| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43 | Very low | 46.7 | Very low | 248 Ų | 248 | 147.7 Ų | 147.7 | 100% | 1.222 | 87% | 0.87 | S | S | * | * | 0 | 114.7 | 0 | -83.6 | 158.2 | 149.2 | 0 | 0 | 107.1 | |||||
| 2 | G | 42 | Very low | 47.5 | Very low | 81 Ų | 81 | 146.6 Ų | 146.6 | 84% | 0.835 | 87% | 0.87 | S | S | * | * | trans | 65.6 | 152.3 | 166.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 3 | D | 42.1 | Very low | 47.4 | Very low | 171 Ų | 171 | 142 Ų | 142 | 91% | 0.914 | 86% | 0.858 | S | S | * | * | cis | -172.4 | 156.5 | -0.4 | -175.1 | -102 | 0 | 0 | 0 | 107.1 | ||||
| 4 | G | 40.5 | Very low | 47.3 | Very low | 71 Ų | 71 | 149.5 Ų | 149.5 | 73% | 0.732 | 86% | 0.863 | S | S | * | * | trans | 110 | 123.7 | 162.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 5 | G | 38.3 | Very low | 46.9 | Very low | 81 Ų | 81 | 152.1 Ų | 152.1 | 84% | 0.835 | 85% | 0.853 | S | S | * | * | cis | 173 | 107.8 | 0.7 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 6 | A | 54.6 | Low | 46.7 | Very low | 107 Ų | 107 | 148.8 Ų | 148.8 | 88% | 0.884 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -99.5 | 116.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||
| 7 | E | 55.6 | Low | 46.4 | Very low | 197 Ų | 197 | 149.1 Ų | 149.1 | 92% | 0.921 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 150.3 | -178.8 | -166.1 | 166.2 | 84.7 | 0 | 0 | 111.7 | ||
| 8 | R | 51.7 | Low | 46.2 | Very low | 210 Ų | 210 | 147.7 Ų | 147.7 | 79% | 0.792 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 142.2 | -170.3 | -57.3 | 155.5 | -163.5 | -102.9 | 1 | 108.4 | ||
| 9 | D | 51.2 | Low | 46.2 | Very low | 166 Ų | 166 | 145.1 Ų | 145.1 | 89% | 0.888 | 84% | 0.843 | S | S | * | * | trans | -132.9 | 119.6 | 144.2 | -155.2 | -97.9 | 0 | 0 | 0 | 110.1 | ||||
| 10 | R | 51.2 | Low | 45.7 | Very low | 226 Ų | 226 | 142 Ų | 142 | 85% | 0.853 | 84% | 0.844 | S | S | * | * | trans | -107.1 | 126.8 | 175.9 | -89.5 | -177.3 | -175.4 | 165.3 | 0.6 | 106.6 | ||||
| 11 | G | 43.7 | Very low | 45.3 | Very low | 67 Ų | 67 | 139.2 Ų | 139.2 | 69% | 0.691 | 85% | 0.845 | S | S | * | * | trans | -159.4 | 145.9 | 162.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 12 | P | 55.5 | Low | 44.9 | Very low | 134 Ų | 134 | 131.5 Ų | 131.5 | 87% | 0.87 | 83% | 0.829 | S | S | * | * | -103.5 | 155.5 | -121.1 | 35.7 | -34.2 | 0 | 0 | 0 | 116.5 | |||||
| 13 | A | 46.6 | Very low | 44.6 | Very low | 87 Ų | 87 | 131.3 Ų | 131.3 | 72% | 0.719 | 83% | 0.827 | S | S | * | * | trans | -75.1 | 162.5 | 164.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 14 | R | 46.8 | Very low | 44.5 | Very low | 247 Ų | 247 | 135.7 Ų | 135.7 | 93% | 0.932 | 83% | 0.831 | S | S | * | * | trans | 127.8 | 131.9 | 162.1 | -70.6 | 162 | -161.5 | -91.4 | 3.8 | 108.4 | ||||
| 15 | R | 40.2 | Very low | 44.5 | Very low | 188 Ų | 188 | 136.2 Ų | 136.2 | 71% | 0.709 | 84% | 0.836 | S | S | * | * | cis | -162.9 | 133.4 | 25.5 | -178.4 | 166.3 | 173.4 | -103.3 | -9.4 | 108 | E17 | R15-E17 IonicContact CZ-OE1 3.36Å; R15-E17 IonicContact CZ-OE2 3.49Å; R15-E17 IonicContact NH1-OE1 3.31Å; R15-E17 PolarHBondContact NH1-OE1 2.78Å; R15-E17 IonicContact NH1-OE2 2.69Å; R15-E17 PolarHBondContact NH1-OE2 2.8Å; R15-E17 IonicContact NH2-OE1 2.75Å; R15-E17 PolarHBondContact NH2-OE1 3.05Å; R15-E17 IonicContact NH2-OE2 3.67Å | ||
| 16 | A | 44.4 | Very low | 44.6 | Very low | 100 Ų | 100 | 136.2 Ų | 136.2 | 83% | 0.826 | 84% | 0.836 | S | S | * | * | trans | -75.4 | 134.7 | 163.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 17 | E | 41.9 | Very low | 43.7 | Very low | 153 Ų | 153 | 139 Ų | 139 | 72% | 0.715 | 84% | 0.836 | S | S | * | * | trans | -126.9 | 130.8 | 158.3 | -80.5 | -162.7 | 116.6 | 0 | 0 | 110.4 | R15 | R15-E17 IonicContact CZ-OE1 3.36Å; R15-E17 IonicContact CZ-OE2 3.49Å; R15-E17 IonicContact NH1-OE1 3.31Å; R15-E17 PolarHBondContact NH1-OE1 2.78Å; R15-E17 IonicContact NH1-OE2 2.69Å; R15-E17 PolarHBondContact NH1-OE2 2.8Å; R15-E17 IonicContact NH2-OE1 2.75Å; R15-E17 PolarHBondContact NH2-OE1 3.05Å; R15-E17 IonicContact NH2-OE2 3.67Å | ||
| 18 | S | 42.8 | Very low | 43.3 | Very low | 125 Ų | 125 | 141.3 Ų | 141.3 | 87% | 0.874 | 84% | 0.836 | S | S | * | * | trans | -116.7 | 127.9 | 178.5 | 172.1 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 19 | A | 46.3 | Very low | 42.6 | Very low | 97 Ų | 97 | 135 Ų | 135 | 80% | 0.802 | 84% | 0.836 | S | S | * | * | trans | -168.8 | 116.4 | 159.9 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 20 | G | 36.5 | Very low | 41.9 | Very low | 83 Ų | 83 | 130.8 Ų | 130.8 | 86% | 0.856 | 83% | 0.833 | S | S | * | * | 83.6 | 117.7 | 85.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | |||||
| 21 | G | 35.9 | Very low | 41.4 | Very low | 85 Ų | 85 | 124.5 Ų | 124.5 | 88% | 0.876 | 83% | 0.829 | S | S | * | * | cis | 107.9 | 113.7 | 38.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 22 | G | 35.3 | Very low | 41.5 | Very low | 86 Ų | 86 | 129.3 Ų | 129.3 | 89% | 0.887 | 83% | 0.833 | S | S | * | * | trans | 104.9 | 139.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 23 | G | 36.1 | Very low | 40.6 | Very low | 77 Ų | 77 | 129.8 Ų | 129.8 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | cis | -166.2 | 146.1 | 2.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 24 | R | 40.3 | Very low | 40.7 | Very low | 263 Ų | 263 | 133.4 Ų | 133.4 | 99% | 0.992 | 84% | 0.835 | S | S | * | * | trans | -83.7 | 111.6 | 173 | -72.8 | 176.9 | 171.4 | -130.6 | -0.6 | 108.2 | ||||
| 25 | G | 40.1 | Very low | 40.3 | Very low | 81 Ų | 81 | 133.4 Ų | 133.4 | 84% | 0.835 | 84% | 0.835 | S | S | * | * | trans | -86.1 | 125.3 | 164.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 26 | G | 39.2 | Very low | 40.4 | Very low | 81 Ų | 81 | 129.3 Ų | 129.3 | 84% | 0.835 | 84% | 0.841 | S | S | * | * | trans | -79.1 | 158.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 27 | D | 37.6 | Very low | 40.1 | Very low | 165 Ų | 165 | 132.4 Ų | 132.4 | 88% | 0.882 | 84% | 0.844 | S | S | * | * | trans | -133 | 129.2 | 158 | -168.6 | -116.1 | 0 | 0 | 0 | 109.1 | ||||
| 28 | R | 45.7 | Very low | 39.8 | Very low | 246 Ų | 246 | 128.2 Ų | 128.2 | 93% | 0.928 | 84% | 0.842 | S | S | * | * | trans | -110.3 | 127.6 | -179.8 | -80 | 179.8 | 175.1 | -178.9 | -1.2 | 107.3 | ||||
| 29 | G | 37.8 | Very low | 39.3 | Very low | 77 Ų | 77 | 126.6 Ų | 126.6 | 79% | 0.794 | 85% | 0.845 | S | S | * | * | trans | -173.4 | 121.1 | 157.4 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 30 | G | 35.5 | Very low | 38.9 | Very low | 79 Ų | 79 | 125.1 Ų | 125.1 | 81% | 0.814 | 84% | 0.839 | S | S | * | * | cis | 112.8 | 93.2 | 33.3 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 31 | A | 41.9 | Very low | 39 | Very low | 93 Ų | 93 | 130.4 Ų | 130.4 | 77% | 0.769 | 84% | 0.841 | S | S | * | * | trans | -157.1 | 118.6 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 32 | E | 44.5 | Very low | 39.4 | Very low | 168 Ų | 168 | 132.2 Ų | 132.2 | 79% | 0.785 | 84% | 0.84 | S | S | * | * | trans | -54.6 | 149.2 | 173.2 | 52.1 | -115.3 | 79.8 | 0 | 0 | 115.3 | ||||
| 33 | D | 38.3 | Very low | 40 | Very low | 144 Ų | 144 | 133.2 Ų | 133.2 | 77% | 0.77 | 83% | 0.831 | S | S | * | * | -164.2 | 113.6 | 125.8 | -105.4 | -37.6 | 0 | 0 | 0 | 113.1 | |||||
| 34 | L | 47.7 | Very low | 40.3 | Very low | 164 Ų | 164 | 136.6 Ų | 136.6 | 86% | 0.859 | 84% | 0.836 | S | S | * | * | trans | 41.3 | 134.3 | 139.6 | -61.5 | 167.9 | 0 | 0 | 0 | 123.1 | ||||
| 35 | R | 38 | Very low | 40.3 | Very low | 247 Ų | 247 | 132.3 Ų | 132.3 | 93% | 0.932 | 83% | 0.828 | S | S | * | * | trans | -88.2 | 151.2 | -176.4 | -60.5 | 173.3 | 162.4 | -151.6 | -4.6 | 113.3 | ||||
| 36 | A | 42.1 | Very low | 40.4 | Very low | 102 Ų | 102 | 135.4 Ų | 135.4 | 84% | 0.843 | 83% | 0.83 | S | S | * | * | trans | 173.5 | 142 | 141.3 | 0 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 37 | D | 37.7 | Very low | 40.5 | Very low | 164 Ų | 164 | 135.9 Ų | 135.9 | 88% | 0.877 | 83% | 0.826 | S | S | * | * | cis | -170.9 | 130 | 8.3 | -176.7 | -106.1 | 0 | 0 | 0 | 102.7 | ||||
| 38 | G | 35.6 | Very low | 40.4 | Very low | 65 Ų | 65 | 131.4 Ų | 131.4 | 67% | 0.67 | 82% | 0.819 | S | S | * | * | 107.9 | 104.7 | 90.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 39 | G | 33.9 | Very low | 40.3 | Very low | 92 Ų | 92 | 126.6 Ų | 126.6 | 95% | 0.948 | 82% | 0.817 | S | S | * | * | trans | 70.2 | 138.8 | 158.8 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 40 | G | 37 | Very low | 40.3 | Very low | 65 Ų | 65 | 128.1 Ų | 128.1 | 67% | 0.67 | 82% | 0.816 | S | S | * | * | cis | 161.3 | 143.4 | 8.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 41 | H | 39.3 | Very low | 40.6 | Very low | 194 Ų | 194 | 129.4 Ų | 129.4 | 90% | 0.898 | 82% | 0.818 | S | S | * | * | trans | 92.8 | 89.7 | 166.7 | -46.8 | 165.9 | 0 | 0 | 0 | 118.8 | ||||
| 42 | S | 43 | Very low | 40.5 | Very low | 124 Ų | 124 | 130.6 Ų | 130.6 | 87% | 0.867 | 82% | 0.821 | S | S | * | * | 36.4 | 157 | 118.5 | -84.1 | 0 | 0 | 0 | 0 | 123.7 | |||||
| 43 | P | 48.7 | Very low | 40.4 | Very low | 106 Ų | 106 | 128 Ų | 128 | 69% | 0.688 | 82% | 0.822 | S | S | * | * | -113.1 | 160.2 | -120.5 | 40.9 | -35 | 0 | 0 | 0 | 114.8 | |||||
| 44 | T | 42.5 | Very low | 41.1 | Very low | 148 Ų | 148 | 127.6 Ų | 127.6 | 91% | 0.908 | 83% | 0.827 | S | S | * | * | trans | -116.4 | 116.8 | 154.2 | 30.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 45 | E | 40.5 | Very low | 40.7 | Very low | 174 Ų | 174 | 124.7 Ų | 124.7 | 81% | 0.813 | 83% | 0.826 | S | S | * | * | trans | -51.2 | 134.9 | 170.6 | -58.1 | -101.1 | 124.9 | 0 | 0 | 112.4 | ||||
| 46 | V | 42.6 | Very low | 40.7 | Very low | 146 Ų | 146 | 116.8 Ų | 116.8 | 89% | 0.885 | 82% | 0.822 | S | S | * | * | trans | -155.8 | 119.1 | 133.1 | -80.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 47 | A | 40.8 | Very low | 40.7 | Very low | 90 Ų | 90 | 117.6 Ų | 117.6 | 74% | 0.744 | 82% | 0.821 | S | S | * | * | trans | -55.5 | 150.2 | 166.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 48 | G | 36.3 | Very low | 41.4 | Very low | 71 Ų | 71 | 121.3 Ų | 121.3 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | cis | 83.6 | 67 | 29.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 49 | T | 43.3 | Very low | 41.7 | Very low | 145 Ų | 145 | 126.6 Ų | 126.6 | 89% | 0.89 | 83% | 0.83 | S | S | * | * | trans | -153.8 | 139.9 | 160.4 | 37.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 50 | S | 38 | Very low | 42 | Very low | 110 Ų | 110 | 127.8 Ų | 127.8 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | trans | -83.4 | 169.1 | -165.4 | -56.1 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 51 | A | 41.5 | Very low | 42.3 | Very low | 105 Ų | 105 | 128.7 Ų | 128.7 | 87% | 0.868 | 83% | 0.833 | S | S | * | * | trans | -31.4 | 131.3 | 162.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 52 | S | 40.1 | Very low | 42.6 | Very low | 119 Ų | 119 | 124.3 Ų | 124.3 | 83% | 0.832 | 83% | 0.831 | S | S | * | * | trans | -110 | 114.3 | 168.1 | -62 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 53 | S | 41 | Very low | 42.7 | Very low | 113 Ų | 113 | 125.8 Ų | 125.8 | 79% | 0.79 | 83% | 0.829 | S | S | * | * | trans | -82 | 141.9 | 154.9 | -61.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 54 | P | 52.8 | Low | 42.7 | Very low | 135 Ų | 135 | 126.1 Ų | 126.1 | 88% | 0.877 | 83% | 0.834 | S | S | * | * | trans | -95.4 | 115.3 | 164 | 31.7 | -24.2 | 0 | 0 | 0 | 109.7 | ||||
| 55 | A | 39.6 | Very low | 42.9 | Very low | 103 Ų | 103 | 126.6 Ų | 126.6 | 85% | 0.851 | 83% | 0.831 | S | S | * | * | trans | -122.3 | 130.8 | 159.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 56 | G | 37.8 | Very low | 43.2 | Very low | 82 Ų | 82 | 121.6 Ų | 121.6 | 85% | 0.845 | 83% | 0.826 | S | S | * | * | trans | 109.6 | 111.6 | 153.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 57 | S | 42.4 | Very low | 43.3 | Very low | 118 Ų | 118 | 123.2 Ų | 123.2 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | -154.2 | 134.7 | 118.7 | -158.5 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 58 | R | 52.3 | Low | 43.6 | Very low | 242 Ų | 242 | 124.9 Ų | 124.9 | 91% | 0.913 | 83% | 0.827 | S | S | * | * | trans | -121.1 | 130.7 | 176 | -85.3 | 177.3 | 154.6 | -168.1 | -5.2 | 107.1 | ||||
| 59 | E | 41.4 | Very low | 43.6 | Very low | 176 Ų | 176 | 124.1 Ų | 124.1 | 82% | 0.822 | 82% | 0.819 | S | S | * | * | trans | 177.4 | 153.1 | 147.1 | 56.3 | -173.4 | 102.1 | 0 | 0 | 107.2 | ||||
| 60 | S | 41.4 | Very low | 44.1 | Very low | 118 Ų | 118 | 123.8 Ų | 123.8 | 83% | 0.825 | 82% | 0.82 | S | S | * | * | cis | -167.6 | 140 | -26.4 | -90 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 61 | G | 43 | Very low | 44.8 | Very low | 83 Ų | 83 | 121.6 Ų | 121.6 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | trans | 45.3 | 118.4 | 151.5 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 62 | A | 44.9 | Very low | 45.2 | Very low | 102 Ų | 102 | 125.2 Ų | 125.2 | 84% | 0.843 | 81% | 0.813 | S | S | * | * | trans | -152.9 | 114 | 134.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 63 | D | 45 | Very low | 45.9 | Very low | 156 Ų | 156 | 122.7 Ų | 122.7 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | trans | -78.1 | 126.6 | 164.7 | -179.8 | -98.4 | 0 | 0 | 0 | 108.2 | ||||
| 64 | S | 49.8 | Very low | 47 | Very low | 112 Ų | 112 | 122.7 Ų | 122.7 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | trans | -162.7 | 104.3 | 165.5 | -76.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 65 | D | 46.3 | Very low | 47.8 | Very low | 158 Ų | 158 | 123.2 Ų | 123.2 | 85% | 0.845 | 78% | 0.781 | S | S | * | * | trans | 5.6 | 126.3 | 144.6 | -116.9 | -93.3 | 0 | 0 | 0 | 119.5 | ||||
| 66 | G | 47.1 | Very low | 49.6 | Very low | 69 Ų | 69 | 120.8 Ų | 120.8 | 71% | 0.711 | 76% | 0.757 | S | S | * | * | trans | 68 | 97.4 | 139.5 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 67 | Q | 43.9 | Very low | 51.7 | Low | 180 Ų | 180 | 122.8 Ų | 122.8 | 84% | 0.841 | 74% | 0.739 | S | S | * | * | 171.9 | 129.7 | 128.4 | -158.9 | 85.5 | -92.8 | 0 | 0 | 110.1 | G69 | Q67-G69 PolarHBondContact O-N 3.44Å; Q67-G69 VanDerWaalsContact O-N 3.12Å | |||
| 68 | P | 46.6 | Very low | 53.6 | Low | 126 Ų | 126 | 125.5 Ų | 125.5 | 82% | 0.818 | 73% | 0.731 | S | S | * | * | trans | -75 | 102 | 167 | 29.6 | -28.7 | 0 | 0 | 0 | 109.2 | ||||
| 69 | G | 36.9 | Very low | 55.3 | Low | 54 Ų | 54 | 116.4 Ų | 116.4 | 56% | 0.557 | 70% | 0.7 | S | S | * | * | trans | -70.9 | 149.4 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q67 G71 | Q67-G69 PolarHBondContact O-N 3.44Å; Q67-G69 VanDerWaalsContact O-N 3.12Å; G69-G71 PolarHBondContact O-N 2.92Å | ||
| 70 | P | 55.1 | Low | 57.7 | Low | 139 Ų | 139 | 113.7 Ų | 113.7 | 90% | 0.903 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.5 | 32.1 | -174 | 34 | -36.6 | 0 | 0 | 0 | 113.6 | ||
| 71 | G | 50.8 | Low | 60 | Low | 63 Ų | 63 | 111.3 Ų | 111.3 | 65% | 0.649 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -4.3 | -170 | 0 | 0 | 0 | 0 | 0 | 115.9 | G69 | G69-G71 PolarHBondContact O-N 2.92Š|
| 72 | E | 50 | Low | 62.4 | Low | 182 Ų | 182 | 115.9 Ų | 115.9 | 85% | 0.85 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | -3.1 | -172.8 | -153.1 | 178.5 | 169.8 | 0 | 0 | 113.9 | D74 | E72-D74 VanDerWaalsContact C-N 3.34Å; E72-D74 PolarHBondContact O-N 3.36Å |
| 73 | A | 56 | Low | 64.4 | Low | 65 Ų | 65 | 114 Ų | 114 | 54% | 0.537 | 64% | 0.638 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.7 | -6.2 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 74 | D | 63.7 | Low | 66.3 | Low | 114 Ų | 114 | 112 Ų | 112 | 61% | 0.61 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.8 | 3.6 | -155.8 | -133.5 | 32.8 | 0 | 0 | 0 | 116.6 | E72 K95 | E72-D74 VanDerWaalsContact C-N 3.34Å; E72-D74 PolarHBondContact O-N 3.36Å; D74-K95 WeakPolarHBondContact O-CD 3.37Å; D74-K95 WeakPolarHBondContact O-CE 3.44Å; D74-K95 PolarHBondContact O-NZ 2.92Å; D74-K95 IonicContact OD1-NZ 2.81Å; D74-K95 PolarHBondContact OD1-NZ 3.2Å; D74-K95 IonicContact OD2-NZ 3.24Å |
| 75 | H | 69.7 | Low | 68.2 | Low | 145 Ų | 145 | 115.9 Ų | 115.9 | 67% | 0.671 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -14.8 | 179.6 | -65.1 | 88.9 | 0 | 0 | 0 | 114.2 | K95 | H75-K95 PolarHBondContact O-N 3.23Š|
| 76 | C | 77.1 | Confident | 70.2 | Confident | 52 Ų | 52 | 110.4 Ų | 110.4 | 35% | 0.351 | 63% | 0.627 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -127.1 | 133.5 | -174.1 | -67.1 | 0 | 0 | 0 | 0 | 111.8 | V92 L93 K95 | C76-V92 HydrophobicContact CB-CG1 3.41Å; C76-V92 VanDerWaalsContact CB-CG1 3.41Å; C76-L93 CarbonylContact C-O 3.6Å; C76-L93 WeakPolarHBondContact CA-O 3.26Å; C76-K95 WeakPolarHBondContact O-CE 3.45Å |
| 77 | R | 82.1 | Confident | 72.2 | Confident | 125 Ų | 125 | 111 Ų | 111 | 47% | 0.472 | 62% | 0.617 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -87.8 | 119.1 | 167.2 | -174.3 | 178.8 | 179.9 | -144.3 | 1 | 108.2 | I79 L93 K95 | R77-I79 HydrophobicContact CG-CG1 4.09Å; R77-L93 PolarHBondContact N-O 3.42Å; R77-L93 PolarHBondContact O-N 3.34Å; R77-K95 HydrophobicContact CB-CG 4.12Å |
| 78 | R | 83.3 | Confident | 74.5 | Confident | 175 Ų | 175 | 106.9 Ų | 106.9 | 66% | 0.66 | 60% | 0.599 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -90.7 | 118.9 | 174.6 | -62.4 | 172.9 | 168.2 | 164.2 | 5.9 | 108.8 | E90 V92 | R78-E90 HydrophobicContact CB-CG 4.36Å; R78-E90 WeakPolarHBondContact CB-OE1 3.42Å; R78-E90 WeakPolarHBondContact CD-OE1 3.35Å; R78-E90 WeakPolarHBondContact CG-OE1 3.45Å; R78-E90 IonicContact NE-OE1 3.29Å; R78-E90 PolarHBondContact NE-OE1 3.09Å; R78-V92 HydrophobicContact CG-CG2 4.42Å |
| 79 | I | 87.3 | Confident | 76.5 | Confident | 50 Ų | 50 | 109.1 Ų | 109.1 | 26% | 0.256 | 59% | 0.591 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -115.7 | 121.9 | 177.1 | -54.7 | -179.6 | 0 | 0 | 0 | 107.7 | R77 V81 I91 L93 L99 | R77-I79 HydrophobicContact CG-CG1 4.09Å; I79-V81 HydrophobicContact CG2-CG2 4.14Å; I79-I91 PolarHBondContact N-O 3.14Å; I79-I91 PolarHBondContact O-N 3.49Å; I79-L93 HydrophobicContact CD1-CD1 3.93Å; I79-L93 HydrophobicContact CG1-CD1 4.31Å; I79-L99 HydrophobicContact CD1-CD1 4.45Å |
| 80 | L | 90.7 | Very high | 78.9 | Confident | 120 Ų | 120 | 111.5 Ų | 111.5 | 63% | 0.628 | 59% | 0.588 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -85.6 | 115.8 | 173.9 | -62.1 | 178.3 | 0 | 0 | 0 | 109 | I88 R89 E90 | L80-I88 HydrophobicContact CB-CG2 3.79Å; L80-I88 HydrophobicContact CD1-CG2 4.4Å; L80-I88 HydrophobicContact CD2-CG2 4.09Å; L80-I88 HydrophobicContact CG-CG2 4.31Å; L80-R89 WeakPolarHBondContact CA-O 3.31Å; L80-E90 HydrophobicContact CD2-CB 3.95Å; L80-E90 HydrophobicContact CD2-CG 4.16Å |
| 81 | V | 91.2 | Very high | 80.4 | Confident | 68 Ų | 68 | 108.5 Ų | 108.5 | 41% | 0.412 | 56% | 0.564 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -107 | 121.3 | 175.9 | 179.8 | 0 | 0 | 0 | 0 | 108.9 | I79 R89 I91 | I79-V81 HydrophobicContact CG2-CG2 4.14Å; V81-R89 PolarHBondContact N-O 2.79Å; V81-R89 PolarHBondContact O-N 3.48Å; V81-I91 HydrophobicContact CB-CD1 4.02Å; V81-I91 HydrophobicContact CB-CG1 4.46Å; V81-I91 HydrophobicContact CG2-CD1 3.41Å; V81-I91 VanDerWaalsContact CG2-CD1 3.41Å; V81-I91 HydrophobicContact CG2-CG1 4.01Å |
| 82 | R | 92.7 | Very high | 81.9 | Confident | 179 Ų | 179 | 109.2 Ų | 109.2 | 68% | 0.675 | 56% | 0.556 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -85.4 | 128.7 | 172.7 | -172.7 | -177.9 | -77.4 | -180 | -3 | 109.4 | T87 I88 | R82-T87 CarbonylContact C-O 3.59Å; R82-T87 WeakPolarHBondContact CA-O 3.33Å; R82-I88 HydrophobicContact CB-CG1 4.44Å; R82-I88 HydrophobicContact CG-CG1 4.39Å |
| 83 | D | 86.6 | Confident | 83.4 | Confident | 63 Ų | 63 | 102.4 Ų | 102.4 | 34% | 0.337 | 53% | 0.525 | S | S | . | . | trans | -82.7 | 174 | 174.9 | 70.7 | 20.1 | 0 | 0 | 0 | 112.7 | K85 G86 T87 | D83-K85 PolarHBondContact O-N 2.98Å; D83-K85 VanDerWaalsContact OD1-C 3.29Å; D83-K85 WeakPolarHBondContact OD1-CA 3.47Å; D83-K85 WeakPolarHBondContact OD1-CB 3.5Å; D83-K85 PolarHBondContact OD1-N 3.48Å; D83-G86 PolarHBondContact O-N 3.49Å; D83-G86 PolarHBondContact OD1-N 2.98Å; D83-T87 PolarHBondContact N-O 3.1Å; D83-T87 PolarHBondContact OD1-N 3.02Å; D83-T87 WeakPolarHBondContact OD2-CB 3.45Å | ||
| 84 | A | 85.9 | Confident | 84.4 | Confident | 114 Ų | 114 | 102.9 Ų | 102.9 | 94% | 0.942 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -16.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | G86 | A84-G86 VanDerWaalsContact C-N 3.32Š|
| 85 | K | 88.4 | Confident | 84.5 | Confident | 193 Ų | 193 | 102 Ų | 102 | 84% | 0.839 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.2 | 4.4 | 174.6 | -61.3 | -167.1 | 178.6 | -170.3 | 0 | 112.1 | D83 T87 | D83-K85 PolarHBondContact O-N 2.98Å; D83-K85 VanDerWaalsContact OD1-C 3.29Å; D83-K85 WeakPolarHBondContact OD1-CA 3.47Å; D83-K85 WeakPolarHBondContact OD1-CB 3.5Å; D83-K85 PolarHBondContact OD1-N 3.48Å; K85-T87 VanDerWaalsContact C-N 3.29Å; K85-T87 PolarHBondContact O-N 3.46Å |
| 86 | G | 88.1 | Confident | 84.3 | Confident | 43 Ų | 43 | 98.6 Ų | 98.6 | 44% | 0.443 | 52% | 0.517 | S | S | . | . | S | Bend | trans | 81.4 | 2.6 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | D83 A84 | D83-G86 PolarHBondContact O-N 3.49Å; D83-G86 PolarHBondContact OD1-N 2.98Å; A84-G86 VanDerWaalsContact C-N 3.32Å |
| 87 | T | 89.9 | Confident | 83.7 | Confident | 81 Ų | 81 | 101.1 Ų | 101.1 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | trans | -78.7 | 133.7 | 179 | -53.4 | 0 | 0 | 0 | 0 | 109.8 | R82 D83 K85 | R82-T87 CarbonylContact C-O 3.59Å; R82-T87 WeakPolarHBondContact CA-O 3.33Å; D83-T87 PolarHBondContact N-O 3.1Å; D83-T87 PolarHBondContact OD1-N 3.02Å; D83-T87 WeakPolarHBondContact OD2-CB 3.45Å; K85-T87 VanDerWaalsContact C-N 3.29Å; K85-T87 PolarHBondContact O-N 3.46Å | ||
| 88 | I | 91.8 | Very high | 82.8 | Confident | 93 Ų | 93 | 99.7 Ų | 99.7 | 48% | 0.477 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.3 | 124.8 | 179.8 | -57.3 | 175.3 | 0 | 0 | 0 | 108.7 | L80 R82 | L80-I88 HydrophobicContact CB-CG2 3.79Å; L80-I88 HydrophobicContact CD1-CG2 4.4Å; L80-I88 HydrophobicContact CD2-CG2 4.09Å; L80-I88 HydrophobicContact CG-CG2 4.31Å; R82-I88 HydrophobicContact CB-CG1 4.44Å; R82-I88 HydrophobicContact CG-CG1 4.39Å |
| 89 | R | 88.3 | Confident | 81.9 | Confident | 173 Ų | 173 | 95 Ų | 95 | 65% | 0.653 | 52% | 0.516 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 136.5 | 175.1 | -62.4 | -177.5 | 67.5 | -161.1 | 0.1 | 110.2 | L80 V81 | L80-R89 WeakPolarHBondContact CA-O 3.31Å; V81-R89 PolarHBondContact N-O 2.79Å; V81-R89 PolarHBondContact O-N 3.48Å |
| 90 | E | 89.1 | Confident | 80.8 | Confident | 104 Ų | 104 | 99.5 Ų | 99.5 | 49% | 0.486 | 54% | 0.54 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.8 | 127 | 173.5 | -172.2 | -179 | 176.7 | 0 | 0 | 110.3 | R78 L80 V92 | R78-E90 HydrophobicContact CB-CG 4.36Å; R78-E90 WeakPolarHBondContact CB-OE1 3.42Å; R78-E90 WeakPolarHBondContact CD-OE1 3.35Å; R78-E90 WeakPolarHBondContact CG-OE1 3.45Å; R78-E90 IonicContact NE-OE1 3.29Å; R78-E90 PolarHBondContact NE-OE1 3.09Å; L80-E90 HydrophobicContact CD2-CB 3.95Å; L80-E90 HydrophobicContact CD2-CG 4.16Å; E90-V92 HydrophobicContact CG-CG2 4.18Å |
| 91 | I | 86.1 | Confident | 79.6 | Confident | 77 Ų | 77 | 101.1 Ų | 101.1 | 40% | 0.395 | 54% | 0.538 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 119.3 | 171 | -47.2 | -176 | 0 | 0 | 0 | 107.7 | I79 V81 L93 | I79-I91 PolarHBondContact N-O 3.14Å; I79-I91 PolarHBondContact O-N 3.49Å; V81-I91 HydrophobicContact CB-CD1 4.02Å; V81-I91 HydrophobicContact CB-CG1 4.46Å; V81-I91 HydrophobicContact CG2-CD1 3.41Å; V81-I91 VanDerWaalsContact CG2-CD1 3.41Å; V81-I91 HydrophobicContact CG2-CG1 4.01Å; I91-L93 HydrophobicContact CB-CD1 4.08Å; I91-L93 HydrophobicContact CG2-CD1 3.49Å; I91-L93 VanDerWaalsContact CG2-CD1 3.49Å; I91-L93 HydrophobicContact CG2-CG 4.4Å |
| 92 | V | 83 | Confident | 78.5 | Confident | 78 Ų | 78 | 103.4 Ų | 103.4 | 47% | 0.473 | 55% | 0.554 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -98.6 | 110.5 | 179.7 | -173.8 | 0 | 0 | 0 | 0 | 108.1 | C76 R78 E90 | C76-V92 HydrophobicContact CB-CG1 3.41Å; C76-V92 VanDerWaalsContact CB-CG1 3.41Å; R78-V92 HydrophobicContact CG-CG2 4.42Å; E90-V92 HydrophobicContact CG-CG2 4.18Å |
| 93 | L | 80.8 | Confident | 77.6 | Confident | 39 Ų | 39 | 102.7 Ų | 102.7 | 20% | 0.204 | 56% | 0.556 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -106.1 | 133.3 | 176.4 | -71.7 | 90.8 | 0 | 0 | 0 | 110 | C76 R77 I79 I91 K95 L99 | C76-L93 CarbonylContact C-O 3.6Å; C76-L93 WeakPolarHBondContact CA-O 3.26Å; R77-L93 PolarHBondContact N-O 3.42Å; R77-L93 PolarHBondContact O-N 3.34Å; I79-L93 HydrophobicContact CD1-CD1 3.93Å; I79-L93 HydrophobicContact CG1-CD1 4.31Å; I91-L93 HydrophobicContact CB-CD1 4.08Å; I91-L93 HydrophobicContact CG2-CD1 3.49Å; I91-L93 VanDerWaalsContact CG2-CD1 3.49Å; I91-L93 HydrophobicContact CG2-CG 4.4Å; L93-K95 PolarHBondContact O-N 3.43Å; L93-L99 HydrophobicContact CD2-CD1 4.11Å |
| 94 | P | 77.3 | Confident | 76.9 | Confident | 75 Ų | 75 | 109.5 Ų | 109.5 | 49% | 0.487 | 58% | 0.577 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -57.1 | 130.2 | 170.1 | -19.7 | 29.5 | 0 | 0 | 0 | 110 | G96 L97 | P94-G96 PolarHBondContact O-N 3.27Å; P94-G96 VanDerWaalsContact O-N 3.07Å; P94-L97 HydrophobicContact CB-CG 4.47Å; P94-L97 HydrophobicContact CG-CD1 4.43Å; P94-L97 WeakPolarHBondContact O-CB 3.18Å; P94-L97 PolarHBondContact O-N 3.29Å |
| 95 | K | 65.8 | Low | 76.4 | Confident | 96 Ų | 96 | 110.1 Ų | 110.1 | 42% | 0.417 | 57% | 0.569 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -65.1 | -11.5 | -178.7 | -65.7 | -167.4 | -164.6 | 171 | 0 | 113.9 | D74 H75 C76 R77 L93 L97 | D74-K95 WeakPolarHBondContact O-CD 3.37Å; D74-K95 WeakPolarHBondContact O-CE 3.44Å; D74-K95 PolarHBondContact O-NZ 2.92Å; D74-K95 IonicContact OD1-NZ 2.81Å; D74-K95 PolarHBondContact OD1-NZ 3.2Å; D74-K95 IonicContact OD2-NZ 3.24Å; H75-K95 PolarHBondContact O-N 3.23Å; C76-K95 WeakPolarHBondContact O-CE 3.45Å; R77-K95 HydrophobicContact CB-CG 4.12Å; L93-K95 PolarHBondContact O-N 3.43Å; K95-L97 VanDerWaalsContact C-N 3.31Å |
| 96 | G | 64.1 | Low | 76.1 | Confident | 72 Ų | 72 | 112.5 Ų | 112.5 | 74% | 0.742 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | -9.2 | 170.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | P94 D98 | P94-G96 PolarHBondContact O-N 3.27Å; P94-G96 VanDerWaalsContact O-N 3.07Å; G96-D98 PolarHBondContact O-N 3.47Å |
| 97 | L | 65.1 | Low | 75.8 | Confident | 106 Ų | 106 | 114.3 Ų | 114.3 | 56% | 0.555 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -80.3 | 82.9 | 163.1 | -61.4 | -176.7 | 0 | 0 | 0 | 106.6 | P94 K95 L99 | P94-L97 HydrophobicContact CB-CG 4.47Å; P94-L97 HydrophobicContact CG-CD1 4.43Å; P94-L97 WeakPolarHBondContact O-CB 3.18Å; P94-L97 PolarHBondContact O-N 3.29Å; K95-L97 VanDerWaalsContact C-N 3.31Å; L97-L99 WeakPolarHBondContact O-CG 3.34Å; L97-L99 PolarHBondContact O-N 2.92Å |
| 98 | D | 63.4 | Low | 75.9 | Confident | 95 Ų | 95 | 116 Ų | 116 | 51% | 0.508 | 59% | 0.59 | S | S | . | * | trans | -61.1 | 81.8 | -173.3 | -163.8 | 7.3 | 0 | 0 | 0 | 110.8 | G96 R101 | G96-D98 PolarHBondContact O-N 3.47Å; D98-R101 HydrophobicContact CB-CB 3.89Å; D98-R101 VanDerWaalsContact CG-CB 3.46Å; D98-R101 VanDerWaalsContact O-CB 3.26Å; D98-R101 WeakPolarHBondContact O-CB 3.4Å; D98-R101 PolarHBondContact O-N 3.35Å; D98-R101 PolarHBondContact OD1-N 3.38Å; D98-R101 VanDerWaalsContact OD2-CB 3.25Å; D98-R101 WeakPolarHBondContact OD2-CB 3.18Å | ||
| 99 | L | 64.3 | Low | 76.1 | Confident | 77 Ų | 77 | 113.9 Ų | 113.9 | 40% | 0.403 | 58% | 0.578 | S | S | . | * | S | Bend | trans | -71 | -21.7 | 174.2 | -69.1 | 174.8 | 0 | 0 | 0 | 111.3 | I79 L93 L97 | I79-L99 HydrophobicContact CD1-CD1 4.45Å; L93-L99 HydrophobicContact CD2-CD1 4.11Å; L97-L99 WeakPolarHBondContact O-CG 3.34Å; L97-L99 PolarHBondContact O-N 2.92Å |
| 100 | D | 63.6 | Low | 76.6 | Confident | 143 Ų | 143 | 109.2 Ų | 109.2 | 77% | 0.765 | 57% | 0.569 | S | S | * | * | S | Bend | trans | -85.1 | -10 | 172.8 | -97.3 | -70.7 | 0 | 0 | 0 | 112.6 | P102 | D100-P102 WeakPolarHBondContact O-CD 3.38Å; D100-P102 VanDerWaalsContact O-N 3.13Å |
| 101 | R | 66.4 | Low | 76.9 | Confident | 155 Ų | 155 | 108.3 Ų | 108.3 | 59% | 0.585 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -56 | 125.4 | 168.9 | -157 | 160.2 | -176.4 | -122.6 | 2.9 | 107.9 | D98 K103 | D98-R101 HydrophobicContact CB-CB 3.89Å; D98-R101 VanDerWaalsContact CG-CB 3.46Å; D98-R101 VanDerWaalsContact O-CB 3.26Å; D98-R101 WeakPolarHBondContact O-CB 3.4Å; D98-R101 PolarHBondContact O-N 3.35Å; D98-R101 PolarHBondContact OD1-N 3.38Å; D98-R101 VanDerWaalsContact OD2-CB 3.25Å; D98-R101 WeakPolarHBondContact OD2-CB 3.18Å; R101-K103 PolarHBondContact O-N 2.92Å |
| 102 | P | 68.4 | Low | 77.5 | Confident | 115 Ų | 115 | 111.1 Ų | 111.1 | 75% | 0.747 | 59% | 0.59 | S | S | * | * | trans | -50.1 | 115.1 | 176.7 | -26.5 | 32.7 | 0 | 0 | 0 | 108.8 | D100 R104 | D100-P102 WeakPolarHBondContact O-CD 3.38Å; D100-P102 VanDerWaalsContact O-N 3.13Å; P102-R104 PolarHBondContact O-N 3.39Å | ||
| 103 | K | 73.4 | Confident | 78.2 | Confident | 165 Ų | 165 | 109 Ų | 109 | 72% | 0.717 | 58% | 0.575 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 116.1 | 173.2 | -116.1 | 85.4 | 174.1 | -172.9 | 0 | 104.9 | R101 T105 | R101-K103 PolarHBondContact O-N 2.92Å; K103-T105 PolarHBondContact O-N 2.89Å |
| 104 | R | 71.1 | Confident | 79 | Confident | 205 Ų | 205 | 110.6 Ų | 110.6 | 77% | 0.774 | 58% | 0.584 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 119.5 | 173 | -77.8 | -164.3 | -163.4 | 173.6 | 4.9 | 107 | P102 R106 | P102-R104 PolarHBondContact O-N 3.39Å; R104-R106 PolarHBondContact O-N 3.28Å; R104-R106 VanDerWaalsContact O-N 3.14Å |
| 105 | T | 76.1 | Confident | 80 | Confident | 127 Ų | 127 | 114.5 Ų | 114.5 | 78% | 0.779 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 122.7 | 174.7 | -54.9 | 0 | 0 | 0 | 0 | 108.3 | K103 T107 | K103-T105 PolarHBondContact O-N 2.89Å; T105-T107 PolarHBondContact O-N 3.47Å; T105-T107 VanDerWaalsContact O-N 3.16Å |
| 106 | R | 82.1 | Confident | 81.5 | Confident | 243 Ų | 243 | 115 Ų | 115 | 92% | 0.917 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 117.4 | 173.7 | -89.9 | 176.1 | 78.2 | 179.9 | 3.4 | 107.6 | R104 | R104-R106 PolarHBondContact O-N 3.28Å; R104-R106 VanDerWaalsContact O-N 3.14Å |
| 107 | T | 82.8 | Confident | 83.2 | Confident | 82 Ų | 82 | 111.6 Ų | 111.6 | 50% | 0.503 | 55% | 0.554 | S | S | . | * | P | Polyproline II helix | trans | -79.9 | 124.9 | 169.5 | 53.4 | 0 | 0 | 0 | 0 | 109 | T105 | T105-T107 PolarHBondContact O-N 3.47Å; T105-T107 VanDerWaalsContact O-N 3.16Å |
| 108 | S | 91.6 | Very high | 84.7 | Confident | 115 Ų | 115 | 109 Ų | 109 | 80% | 0.804 | 54% | 0.539 | S | S | * | . | P | Polyproline II helix | trans | -86.4 | 140.5 | 165 | 46.8 | 0 | 0 | 0 | 0 | 109.6 | ||
| 109 | F | 95.9 | Very high | 86.4 | Confident | 49 Ų | 49 | 108.3 Ų | 108.3 | 22% | 0.215 | 53% | 0.533 | C | S | . | . | P | Polyproline II helix | trans | -94.1 | 146.4 | 171.3 | -58.6 | -56 | 0 | 0 | 0 | 109.3 | Q113 L114 L141 Q145 W149 | F109-Q113 HydrophobicContact CB-CB 4.27Å; F109-L114 HydrophobicContact CB-CD2 3.84Å; F109-L114 HydrophobicContact CB-CG 3.94Å; F109-L114 HydrophobicContact CD2-CD2 4.07Å; F109-L114 HydrophobicContact CG-CD2 4.38Å; F109-L141 HydrophobicContact CD1-CD1 3.92Å; F109-L141 HydrophobicContact CD1-CD2 3.85Å; F109-L141 HydrophobicContact CE1-CD1 3.83Å; F109-L141 HydrophobicContact CE1-CD2 3.78Å; F109-L141 HydrophobicContact CE1-CG 4.44Å; F109-Q145 HydrophobicContact CE1-CB 4.27Å; F109-Q145 HydrophobicContact CZ-CB 4.2Å; F109-W149 AromaticContact CD2-CD1 3.68Å; F109-W149 HydrophobicContact CE2-CB 4.36Å; F109-W149 AromaticContact CE2-CD1 3.53Å; F109-W149 HydrophobicContact CE2-CG 4.32Å |
| 110 | T | 97.6 | Very high | 88 | Confident | 76 Ų | 76 | 106.4 Ų | 106.4 | 47% | 0.466 | 52% | 0.522 | S | S | . | . | P | Polyproline II helix | trans | -69.8 | 162.2 | 173.3 | 70.9 | 0 | 0 | 0 | 0 | 110.7 | E112 Q113 L114 | T110-E112 VanDerWaalsContact C-N 3.28Å; T110-E112 PolarHBondContact O-N 2.76Å; T110-Q113 PolarHBondContact O-N 3.02Å; T110-Q113 VanDerWaalsContact OG1-CG 3.26Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.28Å; T110-Q113 PolarHBondContact OG1-N 3.48Å; T110-Q113 PolarHBondContact OG1-OE1 3.44Å; T110-L114 WeakPolarHBondContact O-CG 3.48Å; T110-L114 PolarHBondContact O-N 2.91Å |
| 111 | A | 97.1 | Very high | 89.6 | Confident | 84 Ų | 84 | 99.8 Ų | 99.8 | 69% | 0.694 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -59.3 | -40.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L114 Y115 | A111-L114 PolarHBondContact O-N 2.79Å; A111-Y115 WeakPolarHBondContact O-CB 3.44Å; A111-Y115 PolarHBondContact O-N 3.29Å |
| 112 | E | 97.4 | Very high | 91.1 | Very high | 136 Ų | 136 | 99.6 Ų | 99.6 | 64% | 0.636 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.6 | -43.5 | 177.1 | -175.3 | -179.9 | -179.5 | 0 | 0 | 112.1 | T110 L114 Y115 R116 | T110-E112 VanDerWaalsContact C-N 3.28Å; T110-E112 PolarHBondContact O-N 2.76Å; E112-L114 VanDerWaalsContact C-N 3.35Å; E112-L114 PolarHBondContact O-N 2.81Å; E112-Y115 PolarHBondContact O-N 3.02Å; E112-R116 WeakPolarHBondContact O-CG 3.4Å; E112-R116 PolarHBondContact O-N 3.44Å |
| 113 | Q | 97.8 | Very high | 92.5 | Very high | 33 Ų | 33 | 102 Ų | 102 | 15% | 0.154 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -60.8 | -45.4 | 175.9 | -74 | 171.6 | -26.5 | 0 | 0 | 111.2 | F109 T110 Y115 R116 L117 L139 | F109-Q113 HydrophobicContact CB-CB 4.27Å; T110-Q113 PolarHBondContact O-N 3.02Å; T110-Q113 VanDerWaalsContact OG1-CG 3.26Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.28Å; T110-Q113 PolarHBondContact OG1-N 3.48Å; T110-Q113 PolarHBondContact OG1-OE1 3.44Å; Q113-Y115 VanDerWaalsContact C-N 3.35Å; Q113-Y115 PolarHBondContact O-N 2.89Å; Q113-R116 PolarHBondContact O-N 3.02Å; Q113-L117 WeakPolarHBondContact O-CB 3.25Å; Q113-L117 WeakPolarHBondContact O-CD1 3.45Å; Q113-L117 WeakPolarHBondContact O-CG 3.37Å; Q113-L117 PolarHBondContact O-N 3.49Å; Q113-L139 HydrophobicContact CG-CB 4.44Å; Q113-L139 PolarHBondContact NE2-O 3.34Å |
| 114 | L | 98 | Very high | 93.6 | Very high | 74 Ų | 74 | 96.1 Ų | 96.1 | 39% | 0.387 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62 | -42.4 | 177.2 | -69 | 174.9 | 0 | 0 | 0 | 111.9 | F109 T110 A111 E112 L117 E118 | F109-L114 HydrophobicContact CB-CD2 3.84Å; F109-L114 HydrophobicContact CB-CG 3.94Å; F109-L114 HydrophobicContact CD2-CD2 4.07Å; F109-L114 HydrophobicContact CG-CD2 4.38Å; T110-L114 WeakPolarHBondContact O-CG 3.48Å; T110-L114 PolarHBondContact O-N 2.91Å; A111-L114 PolarHBondContact O-N 2.79Å; E112-L114 VanDerWaalsContact C-N 3.35Å; E112-L114 PolarHBondContact O-N 2.81Å; L114-L117 PolarHBondContact O-N 3.06Å; L114-E118 WeakPolarHBondContact O-CB 3.39Å; L114-E118 PolarHBondContact O-N 3.13Å |
| 115 | Y | 98.1 | Very high | 94.8 | Very high | 156 Ų | 156 | 90.2 Ų | 90.2 | 61% | 0.612 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -59.7 | -49.6 | 177.8 | 173.8 | -100.7 | 0 | 0 | 0 | 111.7 | A111 E112 Q113 L117 E118 M119 | A111-Y115 WeakPolarHBondContact O-CB 3.44Å; A111-Y115 PolarHBondContact O-N 3.29Å; E112-Y115 PolarHBondContact O-N 3.02Å; Q113-Y115 VanDerWaalsContact C-N 3.35Å; Q113-Y115 PolarHBondContact O-N 2.89Å; Y115-L117 PolarHBondContact O-N 3.28Å; Y115-E118 PolarHBondContact O-N 3.35Å; Y115-M119 WeakPolarHBondContact O-CB 3.44Å; Y115-M119 PolarHBondContact O-N 3.4Å |
| 116 | R | 98.1 | Very high | 95.9 | Very high | 108 Ų | 108 | 90.5 Ų | 90.5 | 41% | 0.408 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 178 | -69.5 | -72 | -166.2 | 148 | 1.2 | 112.5 | E112 Q113 E118 M119 E120 L139 | E112-R116 WeakPolarHBondContact O-CG 3.4Å; E112-R116 PolarHBondContact O-N 3.44Å; Q113-R116 PolarHBondContact O-N 3.02Å; R116-E118 VanDerWaalsContact C-N 3.34Å; R116-M119 PolarHBondContact O-N 2.97Å; R116-E120 PolarHBondContact O-N 3.29Å; R116-L139 HydrophobicContact CB-CD1 4.24Å; R116-L139 HydrophobicContact CB-CD2 3.51Å; R116-L139 HydrophobicContact CB-CG 4.48Å; R116-L139 HydrophobicContact CG-CD2 3.79Å |
| 117 | L | 98.3 | Very high | 96.6 | Very high | 0 Ų | 0 | 79.5 Ų | 79.5 | 0% | 0 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -62.2 | -41.5 | 175.7 | -73 | 165 | 0 | 0 | 0 | 111.8 | Q113 L114 Y115 F121 L135 L139 L141 V146 W149 F150 | Q113-L117 WeakPolarHBondContact O-CB 3.25Å; Q113-L117 WeakPolarHBondContact O-CD1 3.45Å; Q113-L117 WeakPolarHBondContact O-CG 3.37Å; Q113-L117 PolarHBondContact O-N 3.49Å; L114-L117 PolarHBondContact O-N 3.06Å; Y115-L117 PolarHBondContact O-N 3.28Å; L117-F121 VanDerWaalsContact O-CB 3.28Å; L117-F121 WeakPolarHBondContact O-CB 3.28Å; L117-F121 PolarHBondContact O-N 3.08Å; L117-L135 HydrophobicContact CD2-CD2 3.97Å; L117-L135 HydrophobicContact CD2-CG 4.45Å; L117-L139 HydrophobicContact CD1-CD1 4.37Å; L117-L139 HydrophobicContact CD2-CD1 3.69Å; L117-L139 HydrophobicContact CG-CD1 3.61Å; L117-L141 HydrophobicContact CD1-CD1 4.25Å; L117-V146 HydrophobicContact CD2-CG1 4.39Å; L117-W149 HydrophobicContact CB-CD2 3.92Å; L117-W149 HydrophobicContact CB-CE3 3.89Å; L117-W149 HydrophobicContact CB-CH2 3.62Å; L117-W149 HydrophobicContact CB-CZ2 3.6Å; L117-W149 HydrophobicContact CB-CZ3 3.75Å; L117-W149 HydrophobicContact CD1-CD2 3.85Å; L117-W149 HydrophobicContact CD1-CE3 4.48Å; L117-W149 HydrophobicContact CD1-CG 3.85Å; L117-W149 HydrophobicContact CD2-CD2 4.32Å; L117-W149 HydrophobicContact CD2-CE3 4.19Å; L117-W149 HydrophobicContact CG-CD2 4.25Å; L117-W149 HydrophobicContact CG-CE3 4.41Å; L117-F150 HydrophobicContact CD2-CE2 3.95Å |
| 118 | E | 98.3 | Very high | 97.2 | Very high | 52 Ų | 52 | 80 Ų | 80 | 24% | 0.243 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -68.6 | -41.9 | 178.3 | -167.3 | 66.1 | -150.4 | 0 | 0 | 111.8 | L114 Y115 R116 E120 F121 Q122 W149 R153 | L114-E118 WeakPolarHBondContact O-CB 3.39Å; L114-E118 PolarHBondContact O-N 3.13Å; Y115-E118 PolarHBondContact O-N 3.35Å; R116-E118 VanDerWaalsContact C-N 3.34Å; E118-E120 VanDerWaalsContact C-N 3.34Å; E118-E120 PolarHBondContact O-N 2.85Å; E118-F121 WeakPolarHBondContact O-CB 3.35Å; E118-F121 PolarHBondContact O-N 2.95Å; E118-Q122 WeakPolarHBondContact O-CG 3.33Å; E118-Q122 PolarHBondContact O-N 3.13Å; E118-W149 HydrophobicContact CB-CH2 4.48Å; E118-R153 VanDerWaalsContact CD-NE 3.31Å; E118-R153 IonicContact OE1-CZ 2.8Å; E118-R153 VanDerWaalsContact OE1-CZ 3.28Å; E118-R153 IonicContact OE1-NE 3.63Å; E118-R153 PolarHBondContact OE1-NE 3.41Å; E118-R153 IonicContact OE1-NH2 3.8Å; E118-R153 PolarHBondContact OE1-NH2 3.26Å; E118-R153 WeakPolarHBondContact OE2-CD 3.44Å; E118-R153 IonicContact OE2-CZ 3.68Å; E118-R153 IonicContact OE2-NE 2.6Å; E118-R153 PolarHBondContact OE2-NE 3.42Å; E118-R153 IonicContact OE2-NH2 3.29Å |
| 119 | M | 98.1 | Very high | 97.4 | Very high | 79 Ų | 79 | 76.3 Ų | 76.3 | 39% | 0.389 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -59.3 | -46 | 175.3 | -175.6 | -178.8 | 69.1 | 0 | 0 | 111.2 | Y115 R116 F121 Q122 R123 | Y115-M119 WeakPolarHBondContact O-CB 3.44Å; Y115-M119 PolarHBondContact O-N 3.4Å; R116-M119 PolarHBondContact O-N 2.97Å; M119-F121 VanDerWaalsContact C-N 3.33Å; M119-F121 PolarHBondContact O-N 3.49Å; M119-Q122 PolarHBondContact O-N 3.02Å; M119-R123 PolarHBondContact O-N 3.32Å |
| 120 | E | 97.9 | Very high | 97.5 | Very high | 37 Ų | 37 | 84.7 Ų | 84.7 | 17% | 0.173 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65.8 | -37.8 | 176 | -164.1 | 63.9 | -133 | 0 | 0 | 111.4 | R116 E118 Q122 R123 C124 V127 L135 F150 | R116-E120 PolarHBondContact O-N 3.29Å; E118-E120 VanDerWaalsContact C-N 3.34Å; E118-E120 PolarHBondContact O-N 2.85Å; E120-Q122 VanDerWaalsContact C-N 3.32Å; E120-Q122 PolarHBondContact O-N 3.45Å; E120-R123 CarbonylContact O-C 3.36Å; E120-R123 WeakPolarHBondContact O-CB 3.39Å; E120-R123 PolarHBondContact O-N 2.89Å; E120-R123 VanDerWaalsContact O-N 3.07Å; E120-R123 IonicContact OE1-CZ 3.61Å; E120-R123 IonicContact OE1-NE 3.61Å; E120-R123 PolarHBondContact OE1-NE 3.21Å; E120-R123 IonicContact OE1-NH2 3.05Å; E120-R123 PolarHBondContact OE1-NH2 3.43Å; E120-C124 PolarHBondContact O-N 3.14Å; E120-V127 HydrophobicContact CG-CG1 4.17Å; E120-L135 HydrophobicContact CB-CD1 4.46Å; E120-L135 HydrophobicContact CB-CD2 4.22Å; E120-L135 HydrophobicContact CG-CD2 4.03Å; E120-F150 HydrophobicContact CB-CZ 4.32Å; E120-F150 HydrophobicContact CG-CZ 4.35Å |
| 121 | F | 98.1 | Very high | 97.4 | Very high | 4 Ų | 4 | 84.9 Ų | 84.9 | 2% | 0.018 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -63.2 | -35.9 | 177.9 | -176.8 | -99.6 | 0 | 0 | 0 | 113.4 | L117 E118 M119 R123 C124 Q125 W149 F150 R153 R154 Q157 | L117-F121 VanDerWaalsContact O-CB 3.28Å; L117-F121 WeakPolarHBondContact O-CB 3.28Å; L117-F121 PolarHBondContact O-N 3.08Å; E118-F121 WeakPolarHBondContact O-CB 3.35Å; E118-F121 PolarHBondContact O-N 2.95Å; M119-F121 VanDerWaalsContact C-N 3.33Å; M119-F121 PolarHBondContact O-N 3.49Å; F121-R123 VanDerWaalsContact C-N 3.29Å; F121-C124 CarbonylContact O-C 3.53Å; F121-Q125 HydrophobicContact CD2-CB 4.35Å; F121-Q125 HydrophobicContact CD2-CG 4.45Å; F121-Q125 HydrophobicContact CE1-CG 4.2Å; F121-Q125 HydrophobicContact CE2-CB 3.79Å; F121-Q125 HydrophobicContact CE2-CG 3.92Å; F121-Q125 HydrophobicContact CZ-CB 4.11Å; F121-Q125 HydrophobicContact CZ-CG 3.78Å; F121-Q125 PolarHBondContact O-N 2.8Å; F121-W149 HydrophobicContact CB-CH2 4.22Å; F121-W149 HydrophobicContact CB-CZ3 4.01Å; F121-W149 HydrophobicContact CD2-CZ3 4.4Å; F121-W149 HydrophobicContact CG-CZ3 4.35Å; F121-F150 HydrophobicContact CB-CE1 4.13Å; F121-F150 HydrophobicContact CB-CZ 4.41Å; F121-F150 AromaticContact CD2-CD1 3.77Å; F121-F150 HydrophobicContact CD2-CD1 3.77Å; F121-F150 AromaticContact CD2-CE1 3.81Å; F121-F150 HydrophobicContact CD2-CE1 3.81Å; F121-F150 HydrophobicContact CE2-CD1 4.46Å; F121-F150 HydrophobicContact CG-CE1 4.48Å; F121-R153 HydrophobicContact CD1-CG 3.68Å; F121-R153 HydrophobicContact CD2-CB 4.27Å; F121-R153 HydrophobicContact CD2-CG 3.72Å; F121-R153 HydrophobicContact CE1-CG 3.62Å; F121-R153 HydrophobicContact CE2-CB 4.13Å; F121-R153 HydrophobicContact CE2-CG 3.68Å; F121-R153 HydrophobicContact CG-CG 3.73Å; F121-R153 HydrophobicContact CZ-CB 4.41Å; F121-R153 HydrophobicContact CZ-CG 3.63Å; F121-R154 HydrophobicContact CE2-CG 3.74Å; F121-R154 HydrophobicContact CZ-CG 4.1Å; F121-Q157 VanDerWaalsContact CZ-OE1 3.25Å |
| 122 | Q | 97.6 | Very high | 97.5 | Very high | 152 Ų | 152 | 83.5 Ų | 83.5 | 71% | 0.71 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -64.7 | -35.9 | 172.8 | -71.2 | 173.8 | -1.3 | 0 | 0 | 111.7 | E118 M119 E120 | E118-Q122 WeakPolarHBondContact O-CG 3.33Å; E118-Q122 PolarHBondContact O-N 3.13Å; M119-Q122 PolarHBondContact O-N 3.02Å; E120-Q122 VanDerWaalsContact C-N 3.32Å; E120-Q122 PolarHBondContact O-N 3.45Å |
| 123 | R | 97 | Very high | 97.5 | Very high | 165 Ų | 165 | 80.2 Ų | 80.2 | 62% | 0.623 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -75.2 | -42.5 | 177.3 | -158.6 | -175.4 | 72.4 | 85.8 | 4 | 112 | M119 E120 F121 E131 | M119-R123 PolarHBondContact O-N 3.32Å; E120-R123 CarbonylContact O-C 3.36Å; E120-R123 WeakPolarHBondContact O-CB 3.39Å; E120-R123 PolarHBondContact O-N 2.89Å; E120-R123 VanDerWaalsContact O-N 3.07Å; E120-R123 IonicContact OE1-CZ 3.61Å; E120-R123 IonicContact OE1-NE 3.61Å; E120-R123 PolarHBondContact OE1-NE 3.21Å; E120-R123 IonicContact OE1-NH2 3.05Å; E120-R123 PolarHBondContact OE1-NH2 3.43Å; F121-R123 VanDerWaalsContact C-N 3.29Å; R123-E131 IonicContact NH2-OE1 3.79Å; R123-E131 PolarHBondContact NH2-OE1 3.16Å |
| 124 | C | 96.7 | Very high | 97.5 | Very high | 41 Ų | 41 | 82.1 Ų | 82.1 | 28% | 0.277 | 38% | 0.378 | S | S | . | . | trans | -150.2 | 118.2 | 179.1 | -172.4 | 0 | 0 | 0 | 0 | 111 | E120 F121 Y126 F150 | E120-C124 PolarHBondContact O-N 3.14Å; F121-C124 CarbonylContact O-C 3.53Å; C124-Y126 PolarHBondContact O-N 2.97Å; C124-Y126 PolarHBondContact SG-O 3.32Å; C124-F150 WeakPolarHBondContact O-CE1 3.44Å | ||
| 125 | Q | 97.1 | Very high | 97.5 | Very high | 81 Ų | 81 | 79 Ų | 79 | 38% | 0.379 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -72.7 | -8.4 | -178.9 | -65.3 | 179.8 | -1.7 | 0 | 0 | 113.9 | F121 R154 | F121-Q125 HydrophobicContact CD2-CB 4.35Å; F121-Q125 HydrophobicContact CD2-CG 4.45Å; F121-Q125 HydrophobicContact CE1-CG 4.2Å; F121-Q125 HydrophobicContact CE2-CB 3.79Å; F121-Q125 HydrophobicContact CE2-CG 3.92Å; F121-Q125 HydrophobicContact CZ-CB 4.11Å; F121-Q125 HydrophobicContact CZ-CG 3.78Å; F121-Q125 PolarHBondContact O-N 2.8Å; Q125-R154 WeakPolarHBondContact O-CD 3.34Å |
| 126 | Y | 97.9 | Very high | 97.5 | Very high | 134 Ų | 134 | 71.8 Ų | 71.8 | 53% | 0.525 | 34% | 0.335 | S | S | . | . | trans | -136.1 | 97.2 | -175.4 | -67.2 | -97.3 | 0 | 0 | 0 | 111 | C124 R154 | C124-Y126 PolarHBondContact O-N 2.97Å; C124-Y126 PolarHBondContact SG-O 3.32Å; Y126-R154 VanDerWaalsContact CZ-CD 3.42Å; Y126-R154 PolarHBondContact OH-NH1 2.81Å | ||
| 127 | V | 96.8 | Very high | 97.5 | Very high | 11 Ų | 11 | 74.3 Ų | 74.3 | 7% | 0.067 | 34% | 0.344 | C | S | . | . | trans | -84.1 | 132.8 | 173.1 | -66.9 | 0 | 0 | 0 | 0 | 111.6 | E120 R132 L135 V146 F150 | E120-V127 HydrophobicContact CG-CG1 4.17Å; V127-R132 HydrophobicContact CB-CB 4.39Å; V127-R132 HydrophobicContact CG2-CB 4.31Å; V127-L135 HydrophobicContact CG1-CD2 4.45Å; V127-V146 HydrophobicContact CG2-CG1 3.96Å; V127-F150 HydrophobicContact CB-CE1 4.29Å; V127-F150 HydrophobicContact CB-CZ 4.28Å; V127-F150 HydrophobicContact CG1-CD1 4.26Å; V127-F150 HydrophobicContact CG1-CE1 3.54Å; V127-F150 HydrophobicContact CG1-CE2 4.06Å; V127-F150 HydrophobicContact CG1-CZ 3.42Å; V127-F150 VanDerWaalsContact CG1-CZ 3.42Å; V127-F150 HydrophobicContact CG2-CB 4.47Å; V127-F150 HydrophobicContact CG2-CD1 3.85Å; V127-F150 HydrophobicContact CG2-CD2 3.6Å; V127-F150 HydrophobicContact CG2-CE1 3.92Å; V127-F150 HydrophobicContact CG2-CE2 3.68Å; V127-F150 HydrophobicContact CG2-CG 3.7Å; V127-F150 HydrophobicContact CG2-CZ 3.84Å | ||
| 128 | V | 96.3 | Very high | 97.4 | Very high | 92 Ų | 92 | 78.9 Ų | 78.9 | 56% | 0.558 | 37% | 0.366 | S | S | * | . | trans | -132.4 | 153.9 | -174.9 | -63.7 | 0 | 0 | 0 | 0 | 112.1 | R130 E131 R132 | V128-R130 PolarHBondContact O-N 3.24Å; V128-E131 PolarHBondContact O-N 3.18Å; V128-R132 PolarHBondContact O-N 3.07Å | ||
| 129 | G | 95.7 | Very high | 97.4 | Very high | 39 Ų | 39 | 77.1 Ų | 77.1 | 40% | 0.402 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | 39.6 | -111.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | R132 T133 | G129-R132 PolarHBondContact O-N 3.39Å; G129-T133 PolarHBondContact O-N 3.48Å; G129-T133 VanDerWaalsContact O-N 3.13Å; G129-T133 PolarHBondContact O-OG1 2.71Å; G129-T133 VanDerWaalsContact O-OG1 3.14Å |
| 130 | R | 96.7 | Very high | 97.3 | Very high | 225 Ų | 225 | 80.5 Ų | 80.5 | 85% | 0.849 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -60.5 | -43.8 | -177 | -173.6 | -178.6 | 179.8 | -154.7 | 0.1 | 114.3 | V128 R132 T133 E134 | V128-R130 PolarHBondContact O-N 3.24Å; R130-R132 VanDerWaalsContact C-N 3.28Å; R130-R132 PolarHBondContact O-N 3.41Å; R130-T133 PolarHBondContact O-N 2.96Å; R130-E134 PolarHBondContact O-N 3.46Å |
| 131 | E | 97 | Very high | 97.3 | Very high | 80 Ų | 80 | 79.9 Ų | 79.9 | 37% | 0.374 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64 | -38.6 | -178.6 | -64.6 | -174.9 | 133.6 | 0 | 0 | 110.9 | R123 V128 E134 L135 | R123-E131 IonicContact NH2-OE1 3.79Å; R123-E131 PolarHBondContact NH2-OE1 3.16Å; V128-E131 PolarHBondContact O-N 3.18Å; E131-E134 PolarHBondContact O-N 2.79Å; E131-L135 WeakPolarHBondContact O-CB 3.34Å; E131-L135 PolarHBondContact O-N 3.33Å |
| 132 | R | 98.3 | Very high | 97.2 | Very high | 55 Ų | 55 | 82.2 Ų | 82.2 | 21% | 0.208 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -65.3 | -44.9 | 175.2 | 172.4 | 173.3 | 53.4 | -141.4 | -12.4 | 111.7 | V127 V128 G129 R130 E134 L135 A136 E143 V146 | V127-R132 HydrophobicContact CB-CB 4.39Å; V127-R132 HydrophobicContact CG2-CB 4.31Å; V128-R132 PolarHBondContact O-N 3.07Å; G129-R132 PolarHBondContact O-N 3.39Å; R130-R132 VanDerWaalsContact C-N 3.28Å; R130-R132 PolarHBondContact O-N 3.41Å; R132-E134 VanDerWaalsContact C-N 3.32Å; R132-E134 PolarHBondContact O-N 3.49Å; R132-L135 PolarHBondContact O-N 2.87Å; R132-A136 WeakPolarHBondContact O-CB 3.4Å; R132-A136 PolarHBondContact O-N 3Å; R132-E143 WeakPolarHBondContact CD-O 3.5Å; R132-E143 HydrophobicContact CG-CB 4.04Å; R132-E143 HydrophobicContact CG-CG 4.1Å; R132-E143 IonicContact NE-OE2 2.79Å; R132-E143 PolarHBondContact NE-OE2 3.46Å; R132-V146 HydrophobicContact CG-CB 4.39Å; R132-V146 HydrophobicContact CG-CG1 4.23Å |
| 133 | T | 98.1 | Very high | 97.2 | Very high | 66 Ų | 66 | 78.7 Ų | 78.7 | 41% | 0.405 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 178 | -53.8 | 0 | 0 | 0 | 0 | 111 | G129 R130 A136 R137 E143 | G129-T133 PolarHBondContact O-N 3.48Å; G129-T133 VanDerWaalsContact O-N 3.13Å; G129-T133 PolarHBondContact O-OG1 2.71Å; G129-T133 VanDerWaalsContact O-OG1 3.14Å; R130-T133 PolarHBondContact O-N 2.96Å; T133-A136 PolarHBondContact O-N 3.18Å; T133-R137 WeakPolarHBondContact O-CB 3.26Å; T133-R137 PolarHBondContact O-N 2.93Å; T133-E143 VanDerWaalsContact OG1-CD 3.24Å; T133-E143 PolarHBondContact OG1-OE1 3Å; T133-E143 PolarHBondContact OG1-OE2 2.79Å |
| 134 | E | 97.8 | Very high | 97.1 | Very high | 73 Ų | 73 | 75.1 Ų | 75.1 | 34% | 0.341 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.2 | -44 | 179.8 | -178.5 | 54.4 | -158.6 | 0 | 0 | 112.1 | R130 E131 R132 A136 R137 Q138 | R130-E134 PolarHBondContact O-N 3.46Å; E131-E134 PolarHBondContact O-N 2.79Å; R132-E134 VanDerWaalsContact C-N 3.32Å; R132-E134 PolarHBondContact O-N 3.49Å; E134-A136 VanDerWaalsContact C-N 3.32Å; E134-A136 PolarHBondContact O-N 3.5Å; E134-R137 WeakPolarHBondContact O-CB 3.46Å; E134-R137 PolarHBondContact O-N 3.35Å; E134-R137 IonicContact OE1-CZ 3Å; E134-R137 IonicContact OE1-NE 3.7Å; E134-R137 IonicContact OE1-NH2 2.78Å; E134-R137 PolarHBondContact OE1-NH2 2.78Å; E134-R137 IonicContact OE2-CZ 2.71Å; E134-R137 IonicContact OE2-NE 3.28Å; E134-R137 PolarHBondContact OE2-NE 3.38Å; E134-R137 IonicContact OE2-NH2 3.62Å; E134-Q138 WeakPolarHBondContact O-CG 3.41Å; E134-Q138 PolarHBondContact O-N 3.18Å; E134-Q138 WeakPolarHBondContact OE1-CG 3.26Å; E134-Q138 PolarHBondContact OE1-NE2 2.93Å |
| 135 | L | 97.6 | Very high | 97.1 | Very high | 9 Ų | 9 | 75.5 Ų | 75.5 | 5% | 0.047 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63 | -40 | 176.6 | -172.6 | 63.8 | 0 | 0 | 0 | 111.9 | L117 E120 V127 E131 R132 R137 Q138 L139 V146 F150 | L117-L135 HydrophobicContact CD2-CD2 3.97Å; L117-L135 HydrophobicContact CD2-CG 4.45Å; E120-L135 HydrophobicContact CB-CD1 4.46Å; E120-L135 HydrophobicContact CB-CD2 4.22Å; E120-L135 HydrophobicContact CG-CD2 4.03Å; V127-L135 HydrophobicContact CG1-CD2 4.45Å; E131-L135 WeakPolarHBondContact O-CB 3.34Å; E131-L135 PolarHBondContact O-N 3.33Å; R132-L135 PolarHBondContact O-N 2.87Å; L135-R137 VanDerWaalsContact C-N 3.35Å; L135-Q138 PolarHBondContact O-N 3.38Å; L135-L139 HydrophobicContact CD1-CD1 3.83Å; L135-L139 HydrophobicContact CD1-CG 4.23Å; L135-L139 HydrophobicContact CG-CD1 4Å; L135-L139 WeakPolarHBondContact O-CB 3.44Å; L135-L139 VanDerWaalsContact O-CG 3.31Å; L135-L139 WeakPolarHBondContact O-CG 3.25Å; L135-L139 PolarHBondContact O-N 2.89Å; L135-L139 VanDerWaalsContact O-N 3.1Å; L135-V146 HydrophobicContact CD2-CG1 3.93Å; L135-F150 HydrophobicContact CD2-CE2 3.77Å; L135-F150 HydrophobicContact CD2-CZ 4.09Å |
| 136 | A | 97.9 | Very high | 97.1 | Very high | 5 Ų | 5 | 71.7 Ų | 71.7 | 4% | 0.041 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59.9 | -46.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | R132 T133 E134 L139 N140 L141 E143 V146 | R132-A136 WeakPolarHBondContact O-CB 3.4Å; R132-A136 PolarHBondContact O-N 3Å; T133-A136 PolarHBondContact O-N 3.18Å; E134-A136 VanDerWaalsContact C-N 3.32Å; E134-A136 PolarHBondContact O-N 3.5Å; A136-L139 PolarHBondContact O-N 3.39Å; A136-N140 PolarHBondContact O-N 2.96Å; A136-N140 VanDerWaalsContact O-N 3.09Å; A136-L141 CarbonylContact C-O 3.45Å; A136-L141 WeakPolarHBondContact CB-O 3.34Å; A136-L141 PolarHBondContact O-N 2.9Å; A136-L141 VanDerWaalsContact O-O 3.1Å; A136-E143 HydrophobicContact CB-CG 4.06Å; A136-V146 HydrophobicContact CB-CG2 3.96Å |
| 137 | R | 98 | Very high | 97.1 | Very high | 160 Ų | 160 | 71.4 Ų | 71.4 | 60% | 0.604 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -62.4 | -47 | 177.2 | -167.9 | -167.9 | 69.9 | 77.2 | 3 | 112.1 | T133 E134 L135 L139 N140 | T133-R137 WeakPolarHBondContact O-CB 3.26Å; T133-R137 PolarHBondContact O-N 2.93Å; E134-R137 WeakPolarHBondContact O-CB 3.46Å; E134-R137 PolarHBondContact O-N 3.35Å; E134-R137 IonicContact OE1-CZ 3Å; E134-R137 IonicContact OE1-NE 3.7Å; E134-R137 IonicContact OE1-NH2 2.78Å; E134-R137 PolarHBondContact OE1-NH2 2.78Å; E134-R137 IonicContact OE2-CZ 2.71Å; E134-R137 IonicContact OE2-NE 3.28Å; E134-R137 PolarHBondContact OE2-NE 3.38Å; E134-R137 IonicContact OE2-NH2 3.62Å; L135-R137 VanDerWaalsContact C-N 3.35Å; R137-L139 VanDerWaalsContact C-N 3.28Å; R137-L139 PolarHBondContact O-N 3.21Å; R137-N140 PolarHBondContact O-N 2.83Å |
| 138 | Q | 97.4 | Very high | 97.1 | Very high | 97 Ų | 97 | 74.1 Ų | 74.1 | 45% | 0.453 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.6 | -34.5 | -179.5 | -71.9 | 178.2 | 9.7 | 0 | 0 | 112.9 | E134 L135 | E134-Q138 WeakPolarHBondContact O-CG 3.41Å; E134-Q138 PolarHBondContact O-N 3.18Å; E134-Q138 WeakPolarHBondContact OE1-CG 3.26Å; E134-Q138 PolarHBondContact OE1-NE2 2.93Å; L135-Q138 PolarHBondContact O-N 3.38Å |
| 139 | L | 96.9 | Very high | 97.2 | Very high | 15 Ų | 15 | 71 Ų | 71 | 8% | 0.079 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -95.4 | 0.5 | -176.8 | -58.8 | -178.4 | 0 | 0 | 0 | 113.9 | Q113 R116 L117 L135 A136 R137 L141 | Q113-L139 HydrophobicContact CG-CB 4.44Å; Q113-L139 PolarHBondContact NE2-O 3.34Å; R116-L139 HydrophobicContact CB-CD1 4.24Å; R116-L139 HydrophobicContact CB-CD2 3.51Å; R116-L139 HydrophobicContact CB-CG 4.48Å; R116-L139 HydrophobicContact CG-CD2 3.79Å; L117-L139 HydrophobicContact CD1-CD1 4.37Å; L117-L139 HydrophobicContact CD2-CD1 3.69Å; L117-L139 HydrophobicContact CG-CD1 3.61Å; L135-L139 HydrophobicContact CD1-CD1 3.83Å; L135-L139 HydrophobicContact CD1-CG 4.23Å; L135-L139 HydrophobicContact CG-CD1 4Å; L135-L139 WeakPolarHBondContact O-CB 3.44Å; L135-L139 VanDerWaalsContact O-CG 3.31Å; L135-L139 WeakPolarHBondContact O-CG 3.25Å; L135-L139 PolarHBondContact O-N 2.89Å; L135-L139 VanDerWaalsContact O-N 3.1Å; A136-L139 PolarHBondContact O-N 3.39Å; R137-L139 VanDerWaalsContact C-N 3.28Å; R137-L139 PolarHBondContact O-N 3.21Å; L139-L141 HydrophobicContact CB-CD1 4.04Å; L139-L141 HydrophobicContact CB-CG 3.97Å; L139-L141 HydrophobicContact CD1-CD1 4.41Å; L139-L141 PolarHBondContact O-N 2.96Å |
| 140 | N | 97.2 | Very high | 97.3 | Very high | 149 Ų | 149 | 69.3 Ų | 69.3 | 80% | 0.797 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53 | 42.9 | -172 | -58.2 | -74.5 | 0 | 0 | 0 | 112.3 | A136 R137 | A136-N140 PolarHBondContact O-N 2.96Å; A136-N140 VanDerWaalsContact O-N 3.09Å; R137-N140 PolarHBondContact O-N 2.83Å |
| 141 | L | 96.3 | Very high | 97.3 | Very high | 24 Ų | 24 | 62.7 Ų | 62.7 | 13% | 0.126 | 31% | 0.309 | C | S | . | . | trans | -115.7 | 160.7 | 177 | -62.4 | -179 | 0 | 0 | 0 | 110.1 | F109 L117 A136 L139 Q145 V146 | F109-L141 HydrophobicContact CD1-CD1 3.92Å; F109-L141 HydrophobicContact CD1-CD2 3.85Å; F109-L141 HydrophobicContact CE1-CD1 3.83Å; F109-L141 HydrophobicContact CE1-CD2 3.78Å; F109-L141 HydrophobicContact CE1-CG 4.44Å; L117-L141 HydrophobicContact CD1-CD1 4.25Å; A136-L141 CarbonylContact C-O 3.45Å; A136-L141 WeakPolarHBondContact CB-O 3.34Å; A136-L141 PolarHBondContact O-N 2.9Å; A136-L141 VanDerWaalsContact O-O 3.1Å; L139-L141 HydrophobicContact CB-CD1 4.04Å; L139-L141 HydrophobicContact CB-CG 3.97Å; L139-L141 HydrophobicContact CD1-CD1 4.41Å; L139-L141 PolarHBondContact O-N 2.96Å; L141-Q145 HydrophobicContact CB-CB 4.48Å; L141-V146 HydrophobicContact CB-CG2 4.19Å; L141-V146 HydrophobicContact CD1-CG2 4.49Å | ||
| 142 | S | 97 | Very high | 97.4 | Very high | 54 Ų | 54 | 63.6 Ų | 63.6 | 38% | 0.378 | 32% | 0.316 | S | S | . | . | trans | -77.8 | 149.9 | 168.1 | 65 | 0 | 0 | 0 | 0 | 111.5 | T144 Q145 V146 | S142-T144 PolarHBondContact O-N 3.27Å; S142-T144 VanDerWaalsContact O-N 3.13Å; S142-Q145 WeakPolarHBondContact O-CB 3.46Å; S142-Q145 PolarHBondContact O-N 3.07Å; S142-Q145 VanDerWaalsContact OG-CG 3.25Å; S142-Q145 WeakPolarHBondContact OG-CG 3.49Å; S142-Q145 PolarHBondContact OG-N 3.05Å; S142-Q145 PolarHBondContact OG-OE1 2.86Å; S142-V146 PolarHBondContact O-N 3.31Å; S142-V146 VanDerWaalsContact O-N 3.08Å | ||
| 143 | E | 97.4 | Very high | 97.3 | Very high | 77 Ų | 77 | 63.1 Ų | 63.1 | 36% | 0.36 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -54.1 | -34.6 | 173.4 | -70.5 | -164.4 | -141.8 | 0 | 0 | 112.5 | R132 T133 A136 V146 K147 | R132-E143 WeakPolarHBondContact CD-O 3.5Å; R132-E143 HydrophobicContact CG-CB 4.04Å; R132-E143 HydrophobicContact CG-CG 4.1Å; R132-E143 IonicContact NE-OE2 2.79Å; R132-E143 PolarHBondContact NE-OE2 3.46Å; T133-E143 VanDerWaalsContact OG1-CD 3.24Å; T133-E143 PolarHBondContact OG1-OE1 3Å; T133-E143 PolarHBondContact OG1-OE2 2.79Å; A136-E143 HydrophobicContact CB-CG 4.06Å; E143-V146 PolarHBondContact O-N 3.49Å; E143-K147 VanDerWaalsContact O-CB 3.28Å; E143-K147 WeakPolarHBondContact O-CB 3.45Å; E143-K147 PolarHBondContact O-N 2.96Å |
| 144 | T | 96.2 | Very high | 97.3 | Very high | 90 Ų | 90 | 62.6 Ų | 62.6 | 55% | 0.552 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -65.6 | -41.7 | 176.4 | -62.3 | 0 | 0 | 0 | 0 | 111.5 | S142 K147 V148 | S142-T144 PolarHBondContact O-N 3.27Å; S142-T144 VanDerWaalsContact O-N 3.13Å; T144-K147 PolarHBondContact O-N 3.48Å; T144-V148 HydrophobicContact CG2-CG2 4.37Å; T144-V148 WeakPolarHBondContact O-CB 3.37Å; T144-V148 VanDerWaalsContact O-CG2 3.26Å; T144-V148 WeakPolarHBondContact O-CG2 3.02Å; T144-V148 PolarHBondContact O-N 3.09Å |
| 145 | Q | 96.3 | Very high | 97.3 | Very high | 50 Ų | 50 | 63.1 Ų | 63.1 | 23% | 0.234 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.3 | -43.8 | 176.1 | -76.4 | 164.5 | -56.3 | 0 | 0 | 111.5 | F109 L141 S142 K147 V148 W149 | F109-Q145 HydrophobicContact CE1-CB 4.27Å; F109-Q145 HydrophobicContact CZ-CB 4.2Å; L141-Q145 HydrophobicContact CB-CB 4.48Å; S142-Q145 WeakPolarHBondContact O-CB 3.46Å; S142-Q145 PolarHBondContact O-N 3.07Å; S142-Q145 VanDerWaalsContact OG-CG 3.25Å; S142-Q145 WeakPolarHBondContact OG-CG 3.49Å; S142-Q145 PolarHBondContact OG-N 3.05Å; S142-Q145 PolarHBondContact OG-OE1 2.86Å; Q145-K147 PolarHBondContact O-N 3.32Å; Q145-V148 PolarHBondContact O-N 3.1Å; Q145-W149 WeakPolarHBondContact O-CB 3.4Å; Q145-W149 PolarHBondContact O-N 3.45Å |
| 146 | V | 97.3 | Very high | 97.3 | Very high | 0 Ų | 0 | 67.9 Ų | 67.9 | 0% | 0 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -59.9 | -47.8 | 174.5 | 177.4 | 0 | 0 | 0 | 0 | 110.1 | L117 V127 R132 L135 A136 L141 S142 E143 V148 W149 F150 | L117-V146 HydrophobicContact CD2-CG1 4.39Å; V127-V146 HydrophobicContact CG2-CG1 3.96Å; R132-V146 HydrophobicContact CG-CB 4.39Å; R132-V146 HydrophobicContact CG-CG1 4.23Å; L135-V146 HydrophobicContact CD2-CG1 3.93Å; A136-V146 HydrophobicContact CB-CG2 3.96Å; L141-V146 HydrophobicContact CB-CG2 4.19Å; L141-V146 HydrophobicContact CD1-CG2 4.49Å; S142-V146 PolarHBondContact O-N 3.31Å; S142-V146 VanDerWaalsContact O-N 3.08Å; E143-V146 PolarHBondContact O-N 3.49Å; V146-V148 PolarHBondContact O-N 3.06Å; V146-W149 PolarHBondContact O-N 2.8Å; V146-F150 HydrophobicContact CG1-CD2 3.84Å; V146-F150 HydrophobicContact CG1-CE2 3.9Å; V146-F150 WeakPolarHBondContact O-CD2 3.33Å; V146-F150 PolarHBondContact O-N 3.29Å |
| 147 | K | 96.9 | Very high | 97.2 | Very high | 128 Ų | 128 | 69.5 Ų | 69.5 | 56% | 0.557 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -56.3 | -47.9 | 176.6 | -178.2 | -176.2 | 178.9 | -178.8 | 0 | 112.2 | E143 T144 Q145 F150 Q151 | E143-K147 VanDerWaalsContact O-CB 3.28Å; E143-K147 WeakPolarHBondContact O-CB 3.45Å; E143-K147 PolarHBondContact O-N 2.96Å; T144-K147 PolarHBondContact O-N 3.48Å; Q145-K147 PolarHBondContact O-N 3.32Å; K147-F150 PolarHBondContact O-N 2.93Å; K147-Q151 WeakPolarHBondContact O-CB 3.46Å; K147-Q151 PolarHBondContact O-N 2.89Å |
| 148 | V | 96.9 | Very high | 97.1 | Very high | 69 Ų | 69 | 69.6 Ų | 69.6 | 42% | 0.418 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.8 | -40.5 | 179.3 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | T144 Q145 V146 Q151 N152 | T144-V148 HydrophobicContact CG2-CG2 4.37Å; T144-V148 WeakPolarHBondContact O-CB 3.37Å; T144-V148 VanDerWaalsContact O-CG2 3.26Å; T144-V148 WeakPolarHBondContact O-CG2 3.02Å; T144-V148 PolarHBondContact O-N 3.09Å; Q145-V148 PolarHBondContact O-N 3.1Å; V146-V148 PolarHBondContact O-N 3.06Å; V148-Q151 PolarHBondContact O-N 2.71Å; V148-N152 WeakPolarHBondContact O-CB 3.39Å; V148-N152 VanDerWaalsContact O-CG 3.23Å; V148-N152 PolarHBondContact O-N 3.42Å; V148-N152 PolarHBondContact O-ND2 2.95Å |
| 149 | W | 97.4 | Very high | 97 | Very high | 25 Ų | 25 | 71.6 Ų | 71.6 | 10% | 0.095 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -61.2 | -48.9 | 176.8 | -172.5 | 97.8 | 0 | 0 | 0 | 111.2 | F109 L117 E118 F121 Q145 V146 Q151 N152 R153 | F109-W149 AromaticContact CD2-CD1 3.68Å; F109-W149 HydrophobicContact CE2-CB 4.36Å; F109-W149 AromaticContact CE2-CD1 3.53Å; F109-W149 HydrophobicContact CE2-CG 4.32Å; L117-W149 HydrophobicContact CB-CD2 3.92Å; L117-W149 HydrophobicContact CB-CE3 3.89Å; L117-W149 HydrophobicContact CB-CH2 3.62Å; L117-W149 HydrophobicContact CB-CZ2 3.6Å; L117-W149 HydrophobicContact CB-CZ3 3.75Å; L117-W149 HydrophobicContact CD1-CD2 3.85Å; L117-W149 HydrophobicContact CD1-CE3 4.48Å; L117-W149 HydrophobicContact CD1-CG 3.85Å; L117-W149 HydrophobicContact CD2-CD2 4.32Å; L117-W149 HydrophobicContact CD2-CE3 4.19Å; L117-W149 HydrophobicContact CG-CD2 4.25Å; L117-W149 HydrophobicContact CG-CE3 4.41Å; E118-W149 HydrophobicContact CB-CH2 4.48Å; F121-W149 HydrophobicContact CB-CH2 4.22Å; F121-W149 HydrophobicContact CB-CZ3 4.01Å; F121-W149 HydrophobicContact CD2-CZ3 4.4Å; F121-W149 HydrophobicContact CG-CZ3 4.35Å; Q145-W149 WeakPolarHBondContact O-CB 3.4Å; Q145-W149 PolarHBondContact O-N 3.45Å; V146-W149 PolarHBondContact O-N 2.8Å; W149-Q151 VanDerWaalsContact C-N 3.31Å; W149-Q151 PolarHBondContact O-N 3.43Å; W149-N152 PolarHBondContact O-N 3.42Å; W149-R153 HydrophobicContact CE3-CB 4.08Å; W149-R153 HydrophobicContact CH2-CB 4.08Å; W149-R153 HydrophobicContact CH2-CG 3.78Å; W149-R153 HydrophobicContact CZ2-CG 4.47Å; W149-R153 HydrophobicContact CZ3-CB 3.82Å; W149-R153 HydrophobicContact CZ3-CG 3.87Å; W149-R153 WeakPolarHBondContact O-CB 3.48Å; W149-R153 PolarHBondContact O-N 3.45Å |
| 150 | F | 98.3 | Very high | 96.8 | Very high | 5 Ų | 5 | 72.8 Ų | 72.8 | 2% | 0.022 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.8 | -37.5 | 177.6 | -89.4 | -101.6 | 0 | 0 | 0 | 112.3 | L117 E120 F121 C124 V127 L135 V146 K147 R153 R154 | L117-F150 HydrophobicContact CD2-CE2 3.95Å; E120-F150 HydrophobicContact CB-CZ 4.32Å; E120-F150 HydrophobicContact CG-CZ 4.35Å; F121-F150 HydrophobicContact CB-CE1 4.13Å; F121-F150 HydrophobicContact CB-CZ 4.41Å; F121-F150 AromaticContact CD2-CD1 3.77Å; F121-F150 HydrophobicContact CD2-CD1 3.77Å; F121-F150 AromaticContact CD2-CE1 3.81Å; F121-F150 HydrophobicContact CD2-CE1 3.81Å; F121-F150 HydrophobicContact CE2-CD1 4.46Å; F121-F150 HydrophobicContact CG-CE1 4.48Å; C124-F150 WeakPolarHBondContact O-CE1 3.44Å; V127-F150 HydrophobicContact CB-CE1 4.29Å; V127-F150 HydrophobicContact CB-CZ 4.28Å; V127-F150 HydrophobicContact CG1-CD1 4.26Å; V127-F150 HydrophobicContact CG1-CE1 3.54Å; V127-F150 HydrophobicContact CG1-CE2 4.06Å; V127-F150 HydrophobicContact CG1-CZ 3.42Å; V127-F150 VanDerWaalsContact CG1-CZ 3.42Å; V127-F150 HydrophobicContact CG2-CB 4.47Å; V127-F150 HydrophobicContact CG2-CD1 3.85Å; V127-F150 HydrophobicContact CG2-CD2 3.6Å; V127-F150 HydrophobicContact CG2-CE1 3.92Å; V127-F150 HydrophobicContact CG2-CE2 3.68Å; V127-F150 HydrophobicContact CG2-CG 3.7Å; V127-F150 HydrophobicContact CG2-CZ 3.84Å; L135-F150 HydrophobicContact CD2-CE2 3.77Å; L135-F150 HydrophobicContact CD2-CZ 4.09Å; V146-F150 HydrophobicContact CG1-CD2 3.84Å; V146-F150 HydrophobicContact CG1-CE2 3.9Å; V146-F150 WeakPolarHBondContact O-CD2 3.33Å; V146-F150 PolarHBondContact O-N 3.29Å; K147-F150 PolarHBondContact O-N 2.93Å; F150-R153 PolarHBondContact O-N 3.27Å; F150-R154 WeakPolarHBondContact O-CG 3.29Å; F150-R154 PolarHBondContact O-N 3.4Å |
| 151 | Q | 98 | Very high | 96.6 | Very high | 85 Ų | 85 | 70.7 Ų | 70.7 | 40% | 0.397 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.4 | -47 | 173.9 | -175.5 | 58.4 | 69.5 | 0 | 0 | 111.6 | K147 V148 W149 R153 R154 T155 | K147-Q151 WeakPolarHBondContact O-CB 3.46Å; K147-Q151 PolarHBondContact O-N 2.89Å; V148-Q151 PolarHBondContact O-N 2.71Å; W149-Q151 VanDerWaalsContact C-N 3.31Å; W149-Q151 PolarHBondContact O-N 3.43Å; Q151-R153 VanDerWaalsContact C-N 3.32Å; Q151-R153 PolarHBondContact O-N 2.91Å; Q151-R154 PolarHBondContact O-N 2.84Å; Q151-T155 PolarHBondContact O-N 2.82Å; Q151-T155 VanDerWaalsContact O-N 3.1Å; Q151-T155 PolarHBondContact O-OG1 3.15Å; Q151-T155 VanDerWaalsContact O-OG1 3.09Å |
| 152 | N | 97.4 | Very high | 96.2 | Very high | 99 Ų | 99 | 73 Ų | 73 | 53% | 0.529 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 177.6 | -71.7 | -18.2 | 0 | 0 | 0 | 111.6 | V148 W149 T155 K156 | V148-N152 WeakPolarHBondContact O-CB 3.39Å; V148-N152 VanDerWaalsContact O-CG 3.23Å; V148-N152 PolarHBondContact O-N 3.42Å; V148-N152 PolarHBondContact O-ND2 2.95Å; W149-N152 PolarHBondContact O-N 3.42Å; N152-T155 PolarHBondContact O-N 2.96Å; N152-K156 WeakPolarHBondContact O-CB 3.13Å; N152-K156 PolarHBondContact O-N 3.07Å |
| 153 | R | 97.8 | Very high | 95.9 | Very high | 45 Ų | 45 | 75.9 Ų | 75.9 | 17% | 0.17 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -63.2 | -44.3 | 179.2 | -174.9 | 65.4 | -171.1 | 101.4 | -3.3 | 111.8 | E118 F121 W149 F150 Q151 K156 Q157 | E118-R153 VanDerWaalsContact CD-NE 3.31Å; E118-R153 IonicContact OE1-CZ 2.8Å; E118-R153 VanDerWaalsContact OE1-CZ 3.28Å; E118-R153 IonicContact OE1-NE 3.63Å; E118-R153 PolarHBondContact OE1-NE 3.41Å; E118-R153 IonicContact OE1-NH2 3.8Å; E118-R153 PolarHBondContact OE1-NH2 3.26Å; E118-R153 WeakPolarHBondContact OE2-CD 3.44Å; E118-R153 IonicContact OE2-CZ 3.68Å; E118-R153 IonicContact OE2-NE 2.6Å; E118-R153 PolarHBondContact OE2-NE 3.42Å; E118-R153 IonicContact OE2-NH2 3.29Å; F121-R153 HydrophobicContact CD1-CG 3.68Å; F121-R153 HydrophobicContact CD2-CB 4.27Å; F121-R153 HydrophobicContact CD2-CG 3.72Å; F121-R153 HydrophobicContact CE1-CG 3.62Å; F121-R153 HydrophobicContact CE2-CB 4.13Å; F121-R153 HydrophobicContact CE2-CG 3.68Å; F121-R153 HydrophobicContact CG-CG 3.73Å; F121-R153 HydrophobicContact CZ-CB 4.41Å; F121-R153 HydrophobicContact CZ-CG 3.63Å; W149-R153 HydrophobicContact CE3-CB 4.08Å; W149-R153 HydrophobicContact CH2-CB 4.08Å; W149-R153 HydrophobicContact CH2-CG 3.78Å; W149-R153 HydrophobicContact CZ2-CG 4.47Å; W149-R153 HydrophobicContact CZ3-CB 3.82Å; W149-R153 HydrophobicContact CZ3-CG 3.87Å; W149-R153 WeakPolarHBondContact O-CB 3.48Å; W149-R153 PolarHBondContact O-N 3.45Å; F150-R153 PolarHBondContact O-N 3.27Å; Q151-R153 VanDerWaalsContact C-N 3.32Å; Q151-R153 PolarHBondContact O-N 2.91Å; R153-K156 PolarHBondContact O-N 3.34Å; R153-Q157 PolarHBondContact O-N 2.78Å |
| 154 | R | 97.8 | Very high | 95.5 | Very high | 56 Ų | 56 | 76.4 Ų | 76.4 | 21% | 0.211 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -62.1 | -43.9 | 173.9 | -73.1 | -174.5 | -72.9 | 130.1 | -0.1 | 112.3 | F121 Q125 Y126 F150 Q151 K156 Q157 K158 | F121-R154 HydrophobicContact CE2-CG 3.74Å; F121-R154 HydrophobicContact CZ-CG 4.1Å; Q125-R154 WeakPolarHBondContact O-CD 3.34Å; Y126-R154 VanDerWaalsContact CZ-CD 3.42Å; Y126-R154 PolarHBondContact OH-NH1 2.81Å; F150-R154 WeakPolarHBondContact O-CG 3.29Å; F150-R154 PolarHBondContact O-N 3.4Å; Q151-R154 PolarHBondContact O-N 2.84Å; R154-K156 VanDerWaalsContact C-N 3.33Å; R154-K156 PolarHBondContact O-N 2.9Å; R154-Q157 PolarHBondContact O-N 2.83Å; R154-K158 PolarHBondContact O-N 3.23Å |
| 155 | T | 97.8 | Very high | 95.1 | Very high | 83 Ų | 83 | 78 Ų | 78 | 51% | 0.509 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -59.9 | -44.3 | 175.2 | -58.1 | 0 | 0 | 0 | 0 | 111.3 | Q151 N152 K158 K159 | Q151-T155 PolarHBondContact O-N 2.82Å; Q151-T155 VanDerWaalsContact O-N 3.1Å; Q151-T155 PolarHBondContact O-OG1 3.15Å; Q151-T155 VanDerWaalsContact O-OG1 3.09Å; N152-T155 PolarHBondContact O-N 2.96Å; T155-K158 PolarHBondContact O-N 2.99Å; T155-K159 WeakPolarHBondContact O-CB 3.37Å; T155-K159 PolarHBondContact O-N 3.43Å |
| 156 | K | 96.3 | Very high | 94.6 | Very high | 110 Ų | 110 | 82 Ų | 82 | 48% | 0.478 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.9 | -45.8 | 175.9 | -179.2 | 177.4 | 179.5 | -66.2 | 0 | 111.6 | N152 R153 R154 K158 K159 D160 | N152-K156 WeakPolarHBondContact O-CB 3.13Å; N152-K156 PolarHBondContact O-N 3.07Å; R153-K156 PolarHBondContact O-N 3.34Å; R154-K156 VanDerWaalsContact C-N 3.33Å; R154-K156 PolarHBondContact O-N 2.9Å; K156-K158 PolarHBondContact O-N 3.31Å; K156-K159 PolarHBondContact O-N 2.99Å; K156-K159 VanDerWaalsContact O-N 3.15Å; K156-D160 WeakPolarHBondContact CG-OD2 3.5Å; K156-D160 IonicContact NZ-OD2 2.76Å; K156-D160 PolarHBondContact NZ-OD2 2.86Å; K156-D160 WeakPolarHBondContact O-CB 3.45Å; K156-D160 VanDerWaalsContact O-CG 3.24Å; K156-D160 PolarHBondContact O-N 3.19Å |
| 157 | Q | 96.6 | Very high | 94 | Very high | 39 Ų | 39 | 87.1 Ų | 87.1 | 18% | 0.182 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -57.6 | -47 | 176.7 | 178.3 | -179 | -60.7 | 0 | 0 | 111.7 | F121 R153 R154 K159 D160 Q161 | F121-Q157 VanDerWaalsContact CZ-OE1 3.25Å; R153-Q157 PolarHBondContact O-N 2.78Å; R154-Q157 PolarHBondContact O-N 2.83Å; Q157-K159 VanDerWaalsContact C-N 3.3Å; Q157-K159 PolarHBondContact O-N 2.6Å; Q157-D160 PolarHBondContact O-N 3.4Å; Q157-Q161 HydrophobicContact CG-CG 4.48Å; Q157-Q161 WeakPolarHBondContact O-CB 3.39Å; Q157-Q161 VanDerWaalsContact O-CG 3.29Å; Q157-Q161 WeakPolarHBondContact O-CG 2.95Å; Q157-Q161 PolarHBondContact O-N 3.08Å |
| 158 | K | 96.3 | Very high | 93.5 | Very high | 161 Ų | 161 | 90.9 Ų | 90.9 | 70% | 0.7 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -59.7 | -42.4 | 176.7 | -176.8 | 177.6 | 178.3 | 178.7 | 0 | 111.5 | R154 T155 K156 S162 | R154-K158 PolarHBondContact O-N 3.23Å; T155-K158 PolarHBondContact O-N 2.99Å; K156-K158 PolarHBondContact O-N 3.31Å; K158-S162 WeakPolarHBondContact O-CB 3.48Å; K158-S162 PolarHBondContact O-N 3.02Å |
| 159 | K | 94.6 | Very high | 92.9 | Very high | 140 Ų | 140 | 90.5 Ų | 90.5 | 61% | 0.609 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -65.5 | -42.4 | 177.5 | -174.7 | 176.3 | -179.7 | 177.8 | 0 | 112.1 | T155 K156 Q157 S162 R163 | T155-K159 WeakPolarHBondContact O-CB 3.37Å; T155-K159 PolarHBondContact O-N 3.43Å; K156-K159 PolarHBondContact O-N 2.99Å; K156-K159 VanDerWaalsContact O-N 3.15Å; Q157-K159 VanDerWaalsContact C-N 3.3Å; Q157-K159 PolarHBondContact O-N 2.6Å; K159-S162 PolarHBondContact O-N 2.97Å; K159-R163 VanDerWaalsContact O-CG 3.31Å; K159-R163 WeakPolarHBondContact O-CG 3.31Å; K159-R163 PolarHBondContact O-N 3.41Å |
| 160 | D | 92.5 | Very high | 92.2 | Very high | 40 Ų | 40 | 92.5 Ų | 92.5 | 21% | 0.214 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -63.6 | -48.2 | 178.8 | -69.1 | -21.1 | 0 | 0 | 0 | 109.9 | K156 Q157 S162 R163 D164 | K156-D160 WeakPolarHBondContact CG-OD2 3.5Å; K156-D160 IonicContact NZ-OD2 2.76Å; K156-D160 PolarHBondContact NZ-OD2 2.86Å; K156-D160 WeakPolarHBondContact O-CB 3.45Å; K156-D160 VanDerWaalsContact O-CG 3.24Å; K156-D160 PolarHBondContact O-N 3.19Å; Q157-D160 PolarHBondContact O-N 3.4Å; D160-S162 PolarHBondContact O-N 3.13Å; D160-R163 PolarHBondContact O-N 2.84Å; D160-R163 VanDerWaalsContact O-N 3.13Å; D160-R163 IonicContact OD1-NH1 3.22Å; D160-D164 PolarHBondContact O-N 2.79Å |
| 161 | Q | 92.5 | Very high | 91.6 | Very high | 104 Ų | 104 | 95.3 Ų | 95.3 | 49% | 0.486 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -57.3 | -44.9 | 174.9 | -70.9 | 174.5 | -0.6 | 0 | 0 | 112.7 | Q157 R163 D164 L165 | Q157-Q161 HydrophobicContact CG-CG 4.48Å; Q157-Q161 WeakPolarHBondContact O-CB 3.39Å; Q157-Q161 VanDerWaalsContact O-CG 3.29Å; Q157-Q161 WeakPolarHBondContact O-CG 2.95Å; Q157-Q161 PolarHBondContact O-N 3.08Å; Q161-R163 VanDerWaalsContact C-N 3.32Å; Q161-R163 PolarHBondContact O-N 3.01Å; Q161-D164 PolarHBondContact O-N 3.35Å; Q161-L165 WeakPolarHBondContact O-CD1 3.34Å; Q161-L165 WeakPolarHBondContact O-CG 3.48Å; Q161-L165 PolarHBondContact O-N 3.04Å |
| 162 | S | 89.8 | Confident | 91 | Very high | 72 Ų | 72 | 94.7 Ų | 94.7 | 50% | 0.503 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.9 | -39.2 | 177.8 | -171 | 0 | 0 | 0 | 0 | 112.5 | K158 K159 D160 E166 | K158-S162 WeakPolarHBondContact O-CB 3.48Å; K158-S162 PolarHBondContact O-N 3.02Å; K159-S162 PolarHBondContact O-N 2.97Å; D160-S162 PolarHBondContact O-N 3.13Å; S162-E166 PolarHBondContact O-N 3.24Å; S162-E166 VanDerWaalsContact O-N 3.07Å |
| 163 | R | 89.8 | Confident | 90.3 | Very high | 115 Ų | 115 | 92.8 Ų | 92.8 | 43% | 0.434 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -69.3 | -38.7 | 177.8 | -73.3 | 169.7 | 66.5 | -126.5 | 1.2 | 111.6 | K159 D160 Q161 L165 E166 K167 | K159-R163 VanDerWaalsContact O-CG 3.31Å; K159-R163 WeakPolarHBondContact O-CG 3.31Å; K159-R163 PolarHBondContact O-N 3.41Å; D160-R163 PolarHBondContact O-N 2.84Å; D160-R163 VanDerWaalsContact O-N 3.13Å; D160-R163 IonicContact OD1-NH1 3.22Å; Q161-R163 VanDerWaalsContact C-N 3.32Å; Q161-R163 PolarHBondContact O-N 3.01Å; R163-L165 VanDerWaalsContact C-N 3.35Å; R163-E166 PolarHBondContact O-N 2.82Å; R163-K167 WeakPolarHBondContact O-CB 3.3Å; R163-K167 VanDerWaalsContact O-CG 3.24Å; R163-K167 WeakPolarHBondContact O-CG 3.07Å; R163-K167 PolarHBondContact O-N 2.86Å |
| 164 | D | 88.1 | Confident | 89.7 | Confident | 89 Ų | 89 | 94 Ų | 94 | 48% | 0.476 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -68.4 | -37 | 178.4 | -65.4 | -33.7 | 0 | 0 | 0 | 111.5 | D160 Q161 R168 | D160-D164 PolarHBondContact O-N 2.79Å; Q161-D164 PolarHBondContact O-N 3.35Å; D164-R168 VanDerWaalsContact O-CB 3.25Å; D164-R168 WeakPolarHBondContact O-CB 3.47Å; D164-R168 PolarHBondContact O-N 2.99Å |
| 165 | L | 88.1 | Confident | 89.1 | Confident | 124 Ų | 124 | 97.5 Ų | 97.5 | 65% | 0.649 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.3 | -47.4 | 171.1 | -76.9 | 155.1 | 0 | 0 | 0 | 111.9 | Q161 R163 R168 A169 | Q161-L165 WeakPolarHBondContact O-CD1 3.34Å; Q161-L165 WeakPolarHBondContact O-CG 3.48Å; Q161-L165 PolarHBondContact O-N 3.04Å; R163-L165 VanDerWaalsContact C-N 3.35Å; L165-R168 PolarHBondContact O-N 2.93Å; L165-A169 VanDerWaalsContact O-CB 3.3Å; L165-A169 WeakPolarHBondContact O-CB 3.25Å; L165-A169 PolarHBondContact O-N 3.48Å |
| 166 | E | 85.9 | Confident | 88.6 | Confident | 133 Ų | 133 | 96 Ų | 96 | 62% | 0.621 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.5 | -42.8 | 179.2 | -172.1 | -176.2 | 94.2 | 0 | 0 | 112.1 | S162 R163 A169 S170 | S162-E166 PolarHBondContact O-N 3.24Å; S162-E166 VanDerWaalsContact O-N 3.07Å; R163-E166 PolarHBondContact O-N 2.82Å; E166-A169 PolarHBondContact O-N 3.33Å; E166-S170 VanDerWaalsContact O-CB 3.31Å; E166-S170 WeakPolarHBondContact O-CB 3.28Å; E166-S170 PolarHBondContact O-N 2.87Å; E166-S170 PolarHBondContact O-OG 3.07Å |
| 167 | K | 85.5 | Confident | 88.2 | Confident | 108 Ų | 108 | 97.2 Ų | 97.2 | 47% | 0.47 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 175.1 | -74.2 | 170.9 | 178.9 | -173.6 | 0 | 111.3 | R163 S170 S171 | R163-K167 WeakPolarHBondContact O-CB 3.3Å; R163-K167 VanDerWaalsContact O-CG 3.24Å; R163-K167 WeakPolarHBondContact O-CG 3.07Å; R163-K167 PolarHBondContact O-N 2.86Å; K167-S170 PolarHBondContact O-N 3.12Å; K167-S171 WeakPolarHBondContact O-CB 3.47Å; K167-S171 PolarHBondContact O-N 3.39Å; K167-S171 PolarHBondContact O-OG 2.86Å; K167-S171 VanDerWaalsContact O-OG 3.13Å |
| 168 | R | 85.3 | Confident | 87.9 | Confident | 206 Ų | 206 | 97.6 Ų | 97.6 | 78% | 0.777 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68.6 | -36.8 | -177.9 | -163.2 | 162.7 | 168.4 | -169.9 | -4.4 | 111.9 | D164 L165 S172 | D164-R168 VanDerWaalsContact O-CB 3.25Å; D164-R168 WeakPolarHBondContact O-CB 3.47Å; D164-R168 PolarHBondContact O-N 2.99Å; L165-R168 PolarHBondContact O-N 2.93Å; R168-S172 VanDerWaalsContact O-CB 3.28Å; R168-S172 WeakPolarHBondContact O-CB 3.37Å; R168-S172 PolarHBondContact O-N 3.45Å |
| 169 | A | 84.9 | Confident | 87.6 | Confident | 61 Ų | 61 | 93.7 Ų | 93.7 | 50% | 0.504 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.3 | -42.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L165 E166 S172 A173 | L165-A169 VanDerWaalsContact O-CB 3.3Å; L165-A169 WeakPolarHBondContact O-CB 3.25Å; L165-A169 PolarHBondContact O-N 3.48Å; E166-A169 PolarHBondContact O-N 3.33Å; A169-S172 PolarHBondContact O-N 3.44Å; A169-A173 VanDerWaalsContact O-CB 3.27Å; A169-A173 WeakPolarHBondContact O-CB 3.24Å; A169-A173 PolarHBondContact O-N 2.99Å |
| 170 | S | 82.6 | Confident | 87.3 | Confident | 68 Ų | 68 | 89.9 Ų | 89.9 | 48% | 0.476 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.1 | -43.5 | 178.3 | -57.5 | 0 | 0 | 0 | 0 | 111.8 | E166 K167 A173 S174 | E166-S170 VanDerWaalsContact O-CB 3.31Å; E166-S170 WeakPolarHBondContact O-CB 3.28Å; E166-S170 PolarHBondContact O-N 2.87Å; E166-S170 PolarHBondContact O-OG 3.07Å; K167-S170 PolarHBondContact O-N 3.12Å; S170-A173 PolarHBondContact O-N 3.29Å; S170-S174 WeakPolarHBondContact O-CB 3.38Å; S170-S174 PolarHBondContact O-N 3.13Å; S170-S174 PolarHBondContact O-OG 3.39Å |
| 171 | S | 85.3 | Confident | 87.2 | Confident | 64 Ų | 64 | 90.9 Ų | 90.9 | 45% | 0.448 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.4 | -50.4 | 173.7 | -65.1 | 0 | 0 | 0 | 0 | 111 | K167 A173 S174 E175 | K167-S171 WeakPolarHBondContact O-CB 3.47Å; K167-S171 PolarHBondContact O-N 3.39Å; K167-S171 PolarHBondContact O-OG 2.86Å; K167-S171 VanDerWaalsContact O-OG 3.13Å; S171-A173 PolarHBondContact O-N 2.96Å; S171-S174 PolarHBondContact O-N 3.22Å; S171-S174 PolarHBondContact O-OG 2.86Å; S171-E175 WeakPolarHBondContact O-CG 3.31Å; S171-E175 PolarHBondContact O-N 2.72Å |
| 172 | S | 86 | Confident | 87.1 | Confident | 71 Ų | 71 | 90.2 Ų | 90.2 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.2 | -39.5 | 179.2 | -178.4 | 0 | 0 | 0 | 0 | 113 | R168 A169 E175 A176 | R168-S172 VanDerWaalsContact O-CB 3.28Å; R168-S172 WeakPolarHBondContact O-CB 3.37Å; R168-S172 PolarHBondContact O-N 3.45Å; A169-S172 PolarHBondContact O-N 3.44Å; S172-E175 PolarHBondContact O-N 3Å; S172-A176 WeakPolarHBondContact O-CB 3.33Å; S172-A176 PolarHBondContact O-N 3.46Å |
| 173 | A | 83 | Confident | 87.2 | Confident | 60 Ų | 60 | 91.9 Ų | 91.9 | 50% | 0.496 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.9 | -40.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | A169 S170 S171 A176 F177 | A169-A173 VanDerWaalsContact O-CB 3.27Å; A169-A173 WeakPolarHBondContact O-CB 3.24Å; A169-A173 PolarHBondContact O-N 2.99Å; S170-A173 PolarHBondContact O-N 3.29Å; S171-A173 PolarHBondContact O-N 2.96Å; A173-A176 PolarHBondContact O-N 2.91Å; A173-F177 WeakPolarHBondContact O-CB 3.27Å; A173-F177 PolarHBondContact O-N 2.94Å |
| 174 | S | 86.2 | Confident | 87.1 | Confident | 71 Ų | 71 | 92.2 Ų | 92.2 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.4 | -40.4 | 176.4 | 70.4 | 0 | 0 | 0 | 0 | 112.1 | S170 S171 F177 A178 | S170-S174 WeakPolarHBondContact O-CB 3.38Å; S170-S174 PolarHBondContact O-N 3.13Å; S170-S174 PolarHBondContact O-OG 3.39Å; S171-S174 PolarHBondContact O-N 3.22Å; S171-S174 PolarHBondContact O-OG 2.86Å; S174-F177 PolarHBondContact O-N 3.28Å; S174-A178 WeakPolarHBondContact O-CB 3.34Å; S174-A178 PolarHBondContact O-N 2.85Å |
| 175 | E | 83.6 | Confident | 87.3 | Confident | 129 Ų | 129 | 90.3 Ų | 90.3 | 60% | 0.603 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.3 | -49.5 | 174.5 | -73.2 | 175.1 | 172.3 | 0 | 0 | 110.8 | S171 S172 F177 A178 T179 | S171-E175 WeakPolarHBondContact O-CG 3.31Å; S171-E175 PolarHBondContact O-N 2.72Å; S172-E175 PolarHBondContact O-N 3Å; E175-F177 VanDerWaalsContact C-N 3.27Å; E175-F177 PolarHBondContact O-N 3.2Å; E175-A178 PolarHBondContact O-N 3.39Å; E175-A178 VanDerWaalsContact O-N 3.14Å; E175-T179 PolarHBondContact O-N 2.74Å; E175-T179 PolarHBondContact O-OG1 3.47Å |
| 176 | A | 87.3 | Confident | 87.2 | Confident | 51 Ų | 51 | 88.1 Ų | 88.1 | 42% | 0.421 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.4 | -38.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | S172 A173 S180 | S172-A176 WeakPolarHBondContact O-CB 3.33Å; S172-A176 PolarHBondContact O-N 3.46Å; A173-A176 PolarHBondContact O-N 2.91Å; A176-S180 WeakPolarHBondContact O-CB 3.37Å; A176-S180 PolarHBondContact O-N 2.96Å; A176-S180 PolarHBondContact O-OG 3.14Å |
| 177 | F | 88.3 | Confident | 87.2 | Confident | 136 Ų | 136 | 89.9 Ų | 89.9 | 60% | 0.596 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -67.8 | -43.7 | 175.4 | -175.6 | -96.3 | 0 | 0 | 0 | 112.1 | A173 S174 E175 S180 N181 | A173-F177 WeakPolarHBondContact O-CB 3.27Å; A173-F177 PolarHBondContact O-N 2.94Å; S174-F177 PolarHBondContact O-N 3.28Å; E175-F177 VanDerWaalsContact C-N 3.27Å; E175-F177 PolarHBondContact O-N 3.2Å; F177-S180 PolarHBondContact O-N 3.47Å; F177-N181 WeakPolarHBondContact O-CB 3.33Å; F177-N181 PolarHBondContact O-N 3.3Å |
| 178 | A | 89.5 | Confident | 87.1 | Confident | 46 Ų | 46 | 90.1 Ų | 90.1 | 38% | 0.38 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.7 | -45.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | S174 E175 S180 N181 I182 | S174-A178 WeakPolarHBondContact O-CB 3.34Å; S174-A178 PolarHBondContact O-N 2.85Å; E175-A178 PolarHBondContact O-N 3.39Å; E175-A178 VanDerWaalsContact O-N 3.14Å; A178-S180 PolarHBondContact O-N 2.83Å; A178-N181 WeakPolarHBondContact O-CB 3.31Å; A178-N181 PolarHBondContact O-N 2.92Å; A178-I182 VanDerWaalsContact O-CG1 3.31Å; A178-I182 WeakPolarHBondContact O-CG1 3.33Å; A178-I182 PolarHBondContact O-N 3.45Å |
| 179 | T | 90.4 | Very high | 86.5 | Confident | 79 Ų | 79 | 82 Ų | 82 | 49% | 0.485 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.5 | -46.9 | 174.3 | -53.1 | 0 | 0 | 0 | 0 | 111.2 | E175 N181 I182 L183 | E175-T179 PolarHBondContact O-N 2.74Å; E175-T179 PolarHBondContact O-OG1 3.47Å; T179-N181 VanDerWaalsContact C-N 3.29Å; T179-N181 PolarHBondContact O-N 2.91Å; T179-I182 PolarHBondContact O-N 2.93Å; T179-L183 HydrophobicContact CG2-CD1 4.21Å; T179-L183 WeakPolarHBondContact O-CG 3.39Å; T179-L183 PolarHBondContact O-N 3.45Å |
| 180 | S | 88.3 | Confident | 85.7 | Confident | 60 Ų | 60 | 87.9 Ų | 87.9 | 42% | 0.42 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.4 | -36.6 | 177.9 | -60.7 | 0 | 0 | 0 | 0 | 112.6 | A176 F177 A178 R184 | A176-S180 WeakPolarHBondContact O-CB 3.37Å; A176-S180 PolarHBondContact O-N 2.96Å; A176-S180 PolarHBondContact O-OG 3.14Å; F177-S180 PolarHBondContact O-N 3.47Å; A178-S180 PolarHBondContact O-N 2.83Å; S180-R184 PolarHBondContact O-N 3.21Å |
| 181 | N | 90.9 | Very high | 84.5 | Confident | 61 Ų | 61 | 89.2 Ų | 89.2 | 33% | 0.326 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66 | -49.9 | 175.9 | -165.5 | -73.6 | 0 | 0 | 0 | 110.7 | F177 A178 T179 L183 R184 L185 | F177-N181 WeakPolarHBondContact O-CB 3.33Å; F177-N181 PolarHBondContact O-N 3.3Å; A178-N181 WeakPolarHBondContact O-CB 3.31Å; A178-N181 PolarHBondContact O-N 2.92Å; T179-N181 VanDerWaalsContact C-N 3.29Å; T179-N181 PolarHBondContact O-N 2.91Å; N181-L183 PolarHBondContact O-N 3.29Å; N181-R184 WeakPolarHBondContact O-CB 3.44Å; N181-R184 PolarHBondContact O-N 2.88Å; N181-R184 VanDerWaalsContact O-N 3.17Å; N181-L185 WeakPolarHBondContact O-CD1 3.44Å; N181-L185 PolarHBondContact O-N 3.35Å; N181-L185 WeakPolarHBondContact OD1-CD1 3.03Å |
| 182 | I | 90.8 | Very high | 83.2 | Confident | 91 Ų | 91 | 92.7 Ų | 92.7 | 47% | 0.467 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -57 | -48.4 | 178.2 | -67.6 | 164.6 | 0 | 0 | 0 | 111 | A178 T179 R184 L185 L186 | A178-I182 VanDerWaalsContact O-CG1 3.31Å; A178-I182 WeakPolarHBondContact O-CG1 3.33Å; A178-I182 PolarHBondContact O-N 3.45Å; T179-I182 PolarHBondContact O-N 2.93Å; I182-R184 VanDerWaalsContact C-N 3.29Å; I182-R184 PolarHBondContact O-N 2.76Å; I182-L185 PolarHBondContact O-N 2.94Å; I182-L185 VanDerWaalsContact O-N 3.14Å; I182-L186 HydrophobicContact CG2-CD1 3.97Å; I182-L186 HydrophobicContact CG2-CG 4.39Å; I182-L186 WeakPolarHBondContact O-CG 3.36Å; I182-L186 PolarHBondContact O-N 3.3Å |
| 183 | L | 91.7 | Very high | 81.6 | Confident | 107 Ų | 107 | 93.7 Ų | 93.7 | 56% | 0.56 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -57.5 | -42.1 | 178.7 | -70.7 | 173.5 | 0 | 0 | 0 | 112 | T179 N181 L186 E187 | T179-L183 HydrophobicContact CG2-CD1 4.21Å; T179-L183 WeakPolarHBondContact O-CG 3.39Å; T179-L183 PolarHBondContact O-N 3.45Å; N181-L183 PolarHBondContact O-N 3.29Å; L183-L186 PolarHBondContact O-N 2.92Å; L183-E187 PolarHBondContact O-N 3.38Å |
| 184 | R | 88.6 | Confident | 80.3 | Confident | 122 Ų | 122 | 96.6 Ų | 96.6 | 46% | 0.46 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -39.8 | 176.6 | -170.9 | -174.8 | -55.8 | 144.3 | 6.5 | 112.7 | S180 N181 I182 L186 E187 Q188 | S180-R184 PolarHBondContact O-N 3.21Å; N181-R184 WeakPolarHBondContact O-CB 3.44Å; N181-R184 PolarHBondContact O-N 2.88Å; N181-R184 VanDerWaalsContact O-N 3.17Å; I182-R184 VanDerWaalsContact C-N 3.29Å; I182-R184 PolarHBondContact O-N 2.76Å; R184-L186 VanDerWaalsContact C-N 3.34Å; R184-E187 PolarHBondContact O-N 3.14Å; R184-Q188 VanDerWaalsContact O-CG 3.27Å; R184-Q188 WeakPolarHBondContact O-CG 3.03Å; R184-Q188 PolarHBondContact O-N 2.98Å |
| 185 | L | 90.6 | Very high | 78.7 | Confident | 48 Ų | 48 | 98.8 Ų | 98.8 | 25% | 0.251 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -69.1 | -35.1 | 177.4 | -87 | 82.8 | 0 | 0 | 0 | 112.2 | N181 I182 Q188 G189 R190 L191 | N181-L185 WeakPolarHBondContact O-CD1 3.44Å; N181-L185 PolarHBondContact O-N 3.35Å; N181-L185 WeakPolarHBondContact OD1-CD1 3.03Å; I182-L185 PolarHBondContact O-N 2.94Å; I182-L185 VanDerWaalsContact O-N 3.14Å; L185-Q188 PolarHBondContact O-N 3.33Å; L185-G189 PolarHBondContact O-N 2.99Å; L185-R190 PolarHBondContact O-N 3.41Å; L185-R190 VanDerWaalsContact O-N 3.1Å; L185-L191 HydrophobicContact CB-CD1 3.93Å; L185-L191 HydrophobicContact CB-CG 3.9Å; L185-L191 HydrophobicContact CD2-CD1 4.49Å; L185-L191 HydrophobicContact CD2-CD2 3.94Å; L185-L191 HydrophobicContact CD2-CG 4.19Å |
| 186 | L | 87.2 | Confident | 77 | Confident | 79 Ų | 79 | 103.5 Ų | 103.5 | 41% | 0.414 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.2 | -45.1 | 173.4 | -69.7 | 170.8 | 0 | 0 | 0 | 110.8 | I182 L183 R184 Q188 G189 L191 | I182-L186 HydrophobicContact CG2-CD1 3.97Å; I182-L186 HydrophobicContact CG2-CG 4.39Å; I182-L186 WeakPolarHBondContact O-CG 3.36Å; I182-L186 PolarHBondContact O-N 3.3Å; L183-L186 PolarHBondContact O-N 2.92Å; R184-L186 VanDerWaalsContact C-N 3.34Å; L186-Q188 VanDerWaalsContact C-N 3.31Å; L186-Q188 PolarHBondContact O-N 2.98Å; L186-G189 PolarHBondContact O-N 2.86Å; L186-G189 VanDerWaalsContact O-N 3.09Å; L186-L191 HydrophobicContact CD2-CB 4.08Å; L186-L191 HydrophobicContact CD2-CD1 4.03Å; L186-L191 HydrophobicContact CG-CD1 4.21Å |
| 187 | E | 84.6 | Confident | 75.3 | Confident | 169 Ų | 169 | 104.6 Ų | 104.6 | 79% | 0.79 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -59.3 | -39.8 | 175.4 | -175.7 | -179.9 | -167 | 0 | 0 | 112.4 | L183 R184 G189 | L183-E187 PolarHBondContact O-N 3.38Å; R184-E187 PolarHBondContact O-N 3.14Å; E187-G189 PolarHBondContact O-N 3.03Å |
| 188 | Q | 83.4 | Confident | 73.5 | Confident | 113 Ų | 113 | 103.4 Ų | 103.4 | 53% | 0.528 | 56% | 0.558 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -76.8 | 0.4 | 178.1 | -67.9 | 174 | -3 | 0 | 0 | 114 | R184 L185 L186 R190 | R184-Q188 VanDerWaalsContact O-CG 3.27Å; R184-Q188 WeakPolarHBondContact O-CG 3.03Å; R184-Q188 PolarHBondContact O-N 2.98Å; L185-Q188 PolarHBondContact O-N 3.33Å; L186-Q188 VanDerWaalsContact C-N 3.31Å; L186-Q188 PolarHBondContact O-N 2.98Å; Q188-R190 HydrophobicContact CB-CG 3.98Å; Q188-R190 PolarHBondContact O-N 2.97Å; Q188-R190 VanDerWaalsContact O-N 3.16Å |
| 189 | G | 73.5 | Confident | 71.4 | Confident | 37 Ų | 37 | 106.6 Ų | 106.6 | 38% | 0.381 | 58% | 0.577 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 66.1 | 13.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | L185 L186 E187 S193 | L185-G189 PolarHBondContact O-N 2.99Å; L186-G189 PolarHBondContact O-N 2.86Å; L186-G189 VanDerWaalsContact O-N 3.09Å; E187-G189 PolarHBondContact O-N 3.03Å; G189-S193 PolarHBondContact O-N 3.17Å |
| 190 | R | 67.5 | Low | 69.3 | Low | 183 Ų | 183 | 110 Ų | 110 | 69% | 0.691 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -80 | -17.3 | -173.8 | -68.4 | -168.8 | 70.1 | 171.8 | 2 | 114.2 | L185 Q188 | L185-R190 PolarHBondContact O-N 3.41Å; L185-R190 VanDerWaalsContact O-N 3.1Å; Q188-R190 HydrophobicContact CB-CG 3.98Å; Q188-R190 PolarHBondContact O-N 2.97Å; Q188-R190 VanDerWaalsContact O-N 3.16Å |
| 191 | L | 58.4 | Low | 67.5 | Low | 96 Ų | 96 | 114.7 Ų | 114.7 | 50% | 0.503 | 61% | 0.611 | S | S | . | * | S | Bend | trans | -97.7 | -11.9 | 175.2 | -63.5 | -179.4 | 0 | 0 | 0 | 113.8 | L185 L186 | L185-L191 HydrophobicContact CB-CD1 3.93Å; L185-L191 HydrophobicContact CB-CG 3.9Å; L185-L191 HydrophobicContact CD2-CD1 4.49Å; L185-L191 HydrophobicContact CD2-CD2 3.94Å; L185-L191 HydrophobicContact CD2-CG 4.19Å; L186-L191 HydrophobicContact CD2-CB 4.08Å; L186-L191 HydrophobicContact CD2-CD1 4.03Å; L186-L191 HydrophobicContact CG-CD1 4.21Å |
| 192 | L | 56.9 | Low | 65.1 | Low | 137 Ų | 137 | 116.1 Ų | 116.1 | 72% | 0.717 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -106.2 | 1.6 | 178.7 | -63.3 | 177.2 | 0 | 0 | 0 | 113 | V194 | L192-V194 PolarHBondContact O-N 3.22Š|
| 193 | S | 53.3 | Low | 62.9 | Low | 93 Ų | 93 | 120 Ų | 120 | 65% | 0.65 | 65% | 0.652 | S | S | * | * | trans | -76.4 | 89.4 | 171.8 | -170.1 | 0 | 0 | 0 | 0 | 109.5 | G189 | G189-S193 PolarHBondContact O-N 3.17Š| ||
| 194 | V | 56.2 | Low | 60.4 | Low | 120 Ų | 120 | 121.5 Ų | 121.5 | 73% | 0.727 | 67% | 0.666 | S | S | * | * | trans | -52.5 | 125.6 | 161.7 | 174.4 | 0 | 0 | 0 | 0 | 107.2 | L192 R196 | L192-V194 PolarHBondContact O-N 3.22Å; V194-R196 PolarHBondContact O-N 3.09Å | ||
| 195 | P | 51.8 | Low | 58.6 | Low | 117 Ų | 117 | 121.3 Ų | 121.3 | 76% | 0.76 | 68% | 0.68 | S | S | * | * | trans | -57.4 | 109.6 | 169.7 | -19 | 30.1 | 0 | 0 | 0 | 107.5 | A197 | P195-A197 VanDerWaalsContact C-N 3.35Å; P195-A197 PolarHBondContact O-N 3.26Å | ||
| 196 | R | 47.8 | Very low | 56.2 | Low | 228 Ų | 228 | 124.5 Ų | 124.5 | 86% | 0.86 | 71% | 0.706 | S | S | * | * | trans | -60.1 | 102.3 | 171.9 | 179.2 | 100.8 | 76.1 | 86.7 | 1 | 106.4 | V194 | V194-R196 PolarHBondContact O-N 3.09Š| ||
| 197 | A | 52.1 | Low | 54.2 | Low | 74 Ų | 74 | 128.8 Ų | 128.8 | 61% | 0.612 | 73% | 0.729 | S | S | * | * | trans | -54.1 | 136.5 | 170.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | P195 S199 | P195-A197 VanDerWaalsContact C-N 3.35Å; P195-A197 PolarHBondContact O-N 3.26Å; A197-S199 PolarHBondContact O-N 3.36Å; A197-S199 VanDerWaalsContact O-N 3.11Å | ||
| 198 | P | 50.5 | Low | 52.7 | Low | 112 Ų | 112 | 126.2 Ų | 126.2 | 73% | 0.727 | 73% | 0.727 | S | S | * | * | trans | -64.3 | 116.7 | 176.5 | 26.8 | -32 | 0 | 0 | 0 | 108.5 | L200 | P198-L200 PolarHBondContact O-N 3.44Å; P198-L200 VanDerWaalsContact O-N 3.09Å | ||
| 199 | S | 45.7 | Very low | 50.4 | Low | 112 Ų | 112 | 124.8 Ų | 124.8 | 78% | 0.783 | 74% | 0.743 | S | S | * | * | trans | -63.6 | 108.5 | 175.9 | -56.7 | 0 | 0 | 0 | 0 | 109.7 | A197 | A197-S199 PolarHBondContact O-N 3.36Å; A197-S199 VanDerWaalsContact O-N 3.11Å | ||
| 200 | L | 45.3 | Very low | 48.8 | Very low | 151 Ų | 151 | 131.1 Ų | 131.1 | 79% | 0.791 | 77% | 0.767 | S | S | * | * | trans | -89.2 | 109.3 | 169.6 | -63.4 | -171.1 | 0 | 0 | 0 | 110.1 | P198 | P198-L200 PolarHBondContact O-N 3.44Å; P198-L200 VanDerWaalsContact O-N 3.09Å | ||
| 201 | L | 50.1 | Low | 48.2 | Very low | 159 Ų | 159 | 127.8 Ų | 127.8 | 83% | 0.832 | 77% | 0.769 | S | S | * | * | trans | 60.5 | 122.3 | 144 | -50.4 | -179.8 | 0 | 0 | 0 | 121.2 | ||||
| 202 | A | 40.4 | Very low | 47.1 | Very low | 91 Ų | 91 | 128 Ų | 128 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | -175.3 | 89.6 | 135.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 203 | L | 45.4 | Very low | 46.2 | Very low | 171 Ų | 171 | 126.8 Ų | 126.8 | 90% | 0.895 | 79% | 0.788 | S | S | * | * | 46.3 | 100 | 101 | -76.3 | 162.8 | 0 | 0 | 0 | 115.4 | |||||
| 204 | T | 39.7 | Very low | 45.9 | Very low | 139 Ų | 139 | 130.6 Ų | 130.6 | 85% | 0.853 | 80% | 0.795 | S | S | * | * | trans | -139.5 | 135.3 | 149 | 62.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 205 | P | 49.9 | Very low | 45.1 | Very low | 119 Ų | 119 | 137 Ų | 137 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -99.9 | 152.5 | -176.2 | 36.3 | -30 | 0 | 0 | 0 | 112.7 | ||||
| 206 | S | 40.2 | Very low | 44.4 | Very low | 114 Ų | 114 | 134.2 Ų | 134.2 | 80% | 0.797 | 80% | 0.798 | S | S | * | * | trans | 151 | 97.1 | 132.3 | -62.1 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 207 | L | 45.8 | Very low | 44.1 | Very low | 169 Ų | 169 | 130.2 Ų | 130.2 | 89% | 0.885 | 80% | 0.8 | S | S | * | * | 41.7 | 165.2 | 124.5 | -128.6 | 78.1 | 0 | 0 | 0 | 123.2 | |||||
| 208 | P | 52.6 | Low | 43.5 | Very low | 116 Ų | 116 | 131.9 Ų | 131.9 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | -123.4 | 169.1 | -76.3 | 37.8 | -22.2 | 0 | 0 | 0 | 114.3 | |||||
| 209 | G | 35.2 | Very low | 43.3 | Very low | 83 Ų | 83 | 134.7 Ų | 134.7 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | trans | 174.1 | 96.6 | 163.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 210 | L | 39.7 | Very low | 42.9 | Very low | 169 Ų | 169 | 132.7 Ų | 132.7 | 89% | 0.885 | 81% | 0.811 | S | S | * | * | trans | -82 | -178.3 | 169.2 | -81.8 | 157.3 | 0 | 0 | 0 | 110.9 | ||||
| 211 | P | 55.7 | Low | 42.9 | Very low | 113 Ų | 113 | 132 Ų | 132 | 73% | 0.734 | 81% | 0.809 | S | S | * | * | cis | -134.4 | 170.8 | -38.5 | 34 | -16.9 | 0 | 0 | 0 | 112.5 | ||||
| 212 | A | 35.4 | Very low | 43.1 | Very low | 102 Ų | 102 | 130.3 Ų | 130.3 | 84% | 0.843 | 81% | 0.807 | S | S | * | * | trans | -169 | 127.6 | 141.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 213 | S | 37.6 | Very low | 42.9 | Very low | 111 Ų | 111 | 136.9 Ų | 136.9 | 78% | 0.776 | 81% | 0.812 | S | S | * | * | trans | -85.3 | 136.9 | -178.2 | 173.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 214 | H | 45.9 | Very low | 42.5 | Very low | 172 Ų | 172 | 135.8 Ų | 135.8 | 80% | 0.796 | 81% | 0.807 | S | S | * | * | trans | 169 | 110.9 | 137.6 | 49.8 | -94.3 | 0 | 0 | 0 | 110.3 | ||||
| 215 | R | 40.3 | Very low | 42.3 | Very low | 255 Ų | 255 | 133.8 Ų | 133.8 | 96% | 0.962 | 80% | 0.799 | S | S | * | * | 70.9 | 121.8 | 83.6 | -158.3 | -177.3 | -165.4 | -161.6 | 4.5 | 115.7 | |||||
| 216 | G | 36.2 | Very low | 41.9 | Very low | 58 Ų | 58 | 133.5 Ų | 133.5 | 60% | 0.598 | 80% | 0.8 | S | S | * | * | trans | 118.5 | 107.5 | 150.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 217 | T | 42.4 | Very low | 42.5 | Very low | 145 Ų | 145 | 133.6 Ų | 133.6 | 89% | 0.89 | 80% | 0.798 | S | S | * | * | 84.1 | 138.1 | 74.7 | 47.3 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 218 | S | 38.7 | Very low | 42.2 | Very low | 108 Ų | 108 | 137.5 Ų | 137.5 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | trans | 87.7 | 110.9 | 157.1 | -114.8 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 219 | L | 46.8 | Very low | 41.8 | Very low | 172 Ų | 172 | 139.9 Ų | 139.9 | 90% | 0.901 | 81% | 0.806 | S | S | * | * | 76.6 | 118.5 | 76.8 | -167.6 | 75.2 | 0 | 0 | 0 | 111.6 | |||||
| 220 | G | 38.8 | Very low | 42.3 | Very low | 69 Ų | 69 | 143.5 Ų | 143.5 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | 179.1 | 76.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 221 | D | 44.1 | Very low | 42.6 | Very low | 138 Ų | 138 | 141.1 Ų | 141.1 | 74% | 0.738 | 80% | 0.801 | S | S | * | * | trans | -55.8 | 148.3 | 153.3 | -137.8 | -82.3 | 0 | 0 | 0 | 108.8 | R223 | D221-R223 PolarHBondContact OD1-N 3.4Š| ||
| 222 | P | 53.7 | Low | 41.9 | Very low | 122 Ų | 122 | 142.9 Ų | 142.9 | 79% | 0.792 | 80% | 0.803 | S | S | * | * | -145.4 | 125.5 | 121.3 | 30.1 | -11.8 | 0 | 0 | 0 | 114.3 | |||||
| 223 | R | 37.9 | Very low | 42.4 | Very low | 230 Ų | 230 | 144 Ų | 144 | 87% | 0.868 | 80% | 0.802 | S | S | * | * | trans | -71.1 | 124.2 | 141.6 | -64.8 | 164.6 | 67.6 | -159 | 3.1 | 108.7 | D221 | D221-R223 PolarHBondContact OD1-N 3.4Š| ||
| 224 | N | 35.4 | Very low | 42.6 | Very low | 147 Ų | 147 | 143.9 Ų | 143.9 | 79% | 0.786 | 80% | 0.801 | S | S | * | * | trans | -171.6 | 132.9 | 134 | -154.1 | 11.7 | 0 | 0 | 0 | 114.3 | ||||
| 225 | S | 36.8 | Very low | 42.3 | Very low | 98 Ų | 98 | 140.4 Ų | 140.4 | 69% | 0.685 | 80% | 0.802 | S | S | * | * | trans | 74.5 | 100.7 | 143.7 | -70.9 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 226 | S | 40.5 | Very low | 42.7 | Very low | 113 Ų | 113 | 134.2 Ų | 134.2 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -38.8 | -167.9 | 150.6 | -43.4 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 227 | P | 53.5 | Low | 43 | Very low | 115 Ų | 115 | 136 Ų | 136 | 75% | 0.747 | 81% | 0.807 | S | S | * | * | -128.4 | 159.5 | -64.6 | 34.8 | -17.9 | 0 | 0 | 0 | 111.2 | |||||
| 228 | R | 38.3 | Very low | 43.3 | Very low | 251 Ų | 251 | 134.2 Ų | 134.2 | 95% | 0.947 | 80% | 0.8 | S | S | * | * | trans | -136.1 | 119 | 160.4 | -86.1 | -168.3 | 162.5 | -109.3 | -1 | 111.5 | ||||
| 229 | L | 45.4 | Very low | 44.5 | Very low | 166 Ų | 166 | 134.6 Ų | 134.6 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | -66.3 | 137.4 | 171.3 | -61 | 167.3 | 0 | 0 | 0 | 109.3 | ||||
| 230 | N | 45 | Very low | 45.1 | Very low | 159 Ų | 159 | 132.5 Ų | 132.5 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | -137.4 | 145.1 | 156.2 | -92.6 | -16 | 0 | 0 | 0 | 109.9 | ||||
| 231 | P | 47 | Very low | 46.1 | Very low | 119 Ų | 119 | 137 Ų | 137 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | trans | -93.9 | 167.1 | -163.8 | 4.1 | 18.7 | 0 | 0 | 0 | 112.9 | ||||
| 232 | L | 40.2 | Very low | 47.1 | Very low | 150 Ų | 150 | 135.8 Ų | 135.8 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -29.6 | 156.1 | 169.5 | -107.7 | 73 | 0 | 0 | 0 | 116.1 | ||||
| 233 | P | 46.3 | Very low | 47.9 | Very low | 125 Ų | 125 | 135.4 Ų | 135.4 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | -125.5 | 137.7 | 116.8 | 34.1 | -26.9 | 0 | 0 | 0 | 113 | |||||
| 234 | S | 40.7 | Very low | 49.2 | Very low | 110 Ų | 110 | 130.5 Ų | 130.5 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -59.1 | 129.5 | 162.1 | -76.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 235 | A | 41 | Very low | 50.4 | Low | 99 Ų | 99 | 131.2 Ų | 131.2 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | -145.7 | 115.5 | 152.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | A237 | A235-A237 PolarHBondContact O-N 3.42Š| ||
| 236 | S | 47.3 | Very low | 51.3 | Low | 125 Ų | 125 | 132.1 Ų | 132.1 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -55.4 | 123.5 | 166.8 | 176.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 237 | A | 44.2 | Very low | 51.8 | Low | 94 Ų | 94 | 131.1 Ų | 131.1 | 78% | 0.777 | 80% | 0.804 | S | S | * | * | trans | -155.5 | 112.6 | 160.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | A235 | A235-A237 PolarHBondContact O-N 3.42Š| ||
| 238 | S | 48.8 | Very low | 51.5 | Low | 108 Ų | 108 | 132 Ų | 132 | 76% | 0.755 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 145.5 | 172.2 | -56.9 | 0 | 0 | 0 | 0 | 111.8 | ||
| 239 | P | 62.7 | Low | 51.8 | Low | 117 Ų | 117 | 125.7 Ų | 125.7 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 144.7 | 173.6 | 30.6 | -32.8 | 0 | 0 | 0 | 111 | ||
| 240 | P | 58.7 | Low | 51.8 | Low | 127 Ų | 127 | 128 Ų | 128 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 145.1 | 178 | 30.7 | -32.8 | 0 | 0 | 0 | 112.1 | ||
| 241 | L | 61.5 | Low | 51.6 | Low | 165 Ų | 165 | 125.6 Ų | 125.6 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 152 | 173.8 | -80.2 | 117.9 | 0 | 0 | 0 | 112.5 | ||
| 242 | P | 65.1 | Low | 51.9 | Low | 112 Ų | 112 | 125.6 Ų | 125.6 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 154.8 | 174.7 | 31.7 | -34.4 | 0 | 0 | 0 | 112.8 | ||
| 243 | P | 70.3 | Confident | 52.1 | Low | 114 Ų | 114 | 122.6 Ų | 122.6 | 74% | 0.74 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 153.8 | -179.6 | 31.1 | -35.1 | 0 | 0 | 0 | 112.8 | ||
| 244 | P | 65.6 | Low | 52.3 | Low | 126 Ų | 126 | 122.2 Ų | 122.2 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -76 | 143.1 | 178 | 31.3 | -33.5 | 0 | 0 | 0 | 112.1 | ||
| 245 | L | 59.5 | Low | 52.7 | Low | 162 Ų | 162 | 124.1 Ų | 124.1 | 85% | 0.848 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 148.5 | 175.3 | -61.7 | 173.9 | 0 | 0 | 0 | 111.3 | ||
| 246 | P | 56.5 | Low | 53.2 | Low | 117 Ų | 117 | 128 Ų | 128 | 76% | 0.76 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 139.3 | 180 | 28.8 | -33.8 | 0 | 0 | 0 | 112.1 | V248 | P246-V248 PolarHBondContact O-N 3.11Š|
| 247 | A | 49.8 | Very low | 52.9 | Low | 92 Ų | 92 | 128.3 Ų | 128.3 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 123.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | C249 | A247-C249 PolarHBondContact O-N 2.89Š|
| 248 | V | 47.1 | Very low | 53 | Low | 134 Ų | 134 | 130.7 Ų | 130.7 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -76.4 | 103.5 | 167.4 | -72.4 | 0 | 0 | 0 | 0 | 108.6 | P246 F250 | P246-V248 PolarHBondContact O-N 3.11Å; V248-F250 PolarHBondContact O-N 3.09Å | ||
| 249 | C | 45.9 | Very low | 52.9 | Low | 119 Ų | 119 | 130.7 Ų | 130.7 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | -66.6 | 111.9 | 168.8 | -63.8 | 0 | 0 | 0 | 0 | 108.9 | A247 S251 | A247-C249 PolarHBondContact O-N 2.89Å; C249-S251 PolarHBondContact O-N 3.05Å; C249-S251 VanDerWaalsContact O-N 3.08Å | ||
| 250 | F | 44.6 | Very low | 52.1 | Low | 214 Ų | 214 | 130.1 Ų | 130.1 | 94% | 0.939 | 80% | 0.797 | S | S | * | * | trans | -71.1 | 94.8 | 163.4 | -114.2 | -93.9 | 0 | 0 | 0 | 107.8 | V248 | V248-F250 PolarHBondContact O-N 3.09Š| ||
| 251 | S | 40.6 | Very low | 51.5 | Low | 109 Ų | 109 | 127.8 Ų | 127.8 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | trans | -100.1 | 109.9 | 168.8 | -161.4 | 0 | 0 | 0 | 0 | 108.8 | C249 | C249-S251 PolarHBondContact O-N 3.05Å; C249-S251 VanDerWaalsContact O-N 3.08Å | ||
| 252 | S | 53.9 | Low | 50.9 | Low | 118 Ų | 118 | 130.7 Ų | 130.7 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | trans | -71.2 | 126.6 | 166.5 | 178.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 253 | A | 44.3 | Very low | 50.1 | Low | 87 Ų | 87 | 133.8 Ų | 133.8 | 72% | 0.719 | 80% | 0.801 | S | S | * | * | trans | -151.6 | 150.5 | 158.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 254 | P | 49.6 | Very low | 49.1 | Very low | 117 Ų | 117 | 136.1 Ų | 136.1 | 76% | 0.76 | 81% | 0.807 | S | S | * | * | trans | -103.8 | 159.1 | -154.5 | 36.5 | -26.1 | 0 | 0 | 0 | 114.5 | ||||
| 255 | L | 49.6 | Very low | 47.8 | Very low | 151 Ų | 151 | 133.4 Ų | 133.4 | 79% | 0.791 | 80% | 0.802 | S | S | * | * | trans | 34.2 | 107 | 139.3 | -146 | 169.5 | 0 | 0 | 0 | 117.5 | ||||
| 256 | L | 51.8 | Low | 47.6 | Very low | 179 Ų | 179 | 131.7 Ų | 131.7 | 94% | 0.937 | 80% | 0.803 | S | S | * | * | trans | -133.6 | 131.8 | 146.7 | -75.6 | -179 | 0 | 0 | 0 | 110.9 | ||||
| 257 | D | 41.8 | Very low | 47 | Very low | 133 Ų | 133 | 131.7 Ų | 131.7 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | trans | -75.7 | 137.4 | 175 | 177 | 42.6 | 0 | 0 | 0 | 111 | ||||
| 258 | L | 44.4 | Very low | 47.1 | Very low | 144 Ų | 144 | 131.9 Ų | 131.9 | 75% | 0.754 | 81% | 0.808 | S | S | * | * | trans | 165.2 | 166.7 | 137.6 | -118 | 77.5 | 0 | 0 | 0 | 113.2 | ||||
| 259 | P | 48.6 | Very low | 47 | Very low | 107 Ų | 107 | 134.8 Ų | 134.8 | 70% | 0.695 | 81% | 0.81 | S | S | * | * | -124.3 | 175.6 | -104.9 | 40.8 | -22.8 | 0 | 0 | 0 | 115 | |||||
| 260 | A | 46.1 | Very low | 47.2 | Very low | 106 Ų | 106 | 138 Ų | 138 | 88% | 0.876 | 81% | 0.813 | S | S | * | * | trans | 35.4 | 116.4 | 149.2 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 261 | G | 45.5 | Very low | 47.6 | Very low | 78 Ų | 78 | 133 Ų | 133 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | 120.6 | 81.2 | 143 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 262 | Y | 48.6 | Very low | 47.9 | Very low | 226 Ų | 226 | 138.9 Ų | 138.9 | 89% | 0.886 | 81% | 0.809 | S | S | * | * | trans | -152.7 | 115.6 | 137.3 | 66.2 | -82 | 0 | 0 | 0 | 109.8 | ||||
| 263 | E | 48.7 | Very low | 47.7 | Very low | 177 Ų | 177 | 137.3 Ų | 137.3 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | -70.7 | 161.9 | 161.7 | -86 | -79.1 | 141 | 0 | 0 | 110 | ||||
| 264 | L | 49.7 | Very low | 47.9 | Very low | 162 Ų | 162 | 145.2 Ų | 145.2 | 85% | 0.848 | 81% | 0.81 | S | S | * | * | trans | 89.7 | 104.2 | 160.8 | -130.1 | 72 | 0 | 0 | 0 | 118.2 | ||||
| 265 | G | 38.2 | Very low | 48 | Very low | 70 Ų | 70 | 146.3 Ų | 146.3 | 72% | 0.722 | 81% | 0.809 | S | S | * | * | trans | 179.7 | 73.5 | 165.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | S267 | G265-S267 PolarHBondContact O-N 3.16Å; G265-S267 VanDerWaalsContact O-N 3.07Å | ||
| 266 | S | 53.8 | Low | 47.8 | Very low | 126 Ų | 126 | 147.2 Ų | 147.2 | 88% | 0.881 | 81% | 0.809 | S | S | * | * | trans | -44.6 | 109.6 | 173.4 | -54.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 267 | S | 45.1 | Very low | 47.3 | Very low | 116 Ų | 116 | 150.8 Ų | 150.8 | 81% | 0.811 | 81% | 0.81 | S | S | * | * | trans | -97.2 | 116.9 | 172.4 | -173.3 | 0 | 0 | 0 | 0 | 109.9 | G265 F269 | G265-S267 PolarHBondContact O-N 3.16Å; G265-S267 VanDerWaalsContact O-N 3.07Å; S267-F269 VanDerWaalsContact C-N 3.31Å; S267-F269 PolarHBondContact O-N 3.45Å | ||
| 268 | A | 52.1 | Low | 47.6 | Very low | 97 Ų | 97 | 152.6 Ų | 152.6 | 80% | 0.802 | 81% | 0.811 | S | S | * | * | trans | -75.8 | 63.3 | -169.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 269 | F | 43.6 | Very low | 47.5 | Very low | 195 Ų | 195 | 152.5 Ų | 152.5 | 86% | 0.855 | 82% | 0.816 | S | S | * | * | trans | -142.1 | 74.2 | 167.1 | -121.8 | -93.5 | 0 | 0 | 0 | 110.3 | S267 | S267-F269 VanDerWaalsContact C-N 3.31Å; S267-F269 PolarHBondContact O-N 3.45Å | ||
| 270 | E | 50.7 | Low | 47.1 | Very low | 185 Ų | 185 | 150.6 Ų | 150.6 | 86% | 0.864 | 82% | 0.816 | S | S | * | * | trans | -66.5 | 126.1 | 159.7 | -91.3 | -162 | 120.7 | 0 | 0 | 108.9 | Y272 | E270-Y272 PolarHBondContact O-N 2.69Š| ||
| 271 | P | 52.5 | Low | 46.8 | Very low | 111 Ų | 111 | 151.3 Ų | 151.3 | 72% | 0.721 | 82% | 0.815 | S | S | * | * | trans | -74.2 | 125.9 | 171.4 | 30.6 | -29.1 | 0 | 0 | 0 | 107.8 | S273 | P271-S273 PolarHBondContact O-N 3.1Š| ||
| 272 | Y | 46.8 | Very low | 46.7 | Very low | 231 Ų | 231 | 152.6 Ų | 152.6 | 91% | 0.906 | 82% | 0.817 | S | S | * | * | trans | -54.5 | 100.6 | 171.5 | -101.2 | -90.3 | 0 | 0 | 0 | 110.3 | E270 W274 | E270-Y272 PolarHBondContact O-N 2.69Å; Y272-W274 PolarHBondContact O-N 3.31Å | ||
| 273 | S | 50 | Low | 46.2 | Very low | 85 Ų | 85 | 145.2 Ų | 145.2 | 59% | 0.594 | 81% | 0.81 | S | S | * | * | trans | -63.2 | 115.2 | 159.9 | 49.1 | 0 | 0 | 0 | 0 | 107.9 | P271 L275 | P271-S273 PolarHBondContact O-N 3.1Å; S273-L275 VanDerWaalsContact C-N 3.3Å; S273-L275 PolarHBondContact O-N 2.75Å; S273-L275 WeakPolarHBondContact OG-CD1 3.27Å | ||
| 274 | W | 48.1 | Very low | 45.9 | Very low | 253 Ų | 253 | 143.3 Ų | 143.3 | 96% | 0.958 | 82% | 0.816 | S | S | * | * | trans | -59.9 | 94.3 | 163.6 | -101.2 | 69.4 | 0 | 0 | 0 | 108.2 | Y272 E276 | Y272-W274 PolarHBondContact O-N 3.31Å; W274-E276 PolarHBondContact O-N 3.5Å | ||
| 275 | L | 51.5 | Low | 45.5 | Very low | 141 Ų | 141 | 139.1 Ų | 139.1 | 74% | 0.738 | 81% | 0.812 | S | S | * | * | trans | -68.9 | 120.2 | 171.8 | -99.2 | 76.8 | 0 | 0 | 0 | 109.3 | S273 R277 | S273-L275 VanDerWaalsContact C-N 3.3Å; S273-L275 PolarHBondContact O-N 2.75Å; S273-L275 WeakPolarHBondContact OG-CD1 3.27Å; L275-R277 PolarHBondContact O-N 3.37Å | ||
| 276 | E | 45.6 | Very low | 46.1 | Very low | 169 Ų | 169 | 145.6 Ų | 145.6 | 79% | 0.79 | 82% | 0.82 | S | S | * | * | trans | -35.9 | 127.4 | 154.6 | -78.5 | -131.1 | 102.3 | 0 | 0 | 111.9 | W274 | W274-E276 PolarHBondContact O-N 3.5Š| ||
| 277 | R | 41.7 | Very low | 45.6 | Very low | 254 Ų | 254 | 149.1 Ų | 149.1 | 96% | 0.958 | 82% | 0.82 | S | S | * | * | trans | -105 | 91.3 | 158.6 | -163.2 | -178.7 | -62.1 | -129.3 | 0.7 | 107.6 | L275 | L275-R277 PolarHBondContact O-N 3.37Š| ||
| 278 | K | 49 | Very low | 45.8 | Very low | 172 Ų | 172 | 148 Ų | 148 | 75% | 0.748 | 82% | 0.818 | S | S | * | * | trans | -122.3 | 109.8 | 166.2 | -171.3 | 142.7 | -177.9 | 174.8 | 0 | 110.8 | ||||
| 279 | V | 42.6 | Very low | 45.2 | Very low | 142 Ų | 142 | 151 Ų | 151 | 86% | 0.861 | 82% | 0.821 | S | S | * | * | trans | -145.8 | 105.1 | 153.9 | 167.5 | 0 | 0 | 0 | 0 | 102.4 | ||||
| 280 | G | 39.7 | Very low | 45.8 | Very low | 66 Ų | 66 | 151.2 Ų | 151.2 | 68% | 0.68 | 84% | 0.838 | S | S | * | * | 69.2 | 127.2 | 75 | 0 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 281 | S | 39.4 | Very low | 45.5 | Very low | 122 Ų | 122 | 149.5 Ų | 149.5 | 85% | 0.853 | 84% | 0.837 | S | S | * | * | cis | -176.3 | 170.1 | 18 | -177.8 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 282 | A | 43.8 | Very low | 45.1 | Very low | 104 Ų | 104 | 151.5 Ų | 151.5 | 86% | 0.86 | 84% | 0.843 | S | S | * | * | trans | 75.7 | 133.6 | 168 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 283 | G | 38.1 | Very low | 45 | Very low | 71 Ų | 71 | 147.1 Ų | 147.1 | 73% | 0.732 | 84% | 0.839 | S | S | * | * | cis | 153.1 | 132.2 | 5.6 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 284 | S | 41.9 | Very low | 44.7 | Very low | 137 Ų | 137 | 150.8 Ų | 150.8 | 96% | 0.958 | 85% | 0.854 | S | S | * | * | trans | 62.7 | 131 | 154.3 | -154.8 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 285 | G | 40.8 | Very low | 44.5 | Very low | 74 Ų | 74 | 144.4 Ų | 144.4 | 76% | 0.763 | 85% | 0.847 | S | S | * | * | trans | 154.5 | 66.9 | 155.9 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 286 | K | 50.4 | Low | 44.1 | Very low | 206 Ų | 206 | 144.6 Ų | 144.6 | 90% | 0.896 | 85% | 0.854 | S | S | * | * | trans | -59 | 129.8 | 158.2 | -69.9 | 160.3 | 119.8 | 178.6 | 0 | 110.2 | ||||
| 287 | K | 43.3 | Very low | 44 | Very low | 200 Ų | 200 | 142.9 Ų | 142.9 | 87% | 0.87 | 86% | 0.859 | S | S | * | * | trans | -158.6 | 110.8 | 141.4 | -61.9 | -164 | 179.3 | 179 | 0 | 106.3 | ||||
| 288 | A | 50.6 | Low | 44.1 | Very low | 94 Ų | 94 | 134.3 Ų | 134.3 | 78% | 0.777 | 85% | 0.851 | S | S | * | * | 59.3 | 105.1 | 67.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 289 | N | 39.4 | Very low | 43.7 | Very low | 160 Ų | 160 | 131.2 Ų | 131.2 | 86% | 0.856 | 86% | 0.86 | S | S | * | * | trans | 41.7 | 108.1 | 134.4 | -158.1 | 44.7 | 0 | 0 | 0 | 118.6 | ||||
| 290 | T | 54.8 | Low | 43.8 | Very low | 198 Ų | 198 | 130.2 Ų | 130.2 | 100% | 1.215 | 86% | 0.86 | S | S | * | * | -166.2 | 0 | 105 | -149.3 | 0 | 0 | 0 | 0 | 110.6 |
Retrieved 290 of 290 residues in 220.8 ms
(Link to these results)