 | T115-T119 PolarHBondContact O-OG1 3.09Å; T115-T119 VanDerWaalsContact O-OG1 3.08Å; L116-T119 WeakPolarHBondContact O-CB 3.41Å; L116-T119 PolarHBondContact O-N 3.5Å; L116-T119 VanDerWaalsContact O-N 3.12Å; D117-T119 PolarHBondContact O-N 3.13Å |
| 120 | C | 51.2 | Low | 48.1 | Very low | 75 Ų | 75 | 124.1 Ų | 124.1 | 51% | 0.507 | 68% | 0.683 | S | S | . | * | G | 310 helix | trans | -81.2 | -13.3 | -171.7 | -74.9 | 0 | 0 | 0 | 0 | 115.2 | L116 D117 L122 | L116-C120 PolarHBondContact O-SG 2.89Å; L116-C120 VanDerWaalsContact O-SG 3.38Å; D117-C120 WeakPolarHBondContact O-CB 3.35Å; D117-C120 PolarHBondContact O-N 3.09Å; C120-L122 PolarHBondContact O-N 3.31Å |
| 121 | D | 47.3 | Very low | 46.6 | Very low | 146 Ų | 146 | 123.5 Ų | 123.5 | 78% | 0.781 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -73.1 | 2.8 | -174 | -152.1 | 30.1 | 0 | 0 | 0 | 114.5 | F123 | D121-F123 VanDerWaalsContact C-N 3.3Å; D121-F123 PolarHBondContact O-N 2.87Å |
| 122 | L | 49.6 | Very low | 45.4 | Very low | 149 Ų | 149 | 126.7 Ų | 126.7 | 78% | 0.78 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -77.4 | -8.2 | -177.7 | -165.3 | 59.1 | 0 | 0 | 0 | 114.3 | C120 | C120-L122 PolarHBondContact O-N 3.31Š|
| 123 | F | 45.7 | Very low | 44.3 | Very low | 185 Ų | 185 | 130.9 Ų | 130.9 | 81% | 0.811 | 70% | 0.704 | S | S | * | * | G | 310 helix | trans | -117.8 | 43.5 | -175 | -74.7 | -74.8 | 0 | 0 | 0 | 114.4 | D121 P125 | D121-F123 VanDerWaalsContact C-N 3.3Å; D121-F123 PolarHBondContact O-N 2.87Å; F123-P125 VanDerWaalsContact O-CD 3.25Å; F123-P125 WeakPolarHBondContact O-CD 3.35Å |
| 124 | A | 44.5 | Very low | 44 | Very low | 84 Ų | 84 | 130.3 Ų | 130.3 | 69% | 0.694 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 118.2 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 125 | P | 38.4 | Very low | 43.5 | Very low | 127 Ų | 127 | 130.3 Ų | 130.3 | 83% | 0.825 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 131.6 | 173.1 | -13.8 | 31.6 | 0 | 0 | 0 | 111.3 | F123 | F123-P125 VanDerWaalsContact O-CD 3.25Å; F123-P125 WeakPolarHBondContact O-CD 3.35Å |
| 126 | L | 36.8 | Very low | 42.3 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 85% | 0.853 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -73 | 157.6 | 171.6 | -171.3 | 68.6 | 0 | 0 | 0 | 111 | ||
| 127 | V | 33.9 | Very low | 41.1 | Very low | 104 Ų | 104 | 134.8 Ų | 134.8 | 63% | 0.63 | 73% | 0.729 | S | S | * | * | trans | 103.9 | 91 | 161.8 | -171.5 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 128 | Q | 34 | Very low | 39.8 | Very low | 161 Ų | 161 | 134.6 Ų | 134.6 | 75% | 0.752 | 73% | 0.732 | S | S | * | * | 65.3 | 130.7 | 129 | -65.4 | 176.9 | -37 | 0 | 0 | 123.3 | |||||
| 129 | E | 31.9 | Very low | 38.6 | Very low | 172 Ų | 172 | 134.6 Ų | 134.6 | 80% | 0.804 | 73% | 0.732 | S | S | * | * | trans | 66.1 | 139.7 | 139.3 | -70.7 | -160.3 | 98.7 | 0 | 0 | 119.3 | ||||
| 130 | T | 30.8 | Very low | 38.9 | Very low | 105 Ų | 105 | 134.2 Ų | 134.2 | 64% | 0.644 | 73% | 0.731 | S | S | * | * | cis | -157.4 | 169.2 | 19.3 | -168.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 131 | N | 28.5 | Very low | 37.9 | Very low | 118 Ų | 118 | 138.5 Ų | 138.5 | 63% | 0.631 | 75% | 0.748 | S | S | * | * | trans | 77.5 | 115.5 | 154.3 | -87.3 | -69.2 | 0 | 0 | 0 | 123.2 | ||||
| 132 | K | 34.9 | Very low | 37 | Very low | 197 Ų | 197 | 134.6 Ų | 134.6 | 86% | 0.857 | 74% | 0.742 | S | S | * | * | trans | 95 | 136.5 | 142 | -58.5 | -71.9 | 172.7 | 178.3 | 0 | 119.6 | ||||
| 133 | E | 31.3 | Very low | 36 | Very low | 183 Ų | 183 | 136.5 Ų | 136.5 | 86% | 0.855 | 75% | 0.746 | S | S | * | * | trans | -115.1 | -174.1 | -170.7 | -135.5 | -152.6 | 111.1 | 0 | 0 | 110 | ||||
| 134 | P | 54.3 | Low | 35.5 | Very low | 97 Ų | 97 | 135 Ų | 135 | 63% | 0.63 | 75% | 0.746 | S | S | * | * | -114.8 | -146 | -126.1 | 38.4 | -15.2 | 0 | 0 | 0 | 111.1 | |||||
| 135 | P | 47.5 | Very low | 35.9 | Very low | 94 Ų | 94 | 135.8 Ų | 135.8 | 61% | 0.61 | 74% | 0.744 | S | S | * | * | -151.6 | 153 | 56.6 | 39.8 | -17.8 | 0 | 0 | 0 | 119.3 | |||||
| 136 | Q | 30.3 | Very low | 35.5 | Very low | 175 Ų | 175 | 137.7 Ų | 137.7 | 82% | 0.818 | 74% | 0.742 | S | S | * | * | trans | 63.9 | 169.1 | 143.7 | -61.1 | 163.7 | 8.7 | 0 | 0 | 117.3 | ||||
| 137 | T | 29.5 | Very low | 35.4 | Very low | 117 Ų | 117 | 134.6 Ų | 134.6 | 72% | 0.718 | 73% | 0.734 | S | S | * | * | cis | -153.3 | 135 | 16.9 | -32.7 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 138 | V | 28.8 | Very low | 35.3 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 75% | 0.752 | 74% | 0.741 | S | S | * | * | trans | 19 | 117.2 | 144.7 | -166.7 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 139 | N | 31.3 | Very low | 35 | Very low | 148 Ų | 148 | 135.2 Ų | 135.2 | 79% | 0.791 | 74% | 0.743 | S | S | * | * | 24.5 | 165.5 | 116.7 | -79.9 | -19.9 | 0 | 0 | 0 | 121.8 | |||||
| 140 | P | 55.9 | Low | 35.4 | Very low | 95 Ų | 95 | 136.5 Ų | 136.5 | 62% | 0.617 | 75% | 0.746 | S | S | * | * | cis | -145.5 | -165.7 | -33.1 | 42.6 | -23.6 | 0 | 0 | 0 | 114.2 | ||||
| 141 | I | 31.3 | Very low | 36.1 | Very low | 165 Ų | 165 | 136.9 Ų | 136.9 | 85% | 0.846 | 75% | 0.75 | S | S | * | * | trans | 68.2 | 131.4 | 157.1 | -62.4 | 166.7 | 0 | 0 | 0 | 118.9 | ||||
| 142 | G | 27.2 | Very low | 36.2 | Very low | 64 Ų | 64 | 136.8 Ų | 136.8 | 66% | 0.66 | 75% | 0.75 | S | S | * | * | trans | 165.9 | 92.8 | 157.8 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 143 | H | 30.4 | Very low | 36.6 | Very low | 188 Ų | 188 | 135.4 Ų | 135.4 | 87% | 0.87 | 75% | 0.746 | S | S | * | * | trans | 54.3 | 117.8 | 140.4 | -81.4 | -82.2 | 0 | 0 | 0 | 125.6 | ||||
| 144 | L | 34.1 | Very low | 36.8 | Very low | 153 Ų | 153 | 133.4 Ų | 133.4 | 80% | 0.801 | 75% | 0.746 | S | S | * | * | trans | -73.4 | 175.2 | 133.7 | -86.8 | 166.7 | 0 | 0 | 0 | 110.8 | ||||
| 145 | P | 53.8 | Low | 35.9 | Very low | 102 Ų | 102 | 132.7 Ų | 132.7 | 66% | 0.662 | 75% | 0.749 | S | S | * | * | cis | -128.5 | -151 | 7.3 | 37.1 | -13.1 | 0 | 0 | 0 | 111.9 | ||||
| 146 | E | 28.6 | Very low | 36.1 | Very low | 166 Ų | 166 | 133.4 Ų | 133.4 | 78% | 0.776 | 75% | 0.753 | S | S | * | * | cis | -161.1 | 156 | 1.3 | -151.8 | 176.4 | 118.2 | 0 | 0 | 113.2 | ||||
| 147 | S | 34.3 | Very low | 36.3 | Very low | 99 Ų | 99 | 135.3 Ų | 135.3 | 69% | 0.692 | 76% | 0.759 | S | S | * | * | trans | 68.6 | 166.1 | 156.5 | 81.9 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 148 | L | 32.1 | Very low | 36.7 | Very low | 148 Ų | 148 | 135.6 Ų | 135.6 | 78% | 0.775 | 76% | 0.761 | S | S | * | * | cis | -151.1 | 129.4 | 7.4 | -170.5 | 67.6 | 0 | 0 | 0 | 108.8 | ||||
| 149 | T | 29.4 | Very low | 37 | Very low | 129 Ų | 129 | 138.8 Ų | 138.8 | 79% | 0.791 | 77% | 0.765 | S | S | * | * | -169.7 | 163.2 | 92 | 31.3 | 0 | 0 | 0 | 0 | 113 | |||||
| 150 | K | 38.3 | Very low | 37.4 | Very low | 199 Ų | 199 | 138.6 Ų | 138.6 | 87% | 0.865 | 76% | 0.763 | S | S | * | * | trans | -138.5 | -177.3 | 174.8 | -67.4 | -175.8 | 179.2 | -179.4 | 0 | 107.3 | ||||
| 151 | P | 46.8 | Very low | 36.7 | Very low | 113 Ų | 113 | 141.2 Ų | 141.2 | 73% | 0.734 | 77% | 0.767 | S | S | * | * | cis | -118.8 | -158 | -7 | 39.5 | -20 | 0 | 0 | 0 | 110.9 | ||||
| 152 | D | 30.7 | Very low | 37 | Very low | 117 Ų | 117 | 139.4 Ų | 139.4 | 63% | 0.626 | 77% | 0.766 | S | S | * | * | cis | -153.7 | 133.2 | 13.3 | -136.5 | 6.4 | 0 | 0 | 0 | 108 | ||||
| 153 | Q | 43.3 | Very low | 37.3 | Very low | 168 Ų | 168 | 143.2 Ų | 143.2 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | 48.2 | 140.9 | 94.7 | -50.3 | -171.7 | 106 | 0 | 0 | 115.3 | |||||
| 154 | V | 34.5 | Very low | 38 | Very low | 141 Ų | 141 | 140.1 Ų | 140.1 | 86% | 0.855 | 77% | 0.767 | S | S | * | * | cis | -140 | 159.7 | 29.1 | -179.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 155 | A | 36.8 | Very low | 37.9 | Very low | 82 Ų | 82 | 141.4 Ų | 141.4 | 68% | 0.678 | 77% | 0.774 | S | S | * | * | trans | -107.8 | -153.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 156 | P | 50.4 | Low | 37.3 | Very low | 108 Ų | 108 | 141.4 Ų | 141.4 | 70% | 0.701 | 78% | 0.777 | S | S | * | * | cis | -122.3 | 171.7 | -33.7 | 39.3 | -26.2 | 0 | 0 | 0 | 112.3 | ||||
| 157 | F | 34 | Very low | 38.1 | Very low | 215 Ų | 215 | 139.6 Ų | 139.6 | 94% | 0.943 | 78% | 0.779 | S | S | * | * | trans | -137.5 | 113.4 | 164.7 | -83.6 | -75.8 | 0 | 0 | 0 | 113.5 | ||||
| 158 | T | 39.5 | Very low | 38.1 | Very low | 123 Ų | 123 | 137.7 Ų | 137.7 | 76% | 0.755 | 78% | 0.775 | S | S | * | * | trans | -102.4 | 134.9 | 149.8 | 46 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 159 | F | 33.9 | Very low | 38.3 | Very low | 192 Ų | 192 | 137.2 Ų | 137.2 | 84% | 0.842 | 78% | 0.778 | S | S | * | * | trans | -174.8 | 174.6 | 130.7 | -120.1 | -101 | 0 | 0 | 0 | 111.7 | ||||
| 160 | L | 39.2 | Very low | 38.7 | Very low | 143 Ų | 143 | 138.2 Ų | 138.2 | 75% | 0.749 | 78% | 0.778 | S | S | * | * | trans | -74.8 | 164.1 | -163.1 | -57.5 | 165.3 | 0 | 0 | 0 | 115.6 | ||||
| 161 | Q | 41.9 | Very low | 38.7 | Very low | 150 Ų | 150 | 133.7 Ų | 133.7 | 70% | 0.701 | 77% | 0.771 | S | S | * | * | trans | 78.4 | 126.5 | 143 | -170.5 | 178.5 | 1.2 | 0 | 0 | 119.8 | ||||
| 162 | P | 38.2 | Very low | 38 | Very low | 127 Ų | 127 | 133.8 Ų | 133.8 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | trans | -101 | 137.2 | 152.8 | 33 | -23.3 | 0 | 0 | 0 | 112 | ||||
| 163 | L | 32.8 | Very low | 38.4 | Very low | 144 Ų | 144 | 134.4 Ų | 134.4 | 75% | 0.754 | 78% | 0.783 | S | S | * | * | trans | -130 | 139 | 165.4 | -154.1 | 71.5 | 0 | 0 | 0 | 106.7 | ||||
| 164 | P | 45 | Very low | 38.3 | Very low | 123 Ų | 123 | 132.2 Ų | 132.2 | 80% | 0.799 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 152.7 | -162.1 | 31.4 | -36.3 | 0 | 0 | 0 | 114.1 | ||
| 165 | L | 32.2 | Very low | 38.7 | Very low | 180 Ų | 180 | 132.1 Ų | 132.1 | 94% | 0.942 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -93.4 | 134.6 | 167.1 | -81.3 | 163.6 | 0 | 0 | 0 | 110.7 | ||
| 166 | S | 41.1 | Very low | 39 | Very low | 103 Ų | 103 | 137.1 Ų | 137.1 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 161.8 | -179.9 | -179.2 | 0 | 0 | 0 | 0 | 111.7 | G168 | S166-G168 PolarHBondContact OG-N 2.86Š|
| 167 | P | 45.6 | Very low | 38.6 | Very low | 127 Ų | 127 | 137 Ų | 137 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | -125.1 | 136.5 | 120.5 | 2.7 | 17.9 | 0 | 0 | 0 | 112.9 | |||||
| 168 | G | 34.5 | Very low | 38.8 | Very low | 60 Ų | 60 | 135.6 Ų | 135.6 | 62% | 0.619 | 78% | 0.783 | S | S | * | * | trans | -77.9 | 152.8 | 161.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | S166 | S166-G168 PolarHBondContact OG-N 2.86Š| ||
| 169 | V | 35.4 | Very low | 39.1 | Very low | 138 Ų | 138 | 134.3 Ų | 134.3 | 84% | 0.836 | 78% | 0.779 | S | S | * | * | 173.5 | 138.3 | 91.2 | 150.5 | 0 | 0 | 0 | 0 | 106.1 | |||||
| 170 | L | 39 | Very low | 39.9 | Very low | 149 Ų | 149 | 132.4 Ų | 132.4 | 78% | 0.78 | 78% | 0.776 | S | S | * | * | cis | -156.9 | 178.2 | -4.2 | -121 | 177.7 | 0 | 0 | 0 | 110.3 | ||||
| 171 | S | 36.9 | Very low | 40.1 | Very low | 105 Ų | 105 | 134.9 Ų | 134.9 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | trans | 49.7 | 107.9 | 154.7 | 63.2 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 172 | S | 32.9 | Very low | 40.8 | Very low | 114 Ų | 114 | 135.8 Ų | 135.8 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | -175.2 | 135.7 | 105.2 | -168.7 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 173 | T | 40.3 | Very low | 41 | Very low | 131 Ų | 131 | 133.1 Ų | 133.1 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -100.6 | 133.7 | 170.8 | 49.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 174 | P | 39.8 | Very low | 41.9 | Very low | 121 Ų | 121 | 131.3 Ų | 131.3 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | -135.5 | 119.5 | 121.1 | 18.3 | 1.6 | 0 | 0 | 0 | 112.2 | |||||
| 175 | D | 43.4 | Very low | 42 | Very low | 139 Ų | 139 | 134.5 Ų | 134.5 | 74% | 0.743 | 79% | 0.792 | S | S | * | * | trans | -69.2 | 153.3 | 146.9 | -92.1 | -59.5 | 0 | 0 | 0 | 109 | ||||
| 176 | H | 42.4 | Very low | 42.6 | Very low | 187 Ų | 187 | 131.5 Ų | 131.5 | 87% | 0.866 | 78% | 0.781 | S | S | * | * | 176.5 | 131.1 | 121 | -80.7 | -28.5 | 0 | 0 | 0 | 111.8 | |||||
| 177 | S | 41.9 | Very low | 43.2 | Very low | 106 Ų | 106 | 132.9 Ų | 132.9 | 74% | 0.741 | 78% | 0.78 | S | S | * | * | trans | -34.5 | 128.8 | 179.5 | -169 | 0 | 0 | 0 | 0 | 116.8 | S179 | S177-S179 PolarHBondContact O-N 2.83Š| ||
| 178 | F | 39.2 | Very low | 43.2 | Very low | 186 Ų | 186 | 134 Ų | 134 | 82% | 0.816 | 78% | 0.778 | S | S | * | * | trans | -76.2 | 100 | 165.6 | -178.5 | -95.8 | 0 | 0 | 0 | 110 | L180 | F178-L180 HydrophobicContact CE1-CD2 3.78Å; F178-L180 HydrophobicContact CZ-CD2 4.47Å | ||
| 179 | S | 45.1 | Very low | 44 | Very low | 96 Ų | 96 | 137.4 Ų | 137.4 | 67% | 0.671 | 79% | 0.786 | S | S | * | * | trans | -90.2 | 138.1 | 171.5 | -69 | 0 | 0 | 0 | 0 | 110.7 | S177 E181 | S177-S179 PolarHBondContact O-N 2.83Å; S179-E181 PolarHBondContact O-N 3.11Å | ||
| 180 | L | 51 | Low | 44.3 | Very low | 152 Ų | 152 | 140.2 Ų | 140.2 | 80% | 0.796 | 79% | 0.79 | S | S | * | * | trans | -76.6 | 112.9 | 173.8 | -68 | 168.4 | 0 | 0 | 0 | 109.8 | F178 L182 | F178-L180 HydrophobicContact CE1-CD2 3.78Å; F178-L180 HydrophobicContact CZ-CD2 4.47Å; L180-L182 PolarHBondContact O-N 3.35Å | ||
| 181 | E | 42.8 | Very low | 44.2 | Very low | 195 Ų | 195 | 136.7 Ų | 136.7 | 91% | 0.911 | 79% | 0.79 | S | S | * | * | trans | -78.7 | 100.3 | 174.9 | -169.4 | 164.3 | -150.8 | 0 | 0 | 109.9 | S179 | S179-E181 PolarHBondContact O-N 3.11Š| ||
| 182 | L | 58 | Low | 44.2 | Very low | 169 Ų | 169 | 137.4 Ų | 137.4 | 89% | 0.885 | 79% | 0.786 | S | S | * | * | trans | -87.6 | 128.8 | 175.1 | -155.3 | 74.5 | 0 | 0 | 0 | 109 | L180 | L180-L182 PolarHBondContact O-N 3.35Š| ||
| 183 | G | 41.6 | Very low | 44.5 | Very low | 71 Ų | 71 | 141.7 Ų | 141.7 | 73% | 0.732 | 78% | 0.784 | S | S | * | * | trans | -72.3 | 132.2 | -160.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 184 | S | 51.1 | Low | 44.8 | Very low | 105 Ų | 105 | 144.9 Ų | 144.9 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | trans | 46.9 | 83.9 | 141.5 | -173.6 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 185 | E | 47.1 | Very low | 45.5 | Very low | 190 Ų | 190 | 144.1 Ų | 144.1 | 89% | 0.888 | 78% | 0.782 | S | S | * | * | trans | -69.2 | 123.9 | 157.1 | -170.1 | 170.6 | 150.7 | 0 | 0 | 109.6 | ||||
| 186 | V | 45.8 | Very low | 45 | Very low | 118 Ų | 118 | 145.1 Ų | 145.1 | 72% | 0.715 | 79% | 0.788 | S | S | * | * | trans | -101.5 | 102.3 | 178.3 | 178.5 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 187 | D | 53.3 | Low | 44.9 | Very low | 132 Ų | 132 | 140 Ų | 140 | 71% | 0.706 | 78% | 0.778 | S | S | * | * | trans | -85.2 | 130.9 | -179.9 | -164.3 | 10.3 | 0 | 0 | 0 | 111.2 | ||||
| 188 | I | 46.3 | Very low | 44.6 | Very low | 151 Ų | 151 | 141.1 Ų | 141.1 | 77% | 0.774 | 78% | 0.78 | S | S | * | * | trans | -106.8 | 112.8 | -176.9 | -59.1 | 176.6 | 0 | 0 | 0 | 108.8 | ||||
| 189 | T | 51 | Low | 44.3 | Very low | 130 Ų | 130 | 136.6 Ų | 136.6 | 80% | 0.798 | 78% | 0.777 | S | S | * | * | trans | -126.3 | 145.3 | 170.4 | 47.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 190 | E | 42 | Very low | 43.9 | Very low | 197 Ų | 197 | 142.9 Ų | 142.9 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | trans | -124.3 | 138.3 | -162.1 | -178.2 | -173.9 | 169.5 | 0 | 0 | 111.7 | ||||
| 191 | G | 36.1 | Very low | 43.1 | Very low | 75 Ų | 75 | 141.1 Ų | 141.1 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | trans | 81.7 | 166.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 192 | D | 36 | Very low | 42.8 | Very low | 121 Ų | 121 | 136.4 Ų | 136.4 | 65% | 0.647 | 78% | 0.777 | S | S | * | * | cis | -156.8 | 151.1 | -11 | -179.1 | 26.1 | 0 | 0 | 0 | 110.3 | ||||
| 193 | R | 40.6 | Very low | 41.7 | Very low | 203 Ų | 203 | 136.4 Ų | 136.4 | 77% | 0.766 | 78% | 0.775 | S | S | * | * | trans | 36.2 | 106.4 | 163.7 | 68 | -169 | -166.1 | -98.3 | -4.1 | 122 | ||||
| 194 | K | 45.4 | Very low | 41.8 | Very low | 199 Ų | 199 | 140.8 Ų | 140.8 | 87% | 0.865 | 78% | 0.78 | S | S | * | * | 32.4 | 152.4 | 109.3 | -127.3 | -157.7 | 175.5 | -178.2 | 0 | 120 | |||||
| 195 | P | 54.5 | Low | 42 | Very low | 104 Ų | 104 | 141 Ų | 141 | 68% | 0.675 | 78% | 0.779 | S | S | * | * | -132.5 | 176.2 | -69.3 | 42.8 | -29.2 | 0 | 0 | 0 | 113.1 | |||||
| 196 | D | 34.1 | Very low | 41.9 | Very low | 161 Ų | 161 | 137.2 Ų | 137.2 | 86% | 0.861 | 77% | 0.77 | S | S | * | * | trans | -162.8 | 161.5 | 142.5 | -131.7 | -28.7 | 0 | 0 | 0 | 115.5 | ||||
| 197 | A | 40 | Very low | 41.2 | Very low | 80 Ų | 80 | 137.1 Ų | 137.1 | 66% | 0.661 | 77% | 0.774 | S | S | * | * | trans | 10.6 | 151.5 | 159.1 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 198 | T | 34.5 | Very low | 40.5 | Very low | 129 Ų | 129 | 137.9 Ų | 137.9 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | cis | -174.1 | 152.8 | -8.9 | -96.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 199 | A | 34.1 | Very low | 40.1 | Very low | 90 Ų | 90 | 138 Ų | 138 | 74% | 0.744 | 77% | 0.771 | S | S | * | * | trans | 70.3 | 153.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 200 | Y | 36.6 | Very low | 39.4 | Very low | 228 Ų | 228 | 138.7 Ų | 138.7 | 89% | 0.894 | 77% | 0.765 | S | S | * | * | cis | -129.1 | 170.7 | 17.3 | -155.7 | -96.1 | 0 | 0 | 0 | 113.3 | ||||
| 201 | V | 33.7 | Very low | 39.3 | Very low | 116 Ų | 116 | 137.4 Ų | 137.4 | 70% | 0.703 | 76% | 0.759 | S | S | * | * | trans | -100.4 | 134.6 | -169.3 | 174.4 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 202 | A | 36.5 | Very low | 39.3 | Very low | 95 Ų | 95 | 141.3 Ų | 141.3 | 79% | 0.785 | 76% | 0.762 | S | S | * | * | trans | -147.5 | 125.3 | 162 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 203 | M | 36.2 | Very low | 40.1 | Very low | 170 Ų | 170 | 140.4 Ų | 140.4 | 84% | 0.837 | 76% | 0.762 | S | S | * | * | trans | -67.5 | 140.9 | -166.1 | -53 | -74.8 | -76.2 | 0 | 0 | 115.8 | ||||
| 204 | I | 43.2 | Very low | 40.5 | Very low | 162 Ų | 162 | 137.3 Ų | 137.3 | 83% | 0.831 | 77% | 0.768 | S | S | * | * | trans | -140.8 | 137.7 | 153.6 | -28.1 | 175.9 | 0 | 0 | 0 | 107.2 | ||||
| 205 | P | 54.6 | Low | 40.7 | Very low | 110 Ų | 110 | 132.9 Ų | 132.9 | 71% | 0.714 | 76% | 0.762 | S | S | * | * | -150.5 | -176.3 | 106.2 | 42.2 | -24.8 | 0 | 0 | 0 | 112 | |||||
| 206 | P | 46.1 | Very low | 40.4 | Very low | 110 Ų | 110 | 134.5 Ų | 134.5 | 71% | 0.714 | 77% | 0.765 | S | S | * | * | cis | -139.2 | 169.3 | 9.8 | 43.8 | -26.7 | 0 | 0 | 0 | 118.5 | ||||
| 207 | C | 29.9 | Very low | 41 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 78% | 0.784 | 76% | 0.758 | S | S | * | * | trans | 71.6 | 141.3 | 154.9 | -68.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 208 | I | 38.3 | Very low | 41.4 | Very low | 149 Ų | 149 | 136 Ų | 136 | 76% | 0.764 | 76% | 0.761 | S | S | * | * | cis | -152.8 | 147.9 | 1.8 | 16.6 | 175.5 | 0 | 0 | 0 | 111.4 | ||||
| 209 | K | 38.3 | Very low | 42.4 | Very low | 154 Ų | 154 | 134 Ų | 134 | 67% | 0.67 | 75% | 0.753 | S | S | * | * | trans | 41.6 | 113.9 | 145.4 | -73.5 | -166.6 | 163 | -74.8 | 0 | 119.5 | ||||
| 210 | E | 36.3 | Very low | 42.8 | Very low | 143 Ų | 143 | 132.7 Ų | 132.7 | 67% | 0.668 | 75% | 0.749 | S | S | * | * | 80.7 | 143 | 94.5 | -75.8 | 159.9 | -155 | 0 | 0 | 113.2 | |||||
| 211 | E | 40.9 | Very low | 42.9 | Very low | 170 Ų | 170 | 129.4 Ų | 129.4 | 79% | 0.794 | 75% | 0.745 | S | S | * | * | cis | -150.8 | 149 | -0.9 | -178.1 | 167.6 | 112.8 | 0 | 0 | 107.6 | ||||
| 212 | D | 36.4 | Very low | 43.4 | Very low | 157 Ų | 157 | 129.3 Ų | 129.3 | 84% | 0.84 | 75% | 0.748 | S | S | * | * | trans | -123.7 | 129.2 | -173.2 | -148.9 | -21.5 | 0 | 0 | 0 | 111.2 | ||||
| 213 | T | 51.3 | Low | 44 | Very low | 103 Ų | 103 | 133.1 Ų | 133.1 | 63% | 0.632 | 75% | 0.752 | S | S | * | * | trans | -139.4 | 121.3 | -178.5 | 57.3 | 0 | 0 | 0 | 0 | 110.9 | S215 | T213-S215 PolarHBondContact O-N 3.1Š| ||
| 214 | P | 49.8 | Very low | 44.4 | Very low | 137 Ų | 137 | 129.7 Ų | 129.7 | 89% | 0.89 | 75% | 0.745 | S | S | * | * | trans | -77.6 | 110.8 | -179.6 | 30.3 | -32.9 | 0 | 0 | 0 | 110.7 | ||||
| 215 | S | 48.7 | Very low | 44.7 | Very low | 106 Ų | 106 | 127.8 Ų | 127.8 | 74% | 0.741 | 74% | 0.743 | S | S | * | * | trans | -103.3 | 108.1 | 169.6 | -171.4 | 0 | 0 | 0 | 0 | 110.3 | T213 | T213-S215 PolarHBondContact O-N 3.1Š| ||
| 216 | D | 48 | Very low | 43.7 | Very low | 138 Ų | 138 | 130.9 Ų | 130.9 | 74% | 0.738 | 75% | 0.748 | S | S | * | * | trans | -56.8 | 141.6 | 163.8 | -178.7 | 13.4 | 0 | 0 | 0 | 110.8 | D218 | D216-D218 PolarHBondContact OD1-N 2.93Š| ||
| 217 | N | 47.8 | Very low | 43.5 | Very low | 135 Ų | 135 | 130.8 Ų | 130.8 | 72% | 0.722 | 75% | 0.75 | S | S | * | * | trans | -164 | 74.3 | 164.8 | -119.9 | -107.1 | 0 | 0 | 0 | 110.7 | ||||
| 218 | D | 47.5 | Very low | 44 | Very low | 137 Ų | 137 | 136.3 Ų | 136.3 | 73% | 0.733 | 76% | 0.756 | S | S | * | * | trans | -57.4 | 141.5 | 148.8 | 179.5 | 19.8 | 0 | 0 | 0 | 109.4 | D216 G220 | D216-D218 PolarHBondContact OD1-N 2.93Å; D218-G220 PolarHBondContact OD1-N 3.46Å; D218-G220 VanDerWaalsContact OD1-N 3.12Å | ||
| 219 | S | 55.2 | Low | 44.1 | Very low | 87 Ų | 87 | 137.9 Ų | 137.9 | 61% | 0.608 | 76% | 0.764 | S | S | * | * | trans | -156.3 | 57.9 | 173.4 | -82.4 | 0 | 0 | 0 | 0 | 110.7 | I221 | S219-I221 PolarHBondContact O-N 2.87Š| ||
| 220 | G | 44.4 | Very low | 43.8 | Very low | 64 Ų | 64 | 133.8 Ų | 133.8 | 66% | 0.66 | 77% | 0.766 | S | S | * | * | trans | -57.2 | 103.8 | 162.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | D218 C222 | D218-G220 PolarHBondContact OD1-N 3.46Å; D218-G220 VanDerWaalsContact OD1-N 3.12Å; G220-C222 VanDerWaalsContact C-N 3.32Å; G220-C222 PolarHBondContact O-N 3.45Å | ||
| 221 | I | 38.6 | Very low | 44 | Very low | 159 Ų | 159 | 132.4 Ų | 132.4 | 82% | 0.815 | 77% | 0.772 | S | S | * | * | trans | -72.3 | 85 | -177.2 | -57.6 | 177.6 | 0 | 0 | 0 | 110.4 | S219 M223 | S219-I221 PolarHBondContact O-N 2.87Å; I221-M223 HydrophobicContact CG2-CG 4.35Å; I221-M223 PolarHBondContact O-N 3.43Å | ||
| 222 | C | 43.6 | Very low | 44.2 | Very low | 114 Ų | 114 | 130.5 Ų | 130.5 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | trans | -77.6 | 104 | 169.3 | -176.2 | 0 | 0 | 0 | 0 | 109.8 | G220 S224 | G220-C222 VanDerWaalsContact C-N 3.32Å; G220-C222 PolarHBondContact O-N 3.45Å; C222-S224 PolarHBondContact O-N 3.08Å | ||
| 223 | M | 49.7 | Very low | 44.4 | Very low | 174 Ų | 174 | 130.7 Ų | 130.7 | 86% | 0.857 | 77% | 0.771 | S | S | * | * | trans | -79.3 | 112.2 | 169.8 | -69.2 | -159.5 | 78.2 | 0 | 0 | 110.9 | I221 | I221-M223 HydrophobicContact CG2-CG 4.35Å; I221-M223 PolarHBondContact O-N 3.43Å | ||
| 224 | S | 44 | Very low | 43.7 | Very low | 99 Ų | 99 | 135 Ų | 135 | 69% | 0.692 | 78% | 0.783 | S | S | * | * | trans | -144.2 | 148.1 | 159.9 | -83.6 | 0 | 0 | 0 | 0 | 109.5 | C222 | C222-S224 PolarHBondContact O-N 3.08Š| ||
| 225 | P | 49.5 | Very low | 43.5 | Very low | 122 Ų | 122 | 133.2 Ų | 133.2 | 79% | 0.792 | 77% | 0.774 | S | S | * | * | trans | -79.3 | 143.4 | -154.3 | 29.3 | -36.1 | 0 | 0 | 0 | 114.4 | S227 | P225-S227 PolarHBondContact O-N 2.97Š| ||
| 226 | E | 33.5 | Very low | 43.6 | Very low | 175 Ų | 175 | 134 Ų | 134 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -50.2 | 130.9 | 174.8 | -148.5 | 69.9 | -164.6 | 0 | 0 | 112.3 | ||||
| 227 | S | 42.1 | Very low | 43 | Very low | 108 Ų | 108 | 132.6 Ų | 132.6 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | -120.6 | 125.6 | 168.8 | 50.9 | 0 | 0 | 0 | 0 | 109.6 | P225 L229 | P225-S227 PolarHBondContact O-N 2.97Å; S227-L229 PolarHBondContact O-N 3.37Å | ||
| 228 | Y | 40.3 | Very low | 42.4 | Very low | 232 Ų | 232 | 132.6 Ų | 132.6 | 91% | 0.91 | 78% | 0.782 | S | S | * | * | trans | -63.2 | 132.4 | -164.2 | -94.6 | -112.8 | 0 | 0 | 0 | 113.5 | ||||
| 229 | L | 40.1 | Very low | 42.1 | Very low | 181 Ų | 181 | 137.6 Ų | 137.6 | 95% | 0.948 | 79% | 0.791 | S | S | * | * | trans | -65.9 | 136.7 | 170.2 | -76.8 | 165.7 | 0 | 0 | 0 | 111.5 | S227 | S227-L229 PolarHBondContact O-N 3.37Š| ||
| 230 | G | 33.2 | Very low | 41 | Very low | 68 Ų | 68 | 137.2 Ų | 137.2 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | trans | -170.6 | 47.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 231 | S | 38.9 | Very low | 40.9 | Very low | 114 Ų | 114 | 140 Ų | 140 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -140.6 | 112.8 | -178 | -65.9 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 232 | P | 46.3 | Very low | 41.7 | Very low | 130 Ų | 130 | 137.4 Ų | 137.4 | 84% | 0.844 | 80% | 0.803 | S | S | * | * | trans | -80.8 | 137.3 | 158.3 | -14.1 | 31.3 | 0 | 0 | 0 | 111.6 | ||||
| 233 | Q | 38.9 | Very low | 41.4 | Very low | 162 Ų | 162 | 139.1 Ų | 139.1 | 76% | 0.757 | 81% | 0.805 | S | S | * | * | trans | -84.7 | 136.6 | -179 | -75.9 | -79.4 | -9.8 | 0 | 0 | 112.7 | ||||
| 234 | H | 37.5 | Very low | 40.9 | Very low | 193 Ų | 193 | 142.4 Ų | 142.4 | 89% | 0.894 | 81% | 0.808 | S | S | * | * | trans | -150.7 | 125.9 | 157.1 | -93 | -71.6 | 0 | 0 | 0 | 111.6 | ||||
| 235 | S | 45.7 | Very low | 40.7 | Very low | 99 Ų | 99 | 142.1 Ų | 142.1 | 69% | 0.692 | 81% | 0.806 | S | S | * | * | trans | -117.9 | 160.2 | 173.8 | -54.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 236 | P | 51.6 | Low | 40.7 | Very low | 124 Ų | 124 | 144.7 Ų | 144.7 | 81% | 0.805 | 81% | 0.812 | S | S | * | * | -146.7 | 155.3 | 78.4 | 36.8 | -17.9 | 0 | 0 | 0 | 117.8 | |||||
| 237 | S | 33.7 | Very low | 41.4 | Very low | 107 Ų | 107 | 141.6 Ų | 141.6 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | trans | -19.4 | 138.5 | 163.8 | -176.4 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 238 | T | 35.6 | Very low | 41.4 | Very low | 136 Ų | 136 | 142 Ų | 142 | 83% | 0.834 | 81% | 0.81 | S | S | * | * | trans | -147.3 | 92.5 | 146.6 | -46.5 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 239 | R | 40.9 | Very low | 42.1 | Very low | 242 Ų | 242 | 136.7 Ų | 136.7 | 91% | 0.913 | 80% | 0.804 | S | S | * | * | trans | 22.1 | 108.9 | 140.5 | -164.2 | -174.4 | -141.4 | -174 | 6.5 | 119.3 | ||||
| 240 | G | 33.3 | Very low | 42 | Very low | 78 Ų | 78 | 131.8 Ų | 131.8 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | -164.1 | 145.3 | 164.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 241 | S | 42.5 | Very low | 42.4 | Very low | 124 Ų | 124 | 134.8 Ų | 134.8 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -125.7 | 175.5 | -172 | -119.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 242 | P | 55 | Low | 42.5 | Very low | 103 Ų | 103 | 136.8 Ų | 136.8 | 67% | 0.669 | 80% | 0.803 | S | S | * | * | trans | -119.4 | -170.8 | -133.4 | 35.3 | -16.9 | 0 | 0 | 0 | 115.7 | ||||
| 243 | N | 36.7 | Very low | 42.3 | Very low | 151 Ų | 151 | 136.9 Ų | 136.9 | 81% | 0.807 | 81% | 0.805 | S | S | * | * | trans | 75.6 | 120.9 | 166.6 | -61.2 | -50 | 0 | 0 | 0 | 118.7 | ||||
| 244 | R | 40.7 | Very low | 42.2 | Very low | 242 Ų | 242 | 132.7 Ų | 132.7 | 91% | 0.913 | 81% | 0.805 | S | S | * | * | trans | -154 | 94.1 | 137 | -119.7 | -179.2 | -174.5 | -125.9 | -1.1 | 113.7 | ||||
| 245 | S | 39.2 | Very low | 42.9 | Very low | 94 Ų | 94 | 128.8 Ų | 128.8 | 66% | 0.657 | 80% | 0.8 | S | S | * | * | trans | 26.7 | 116.8 | 139.4 | 59.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 246 | L | 49.7 | Very low | 43.2 | Very low | 175 Ų | 175 | 129.2 Ų | 129.2 | 92% | 0.916 | 81% | 0.809 | S | S | * | * | trans | -62.7 | 151.6 | 143.7 | -75.2 | 165.7 | 0 | 0 | 0 | 110.6 | ||||
| 247 | P | 46.5 | Very low | 43.3 | Very low | 111 Ų | 111 | 133.4 Ų | 133.4 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | trans | -142.2 | 111.8 | 137.6 | 33.5 | -17 | 0 | 0 | 0 | 114.7 | ||||
| 248 | S | 42.5 | Very low | 44.3 | Very low | 117 Ų | 117 | 133.2 Ų | 133.2 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | 61.4 | 162.5 | 128.8 | -72.1 | 0 | 0 | 0 | 0 | 122.1 | |||||
| 249 | P | 54.7 | Low | 45.6 | Very low | 120 Ų | 120 | 135 Ų | 135 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | trans | -96.1 | 153.1 | -154.3 | 36.4 | -35.9 | 0 | 0 | 0 | 115.9 | ||||
| 250 | G | 38 | Very low | 46.6 | Very low | 78 Ų | 78 | 128.8 Ų | 128.8 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | trans | -104.1 | 154.9 | 165.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 251 | V | 42.2 | Very low | 47.5 | Very low | 131 Ų | 131 | 135.2 Ų | 135.2 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | trans | -119.7 | 167 | -168.4 | -162.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 252 | L | 41.4 | Very low | 48.2 | Very low | 156 Ų | 156 | 135.5 Ų | 135.5 | 82% | 0.817 | 79% | 0.786 | S | S | * | * | trans | 92.8 | 99.7 | 162.6 | -57.5 | 169.8 | 0 | 0 | 0 | 118.5 | ||||
| 253 | C | 43 | Very low | 48.4 | Very low | 132 Ų | 132 | 134 Ų | 134 | 89% | 0.892 | 78% | 0.776 | S | S | * | * | 53.7 | 121.2 | 111.1 | -154.4 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 254 | G | 36.7 | Very low | 49.3 | Very low | 74 Ų | 74 | 133.5 Ų | 133.5 | 76% | 0.763 | 78% | 0.781 | S | S | * | * | trans | 146.4 | 96.3 | 150.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 255 | S | 51.3 | Low | 49.9 | Very low | 111 Ų | 111 | 124.1 Ų | 124.1 | 78% | 0.776 | 76% | 0.759 | S | S | * | * | trans | 169.1 | 73.7 | 134.3 | -170.6 | 0 | 0 | 0 | 0 | 111.2 | R257 | S255-R257 PolarHBondContact O-N 2.99Š| ||
| 256 | A | 52.8 | Low | 50.6 | Low | 107 Ų | 107 | 125.7 Ų | 125.7 | 88% | 0.884 | 76% | 0.756 | S | S | * | * | trans | -81.4 | 100.5 | 160.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 257 | R | 52.5 | Low | 50.8 | Low | 212 Ų | 212 | 125.7 Ų | 125.7 | 80% | 0.8 | 75% | 0.748 | S | S | * | * | trans | -114.3 | 101 | 175.9 | -170.9 | 179.9 | -174 | -166.8 | 2.8 | 110.6 | S255 | S255-R257 PolarHBondContact O-N 2.99Š| ||
| 258 | P | 55 | Low | 51.1 | Low | 104 Ų | 104 | 128 Ų | 128 | 68% | 0.675 | 75% | 0.751 | S | S | * | * | trans | -56.7 | 141.3 | 166.9 | -21.5 | 33.2 | 0 | 0 | 0 | 110.4 | ||||
| 259 | K | 62.2 | Low | 51.6 | Low | 174 Ų | 174 | 127 Ų | 127 | 76% | 0.757 | 74% | 0.741 | S | S | * | * | trans | -81.5 | 140.7 | 171.6 | -71.5 | -178.5 | 179 | 177 | 0 | 108.5 | Y261 | K259-Y261 PolarHBondContact O-N 2.87Š| ||
| 260 | P | 62.3 | Low | 51.5 | Low | 111 Ų | 111 | 126 Ų | 126 | 72% | 0.721 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -67.8 | 17.4 | -175 | -24 | 35.9 | 0 | 0 | 0 | 117.6 | ||
| 261 | Y | 52.6 | Low | 52.5 | Low | 212 Ų | 212 | 125 Ų | 125 | 83% | 0.831 | 71% | 0.71 | S | S | * | * | trans | -144.3 | 60 | -173.3 | -67.4 | -74.7 | 0 | 0 | 0 | 112 | K259 P263 | K259-Y261 PolarHBondContact O-N 2.87Å; Y261-P263 WeakPolarHBondContact O-CD 3.44Å | ||
| 262 | D | 56.7 | Low | 53.2 | Low | 131 Ų | 131 | 127 Ų | 127 | 70% | 0.701 | 71% | 0.707 | S | S | * | * | trans | -86 | 113.4 | 162.1 | -73.4 | -22.1 | 0 | 0 | 0 | 108.6 | P264 | D262-P264 WeakPolarHBondContact O-CD 3.21Š| ||
| 263 | P | 59.6 | Low | 54.1 | Low | 72 Ų | 72 | 122.2 Ų | 122.2 | 47% | 0.468 | 69% | 0.685 | S | S | . | * | trans | -70 | 128.8 | 179.9 | 27.8 | -33.8 | 0 | 0 | 0 | 111 | Y261 G265 E266 | Y261-P263 WeakPolarHBondContact O-CD 3.44Å; P263-G265 VanDerWaalsContact C-N 3.26Å; P263-G265 PolarHBondContact O-N 3.28Å; P263-E266 HydrophobicContact CG-CG 4Å; P263-E266 VanDerWaalsContact CG-OE2 3.23Å; P263-E266 WeakPolarHBondContact CG-OE2 3.34Å | ||
| 264 | P | 56 | Low | 55.1 | Low | 140 Ų | 140 | 120.8 Ų | 120.8 | 91% | 0.909 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | 68.5 | -179.3 | -22 | 35.5 | 0 | 0 | 0 | 114.8 | D262 | D262-P264 WeakPolarHBondContact O-CD 3.21Š|
| 265 | G | 52.1 | Low | 56.4 | Low | 44 Ų | 44 | 118.7 Ų | 118.7 | 45% | 0.454 | 64% | 0.641 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -172.8 | -29.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | P263 K267 | P263-G265 VanDerWaalsContact C-N 3.26Å; P263-G265 PolarHBondContact O-N 3.28Å; G265-K267 VanDerWaalsContact C-N 3.26Å; G265-K267 PolarHBondContact O-N 3.35Å |
| 266 | E | 54.9 | Low | 57.4 | Low | 127 Ų | 127 | 118.2 Ų | 118.2 | 59% | 0.593 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -60.6 | -29.5 | -166.2 | -75.7 | -173.8 | 115.1 | 0 | 0 | 114.9 | P263 M268 V269 E270 | P263-E266 HydrophobicContact CG-CG 4Å; P263-E266 VanDerWaalsContact CG-OE2 3.23Å; P263-E266 WeakPolarHBondContact CG-OE2 3.34Å; E266-M268 VanDerWaalsContact C-N 3.26Å; E266-M268 PolarHBondContact O-N 3.1Å; E266-V269 PolarHBondContact O-N 3.48Å; E266-E270 WeakPolarHBondContact O-CB 3.3Å; E266-E270 PolarHBondContact O-N 2.84Å |
| 267 | K | 53.9 | Low | 58.5 | Low | 175 Ų | 175 | 119.5 Ų | 119.5 | 76% | 0.761 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -56.5 | -24.9 | -172.5 | 43.9 | -174 | 167 | -175 | 0 | 116.4 | G265 A271 | G265-K267 VanDerWaalsContact C-N 3.26Å; G265-K267 PolarHBondContact O-N 3.35Å; K267-A271 VanDerWaalsContact O-CB 3.27Å; K267-A271 WeakPolarHBondContact O-CB 3.35Å; K267-A271 PolarHBondContact O-N 3.48Å |
| 268 | M | 52.1 | Low | 59.8 | Low | 159 Ų | 159 | 114.5 Ų | 114.5 | 78% | 0.783 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -85.6 | -35 | 171.3 | -71.2 | -175.1 | 75.7 | 0 | 0 | 113.2 | E266 K272 | E266-M268 VanDerWaalsContact C-N 3.26Å; E266-M268 PolarHBondContact O-N 3.1Å; M268-K272 PolarHBondContact O-N 3.19Å |
| 269 | V | 53.2 | Low | 61.4 | Low | 98 Ų | 98 | 113.7 Ų | 113.7 | 59% | 0.594 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -71.7 | -46.4 | 178.6 | -172 | 0 | 0 | 0 | 0 | 109.9 | E266 A271 K272 V273 | E266-V269 PolarHBondContact O-N 3.48Å; V269-A271 VanDerWaalsContact C-N 3.28Å; V269-A271 PolarHBondContact O-N 2.88Å; V269-K272 PolarHBondContact O-N 2.98Å; V269-V273 HydrophobicContact CG1-CG2 4.44Å; V269-V273 WeakPolarHBondContact O-CB 3.5Å; V269-V273 VanDerWaalsContact O-CG2 3.32Å; V269-V273 WeakPolarHBondContact O-CG2 3.45Å; V269-V273 PolarHBondContact O-N 3.44Å |
| 270 | E | 53.8 | Low | 62.8 | Low | 99 Ų | 99 | 110.9 Ų | 110.9 | 46% | 0.463 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.5 | -32.9 | 177.5 | -151.9 | -149.9 | -174.7 | 0 | 0 | 111.6 | E266 K274 | E266-E270 WeakPolarHBondContact O-CB 3.3Å; E266-E270 PolarHBondContact O-N 2.84Å; E270-K274 HydrophobicContact CG-CD 4.32Å; E270-K274 VanDerWaalsContact O-CB 3.23Å; E270-K274 WeakPolarHBondContact O-CB 3.32Å; E270-K274 VanDerWaalsContact O-CG 3.23Å; E270-K274 WeakPolarHBondContact O-CG 3.48Å; E270-K274 PolarHBondContact O-N 3.05Å; E270-K274 WeakPolarHBondContact OE1-CE 3.21Å; E270-K274 IonicContact OE1-NZ 2.66Å; E270-K274 PolarHBondContact OE1-NZ 2.89Å; E270-K274 WeakPolarHBondContact OE2-CE 3.34Å; E270-K274 IonicContact OE2-NZ 3.99Å; E270-K274 PolarHBondContact OE2-NZ 2.68Å |
| 271 | A | 57.7 | Low | 64.3 | Low | 57 Ų | 57 | 112.6 Ų | 112.6 | 47% | 0.471 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.8 | -48.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | K267 V269 K274 G275 | K267-A271 VanDerWaalsContact O-CB 3.27Å; K267-A271 WeakPolarHBondContact O-CB 3.35Å; K267-A271 PolarHBondContact O-N 3.48Å; V269-A271 VanDerWaalsContact C-N 3.28Å; V269-A271 PolarHBondContact O-N 2.88Å; A271-K274 PolarHBondContact O-N 2.95Å; A271-G275 PolarHBondContact O-N 3.26Å |
| 272 | K | 57.9 | Low | 66.2 | Low | 171 Ų | 171 | 107.1 Ų | 107.1 | 74% | 0.743 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -61.5 | -44.4 | 173.9 | -84.2 | -163.1 | 170.5 | -168.8 | 0 | 112.1 | M268 V269 K274 G275 E276 | M268-K272 PolarHBondContact O-N 3.19Å; V269-K272 PolarHBondContact O-N 2.98Å; K272-K274 VanDerWaalsContact C-N 3.31Å; K272-K274 PolarHBondContact O-N 3.08Å; K272-G275 PolarHBondContact O-N 3.48Å; K272-E276 PolarHBondContact O-N 3.03Å |
| 273 | V | 60.3 | Low | 68 | Low | 56 Ų | 56 | 107.6 Ų | 107.6 | 34% | 0.339 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66.3 | -31 | 178.5 | 170.1 | 0 | 0 | 0 | 0 | 112.2 | V269 K277 | V269-V273 HydrophobicContact CG1-CG2 4.44Å; V269-V273 WeakPolarHBondContact O-CB 3.5Å; V269-V273 VanDerWaalsContact O-CG2 3.32Å; V269-V273 WeakPolarHBondContact O-CG2 3.45Å; V269-V273 PolarHBondContact O-N 3.44Å; V273-K277 HydrophobicContact CG1-CD 4.22Å; V273-K277 WeakPolarHBondContact O-CB 3.24Å; V273-K277 VanDerWaalsContact O-CD 3.28Å; V273-K277 WeakPolarHBondContact O-CD 3.37Å; V273-K277 WeakPolarHBondContact O-CG 3.19Å; V273-K277 PolarHBondContact O-N 3.35Å |
| 274 | K | 62.7 | Low | 69.8 | Low | 103 Ų | 103 | 111.3 Ų | 111.3 | 45% | 0.448 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -72.6 | -41.6 | 170.8 | -79.6 | 169.5 | 175.9 | 166.7 | 0 | 111.8 | E270 A271 K272 K277 L278 | E270-K274 HydrophobicContact CG-CD 4.32Å; E270-K274 VanDerWaalsContact O-CB 3.23Å; E270-K274 WeakPolarHBondContact O-CB 3.32Å; E270-K274 VanDerWaalsContact O-CG 3.23Å; E270-K274 WeakPolarHBondContact O-CG 3.48Å; E270-K274 PolarHBondContact O-N 3.05Å; E270-K274 WeakPolarHBondContact OE1-CE 3.21Å; E270-K274 IonicContact OE1-NZ 2.66Å; E270-K274 PolarHBondContact OE1-NZ 2.89Å; E270-K274 WeakPolarHBondContact OE2-CE 3.34Å; E270-K274 IonicContact OE2-NZ 3.99Å; E270-K274 PolarHBondContact OE2-NZ 2.68Å; A271-K274 PolarHBondContact O-N 2.95Å; K272-K274 VanDerWaalsContact C-N 3.31Å; K272-K274 PolarHBondContact O-N 3.08Å; K274-K277 PolarHBondContact O-N 2.62Å; K274-L278 WeakPolarHBondContact O-CG 3.48Å; K274-L278 PolarHBondContact O-N 2.99Å |
| 275 | G | 65.6 | Low | 71.7 | Confident | 29 Ų | 29 | 110.4 Ų | 110.4 | 30% | 0.299 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -54.1 | -57.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | A271 K272 K277 L278 D279 | A271-G275 PolarHBondContact O-N 3.26Å; K272-G275 PolarHBondContact O-N 3.48Å; G275-K277 PolarHBondContact O-N 3.37Å; G275-K277 VanDerWaalsContact O-N 3.15Å; G275-L278 WeakPolarHBondContact O-CA 3.4Å; G275-L278 WeakPolarHBondContact O-CB 3.29Å; G275-L278 PolarHBondContact O-N 3.05Å; G275-D279 PolarHBondContact O-N 3.28Å |
| 276 | E | 71.2 | Confident | 73.8 | Confident | 101 Ų | 101 | 114.3 Ų | 114.3 | 47% | 0.472 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -55.2 | -37.3 | 176.5 | -76.8 | -170.3 | -167.3 | 0 | 0 | 113.3 | K272 L278 D279 K280 | K272-E276 PolarHBondContact O-N 3.03Å; E276-L278 VanDerWaalsContact C-N 3.32Å; E276-D279 PolarHBondContact O-N 3.41Å; E276-K280 HydrophobicContact CB-CD 4.44Å; E276-K280 VanDerWaalsContact O-CB 3.22Å; E276-K280 WeakPolarHBondContact O-CB 3.49Å; E276-K280 VanDerWaalsContact O-CD 3.24Å; E276-K280 WeakPolarHBondContact O-CD 3.39Å; E276-K280 WeakPolarHBondContact O-CG 3.47Å; E276-K280 PolarHBondContact O-N 3.38Å; E276-K280 IonicContact OE2-NZ 2.68Å; E276-K280 PolarHBondContact OE2-NZ 3.4Å |
| 277 | K | 76.5 | Confident | 75.8 | Confident | 134 Ų | 134 | 114.6 Ų | 114.6 | 58% | 0.583 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67.7 | -32.4 | 177.9 | -76.7 | 167.9 | -175.2 | 175 | 0 | 112 | V273 K274 G275 K281 | V273-K277 HydrophobicContact CG1-CD 4.22Å; V273-K277 WeakPolarHBondContact O-CB 3.24Å; V273-K277 VanDerWaalsContact O-CD 3.28Å; V273-K277 WeakPolarHBondContact O-CD 3.37Å; V273-K277 WeakPolarHBondContact O-CG 3.19Å; V273-K277 PolarHBondContact O-N 3.35Å; K274-K277 PolarHBondContact O-N 2.62Å; G275-K277 PolarHBondContact O-N 3.37Å; G275-K277 VanDerWaalsContact O-N 3.15Å; K277-K281 WeakPolarHBondContact O-CB 3.3Å; K277-K281 PolarHBondContact O-N 3.31Å |
| 278 | L | 79.5 | Confident | 77.9 | Confident | 108 Ų | 108 | 111.8 Ų | 111.8 | 57% | 0.565 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -72.5 | -44.5 | 172.2 | -66.2 | 174.5 | 0 | 0 | 0 | 111 | K274 G275 E276 K280 K281 L282 | K274-L278 WeakPolarHBondContact O-CG 3.48Å; K274-L278 PolarHBondContact O-N 2.99Å; G275-L278 WeakPolarHBondContact O-CA 3.4Å; G275-L278 WeakPolarHBondContact O-CB 3.29Å; G275-L278 PolarHBondContact O-N 3.05Å; E276-L278 VanDerWaalsContact C-N 3.32Å; L278-K280 VanDerWaalsContact C-N 3.33Å; L278-K280 PolarHBondContact O-N 2.99Å; L278-K281 CarbonylContact O-C 3.55Å; L278-K281 WeakPolarHBondContact O-CA 3.45Å; L278-K281 WeakPolarHBondContact O-CB 3.46Å; L278-K281 PolarHBondContact O-N 3.23Å; L278-L282 WeakPolarHBondContact O-CG 3.31Å; L278-L282 PolarHBondContact O-N 2.87Å |
| 279 | D | 87.6 | Confident | 80.1 | Confident | 86 Ų | 86 | 111.1 Ų | 111.1 | 46% | 0.46 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.1 | -42.7 | 176.7 | -58.4 | -34.4 | 0 | 0 | 0 | 111.7 | G275 E276 K281 L282 K283 | G275-D279 PolarHBondContact O-N 3.28Å; E276-D279 PolarHBondContact O-N 3.41Å; D279-K281 PolarHBondContact O-N 3.29Å; D279-L282 PolarHBondContact O-N 2.91Å; D279-K283 WeakPolarHBondContact O-CB 3.2Å; D279-K283 WeakPolarHBondContact O-CG 3.34Å; D279-K283 PolarHBondContact O-N 3.32Å |
| 280 | K | 92.6 | Very high | 82.2 | Confident | 116 Ų | 116 | 110.7 Ų | 110.7 | 50% | 0.504 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.2 | -24.6 | 174.1 | -70.3 | 162 | -171.6 | 173.9 | 0 | 112.3 | E276 L278 K284 | E276-K280 HydrophobicContact CB-CD 4.44Å; E276-K280 VanDerWaalsContact O-CB 3.22Å; E276-K280 WeakPolarHBondContact O-CB 3.49Å; E276-K280 VanDerWaalsContact O-CD 3.24Å; E276-K280 WeakPolarHBondContact O-CD 3.39Å; E276-K280 WeakPolarHBondContact O-CG 3.47Å; E276-K280 PolarHBondContact O-N 3.38Å; E276-K280 IonicContact OE2-NZ 2.68Å; E276-K280 PolarHBondContact OE2-NZ 3.4Å; L278-K280 VanDerWaalsContact C-N 3.33Å; L278-K280 PolarHBondContact O-N 2.99Å; K280-K284 VanDerWaalsContact O-CG 3.29Å; K280-K284 WeakPolarHBondContact O-CG 2.99Å |
| 281 | K | 94.2 | Very high | 84.3 | Confident | 147 Ų | 147 | 108.7 Ų | 108.7 | 64% | 0.639 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -79.1 | -44.2 | 171.4 | -174.4 | -175.1 | 176.8 | -173.2 | 0 | 111.6 | K277 L278 D279 K284 M285 | K277-K281 WeakPolarHBondContact O-CB 3.3Å; K277-K281 PolarHBondContact O-N 3.31Å; L278-K281 CarbonylContact O-C 3.55Å; L278-K281 WeakPolarHBondContact O-CA 3.45Å; L278-K281 WeakPolarHBondContact O-CB 3.46Å; L278-K281 PolarHBondContact O-N 3.23Å; D279-K281 PolarHBondContact O-N 3.29Å; K281-K284 PolarHBondContact O-N 3.43Å; K281-M285 WeakPolarHBondContact O-CB 3.27Å; K281-M285 PolarHBondContact O-N 3.39Å |
| 282 | L | 92.1 | Very high | 86.2 | Confident | 96 Ų | 96 | 107.8 Ų | 107.8 | 50% | 0.503 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.8 | -49.5 | 178 | -69.8 | 173.3 | 0 | 0 | 0 | 111 | L278 D279 K284 M285 E286 | L278-L282 WeakPolarHBondContact O-CG 3.31Å; L278-L282 PolarHBondContact O-N 2.87Å; D279-L282 PolarHBondContact O-N 2.91Å; L282-K284 VanDerWaalsContact C-N 3.31Å; L282-K284 PolarHBondContact O-N 3.13Å; L282-M285 HydrophobicContact CD2-CE 3.88Å; L282-M285 WeakPolarHBondContact O-CB 3.47Å; L282-M285 PolarHBondContact O-N 3.38Å; L282-M285 VanDerWaalsContact O-N 3.08Å; L282-E286 PolarHBondContact O-N 3.24Å |
| 283 | K | 95.4 | Very high | 88.2 | Confident | 141 Ų | 141 | 102.9 Ų | 102.9 | 61% | 0.613 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.6 | -39.7 | 176.6 | -69.4 | 179.9 | 179.9 | -173.1 | 0 | 112.5 | D279 Q287 | D279-K283 WeakPolarHBondContact O-CB 3.2Å; D279-K283 WeakPolarHBondContact O-CG 3.34Å; D279-K283 PolarHBondContact O-N 3.32Å; K283-Q287 WeakPolarHBondContact O-CB 3.42Å; K283-Q287 WeakPolarHBondContact O-CG 3.23Å; K283-Q287 PolarHBondContact O-N 3.31Å |
| 284 | K | 96.9 | Very high | 90 | Very high | 151 Ų | 151 | 109.6 Ų | 109.6 | 66% | 0.657 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -68.1 | -37.7 | 174.3 | -78.1 | -177.6 | 176.6 | -168.7 | 0 | 113.4 | K280 K281 L282 N288 | K280-K284 VanDerWaalsContact O-CG 3.29Å; K280-K284 WeakPolarHBondContact O-CG 2.99Å; K281-K284 PolarHBondContact O-N 3.43Å; L282-K284 VanDerWaalsContact C-N 3.31Å; L282-K284 PolarHBondContact O-N 3.13Å; K284-N288 VanDerWaalsContact O-CB 3.3Å; K284-N288 WeakPolarHBondContact O-CB 3.39Å; K284-N288 PolarHBondContact O-N 3.28Å |
| 285 | M | 95.2 | Very high | 91.7 | Very high | 121 Ų | 121 | 112.4 Ų | 112.4 | 60% | 0.596 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.4 | -41.7 | 176.5 | -176.2 | 179.4 | 73.7 | 0 | 0 | 111.1 | K281 L282 N288 K289 | K281-M285 WeakPolarHBondContact O-CB 3.27Å; K281-M285 PolarHBondContact O-N 3.39Å; L282-M285 HydrophobicContact CD2-CE 3.88Å; L282-M285 WeakPolarHBondContact O-CB 3.47Å; L282-M285 PolarHBondContact O-N 3.38Å; L282-M285 VanDerWaalsContact O-N 3.08Å; M285-N288 PolarHBondContact O-N 2.83Å; M285-K289 WeakPolarHBondContact O-CB 3.48Å; M285-K289 PolarHBondContact O-N 2.65Å |
| 286 | E | 96.1 | Very high | 93.3 | Very high | 126 Ų | 126 | 119.8 Ų | 119.8 | 59% | 0.589 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -68.3 | -46.9 | 176.3 | -174.8 | 152.5 | -116.8 | 0 | 0 | 112.3 | L282 N288 K289 T290 | L282-E286 PolarHBondContact O-N 3.24Å; E286-N288 VanDerWaalsContact C-N 3.28Å; E286-N288 PolarHBondContact O-N 3.35Å; E286-K289 WeakPolarHBondContact O-CB 3.35Å; E286-K289 PolarHBondContact O-N 3.04Å; E286-K289 VanDerWaalsContact O-N 3.15Å; E286-T290 PolarHBondContact O-N 3.01Å; E286-T290 PolarHBondContact O-OG1 3.12Å |
| 287 | Q | 97.6 | Very high | 94.6 | Very high | 133 Ų | 133 | 120.3 Ų | 120.3 | 62% | 0.621 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -55.5 | -42.4 | 172 | -76 | 171.4 | -17.6 | 0 | 0 | 112 | K283 A291 | K283-Q287 WeakPolarHBondContact O-CB 3.42Å; K283-Q287 WeakPolarHBondContact O-CG 3.23Å; K283-Q287 PolarHBondContact O-N 3.31Å; Q287-A291 VanDerWaalsContact O-CB 3.23Å; Q287-A291 WeakPolarHBondContact O-CB 3.41Å; Q287-A291 PolarHBondContact O-N 3.14Å |
| 288 | N | 97.3 | Very high | 95.6 | Very high | 115 Ų | 115 | 120 Ų | 120 | 62% | 0.615 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.9 | -40.7 | 176.7 | -176.4 | -104.7 | 0 | 0 | 0 | 112.5 | K284 M285 E286 A291 A292 | K284-N288 VanDerWaalsContact O-CB 3.3Å; K284-N288 WeakPolarHBondContact O-CB 3.39Å; K284-N288 PolarHBondContact O-N 3.28Å; M285-N288 PolarHBondContact O-N 2.83Å; E286-N288 VanDerWaalsContact C-N 3.28Å; E286-N288 PolarHBondContact O-N 3.35Å; N288-A291 PolarHBondContact O-N 3.21Å; N288-A292 WeakPolarHBondContact O-CB 3.25Å; N288-A292 PolarHBondContact O-N 2.93Å |
| 289 | K | 98.4 | Very high | 96.5 | Very high | 145 Ų | 145 | 119.3 Ų | 119.3 | 63% | 0.63 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -58.8 | -47.4 | 174.1 | -179.2 | -171.2 | 174.4 | -166.7 | 0 | 111.3 | M285 E286 T293 | M285-K289 WeakPolarHBondContact O-CB 3.48Å; M285-K289 PolarHBondContact O-N 2.65Å; E286-K289 WeakPolarHBondContact O-CB 3.35Å; E286-K289 PolarHBondContact O-N 3.04Å; E286-K289 VanDerWaalsContact O-N 3.15Å; K289-T293 WeakPolarHBondContact O-CB 3.39Å; K289-T293 PolarHBondContact O-N 3.35Å; K289-T293 PolarHBondContact O-OG1 3.28Å |
| 290 | T | 97.6 | Very high | 97 | Very high | 89 Ų | 89 | 122.2 Ų | 122.2 | 55% | 0.546 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66.8 | -44.8 | 178 | -58.7 | 0 | 0 | 0 | 0 | 111.7 | E286 A292 T293 R294 | E286-T290 PolarHBondContact O-N 3.01Å; E286-T290 PolarHBondContact O-OG1 3.12Å; T290-A292 PolarHBondContact O-N 3.35Å; T290-T293 PolarHBondContact O-N 2.78Å; T290-R294 WeakPolarHBondContact O-CB 3.2Å; T290-R294 PolarHBondContact O-N 3.47Å |
| 291 | A | 97.9 | Very high | 97.3 | Very high | 58 Ų | 58 | 119.2 Ų | 119.2 | 48% | 0.479 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -62.3 | -43.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q287 N288 T293 R294 Y295 | Q287-A291 VanDerWaalsContact O-CB 3.23Å; Q287-A291 WeakPolarHBondContact O-CB 3.41Å; Q287-A291 PolarHBondContact O-N 3.14Å; N288-A291 PolarHBondContact O-N 3.21Å; A291-T293 VanDerWaalsContact C-N 3.31Å; A291-T293 PolarHBondContact O-N 3.04Å; A291-R294 PolarHBondContact O-N 2.61Å; A291-Y295 WeakPolarHBondContact O-CB 3.36Å; A291-Y295 PolarHBondContact O-N 2.91Å |
| 292 | A | 98.4 | Very high | 97.5 | Very high | 37 Ų | 37 | 115.3 Ų | 115.3 | 31% | 0.306 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.8 | -35.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | N288 T290 R296 | N288-A292 WeakPolarHBondContact O-CB 3.25Å; N288-A292 PolarHBondContact O-N 2.93Å; T290-A292 PolarHBondContact O-N 3.35Å; A292-R296 WeakPolarHBondContact O-CB 3.23Å; A292-R296 VanDerWaalsContact O-CG 3.23Å; A292-R296 WeakPolarHBondContact O-CG 3.48Å; A292-R296 PolarHBondContact O-N 2.86Å; A292-R296 VanDerWaalsContact O-N 3.07Å |
| 293 | T | 98.4 | Very high | 97.8 | Very high | 69 Ų | 69 | 115.8 Ų | 115.8 | 42% | 0.423 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -68 | -50.8 | 175.4 | -56.3 | 0 | 0 | 0 | 0 | 110.6 | K289 T290 A291 Y295 R296 Q297 | K289-T293 WeakPolarHBondContact O-CB 3.39Å; K289-T293 PolarHBondContact O-N 3.35Å; K289-T293 PolarHBondContact O-OG1 3.28Å; T290-T293 PolarHBondContact O-N 2.78Å; A291-T293 VanDerWaalsContact C-N 3.31Å; A291-T293 PolarHBondContact O-N 3.04Å; T293-Y295 VanDerWaalsContact C-N 3.33Å; T293-Y295 PolarHBondContact O-N 2.88Å; T293-R296 PolarHBondContact O-N 3.27Å; T293-Q297 WeakPolarHBondContact O-CG 3.37Å; T293-Q297 PolarHBondContact O-N 2.89Å; T293-Q297 PolarHBondContact O-OE1 3.47Å |
| 294 | R | 98.6 | Very high | 97.9 | Very high | 197 Ų | 197 | 114.7 Ų | 114.7 | 74% | 0.743 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -59.2 | -40.8 | 176.8 | -170.1 | -177.4 | -176.2 | -151.4 | 2.3 | 112.4 | T290 A291 Q297 K298 | T290-R294 WeakPolarHBondContact O-CB 3.2Å; T290-R294 PolarHBondContact O-N 3.47Å; A291-R294 PolarHBondContact O-N 2.61Å; R294-Q297 PolarHBondContact O-N 3.44Å; R294-K298 WeakPolarHBondContact O-CB 3.45Å; R294-K298 PolarHBondContact O-N 3.42Å |
| 295 | Y | 98.6 | Very high | 98 | Very high | 161 Ų | 161 | 110.7 Ų | 110.7 | 63% | 0.631 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.5 | -47.7 | 175.3 | 176.9 | -99.3 | 0 | 0 | 0 | 111.8 | A291 T293 Q297 K298 K299 | A291-Y295 WeakPolarHBondContact O-CB 3.36Å; A291-Y295 PolarHBondContact O-N 2.91Å; T293-Y295 VanDerWaalsContact C-N 3.33Å; T293-Y295 PolarHBondContact O-N 2.88Å; Y295-Q297 VanDerWaalsContact C-N 3.35Å; Y295-Q297 PolarHBondContact O-N 3.19Å; Y295-K298 PolarHBondContact O-N 3.13Å; Y295-K299 WeakPolarHBondContact O-CB 3.19Å; Y295-K299 PolarHBondContact O-N 3.4Å |
| 296 | R | 98.4 | Very high | 98.2 | Very high | 184 Ų | 184 | 109.5 Ų | 109.5 | 69% | 0.694 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -63.5 | -38.7 | 177 | -73.6 | 170.8 | 177.2 | -171.7 | -1.6 | 112.4 | A292 T293 R300 | A292-R296 WeakPolarHBondContact O-CB 3.23Å; A292-R296 VanDerWaalsContact O-CG 3.23Å; A292-R296 WeakPolarHBondContact O-CG 3.48Å; A292-R296 PolarHBondContact O-N 2.86Å; A292-R296 VanDerWaalsContact O-N 3.07Å; T293-R296 PolarHBondContact O-N 3.27Å; R296-R300 WeakPolarHBondContact O-CB 3.49Å; R296-R300 PolarHBondContact O-N 3.33Å |
| 297 | Q | 98.7 | Very high | 98.3 | Very high | 113 Ų | 113 | 105.9 Ų | 105.9 | 53% | 0.528 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.1 | -52.4 | 174.6 | -74.4 | 168.6 | -50 | 0 | 0 | 111.2 | T293 R294 Y295 K299 R300 A301 | T293-Q297 WeakPolarHBondContact O-CG 3.37Å; T293-Q297 PolarHBondContact O-N 2.89Å; T293-Q297 PolarHBondContact O-OE1 3.47Å; R294-Q297 PolarHBondContact O-N 3.44Å; Y295-Q297 VanDerWaalsContact C-N 3.35Å; Y295-Q297 PolarHBondContact O-N 3.19Å; Q297-K299 PolarHBondContact O-N 3.03Å; Q297-R300 PolarHBondContact O-N 3.17Å; Q297-A301 PolarHBondContact O-N 2.9Å |
| 298 | K | 98.4 | Very high | 98.3 | Very high | 127 Ų | 127 | 101.3 Ų | 101.3 | 55% | 0.552 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -58.1 | -47.4 | 177.5 | 173.8 | 163 | 173.8 | 163.9 | 0 | 111.7 | R294 Y295 R300 A301 E302 | R294-K298 WeakPolarHBondContact O-CB 3.45Å; R294-K298 PolarHBondContact O-N 3.42Å; Y295-K298 PolarHBondContact O-N 3.13Å; K298-R300 VanDerWaalsContact C-N 3.27Å; K298-R300 PolarHBondContact O-N 2.89Å; K298-A301 PolarHBondContact O-N 2.86Å; K298-E302 WeakPolarHBondContact CE-OE1 3.44Å; K298-E302 HydrophobicContact CG-CG 4.39Å; K298-E302 VanDerWaalsContact CG-OE1 3.31Å; K298-E302 WeakPolarHBondContact CG-OE1 3.32Å; K298-E302 IonicContact NZ-OE1 2.72Å; K298-E302 WeakPolarHBondContact O-CG 3.31Å; K298-E302 PolarHBondContact O-N 2.98Å |
| 299 | K | 98.7 | Very high | 98.4 | Very high | 94 Ų | 94 | 101.2 Ų | 101.2 | 41% | 0.409 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.2 | -29.2 | 179.4 | -165.4 | 65.2 | -118.9 | 168.4 | 0 | 112.8 | Y295 Q297 E302 Q303 | Y295-K299 WeakPolarHBondContact O-CB 3.19Å; Y295-K299 PolarHBondContact O-N 3.4Å; Q297-K299 PolarHBondContact O-N 3.03Å; K299-E302 WeakPolarHBondContact CD-OE2 3.32Å; K299-E302 WeakPolarHBondContact CE-OE2 3.45Å; K299-E302 IonicContact NZ-OE2 2.59Å; K299-E302 PolarHBondContact NZ-OE2 3.45Å; K299-Q303 PolarHBondContact O-N 3.25Å |
| 300 | R | 98.6 | Very high | 98.4 | Very high | 146 Ų | 146 | 97.6 Ų | 97.6 | 55% | 0.551 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -73 | -46.9 | 171.6 | -162 | -165.9 | -61.3 | 127.2 | -3.7 | 111.6 | R296 Q297 K298 E302 Q303 E304 | R296-R300 WeakPolarHBondContact O-CB 3.49Å; R296-R300 PolarHBondContact O-N 3.33Å; Q297-R300 PolarHBondContact O-N 3.17Å; K298-R300 VanDerWaalsContact C-N 3.27Å; K298-R300 PolarHBondContact O-N 2.89Å; R300-E302 VanDerWaalsContact C-N 3.32Å; R300-E302 PolarHBondContact O-N 3.23Å; R300-Q303 CarbonylContact O-C 3.56Å; R300-Q303 WeakPolarHBondContact O-CA 3.07Å; R300-Q303 WeakPolarHBondContact O-CB 3.32Å; R300-Q303 PolarHBondContact O-N 3.07Å; R300-E304 WeakPolarHBondContact CD-OE1 3.32Å; R300-E304 HydrophobicContact CG-CG 4.2Å; R300-E304 VanDerWaalsContact CG-OE1 3.32Å; R300-E304 WeakPolarHBondContact CG-OE1 2.74Å; R300-E304 WeakPolarHBondContact O-CB 3.35Å; R300-E304 WeakPolarHBondContact O-CG 3.26Å; R300-E304 PolarHBondContact O-N 2.87Å |
| 301 | A | 98.4 | Very high | 98.4 | Very high | 53 Ų | 53 | 98.8 Ų | 98.8 | 44% | 0.438 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.7 | -41.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q297 K298 Q303 E304 A305 | Q297-A301 PolarHBondContact O-N 2.9Å; K298-A301 PolarHBondContact O-N 2.86Å; A301-Q303 VanDerWaalsContact C-N 3.35Å; A301-Q303 PolarHBondContact O-N 3.5Å; A301-E304 PolarHBondContact O-N 3.45Å; A301-A305 VanDerWaalsContact O-CB 3.32Å; A301-A305 WeakPolarHBondContact O-CB 3.37Å; A301-A305 PolarHBondContact O-N 2.88Å |
| 302 | E | 98 | Very high | 98.5 | Very high | 66 Ų | 66 | 101.1 Ų | 101.1 | 31% | 0.308 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57.6 | -45.2 | 171 | -73.2 | 168 | -172.7 | 0 | 0 | 112 | K298 K299 R300 L306 | K298-E302 WeakPolarHBondContact CE-OE1 3.44Å; K298-E302 HydrophobicContact CG-CG 4.39Å; K298-E302 VanDerWaalsContact CG-OE1 3.31Å; K298-E302 WeakPolarHBondContact CG-OE1 3.32Å; K298-E302 IonicContact NZ-OE1 2.72Å; K298-E302 WeakPolarHBondContact O-CG 3.31Å; K298-E302 PolarHBondContact O-N 2.98Å; K299-E302 WeakPolarHBondContact CD-OE2 3.32Å; K299-E302 WeakPolarHBondContact CE-OE2 3.45Å; K299-E302 IonicContact NZ-OE2 2.59Å; K299-E302 PolarHBondContact NZ-OE2 3.45Å; R300-E302 VanDerWaalsContact C-N 3.32Å; R300-E302 PolarHBondContact O-N 3.23Å; E302-L306 WeakPolarHBondContact O-CG 3.38Å; E302-L306 PolarHBondContact O-N 3.01Å; E302-L306 VanDerWaalsContact O-N 3.14Å |
| 303 | Q | 98.5 | Very high | 98.5 | Very high | 106 Ų | 106 | 103.6 Ų | 103.6 | 50% | 0.495 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.5 | -40.2 | 178.4 | -173.7 | 62.5 | 54 | 0 | 0 | 111.9 | K299 R300 A301 T307 | K299-Q303 PolarHBondContact O-N 3.25Å; R300-Q303 CarbonylContact O-C 3.56Å; R300-Q303 WeakPolarHBondContact O-CA 3.07Å; R300-Q303 WeakPolarHBondContact O-CB 3.32Å; R300-Q303 PolarHBondContact O-N 3.07Å; A301-Q303 VanDerWaalsContact C-N 3.35Å; A301-Q303 PolarHBondContact O-N 3.5Å; Q303-T307 PolarHBondContact NE2-OG1 2.85Å; Q303-T307 WeakPolarHBondContact O-CB 3.33Å; Q303-T307 PolarHBondContact O-N 2.89Å; Q303-T307 PolarHBondContact O-OG1 3.41Å |
| 304 | E | 98.3 | Very high | 98.5 | Very high | 117 Ų | 117 | 106.2 Ų | 106.2 | 55% | 0.547 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.5 | -40.2 | 178.6 | -75.3 | 165.3 | 168.2 | 0 | 0 | 111.3 | R300 A301 G308 | R300-E304 WeakPolarHBondContact CD-OE1 3.32Å; R300-E304 HydrophobicContact CG-CG 4.2Å; R300-E304 VanDerWaalsContact CG-OE1 3.32Å; R300-E304 WeakPolarHBondContact CG-OE1 2.74Å; R300-E304 WeakPolarHBondContact O-CB 3.35Å; R300-E304 WeakPolarHBondContact O-CG 3.26Å; R300-E304 PolarHBondContact O-N 2.87Å; A301-E304 PolarHBondContact O-N 3.45Å; E304-G308 PolarHBondContact O-N 3.19Å |
| 305 | A | 98.5 | Very high | 98.5 | Very high | 67 Ų | 67 | 103.7 Ų | 103.7 | 55% | 0.554 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.1 | -54.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A301 T307 G308 E309 | A301-A305 VanDerWaalsContact O-CB 3.32Å; A301-A305 WeakPolarHBondContact O-CB 3.37Å; A301-A305 PolarHBondContact O-N 2.88Å; A305-T307 VanDerWaalsContact C-N 3.31Å; A305-T307 PolarHBondContact O-N 2.88Å; A305-G308 WeakPolarHBondContact O-CA 3.44Å; A305-G308 PolarHBondContact O-N 3.3Å; A305-E309 PolarHBondContact O-N 2.96Å |
| 306 | L | 98.4 | Very high | 98.5 | Very high | 96 Ų | 96 | 100.8 Ų | 100.8 | 50% | 0.503 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.2 | -42.8 | 177 | -70.1 | 169.2 | 0 | 0 | 0 | 111.8 | E302 G308 E309 C310 | E302-L306 WeakPolarHBondContact O-CG 3.38Å; E302-L306 PolarHBondContact O-N 3.01Å; E302-L306 VanDerWaalsContact O-N 3.14Å; L306-G308 VanDerWaalsContact C-N 3.28Å; L306-G308 PolarHBondContact O-N 3.37Å; L306-E309 PolarHBondContact O-N 3.44Å; L306-C310 PolarHBondContact O-N 3.28Å; L306-C310 PolarHBondContact O-SG 2.91Å |
| 307 | T | 98.3 | Very high | 98.5 | Very high | 50 Ų | 50 | 97.5 Ų | 97.5 | 31% | 0.307 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -68.4 | -28.4 | 177.9 | -52.7 | 0 | 0 | 0 | 0 | 112 | Q303 A305 K311 | Q303-T307 PolarHBondContact NE2-OG1 2.85Å; Q303-T307 WeakPolarHBondContact O-CB 3.33Å; Q303-T307 PolarHBondContact O-N 2.89Å; Q303-T307 PolarHBondContact O-OG1 3.41Å; A305-T307 VanDerWaalsContact C-N 3.31Å; A305-T307 PolarHBondContact O-N 2.88Å; T307-K311 HydrophobicContact CG2-CD 4.43Å; T307-K311 WeakPolarHBondContact O-CD 3.43Å; T307-K311 VanDerWaalsContact O-CG 3.26Å; T307-K311 WeakPolarHBondContact O-CG 3Å; T307-K311 PolarHBondContact O-N 3.08Å |
| 308 | G | 98.5 | Very high | 98.5 | Very high | 38 Ų | 38 | 98.2 Ų | 98.2 | 39% | 0.392 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -70.1 | -48.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112 | E304 A305 L306 K311 E312 | E304-G308 PolarHBondContact O-N 3.19Å; A305-G308 WeakPolarHBondContact O-CA 3.44Å; A305-G308 PolarHBondContact O-N 3.3Å; L306-G308 VanDerWaalsContact C-N 3.28Å; L306-G308 PolarHBondContact O-N 3.37Å; G308-K311 PolarHBondContact O-N 2.96Å; G308-E312 PolarHBondContact O-N 3.43Å |
| 309 | E | 98.5 | Very high | 98.5 | Very high | 113 Ų | 113 | 94.9 Ų | 94.9 | 53% | 0.528 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.9 | -48.6 | 177.5 | -170.3 | -171.5 | 172.5 | 0 | 0 | 111.5 | A305 L306 K311 E312 L313 | A305-E309 PolarHBondContact O-N 2.96Å; L306-E309 PolarHBondContact O-N 3.44Å; E309-K311 VanDerWaalsContact C-N 3.3Å; E309-K311 PolarHBondContact O-N 2.92Å; E309-E312 PolarHBondContact O-N 3.44Å; E309-L313 HydrophobicContact CG-CD1 3.97Å; E309-L313 HydrophobicContact CG-CG 4.33Å; E309-L313 WeakPolarHBondContact O-CG 3.43Å; E309-L313 PolarHBondContact O-N 3.29Å |
| 310 | C | 98.3 | Very high | 98.5 | Very high | 68 Ų | 68 | 95.6 Ų | 95.6 | 46% | 0.459 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -53.8 | -47.2 | 175.9 | -67 | 0 | 0 | 0 | 0 | 111.8 | L306 E312 L313 E314 | L306-C310 PolarHBondContact O-N 3.28Å; L306-C310 PolarHBondContact O-SG 2.91Å; C310-E312 VanDerWaalsContact C-N 3.3Å; C310-E312 PolarHBondContact O-N 2.72Å; C310-L313 PolarHBondContact O-N 2.89Å; C310-E314 WeakPolarHBondContact O-CB 3.22Å; C310-E314 VanDerWaalsContact O-CG 3.23Å; C310-E314 WeakPolarHBondContact O-CG 3.23Å; C310-E314 PolarHBondContact O-N 3.32Å |
| 311 | K | 98.6 | Very high | 98.5 | Very high | 115 Ų | 115 | 95.1 Ų | 95.1 | 50% | 0.5 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.2 | -28.7 | 178.6 | -72.4 | 170.4 | -176.6 | 173.2 | 0 | 113.6 | T307 G308 E309 K315 | T307-K311 HydrophobicContact CG2-CD 4.43Å; T307-K311 WeakPolarHBondContact O-CD 3.43Å; T307-K311 VanDerWaalsContact O-CG 3.26Å; T307-K311 WeakPolarHBondContact O-CG 3Å; T307-K311 PolarHBondContact O-N 3.08Å; G308-K311 PolarHBondContact O-N 2.96Å; E309-K311 VanDerWaalsContact C-N 3.3Å; E309-K311 PolarHBondContact O-N 2.92Å; K311-K315 WeakPolarHBondContact O-CD 3.39Å; K311-K315 VanDerWaalsContact O-CG 3.25Å; K311-K315 WeakPolarHBondContact O-CG 3.47Å; K311-K315 PolarHBondContact O-N 3.15Å |
| 312 | E | 98.6 | Very high | 98.5 | Very high | 107 Ų | 107 | 99 Ų | 99 | 50% | 0.5 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -77.4 | -40.1 | 175.1 | -157.8 | -169.7 | 142.2 | 0 | 0 | 111.4 | G308 E309 C310 K315 K316 | G308-E312 PolarHBondContact O-N 3.43Å; E309-E312 PolarHBondContact O-N 3.44Å; C310-E312 VanDerWaalsContact C-N 3.3Å; C310-E312 PolarHBondContact O-N 2.72Å; E312-K315 PolarHBondContact O-N 2.91Å; E312-K316 VanDerWaalsContact CD-NZ 3.35Å; E312-K316 WeakPolarHBondContact O-CB 3.38Å; E312-K316 VanDerWaalsContact O-CG 3.27Å; E312-K316 WeakPolarHBondContact O-CG 3.46Å; E312-K316 PolarHBondContact O-N 3.15Å; E312-K316 WeakPolarHBondContact OE1-CE 3.3Å; E312-K316 IonicContact OE1-NZ 2.62Å; E312-K316 PolarHBondContact OE1-NZ 3.02Å |
| 313 | L | 98.6 | Very high | 98.6 | Very high | 89 Ų | 89 | 103.9 Ų | 103.9 | 47% | 0.466 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.5 | -40 | 174.3 | -68.5 | 174 | 0 | 0 | 0 | 112 | E309 C310 K316 N317 | E309-L313 HydrophobicContact CG-CD1 3.97Å; E309-L313 HydrophobicContact CG-CG 4.33Å; E309-L313 WeakPolarHBondContact O-CG 3.43Å; E309-L313 PolarHBondContact O-N 3.29Å; C310-L313 PolarHBondContact O-N 2.89Å; L313-K316 HydrophobicContact CD2-CD 4.42Å; L313-K316 PolarHBondContact O-N 3.32Å; L313-N317 VanDerWaalsContact O-CB 3.3Å; L313-N317 WeakPolarHBondContact O-CB 3.23Å; L313-N317 PolarHBondContact O-N 2.94Å |
| 314 | E | 98.6 | Very high | 98.6 | Very high | 124 Ų | 124 | 101.4 Ų | 101.4 | 58% | 0.579 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -56.9 | -51.6 | 172.2 | -77.2 | 164.7 | -178.7 | 0 | 0 | 111.3 | C310 K316 N317 E318 | C310-E314 WeakPolarHBondContact O-CB 3.22Å; C310-E314 VanDerWaalsContact O-CG 3.23Å; C310-E314 WeakPolarHBondContact O-CG 3.23Å; C310-E314 PolarHBondContact O-N 3.32Å; E314-K316 PolarHBondContact O-N 3.22Å; E314-N317 WeakPolarHBondContact O-CB 3.4Å; E314-N317 PolarHBondContact O-N 3.31Å; E314-E318 PolarHBondContact O-N 3.22Å |
| 315 | K | 98.8 | Very high | 98.6 | Very high | 143 Ų | 143 | 99.4 Ų | 99.4 | 62% | 0.622 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.5 | -40.7 | 176.7 | -71.9 | 170 | -176.3 | 178.8 | 0 | 113 | K311 E312 N317 E318 A319 | K311-K315 WeakPolarHBondContact O-CD 3.39Å; K311-K315 VanDerWaalsContact O-CG 3.25Å; K311-K315 WeakPolarHBondContact O-CG 3.47Å; K311-K315 PolarHBondContact O-N 3.15Å; E312-K315 PolarHBondContact O-N 2.91Å; K315-N317 VanDerWaalsContact C-N 3.33Å; K315-E318 PolarHBondContact O-N 3.37Å; K315-A319 WeakPolarHBondContact O-CB 3.48Å; K315-A319 PolarHBondContact O-N 3.34Å |
| 316 | K | 98.7 | Very high | 98.6 | Very high | 101 Ų | 101 | 99.7 Ų | 99.7 | 44% | 0.439 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.3 | -42.1 | 175 | -75.2 | 165.7 | -178 | 165.8 | 0 | 111.1 | E312 L313 E314 L320 | E312-K316 VanDerWaalsContact CD-NZ 3.35Å; E312-K316 WeakPolarHBondContact O-CB 3.38Å; E312-K316 VanDerWaalsContact O-CG 3.27Å; E312-K316 WeakPolarHBondContact O-CG 3.46Å; E312-K316 PolarHBondContact O-N 3.15Å; E312-K316 WeakPolarHBondContact OE1-CE 3.3Å; E312-K316 IonicContact OE1-NZ 2.62Å; E312-K316 PolarHBondContact OE1-NZ 3.02Å; L313-K316 HydrophobicContact CD2-CD 4.42Å; L313-K316 PolarHBondContact O-N 3.32Å; E314-K316 PolarHBondContact O-N 3.22Å; K316-L320 WeakPolarHBondContact O-CB 3.44Å; K316-L320 WeakPolarHBondContact O-CG 3.29Å; K316-L320 PolarHBondContact O-N 2.97Å |
| 317 | N | 98.6 | Very high | 98.7 | Very high | 114 Ų | 114 | 98.8 Ų | 98.8 | 61% | 0.61 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -66.4 | -44.6 | 178.1 | -167.3 | -5 | 0 | 0 | 0 | 111.4 | L313 E314 K315 L320 K321 | L313-N317 VanDerWaalsContact O-CB 3.3Å; L313-N317 WeakPolarHBondContact O-CB 3.23Å; L313-N317 PolarHBondContact O-N 2.94Å; E314-N317 WeakPolarHBondContact O-CB 3.4Å; E314-N317 PolarHBondContact O-N 3.31Å; K315-N317 VanDerWaalsContact C-N 3.33Å; N317-L320 PolarHBondContact O-N 3.01Å; N317-K321 WeakPolarHBondContact O-CB 3.39Å; N317-K321 PolarHBondContact O-N 3.37Å |
| 318 | E | 98.8 | Very high | 98.7 | Very high | 129 Ų | 129 | 99 Ų | 99 | 60% | 0.603 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -58.5 | -51.5 | 174.7 | -174.9 | 165.6 | -125.9 | 0 | 0 | 111.9 | E314 K315 L320 K321 E322 | E314-E318 PolarHBondContact O-N 3.22Å; K315-E318 PolarHBondContact O-N 3.37Å; E318-L320 VanDerWaalsContact C-N 3.32Å; E318-L320 PolarHBondContact O-N 3.17Å; E318-K321 WeakPolarHBondContact O-CB 3.21Å; E318-K321 PolarHBondContact O-N 3.27Å; E318-K321 VanDerWaalsContact O-N 3.1Å; E318-E322 PolarHBondContact O-N 2.92Å |
| 319 | A | 98.7 | Very high | 98.7 | Very high | 57 Ų | 57 | 104.1 Ų | 104.1 | 47% | 0.471 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.2 | -34.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | K315 R323 | K315-A319 WeakPolarHBondContact O-CB 3.48Å; K315-A319 PolarHBondContact O-N 3.34Å; A319-R323 WeakPolarHBondContact O-CB 3.23Å; A319-R323 PolarHBondContact O-N 2.91Å; A319-R323 VanDerWaalsContact O-N 3.08Å |
| 320 | L | 98.8 | Very high | 98.7 | Very high | 109 Ų | 109 | 104 Ų | 104 | 57% | 0.571 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.6 | -37.7 | 173.2 | -76 | 170.5 | 0 | 0 | 0 | 111.9 | K316 N317 E318 R323 A324 | K316-L320 WeakPolarHBondContact O-CB 3.44Å; K316-L320 WeakPolarHBondContact O-CG 3.29Å; K316-L320 PolarHBondContact O-N 2.97Å; N317-L320 PolarHBondContact O-N 3.01Å; E318-L320 VanDerWaalsContact C-N 3.32Å; E318-L320 PolarHBondContact O-N 3.17Å; L320-R323 PolarHBondContact O-N 3.34Å; L320-A324 WeakPolarHBondContact O-CB 3.25Å; L320-A324 PolarHBondContact O-N 2.83Å |
| 321 | K | 98.8 | Very high | 98.7 | Very high | 135 Ų | 135 | 105.2 Ų | 105.2 | 59% | 0.587 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.6 | -46.7 | 174.9 | -176.6 | -172.9 | 172.8 | -167.9 | 0 | 111.5 | N317 E318 R323 A324 D325 | N317-K321 WeakPolarHBondContact O-CB 3.39Å; N317-K321 PolarHBondContact O-N 3.37Å; E318-K321 WeakPolarHBondContact O-CB 3.21Å; E318-K321 PolarHBondContact O-N 3.27Å; E318-K321 VanDerWaalsContact O-N 3.1Å; K321-R323 VanDerWaalsContact C-N 3.28Å; K321-R323 PolarHBondContact O-N 3.32Å; K321-A324 WeakPolarHBondContact O-CB 3.28Å; K321-A324 PolarHBondContact O-N 3.43Å; K321-A324 VanDerWaalsContact O-N 3.11Å; K321-D325 WeakPolarHBondContact O-CB 3.16Å; K321-D325 PolarHBondContact O-N 2.87Å |
| 322 | E | 98.8 | Very high | 98.7 | Very high | 134 Ų | 134 | 103.6 Ų | 103.6 | 63% | 0.626 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -56.6 | -43.2 | 173.8 | -71.8 | -169.3 | 145.3 | 0 | 0 | 111.8 | E318 D325 S326 | E318-E322 PolarHBondContact O-N 2.92Å; E322-D325 PolarHBondContact O-N 3.22Å; E322-S326 VanDerWaalsContact O-CB 3.29Å; E322-S326 WeakPolarHBondContact O-CB 3.36Å; E322-S326 PolarHBondContact O-N 3.46Å |
| 323 | R | 98.7 | Very high | 98.7 | Very high | 169 Ų | 169 | 105.8 Ų | 105.8 | 64% | 0.638 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.8 | -42.4 | 175.1 | -176.9 | 178.7 | 178.1 | -177.6 | 0.1 | 112.1 | A319 L320 K321 S326 L327 | A319-R323 WeakPolarHBondContact O-CB 3.23Å; A319-R323 PolarHBondContact O-N 2.91Å; A319-R323 VanDerWaalsContact O-N 3.08Å; L320-R323 PolarHBondContact O-N 3.34Å; K321-R323 VanDerWaalsContact C-N 3.28Å; K321-R323 PolarHBondContact O-N 3.32Å; R323-S326 PolarHBondContact O-N 3.04Å; R323-L327 HydrophobicContact CG-CD1 4.17Å; R323-L327 WeakPolarHBondContact O-CG 3.47Å; R323-L327 PolarHBondContact O-N 3.38Å |
| 324 | A | 98.8 | Very high | 98.7 | Very high | 55 Ų | 55 | 105.3 Ų | 105.3 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.7 | -45 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L320 K321 S326 L327 A328 | L320-A324 WeakPolarHBondContact O-CB 3.25Å; L320-A324 PolarHBondContact O-N 2.83Å; K321-A324 WeakPolarHBondContact O-CB 3.28Å; K321-A324 PolarHBondContact O-N 3.43Å; K321-A324 VanDerWaalsContact O-N 3.11Å; A324-S326 VanDerWaalsContact C-N 3.32Å; A324-S326 PolarHBondContact O-N 2.59Å; A324-L327 PolarHBondContact O-N 2.99Å; A324-A328 VanDerWaalsContact O-CB 3.32Å; A324-A328 WeakPolarHBondContact O-CB 3.48Å; A324-A328 PolarHBondContact O-N 3.12Å |
| 325 | D | 98.8 | Very high | 98.7 | Very high | 74 Ų | 74 | 104.8 Ų | 104.8 | 40% | 0.396 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.1 | -34.6 | 176.9 | -74.7 | -19.5 | 0 | 0 | 0 | 112 | K321 E322 K329 | K321-D325 WeakPolarHBondContact O-CB 3.16Å; K321-D325 PolarHBondContact O-N 2.87Å; E322-D325 PolarHBondContact O-N 3.22Å; D325-K329 VanDerWaalsContact O-CD 3.24Å; D325-K329 WeakPolarHBondContact O-CD 3.42Å; D325-K329 WeakPolarHBondContact O-CE 3.41Å; D325-K329 WeakPolarHBondContact O-CG 3.4Å; D325-K329 PolarHBondContact O-N 3.17Å; D325-K329 VanDerWaalsContact O-N 3.13Å |
| 326 | S | 98.8 | Very high | 98.7 | Very high | 73 Ų | 73 | 101.3 Ų | 101.3 | 51% | 0.51 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66 | -50.6 | 174 | -170 | 0 | 0 | 0 | 0 | 111.7 | E322 R323 A324 A328 K329 E330 | E322-S326 VanDerWaalsContact O-CB 3.29Å; E322-S326 WeakPolarHBondContact O-CB 3.36Å; E322-S326 PolarHBondContact O-N 3.46Å; R323-S326 PolarHBondContact O-N 3.04Å; A324-S326 VanDerWaalsContact C-N 3.32Å; A324-S326 PolarHBondContact O-N 2.59Å; S326-A328 VanDerWaalsContact C-N 3.3Å; S326-A328 PolarHBondContact O-N 3.21Å; S326-K329 WeakPolarHBondContact O-CB 3.34Å; S326-K329 PolarHBondContact O-N 3.22Å; S326-K329 VanDerWaalsContact O-N 3.15Å; S326-E330 PolarHBondContact O-N 2.81Å |
| 327 | L | 98.8 | Very high | 98.7 | Very high | 78 Ų | 78 | 99.9 Ų | 99.9 | 41% | 0.408 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.4 | -36.3 | 176 | -70.5 | 169.1 | 0 | 0 | 0 | 112.1 | R323 A324 K329 E330 I331 | R323-L327 HydrophobicContact CG-CD1 4.17Å; R323-L327 WeakPolarHBondContact O-CG 3.47Å; R323-L327 PolarHBondContact O-N 3.38Å; A324-L327 PolarHBondContact O-N 2.99Å; L327-K329 VanDerWaalsContact C-N 3.35Å; L327-K329 PolarHBondContact O-N 2.72Å; L327-E330 PolarHBondContact O-N 3.31Å; L327-I331 WeakPolarHBondContact O-CB 3.09Å; L327-I331 WeakPolarHBondContact O-CD1 3.39Å; L327-I331 WeakPolarHBondContact O-CG1 3.22Å; L327-I331 PolarHBondContact O-N 3.41Å |
| 328 | A | 98.8 | Very high | 98.7 | Very high | 54 Ų | 54 | 98.5 Ų | 98.5 | 45% | 0.446 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.8 | -40.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A324 S326 Q332 | A324-A328 VanDerWaalsContact O-CB 3.32Å; A324-A328 WeakPolarHBondContact O-CB 3.48Å; A324-A328 PolarHBondContact O-N 3.12Å; S326-A328 VanDerWaalsContact C-N 3.3Å; S326-A328 PolarHBondContact O-N 3.21Å; A328-Q332 WeakPolarHBondContact O-CB 3.49Å; A328-Q332 PolarHBondContact O-N 3.21Å |
| 329 | K | 98.8 | Very high | 98.7 | Very high | 146 Ų | 146 | 96.5 Ų | 96.5 | 64% | 0.635 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -66.7 | -42.5 | 175 | -69.1 | 157.8 | -167 | 164 | 0 | 111.8 | D325 S326 L327 Q332 Y333 | D325-K329 VanDerWaalsContact O-CD 3.24Å; D325-K329 WeakPolarHBondContact O-CD 3.42Å; D325-K329 WeakPolarHBondContact O-CE 3.41Å; D325-K329 WeakPolarHBondContact O-CG 3.4Å; D325-K329 PolarHBondContact O-N 3.17Å; D325-K329 VanDerWaalsContact O-N 3.13Å; S326-K329 WeakPolarHBondContact O-CB 3.34Å; S326-K329 PolarHBondContact O-N 3.22Å; S326-K329 VanDerWaalsContact O-N 3.15Å; L327-K329 VanDerWaalsContact C-N 3.35Å; L327-K329 PolarHBondContact O-N 2.72Å; K329-Q332 PolarHBondContact O-N 3.03Å; K329-Y333 WeakPolarHBondContact O-CB 3.26Å; K329-Y333 PolarHBondContact O-N 2.93Å |
| 330 | E | 98.7 | Very high | 98.6 | Very high | 110 Ų | 110 | 100 Ų | 100 | 51% | 0.514 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.5 | -48.1 | 175.3 | -174.3 | -178.5 | -178.8 | 0 | 0 | 111.5 | S326 L327 Q332 Y333 L334 | S326-E330 PolarHBondContact O-N 2.81Å; L327-E330 PolarHBondContact O-N 3.31Å; E330-Q332 PolarHBondContact O-N 3.4Å; E330-Y333 PolarHBondContact O-N 3.27Å; E330-L334 HydrophobicContact CG-CD1 4.18Å; E330-L334 WeakPolarHBondContact O-CG 3.24Å; E330-L334 PolarHBondContact O-N 2.9Å |
| 331 | I | 98.7 | Very high | 98.5 | Very high | 93 Ų | 93 | 98.5 Ų | 98.5 | 48% | 0.477 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.5 | -38 | 175.5 | -72.3 | 165.8 | 0 | 0 | 0 | 111 | L327 K335 | L327-I331 WeakPolarHBondContact O-CB 3.09Å; L327-I331 WeakPolarHBondContact O-CD1 3.39Å; L327-I331 WeakPolarHBondContact O-CG1 3.22Å; L327-I331 PolarHBondContact O-N 3.41Å; I331-K335 HydrophobicContact CG2-CD 4.37Å; I331-K335 VanDerWaalsContact O-CG 3.27Å; I331-K335 WeakPolarHBondContact O-CG 3.48Å; I331-K335 PolarHBondContact O-N 2.94Å; I331-K335 VanDerWaalsContact O-N 3.07Å |
| 332 | Q | 98.8 | Very high | 98.3 | Very high | 81 Ų | 81 | 100.3 Ų | 100.3 | 38% | 0.379 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -69.1 | -49.3 | 177.4 | -172.1 | 53.2 | 39.2 | 0 | 0 | 111.8 | A328 K329 E330 L334 K335 D336 | A328-Q332 WeakPolarHBondContact O-CB 3.49Å; A328-Q332 PolarHBondContact O-N 3.21Å; K329-Q332 PolarHBondContact O-N 3.03Å; E330-Q332 PolarHBondContact O-N 3.4Å; Q332-L334 VanDerWaalsContact C-N 3.28Å; Q332-L334 PolarHBondContact O-N 3.15Å; Q332-K335 WeakPolarHBondContact O-CB 3.03Å; Q332-K335 PolarHBondContact O-N 3.21Å; Q332-D336 PolarHBondContact NE2-OD1 3.45Å; Q332-D336 PolarHBondContact NE2-OD2 3.26Å; Q332-D336 PolarHBondContact O-N 3.08Å |
| 333 | Y | 98.8 | Very high | 98.1 | Very high | 154 Ų | 154 | 98.7 Ų | 98.7 | 60% | 0.604 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -54.5 | -42.7 | 174.8 | 172.4 | -105.5 | 0 | 0 | 0 | 112.5 | K329 E330 D336 L337 | K329-Y333 WeakPolarHBondContact O-CB 3.26Å; K329-Y333 PolarHBondContact O-N 2.93Å; E330-Y333 PolarHBondContact O-N 3.27Å; Y333-D336 PolarHBondContact O-N 3.04Å; Y333-L337 HydrophobicContact CE1-CD2 4.45Å; Y333-L337 VanDerWaalsContact O-CB 3.3Å; Y333-L337 WeakPolarHBondContact O-CB 3.23Å; Y333-L337 PolarHBondContact O-N 3.32Å |
| 334 | L | 98.8 | Very high | 98 | Very high | 78 Ų | 78 | 93.1 Ų | 93.1 | 41% | 0.408 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -67.7 | -36.9 | 176.8 | -68.7 | 174.4 | 0 | 0 | 0 | 112.8 | E330 Q332 I338 | E330-L334 HydrophobicContact CG-CD1 4.18Å; E330-L334 WeakPolarHBondContact O-CG 3.24Å; E330-L334 PolarHBondContact O-N 2.9Å; Q332-L334 VanDerWaalsContact C-N 3.28Å; Q332-L334 PolarHBondContact O-N 3.15Å; L334-I338 WeakPolarHBondContact O-CB 3.43Å; L334-I338 WeakPolarHBondContact O-CD1 3.44Å; L334-I338 WeakPolarHBondContact O-CG1 3.4Å; L334-I338 PolarHBondContact O-N 2.95Å; L334-I338 VanDerWaalsContact O-N 3.1Å |
| 335 | K | 98.7 | Very high | 97.6 | Very high | 114 Ų | 114 | 99.3 Ų | 99.3 | 50% | 0.496 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.7 | -48.4 | 172.3 | -73.4 | 164.3 | -174 | 165.9 | 0 | 111 | I331 Q332 I338 E339 | I331-K335 HydrophobicContact CG2-CD 4.37Å; I331-K335 VanDerWaalsContact O-CG 3.27Å; I331-K335 WeakPolarHBondContact O-CG 3.48Å; I331-K335 PolarHBondContact O-N 2.94Å; I331-K335 VanDerWaalsContact O-N 3.07Å; Q332-K335 WeakPolarHBondContact O-CB 3.03Å; Q332-K335 PolarHBondContact O-N 3.21Å; K335-I338 PolarHBondContact O-N 2.88Å; K335-E339 PolarHBondContact O-N 2.82Å |
| 336 | D | 98.5 | Very high | 97 | Very high | 70 Ų | 70 | 97.9 Ų | 97.9 | 37% | 0.374 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.2 | -45.6 | -175.6 | -64.9 | -31 | 0 | 0 | 0 | 110.8 | Q332 Y333 I338 E339 E340 | Q332-D336 PolarHBondContact NE2-OD1 3.45Å; Q332-D336 PolarHBondContact NE2-OD2 3.26Å; Q332-D336 PolarHBondContact O-N 3.08Å; Y333-D336 PolarHBondContact O-N 3.04Å; D336-I338 VanDerWaalsContact C-N 3.34Å; D336-I338 PolarHBondContact O-N 3.13Å; D336-E339 CarbonylContact O-C 3.58Å; D336-E339 WeakPolarHBondContact O-CA 3.23Å; D336-E339 WeakPolarHBondContact O-CB 3.46Å; D336-E339 PolarHBondContact O-N 3.08Å; D336-E340 PolarHBondContact O-N 3.35Å |
| 337 | L | 98.6 | Very high | 96 | Very high | 71 Ų | 71 | 102.1 Ų | 102.1 | 37% | 0.372 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57 | -43.6 | 173.1 | 179.2 | 62.1 | 0 | 0 | 0 | 112.6 | Y333 E339 E340 V341 | Y333-L337 HydrophobicContact CE1-CD2 4.45Å; Y333-L337 VanDerWaalsContact O-CB 3.3Å; Y333-L337 WeakPolarHBondContact O-CB 3.23Å; Y333-L337 PolarHBondContact O-N 3.32Å; L337-E339 VanDerWaalsContact C-N 3.33Å; L337-E340 PolarHBondContact O-N 3.06Å; L337-V341 WeakPolarHBondContact O-CG2 3.46Å; L337-V341 PolarHBondContact O-N 3.49Å |
| 338 | I | 98 | Very high | 94.6 | Very high | 84 Ų | 84 | 107.5 Ų | 107.5 | 43% | 0.431 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.9 | -35.8 | 176.1 | -69.3 | 167.1 | 0 | 0 | 0 | 111 | L334 K335 D336 R342 | L334-I338 WeakPolarHBondContact O-CB 3.43Å; L334-I338 WeakPolarHBondContact O-CD1 3.44Å; L334-I338 WeakPolarHBondContact O-CG1 3.4Å; L334-I338 PolarHBondContact O-N 2.95Å; L334-I338 VanDerWaalsContact O-N 3.1Å; K335-I338 PolarHBondContact O-N 2.88Å; D336-I338 VanDerWaalsContact C-N 3.34Å; D336-I338 PolarHBondContact O-N 3.13Å; I338-R342 VanDerWaalsContact CG2-CZ 3.4Å; I338-R342 VanDerWaalsContact O-CG 3.27Å; I338-R342 WeakPolarHBondContact O-CG 3.45Å; I338-R342 PolarHBondContact O-N 3.03Å |
| 339 | E | 97.9 | Very high | 93.1 | Very high | 88 Ų | 88 | 115.5 Ų | 115.5 | 41% | 0.411 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -69.5 | -40.6 | 176.5 | -148.4 | -150 | 165.6 | 0 | 0 | 112.1 | K335 D336 L337 R342 K343 | K335-E339 PolarHBondContact O-N 2.82Å; D336-E339 CarbonylContact O-C 3.58Å; D336-E339 WeakPolarHBondContact O-CA 3.23Å; D336-E339 WeakPolarHBondContact O-CB 3.46Å; D336-E339 PolarHBondContact O-N 3.08Å; L337-E339 VanDerWaalsContact C-N 3.33Å; E339-R342 WeakPolarHBondContact O-CB 3.43Å; E339-R342 PolarHBondContact O-N 3.49Å; E339-K343 HydrophobicContact CG-CD 4.49Å; E339-K343 WeakPolarHBondContact O-CB 3.23Å; E339-K343 VanDerWaalsContact O-CG 3.28Å; E339-K343 WeakPolarHBondContact O-CG 3.44Å; E339-K343 PolarHBondContact O-N 2.66Å; E339-K343 WeakPolarHBondContact OE1-CE 3.44Å; E339-K343 IonicContact OE1-NZ 2.9Å; E339-K343 PolarHBondContact OE1-NZ 2.79Å; E339-K343 IonicContact OE2-NZ 2.62Å; E339-K343 PolarHBondContact OE2-NZ 2.94Å |
| 340 | E | 97.4 | Very high | 91.2 | Very high | 130 Ų | 130 | 114.1 Ų | 114.1 | 61% | 0.607 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.2 | -46.2 | 172.4 | -73.4 | -167.8 | 167.7 | 0 | 0 | 111.8 | D336 L337 R342 K343 A344 | D336-E340 PolarHBondContact O-N 3.35Å; L337-E340 PolarHBondContact O-N 3.06Å; E340-R342 VanDerWaalsContact C-N 3.3Å; E340-R342 PolarHBondContact O-N 3.1Å; E340-K343 PolarHBondContact O-N 3.07Å; E340-A344 WeakPolarHBondContact O-CB 3.45Å; E340-A344 PolarHBondContact O-N 3.47Å |
| 341 | V | 96.9 | Very high | 89.3 | Confident | 77 Ų | 77 | 118 Ų | 118 | 47% | 0.467 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.1 | -39.5 | 175.5 | 169.7 | 0 | 0 | 0 | 0 | 111.2 | L337 R345 | L337-V341 WeakPolarHBondContact O-CG2 3.46Å; L337-V341 PolarHBondContact O-N 3.49Å; V341-R345 WeakPolarHBondContact O-CB 3.32Å; V341-R345 VanDerWaalsContact O-CG 3.29Å; V341-R345 WeakPolarHBondContact O-CG 3.41Å; V341-R345 PolarHBondContact O-N 2.98Å |
| 342 | R | 95.1 | Very high | 88.8 | Confident | 173 Ų | 173 | 119.3 Ų | 119.3 | 65% | 0.653 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -63.6 | -48.7 | 173 | -74.6 | 168.1 | 179 | 153.1 | 1 | 111.5 | I338 E339 E340 A344 R345 G346 | I338-R342 VanDerWaalsContact CG2-CZ 3.4Å; I338-R342 VanDerWaalsContact O-CG 3.27Å; I338-R342 WeakPolarHBondContact O-CG 3.45Å; I338-R342 PolarHBondContact O-N 3.03Å; E339-R342 WeakPolarHBondContact O-CB 3.43Å; E339-R342 PolarHBondContact O-N 3.49Å; E340-R342 VanDerWaalsContact C-N 3.3Å; E340-R342 PolarHBondContact O-N 3.1Å; R342-A344 PolarHBondContact O-N 3.38Å; R342-R345 PolarHBondContact O-N 3.36Å; R342-G346 PolarHBondContact O-N 2.82Å |
| 343 | K | 94.9 | Very high | 88.3 | Confident | 100 Ų | 100 | 121.3 Ų | 121.3 | 44% | 0.435 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -57.5 | -45.3 | 176.8 | -75.1 | 163.2 | 174.3 | 165 | 0 | 111.4 | E339 E340 G346 K347 | E339-K343 HydrophobicContact CG-CD 4.49Å; E339-K343 WeakPolarHBondContact O-CB 3.23Å; E339-K343 VanDerWaalsContact O-CG 3.28Å; E339-K343 WeakPolarHBondContact O-CG 3.44Å; E339-K343 PolarHBondContact O-N 2.66Å; E339-K343 WeakPolarHBondContact OE1-CE 3.44Å; E339-K343 IonicContact OE1-NZ 2.9Å; E339-K343 PolarHBondContact OE1-NZ 2.79Å; E339-K343 IonicContact OE2-NZ 2.62Å; E339-K343 PolarHBondContact OE2-NZ 2.94Å; E340-K343 PolarHBondContact O-N 3.07Å; K343-G346 PolarHBondContact O-N 3.05Å; K343-K347 VanDerWaalsContact O-CG 3.25Å; K343-K347 WeakPolarHBondContact O-CG 3.27Å; K343-K347 PolarHBondContact O-N 3.2Å |
| 344 | A | 94.8 | Very high | 87.7 | Confident | 53 Ų | 53 | 119.4 Ų | 119.4 | 44% | 0.438 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -66.4 | -39.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | E340 R342 K348 | E340-A344 WeakPolarHBondContact O-CB 3.45Å; E340-A344 PolarHBondContact O-N 3.47Å; R342-A344 PolarHBondContact O-N 3.38Å; A344-K348 PolarHBondContact O-N 2.76Å |
| 345 | R | 91 | Very high | 87.1 | Confident | 185 Ų | 185 | 121.9 Ų | 121.9 | 70% | 0.698 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -72.1 | -34.1 | 176.1 | -70.1 | 179.8 | 76.4 | -157.6 | 5 | 112.9 | V341 R342 | V341-R345 WeakPolarHBondContact O-CB 3.32Å; V341-R345 VanDerWaalsContact O-CG 3.29Å; V341-R345 WeakPolarHBondContact O-CG 3.41Å; V341-R345 PolarHBondContact O-N 2.98Å; R342-R345 PolarHBondContact O-N 3.36Å |
| 346 | G | 86.6 | Confident | 86.3 | Confident | 43 Ų | 43 | 122.4 Ų | 122.4 | 44% | 0.443 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -65.1 | -47.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | R342 K343 K348 R349 | R342-G346 PolarHBondContact O-N 2.82Å; K343-G346 PolarHBondContact O-N 3.05Å; G346-K348 PolarHBondContact O-N 3.27Å; G346-R349 PolarHBondContact O-N 2.75Å |
| 347 | K | 77.7 | Confident | 85.5 | Confident | 162 Ų | 162 | 125.9 Ų | 125.9 | 70% | 0.704 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -56.6 | -33.2 | 177.7 | -72.6 | 168.2 | -176.9 | -177.8 | 0 | 113.3 | K343 R349 | K343-K347 VanDerWaalsContact O-CG 3.25Å; K343-K347 WeakPolarHBondContact O-CG 3.27Å; K343-K347 PolarHBondContact O-N 3.2Å; K347-R349 PolarHBondContact O-N 3.39Å |
| 348 | K | 70.2 | Confident | 84.6 | Confident | 191 Ų | 191 | 129.8 Ų | 129.8 | 83% | 0.83 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | 6 | 176.3 | -70.3 | -173.3 | 177 | -175.3 | 0 | 115.1 | A344 G346 | A344-K348 PolarHBondContact O-N 2.76Å; G346-K348 PolarHBondContact O-N 3.27Å |
| 349 | R | 66.8 | Low | 83.6 | Confident | 222 Ų | 222 | 133.3 Ų | 133.3 | 84% | 0.838 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.9 | 5.1 | 177.4 | -73.9 | -158.4 | 172.7 | -136.3 | -0.5 | 114.8 | G346 K347 | G346-R349 PolarHBondContact O-N 2.75Å; K347-R349 PolarHBondContact O-N 3.39Å |
| 350 | V | 57.9 | Low | 82.4 | Confident | 117 Ų | 117 | 137.1 Ų | 137.1 | 71% | 0.709 | 67% | 0.672 | S | S | * | * | trans | -90.5 | 121.5 | 165.4 | -173.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 351 | P | 59.4 | Low | 81 | Confident | 192 Ų | 192 | 137.7 Ų | 137.7 | 100% | 1.247 | 68% | 0.678 | S | S | * | * | trans | -77.7 | 0 | 175.6 | 34.3 | -35.3 | 0 | 0 | 0 | 112.6 |
Retrieved 351 of 351 residues in 523.6 ms
(Link to these results)