| 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 | 44.7 | Very low | 47.9 | Very low | 244 Ų | 244 | 144.2 Ų | 144.2 | 100% | 1.202 | 88% | 0.878 | S | S | * | * | 0 | 109.5 | 0 | -54.8 | -180 | 91 | 0 | 0 | 105.4 | |||||
| 2 | C | 37.1 | Very low | 47.3 | Very low | 141 Ų | 141 | 146.8 Ų | 146.8 | 95% | 0.953 | 88% | 0.883 | S | S | * | * | trans | -89.8 | 149.8 | -165.7 | -65.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 3 | S | 52.8 | Low | 47 | Very low | 126 Ų | 126 | 140.9 Ų | 140.9 | 88% | 0.881 | 87% | 0.871 | S | S | * | * | trans | -108.1 | 133.3 | -180 | -176.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 4 | A | 51.4 | Low | 46.8 | Very low | 100 Ų | 100 | 136.9 Ų | 136.9 | 83% | 0.826 | 87% | 0.87 | S | S | * | * | trans | 179.7 | 137.5 | 163 | 0 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 5 | G | 46.8 | Very low | 46.2 | Very low | 69 Ų | 69 | 138.8 Ų | 138.8 | 71% | 0.711 | 86% | 0.864 | S | S | * | * | cis | 101.7 | 90.4 | 35.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 6 | E | 52.6 | Low | 46.4 | Very low | 182 Ų | 182 | 143.2 Ų | 143.2 | 85% | 0.85 | 86% | 0.859 | S | S | * | * | trans | -172 | 113.7 | 166.1 | -102.6 | 170.6 | 101.8 | 0 | 0 | 104.6 | ||||
| 7 | L | 49.8 | Very low | 46.2 | Very low | 169 Ų | 169 | 141.5 Ų | 141.5 | 89% | 0.885 | 85% | 0.845 | S | S | * | * | cis | 48 | 107.9 | 32.7 | -96.8 | 178.7 | 0 | 0 | 0 | 113.7 | ||||
| 8 | L | 50.5 | Low | 46.7 | Very low | 156 Ų | 156 | 142.7 Ų | 142.7 | 82% | 0.817 | 84% | 0.84 | S | S | * | * | trans | 158.7 | 122.1 | 150.7 | -83.3 | 172.7 | 0 | 0 | 0 | 105.6 | ||||
| 9 | R | 47.7 | Very low | 46.6 | Very low | 242 Ų | 242 | 143 Ų | 143 | 91% | 0.913 | 84% | 0.838 | S | S | * | * | 172.8 | 113.6 | 69.2 | 171.6 | 168.3 | 150.3 | 151.4 | -5.6 | 106.3 | |||||
| 10 | G | 46.1 | Very low | 46.6 | Very low | 84 Ų | 84 | 139.1 Ų | 139.1 | 87% | 0.866 | 83% | 0.829 | S | S | * | * | 89.5 | 135 | 92.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 11 | G | 47.9 | Very low | 46.4 | Very low | 73 Ų | 73 | 140.1 Ų | 140.1 | 75% | 0.753 | 83% | 0.831 | S | S | * | * | cis | -156.3 | 144.2 | -2.4 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 12 | D | 40.5 | Very low | 46.5 | Very low | 176 Ų | 176 | 133.4 Ų | 133.4 | 94% | 0.941 | 81% | 0.814 | S | S | * | * | 43.4 | 118.9 | 95.8 | -154.9 | 64.5 | 0 | 0 | 0 | 116.5 | |||||
| 13 | G | 43.2 | Very low | 46.9 | Very low | 70 Ų | 70 | 134.5 Ų | 134.5 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | 113.7 | 110.1 | 139.5 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 14 | G | 43.7 | Very low | 46.4 | Very low | 84 Ų | 84 | 132.9 Ų | 132.9 | 87% | 0.866 | 80% | 0.804 | S | S | * | * | 114.6 | 102.4 | 126.4 | 0 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 15 | E | 38.9 | Very low | 46 | Very low | 166 Ų | 166 | 135.7 Ų | 135.7 | 78% | 0.776 | 80% | 0.8 | S | S | * | * | trans | -67.8 | 154.3 | 161.7 | -68.8 | 160.4 | 73.4 | 0 | 0 | 113 | ||||
| 16 | R | 48 | Very low | 45.9 | Very low | 209 Ų | 209 | 140.2 Ų | 140.2 | 79% | 0.789 | 80% | 0.802 | S | S | * | * | trans | 62 | 139.1 | 142.2 | -95.6 | -177.9 | -170.3 | 150.4 | 2.9 | 118.5 | ||||
| 17 | D | 44.5 | Very low | 45.2 | Very low | 114 Ų | 114 | 136.3 Ų | 136.3 | 61% | 0.61 | 80% | 0.802 | S | S | * | * | -171.5 | 156.1 | 53.3 | -97.1 | -37.3 | 0 | 0 | 0 | 111.8 | |||||
| 18 | E | 53.7 | Low | 44.8 | Very low | 164 Ų | 164 | 133.3 Ų | 133.3 | 77% | 0.766 | 80% | 0.801 | S | S | * | * | trans | 59.8 | 148 | 137.7 | -61 | 171.3 | 137.7 | 0 | 0 | 119.2 | ||||
| 19 | D | 45.7 | Very low | 44.4 | Very low | 148 Ų | 148 | 131.3 Ų | 131.3 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | cis | -168.3 | 145.1 | 5.6 | -128.4 | -36.1 | 0 | 0 | 0 | 103.5 | ||||
| 20 | G | 46.9 | Very low | 44 | Very low | 65 Ų | 65 | 123.2 Ų | 123.2 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | 100.7 | 111 | 94.1 | 0 | 0 | 0 | 0 | 0 | 114 | |||||
| 21 | D | 42.4 | Very low | 43.8 | Very low | 161 Ų | 161 | 125.4 Ų | 125.4 | 86% | 0.861 | 80% | 0.796 | S | S | * | * | trans | 62.7 | 119.7 | 148.9 | -93.6 | -34.7 | 0 | 0 | 0 | 123.8 | ||||
| 22 | A | 47.1 | Very low | 43.8 | Very low | 103 Ų | 103 | 130.2 Ų | 130.2 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | -171.8 | 106.6 | 121.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 23 | L | 44.4 | Very low | 43.7 | Very low | 164 Ų | 164 | 133.4 Ų | 133.4 | 86% | 0.859 | 80% | 0.797 | S | S | * | * | trans | -75 | 165.3 | 164 | -97.6 | 159.7 | 0 | 0 | 0 | 112 | ||||
| 24 | A | 43.2 | Very low | 43.7 | Very low | 92 Ų | 92 | 137.3 Ų | 137.3 | 76% | 0.76 | 80% | 0.802 | S | S | * | * | trans | 89.6 | 131.4 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 25 | E | 42.7 | Very low | 44 | Very low | 159 Ų | 159 | 138.9 Ų | 138.9 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | cis | -176.3 | 131.7 | 32.9 | -157.7 | -172.2 | 88.2 | 0 | 0 | 104.8 | ||||
| 26 | Q | 44.3 | Very low | 43.9 | Very low | 163 Ų | 163 | 140.1 Ų | 140.1 | 76% | 0.762 | 80% | 0.802 | S | S | * | * | 160.4 | 117.1 | 96.2 | -80.2 | 178 | 2.1 | 0 | 0 | 105.1 | |||||
| 27 | A | 37.8 | Very low | 43.4 | Very low | 101 Ų | 101 | 134.2 Ų | 134.2 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | 77.6 | 110.7 | 69.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 28 | A | 41.7 | Very low | 43.7 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | trans | 91.1 | 100.2 | 139.1 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 29 | A | 41.9 | Very low | 43.5 | Very low | 113 Ų | 113 | 131.6 Ų | 131.6 | 93% | 0.934 | 81% | 0.805 | S | S | * | * | 179.4 | 128.5 | 127 | 0 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 30 | G | 39.2 | Very low | 43.3 | Very low | 72 Ų | 72 | 134.7 Ų | 134.7 | 74% | 0.742 | 81% | 0.805 | S | S | * | * | cis | 158.1 | 125.7 | 4.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 31 | T | 42.1 | Very low | 43 | Very low | 131 Ų | 131 | 140.6 Ų | 140.6 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | 74.7 | 118.5 | 153.4 | -70.2 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 32 | E | 47.2 | Very low | 43 | Very low | 174 Ų | 174 | 142.1 Ų | 142.1 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | trans | -43.1 | 146.4 | 160.8 | -56.1 | 166.8 | 90.4 | 0 | 0 | 116.6 | ||||
| 33 | R | 38.7 | Very low | 42.6 | Very low | 242 Ų | 242 | 141.3 Ų | 141.3 | 91% | 0.913 | 80% | 0.802 | S | S | * | * | trans | 174.5 | 105.7 | 131.7 | -98.1 | -174.7 | -84.5 | 167.4 | -8 | 112.9 | ||||
| 34 | D | 43.4 | Very low | 42.5 | Very low | 153 Ų | 153 | 141.1 Ų | 141.1 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -79.9 | 162.8 | 137.2 | -105.5 | -57.5 | 0 | 0 | 0 | 107.3 | ||||
| 35 | P | 49.6 | Very low | 42.1 | Very low | 116 Ų | 116 | 148.1 Ų | 148.1 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | cis | -144 | 149.1 | 24.7 | 38 | -17.7 | 0 | 0 | 0 | 115.6 | ||||
| 36 | E | 37 | Very low | 42.2 | Very low | 193 Ų | 193 | 145.6 Ų | 145.6 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | trans | -145.4 | 103.1 | 167.6 | -150.9 | 167.7 | 102.5 | 0 | 0 | 116.4 | ||||
| 37 | A | 39.1 | Very low | 42 | Very low | 85 Ų | 85 | 147.9 Ų | 147.9 | 70% | 0.702 | 81% | 0.809 | S | S | * | * | trans | 55.7 | 102.8 | 135 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 38 | S | 50.5 | Low | 42 | Very low | 116 Ų | 116 | 151 Ų | 151 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -66.8 | 136.4 | 135.3 | 179.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 39 | P | 48.8 | Very low | 41.9 | Very low | 107 Ų | 107 | 152.2 Ų | 152.2 | 70% | 0.695 | 80% | 0.798 | S | S | * | * | -148.5 | 132.5 | 115.2 | 32.6 | -13.4 | 0 | 0 | 0 | 115.8 | |||||
| 40 | R | 40.8 | Very low | 41.6 | Very low | 212 Ų | 212 | 155.6 Ų | 155.6 | 80% | 0.8 | 79% | 0.794 | S | S | * | * | 44.2 | 126.1 | 127.5 | -67.2 | -163.1 | 170.6 | 173.4 | 0.5 | 121.2 | |||||
| 41 | R | 41.8 | Very low | 41.4 | Very low | 190 Ų | 190 | 160.7 Ų | 160.7 | 72% | 0.717 | 80% | 0.799 | S | S | * | * | 98.2 | 113.9 | 125.3 | -91.2 | -167.4 | -178.2 | -171.2 | 3.3 | 119.3 | |||||
| 42 | R | 41.8 | Very low | 41 | Very low | 192 Ų | 192 | 161.9 Ų | 161.9 | 73% | 0.725 | 80% | 0.8 | S | S | * | * | 92.3 | 99.2 | 116.2 | -155.8 | -177.1 | -138.6 | -178.3 | 3.7 | 116.6 | |||||
| 43 | G | 38 | Very low | 40.8 | Very low | 86 Ų | 86 | 159.6 Ų | 159.6 | 89% | 0.887 | 80% | 0.798 | S | S | * | * | trans | -139.1 | 81.3 | 158.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 44 | Q | 42.9 | Very low | 40.8 | Very low | 161 Ų | 161 | 156.3 Ų | 156.3 | 75% | 0.752 | 79% | 0.793 | S | S | * | * | trans | -78.3 | 129.5 | -177.4 | -176 | 170.5 | -13.3 | 0 | 0 | 110.2 | ||||
| 45 | R | 35.1 | Very low | 40.4 | Very low | 239 Ų | 239 | 156.7 Ų | 156.7 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | trans | -133.3 | 139.3 | 154.4 | -112.4 | -134.8 | -169.6 | -171.4 | 5.4 | 110.6 | ||||
| 46 | P | 45.1 | Very low | 40.2 | Very low | 105 Ų | 105 | 155.9 Ų | 155.9 | 68% | 0.682 | 79% | 0.792 | S | S | * | * | trans | -91.5 | 136.3 | -166.9 | 34.4 | -27.1 | 0 | 0 | 0 | 110.8 | ||||
| 47 | K | 39.3 | Very low | 40.2 | Very low | 212 Ų | 212 | 154.2 Ų | 154.2 | 92% | 0.922 | 78% | 0.784 | S | S | * | * | trans | -118.6 | 108.1 | 151.2 | -78.6 | -164.5 | 172.9 | -179.9 | 0 | 107.2 | ||||
| 48 | E | 38.7 | Very low | 40.2 | Very low | 165 Ų | 165 | 157.7 Ų | 157.7 | 77% | 0.771 | 79% | 0.791 | S | S | * | * | trans | -56.6 | 147.5 | 162.9 | -87.3 | 167 | 95.8 | 0 | 0 | 110.7 | ||||
| 49 | N | 38.4 | Very low | 39.5 | Very low | 132 Ų | 132 | 158.8 Ų | 158.8 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | trans | 64.6 | 103.7 | 157.5 | -60.4 | -22.3 | 0 | 0 | 0 | 116.7 | ||||
| 50 | E | 35.4 | Very low | 38.8 | Very low | 184 Ų | 184 | 160.2 Ų | 160.2 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | -171.3 | 116.1 | 106.8 | -98.6 | 161.6 | 77.9 | 0 | 0 | 109.5 | D52 | E50-D52 PolarHBondContact O-N 3.14Š| |||
| 51 | Q | 36.3 | Very low | 38.7 | Very low | 179 Ų | 179 | 152.9 Ų | 152.9 | 84% | 0.836 | 78% | 0.781 | S | S | * | * | trans | 9.5 | 89.1 | 154.4 | -68.3 | 164.3 | -9.2 | 0 | 0 | 117 | ||||
| 52 | D | 34.1 | Very low | 38.5 | Very low | 157 Ų | 157 | 152.4 Ų | 152.4 | 84% | 0.84 | 79% | 0.787 | S | S | * | * | trans | -121.1 | 79.1 | 162 | -158.9 | -87.5 | 0 | 0 | 0 | 107.2 | E50 | E50-D52 PolarHBondContact O-N 3.14Š| ||
| 53 | V | 42.1 | Very low | 39.1 | Very low | 126 Ų | 126 | 148.1 Ų | 148.1 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -146.1 | 94.7 | 163.9 | -176 | 0 | 0 | 0 | 0 | 108.4 | ||
| 54 | E | 38.1 | Very low | 39.4 | Very low | 172 Ų | 172 | 151.1 Ų | 151.1 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | 74.1 | 69.1 | 143 | -57.8 | -173.3 | 105.1 | 0 | 0 | 118.4 | ||||
| 55 | D | 36 | Very low | 39.4 | Very low | 161 Ų | 161 | 144.5 Ų | 144.5 | 86% | 0.861 | 76% | 0.759 | S | S | * | * | trans | -90.1 | 71.6 | 147.2 | -145.7 | -61.5 | 0 | 0 | 0 | 108.8 | ||||
| 56 | S | 44.9 | Very low | 39.9 | Very low | 99 Ų | 99 | 138.7 Ų | 138.7 | 69% | 0.692 | 75% | 0.746 | S | S | * | * | trans | -174.4 | 95.7 | 164.2 | -93.8 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 57 | Q | 36.3 | Very low | 40.2 | Very low | 159 Ų | 159 | 139.3 Ų | 139.3 | 74% | 0.743 | 74% | 0.744 | S | S | * | * | -167 | 89.8 | 124.3 | -109.6 | 177.6 | -22.1 | 0 | 0 | 110.4 | H59 | Q57-H59 VanDerWaalsContact CD-CD2 3.41Å; Q57-H59 VanDerWaalsContact CG-CD2 3.44Å; Q57-H59 WeakPolarHBondContact CG-CD2 3.44Å; Q57-H59 PolarHBondContact NE2-CD2 3.16Å; Q57-H59 PolarHBondContact NE2-NE2 3.37Å; Q57-H59 PolarHBondContact O-N 3.01Å; Q57-H59 VanDerWaalsContact O-N 3.14Å | |||
| 58 | N | 38.8 | Very low | 40.2 | Very low | 158 Ų | 158 | 137.8 Ų | 137.8 | 85% | 0.845 | 73% | 0.733 | S | S | * | * | trans | -63.8 | 98.9 | 148 | -81 | -84.6 | 0 | 0 | 0 | 107.9 | ||||
| 59 | H | 37.2 | Very low | 40.6 | Very low | 139 Ų | 139 | 137.1 Ų | 137.1 | 64% | 0.644 | 73% | 0.728 | S | S | * | * | trans | -121.5 | 92.2 | 157.9 | -81.9 | -62.2 | 0 | 0 | 0 | 109.6 | Q57 | Q57-H59 VanDerWaalsContact CD-CD2 3.41Å; Q57-H59 VanDerWaalsContact CG-CD2 3.44Å; Q57-H59 WeakPolarHBondContact CG-CD2 3.44Å; Q57-H59 PolarHBondContact NE2-CD2 3.16Å; Q57-H59 PolarHBondContact NE2-NE2 3.37Å; Q57-H59 PolarHBondContact O-N 3.01Å; Q57-H59 VanDerWaalsContact O-N 3.14Å | ||
| 60 | T | 34.4 | Very low | 41.1 | Very low | 136 Ų | 136 | 137.8 Ų | 137.8 | 83% | 0.834 | 73% | 0.725 | S | S | * | * | 13.2 | 125.7 | 126.2 | -51.1 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 61 | G | 38 | Very low | 41.7 | Very low | 59 Ų | 59 | 134.8 Ų | 134.8 | 61% | 0.608 | 71% | 0.712 | S | S | * | * | trans | 114.6 | 102.5 | 137.1 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 62 | E | 37.4 | Very low | 42.5 | Very low | 180 Ų | 180 | 128.5 Ų | 128.5 | 84% | 0.841 | 70% | 0.695 | S | S | * | * | trans | 82.9 | 147.3 | 142.5 | -65.9 | -116.7 | 84.3 | 0 | 0 | 120.7 | ||||
| 63 | P | 55.2 | Low | 43.6 | Very low | 102 Ų | 102 | 126 Ų | 126 | 66% | 0.662 | 69% | 0.686 | S | S | * | * | trans | -95.1 | 177.5 | -157.2 | 38.7 | -30.1 | 0 | 0 | 0 | 111.2 | ||||
| 64 | V | 44.5 | Very low | 44.4 | Very low | 148 Ų | 148 | 125 Ų | 125 | 90% | 0.897 | 68% | 0.676 | S | S | * | * | S | Bend | trans | 96.1 | 72.1 | 178.6 | -166.6 | 0 | 0 | 0 | 0 | 113.8 | ||
| 65 | G | 43 | Very low | 45.5 | Very low | 22 Ų | 22 | 120.5 Ų | 120.5 | 23% | 0.227 | 65% | 0.653 | C | S | . | * | trans | 171.5 | 41.7 | 169.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y68 | G65-Y68 WeakPolarHBondContact CA-OH 3.38Å; G65-Y68 VanDerWaalsContact O-CE2 3.24Å; G65-Y68 WeakPolarHBondContact O-CE2 3.24Å | ||
| 66 | D | 45.3 | Very low | 46.5 | Very low | 117 Ų | 117 | 114.7 Ų | 114.7 | 63% | 0.626 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -73 | -38.2 | -144.9 | -156.9 | -10.5 | 0 | 0 | 0 | 115.7 | K70 | D66-K70 WeakPolarHBondContact O-CB 3.36Å; D66-K70 PolarHBondContact O-N 3Å |
| 67 | D | 51 | Low | 47.3 | Very low | 119 Ų | 119 | 116.3 Ų | 116.3 | 64% | 0.636 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -78.8 | -37.1 | -165.9 | -72.9 | -49.3 | 0 | 0 | 0 | 115.2 | M71 | D67-M71 VanDerWaalsContact O-CG 3.28Å; D67-M71 WeakPolarHBondContact O-CG 3.48Å; D67-M71 PolarHBondContact O-N 3.26Å |
| 68 | Y | 40 | Very low | 48.6 | Very low | 179 Ų | 179 | 112.2 Ų | 112.2 | 70% | 0.702 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -78.9 | -28.6 | -179 | 38.9 | -94.1 | 0 | 0 | 0 | 112.9 | G65 | G65-Y68 WeakPolarHBondContact CA-OH 3.38Å; G65-Y68 VanDerWaalsContact O-CE2 3.24Å; G65-Y68 WeakPolarHBondContact O-CE2 3.24Å |
| 69 | K | 46.7 | Very low | 49.6 | Very low | 151 Ų | 151 | 107 Ų | 107 | 66% | 0.657 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -74.9 | -31.1 | 178.9 | -154.6 | 178.7 | -179.8 | -168.4 | 0 | 111.6 | G72 | K69-G72 PolarHBondContact O-N 3.35Å |
| 70 | K | 48 | Very low | 50.7 | Low | 147 Ų | 147 | 108 Ų | 108 | 64% | 0.639 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -76.5 | -26.5 | 177.9 | -158.1 | 169.3 | -175.1 | -69.2 | 0 | 113.3 | D66 G72 | D66-K70 WeakPolarHBondContact O-CB 3.36Å; D66-K70 PolarHBondContact O-N 3Å; K70-G72 VanDerWaalsContact C-N 3.35Å |
| 71 | M | 49 | Very low | 51.8 | Low | 121 Ų | 121 | 106.3 Ų | 106.3 | 60% | 0.596 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -76 | -21.3 | 173.7 | -67 | 175 | -169.6 | 0 | 0 | 113.2 | D67 T73 L74 F75 | D67-M71 VanDerWaalsContact O-CG 3.28Å; D67-M71 WeakPolarHBondContact O-CG 3.48Å; D67-M71 PolarHBondContact O-N 3.26Å; M71-T73 VanDerWaalsContact C-N 3.31Å; M71-T73 PolarHBondContact O-N 3.44Å; M71-L74 PolarHBondContact O-N 3.07Å; M71-F75 PolarHBondContact O-N 3.36Å |
| 72 | G | 51.9 | Low | 52.8 | Low | 46 Ų | 46 | 104.4 Ų | 104.4 | 47% | 0.474 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.8 | -30.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | K69 K70 G76 | K69-G72 PolarHBondContact O-N 3.35Å; K70-G72 VanDerWaalsContact C-N 3.35Å; G72-G76 PolarHBondContact O-N 3.5Å |
| 73 | T | 57.8 | Low | 54 | Low | 105 Ų | 105 | 100.6 Ų | 100.6 | 64% | 0.644 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -71.9 | -36.3 | 178.4 | -51.6 | 0 | 0 | 0 | 0 | 112.5 | M71 G76 E77 | M71-T73 VanDerWaalsContact C-N 3.31Å; M71-T73 PolarHBondContact O-N 3.44Å; T73-G76 PolarHBondContact O-N 3.15Å; T73-E77 PolarHBondContact O-N 3.47Å; T73-E77 VanDerWaalsContact O-N 3.15Å |
| 74 | L | 58.2 | Low | 54 | Low | 106 Ų | 106 | 102.6 Ų | 102.6 | 56% | 0.555 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -74.8 | -36.5 | 179.5 | -69.4 | 172.6 | 0 | 0 | 0 | 111.7 | M71 G76 E77 L78 | M71-L74 PolarHBondContact O-N 3.07Å; L74-G76 VanDerWaalsContact C-N 3.32Å; L74-G76 PolarHBondContact O-N 3.22Å; L74-E77 PolarHBondContact O-N 3.28Å; L74-L78 VanDerWaalsContact O-CB 3.28Å; L74-L78 WeakPolarHBondContact O-CB 3.44Å; L74-L78 VanDerWaalsContact O-CD1 3.28Å; L74-L78 WeakPolarHBondContact O-CD1 3.18Å; L74-L78 WeakPolarHBondContact O-CG 3.28Å; L74-L78 PolarHBondContact O-N 2.9Å |
| 75 | F | 61.5 | Low | 54.4 | Low | 76 Ų | 76 | 103.4 Ų | 103.4 | 33% | 0.333 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.2 | -38.4 | 173.2 | -113.6 | -107.9 | 0 | 0 | 0 | 112 | M71 N79 E98 V100 I101 | M71-F75 PolarHBondContact O-N 3.36Å; F75-N79 WeakPolarHBondContact O-CB 3.28Å; F75-N79 PolarHBondContact O-N 3.21Å; F75-E98 WeakPolarHBondContact CD1-OE2 3.21Å; F75-V100 HydrophobicContact CD1-CG1 3.6Å; F75-V100 HydrophobicContact CE1-CG1 3.49Å; F75-V100 VanDerWaalsContact CE1-CG1 3.49Å; F75-V100 HydrophobicContact CZ-CG1 4.4Å; F75-I101 HydrophobicContact CE1-CD1 4.12Å; F75-I101 HydrophobicContact CE1-CG1 3.49Å; F75-I101 VanDerWaalsContact CE1-CG1 3.49Å; F75-I101 HydrophobicContact CZ-CG1 3.88Å |
| 76 | G | 58 | Low | 54.7 | Low | 39 Ų | 39 | 104.8 Ų | 104.8 | 40% | 0.402 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -65.8 | -40.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | G72 T73 L74 N79 K80 | G72-G76 PolarHBondContact O-N 3.5Å; T73-G76 PolarHBondContact O-N 3.15Å; L74-G76 VanDerWaalsContact C-N 3.32Å; L74-G76 PolarHBondContact O-N 3.22Å; G76-N79 PolarHBondContact O-N 3.48Å; G76-K80 WeakPolarHBondContact O-CB 3.34Å; G76-K80 PolarHBondContact O-N 3.35Å |
| 77 | E | 61.4 | Low | 54.9 | Low | 134 Ų | 134 | 102.9 Ų | 102.9 | 63% | 0.626 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -72.2 | -38 | 177.6 | -162.6 | 172.9 | -165.8 | 0 | 0 | 112.1 | T73 L74 K80 N81 | T73-E77 PolarHBondContact O-N 3.47Å; T73-E77 VanDerWaalsContact O-N 3.15Å; L74-E77 PolarHBondContact O-N 3.28Å; E77-K80 WeakPolarHBondContact O-CB 3.39Å; E77-K80 PolarHBondContact O-N 3.36Å; E77-N81 PolarHBondContact O-N 3.47Å |
| 78 | L | 62.7 | Low | 54.8 | Low | 73 Ų | 73 | 102.1 Ų | 102.1 | 38% | 0.382 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.6 | -40.9 | 172 | -74.4 | 160.3 | 0 | 0 | 0 | 111.7 | L74 K80 N81 L82 V100 | L74-L78 VanDerWaalsContact O-CB 3.28Å; L74-L78 WeakPolarHBondContact O-CB 3.44Å; L74-L78 VanDerWaalsContact O-CD1 3.28Å; L74-L78 WeakPolarHBondContact O-CD1 3.18Å; L74-L78 WeakPolarHBondContact O-CG 3.28Å; L74-L78 PolarHBondContact O-N 2.9Å; L78-K80 VanDerWaalsContact C-N 3.29Å; L78-K80 PolarHBondContact O-N 3.48Å; L78-N81 PolarHBondContact O-N 3.01Å; L78-L82 WeakPolarHBondContact O-CB 3.32Å; L78-L82 WeakPolarHBondContact O-CD1 3.28Å; L78-L82 PolarHBondContact O-N 3.37Å; L78-V100 HydrophobicContact CB-CG2 3.48Å; L78-V100 VanDerWaalsContact CB-CG2 3.48Å; L78-V100 HydrophobicContact CD1-CG2 4.46Å |
| 79 | N | 59.7 | Low | 55.1 | Low | 47 Ų | 47 | 104.3 Ų | 104.3 | 25% | 0.251 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -59.1 | -42.5 | 174.7 | -175.1 | 13.4 | 0 | 0 | 0 | 111 | F75 G76 L82 I83 | F75-N79 WeakPolarHBondContact O-CB 3.28Å; F75-N79 PolarHBondContact O-N 3.21Å; G76-N79 PolarHBondContact O-N 3.48Å; N79-L82 PolarHBondContact O-N 3.38Å; N79-I83 WeakPolarHBondContact O-CB 3.46Å; N79-I83 PolarHBondContact O-N 3.33Å |
| 80 | K | 60.6 | Low | 55.3 | Low | 160 Ų | 160 | 102.7 Ų | 102.7 | 70% | 0.696 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -65.5 | -40.5 | 177 | -155.1 | 147.8 | 164.8 | 173.7 | 0 | 112.1 | G76 E77 L78 N84 | G76-K80 WeakPolarHBondContact O-CB 3.34Å; G76-K80 PolarHBondContact O-N 3.35Å; E77-K80 WeakPolarHBondContact O-CB 3.39Å; E77-K80 PolarHBondContact O-N 3.36Å; L78-K80 VanDerWaalsContact C-N 3.29Å; L78-K80 PolarHBondContact O-N 3.48Å; K80-N84 WeakPolarHBondContact O-CB 3.13Å; K80-N84 PolarHBondContact O-N 2.83Å |
| 81 | N | 57.3 | Low | 55.5 | Low | 102 Ų | 102 | 104.9 Ų | 104.9 | 55% | 0.545 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -71.1 | -33.5 | 175.6 | -152.4 | -10 | 0 | 0 | 0 | 112.2 | E77 L78 N84 M85 | E77-N81 PolarHBondContact O-N 3.47Å; L78-N81 PolarHBondContact O-N 3.01Å; N81-N84 PolarHBondContact O-N 3.49Å; N81-M85 WeakPolarHBondContact O-CB 3.48Å; N81-M85 PolarHBondContact O-N 3.3Å |
| 82 | L | 60.4 | Low | 55.2 | Low | 19 Ų | 19 | 107.3 Ų | 107.3 | 10% | 0.099 | 55% | 0.549 | C | S | . | . | H | α-helix | trans | -72.9 | -39.1 | 178.7 | -114.1 | 86.2 | 0 | 0 | 0 | 114.8 | L78 N79 N84 M85 G86 F87 P99 V100 I103 | L78-L82 WeakPolarHBondContact O-CB 3.32Å; L78-L82 WeakPolarHBondContact O-CD1 3.28Å; L78-L82 PolarHBondContact O-N 3.37Å; N79-L82 PolarHBondContact O-N 3.38Å; L82-N84 VanDerWaalsContact C-N 3.25Å; L82-M85 PolarHBondContact O-N 2.96Å; L82-G86 PolarHBondContact O-N 3.26Å; L82-F87 PolarHBondContact O-N 3.48Å; L82-P99 HydrophobicContact CD2-CB 3.92Å; L82-P99 HydrophobicContact CD2-CG 4.44Å; L82-P99 WeakPolarHBondContact CD2-O 3.5Å; L82-V100 HydrophobicContact CD1-CG2 4.46Å; L82-V100 HydrophobicContact CD2-CB 4.12Å; L82-I103 HydrophobicContact CD1-CB 4.32Å; L82-I103 HydrophobicContact CD1-CD1 3.95Å; L82-I103 HydrophobicContact CD2-CB 4.03Å; L82-I103 HydrophobicContact CD2-CD1 3.34Å; L82-I103 HydrophobicContact CD2-CG1 3.67Å; L82-I103 HydrophobicContact CG-CD1 3.45Å; L82-I103 VanDerWaalsContact CG-CD1 3.45Å; L82-I103 HydrophobicContact CG-CG1 4.25Å |
| 83 | I | 61 | Low | 55.3 | Low | 99 Ų | 99 | 109 Ų | 109 | 51% | 0.508 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.9 | -38.8 | 171.8 | -85.8 | 166.9 | 0 | 0 | 0 | 109.9 | N79 M85 | N79-I83 WeakPolarHBondContact O-CB 3.46Å; N79-I83 PolarHBondContact O-N 3.33Å; I83-M85 VanDerWaalsContact C-N 3.33Å; I83-M85 PolarHBondContact O-N 2.84Å |
| 84 | N | 55.7 | Low | 54.8 | Low | 144 Ų | 144 | 113 Ų | 113 | 77% | 0.77 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -73.6 | -23.6 | 179.5 | -141.6 | 5.7 | 0 | 0 | 0 | 113.2 | K80 N81 L82 | K80-N84 WeakPolarHBondContact O-CB 3.13Å; K80-N84 PolarHBondContact O-N 2.83Å; N81-N84 PolarHBondContact O-N 3.49Å; L82-N84 VanDerWaalsContact C-N 3.25Å |
| 85 | M | 53.3 | Low | 54.3 | Low | 165 Ų | 165 | 117.8 Ų | 117.8 | 81% | 0.813 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -1.6 | -179 | -152.8 | 151.6 | -175 | 0 | 0 | 114.1 | N81 L82 I83 | N81-M85 WeakPolarHBondContact O-CB 3.48Å; N81-M85 PolarHBondContact O-N 3.3Å; L82-M85 PolarHBondContact O-N 2.96Å; I83-M85 VanDerWaalsContact C-N 3.33Å; I83-M85 PolarHBondContact O-N 2.84Å |
| 86 | G | 49.7 | Very low | 54 | Low | 51 Ų | 51 | 121.2 Ų | 121.2 | 53% | 0.526 | 61% | 0.609 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 100.7 | 23.2 | 163.3 | 0 | 0 | 0 | 0 | 0 | 117.2 | L82 T88 | L82-G86 PolarHBondContact O-N 3.26Å; G86-T88 VanDerWaalsContact C-N 3.25Å; G86-T88 PolarHBondContact O-N 3.24Å |
| 87 | F | 49.7 | Very low | 53.8 | Low | 77 Ų | 77 | 122.9 Ų | 122.9 | 34% | 0.338 | 61% | 0.612 | S | S | . | * | trans | -84 | 61.4 | 179.8 | -128.1 | -96.9 | 0 | 0 | 0 | 113 | L82 R89 P99 V102 I103 W106 | L82-F87 PolarHBondContact O-N 3.48Å; F87-R89 PolarHBondContact O-N 2.98Å; F87-P99 HydrophobicContact CB-CB 4.36Å; F87-P99 HydrophobicContact CD1-CB 4.38Å; F87-V102 HydrophobicContact CE1-CG1 4.17Å; F87-I103 HydrophobicContact CB-CD1 4.04Å; F87-I103 HydrophobicContact CD1-CD1 4.29Å; F87-I103 HydrophobicContact CD1-CG1 4.24Å; F87-I103 HydrophobicContact CD2-CD1 3.36Å; F87-I103 HydrophobicContact CD2-CG1 3.95Å; F87-I103 HydrophobicContact CE1-CG1 4.24Å; F87-I103 HydrophobicContact CE2-CD1 3.78Å; F87-I103 HydrophobicContact CE2-CG1 3.94Å; F87-I103 HydrophobicContact CG-CD1 3.64Å; F87-I103 HydrophobicContact CG-CG1 4.09Å; F87-I103 HydrophobicContact CZ-CD1 4.39Å; F87-I103 HydrophobicContact CZ-CG1 4.08Å; F87-W106 HydrophobicContact CZ-CZ3 4.33Å | ||
| 88 | T | 48 | Very low | 53.8 | Low | 104 Ų | 104 | 120.1 Ų | 120.1 | 64% | 0.638 | 60% | 0.599 | S | S | * | * | trans | -74 | 3.7 | 179.9 | -65 | 0 | 0 | 0 | 0 | 114.5 | G86 | G86-T88 VanDerWaalsContact C-N 3.25Å; G86-T88 PolarHBondContact O-N 3.24Å | ||
| 89 | R | 46.1 | Very low | 53.9 | Low | 224 Ų | 224 | 118.3 Ų | 118.3 | 85% | 0.845 | 59% | 0.591 | S | S | * | * | trans | -141.8 | 80.8 | -172.2 | -73.7 | -158.5 | 164.3 | 144.8 | 1.2 | 116.4 | F87 | F87-R89 PolarHBondContact O-N 2.98Š| ||
| 90 | M | 51.4 | Low | 54.2 | Low | 118 Ų | 118 | 116.2 Ų | 116.2 | 58% | 0.581 | 58% | 0.58 | S | S | * | * | trans | -149 | 62.7 | 138.3 | -150.8 | 173.6 | -169.9 | 0 | 0 | 110.8 | F92 V102 | M90-F92 PolarHBondContact O-N 3.4Å; M90-V102 HydrophobicContact SD-CG1 4.42Å; M90-V102 HydrophobicContact SD-CG2 4.28Å | ||
| 91 | Y | 51.6 | Low | 54.7 | Low | 193 Ų | 193 | 110.7 Ų | 110.7 | 76% | 0.757 | 56% | 0.558 | S | S | * | * | trans | -82.4 | 98.8 | 167.7 | -74.8 | -87.8 | 0 | 0 | 0 | 108.7 | G93 | Y91-G93 PolarHBondContact O-N 2.89Š| ||
| 92 | F | 42.5 | Very low | 55.5 | Low | 171 Ų | 171 | 107.4 Ų | 107.4 | 75% | 0.75 | 54% | 0.541 | S | S | * | . | B | Isolated β-bridge | trans | -93.9 | 84.5 | 168.7 | -143.7 | -85.9 | 0 | 0 | 0 | 109.5 | M90 E94 R95 | M90-F92 PolarHBondContact O-N 3.4Å; F92-E94 PolarHBondContact O-N 2.91Å; F92-R95 PolarHBondContact O-N 3.49Å |
| 93 | G | 55.7 | Low | 56.2 | Low | 83 Ų | 83 | 108.7 Ų | 108.7 | 86% | 0.856 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.4 | -34.3 | 148.5 | 0 | 0 | 0 | 0 | 0 | 121.6 | Y91 | Y91-G93 PolarHBondContact O-N 2.89Š|
| 94 | E | 47.3 | Very low | 56.9 | Low | 189 Ų | 189 | 108.4 Ų | 108.4 | 88% | 0.883 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -159.9 | -1.9 | -174.1 | -157.5 | 156.1 | -170.9 | 0 | 0 | 113.4 | F92 | F92-E94 PolarHBondContact O-N 2.91Š|
| 95 | R | 47.7 | Very low | 58 | Low | 206 Ų | 206 | 107.5 Ų | 107.5 | 78% | 0.777 | 53% | 0.533 | S | S | * | . | B | Isolated β-bridge | trans | -135.1 | 114.1 | 172.5 | -78.6 | -175.6 | -100 | -99 | -0.5 | 109.7 | F92 V97 | F92-R95 PolarHBondContact O-N 3.49Å; R95-V97 PolarHBondContact O-N 2.98Å |
| 96 | I | 53.9 | Low | 59.3 | Low | 147 Ų | 147 | 107.6 Ų | 107.6 | 75% | 0.754 | 52% | 0.524 | S | S | * | . | trans | -74.1 | 79 | 175.1 | -43.6 | 162.7 | 0 | 0 | 0 | 106.4 | E98 | I96-E98 PolarHBondContact O-N 3.15Å; I96-E98 VanDerWaalsContact O-N 3.13Å | ||
| 97 | V | 54.6 | Low | 60.9 | Low | 74 Ų | 74 | 109.6 Ų | 109.6 | 45% | 0.448 | 53% | 0.526 | S | S | . | . | trans | -73.1 | 107 | 169.3 | -173.1 | 0 | 0 | 0 | 0 | 105 | R95 V102 | R95-V97 PolarHBondContact O-N 2.98Å; V97-V102 HydrophobicContact CG1-CG2 4.32Å | ||
| 98 | E | 60.1 | Low | 62.3 | Low | 77 Ų | 77 | 109.3 Ų | 109.3 | 36% | 0.36 | 53% | 0.526 | S | S | . | . | trans | -53.3 | 131.8 | -174.5 | -63.5 | 176.4 | 145.8 | 0 | 0 | 109.5 | F75 I96 V100 I101 | F75-E98 WeakPolarHBondContact CD1-OE2 3.21Å; I96-E98 PolarHBondContact O-N 3.15Å; I96-E98 VanDerWaalsContact O-N 3.13Å; E98-V100 HydrophobicContact CB-CG1 3.65Å; E98-V100 PolarHBondContact O-N 3.18Å; E98-I101 HydrophobicContact CB-CD1 3.91Å; E98-I101 HydrophobicContact CB-CG1 4.18Å; E98-I101 HydrophobicContact CG-CD1 4.38Å; E98-I101 WeakPolarHBondContact O-CB 3.08Å; E98-I101 PolarHBondContact O-N 3.34Å | ||
| 99 | P | 65.4 | Low | 64 | Low | 34 Ų | 34 | 110.2 Ų | 110.2 | 22% | 0.221 | 53% | 0.527 | C | S | . | . | H | α-helix | trans | -57.2 | -24.9 | -176.8 | 23.2 | -33.6 | 0 | 0 | 0 | 111.9 | L82 F87 I101 V102 I103 | L82-P99 HydrophobicContact CD2-CB 3.92Å; L82-P99 HydrophobicContact CD2-CG 4.44Å; L82-P99 WeakPolarHBondContact CD2-O 3.5Å; F87-P99 HydrophobicContact CB-CB 4.36Å; F87-P99 HydrophobicContact CD1-CB 4.38Å; P99-I101 VanDerWaalsContact C-N 3.28Å; P99-I101 PolarHBondContact O-N 2.93Å; P99-V102 PolarHBondContact O-N 3.13Å; P99-V102 VanDerWaalsContact O-N 3.15Å; P99-I103 PolarHBondContact O-N 2.86Å; P99-I103 VanDerWaalsContact O-N 3.09Å |
| 100 | V | 66.3 | Low | 66 | Low | 3 Ų | 3 | 107.8 Ų | 107.8 | 2% | 0.018 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -59.3 | -40.6 | 175.8 | 67.8 | 0 | 0 | 0 | 0 | 111.9 | F75 L78 L82 E98 V102 F104 | F75-V100 HydrophobicContact CD1-CG1 3.6Å; F75-V100 HydrophobicContact CE1-CG1 3.49Å; F75-V100 VanDerWaalsContact CE1-CG1 3.49Å; F75-V100 HydrophobicContact CZ-CG1 4.4Å; L78-V100 HydrophobicContact CB-CG2 3.48Å; L78-V100 VanDerWaalsContact CB-CG2 3.48Å; L78-V100 HydrophobicContact CD1-CG2 4.46Å; L82-V100 HydrophobicContact CD1-CG2 4.46Å; L82-V100 HydrophobicContact CD2-CB 4.12Å; E98-V100 HydrophobicContact CB-CG1 3.65Å; E98-V100 PolarHBondContact O-N 3.18Å; V100-V102 VanDerWaalsContact C-N 3.33Å; V100-V102 PolarHBondContact O-N 2.89Å; V100-F104 WeakPolarHBondContact O-CB 3.35Å; V100-F104 PolarHBondContact O-N 3.09Å |
| 101 | I | 70.7 | Confident | 67.6 | Low | 45 Ų | 45 | 107.8 Ų | 107.8 | 23% | 0.231 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -67.6 | -39.6 | 179.4 | -59.1 | 167.1 | 0 | 0 | 0 | 109.1 | F75 E98 P99 F105 | F75-I101 HydrophobicContact CE1-CD1 4.12Å; F75-I101 HydrophobicContact CE1-CG1 3.49Å; F75-I101 VanDerWaalsContact CE1-CG1 3.49Å; F75-I101 HydrophobicContact CZ-CG1 3.88Å; E98-I101 HydrophobicContact CB-CD1 3.91Å; E98-I101 HydrophobicContact CB-CG1 4.18Å; E98-I101 HydrophobicContact CG-CD1 4.38Å; E98-I101 WeakPolarHBondContact O-CB 3.08Å; E98-I101 PolarHBondContact O-N 3.34Å; P99-I101 VanDerWaalsContact C-N 3.28Å; P99-I101 PolarHBondContact O-N 2.93Å; I101-F105 HydrophobicContact CB-CD2 4.49Å; I101-F105 HydrophobicContact CG2-CD2 3.3Å; I101-F105 HydrophobicContact CG2-CE2 3.29Å; I101-F105 VanDerWaalsContact O-CB 3.23Å; I101-F105 WeakPolarHBondContact O-CB 3.22Å; I101-F105 WeakPolarHBondContact O-CD2 3.07Å; I101-F105 PolarHBondContact O-N 2.69Å |
| 102 | V | 73.8 | Confident | 69.1 | Low | 32 Ų | 32 | 103.3 Ų | 103.3 | 19% | 0.194 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -65.4 | -46.5 | 179.3 | 179.6 | 0 | 0 | 0 | 0 | 112.1 | F87 M90 V97 P99 V100 W106 | F87-V102 HydrophobicContact CE1-CG1 4.17Å; M90-V102 HydrophobicContact SD-CG1 4.42Å; M90-V102 HydrophobicContact SD-CG2 4.28Å; V97-V102 HydrophobicContact CG1-CG2 4.32Å; P99-V102 PolarHBondContact O-N 3.13Å; P99-V102 VanDerWaalsContact O-N 3.15Å; V100-V102 VanDerWaalsContact C-N 3.33Å; V100-V102 PolarHBondContact O-N 2.89Å; V102-W106 WeakPolarHBondContact O-CB 3.39Å; V102-W106 PolarHBondContact O-N 2.69Å |
| 103 | I | 75.8 | Confident | 71.2 | Confident | 47 Ų | 47 | 96.2 Ų | 96.2 | 24% | 0.241 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -70.8 | -40.8 | 178.2 | -60.8 | -171.2 | 0 | 0 | 0 | 111 | L82 F87 P99 W106 V107 | L82-I103 HydrophobicContact CD1-CB 4.32Å; L82-I103 HydrophobicContact CD1-CD1 3.95Å; L82-I103 HydrophobicContact CD2-CB 4.03Å; L82-I103 HydrophobicContact CD2-CD1 3.34Å; L82-I103 HydrophobicContact CD2-CG1 3.67Å; L82-I103 HydrophobicContact CG-CD1 3.45Å; L82-I103 VanDerWaalsContact CG-CD1 3.45Å; L82-I103 HydrophobicContact CG-CG1 4.25Å; F87-I103 HydrophobicContact CB-CD1 4.04Å; F87-I103 HydrophobicContact CD1-CD1 4.29Å; F87-I103 HydrophobicContact CD1-CG1 4.24Å; F87-I103 HydrophobicContact CD2-CD1 3.36Å; F87-I103 HydrophobicContact CD2-CG1 3.95Å; F87-I103 HydrophobicContact CE1-CG1 4.24Å; F87-I103 HydrophobicContact CE2-CD1 3.78Å; F87-I103 HydrophobicContact CE2-CG1 3.94Å; F87-I103 HydrophobicContact CG-CD1 3.64Å; F87-I103 HydrophobicContact CG-CG1 4.09Å; F87-I103 HydrophobicContact CZ-CD1 4.39Å; F87-I103 HydrophobicContact CZ-CG1 4.08Å; P99-I103 PolarHBondContact O-N 2.86Å; P99-I103 VanDerWaalsContact O-N 3.09Å; I103-W106 WeakPolarHBondContact O-CB 3.01Å; I103-W106 PolarHBondContact O-N 3.1Å; I103-W106 VanDerWaalsContact O-N 3.1Å; I103-V107 HydrophobicContact CG2-CG2 4.47Å; I103-V107 PolarHBondContact O-N 3.39Å |
| 104 | F | 76.4 | Confident | 72.6 | Confident | 93 Ų | 93 | 96.6 Ų | 96.6 | 41% | 0.408 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 176.2 | -176.1 | -101 | 0 | 0 | 0 | 110.7 | V100 W106 V107 M108 | V100-F104 WeakPolarHBondContact O-CB 3.35Å; V100-F104 PolarHBondContact O-N 3.09Å; F104-W106 VanDerWaalsContact C-N 3.28Å; F104-W106 PolarHBondContact O-N 3.48Å; F104-V107 PolarHBondContact O-N 2.85Å; F104-M108 HydrophobicContact CD1-CG 3.87Å; F104-M108 HydrophobicContact CD2-CG 4.16Å; F104-M108 HydrophobicContact CE1-CG 3.55Å; F104-M108 HydrophobicContact CE1-SD 3.95Å; F104-M108 HydrophobicContact CE2-CE 4.18Å; F104-M108 HydrophobicContact CE2-CG 3.86Å; F104-M108 HydrophobicContact CE2-SD 4.22Å; F104-M108 HydrophobicContact CG-CG 4.17Å; F104-M108 HydrophobicContact CZ-CE 4.07Å; F104-M108 HydrophobicContact CZ-CG 3.54Å; F104-M108 HydrophobicContact CZ-SD 3.6Å; F104-M108 VanDerWaalsContact CZ-SD 3.6Å; F104-M108 WeakPolarHBondContact O-CB 2.81Å; F104-M108 WeakPolarHBondContact O-CG 3.23Å; F104-M108 PolarHBondContact O-N 2.78Å |
| 105 | F | 77.4 | Confident | 74.5 | Confident | 124 Ų | 124 | 92.9 Ų | 92.9 | 54% | 0.544 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.5 | -34.1 | 172.6 | -86.7 | -66.6 | 0 | 0 | 0 | 111.8 | I101 L109 | I101-F105 HydrophobicContact CB-CD2 4.49Å; I101-F105 HydrophobicContact CG2-CD2 3.3Å; I101-F105 HydrophobicContact CG2-CE2 3.29Å; I101-F105 VanDerWaalsContact O-CB 3.23Å; I101-F105 WeakPolarHBondContact O-CB 3.22Å; I101-F105 WeakPolarHBondContact O-CD2 3.07Å; I101-F105 PolarHBondContact O-N 2.69Å; F105-L109 VanDerWaalsContact O-CA 3.32Å; F105-L109 WeakPolarHBondContact O-CA 3.15Å; F105-L109 WeakPolarHBondContact O-CB 3.37Å; F105-L109 PolarHBondContact O-N 2.92Å |
| 106 | W | 81.9 | Confident | 76.6 | Confident | 168 Ų | 168 | 85.7 Ų | 85.7 | 64% | 0.636 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -61.5 | -53.3 | 175.1 | -164.8 | -36.2 | 0 | 0 | 0 | 111.1 | F87 V102 I103 F104 W110 | F87-W106 HydrophobicContact CZ-CZ3 4.33Å; V102-W106 WeakPolarHBondContact O-CB 3.39Å; V102-W106 PolarHBondContact O-N 2.69Å; I103-W106 WeakPolarHBondContact O-CB 3.01Å; I103-W106 PolarHBondContact O-N 3.1Å; I103-W106 VanDerWaalsContact O-N 3.1Å; F104-W106 VanDerWaalsContact C-N 3.28Å; F104-W106 PolarHBondContact O-N 3.48Å; W106-W110 WeakPolarHBondContact O-CB 3.22Å; W106-W110 PolarHBondContact O-N 2.78Å |
| 107 | V | 82.9 | Confident | 78.3 | Confident | 92 Ų | 92 | 84.5 Ų | 84.5 | 56% | 0.558 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -65.9 | -44.9 | -178.6 | 176.8 | 0 | 0 | 0 | 0 | 111 | I103 F104 F111 | I103-V107 HydrophobicContact CG2-CG2 4.47Å; I103-V107 PolarHBondContact O-N 3.39Å; F104-V107 PolarHBondContact O-N 2.85Å; V107-F111 WeakPolarHBondContact O-CB 3.12Å; V107-F111 PolarHBondContact O-N 2.66Å |
| 108 | M | 78.3 | Confident | 80 | Confident | 72 Ų | 72 | 82.5 Ų | 82.5 | 36% | 0.355 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.8 | -45.6 | 177 | -73.6 | -97 | 129.2 | 0 | 0 | 111.6 | F104 W110 F111 L112 | F104-M108 HydrophobicContact CD1-CG 3.87Å; F104-M108 HydrophobicContact CD2-CG 4.16Å; F104-M108 HydrophobicContact CE1-CG 3.55Å; F104-M108 HydrophobicContact CE1-SD 3.95Å; F104-M108 HydrophobicContact CE2-CE 4.18Å; F104-M108 HydrophobicContact CE2-CG 3.86Å; F104-M108 HydrophobicContact CE2-SD 4.22Å; F104-M108 HydrophobicContact CG-CG 4.17Å; F104-M108 HydrophobicContact CZ-CE 4.07Å; F104-M108 HydrophobicContact CZ-CG 3.54Å; F104-M108 HydrophobicContact CZ-SD 3.6Å; F104-M108 VanDerWaalsContact CZ-SD 3.6Å; F104-M108 WeakPolarHBondContact O-CB 2.81Å; F104-M108 WeakPolarHBondContact O-CG 3.23Å; F104-M108 PolarHBondContact O-N 2.78Å; M108-W110 VanDerWaalsContact C-N 3.34Å; M108-W110 PolarHBondContact O-N 3.34Å; M108-F111 CarbonylContact O-C 3.57Å; M108-F111 PolarHBondContact O-N 2.8Å; M108-L112 HydrophobicContact CB-CD1 4.1Å; M108-L112 WeakPolarHBondContact O-CB 3.32Å; M108-L112 WeakPolarHBondContact O-CD1 3.37Å; M108-L112 PolarHBondContact O-N 3.33Å; M108-L112 HydrophobicContact SD-CD1 4.05Å |
| 109 | L | 84.9 | Confident | 81.6 | Confident | 123 Ų | 123 | 84.8 Ų | 84.8 | 64% | 0.644 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -68.7 | -34.9 | 179.4 | -172.1 | 66.9 | 0 | 0 | 0 | 111.4 | F105 G113 | F105-L109 VanDerWaalsContact O-CA 3.32Å; F105-L109 WeakPolarHBondContact O-CA 3.15Å; F105-L109 WeakPolarHBondContact O-CB 3.37Å; F105-L109 PolarHBondContact O-N 2.92Å; L109-G113 WeakPolarHBondContact O-CA 3.19Å; L109-G113 PolarHBondContact O-N 2.93Å |
| 110 | W | 86.4 | Confident | 82.9 | Confident | 173 Ų | 173 | 87.7 Ų | 87.7 | 66% | 0.655 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -64.1 | -43.3 | 170.1 | -179.8 | -101.3 | 0 | 0 | 0 | 111 | W106 M108 L114 | W106-W110 WeakPolarHBondContact O-CB 3.22Å; W106-W110 PolarHBondContact O-N 2.78Å; M108-W110 VanDerWaalsContact C-N 3.34Å; M108-W110 PolarHBondContact O-N 3.34Å; W110-L114 HydrophobicContact CD2-CD1 3.95Å; W110-L114 HydrophobicContact CG-CD1 4.09Å; W110-L114 HydrophobicContact CZ2-CD1 3.78Å; W110-L114 HydrophobicContact CZ2-CG 4.49Å; W110-L114 WeakPolarHBondContact O-CB 3.3Å; W110-L114 WeakPolarHBondContact O-CG 3.32Å; W110-L114 PolarHBondContact O-N 3.07Å |
| 111 | F | 85 | Confident | 84.2 | Confident | 118 Ų | 118 | 90.8 Ų | 90.8 | 52% | 0.518 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -71.3 | -53.7 | -180 | 179.8 | -104.7 | 0 | 0 | 0 | 112.9 | V107 M108 G113 L114 Q115 | V107-F111 WeakPolarHBondContact O-CB 3.12Å; V107-F111 PolarHBondContact O-N 2.66Å; M108-F111 CarbonylContact O-C 3.57Å; M108-F111 PolarHBondContact O-N 2.8Å; F111-G113 VanDerWaalsContact C-N 3.26Å; F111-G113 PolarHBondContact O-N 3.12Å; F111-L114 PolarHBondContact O-N 3.38Å; F111-Q115 VanDerWaalsContact O-CB 3.23Å; F111-Q115 WeakPolarHBondContact O-CB 3.12Å; F111-Q115 PolarHBondContact O-N 2.85Å |
| 112 | L | 83.9 | Confident | 85.4 | Confident | 98 Ų | 98 | 92.9 Ų | 92.9 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.5 | -39.7 | 173.3 | -83.6 | 75.3 | 0 | 0 | 0 | 110.6 | M108 Q115 A116 | M108-L112 HydrophobicContact CB-CD1 4.1Å; M108-L112 WeakPolarHBondContact O-CB 3.32Å; M108-L112 WeakPolarHBondContact O-CD1 3.37Å; M108-L112 PolarHBondContact O-N 3.33Å; M108-L112 HydrophobicContact SD-CD1 4.05Å; L112-Q115 PolarHBondContact O-N 2.75Å; L112-A116 VanDerWaalsContact O-CB 3.3Å; L112-A116 WeakPolarHBondContact O-CB 3.13Å; L112-A116 PolarHBondContact O-N 2.76Å |
| 113 | G | 86.1 | Confident | 86.3 | Confident | 22 Ų | 22 | 96.3 Ų | 96.3 | 23% | 0.227 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -64.5 | -53.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | L109 F111 Q115 A116 L117 | L109-G113 WeakPolarHBondContact O-CA 3.19Å; L109-G113 PolarHBondContact O-N 2.93Å; F111-G113 VanDerWaalsContact C-N 3.26Å; F111-G113 PolarHBondContact O-N 3.12Å; G113-Q115 VanDerWaalsContact C-N 3.29Å; G113-Q115 PolarHBondContact O-N 3.39Å; G113-A116 PolarHBondContact O-N 3.39Å; G113-L117 WeakPolarHBondContact O-CB 3.41Å; G113-L117 WeakPolarHBondContact O-CG 3.4Å; G113-L117 PolarHBondContact O-N 2.86Å |
| 114 | L | 85.9 | Confident | 87.1 | Confident | 92 Ų | 92 | 97.5 Ų | 97.5 | 48% | 0.482 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.1 | -36.6 | 175.5 | -86.9 | 164.4 | 0 | 0 | 0 | 112.6 | W110 F111 G118 | W110-L114 HydrophobicContact CD2-CD1 3.95Å; W110-L114 HydrophobicContact CG-CD1 4.09Å; W110-L114 HydrophobicContact CZ2-CD1 3.78Å; W110-L114 HydrophobicContact CZ2-CG 4.49Å; W110-L114 WeakPolarHBondContact O-CB 3.3Å; W110-L114 WeakPolarHBondContact O-CG 3.32Å; W110-L114 PolarHBondContact O-N 3.07Å; F111-L114 PolarHBondContact O-N 3.38Å; L114-G118 WeakPolarHBondContact O-CA 3.23Å; L114-G118 PolarHBondContact O-N 3.5Å |
| 115 | Q | 88.1 | Confident | 87.9 | Confident | 110 Ų | 110 | 98 Ų | 98 | 51% | 0.514 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.6 | -43.6 | 179 | -166.2 | 166.8 | 17.3 | 0 | 0 | 111 | F111 L112 G113 L119 | F111-Q115 VanDerWaalsContact O-CB 3.23Å; F111-Q115 WeakPolarHBondContact O-CB 3.12Å; F111-Q115 PolarHBondContact O-N 2.85Å; L112-Q115 PolarHBondContact O-N 2.75Å; G113-Q115 VanDerWaalsContact C-N 3.29Å; G113-Q115 PolarHBondContact O-N 3.39Å; Q115-L119 VanDerWaalsContact O-CG 3.3Å; Q115-L119 WeakPolarHBondContact O-CG 3.26Å; Q115-L119 PolarHBondContact O-N 3.4Å; Q115-L119 VanDerWaalsContact O-N 3.12Å |
| 116 | A | 90.3 | Very high | 88.8 | Confident | 55 Ų | 55 | 96 Ų | 96 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.9 | -49.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L112 G113 G118 L119 V120 | L112-A116 VanDerWaalsContact O-CB 3.3Å; L112-A116 WeakPolarHBondContact O-CB 3.13Å; L112-A116 PolarHBondContact O-N 2.76Å; G113-A116 PolarHBondContact O-N 3.39Å; A116-G118 VanDerWaalsContact C-N 3.29Å; A116-G118 PolarHBondContact O-N 3.33Å; A116-L119 PolarHBondContact O-N 3.34Å; A116-V120 WeakPolarHBondContact O-CB 3.3Å; A116-V120 VanDerWaalsContact O-CG2 3.26Å; A116-V120 WeakPolarHBondContact O-CG2 3.24Å; A116-V120 PolarHBondContact O-N 2.74Å |
| 117 | L | 89.6 | Confident | 89.3 | Confident | 122 Ų | 122 | 91.7 Ų | 91.7 | 64% | 0.639 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.6 | -35.9 | 177.7 | -69.8 | 173.2 | 0 | 0 | 0 | 111.6 | G113 S121 | G113-L117 WeakPolarHBondContact O-CB 3.41Å; G113-L117 WeakPolarHBondContact O-CG 3.4Å; G113-L117 PolarHBondContact O-N 2.86Å; L117-S121 WeakPolarHBondContact O-CA 3.24Å; L117-S121 WeakPolarHBondContact O-CB 3.14Å; L117-S121 PolarHBondContact O-N 2.91Å |
| 118 | G | 91.6 | Very high | 89.8 | Confident | 32 Ų | 32 | 91.9 Ų | 91.9 | 33% | 0.33 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.4 | -47.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L114 A116 S121 V122 | L114-G118 WeakPolarHBondContact O-CA 3.23Å; L114-G118 PolarHBondContact O-N 3.5Å; A116-G118 VanDerWaalsContact C-N 3.29Å; A116-G118 PolarHBondContact O-N 3.33Å; G118-S121 PolarHBondContact O-N 2.92Å; G118-V122 WeakPolarHBondContact O-CB 3.15Å; G118-V122 VanDerWaalsContact O-CG2 3.24Å; G118-V122 WeakPolarHBondContact O-CG2 2.94Å; G118-V122 PolarHBondContact O-N 2.75Å |
| 119 | L | 92.6 | Very high | 90.6 | Very high | 125 Ų | 125 | 97.4 Ų | 97.4 | 65% | 0.654 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.3 | -45.1 | 175.9 | -71.3 | 174.8 | 0 | 0 | 0 | 111.9 | Q115 A116 L123 | Q115-L119 VanDerWaalsContact O-CG 3.3Å; Q115-L119 WeakPolarHBondContact O-CG 3.26Å; Q115-L119 PolarHBondContact O-N 3.4Å; Q115-L119 VanDerWaalsContact O-N 3.12Å; A116-L119 PolarHBondContact O-N 3.34Å; L119-L123 VanDerWaalsContact O-CB 3.24Å; L119-L123 WeakPolarHBondContact O-CB 3.43Å; L119-L123 PolarHBondContact O-N 3.39Å |
| 120 | V | 93.8 | Very high | 90.9 | Very high | 96 Ų | 96 | 96.6 Ų | 96.6 | 58% | 0.582 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.3 | -41 | 176.7 | 173.8 | 0 | 0 | 0 | 0 | 111 | A116 L123 C124 | A116-V120 WeakPolarHBondContact O-CB 3.3Å; A116-V120 VanDerWaalsContact O-CG2 3.26Å; A116-V120 WeakPolarHBondContact O-CG2 3.24Å; A116-V120 PolarHBondContact O-N 2.74Å; V120-L123 PolarHBondContact O-N 3.47Å; V120-C124 WeakPolarHBondContact O-CB 3.47Å; V120-C124 PolarHBondContact O-N 3.25Å |
| 121 | S | 93.6 | Very high | 90.5 | Very high | 67 Ų | 67 | 96.1 Ų | 96.1 | 47% | 0.469 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.6 | -46.2 | 178.2 | 175.9 | 0 | 0 | 0 | 0 | 111.5 | L117 G118 C124 L125 | L117-S121 WeakPolarHBondContact O-CA 3.24Å; L117-S121 WeakPolarHBondContact O-CB 3.14Å; L117-S121 PolarHBondContact O-N 2.91Å; G118-S121 PolarHBondContact O-N 2.92Å; S121-C124 PolarHBondContact O-N 3.41Å; S121-L125 PolarHBondContact O-N 2.94Å |
| 122 | V | 95.1 | Very high | 89.1 | Confident | 90 Ų | 90 | 101.1 Ų | 101.1 | 55% | 0.545 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.5 | -45.5 | 176.4 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | G118 C124 L125 V126 | G118-V122 WeakPolarHBondContact O-CB 3.15Å; G118-V122 VanDerWaalsContact O-CG2 3.24Å; G118-V122 WeakPolarHBondContact O-CG2 2.94Å; G118-V122 PolarHBondContact O-N 2.75Å; V122-C124 VanDerWaalsContact C-N 3.3Å; V122-C124 PolarHBondContact O-N 3.29Å; V122-L125 PolarHBondContact O-N 2.91Å; V122-V126 HydrophobicContact CG1-CG2 4.46Å; V122-V126 WeakPolarHBondContact O-CG2 3.2Å; V122-V126 PolarHBondContact O-N 2.86Å |
| 123 | L | 93.3 | Very high | 89.3 | Confident | 104 Ų | 104 | 101.3 Ų | 101.3 | 55% | 0.545 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -59.8 | -42.8 | 176.5 | -177.7 | 61.9 | 0 | 0 | 0 | 111.3 | L119 V120 V126 I127 | L119-L123 VanDerWaalsContact O-CB 3.24Å; L119-L123 WeakPolarHBondContact O-CB 3.43Å; L119-L123 PolarHBondContact O-N 3.39Å; V120-L123 PolarHBondContact O-N 3.47Å; L123-V126 PolarHBondContact O-N 3.45Å; L123-I127 HydrophobicContact CD1-CD1 4.16Å; L123-I127 HydrophobicContact CD1-CG1 4.44Å; L123-I127 HydrophobicContact CG-CD1 3.89Å; L123-I127 WeakPolarHBondContact O-CD1 3.21Å; L123-I127 WeakPolarHBondContact O-CG1 3.34Å; L123-I127 PolarHBondContact O-N 2.95Å |
| 124 | C | 93.1 | Very high | 89.5 | Confident | 72 Ų | 72 | 105.5 Ų | 105.5 | 49% | 0.486 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.3 | -44.6 | 177.2 | -161.5 | 0 | 0 | 0 | 0 | 111.4 | V120 S121 V122 V126 I127 I128 | V120-C124 WeakPolarHBondContact O-CB 3.47Å; V120-C124 PolarHBondContact O-N 3.25Å; S121-C124 PolarHBondContact O-N 3.41Å; V122-C124 VanDerWaalsContact C-N 3.3Å; V122-C124 PolarHBondContact O-N 3.29Å; C124-V126 PolarHBondContact O-N 3.5Å; C124-I127 PolarHBondContact O-N 3.15Å; C124-I128 PolarHBondContact O-N 2.94Å |
| 125 | L | 93 | Very high | 89.7 | Confident | 103 Ų | 103 | 106.2 Ų | 106.2 | 54% | 0.539 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -59.8 | -43.1 | 173.8 | -83.8 | 175.4 | 0 | 0 | 0 | 112.6 | S121 V122 I127 I128 Y129 | S121-L125 PolarHBondContact O-N 2.94Å; V122-L125 PolarHBondContact O-N 2.91Å; L125-I127 VanDerWaalsContact C-N 3.34Å; L125-I127 PolarHBondContact O-N 3.35Å; L125-I128 HydrophobicContact CD2-CD1 3.89Å; L125-I128 HydrophobicContact CD2-CG1 4.49Å; L125-I128 WeakPolarHBondContact O-CG1 3.49Å; L125-I128 PolarHBondContact O-N 2.84Å; L125-Y129 WeakPolarHBondContact O-CB 3.39Å; L125-Y129 PolarHBondContact O-N 3.44Å |
| 126 | V | 95.8 | Very high | 89.8 | Confident | 81 Ų | 81 | 106 Ų | 106 | 49% | 0.491 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -64.4 | -40.8 | 178.3 | 168.5 | 0 | 0 | 0 | 0 | 111.1 | V122 L123 C124 Y129 V130 | V122-V126 HydrophobicContact CG1-CG2 4.46Å; V122-V126 WeakPolarHBondContact O-CG2 3.2Å; V122-V126 PolarHBondContact O-N 2.86Å; L123-V126 PolarHBondContact O-N 3.45Å; C124-V126 PolarHBondContact O-N 3.5Å; V126-Y129 PolarHBondContact O-N 3.15Å; V126-V130 WeakPolarHBondContact O-CB 3.47Å; V126-V130 WeakPolarHBondContact O-CG1 3.35Å; V126-V130 PolarHBondContact O-N 3.04Å |
| 127 | I | 92.5 | Very high | 89.8 | Confident | 78 Ų | 78 | 109.2 Ų | 109.2 | 40% | 0.4 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.7 | -43.8 | 179.2 | -67.3 | 164.4 | 0 | 0 | 0 | 110.8 | L123 C124 L125 Y129 V130 Q131 | L123-I127 HydrophobicContact CD1-CD1 4.16Å; L123-I127 HydrophobicContact CD1-CG1 4.44Å; L123-I127 HydrophobicContact CG-CD1 3.89Å; L123-I127 WeakPolarHBondContact O-CD1 3.21Å; L123-I127 WeakPolarHBondContact O-CG1 3.34Å; L123-I127 PolarHBondContact O-N 2.95Å; C124-I127 PolarHBondContact O-N 3.15Å; L125-I127 VanDerWaalsContact C-N 3.34Å; L125-I127 PolarHBondContact O-N 3.35Å; I127-Y129 VanDerWaalsContact C-N 3.34Å; I127-V130 WeakPolarHBondContact O-CG1 3.43Å; I127-Q131 WeakPolarHBondContact O-CB 3.12Å; I127-Q131 WeakPolarHBondContact O-CG 3.15Å; I127-Q131 PolarHBondContact O-N 3.3Å; I127-Q131 VanDerWaalsContact O-N 3.15Å |
| 128 | I | 93.5 | Very high | 89.8 | Confident | 96 Ų | 96 | 108.3 Ų | 108.3 | 49% | 0.492 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -70.3 | -33.4 | 175.9 | 67.2 | 174.3 | 0 | 0 | 0 | 111.9 | C124 L125 Q132 | C124-I128 PolarHBondContact O-N 2.94Å; L125-I128 HydrophobicContact CD2-CD1 3.89Å; L125-I128 HydrophobicContact CD2-CG1 4.49Å; L125-I128 WeakPolarHBondContact O-CG1 3.49Å; L125-I128 PolarHBondContact O-N 2.84Å; I128-Q132 VanDerWaalsContact O-CB 3.25Å; I128-Q132 WeakPolarHBondContact O-CB 3.25Å; I128-Q132 PolarHBondContact O-N 3.33Å; I128-Q132 VanDerWaalsContact O-N 3.15Å |
| 129 | Y | 93.9 | Very high | 89.7 | Confident | 189 Ų | 189 | 113.8 Ų | 113.8 | 74% | 0.741 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -67.6 | -37.9 | 179.1 | 175.2 | -97.3 | 0 | 0 | 0 | 112.2 | L125 V126 I127 | L125-Y129 WeakPolarHBondContact O-CB 3.39Å; L125-Y129 PolarHBondContact O-N 3.44Å; V126-Y129 PolarHBondContact O-N 3.15Å; I127-Y129 VanDerWaalsContact C-N 3.34Å |
| 130 | V | 91.8 | Very high | 89.4 | Confident | 106 Ų | 106 | 112.9 Ų | 112.9 | 64% | 0.642 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -84.1 | -24.9 | -178.7 | 77.7 | 0 | 0 | 0 | 0 | 113.2 | V126 I127 | V126-V130 WeakPolarHBondContact O-CB 3.47Å; V126-V130 WeakPolarHBondContact O-CG1 3.35Å; V126-V130 PolarHBondContact O-N 3.04Å; I127-V130 WeakPolarHBondContact O-CG1 3.43Å |
| 131 | Q | 77.4 | Confident | 89.1 | Confident | 163 Ų | 163 | 114.3 Ų | 114.3 | 76% | 0.762 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -95.6 | 0.4 | 179.1 | -66.8 | -151.8 | 64.3 | 0 | 0 | 114 | I127 | I127-Q131 WeakPolarHBondContact O-CB 3.12Å; I127-Q131 WeakPolarHBondContact O-CG 3.15Å; I127-Q131 PolarHBondContact O-N 3.3Å; I127-Q131 VanDerWaalsContact O-N 3.15Å |
| 132 | Q | 56 | Low | 88.7 | Confident | 223 Ų | 223 | 118.6 Ų | 118.6 | 100% | 1.042 | 61% | 0.608 | S | S | * | * | trans | -92.5 | 0 | 168.9 | -173.7 | 156.1 | 44.4 | 0 | 0 | 110.5 | I128 | I128-Q132 VanDerWaalsContact O-CB 3.25Å; I128-Q132 WeakPolarHBondContact O-CB 3.25Å; I128-Q132 PolarHBondContact O-N 3.33Å; I128-Q132 VanDerWaalsContact O-N 3.15Å |
Retrieved 132 of 132 residues in 211 ms
(Link to these results)