| 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 | N | 38.9 | Very low | 33.4 | Very low | 209 Ų | 209 | 151.3 Ų | 151.3 | 100% | 1.118 | 77% | 0.774 | S | S | * | * | 0 | 104.6 | 0 | -76 | 2 | 0 | 0 | 0 | 109.5 | |||||
| 2 | S | 37.4 | Very low | 33.1 | Very low | 100 Ų | 100 | 151.2 Ų | 151.2 | 70% | 0.699 | 77% | 0.768 | S | S | * | * | 37.9 | 134.8 | 123.4 | -47.6 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 3 | E | 36.3 | Very low | 33.1 | Very low | 186 Ų | 186 | 146.5 Ų | 146.5 | 87% | 0.869 | 76% | 0.757 | S | S | * | * | trans | 106.7 | 115.1 | 131.7 | -86.1 | 162.2 | 119.6 | 0 | 0 | 119.3 | ||||
| 4 | Q | 27.3 | Very low | 32.9 | Very low | 181 Ų | 181 | 142.6 Ų | 142.6 | 85% | 0.846 | 76% | 0.757 | S | S | * | * | trans | -50.9 | 161.3 | 155.5 | -71 | 172.9 | -80.9 | 0 | 0 | 112.4 | ||||
| 5 | P | 44.5 | Very low | 33.1 | Very low | 112 Ų | 112 | 147.4 Ų | 147.4 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | -126.8 | 135.7 | 110 | 5.1 | 16.5 | 0 | 0 | 0 | 110.8 | |||||
| 6 | E | 34 | Very low | 32.8 | Very low | 167 Ų | 167 | 149.6 Ų | 149.6 | 78% | 0.78 | 77% | 0.774 | S | S | * | * | 60.4 | 140.3 | 90.5 | -82.8 | -162.7 | 111.3 | 0 | 0 | 113.4 | |||||
| 7 | L | 28.5 | Very low | 32.8 | Very low | 140 Ų | 140 | 145.6 Ų | 145.6 | 73% | 0.733 | 77% | 0.768 | S | S | * | * | cis | 177.9 | 173.4 | -16.9 | -138.8 | 163.5 | 0 | 0 | 0 | 103.1 | ||||
| 8 | Q | 32 | Very low | 32.5 | Very low | 165 Ų | 165 | 147.1 Ų | 147.1 | 77% | 0.771 | 78% | 0.777 | S | S | * | * | trans | 88.4 | 132.8 | 170.6 | -61.1 | -178.4 | -27.4 | 0 | 0 | 116.6 | ||||
| 9 | Q | 28.2 | Very low | 32.5 | Very low | 139 Ų | 139 | 146.4 Ų | 146.4 | 65% | 0.65 | 78% | 0.78 | S | S | * | * | cis | -175.2 | 141.6 | -14 | -128.7 | 169 | -33 | 0 | 0 | 105.4 | ||||
| 10 | N | 29.4 | Very low | 32 | Very low | 117 Ų | 117 | 143.7 Ų | 143.7 | 63% | 0.626 | 78% | 0.779 | S | S | * | * | trans | 54.2 | 146.1 | 136.6 | -73 | 19.6 | 0 | 0 | 0 | 119.4 | ||||
| 11 | E | 30.8 | Very low | 31.8 | Very low | 148 Ų | 148 | 143.5 Ų | 143.5 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | cis | 173.7 | 156 | 14.8 | -112.6 | 165.2 | 150.3 | 0 | 0 | 101.2 | ||||
| 12 | E | 30.6 | Very low | 31.4 | Very low | 150 Ų | 150 | 138.1 Ų | 138.1 | 70% | 0.701 | 77% | 0.767 | S | S | * | * | cis | -175.8 | 159.5 | -2.7 | -146.1 | -169.5 | 114.4 | 0 | 0 | 106.3 | ||||
| 13 | S | 32.5 | Very low | 30.8 | Very low | 90 Ų | 90 | 141 Ų | 141 | 63% | 0.629 | 77% | 0.773 | S | S | * | * | trans | 75.3 | 72.7 | 140.9 | -74.9 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 14 | A | 30.9 | Very low | 31.3 | Very low | 92 Ų | 92 | 137.6 Ų | 137.6 | 76% | 0.76 | 77% | 0.767 | S | S | * | * | 4.9 | 138.5 | 110.5 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 15 | K | 36 | Very low | 31.5 | Very low | 215 Ų | 215 | 134.7 Ų | 134.7 | 94% | 0.935 | 77% | 0.767 | S | S | * | * | trans | -130.2 | 110.3 | 144.2 | -140.9 | 173.2 | -173.5 | 179.8 | 0 | 109.9 | ||||
| 16 | Q | 28.5 | Very low | 30.7 | Very low | 182 Ų | 182 | 136.6 Ų | 136.6 | 85% | 0.85 | 77% | 0.771 | S | S | * | * | trans | -55.7 | 166.5 | 168.5 | -74.5 | 163.4 | -44 | 0 | 0 | 112 | ||||
| 17 | A | 32.4 | Very low | 30.4 | Very low | 82 Ų | 82 | 133.9 Ų | 133.9 | 68% | 0.678 | 77% | 0.77 | S | S | * | * | cis | -154.9 | 126.3 | 25.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 18 | N | 27.2 | Very low | 30.5 | Very low | 172 Ų | 172 | 136.4 Ų | 136.4 | 92% | 0.92 | 78% | 0.778 | S | S | * | * | trans | -109.3 | 124.2 | 152.7 | -83.7 | -23.4 | 0 | 0 | 0 | 105.8 | ||||
| 19 | T | 32.1 | Very low | 30.3 | Very low | 135 Ų | 135 | 135.4 Ų | 135.4 | 83% | 0.828 | 78% | 0.783 | S | S | * | * | trans | -121.1 | 104.9 | 170.2 | -52.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 20 | A | 23.6 | Very low | 30.4 | Very low | 92 Ų | 92 | 140.2 Ų | 140.2 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | trans | -110.3 | 122.9 | 162.8 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 21 | T | 27.6 | Very low | 30.5 | Very low | 139 Ų | 139 | 143.8 Ų | 143.8 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | trans | -164.4 | 140.7 | 149.2 | -22.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 22 | A | 30.1 | Very low | 30.2 | Very low | 96 Ų | 96 | 140.5 Ų | 140.5 | 79% | 0.793 | 81% | 0.811 | S | S | * | * | trans | 95.8 | 101.4 | 143.8 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 23 | I | 25.3 | Very low | 30 | Very low | 162 Ų | 162 | 141.8 Ų | 141.8 | 83% | 0.831 | 82% | 0.817 | S | S | * | * | trans | -80.5 | 171.7 | 151.2 | -62.3 | 165.8 | 0 | 0 | 0 | 108.3 | ||||
| 24 | P | 46.6 | Very low | 30.1 | Very low | 114 Ų | 114 | 145.5 Ų | 145.5 | 74% | 0.74 | 83% | 0.828 | S | S | * | * | cis | -126.2 | 173.9 | -25.2 | 29.9 | -11.6 | 0 | 0 | 0 | 113.7 | ||||
| 25 | S | 31.7 | Very low | 30 | Very low | 120 Ų | 120 | 146.5 Ų | 146.5 | 84% | 0.839 | 82% | 0.824 | S | S | * | * | trans | -156.6 | 135.9 | 140.9 | 56.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 26 | D | 26.6 | Very low | 29.6 | Very low | 152 Ų | 152 | 144.9 Ų | 144.9 | 81% | 0.813 | 83% | 0.825 | S | S | * | * | trans | -62.3 | 159.4 | -176.7 | -76.4 | -53.2 | 0 | 0 | 0 | 116.6 | ||||
| 27 | S | 28.3 | Very low | 29.5 | Very low | 110 Ų | 110 | 139.4 Ų | 139.4 | 77% | 0.769 | 82% | 0.817 | S | S | * | * | trans | 59.3 | 111 | 147.8 | 65.8 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 28 | E | 30.6 | Very low | 29.3 | Very low | 193 Ų | 193 | 144.7 Ų | 144.7 | 90% | 0.902 | 83% | 0.828 | S | S | * | * | -169.3 | 136.6 | 103.5 | -124.1 | -177.8 | 157.6 | 0 | 0 | 113 | R30 | E28-R30 PolarHBondContact O-N 3.1Š| |||
| 29 | V | 26.8 | Very low | 29.4 | Very low | 143 Ų | 143 | 141.3 Ų | 141.3 | 87% | 0.867 | 82% | 0.824 | S | S | * | * | trans | -67.6 | 114.6 | 176.5 | 171.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 30 | R | 31.9 | Very low | 29.4 | Very low | 240 Ų | 240 | 139.8 Ų | 139.8 | 91% | 0.906 | 82% | 0.819 | S | S | * | * | trans | -126.1 | 96.7 | 162.8 | -156.8 | 173.3 | -167.5 | 165.8 | 3.6 | 111.5 | E28 | E28-R30 PolarHBondContact O-N 3.1Š| ||
| 31 | K | 30.2 | Very low | 30.1 | Very low | 193 Ų | 193 | 141 Ų | 141 | 84% | 0.839 | 82% | 0.821 | S | S | * | * | trans | 24.1 | 120.8 | 144.9 | -74.3 | 178.9 | 175.7 | 178.8 | 0 | 117.5 | ||||
| 32 | G | 25.6 | Very low | 30.5 | Very low | 79 Ų | 79 | 141 Ų | 141 | 81% | 0.814 | 82% | 0.816 | S | S | * | * | trans | -51.9 | 136.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 33 | Q | 26.1 | Very low | 30.5 | Very low | 177 Ų | 177 | 141.7 Ų | 141.7 | 83% | 0.827 | 81% | 0.811 | S | S | * | * | trans | -138.8 | 87.8 | 149.4 | -169.5 | 173.2 | -3.8 | 0 | 0 | 105.3 | V35 | Q33-V35 PolarHBondContact O-N 3.28Š| ||
| 34 | I | 33.1 | Very low | 30.8 | Very low | 167 Ų | 167 | 140.8 Ų | 140.8 | 86% | 0.856 | 81% | 0.812 | S | S | * | * | trans | -86.8 | 101.7 | 171.2 | -60.6 | 177.2 | 0 | 0 | 0 | 105.8 | L36 | I34-L36 PolarHBondContact O-N 3.41Š| ||
| 35 | V | 30.7 | Very low | 30 | Very low | 114 Ų | 114 | 140.9 Ų | 140.9 | 69% | 0.691 | 81% | 0.811 | S | S | * | * | trans | -59.3 | 125.3 | 168.6 | 174.1 | 0 | 0 | 0 | 0 | 107.8 | Q33 G37 | Q33-V35 PolarHBondContact O-N 3.28Å; V35-G37 VanDerWaalsContact C-N 3.31Å; V35-G37 PolarHBondContact O-N 3.06Å | ||
| 36 | L | 27.2 | Very low | 30.2 | Very low | 181 Ų | 181 | 139.8 Ų | 139.8 | 95% | 0.948 | 81% | 0.809 | S | S | * | * | trans | -58.4 | 91.4 | 169 | -90.8 | 137.6 | 0 | 0 | 0 | 109.1 | I34 | I34-L36 PolarHBondContact O-N 3.41Š| ||
| 37 | G | 26.9 | Very low | 30.4 | Very low | 67 Ų | 67 | 137.1 Ų | 137.1 | 69% | 0.691 | 80% | 0.802 | S | S | * | * | trans | -105.4 | 124 | 166.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | V35 | V35-G37 VanDerWaalsContact C-N 3.31Å; V35-G37 PolarHBondContact O-N 3.06Å | ||
| 38 | E | 27.9 | Very low | 30.7 | Very low | 192 Ų | 192 | 139.6 Ų | 139.6 | 90% | 0.897 | 81% | 0.806 | S | S | * | * | trans | -47.9 | 141.6 | -178.6 | -77 | 165.9 | 115.4 | 0 | 0 | 115.2 | ||||
| 39 | A | 29.4 | Very low | 30.9 | Very low | 101 Ų | 101 | 138.6 Ų | 138.6 | 84% | 0.835 | 80% | 0.801 | S | S | * | * | trans | 52.4 | 89.9 | 144.5 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 40 | S | 32.3 | Very low | 31.3 | Very low | 104 Ų | 104 | 137.9 Ų | 137.9 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -154.7 | 108.5 | 139.9 | -172.6 | 0 | 0 | 0 | 0 | 110 | D42 | S40-D42 PolarHBondContact O-N 3.05Š| ||
| 41 | S | 37.5 | Very low | 31.8 | Very low | 116 Ų | 116 | 133 Ų | 133 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -80.3 | 99.5 | 169.8 | 53.2 | 0 | 0 | 0 | 0 | 108.9 | V43 | S41-V43 PolarHBondContact O-N 3.26Å; S41-V43 VanDerWaalsContact O-N 3.15Å | ||
| 42 | D | 35.5 | Very low | 32.3 | Very low | 139 Ų | 139 | 128.8 Ų | 128.8 | 74% | 0.743 | 78% | 0.782 | S | S | * | * | trans | -70.8 | 104.1 | 169.8 | -77.3 | -21.5 | 0 | 0 | 0 | 110.5 | S40 | S40-D42 PolarHBondContact O-N 3.05Š| ||
| 43 | V | 31.1 | Very low | 33.4 | Very low | 112 Ų | 112 | 131.1 Ų | 131.1 | 68% | 0.679 | 78% | 0.783 | S | S | * | * | 15.7 | 109.7 | 126.7 | -172.7 | 0 | 0 | 0 | 0 | 115.9 | S41 V45 | S41-V43 PolarHBondContact O-N 3.26Å; S41-V43 VanDerWaalsContact O-N 3.15Å; V43-V45 HydrophobicContact CG1-CB 4.21Å; V43-V45 HydrophobicContact CG1-CG2 3.54Å | |||
| 44 | V | 32 | Very low | 34.2 | Very low | 142 Ų | 142 | 133 Ų | 133 | 86% | 0.861 | 78% | 0.783 | S | S | * | * | trans | -115.6 | 95.3 | 146.7 | 179.6 | 0 | 0 | 0 | 0 | 106.9 | A46 | V44-A46 PolarHBondContact O-N 3.44Š| ||
| 45 | V | 29.3 | Very low | 34.5 | Very low | 117 Ų | 117 | 131.8 Ų | 131.8 | 71% | 0.709 | 78% | 0.778 | S | S | * | * | trans | -83.3 | 102.4 | 169.8 | 166.5 | 0 | 0 | 0 | 0 | 107.2 | V43 S47 | V43-V45 HydrophobicContact CG1-CB 4.21Å; V43-V45 HydrophobicContact CG1-CG2 3.54Å; V45-S47 PolarHBondContact O-N 3.27Å | ||
| 46 | A | 36.2 | Very low | 34.9 | Very low | 97 Ų | 97 | 133.7 Ų | 133.7 | 80% | 0.802 | 78% | 0.784 | S | S | * | * | trans | -82.4 | 97.4 | 159.7 | 0 | 0 | 0 | 0 | 0 | 107.5 | V44 | V44-A46 PolarHBondContact O-N 3.44Š| ||
| 47 | S | 29.2 | Very low | 35.7 | Very low | 95 Ų | 95 | 130 Ų | 130 | 66% | 0.664 | 77% | 0.771 | S | S | * | * | trans | -71.2 | 136.6 | 159.9 | -179.9 | 0 | 0 | 0 | 0 | 108.4 | V45 | V45-S47 PolarHBondContact O-N 3.27Š| ||
| 48 | L | 34.8 | Very low | 36.3 | Very low | 162 Ų | 162 | 132.2 Ų | 132.2 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | -174.4 | 120.9 | 127.5 | -93.7 | 154.2 | 0 | 0 | 0 | 110.1 | |||||
| 49 | E | 36.1 | Very low | 37.1 | Very low | 173 Ų | 173 | 128.7 Ų | 128.7 | 81% | 0.808 | 77% | 0.767 | S | S | * | * | trans | 94.2 | 115.4 | 162.9 | -67 | -174.1 | 154.4 | 0 | 0 | 120.3 | ||||
| 50 | P | 35.2 | Very low | 37.5 | Very low | 128 Ų | 128 | 133.6 Ų | 133.6 | 83% | 0.831 | 77% | 0.77 | S | S | * | * | trans | -79.7 | 126.2 | 178.6 | 31.9 | -30.7 | 0 | 0 | 0 | 110.9 | D52 | P50-D52 PolarHBondContact O-N 3.38Š| ||
| 51 | V | 41.7 | Very low | 37.8 | Very low | 138 Ų | 138 | 138 Ų | 138 | 84% | 0.836 | 78% | 0.776 | S | S | * | * | trans | -76.8 | 108.6 | 171.4 | 178.6 | 0 | 0 | 0 | 0 | 108.4 | P53 | V51-P53 WeakPolarHBondContact O-CD 3.34Š| ||
| 52 | D | 40 | Very low | 37.8 | Very low | 103 Ų | 103 | 138.2 Ų | 138.2 | 55% | 0.551 | 78% | 0.775 | S | S | * | * | trans | -65.5 | 118.7 | 170 | -176.3 | -16.7 | 0 | 0 | 0 | 109.6 | P50 R54 | P50-D52 PolarHBondContact O-N 3.38Å; D52-R54 PolarHBondContact O-N 3.06Å; D52-R54 VanDerWaalsContact O-N 3.08Å; D52-R54 PolarHBondContact OD1-N 3.4Å | ||
| 53 | P | 49.9 | Very low | 38.1 | Very low | 128 Ų | 128 | 136.1 Ų | 136.1 | 83% | 0.831 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | 5.9 | -175.6 | 29.6 | -33.9 | 0 | 0 | 0 | 114.5 | V51 | V51-P53 WeakPolarHBondContact O-CD 3.34Š|
| 54 | R | 42 | Very low | 38.4 | Very low | 218 Ų | 218 | 139.9 Ų | 139.9 | 82% | 0.823 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -7.3 | 176.4 | -78.7 | -176.2 | 165.9 | 172.4 | -2.4 | 115.9 | D52 N56 | D52-R54 PolarHBondContact O-N 3.06Å; D52-R54 VanDerWaalsContact O-N 3.08Å; D52-R54 PolarHBondContact OD1-N 3.4Å; R54-N56 PolarHBondContact O-N 2.76Å |
| 55 | N | 40.7 | Very low | 38.5 | Very low | 141 Ų | 141 | 141.7 Ų | 141.7 | 75% | 0.754 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -92.5 | 103.3 | 176.1 | -84.4 | -15 | 0 | 0 | 0 | 111.3 | ||
| 56 | N | 38.9 | Very low | 38.8 | Very low | 154 Ų | 154 | 141.5 Ų | 141.5 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 130.4 | 168 | -74.4 | -29.8 | 0 | 0 | 0 | 110.1 | R54 | R54-N56 PolarHBondContact O-N 2.76Š|
| 57 | P | 42.3 | Very low | 38.8 | Very low | 104 Ų | 104 | 143.3 Ų | 143.3 | 68% | 0.675 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 142.3 | -177.1 | 25.2 | -32.7 | 0 | 0 | 0 | 110.6 | ||
| 58 | P | 41.2 | Very low | 39 | Very low | 113 Ų | 113 | 147.4 Ų | 147.4 | 73% | 0.734 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 141.7 | -179.7 | 23 | -30.7 | 0 | 0 | 0 | 110.8 | F60 | P58-F60 PolarHBondContact O-N 3.13Š|
| 59 | P | 43.1 | Very low | 38.8 | Very low | 118 Ų | 118 | 145.1 Ų | 145.1 | 77% | 0.766 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 127.6 | -174.5 | 21.7 | -30.7 | 0 | 0 | 0 | 111.1 | K61 | P59-K61 PolarHBondContact O-N 3.1Š|
| 60 | F | 39 | Very low | 38.8 | Very low | 204 Ų | 204 | 141.9 Ų | 141.9 | 90% | 0.895 | 79% | 0.79 | S | S | * | * | trans | -52.4 | 106.3 | 174.2 | -70.5 | -85.3 | 0 | 0 | 0 | 109.9 | P58 | P58-F60 PolarHBondContact O-N 3.13Š| ||
| 61 | K | 37.5 | Very low | 38.7 | Very low | 195 Ų | 195 | 143.3 Ų | 143.3 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | trans | -76.7 | 123.4 | 162.9 | -75.4 | -174.6 | 178.3 | -179.2 | 0 | 107.5 | P59 A63 | P59-K61 PolarHBondContact O-N 3.1Å; K61-A63 PolarHBondContact O-N 2.89Å; K61-A63 VanDerWaalsContact O-N 3.12Å | ||
| 62 | P | 38.1 | Very low | 38.5 | Very low | 121 Ų | 121 | 144.1 Ų | 144.1 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | trans | -63.2 | 115.4 | 175.6 | -15 | 28.1 | 0 | 0 | 0 | 108.5 | E64 | P62-E64 PolarHBondContact O-N 3.18Š| ||
| 63 | A | 41.5 | Very low | 38.4 | Very low | 96 Ų | 96 | 147.6 Ų | 147.6 | 79% | 0.793 | 80% | 0.802 | S | S | * | * | trans | -66.9 | 122.3 | 170.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | K61 M65 | K61-A63 PolarHBondContact O-N 2.89Å; K61-A63 VanDerWaalsContact O-N 3.12Å; A63-M65 PolarHBondContact O-N 3.33Å | ||
| 64 | E | 38.2 | Very low | 38.1 | Very low | 190 Ų | 190 | 148.4 Ų | 148.4 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | trans | -51.2 | 127.3 | 177.2 | -71.6 | 171.9 | 140.4 | 0 | 0 | 111.2 | P62 S66 | P62-E64 PolarHBondContact O-N 3.18Å; E64-S66 VanDerWaalsContact C-N 3.34Å; E64-S66 PolarHBondContact O-N 3.29Å | ||
| 65 | M | 34.4 | Very low | 38.2 | Very low | 181 Ų | 181 | 142.3 Ų | 142.3 | 89% | 0.892 | 78% | 0.782 | S | S | * | * | trans | -68.1 | 89.6 | 170 | -77.6 | -179.2 | 176.1 | 0 | 0 | 109.5 | A63 V67 | A63-M65 PolarHBondContact O-N 3.33Å; M65-V67 PolarHBondContact O-N 3.5Å | ||
| 66 | S | 34.9 | Very low | 38.9 | Very low | 112 Ų | 112 | 143 Ų | 143 | 78% | 0.783 | 78% | 0.78 | S | S | * | * | trans | -80.3 | 94.1 | 161.1 | -172.3 | 0 | 0 | 0 | 0 | 108.5 | E64 K68 | E64-S66 VanDerWaalsContact C-N 3.34Å; E64-S66 PolarHBondContact O-N 3.29Å; S66-K68 VanDerWaalsContact C-N 3.25Å; S66-K68 PolarHBondContact O-N 2.93Å | ||
| 67 | V | 37.3 | Very low | 39.9 | Very low | 136 Ų | 136 | 141.7 Ų | 141.7 | 82% | 0.824 | 76% | 0.764 | S | S | * | * | trans | -71 | 82.5 | 172.5 | -177.9 | 0 | 0 | 0 | 0 | 108.1 | M65 | M65-V67 PolarHBondContact O-N 3.5Š| ||
| 68 | K | 33.1 | Very low | 40.8 | Very low | 181 Ų | 181 | 140.7 Ų | 140.7 | 79% | 0.787 | 75% | 0.752 | S | S | * | * | trans | -117.1 | 99.9 | 160.3 | -162.8 | 171.8 | -175.5 | 178.8 | 0 | 107.4 | S66 P70 | S66-K68 VanDerWaalsContact C-N 3.25Å; S66-K68 PolarHBondContact O-N 2.93Å; K68-P70 WeakPolarHBondContact O-CD 3.48Å; K68-P70 VanDerWaalsContact O-N 3.08Å | ||
| 69 | S | 29.6 | Very low | 42.4 | Very low | 113 Ų | 113 | 141.7 Ų | 141.7 | 79% | 0.79 | 74% | 0.742 | S | S | * | * | trans | -48.1 | 109.9 | 178.1 | -162 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 70 | P | 36.9 | Very low | 43.8 | Very low | 106 Ų | 106 | 138.9 Ų | 138.9 | 69% | 0.688 | 72% | 0.72 | S | S | * | * | trans | -78.5 | 137 | 173.8 | -4 | 22.4 | 0 | 0 | 0 | 108.2 | K68 I72 | K68-P70 WeakPolarHBondContact O-CD 3.48Å; K68-P70 VanDerWaalsContact O-N 3.08Å; P70-I72 PolarHBondContact O-N 3.18Å | ||
| 71 | D | 33 | Very low | 45.3 | Very low | 158 Ų | 158 | 135.9 Ų | 135.9 | 85% | 0.845 | 71% | 0.709 | S | S | * | * | trans | -40.6 | 125.3 | 162.6 | -102.4 | -38.5 | 0 | 0 | 0 | 109.5 | Q73 | D71-Q73 PolarHBondContact O-N 2.95Š| ||
| 72 | I | 37.4 | Very low | 47.2 | Very low | 155 Ų | 155 | 133.2 Ų | 133.2 | 80% | 0.795 | 70% | 0.697 | S | S | * | * | trans | -72 | 77.6 | 178.6 | -55.9 | 168.4 | 0 | 0 | 0 | 106.9 | P70 I74 | P70-I72 PolarHBondContact O-N 3.18Å; I72-I74 PolarHBondContact O-N 3.18Å; I72-I74 VanDerWaalsContact O-N 3.15Å | ||
| 73 | Q | 37.1 | Very low | 48.8 | Very low | 176 Ų | 176 | 133.7 Ų | 133.7 | 82% | 0.822 | 70% | 0.704 | S | S | * | * | trans | -66.1 | 109.3 | 154.5 | -73.7 | -165.2 | -2.8 | 0 | 0 | 105.4 | D71 D75 | D71-Q73 PolarHBondContact O-N 2.95Å; Q73-D75 VanDerWaalsContact C-N 3.32Å; Q73-D75 PolarHBondContact O-N 2.82Å | ||
| 74 | I | 44.6 | Very low | 50.2 | Low | 144 Ų | 144 | 138 Ų | 138 | 74% | 0.738 | 71% | 0.705 | S | S | * | * | trans | -53.9 | 101.8 | 175.8 | -61.1 | 170.5 | 0 | 0 | 0 | 106.2 | I72 E76 | I72-I74 PolarHBondContact O-N 3.18Å; I72-I74 VanDerWaalsContact O-N 3.15Å; I74-E76 PolarHBondContact O-N 2.92Å | ||
| 75 | D | 44.1 | Very low | 51.8 | Low | 91 Ų | 91 | 130.2 Ų | 130.2 | 49% | 0.487 | 68% | 0.676 | S | S | . | * | trans | -68.8 | 98.2 | -178.1 | -158.9 | 14.4 | 0 | 0 | 0 | 106.3 | Q73 R77 | Q73-D75 VanDerWaalsContact C-N 3.32Å; Q73-D75 PolarHBondContact O-N 2.82Å; D75-R77 VanDerWaalsContact CG-CZ 3.42Å; D75-R77 PolarHBondContact O-N 2.96Å; D75-R77 VanDerWaalsContact OD1-CD 3.24Å; D75-R77 WeakPolarHBondContact OD1-CD 3.29Å; D75-R77 VanDerWaalsContact OD1-CG 3.29Å; D75-R77 WeakPolarHBondContact OD1-CG 3.34Å; D75-R77 IonicContact OD1-CZ 2.66Å; D75-R77 IonicContact OD1-NE 3.07Å; D75-R77 PolarHBondContact OD1-NE 3.21Å; D75-R77 IonicContact OD1-NH2 2.84Å; D75-R77 PolarHBondContact OD1-NH2 3.43Å; D75-R77 WeakPolarHBondContact OD2-CD 3.32Å; D75-R77 IonicContact OD2-CZ 3.1Å; D75-R77 IonicContact OD2-NE 3.56Å; D75-R77 PolarHBondContact OD2-NE 3.12Å; D75-R77 IonicContact OD2-NH1 2.8Å; D75-R77 PolarHBondContact OD2-NH1 3.05Å; D75-R77 VanDerWaalsContact OD2-NH1 3.07Å; D75-R77 IonicContact OD2-NH2 3.27Å | ||
| 76 | E | 54.5 | Low | 53.7 | Low | 155 Ų | 155 | 128.4 Ų | 128.4 | 72% | 0.724 | 66% | 0.663 | S | S | * | * | trans | -69 | 37.3 | -178.8 | -69 | -171.5 | 145.2 | 0 | 0 | 112.5 | I74 | I74-E76 PolarHBondContact O-N 2.92Š| ||
| 77 | R | 61.2 | Low | 55.6 | Low | 126 Ų | 126 | 128.7 Ų | 128.7 | 48% | 0.475 | 65% | 0.648 | S | S | . | * | trans | -89.5 | 109 | -179.2 | -64.8 | -179 | -165.9 | 163.3 | 9.4 | 109.2 | D75 Y79 | D75-R77 VanDerWaalsContact CG-CZ 3.42Å; D75-R77 PolarHBondContact O-N 2.96Å; D75-R77 VanDerWaalsContact OD1-CD 3.24Å; D75-R77 WeakPolarHBondContact OD1-CD 3.29Å; D75-R77 VanDerWaalsContact OD1-CG 3.29Å; D75-R77 WeakPolarHBondContact OD1-CG 3.34Å; D75-R77 IonicContact OD1-CZ 2.66Å; D75-R77 IonicContact OD1-NE 3.07Å; D75-R77 PolarHBondContact OD1-NE 3.21Å; D75-R77 IonicContact OD1-NH2 2.84Å; D75-R77 PolarHBondContact OD1-NH2 3.43Å; D75-R77 WeakPolarHBondContact OD2-CD 3.32Å; D75-R77 IonicContact OD2-CZ 3.1Å; D75-R77 IonicContact OD2-NE 3.56Å; D75-R77 PolarHBondContact OD2-NE 3.12Å; D75-R77 IonicContact OD2-NH1 2.8Å; D75-R77 PolarHBondContact OD2-NH1 3.05Å; D75-R77 VanDerWaalsContact OD2-NH1 3.07Å; D75-R77 IonicContact OD2-NH2 3.27Å; R77-Y79 HydrophobicContact CB-CE2 4.03Å | ||
| 78 | L | 60.4 | Low | 57.4 | Low | 83 Ų | 83 | 128.7 Ų | 128.7 | 44% | 0.435 | 64% | 0.636 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88.4 | 132.7 | 173.3 | -170.3 | 69.4 | 0 | 0 | 0 | 109.7 | A89 V94 | L78-A89 PolarHBondContact O-N 3.31Å; L78-V94 HydrophobicContact CD2-CG1 4.47Å; L78-V94 HydrophobicContact CD2-CG2 4.25Å |
| 79 | Y | 74.1 | Confident | 58.9 | Low | 135 Ų | 135 | 121 Ų | 121 | 53% | 0.529 | 61% | 0.607 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -108.4 | 131.8 | 174.6 | -67.1 | -94.9 | 0 | 0 | 0 | 109.1 | R77 Y87 K88 | R77-Y79 HydrophobicContact CB-CE2 4.03Å; Y79-Y87 WeakPolarHBondContact CA-O 3.46Å; Y79-K88 HydrophobicContact CD1-CB 4.36Å; Y79-K88 HydrophobicContact CE1-CB 4.14Å |
| 80 | I | 74.1 | Confident | 60.8 | Low | 58 Ų | 58 | 120.1 Ų | 120.1 | 30% | 0.297 | 59% | 0.593 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -109.5 | 126.9 | 176.7 | -59.6 | 178.2 | 0 | 0 | 0 | 108.5 | Y87 A89 V94 | I80-Y87 PolarHBondContact N-O 3.41Å; I80-Y87 PolarHBondContact O-N 2.93Å; I80-A89 HydrophobicContact CD1-CB 3.59Å; I80-A89 HydrophobicContact CG1-CB 3.92Å; I80-V94 HydrophobicContact CD1-CG1 4.16Å; I80-V94 HydrophobicContact CD1-CG2 3.53Å |
| 81 | E | 70.1 | Confident | 62.2 | Low | 142 Ų | 142 | 122.6 Ų | 122.6 | 66% | 0.664 | 59% | 0.589 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -80.1 | 126.9 | 172.8 | -168.7 | 175.7 | -178 | 0 | 0 | 110.2 | F86 | E81-F86 HydrophobicContact CB-CD1 3.85Å; E81-F86 HydrophobicContact CB-CE1 3.66Å; E81-F86 HydrophobicContact CB-CZ 4.49Å; E81-F86 HydrophobicContact CG-CD1 4.09Å; E81-F86 HydrophobicContact CG-CE1 3.66Å; E81-F86 HydrophobicContact CG-CZ 4Å |
| 82 | K | 76.9 | Confident | 63.8 | Low | 138 Ų | 138 | 124.9 Ų | 124.9 | 60% | 0.6 | 59% | 0.586 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -119.5 | 168.8 | 168.1 | -66.5 | -174.4 | 177.1 | -177.4 | 0 | 108.7 | K84 G85 Y87 | K82-K84 PolarHBondContact O-N 3.22Å; K82-G85 PolarHBondContact N-O 3.44Å; K82-G85 PolarHBondContact O-N 3.47Å; K82-G85 VanDerWaalsContact O-O 3.13Å; K82-Y87 HydrophobicContact CB-CD2 4.07Å; K82-Y87 HydrophobicContact CB-CE2 4Å; K82-Y87 HydrophobicContact CD-CD2 4.04Å; K82-Y87 HydrophobicContact CD-CE2 4.27Å; K82-Y87 HydrophobicContact CG-CD2 4.14Å; K82-Y87 HydrophobicContact CG-CE2 4.48Å |
| 83 | S | 71.7 | Confident | 64.8 | Low | 132 Ų | 132 | 123.7 Ų | 123.7 | 92% | 0.923 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56 | -16.9 | -177.1 | 56.9 | 0 | 0 | 0 | 0 | 115.9 | ||
| 84 | K | 70.4 | Confident | 66 | Low | 186 Ų | 186 | 116.9 Ų | 116.9 | 81% | 0.809 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.3 | 12.1 | 177.2 | -66.1 | -171.7 | 176.9 | -178.2 | 0 | 114.3 | K82 | K82-K84 PolarHBondContact O-N 3.22Š|
| 85 | G | 72.1 | Confident | 66.9 | Low | 27 Ų | 27 | 116.1 Ų | 116.1 | 28% | 0.278 | 54% | 0.54 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 129.9 | -168.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | K82 Y87 | K82-G85 PolarHBondContact N-O 3.44Å; K82-G85 PolarHBondContact O-N 3.47Å; K82-G85 VanDerWaalsContact O-O 3.13Å; G85-Y87 WeakPolarHBondContact O-CD2 3.38Å |
| 86 | F | 75.3 | Confident | 67.7 | Low | 142 Ų | 142 | 120 Ų | 120 | 62% | 0.623 | 55% | 0.553 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -93.4 | 128 | -176.7 | -61.4 | -85.9 | 0 | 0 | 0 | 111.4 | E81 | E81-F86 HydrophobicContact CB-CD1 3.85Å; E81-F86 HydrophobicContact CB-CE1 3.66Å; E81-F86 HydrophobicContact CB-CZ 4.49Å; E81-F86 HydrophobicContact CG-CD1 4.09Å; E81-F86 HydrophobicContact CG-CE1 3.66Å; E81-F86 HydrophobicContact CG-CZ 4Å |
| 87 | Y | 72.8 | Confident | 68 | Low | 119 Ų | 119 | 118.6 Ų | 118.6 | 47% | 0.467 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 136.6 | 177.1 | -63.9 | -91.1 | 0 | 0 | 0 | 110.2 | Y79 I80 K82 G85 A89 | Y79-Y87 WeakPolarHBondContact CA-O 3.46Å; I80-Y87 PolarHBondContact N-O 3.41Å; I80-Y87 PolarHBondContact O-N 2.93Å; K82-Y87 HydrophobicContact CB-CD2 4.07Å; K82-Y87 HydrophobicContact CB-CE2 4Å; K82-Y87 HydrophobicContact CD-CD2 4.04Å; K82-Y87 HydrophobicContact CD-CE2 4.27Å; K82-Y87 HydrophobicContact CG-CD2 4.14Å; K82-Y87 HydrophobicContact CG-CE2 4.48Å; G85-Y87 WeakPolarHBondContact O-CD2 3.38Å; Y87-A89 PolarHBondContact O-N 3.31Å |
| 88 | K | 75.6 | Confident | 68 | Low | 135 Ų | 135 | 118.9 Ų | 118.9 | 59% | 0.587 | 56% | 0.56 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -70.7 | 125.7 | 174 | -176.8 | 179.9 | 175.6 | -179.8 | 0 | 109.1 | Y79 | Y79-K88 HydrophobicContact CD1-CB 4.36Å; Y79-K88 HydrophobicContact CE1-CB 4.14Å |
| 89 | A | 64.7 | Low | 67.2 | Low | 21 Ų | 21 | 119.1 Ų | 119.1 | 17% | 0.174 | 57% | 0.568 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -126.9 | 137.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | L78 I80 Y87 V94 | L78-A89 PolarHBondContact O-N 3.31Å; I80-A89 HydrophobicContact CD1-CB 3.59Å; I80-A89 HydrophobicContact CG1-CB 3.92Å; Y87-A89 PolarHBondContact O-N 3.31Å; A89-V94 HydrophobicContact CB-CG2 3.71Å |
| 90 | D | 70.8 | Confident | 65.5 | Low | 94 Ų | 94 | 117.6 Ų | 117.6 | 50% | 0.503 | 57% | 0.574 | S | S | . | * | trans | -72.9 | 128.6 | 171.5 | -171.7 | -36.5 | 0 | 0 | 0 | 109.2 | R92 Q93 V94 | D90-R92 PolarHBondContact O-N 2.87Å; D90-R92 VanDerWaalsContact O-N 3.08Å; D90-R92 PolarHBondContact OD1-N 2.96Å; D90-Q93 PolarHBondContact O-N 3.45Å; D90-V94 PolarHBondContact O-N 3.38Å | ||
| 91 | R | 65 | Low | 64 | Low | 157 Ų | 157 | 123.7 Ų | 123.7 | 59% | 0.592 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -50.4 | -35.9 | -179.6 | -175.6 | 176.4 | 169.8 | 148.6 | -1.8 | 112.3 | V94 E95 | R91-V94 PolarHBondContact O-N 3.16Å; R91-E95 PolarHBondContact O-N 3.02Å; R91-E95 VanDerWaalsContact O-N 3.16Å |
| 92 | R | 66.3 | Low | 62.7 | Low | 207 Ų | 207 | 121.7 Ų | 121.7 | 78% | 0.781 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -68.8 | -33.6 | -179.9 | -65 | -177.4 | 177.3 | -179.9 | 0.6 | 113 | D90 K96 | D90-R92 PolarHBondContact O-N 2.87Å; D90-R92 VanDerWaalsContact O-N 3.08Å; D90-R92 PolarHBondContact OD1-N 2.96Å; R92-K96 PolarHBondContact O-N 3.46Å |
| 93 | Q | 59.1 | Low | 61 | Low | 130 Ų | 130 | 124.3 Ų | 124.3 | 61% | 0.607 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -74.5 | -36 | 176.7 | -74.9 | -172.4 | 14.8 | 0 | 0 | 111.8 | D90 K96 I97 | D90-Q93 PolarHBondContact O-N 3.45Å; Q93-K96 PolarHBondContact O-N 3.23Å; Q93-I97 WeakPolarHBondContact O-CD1 3.06Å; Q93-I97 VanDerWaalsContact O-CG1 3.26Å; Q93-I97 WeakPolarHBondContact O-CG1 3.38Å; Q93-I97 PolarHBondContact O-N 2.87Å |
| 94 | V | 62.1 | Low | 59.8 | Low | 32 Ų | 32 | 123.3 Ų | 123.3 | 19% | 0.194 | 61% | 0.606 | C | S | . | * | H | α-helix | trans | -67.5 | -41.8 | 179.5 | -175.4 | 0 | 0 | 0 | 0 | 111.1 | L78 I80 A89 D90 R91 K96 I97 L98 | L78-V94 HydrophobicContact CD2-CG1 4.47Å; L78-V94 HydrophobicContact CD2-CG2 4.25Å; I80-V94 HydrophobicContact CD1-CG1 4.16Å; I80-V94 HydrophobicContact CD1-CG2 3.53Å; A89-V94 HydrophobicContact CB-CG2 3.71Å; D90-V94 PolarHBondContact O-N 3.38Å; R91-V94 PolarHBondContact O-N 3.16Å; V94-K96 VanDerWaalsContact C-N 3.29Å; V94-K96 PolarHBondContact O-N 3.47Å; V94-I97 PolarHBondContact O-N 3.43Å; V94-L98 WeakPolarHBondContact O-CB 3.42Å; V94-L98 PolarHBondContact O-N 3.38Å |
| 95 | E | 63.7 | Low | 58.5 | Low | 128 Ų | 128 | 121.1 Ų | 121.1 | 60% | 0.598 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -63.8 | -34.6 | 176.9 | -170.3 | 162.4 | -155.5 | 0 | 0 | 112.6 | R91 S99 | R91-E95 PolarHBondContact O-N 3.02Å; R91-E95 VanDerWaalsContact O-N 3.16Å; E95-S99 PolarHBondContact O-N 3.24Å; E95-S99 PolarHBondContact O-OG 2.96Å |
| 96 | K | 60.1 | Low | 57 | Low | 173 Ų | 173 | 123.7 Ų | 123.7 | 75% | 0.752 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -69.4 | -36.5 | 173.7 | -167.3 | 176.2 | -177.9 | -178.6 | 0 | 112.9 | R92 Q93 V94 | R92-K96 PolarHBondContact O-N 3.46Å; Q93-K96 PolarHBondContact O-N 3.23Å; V94-K96 VanDerWaalsContact C-N 3.29Å; V94-K96 PolarHBondContact O-N 3.47Å |
| 97 | I | 61.3 | Low | 55.8 | Low | 126 Ų | 126 | 121.8 Ų | 121.8 | 65% | 0.646 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -79.8 | -33 | -179.8 | -64.5 | 163.1 | 0 | 0 | 0 | 111.7 | Q93 V94 S99 P100 | Q93-I97 WeakPolarHBondContact O-CD1 3.06Å; Q93-I97 VanDerWaalsContact O-CG1 3.26Å; Q93-I97 WeakPolarHBondContact O-CG1 3.38Å; Q93-I97 PolarHBondContact O-N 2.87Å; V94-I97 PolarHBondContact O-N 3.43Å; I97-S99 PolarHBondContact O-N 2.92Å; I97-P100 WeakPolarHBondContact O-CD 3.38Å |
| 98 | L | 61.8 | Low | 54.9 | Low | 132 Ų | 132 | 120.9 Ų | 120.9 | 69% | 0.691 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -75.4 | -6.1 | 177.6 | -140.1 | 78.3 | 0 | 0 | 0 | 113.2 | V94 P100 | V94-L98 WeakPolarHBondContact O-CB 3.42Å; V94-L98 PolarHBondContact O-N 3.38Å; L98-P100 WeakPolarHBondContact O-CD 3.49Å |
| 99 | S | 42.5 | Very low | 54 | Low | 88 Ų | 88 | 121.1 Ų | 121.1 | 62% | 0.615 | 65% | 0.645 | S | S | * | * | trans | -116.6 | 60.2 | 178.3 | -48.7 | 0 | 0 | 0 | 0 | 111.8 | E95 I97 | E95-S99 PolarHBondContact O-N 3.24Å; E95-S99 PolarHBondContact O-OG 2.96Å; I97-S99 PolarHBondContact O-N 2.92Å | ||
| 100 | P | 40.3 | Very low | 54.4 | Low | 102 Ų | 102 | 123.7 Ų | 123.7 | 66% | 0.662 | 66% | 0.656 | S | S | * | * | trans | -81 | 126.7 | 166.2 | 32.6 | -24.8 | 0 | 0 | 0 | 109 | I97 L98 | I97-P100 WeakPolarHBondContact O-CD 3.38Å; L98-P100 WeakPolarHBondContact O-CD 3.49Å | ||
| 101 | E | 41.4 | Very low | 54.5 | Low | 186 Ų | 186 | 121.5 Ų | 121.5 | 87% | 0.869 | 65% | 0.651 | S | S | * | * | trans | 71.4 | 68 | 152.7 | -143.7 | 174.9 | 139.4 | 0 | 0 | 117.6 | ||||
| 102 | S | 42 | Very low | 55 | Low | 101 Ų | 101 | 120.2 Ų | 120.2 | 71% | 0.706 | 65% | 0.649 | S | S | * | * | trans | -131.3 | 88.7 | 132.6 | -170.8 | 0 | 0 | 0 | 0 | 107.6 | V104 | S102-V104 PolarHBondContact O-N 3.38Š| ||
| 103 | E | 42.9 | Very low | 55.7 | Low | 193 Ų | 193 | 115.1 Ų | 115.1 | 90% | 0.902 | 64% | 0.635 | S | S | * | * | trans | -64.7 | 66.8 | 156.6 | -73.1 | -175.7 | 147.2 | 0 | 0 | 108.9 | ||||
| 104 | V | 46.1 | Very low | 56.6 | Low | 110 Ų | 110 | 114.8 Ų | 114.8 | 67% | 0.667 | 63% | 0.628 | S | S | * | * | S | Bend | trans | -140 | 102.6 | 157.7 | -173.5 | 0 | 0 | 0 | 0 | 107 | S102 A106 | S102-V104 PolarHBondContact O-N 3.38Å; V104-A106 PolarHBondContact O-N 2.96Å |
| 105 | T | 42 | Very low | 57.4 | Low | 141 Ų | 141 | 118 Ų | 118 | 87% | 0.865 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -24.7 | 119.4 | 172.4 | -38.5 | 0 | 0 | 0 | 0 | 114.9 | ||
| 106 | A | 42 | Very low | 58.3 | Low | 80 Ų | 80 | 116.6 Ų | 116.6 | 66% | 0.661 | 64% | 0.636 | S | S | * | * | trans | 78.2 | 98.2 | 163.9 | 0 | 0 | 0 | 0 | 0 | 120.2 | V104 | V104-A106 PolarHBondContact O-N 2.96Š| ||
| 107 | P | 49 | Very low | 59.4 | Low | 102 Ų | 102 | 113.7 Ų | 113.7 | 66% | 0.662 | 63% | 0.625 | S | S | * | * | trans | -130 | 19.5 | 148.9 | 38 | -26 | 0 | 0 | 0 | 115.3 | M109 | P107-M109 VanDerWaalsContact C-N 3.33Š| ||
| 108 | S | 54.8 | Low | 60.5 | Low | 101 Ų | 101 | 113.3 Ų | 113.3 | 71% | 0.706 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -75.2 | -21 | 172.1 | 66.7 | 0 | 0 | 0 | 0 | 113.5 | ||
| 109 | M | 56.4 | Low | 61.5 | Low | 139 Ų | 139 | 112 Ų | 112 | 69% | 0.685 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -71.8 | -35.4 | 177.3 | -68.2 | -166.7 | 73.2 | 0 | 0 | 112.5 | P107 A111 K112 E113 | P107-M109 VanDerWaalsContact C-N 3.33Å; M109-A111 PolarHBondContact O-N 2.86Å; M109-K112 PolarHBondContact O-N 3.45Å; M109-E113 WeakPolarHBondContact O-CB 3.43Å; M109-E113 PolarHBondContact O-N 3.21Å |
| 110 | D | 73.4 | Confident | 63.6 | Low | 75 Ų | 75 | 111.4 Ų | 111.4 | 40% | 0.401 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -69.2 | -35 | -171.3 | -178 | 38.3 | 0 | 0 | 0 | 113.1 | R114 | D110-R114 VanDerWaalsContact CG-CZ 3.45Å; D110-R114 VanDerWaalsContact CG-NH2 3.33Å; D110-R114 WeakPolarHBondContact O-CB 3.39Å; D110-R114 WeakPolarHBondContact O-CG 3.34Å; D110-R114 PolarHBondContact O-N 3.21Å; D110-R114 VanDerWaalsContact O-N 3.12Å; D110-R114 IonicContact OD1-CZ 3.5Å; D110-R114 IonicContact OD1-NH1 3.06Å; D110-R114 PolarHBondContact OD1-NH1 3.48Å; D110-R114 IonicContact OD1-NH2 3.72Å; D110-R114 IonicContact OD2-CZ 3.93Å; D110-R114 IonicContact OD2-NH1 2.63Å; D110-R114 PolarHBondContact OD2-NH1 3.27Å; D110-R114 IonicContact OD2-NH2 2.87Å; D110-R114 PolarHBondContact OD2-NH2 2.91Å |
| 111 | A | 72.6 | Confident | 65.7 | Low | 48 Ų | 48 | 109.4 Ų | 109.4 | 40% | 0.397 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -70.9 | -41.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | M109 R114 I115 | M109-A111 PolarHBondContact O-N 2.86Å; A111-R114 PolarHBondContact O-N 3.23Å; A111-I115 VanDerWaalsContact O-CG1 3.29Å; A111-I115 WeakPolarHBondContact O-CG1 3.47Å; A111-I115 PolarHBondContact O-N 2.92Å; A111-I115 VanDerWaalsContact O-N 3.1Å |
| 112 | K | 76.2 | Confident | 67.7 | Low | 131 Ų | 131 | 102.1 Ų | 102.1 | 57% | 0.57 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -66.7 | -45.5 | 178.9 | -168.2 | -176.5 | -176.4 | -105.4 | 0 | 111 | M109 R114 I115 E116 | M109-K112 PolarHBondContact O-N 3.45Å; K112-R114 VanDerWaalsContact C-N 3.35Å; K112-R114 PolarHBondContact O-N 2.7Å; K112-I115 PolarHBondContact O-N 3.09Å; K112-E116 VanDerWaalsContact CE-OE1 3.31Å; K112-E116 WeakPolarHBondContact CE-OE1 3.25Å; K112-E116 IonicContact NZ-OE1 2.94Å; K112-E116 PolarHBondContact NZ-OE1 3.46Å; K112-E116 WeakPolarHBondContact O-CG 3.22Å; K112-E116 PolarHBondContact O-N 3.41Å |
| 113 | E | 79.3 | Confident | 69.7 | Low | 100 Ų | 100 | 99.7 Ų | 99.7 | 47% | 0.467 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.3 | -41.1 | 177.7 | -170.1 | 179.1 | 169.5 | 0 | 0 | 111.5 | M109 I115 E116 Q117 | M109-E113 WeakPolarHBondContact O-CB 3.43Å; M109-E113 PolarHBondContact O-N 3.21Å; E113-I115 PolarHBondContact O-N 3.22Å; E113-E116 PolarHBondContact O-N 3.08Å; E113-Q117 WeakPolarHBondContact O-CB 3.19Å; E113-Q117 VanDerWaalsContact O-CG 3.25Å; E113-Q117 WeakPolarHBondContact O-CG 3.29Å; E113-Q117 PolarHBondContact O-N 2.93Å; E113-Q117 PolarHBondContact OE1-NE2 2.8Å |
| 114 | R | 78.1 | Confident | 71.9 | Confident | 122 Ų | 122 | 93 Ų | 93 | 46% | 0.46 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 173 | -84.5 | -168 | -71.8 | -91.4 | -4.1 | 113.3 | D110 A111 K112 Q117 I118 | D110-R114 VanDerWaalsContact CG-CZ 3.45Å; D110-R114 VanDerWaalsContact CG-NH2 3.33Å; D110-R114 WeakPolarHBondContact O-CB 3.39Å; D110-R114 WeakPolarHBondContact O-CG 3.34Å; D110-R114 PolarHBondContact O-N 3.21Å; D110-R114 VanDerWaalsContact O-N 3.12Å; D110-R114 IonicContact OD1-CZ 3.5Å; D110-R114 IonicContact OD1-NH1 3.06Å; D110-R114 PolarHBondContact OD1-NH1 3.48Å; D110-R114 IonicContact OD1-NH2 3.72Å; D110-R114 IonicContact OD2-CZ 3.93Å; D110-R114 IonicContact OD2-NH1 2.63Å; D110-R114 PolarHBondContact OD2-NH1 3.27Å; D110-R114 IonicContact OD2-NH2 2.87Å; D110-R114 PolarHBondContact OD2-NH2 2.91Å; A111-R114 PolarHBondContact O-N 3.23Å; K112-R114 VanDerWaalsContact C-N 3.35Å; K112-R114 PolarHBondContact O-N 2.7Å; R114-Q117 PolarHBondContact O-N 2.94Å; R114-I118 VanDerWaalsContact O-CG1 3.28Å; R114-I118 WeakPolarHBondContact O-CG1 3.34Å; R114-I118 PolarHBondContact O-N 3.2Å |
| 115 | I | 79.8 | Confident | 73.8 | Confident | 100 Ų | 100 | 90.6 Ų | 90.6 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.3 | -46.8 | 178 | -67.2 | 164.8 | 0 | 0 | 0 | 109.6 | A111 K112 E113 Q117 I118 D119 | A111-I115 VanDerWaalsContact O-CG1 3.29Å; A111-I115 WeakPolarHBondContact O-CG1 3.47Å; A111-I115 PolarHBondContact O-N 2.92Å; A111-I115 VanDerWaalsContact O-N 3.1Å; K112-I115 PolarHBondContact O-N 3.09Å; E113-I115 PolarHBondContact O-N 3.22Å; I115-Q117 VanDerWaalsContact C-N 3.3Å; I115-Q117 PolarHBondContact O-N 3.15Å; I115-I118 PolarHBondContact O-N 3.45Å; I115-I118 VanDerWaalsContact O-N 3.15Å; I115-D119 PolarHBondContact O-N 3.45Å |
| 116 | E | 81.8 | Confident | 75.9 | Confident | 99 Ų | 99 | 86.8 Ų | 86.8 | 46% | 0.463 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.4 | -38.2 | 177 | -72.4 | 176.9 | -174.3 | 0 | 0 | 112.5 | K112 E113 C120 | K112-E116 VanDerWaalsContact CE-OE1 3.31Å; K112-E116 WeakPolarHBondContact CE-OE1 3.25Å; K112-E116 IonicContact NZ-OE1 2.94Å; K112-E116 PolarHBondContact NZ-OE1 3.46Å; K112-E116 WeakPolarHBondContact O-CG 3.22Å; K112-E116 PolarHBondContact O-N 3.41Å; E113-E116 PolarHBondContact O-N 3.08Å; E116-C120 VanDerWaalsContact O-CB 3.3Å; E116-C120 WeakPolarHBondContact O-CB 3.38Å; E116-C120 PolarHBondContact O-N 2.85Å |
| 117 | Q | 84.5 | Confident | 78.1 | Confident | 111 Ų | 111 | 87 Ų | 87 | 52% | 0.519 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.9 | -41.8 | 175.5 | -75.3 | 175.5 | 5.4 | 0 | 0 | 112.5 | E113 R114 I115 C120 A121 | E113-Q117 WeakPolarHBondContact O-CB 3.19Å; E113-Q117 VanDerWaalsContact O-CG 3.25Å; E113-Q117 WeakPolarHBondContact O-CG 3.29Å; E113-Q117 PolarHBondContact O-N 2.93Å; E113-Q117 PolarHBondContact OE1-NE2 2.8Å; R114-Q117 PolarHBondContact O-N 2.94Å; I115-Q117 VanDerWaalsContact C-N 3.3Å; I115-Q117 PolarHBondContact O-N 3.15Å; Q117-C120 PolarHBondContact O-N 3.07Å; Q117-A121 WeakPolarHBondContact O-CB 3.45Å; Q117-A121 PolarHBondContact O-N 2.79Å |
| 118 | I | 83.5 | Confident | 80.1 | Confident | 118 Ų | 118 | 83.9 Ų | 83.9 | 61% | 0.605 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -65 | -42.7 | 176.8 | -68.8 | 165.7 | 0 | 0 | 0 | 110.3 | R114 I115 A121 G122 | R114-I118 VanDerWaalsContact O-CG1 3.28Å; R114-I118 WeakPolarHBondContact O-CG1 3.34Å; R114-I118 PolarHBondContact O-N 3.2Å; I115-I118 PolarHBondContact O-N 3.45Å; I115-I118 VanDerWaalsContact O-N 3.15Å; I118-A121 PolarHBondContact O-N 3.37Å; I118-G122 PolarHBondContact O-N 3.48Å |
| 119 | D | 82.9 | Confident | 81.6 | Confident | 104 Ų | 104 | 80.2 Ų | 80.2 | 56% | 0.556 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -64.9 | -41.2 | 177.8 | -70.7 | -20.6 | 0 | 0 | 0 | 111.3 | I115 G122 A123 | I115-D119 PolarHBondContact O-N 3.45Å; D119-G122 PolarHBondContact O-N 3.35Å; D119-A123 WeakPolarHBondContact O-CB 3.19Å; D119-A123 PolarHBondContact O-N 3.38Å |
| 120 | C | 85.5 | Confident | 83.1 | Confident | 77 Ų | 77 | 79.6 Ų | 79.6 | 52% | 0.52 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.2 | -45.6 | 174.7 | -175.5 | 0 | 0 | 0 | 0 | 111.8 | E116 Q117 G122 A123 V124 | E116-C120 VanDerWaalsContact O-CB 3.3Å; E116-C120 WeakPolarHBondContact O-CB 3.38Å; E116-C120 PolarHBondContact O-N 2.85Å; Q117-C120 PolarHBondContact O-N 3.07Å; C120-G122 PolarHBondContact O-N 3.07Å; C120-A123 PolarHBondContact O-N 3.04Å; C120-V124 WeakPolarHBondContact O-CG2 3.38Å; C120-V124 PolarHBondContact O-N 3.37Å |
| 121 | A | 85.7 | Confident | 84 | Confident | 60 Ų | 60 | 79.5 Ų | 79.5 | 50% | 0.496 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61 | -44.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q117 I118 A123 V124 Q125 | Q117-A121 WeakPolarHBondContact O-CB 3.45Å; Q117-A121 PolarHBondContact O-N 2.79Å; I118-A121 PolarHBondContact O-N 3.37Å; A121-A123 PolarHBondContact O-N 3.45Å; A121-V124 PolarHBondContact O-N 3.2Å; A121-Q125 PolarHBondContact O-N 3.17Å |
| 122 | G | 83.5 | Confident | 84.9 | Confident | 32 Ų | 32 | 77.5 Ų | 77.5 | 33% | 0.33 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.4 | -41 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | I118 D119 C120 Q125 T126 | I118-G122 PolarHBondContact O-N 3.48Å; D119-G122 PolarHBondContact O-N 3.35Å; C120-G122 PolarHBondContact O-N 3.07Å; G122-Q125 PolarHBondContact O-N 3.06Å; G122-T126 WeakPolarHBondContact O-CB 3.33Å; G122-T126 VanDerWaalsContact O-CG2 3.29Å; G122-T126 WeakPolarHBondContact O-CG2 3.31Å; G122-T126 PolarHBondContact O-N 2.89Å; G122-T126 PolarHBondContact O-OG1 3.48Å |
| 123 | A | 84.6 | Confident | 85.5 | Confident | 51 Ų | 51 | 74 Ų | 74 | 42% | 0.421 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.9 | -40.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | D119 C120 A121 T126 T127 | D119-A123 WeakPolarHBondContact O-CB 3.19Å; D119-A123 PolarHBondContact O-N 3.38Å; C120-A123 PolarHBondContact O-N 3.04Å; A121-A123 PolarHBondContact O-N 3.45Å; A123-T126 WeakPolarHBondContact CA-OG1 3.36Å; A123-T126 PolarHBondContact O-OG1 2.93Å; A123-T127 VanDerWaalsContact O-CB 3.31Å; A123-T127 WeakPolarHBondContact O-CB 3.4Å; A123-T127 PolarHBondContact O-N 2.58Å; A123-T127 PolarHBondContact O-OG1 3.03Å |
| 124 | V | 87.9 | Confident | 86.1 | Confident | 52 Ų | 52 | 72.8 Ų | 72.8 | 32% | 0.315 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.2 | -46.4 | 176.4 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | C120 A121 T127 F128 | C120-V124 WeakPolarHBondContact O-CG2 3.38Å; C120-V124 PolarHBondContact O-N 3.37Å; A121-V124 PolarHBondContact O-N 3.2Å; V124-T127 PolarHBondContact O-N 3.36Å; V124-F128 WeakPolarHBondContact O-CB 3.45Å; V124-F128 PolarHBondContact O-N 3.13Å |
| 125 | Q | 87.1 | Confident | 86.8 | Confident | 60 Ų | 60 | 68.2 Ų | 68.2 | 28% | 0.28 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64 | -45.2 | -179.8 | -172.8 | 176.3 | 10.6 | 0 | 0 | 111.7 | A121 G122 T127 F128 S129 D191 | A121-Q125 PolarHBondContact O-N 3.17Å; G122-Q125 PolarHBondContact O-N 3.06Å; Q125-T127 PolarHBondContact O-N 3.08Å; Q125-F128 PolarHBondContact O-N 3.36Å; Q125-S129 WeakPolarHBondContact O-CB 3.22Å; Q125-S129 PolarHBondContact O-N 2.85Å; Q125-D191 PolarHBondContact NE2-OD2 3.38Å |
| 126 | T | 85.3 | Confident | 87.4 | Confident | 61 Ų | 61 | 63.9 Ų | 63.9 | 37% | 0.374 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -61.5 | -45.4 | 175.6 | 49.4 | 0 | 0 | 0 | 0 | 111 | G122 A123 F128 S129 H130 | G122-T126 WeakPolarHBondContact O-CB 3.33Å; G122-T126 VanDerWaalsContact O-CG2 3.29Å; G122-T126 WeakPolarHBondContact O-CG2 3.31Å; G122-T126 PolarHBondContact O-N 2.89Å; G122-T126 PolarHBondContact O-OG1 3.48Å; A123-T126 WeakPolarHBondContact CA-OG1 3.36Å; A123-T126 PolarHBondContact O-OG1 2.93Å; T126-F128 PolarHBondContact O-N 3.15Å; T126-S129 WeakPolarHBondContact O-CB 3.28Å; T126-S129 PolarHBondContact O-N 2.97Å; T126-H130 PolarHBondContact O-N 3.5Å; T126-H130 PolarHBondContact O-ND1 3.35Å |
| 127 | T | 88.4 | Confident | 88 | Confident | 85 Ų | 85 | 60.3 Ų | 60.3 | 52% | 0.521 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60 | -46.9 | 176.9 | -56.8 | 0 | 0 | 0 | 0 | 111.7 | A123 V124 Q125 S129 H130 V131 | A123-T127 VanDerWaalsContact O-CB 3.31Å; A123-T127 WeakPolarHBondContact O-CB 3.4Å; A123-T127 PolarHBondContact O-N 2.58Å; A123-T127 PolarHBondContact O-OG1 3.03Å; V124-T127 PolarHBondContact O-N 3.36Å; Q125-T127 PolarHBondContact O-N 3.08Å; T127-S129 VanDerWaalsContact C-N 3.3Å; T127-S129 PolarHBondContact O-N 3.29Å; T127-H130 PolarHBondContact O-N 3.15Å; T127-V131 WeakPolarHBondContact O-CG2 3.26Å; T127-V131 PolarHBondContact O-N 3.19Å |
| 128 | F | 90.5 | Very high | 88.5 | Confident | 36 Ų | 36 | 60.6 Ų | 60.6 | 16% | 0.158 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -58.9 | -42.8 | 177.3 | 175.6 | -109.4 | 0 | 0 | 0 | 111.7 | V124 Q125 T126 H130 V131 A132 V184 I187 A188 | V124-F128 WeakPolarHBondContact O-CB 3.45Å; V124-F128 PolarHBondContact O-N 3.13Å; Q125-F128 PolarHBondContact O-N 3.36Å; T126-F128 PolarHBondContact O-N 3.15Å; F128-H130 PolarHBondContact O-N 3.28Å; F128-V131 PolarHBondContact O-N 3.44Å; F128-A132 WeakPolarHBondContact O-CB 3.29Å; F128-A132 PolarHBondContact O-N 2.8Å; F128-V184 HydrophobicContact CE2-CG1 4.2Å; F128-V184 HydrophobicContact CZ-CG1 4.41Å; F128-I187 HydrophobicContact CZ-CG2 4.45Å; F128-A188 HydrophobicContact CE1-CB 3.72Å; F128-A188 HydrophobicContact CZ-CB 3.97Å |
| 129 | S | 87.2 | Confident | 89.1 | Confident | 23 Ų | 23 | 55.1 Ų | 55.1 | 16% | 0.161 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -58.7 | -47.7 | 176.5 | -171.4 | 0 | 0 | 0 | 0 | 111.8 | Q125 T126 T127 V131 A132 Y133 | Q125-S129 WeakPolarHBondContact O-CB 3.22Å; Q125-S129 PolarHBondContact O-N 2.85Å; T126-S129 WeakPolarHBondContact O-CB 3.28Å; T126-S129 PolarHBondContact O-N 2.97Å; T127-S129 VanDerWaalsContact C-N 3.3Å; T127-S129 PolarHBondContact O-N 3.29Å; S129-V131 PolarHBondContact O-N 2.76Å; S129-A132 PolarHBondContact O-N 2.92Å; S129-Y133 WeakPolarHBondContact O-CD2 3.49Å; S129-Y133 PolarHBondContact O-N 2.97Å; S129-Y133 WeakPolarHBondContact OG-CE2 3.31Å |
| 130 | H | 88.4 | Confident | 89.7 | Confident | 127 Ų | 127 | 50.4 Ų | 50.4 | 59% | 0.588 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -61.5 | -41.4 | 176.8 | -67.9 | 97.2 | 0 | 0 | 0 | 112.8 | T126 T127 F128 Y133 S134 | T126-H130 PolarHBondContact O-N 3.5Å; T126-H130 PolarHBondContact O-ND1 3.35Å; T127-H130 PolarHBondContact O-N 3.15Å; F128-H130 PolarHBondContact O-N 3.28Å; H130-Y133 PolarHBondContact O-N 3.13Å; H130-S134 PolarHBondContact O-N 3.16Å; H130-S134 VanDerWaalsContact O-N 3.09Å; H130-S134 PolarHBondContact O-OG 3.45Å |
| 131 | V | 90.8 | Very high | 90.2 | Very high | 72 Ų | 72 | 48.9 Ų | 48.9 | 44% | 0.436 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.6 | -46.5 | 176.4 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | T127 F128 S129 Y133 S134 L135 | T127-V131 WeakPolarHBondContact O-CG2 3.26Å; T127-V131 PolarHBondContact O-N 3.19Å; F128-V131 PolarHBondContact O-N 3.44Å; S129-V131 PolarHBondContact O-N 2.76Å; V131-Y133 PolarHBondContact O-N 3.31Å; V131-S134 WeakPolarHBondContact O-CB 3.5Å; V131-S134 PolarHBondContact O-N 2.89Å; V131-L135 HydrophobicContact CG1-CD1 3.99Å; V131-L135 HydrophobicContact CG1-CG 4.32Å; V131-L135 WeakPolarHBondContact O-CB 3.42Å; V131-L135 WeakPolarHBondContact O-CG 3.47Å; V131-L135 PolarHBondContact O-N 3.47Å |
| 132 | A | 91.1 | Very high | 90.8 | Very high | 6 Ų | 6 | 48.6 Ų | 48.6 | 5% | 0.05 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.4 | -40.4 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | F128 S129 S134 L135 H136 A188 | F128-A132 WeakPolarHBondContact O-CB 3.29Å; F128-A132 PolarHBondContact O-N 2.8Å; S129-A132 PolarHBondContact O-N 2.92Å; A132-S134 VanDerWaalsContact C-N 3.33Å; A132-S134 PolarHBondContact O-N 2.85Å; A132-L135 PolarHBondContact O-N 3.48Å; A132-H136 WeakPolarHBondContact O-CB 3.28Å; A132-H136 PolarHBondContact O-N 3.33Å; A132-A188 HydrophobicContact CB-CB 3.24Å |
| 133 | Y | 88.9 | Confident | 91.4 | Very high | 58 Ų | 58 | 47 Ų | 47 | 23% | 0.227 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.8 | -41.9 | 173.3 | -73.7 | -58.5 | 0 | 0 | 0 | 113 | S129 H130 V131 H136 G137 R192 | S129-Y133 WeakPolarHBondContact O-CD2 3.49Å; S129-Y133 PolarHBondContact O-N 2.97Å; S129-Y133 WeakPolarHBondContact OG-CE2 3.31Å; H130-Y133 PolarHBondContact O-N 3.13Å; V131-Y133 PolarHBondContact O-N 3.31Å; Y133-H136 PolarHBondContact O-N 2.95Å; Y133-G137 PolarHBondContact O-N 3.45Å; Y133-R192 WeakPolarHBondContact OH-CD 3.27Å; Y133-R192 PolarHBondContact OH-NE 3.42Å; Y133-R192 PolarHBondContact OH-NH1 3.03Å; Y133-R192 PolarHBondContact OH-NH2 3.17Å |
| 134 | S | 91.8 | Very high | 92 | Very high | 74 Ų | 74 | 48.2 Ų | 48.2 | 52% | 0.517 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64 | -45.3 | 178.5 | -56.3 | 0 | 0 | 0 | 0 | 110.3 | H130 V131 A132 H136 G137 I138 | H130-S134 PolarHBondContact O-N 3.16Å; H130-S134 VanDerWaalsContact O-N 3.09Å; H130-S134 PolarHBondContact O-OG 3.45Å; V131-S134 WeakPolarHBondContact O-CB 3.5Å; V131-S134 PolarHBondContact O-N 2.89Å; A132-S134 VanDerWaalsContact C-N 3.33Å; A132-S134 PolarHBondContact O-N 2.85Å; S134-H136 VanDerWaalsContact C-N 3.33Å; S134-H136 PolarHBondContact O-N 3.47Å; S134-G137 PolarHBondContact O-N 3.21Å; S134-I138 VanDerWaalsContact O-CG1 3.32Å; S134-I138 WeakPolarHBondContact O-CG1 3.5Å; S134-I138 PolarHBondContact O-N 3.49Å |
| 135 | L | 94 | Very high | 92.4 | Very high | 27 Ų | 27 | 51.9 Ų | 51.9 | 14% | 0.141 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.3 | -41.2 | 174.9 | -74.8 | 176.2 | 0 | 0 | 0 | 112.3 | V131 A132 G137 I138 L139 V181 V184 F352 | V131-L135 HydrophobicContact CG1-CD1 3.99Å; V131-L135 HydrophobicContact CG1-CG 4.32Å; V131-L135 WeakPolarHBondContact O-CB 3.42Å; V131-L135 WeakPolarHBondContact O-CG 3.47Å; V131-L135 PolarHBondContact O-N 3.47Å; A132-L135 PolarHBondContact O-N 3.48Å; L135-G137 PolarHBondContact O-N 3.37Å; L135-I138 PolarHBondContact O-N 2.89Å; L135-L139 VanDerWaalsContact O-CB 3.23Å; L135-L139 WeakPolarHBondContact O-CB 3.5Å; L135-L139 PolarHBondContact O-N 3.35Å; L135-V181 HydrophobicContact CB-CG1 3.9Å; L135-V181 HydrophobicContact CD2-CG1 4.21Å; L135-V181 HydrophobicContact CG-CG1 4.44Å; L135-V184 HydrophobicContact CD1-CG1 4.06Å; L135-F352 HydrophobicContact CD2-CE2 4.32Å |
| 136 | H | 92.3 | Very high | 92.9 | Very high | 8 Ų | 8 | 49.2 Ų | 49.2 | 4% | 0.037 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 177.1 | -163.6 | 108.6 | 0 | 0 | 0 | 111.3 | A132 Y133 S134 L139 A140 F222 L282 T285 W286 | A132-H136 WeakPolarHBondContact O-CB 3.28Å; A132-H136 PolarHBondContact O-N 3.33Å; Y133-H136 PolarHBondContact O-N 2.95Å; S134-H136 VanDerWaalsContact C-N 3.33Å; S134-H136 PolarHBondContact O-N 3.47Å; H136-L139 PolarHBondContact O-N 2.83Å; H136-A140 WeakPolarHBondContact O-CB 3.37Å; H136-A140 PolarHBondContact O-N 2.87Å; H136-F222 AromaticContact CE1-CE1 3.25Å; H136-F222 WeakPolarHBondContact CE1-CE1 3.31Å; H136-F222 AromaticContact CE1-CZ 3.23Å; H136-F222 WeakPolarHBondContact CE1-CZ 3.23Å; H136-F222 AromaticContact ND1-CE1 3.34Å; H136-F222 VanDerWaalsContact ND1-CE1 3.34Å; H136-F222 WeakPolarHBondContact ND1-CE1 3.41Å; H136-F222 AromaticContact ND1-CZ 3.29Å; H136-F222 VanDerWaalsContact ND1-CZ 3.29Å; H136-F222 WeakPolarHBondContact ND1-CZ 3.49Å; H136-L282 PolarHBondContact NE2-O 2.72Å; H136-T285 PolarHBondContact CE1-OG1 3.5Å; H136-T285 VanDerWaalsContact CE1-OG1 3.27Å; H136-T285 PolarHBondContact NE2-OG1 3Å; H136-W286 VanDerWaalsContact CD2-CA 3.42Å; H136-W286 WeakPolarHBondContact CD2-CA 3.24Å; H136-W286 WeakPolarHBondContact CD2-CB 3.41Å; H136-W286 AromaticContact CD2-CD1 3.59Å; H136-W286 AromaticContact CD2-CG 3.86Å; H136-W286 WeakPolarHBondContact NE2-CA 3.39Å; H136-W286 WeakPolarHBondContact NE2-CB 3.36Å; H136-W286 PolarHBondContact NE2-N 3.04Å |
| 137 | G | 94 | Very high | 93.4 | Very high | 24 Ų | 24 | 46.9 Ų | 46.9 | 25% | 0.247 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.7 | -44.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | Y133 S134 L135 A140 G141 | Y133-G137 PolarHBondContact O-N 3.45Å; S134-G137 PolarHBondContact O-N 3.21Å; L135-G137 PolarHBondContact O-N 3.37Å; G137-A140 PolarHBondContact O-N 2.96Å; G137-G141 PolarHBondContact O-N 2.94Å |
| 138 | I | 95.5 | Very high | 93.7 | Very high | 117 Ų | 117 | 49.6 Ų | 49.6 | 60% | 0.6 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -61.4 | -45.7 | 176 | -68.8 | 166.4 | 0 | 0 | 0 | 110.4 | S134 L135 A140 G141 F142 | S134-I138 VanDerWaalsContact O-CG1 3.32Å; S134-I138 WeakPolarHBondContact O-CG1 3.5Å; S134-I138 PolarHBondContact O-N 3.49Å; L135-I138 PolarHBondContact O-N 2.89Å; I138-A140 PolarHBondContact O-N 2.9Å; I138-G141 PolarHBondContact O-N 3.45Å; I138-F142 VanDerWaalsContact O-CB 3.27Å; I138-F142 WeakPolarHBondContact O-CB 3.47Å; I138-F142 PolarHBondContact O-N 3.48Å |
| 139 | L | 95.5 | Very high | 93.9 | Very high | 4 Ų | 4 | 50.4 Ų | 50.4 | 2% | 0.021 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.5 | -40.6 | -179.4 | -171.7 | 64.2 | 0 | 0 | 0 | 111.8 | L135 H136 S143 Y178 V181 L282 | L135-L139 VanDerWaalsContact O-CB 3.23Å; L135-L139 WeakPolarHBondContact O-CB 3.5Å; L135-L139 PolarHBondContact O-N 3.35Å; H136-L139 PolarHBondContact O-N 2.83Å; L139-S143 VanDerWaalsContact O-CB 3.28Å; L139-S143 WeakPolarHBondContact O-CB 3.26Å; L139-S143 PolarHBondContact O-N 2.82Å; L139-Y178 HydrophobicContact CD1-CD1 3.77Å; L139-Y178 HydrophobicContact CD1-CE1 4.14Å; L139-Y178 HydrophobicContact CG-CD1 4.44Å; L139-V181 HydrophobicContact CB-CG1 4.14Å; L139-V181 HydrophobicContact CD1-CB 4.26Å; L139-V181 HydrophobicContact CD1-CG1 4.38Å; L139-V181 HydrophobicContact CD2-CB 4.18Å; L139-V181 HydrophobicContact CD2-CG1 3.98Å; L139-V181 HydrophobicContact CG-CG1 4.4Å; L139-L282 HydrophobicContact CD2-CD1 4.4Å; L139-L282 HydrophobicContact CD2-CD2 3.69Å; L139-L282 HydrophobicContact CG-CD1 4.1Å; L139-L282 HydrophobicContact CG-CD2 4.06Å |
| 140 | A | 95.7 | Very high | 94.3 | Very high | 5 Ų | 5 | 49.3 Ų | 49.3 | 4% | 0.041 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.9 | -47.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | H136 G137 I138 S143 V144 W286 | H136-A140 WeakPolarHBondContact O-CB 3.37Å; H136-A140 PolarHBondContact O-N 2.87Å; G137-A140 PolarHBondContact O-N 2.96Å; I138-A140 PolarHBondContact O-N 2.9Å; A140-S143 PolarHBondContact O-N 3.21Å; A140-S143 VanDerWaalsContact O-N 3.15Å; A140-V144 PolarHBondContact O-N 2.87Å; A140-W286 HydrophobicContact CB-CB 4Å; A140-W286 HydrophobicContact CB-CG 4.19Å |
| 141 | G | 96.6 | Very high | 94.5 | Very high | 44 Ų | 44 | 46.4 Ų | 46.4 | 45% | 0.454 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.6 | -46.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G137 I138 S143 V144 F145 | G137-G141 PolarHBondContact O-N 2.94Å; I138-G141 PolarHBondContact O-N 3.45Å; G141-S143 PolarHBondContact O-N 3.26Å; G141-V144 PolarHBondContact O-N 2.86Å; G141-F145 PolarHBondContact O-N 2.67Å; G141-F145 VanDerWaalsContact O-N 3.07Å |
| 142 | F | 97 | Very high | 94.6 | Very high | 54 Ų | 54 | 45.5 Ų | 45.5 | 24% | 0.237 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.1 | -38.6 | 173.4 | 176.9 | -103.7 | 0 | 0 | 0 | 111.4 | I138 F145 H146 I174 L177 Y178 | I138-F142 VanDerWaalsContact O-CB 3.27Å; I138-F142 WeakPolarHBondContact O-CB 3.47Å; I138-F142 PolarHBondContact O-N 3.48Å; F142-F145 PolarHBondContact O-N 3.27Å; F142-H146 HydrophobicContact CE1-CB 4.39Å; F142-H146 HydrophobicContact CZ-CB 4.47Å; F142-H146 VanDerWaalsContact O-CB 3.28Å; F142-H146 WeakPolarHBondContact O-CB 3.38Å; F142-H146 PolarHBondContact O-N 3.41Å; F142-I174 HydrophobicContact CE1-CG2 4.13Å; F142-I174 HydrophobicContact CZ-CG1 4.2Å; F142-I174 HydrophobicContact CZ-CG2 4.21Å; F142-L177 HydrophobicContact CD1-CD2 3.89Å; F142-L177 HydrophobicContact CE1-CD2 3.68Å; F142-L177 HydrophobicContact CE2-CD2 4.45Å; F142-L177 HydrophobicContact CG-CD2 4.37Å; F142-L177 HydrophobicContact CZ-CD2 3.98Å; F142-Y178 HydrophobicContact CD1-CE1 4.28Å; F142-Y178 HydrophobicContact CD1-CE2 4.41Å; F142-Y178 AromaticContact CD1-CZ 3.96Å; F142-Y178 AromaticContact CE1-CE2 3.85Å; F142-Y178 HydrophobicContact CE1-CE2 3.85Å; F142-Y178 AromaticContact CE1-CZ 3.84Å |
| 143 | S | 96.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 46.7 Ų | 46.7 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -69.1 | -36.4 | -179.9 | -160.3 | 0 | 0 | 0 | 0 | 114.2 | L139 A140 G141 C147 Y178 S279 | L139-S143 VanDerWaalsContact O-CB 3.28Å; L139-S143 WeakPolarHBondContact O-CB 3.26Å; L139-S143 PolarHBondContact O-N 2.82Å; A140-S143 PolarHBondContact O-N 3.21Å; A140-S143 VanDerWaalsContact O-N 3.15Å; G141-S143 PolarHBondContact O-N 3.26Å; S143-C147 WeakPolarHBondContact O-CB 3.34Å; S143-C147 PolarHBondContact O-N 3.13Å; S143-Y178 VanDerWaalsContact CA-OH 3.26Å; S143-Y178 WeakPolarHBondContact CA-OH 3.27Å; S143-Y178 PolarHBondContact OG-OH 3.38Å; S143-S279 PolarHBondContact O-OG 3.24Å; S143-S279 VanDerWaalsContact OG-CA 3.26Å; S143-S279 WeakPolarHBondContact OG-CA 3.47Å; S143-S279 WeakPolarHBondContact OG-CB 3.44Å |
| 144 | V | 96.9 | Very high | 94.5 | Very high | 75 Ų | 75 | 44 Ų | 44 | 46% | 0.455 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -65.7 | -45.7 | 173 | 174.9 | 0 | 0 | 0 | 0 | 110.2 | A140 G141 C147 F148 C283 | A140-V144 PolarHBondContact O-N 2.87Å; G141-V144 PolarHBondContact O-N 2.86Å; V144-C147 PolarHBondContact O-N 3.4Å; V144-F148 WeakPolarHBondContact O-CB 3.01Å; V144-F148 PolarHBondContact O-N 3.22Å; V144-C283 WeakPolarHBondContact CG2-SG 3.42Å |
| 145 | F | 97.2 | Very high | 94.1 | Very high | 129 Ų | 129 | 45.6 Ų | 45.6 | 57% | 0.566 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -59.1 | -49.3 | 175.7 | 169.9 | -100.8 | 0 | 0 | 0 | 112 | G141 F142 C147 F148 F149 | G141-F145 PolarHBondContact O-N 2.67Å; G141-F145 VanDerWaalsContact O-N 3.07Å; F142-F145 PolarHBondContact O-N 3.27Å; F145-C147 PolarHBondContact O-N 2.87Å; F145-F148 PolarHBondContact O-N 3.21Å; F145-F149 WeakPolarHBondContact O-CB 3.17Å; F145-F149 PolarHBondContact O-N 3.06Å |
| 146 | H | 96.3 | Very high | 93.3 | Very high | 4 Ų | 4 | 50.6 Ų | 50.6 | 2% | 0.019 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61 | -45.1 | 178.2 | 179.8 | -131.2 | 0 | 0 | 0 | 111.1 | F142 F148 F149 I150 Y167 Y178 | F142-H146 HydrophobicContact CE1-CB 4.39Å; F142-H146 HydrophobicContact CZ-CB 4.47Å; F142-H146 VanDerWaalsContact O-CB 3.28Å; F142-H146 WeakPolarHBondContact O-CB 3.38Å; F142-H146 PolarHBondContact O-N 3.41Å; H146-F148 PolarHBondContact O-N 3.16Å; H146-F149 WeakPolarHBondContact O-CB 3.28Å; H146-F149 PolarHBondContact O-N 3.43Å; H146-I150 VanDerWaalsContact O-CG1 3.31Å; H146-I150 WeakPolarHBondContact O-CG1 3.41Å; H146-I150 PolarHBondContact O-N 2.82Å; H146-Y167 PolarHBondContact CE1-OH 3.22Å; H146-Y167 AromaticContact NE2-CE2 3.56Å; H146-Y167 AromaticContact NE2-CZ 3.67Å; H146-Y167 PolarHBondContact NE2-OH 2.67Å; H146-Y178 WeakPolarHBondContact CB-OH 3.49Å; H146-Y178 AromaticContact CE1-CE2 3.98Å; H146-Y178 AromaticContact ND1-CE2 3.47Å; H146-Y178 WeakPolarHBondContact ND1-CE2 3.45Å; H146-Y178 AromaticContact ND1-CZ 3.65Å; H146-Y178 PolarHBondContact ND1-OH 2.87Å |
| 147 | C | 96.3 | Very high | 92.3 | Very high | 12 Ų | 12 | 55.8 Ų | 55.8 | 8% | 0.081 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -58 | -47.4 | 175.1 | -172.4 | 0 | 0 | 0 | 0 | 111.4 | S143 V144 F145 F149 I150 F151 I275 | S143-C147 WeakPolarHBondContact O-CB 3.34Å; S143-C147 PolarHBondContact O-N 3.13Å; V144-C147 PolarHBondContact O-N 3.4Å; F145-C147 PolarHBondContact O-N 2.87Å; C147-F149 PolarHBondContact O-N 2.9Å; C147-I150 PolarHBondContact O-N 3.17Å; C147-F151 WeakPolarHBondContact O-CB 3.45Å; C147-F151 WeakPolarHBondContact O-CD2 3.38Å; C147-F151 PolarHBondContact O-N 3.29Å; C147-I275 HydrophobicContact CB-CG2 4.16Å |
| 148 | F | 95.9 | Very high | 91.3 | Very high | 142 Ų | 142 | 57.3 Ų | 57.3 | 62% | 0.623 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -60.6 | -43.7 | 176.7 | 178.6 | -96.9 | 0 | 0 | 0 | 112.2 | V144 F145 H146 I150 F151 S152 | V144-F148 WeakPolarHBondContact O-CB 3.01Å; V144-F148 PolarHBondContact O-N 3.22Å; F145-F148 PolarHBondContact O-N 3.21Å; H146-F148 PolarHBondContact O-N 3.16Å; F148-I150 PolarHBondContact O-N 3.35Å; F148-F151 PolarHBondContact O-N 3.46Å; F148-S152 WeakPolarHBondContact O-CB 3.3Å; F148-S152 PolarHBondContact O-N 3.3Å; F148-S152 PolarHBondContact O-OG 2.98Å |
| 149 | F | 94.4 | Very high | 90.4 | Very high | 54 Ų | 54 | 54.1 Ų | 54.1 | 24% | 0.237 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -59.8 | -45.1 | 178.4 | -179.9 | -108.7 | 0 | 0 | 0 | 112 | F145 H146 C147 S152 N153 F163 F166 Y167 | F145-F149 WeakPolarHBondContact O-CB 3.17Å; F145-F149 PolarHBondContact O-N 3.06Å; H146-F149 WeakPolarHBondContact O-CB 3.28Å; H146-F149 PolarHBondContact O-N 3.43Å; C147-F149 PolarHBondContact O-N 2.9Å; F149-S152 PolarHBondContact O-N 3.34Å; F149-N153 PolarHBondContact O-N 3.36Å; F149-N153 PolarHBondContact O-ND2 3Å; F149-F163 HydrophobicContact CD1-CE2 4.13Å; F149-F163 HydrophobicContact CE1-CD2 4.12Å; F149-F163 AromaticContact CE1-CE2 3.54Å; F149-F163 HydrophobicContact CE1-CE2 3.54Å; F149-F163 HydrophobicContact CZ-CD2 4.18Å; F149-F163 HydrophobicContact CZ-CE2 4.07Å; F149-F166 HydrophobicContact CZ-CD1 4.16Å; F149-F166 AromaticContact CZ-CE1 3.98Å; F149-F166 HydrophobicContact CZ-CE1 3.98Å; F149-Y167 HydrophobicContact CE1-CD2 4.05Å |
| 150 | I | 94 | Very high | 89.6 | Confident | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -66.5 | -47.1 | 177.2 | -63.1 | -55.2 | 0 | 0 | 0 | 111.3 | H146 C147 F148 S152 N153 V154 F163 Y167 W271 K272 I275 | H146-I150 VanDerWaalsContact O-CG1 3.31Å; H146-I150 WeakPolarHBondContact O-CG1 3.41Å; H146-I150 PolarHBondContact O-N 2.82Å; C147-I150 PolarHBondContact O-N 3.17Å; F148-I150 PolarHBondContact O-N 3.35Å; I150-S152 PolarHBondContact O-N 3.34Å; I150-N153 PolarHBondContact O-N 2.97Å; I150-V154 HydrophobicContact CG2-CB 4.44Å; I150-V154 HydrophobicContact CG2-CG2 4.16Å; I150-V154 WeakPolarHBondContact O-CB 3.4Å; I150-V154 PolarHBondContact O-N 3.34Å; I150-F163 HydrophobicContact CD1-CE2 3.88Å; I150-F163 HydrophobicContact CD1-CZ 3.49Å; I150-F163 VanDerWaalsContact CD1-CZ 3.49Å; I150-Y167 HydrophobicContact CD1-CD2 4.12Å; I150-Y167 HydrophobicContact CD1-CE2 3.72Å; I150-W271 HydrophobicContact CD1-CH2 3.51Å; I150-W271 HydrophobicContact CD1-CZ2 4.27Å; I150-W271 HydrophobicContact CD1-CZ3 4.19Å; I150-W271 HydrophobicContact CG1-CH2 4.18Å; I150-W271 HydrophobicContact CG2-CE3 4.4Å; I150-W271 HydrophobicContact CG2-CH2 4.12Å; I150-W271 HydrophobicContact CG2-CZ3 3.76Å; I150-K272 HydrophobicContact CG2-CG 4.43Å; I150-I275 HydrophobicContact CG1-CD1 4.09Å; I150-I275 HydrophobicContact CG2-CD1 4.15Å |
| 151 | F | 93.4 | Very high | 88.7 | Confident | 66 Ų | 66 | 61.1 Ų | 61.1 | 29% | 0.289 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.6 | -27.3 | -179.4 | -87 | -110.3 | 0 | 0 | 0 | 113.4 | C147 F148 K272 L276 | C147-F151 WeakPolarHBondContact O-CB 3.45Å; C147-F151 WeakPolarHBondContact O-CD2 3.38Å; C147-F151 PolarHBondContact O-N 3.29Å; F148-F151 PolarHBondContact O-N 3.46Å; F151-K272 HydrophobicContact CD1-CD 4.49Å; F151-K272 HydrophobicContact CD2-CD 4.47Å; F151-K272 HydrophobicContact CD2-CG 3.93Å; F151-K272 HydrophobicContact CE1-CD 4.3Å; F151-K272 HydrophobicContact CE1-CG 4.19Å; F151-K272 HydrophobicContact CE2-CD 4.29Å; F151-K272 HydrophobicContact CE2-CG 3.45Å; F151-K272 VanDerWaalsContact CE2-CG 3.45Å; F151-K272 HydrophobicContact CZ-CD 4.19Å; F151-K272 HydrophobicContact CZ-CG 3.58Å; F151-L276 HydrophobicContact CE2-CB 4.02Å; F151-L276 HydrophobicContact CZ-CB 3.93Å; F151-L276 HydrophobicContact CZ-CD2 4.05Å; F151-L276 HydrophobicContact CZ-CG 4.39Å |
| 152 | S | 92 | Very high | 88 | Confident | 53 Ų | 53 | 66.5 Ų | 66.5 | 37% | 0.371 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -76.7 | -25.7 | 176.6 | -58.6 | 0 | 0 | 0 | 0 | 113.2 | F148 F149 I150 | F148-S152 WeakPolarHBondContact O-CB 3.3Å; F148-S152 PolarHBondContact O-N 3.3Å; F148-S152 PolarHBondContact O-OG 2.98Å; F149-S152 PolarHBondContact O-N 3.34Å; I150-S152 PolarHBondContact O-N 3.34Å |
| 153 | N | 90.3 | Very high | 87.5 | Confident | 30 Ų | 30 | 64.2 Ų | 64.2 | 16% | 0.16 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -107.9 | -18.4 | -175 | -74.5 | -78.4 | 0 | 0 | 0 | 114.6 | F149 I150 N160 F163 | F149-N153 PolarHBondContact O-N 3.36Å; F149-N153 PolarHBondContact O-ND2 3Å; I150-N153 PolarHBondContact O-N 2.97Å; N153-N160 PolarHBondContact O-N 2.94Å; N153-F163 HydrophobicContact CB-CB 4.01Å; N153-F163 HydrophobicContact CB-CD1 4.45Å; N153-F163 HydrophobicContact CB-CD2 3.35Å; N153-F163 HydrophobicContact CB-CE2 3.9Å; N153-F163 HydrophobicContact CB-CG 3.67Å |
| 154 | V | 87.9 | Confident | 86.9 | Confident | 1 Ų | 1 | 65.7 Ų | 65.7 | 1% | 0.006 | 36% | 0.356 | C | S | . | . | B | Isolated β-bridge | trans | -113.5 | 103.1 | -177.3 | -178.6 | 0 | 0 | 0 | 0 | 109.7 | I150 I159 F163 V268 W271 K272 | I150-V154 HydrophobicContact CG2-CB 4.44Å; I150-V154 HydrophobicContact CG2-CG2 4.16Å; I150-V154 WeakPolarHBondContact O-CB 3.4Å; I150-V154 PolarHBondContact O-N 3.34Å; V154-I159 HydrophobicContact CG1-CG1 4.47Å; V154-F163 HydrophobicContact CG2-CD1 4.14Å; V154-F163 HydrophobicContact CG2-CE1 3.72Å; V154-F163 HydrophobicContact CG2-CZ 4.13Å; V154-V268 HydrophobicContact CG1-CG1 3.46Å; V154-V268 VanDerWaalsContact CG1-CG1 3.46Å; V154-W271 HydrophobicContact CG2-CZ3 4.37Å; V154-K272 HydrophobicContact CG1-CD 4.34Å; V154-K272 PolarHBondContact O-NZ 2.56Å |
| 155 | H | 83.9 | Confident | 86.4 | Confident | 108 Ų | 108 | 65.9 Ų | 65.9 | 50% | 0.5 | 36% | 0.358 | S | S | . | . | trans | -96.8 | 158 | 174 | -52.4 | -68.3 | 0 | 0 | 0 | 111 | S157 A158 | H155-S157 PolarHBondContact O-N 2.94Å; H155-A158 WeakPolarHBondContact CA-O 3.43Å; H155-A158 WeakPolarHBondContact CB-O 3.37Å; H155-A158 PolarHBondContact N-O 3.15Å; H155-A158 VanDerWaalsContact N-O 3.1Å; H155-A158 PolarHBondContact O-N 3.28Å | ||
| 156 | E | 76.6 | Confident | 85.9 | Confident | 132 Ų | 132 | 65.7 Ų | 65.7 | 62% | 0.617 | 36% | 0.358 | S | S | * | . | S | Bend | trans | -63.1 | -31.5 | -176.8 | -61.8 | -177.7 | 171.2 | 0 | 0 | 113.1 | L269 | E156-L269 HydrophobicContact CB-CD2 4.32Å; E156-L269 HydrophobicContact CG-CD2 4.01Å |
| 157 | S | 72.7 | Confident | 85.7 | Confident | 118 Ų | 118 | 65.5 Ų | 65.5 | 83% | 0.825 | 36% | 0.357 | S | S | * | . | S | Bend | trans | -96 | -19.6 | -178.1 | 57.7 | 0 | 0 | 0 | 0 | 114.1 | H155 | H155-S157 PolarHBondContact O-N 2.94Š|
| 158 | A | 73 | Confident | 85.4 | Confident | 56 Ų | 56 | 65 Ų | 65 | 46% | 0.463 | 35% | 0.353 | S | S | . | . | trans | -160.7 | 139.9 | -174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | H155 | H155-A158 WeakPolarHBondContact CA-O 3.43Å; H155-A158 WeakPolarHBondContact CB-O 3.37Å; H155-A158 PolarHBondContact N-O 3.15Å; H155-A158 VanDerWaalsContact N-O 3.1Å; H155-A158 PolarHBondContact O-N 3.28Å | ||
| 159 | I | 76.5 | Confident | 85.1 | Confident | 50 Ų | 50 | 60.6 Ų | 60.6 | 26% | 0.256 | 34% | 0.339 | S | S | . | . | B | Isolated β-bridge | trans | -91.5 | 136.5 | 167.6 | -58.1 | 169.8 | 0 | 0 | 0 | 107.2 | V154 A161 F163 F264 V268 | V154-I159 HydrophobicContact CG1-CG1 4.47Å; I159-A161 PolarHBondContact O-N 3.31Å; I159-F163 HydrophobicContact CG2-CD1 3.85Å; I159-F264 HydrophobicContact CD1-CD1 4.32Å; I159-F264 HydrophobicContact CD1-CE1 3.64Å; I159-V268 HydrophobicContact CD1-CG1 4.06Å; I159-V268 HydrophobicContact CD1-CG2 4.09Å; I159-V268 HydrophobicContact CG1-CG1 4.45Å |
| 160 | N | 77.3 | Confident | 85.1 | Confident | 67 Ų | 67 | 60.3 Ų | 60.3 | 36% | 0.358 | 34% | 0.339 | S | S | . | . | trans | -56.3 | 123.7 | 172.7 | -179.5 | -6.7 | 0 | 0 | 0 | 109.7 | N153 Q162 F163 | N153-N160 PolarHBondContact O-N 2.94Å; N160-Q162 PolarHBondContact O-N 3Å; N160-Q162 VanDerWaalsContact O-N 3.1Å; N160-Q162 PolarHBondContact OD1-N 3.5Å; N160-Q162 VanDerWaalsContact OD1-N 3.13Å; N160-F163 HydrophobicContact CB-CB 3.88Å; N160-F163 WeakPolarHBondContact O-CB 3.47Å; N160-F163 PolarHBondContact O-N 2.88Å | ||
| 161 | A | 76.7 | Confident | 85 | Confident | 89 Ų | 89 | 60.3 Ų | 60.3 | 74% | 0.736 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.1 | -28.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | I159 P165 | I159-A161 PolarHBondContact O-N 3.31Å; A161-P165 WeakPolarHBondContact O-CD 3.4Å |
| 162 | Q | 82.8 | Confident | 85.1 | Confident | 156 Ų | 156 | 59.9 Ų | 59.9 | 73% | 0.729 | 34% | 0.339 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | -18.2 | 178.1 | -65.5 | -178.7 | -21.7 | 0 | 0 | 113.4 | N160 | N160-Q162 PolarHBondContact O-N 3Å; N160-Q162 VanDerWaalsContact O-N 3.1Å; N160-Q162 PolarHBondContact OD1-N 3.5Å; N160-Q162 VanDerWaalsContact OD1-N 3.13Å |
| 163 | F | 86.8 | Confident | 85.3 | Confident | 7 Ų | 7 | 59.4 Ų | 59.4 | 3% | 0.031 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -72.1 | -45 | -175.9 | 166.3 | -97.2 | 0 | 0 | 0 | 112 | F149 I150 N153 V154 I159 N160 F166 Y167 W271 | F149-F163 HydrophobicContact CD1-CE2 4.13Å; F149-F163 HydrophobicContact CE1-CD2 4.12Å; F149-F163 AromaticContact CE1-CE2 3.54Å; F149-F163 HydrophobicContact CE1-CE2 3.54Å; F149-F163 HydrophobicContact CZ-CD2 4.18Å; F149-F163 HydrophobicContact CZ-CE2 4.07Å; I150-F163 HydrophobicContact CD1-CE2 3.88Å; I150-F163 HydrophobicContact CD1-CZ 3.49Å; I150-F163 VanDerWaalsContact CD1-CZ 3.49Å; N153-F163 HydrophobicContact CB-CB 4.01Å; N153-F163 HydrophobicContact CB-CD1 4.45Å; N153-F163 HydrophobicContact CB-CD2 3.35Å; N153-F163 HydrophobicContact CB-CE2 3.9Å; N153-F163 HydrophobicContact CB-CG 3.67Å; V154-F163 HydrophobicContact CG2-CD1 4.14Å; V154-F163 HydrophobicContact CG2-CE1 3.72Å; V154-F163 HydrophobicContact CG2-CZ 4.13Å; I159-F163 HydrophobicContact CG2-CD1 3.85Å; N160-F163 HydrophobicContact CB-CB 3.88Å; N160-F163 WeakPolarHBondContact O-CB 3.47Å; N160-F163 PolarHBondContact O-N 2.88Å; F163-F166 PolarHBondContact O-N 2.92Å; F163-Y167 HydrophobicContact CE1-CD1 4.4Å; F163-Y167 HydrophobicContact CE1-CG 4.2Å; F163-Y167 HydrophobicContact CE2-CD2 4.01Å; F163-Y167 AromaticContact CE2-CG 3.94Å; F163-Y167 HydrophobicContact CE2-CG 3.94Å; F163-Y167 AromaticContact CZ-CD1 3.98Å; F163-Y167 HydrophobicContact CZ-CD1 3.98Å; F163-Y167 AromaticContact CZ-CD2 3.89Å; F163-Y167 HydrophobicContact CZ-CD2 3.89Å; F163-Y167 AromaticContact CZ-CG 3.52Å; F163-Y167 HydrophobicContact CZ-CG 3.52Å; F163-Y167 WeakPolarHBondContact O-CB 3.34Å; F163-Y167 PolarHBondContact O-N 3.32Å; F163-W271 HydrophobicContact CZ-CH2 4.43Å |
| 164 | M | 84.5 | Confident | 85.6 | Confident | 31 Ų | 31 | 59 Ų | 59 | 15% | 0.153 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.6 | -47 | -171.8 | -153.4 | 68.5 | -151.5 | 0 | 0 | 113.4 | F166 Y167 S168 I239 L242 F264 | M164-F166 VanDerWaalsContact C-N 3.28Å; M164-F166 PolarHBondContact O-N 2.93Å; M164-Y167 PolarHBondContact O-N 3.38Å; M164-S168 VanDerWaalsContact O-CB 3.24Å; M164-S168 WeakPolarHBondContact O-CB 3.48Å; M164-S168 PolarHBondContact O-N 2.91Å; M164-I239 HydrophobicContact CE-CB 3.83Å; M164-I239 HydrophobicContact CE-CD1 4.32Å; M164-I239 HydrophobicContact CE-CG1 3.6Å; M164-I239 HydrophobicContact CE-CG2 3.41Å; M164-I239 VanDerWaalsContact CE-CG2 3.41Å; M164-L242 HydrophobicContact CE-CD1 3.43Å; M164-L242 VanDerWaalsContact CE-CD1 3.43Å; M164-L242 HydrophobicContact CG-CD1 4.01Å; M164-L242 HydrophobicContact SD-CD1 4.41Å; M164-F264 HydrophobicContact CE-CZ 4.18Å; M164-F264 HydrophobicContact SD-CZ 4.48Å |
| 165 | P | 85.1 | Confident | 85.9 | Confident | 78 Ų | 78 | 59.5 Ų | 59.5 | 51% | 0.506 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.8 | -34.5 | 177.2 | -22.3 | 35.1 | 0 | 0 | 0 | 112.9 | A161 P169 | A161-P165 WeakPolarHBondContact O-CD 3.4Å; P165-P169 VanDerWaalsContact O-CD 3.28Å; P165-P169 WeakPolarHBondContact O-CD 3.46Å |
| 166 | F | 87.9 | Confident | 86.5 | Confident | 125 Ų | 125 | 57.4 Ų | 57.4 | 55% | 0.548 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -74.6 | -41.9 | 179.1 | 177.6 | -96.7 | 0 | 0 | 0 | 112.7 | F149 F163 M164 P169 L170 | F149-F166 HydrophobicContact CZ-CD1 4.16Å; F149-F166 AromaticContact CZ-CE1 3.98Å; F149-F166 HydrophobicContact CZ-CE1 3.98Å; F163-F166 PolarHBondContact O-N 2.92Å; M164-F166 VanDerWaalsContact C-N 3.28Å; M164-F166 PolarHBondContact O-N 2.93Å; F166-P169 WeakPolarHBondContact O-CD 3.29Å; F166-L170 HydrophobicContact CD1-CD1 4.48Å; F166-L170 HydrophobicContact CE1-CD1 3.93Å; F166-L170 HydrophobicContact CZ-CD1 4.15Å |
| 167 | Y | 91.4 | Very high | 87.4 | Confident | 1 Ų | 1 | 53.7 Ų | 53.7 | 0% | 0.004 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -79.4 | -31.5 | -175.8 | -175.5 | -97.2 | 0 | 0 | 0 | 113.4 | H146 F149 I150 F163 M164 L170 A171 I174 I239 W271 | H146-Y167 PolarHBondContact CE1-OH 3.22Å; H146-Y167 AromaticContact NE2-CE2 3.56Å; H146-Y167 AromaticContact NE2-CZ 3.67Å; H146-Y167 PolarHBondContact NE2-OH 2.67Å; F149-Y167 HydrophobicContact CE1-CD2 4.05Å; I150-Y167 HydrophobicContact CD1-CD2 4.12Å; I150-Y167 HydrophobicContact CD1-CE2 3.72Å; F163-Y167 HydrophobicContact CE1-CD1 4.4Å; F163-Y167 HydrophobicContact CE1-CG 4.2Å; F163-Y167 HydrophobicContact CE2-CD2 4.01Å; F163-Y167 AromaticContact CE2-CG 3.94Å; F163-Y167 HydrophobicContact CE2-CG 3.94Å; F163-Y167 AromaticContact CZ-CD1 3.98Å; F163-Y167 HydrophobicContact CZ-CD1 3.98Å; F163-Y167 AromaticContact CZ-CD2 3.89Å; F163-Y167 HydrophobicContact CZ-CD2 3.89Å; F163-Y167 AromaticContact CZ-CG 3.52Å; F163-Y167 HydrophobicContact CZ-CG 3.52Å; F163-Y167 WeakPolarHBondContact O-CB 3.34Å; F163-Y167 PolarHBondContact O-N 3.32Å; M164-Y167 PolarHBondContact O-N 3.38Å; Y167-L170 WeakPolarHBondContact O-CA 3.28Å; Y167-L170 WeakPolarHBondContact O-CB 3.27Å; Y167-L170 PolarHBondContact O-N 2.99Å; Y167-A171 HydrophobicContact CD1-CB 4.31Å; Y167-A171 HydrophobicContact CE1-CB 3.83Å; Y167-A171 PolarHBondContact O-N 3.18Å; Y167-I174 HydrophobicContact CD2-CD1 4.49Å; Y167-I174 HydrophobicContact CE2-CD1 3.67Å; Y167-I239 HydrophobicContact CD1-CG2 3.8Å; Y167-I239 HydrophobicContact CE1-CG2 3.99Å; Y167-W271 HydrophobicContact CD1-CH2 4.2Å; Y167-W271 HydrophobicContact CD1-CZ2 4.43Å; Y167-W271 AromaticContact CE1-CH2 3.62Å; Y167-W271 HydrophobicContact CE1-CH2 3.62Å; Y167-W271 AromaticContact CE1-CZ2 3.47Å; Y167-W271 HydrophobicContact CE1-CZ2 3.47Å; Y167-W271 VanDerWaalsContact CE1-CZ2 3.47Å; Y167-W271 AromaticContact CZ-CH2 3.96Å; Y167-W271 AromaticContact CZ-CZ2 3.72Å |
| 168 | S | 90 | Very high | 88.5 | Confident | 1 Ų | 1 | 48.1 Ų | 48.1 | 1% | 0.007 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -52.1 | -48.1 | -176 | -175.4 | 0 | 0 | 0 | 0 | 115 | M164 L170 A171 I239 S240 W243 | M164-S168 VanDerWaalsContact O-CB 3.24Å; M164-S168 WeakPolarHBondContact O-CB 3.48Å; M164-S168 PolarHBondContact O-N 2.91Å; S168-L170 VanDerWaalsContact C-N 3.27Å; S168-L170 PolarHBondContact O-N 2.85Å; S168-A171 PolarHBondContact O-N 2.91Å; S168-I239 WeakPolarHBondContact CB-O 3.12Å; S168-I239 PolarHBondContact OG-O 3.49Å; S168-S240 PolarHBondContact OG-O 3.24Å; S168-W243 WeakPolarHBondContact OG-CB 3.37Å; S168-W243 PolarHBondContact OG-N 3.46Å; S168-W243 VanDerWaalsContact OG-N 3.08Å |
| 169 | P | 90.6 | Very high | 89.6 | Confident | 49 Ų | 49 | 49.6 Ų | 49.6 | 32% | 0.318 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -67.1 | -27 | 176 | 26.2 | -35.2 | 0 | 0 | 0 | 113.2 | P165 F166 | P165-P169 VanDerWaalsContact O-CD 3.28Å; P165-P169 WeakPolarHBondContact O-CD 3.46Å; F166-P169 WeakPolarHBondContact O-CD 3.29Å |
| 170 | L | 93.1 | Very high | 90.5 | Very high | 48 Ų | 48 | 48.1 Ų | 48.1 | 25% | 0.251 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -80.9 | -20.7 | -179.7 | -63.2 | 174.6 | 0 | 0 | 0 | 113.3 | F166 Y167 S168 M172 I173 I174 | F166-L170 HydrophobicContact CD1-CD1 4.48Å; F166-L170 HydrophobicContact CE1-CD1 3.93Å; F166-L170 HydrophobicContact CZ-CD1 4.15Å; Y167-L170 WeakPolarHBondContact O-CA 3.28Å; Y167-L170 WeakPolarHBondContact O-CB 3.27Å; Y167-L170 PolarHBondContact O-N 2.99Å; S168-L170 VanDerWaalsContact C-N 3.27Å; S168-L170 PolarHBondContact O-N 2.85Å; L170-M172 PolarHBondContact O-N 2.98Å; L170-I173 HydrophobicContact CD2-CD1 4.34Å; L170-I173 PolarHBondContact O-N 3.36Å; L170-I174 HydrophobicContact CB-CD1 3.96Å; L170-I174 HydrophobicContact CB-CG1 4.46Å; L170-I174 WeakPolarHBondContact O-CB 3.48Å; L170-I174 VanDerWaalsContact O-CG1 3.27Å; L170-I174 WeakPolarHBondContact O-CG1 3.33Å; L170-I174 PolarHBondContact O-N 3.27Å |
| 171 | A | 93.4 | Very high | 91.4 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -55.8 | -48.8 | -170.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y167 S168 I174 H175 I239 | Y167-A171 HydrophobicContact CD1-CB 4.31Å; Y167-A171 HydrophobicContact CE1-CB 3.83Å; Y167-A171 PolarHBondContact O-N 3.18Å; S168-A171 PolarHBondContact O-N 2.91Å; A171-I174 PolarHBondContact O-N 2.88Å; A171-H175 WeakPolarHBondContact O-CB 3.47Å; A171-H175 PolarHBondContact O-N 3.04Å; A171-I239 HydrophobicContact CB-CB 4.42Å; A171-I239 HydrophobicContact CB-CG2 3.67Å |
| 172 | M | 94.6 | Very high | 92.2 | Very high | 57 Ų | 57 | 41.1 Ų | 41.1 | 28% | 0.281 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -71.4 | -33.1 | -179.4 | -67.7 | -55.8 | -66 | 0 | 0 | 113 | L170 H175 S176 L233 D236 E237 | L170-M172 PolarHBondContact O-N 2.98Å; M172-H175 WeakPolarHBondContact O-CB 3.37Å; M172-H175 PolarHBondContact O-N 3.37Å; M172-S176 WeakPolarHBondContact O-CB 3.41Å; M172-S176 PolarHBondContact O-N 3.09Å; M172-S176 PolarHBondContact O-OG 3.24Å; M172-S176 VanDerWaalsContact O-OG 3.06Å; M172-L233 HydrophobicContact CE-CD1 4Å; M172-D236 HydrophobicContact SD-CB 4.46Å; M172-E237 HydrophobicContact CE-CG 4.05Å; M172-E237 HydrophobicContact SD-CG 3.86Å |
| 173 | I | 96 | Very high | 92.8 | Very high | 43 Ų | 43 | 35 Ų | 35 | 22% | 0.221 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -67 | -46.2 | 177.5 | -58.8 | 161.1 | 0 | 0 | 0 | 109.7 | L170 H175 S176 L177 V362 | L170-I173 HydrophobicContact CD2-CD1 4.34Å; L170-I173 PolarHBondContact O-N 3.36Å; I173-H175 VanDerWaalsContact C-N 3.31Å; I173-H175 PolarHBondContact O-N 2.79Å; I173-S176 PolarHBondContact O-N 3.19Å; I173-L177 WeakPolarHBondContact O-CB 3.26Å; I173-L177 PolarHBondContact O-N 2.94Å; I173-V362 HydrophobicContact CD1-CB 3.63Å; I173-V362 HydrophobicContact CD1-CG1 3.47Å; I173-V362 VanDerWaalsContact CD1-CG1 3.47Å; I173-V362 HydrophobicContact CD1-CG2 3.42Å; I173-V362 VanDerWaalsContact CD1-CG2 3.42Å; I173-V362 HydrophobicContact CG1-CG2 4.24Å |
| 174 | I | 95.9 | Very high | 93.2 | Very high | 22 Ų | 22 | 36.2 Ų | 36.2 | 11% | 0.113 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -61.1 | -43.7 | 175.9 | -68.4 | 173.5 | 0 | 0 | 0 | 109.9 | F142 Y167 L170 A171 L177 Y178 | F142-I174 HydrophobicContact CE1-CG2 4.13Å; F142-I174 HydrophobicContact CZ-CG1 4.2Å; F142-I174 HydrophobicContact CZ-CG2 4.21Å; Y167-I174 HydrophobicContact CD2-CD1 4.49Å; Y167-I174 HydrophobicContact CE2-CD1 3.67Å; L170-I174 HydrophobicContact CB-CD1 3.96Å; L170-I174 HydrophobicContact CB-CG1 4.46Å; L170-I174 WeakPolarHBondContact O-CB 3.48Å; L170-I174 VanDerWaalsContact O-CG1 3.27Å; L170-I174 WeakPolarHBondContact O-CG1 3.33Å; L170-I174 PolarHBondContact O-N 3.27Å; A171-I174 PolarHBondContact O-N 2.88Å; I174-L177 WeakPolarHBondContact O-CB 3.12Å; I174-L177 PolarHBondContact O-N 3.43Å; I174-Y178 HydrophobicContact CG2-CD2 3.71Å; I174-Y178 HydrophobicContact CG2-CE2 3.43Å; I174-Y178 VanDerWaalsContact CG2-CE2 3.43Å; I174-Y178 WeakPolarHBondContact O-CD2 3.13Å; I174-Y178 PolarHBondContact O-N 3.06Å |
| 175 | H | 96 | Very high | 93.6 | Very high | 11 Ų | 11 | 35 Ų | 35 | 5% | 0.051 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.1 | -51.5 | 175.6 | -172.2 | 97.6 | 0 | 0 | 0 | 111.9 | A171 M172 I173 L177 Y178 F179 S229 L233 D236 | A171-H175 WeakPolarHBondContact O-CB 3.47Å; A171-H175 PolarHBondContact O-N 3.04Å; M172-H175 WeakPolarHBondContact O-CB 3.37Å; M172-H175 PolarHBondContact O-N 3.37Å; I173-H175 VanDerWaalsContact C-N 3.31Å; I173-H175 PolarHBondContact O-N 2.79Å; H175-L177 VanDerWaalsContact C-N 3.28Å; H175-L177 PolarHBondContact O-N 3.18Å; H175-Y178 PolarHBondContact O-N 3.46Å; H175-F179 PolarHBondContact O-N 2.83Å; H175-S229 PolarHBondContact CE1-O 3.09Å; H175-L233 WeakPolarHBondContact CE1-CA 3.47Å; H175-L233 VanDerWaalsContact CE1-CB 3.41Å; H175-L233 WeakPolarHBondContact CE1-CB 3.24Å; H175-D236 HydrophobicContact CB-CB 4.48Å; H175-D236 IonicContact CE1-OD2 2.97Å; H175-D236 IonicContact CG-OD2 2.68Å; H175-D236 IonicContact ND1-OD2 2.66Å; H175-D236 PolarHBondContact ND1-OD2 2.92Å |
| 176 | S | 96 | Very high | 93.9 | Very high | 64 Ų | 64 | 31.5 Ų | 31.5 | 45% | 0.448 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -59.6 | -37.9 | 177.8 | -67 | 0 | 0 | 0 | 0 | 112.2 | M172 I173 F179 G180 | M172-S176 WeakPolarHBondContact O-CB 3.41Å; M172-S176 PolarHBondContact O-N 3.09Å; M172-S176 PolarHBondContact O-OG 3.24Å; M172-S176 VanDerWaalsContact O-OG 3.06Å; I173-S176 PolarHBondContact O-N 3.19Å; S176-F179 PolarHBondContact O-N 3.17Å; S176-G180 WeakPolarHBondContact O-CA 3.28Å; S176-G180 PolarHBondContact O-N 3.48Å |
| 177 | L | 95.6 | Very high | 94.1 | Very high | 55 Ų | 55 | 30 Ų | 30 | 29% | 0.288 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.4 | -48.5 | 174.6 | -176.5 | 71.6 | 0 | 0 | 0 | 111.3 | F142 I173 I174 H175 V181 M355 | F142-L177 HydrophobicContact CD1-CD2 3.89Å; F142-L177 HydrophobicContact CE1-CD2 3.68Å; F142-L177 HydrophobicContact CE2-CD2 4.45Å; F142-L177 HydrophobicContact CG-CD2 4.37Å; F142-L177 HydrophobicContact CZ-CD2 3.98Å; I173-L177 WeakPolarHBondContact O-CB 3.26Å; I173-L177 PolarHBondContact O-N 2.94Å; I174-L177 WeakPolarHBondContact O-CB 3.12Å; I174-L177 PolarHBondContact O-N 3.43Å; H175-L177 VanDerWaalsContact C-N 3.28Å; H175-L177 PolarHBondContact O-N 3.18Å; L177-V181 HydrophobicContact CD1-CG2 3.7Å; L177-V181 HydrophobicContact CG-CG2 4.33Å; L177-V181 VanDerWaalsContact O-CB 3.22Å; L177-V181 WeakPolarHBondContact O-CB 3.43Å; L177-V181 VanDerWaalsContact O-CG2 3.28Å; L177-V181 WeakPolarHBondContact O-CG2 3.39Å; L177-V181 PolarHBondContact O-N 3.48Å; L177-M355 HydrophobicContact CD1-SD 4.39Å |
| 178 | Y | 96.3 | Very high | 94 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.4 | -47.8 | 176.8 | -81.1 | -66.3 | 0 | 0 | 0 | 112.2 | L139 F142 S143 H146 I174 H175 G182 R278 L282 | L139-Y178 HydrophobicContact CD1-CD1 3.77Å; L139-Y178 HydrophobicContact CD1-CE1 4.14Å; L139-Y178 HydrophobicContact CG-CD1 4.44Å; F142-Y178 HydrophobicContact CD1-CE1 4.28Å; F142-Y178 HydrophobicContact CD1-CE2 4.41Å; F142-Y178 AromaticContact CD1-CZ 3.96Å; F142-Y178 AromaticContact CE1-CE2 3.85Å; F142-Y178 HydrophobicContact CE1-CE2 3.85Å; F142-Y178 AromaticContact CE1-CZ 3.84Å; S143-Y178 VanDerWaalsContact CA-OH 3.26Å; S143-Y178 WeakPolarHBondContact CA-OH 3.27Å; S143-Y178 PolarHBondContact OG-OH 3.38Å; H146-Y178 WeakPolarHBondContact CB-OH 3.49Å; H146-Y178 AromaticContact CE1-CE2 3.98Å; H146-Y178 AromaticContact ND1-CE2 3.47Å; H146-Y178 WeakPolarHBondContact ND1-CE2 3.45Å; H146-Y178 AromaticContact ND1-CZ 3.65Å; H146-Y178 PolarHBondContact ND1-OH 2.87Å; I174-Y178 HydrophobicContact CG2-CD2 3.71Å; I174-Y178 HydrophobicContact CG2-CE2 3.43Å; I174-Y178 VanDerWaalsContact CG2-CE2 3.43Å; I174-Y178 WeakPolarHBondContact O-CD2 3.13Å; I174-Y178 PolarHBondContact O-N 3.06Å; H175-Y178 PolarHBondContact O-N 3.46Å; Y178-G182 VanDerWaalsContact O-CA 3.27Å; Y178-G182 WeakPolarHBondContact O-CA 3.2Å; Y178-G182 PolarHBondContact O-N 3.34Å; Y178-R278 VanDerWaalsContact CD2-CZ 3.43Å; Y178-L282 HydrophobicContact CD1-CD1 3.99Å; Y178-L282 HydrophobicContact CE1-CD1 3.76Å |
| 179 | F | 95.5 | Very high | 93.9 | Very high | 88 Ų | 88 | 30.9 Ų | 30.9 | 39% | 0.386 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -70.2 | -47.9 | -176.6 | -174.7 | -110.4 | 0 | 0 | 0 | 111.9 | H175 S176 A183 L226 L230 | H175-F179 PolarHBondContact O-N 2.83Å; S176-F179 PolarHBondContact O-N 3.17Å; F179-A183 VanDerWaalsContact O-CB 3.24Å; F179-A183 WeakPolarHBondContact O-CB 3.47Å; F179-A183 PolarHBondContact O-N 2.95Å; F179-L226 HydrophobicContact CD2-CD2 3.96Å; F179-L226 HydrophobicContact CE2-CD2 4.06Å; F179-L230 HydrophobicContact CD2-CD1 3.4Å; F179-L230 VanDerWaalsContact CD2-CD1 3.4Å; F179-L230 HydrophobicContact CE2-CD1 3.11Å; F179-L230 HydrophobicContact CG-CD1 4.46Å; F179-L230 HydrophobicContact CZ-CD1 3.96Å |
| 180 | G | 95 | Very high | 93.8 | Very high | 18 Ų | 18 | 32.8 Ų | 32.8 | 19% | 0.186 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -65.8 | -53.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S176 G182 A183 V184 | S176-G180 WeakPolarHBondContact O-CA 3.28Å; S176-G180 PolarHBondContact O-N 3.48Å; G180-G182 VanDerWaalsContact C-N 3.31Å; G180-G182 PolarHBondContact O-N 3.49Å; G180-A183 PolarHBondContact O-N 2.87Å; G180-V184 WeakPolarHBondContact O-CG2 3.16Å; G180-V184 PolarHBondContact O-N 3.04Å; G180-V184 VanDerWaalsContact O-N 3.09Å |
| 181 | V | 95.4 | Very high | 93.4 | Very high | 9 Ų | 9 | 33.9 Ų | 33.9 | 6% | 0.055 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -66.1 | -38.8 | 177.8 | -176.8 | 0 | 0 | 0 | 0 | 110.5 | L135 L139 L177 A183 V184 C185 M355 | L135-V181 HydrophobicContact CB-CG1 3.9Å; L135-V181 HydrophobicContact CD2-CG1 4.21Å; L135-V181 HydrophobicContact CG-CG1 4.44Å; L139-V181 HydrophobicContact CB-CG1 4.14Å; L139-V181 HydrophobicContact CD1-CB 4.26Å; L139-V181 HydrophobicContact CD1-CG1 4.38Å; L139-V181 HydrophobicContact CD2-CB 4.18Å; L139-V181 HydrophobicContact CD2-CG1 3.98Å; L139-V181 HydrophobicContact CG-CG1 4.4Å; L177-V181 HydrophobicContact CD1-CG2 3.7Å; L177-V181 HydrophobicContact CG-CG2 4.33Å; L177-V181 VanDerWaalsContact O-CB 3.22Å; L177-V181 WeakPolarHBondContact O-CB 3.43Å; L177-V181 VanDerWaalsContact O-CG2 3.28Å; L177-V181 WeakPolarHBondContact O-CG2 3.39Å; L177-V181 PolarHBondContact O-N 3.48Å; V181-A183 VanDerWaalsContact C-N 3.32Å; V181-A183 PolarHBondContact O-N 3.02Å; V181-V184 PolarHBondContact O-N 3.42Å; V181-C185 PolarHBondContact O-N 3.29Å; V181-C185 PolarHBondContact O-SG 3.5Å; V181-M355 HydrophobicContact CG2-CE 4.07Å; V181-M355 HydrophobicContact CG2-SD 4Å |
| 182 | G | 95.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -59.7 | -39.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y178 G180 C185 T186 | Y178-G182 VanDerWaalsContact O-CA 3.27Å; Y178-G182 WeakPolarHBondContact O-CA 3.2Å; Y178-G182 PolarHBondContact O-N 3.34Å; G180-G182 VanDerWaalsContact C-N 3.31Å; G180-G182 PolarHBondContact O-N 3.49Å; G182-C185 PolarHBondContact O-N 2.86Å; G182-T186 WeakPolarHBondContact O-CB 3.38Å; G182-T186 PolarHBondContact O-N 3.34Å; G182-T186 PolarHBondContact O-OG1 3.41Å |
| 183 | A | 95.2 | Very high | 91.8 | Very high | 28 Ų | 28 | 32.1 Ų | 32.1 | 23% | 0.231 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.8 | -44.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | F179 G180 V181 C185 T186 I187 L226 | F179-A183 VanDerWaalsContact O-CB 3.24Å; F179-A183 WeakPolarHBondContact O-CB 3.47Å; F179-A183 PolarHBondContact O-N 2.95Å; G180-A183 PolarHBondContact O-N 2.87Å; V181-A183 VanDerWaalsContact C-N 3.32Å; V181-A183 PolarHBondContact O-N 3.02Å; A183-C185 VanDerWaalsContact C-N 3.33Å; A183-C185 PolarHBondContact O-N 3.3Å; A183-T186 WeakPolarHBondContact O-CB 3.43Å; A183-T186 PolarHBondContact O-N 3.36Å; A183-T186 VanDerWaalsContact O-N 3.17Å; A183-I187 WeakPolarHBondContact O-CG1 3.2Å; A183-I187 PolarHBondContact O-N 3.39Å; A183-L226 HydrophobicContact CB-CD2 4.46Å |
| 184 | V | 94.1 | Very high | 90.7 | Very high | 32 Ų | 32 | 33.3 Ų | 33.3 | 19% | 0.194 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -59.4 | -44.5 | 174.6 | 174.1 | 0 | 0 | 0 | 0 | 111 | F128 L135 G180 V181 T186 I187 A188 L351 | F128-V184 HydrophobicContact CE2-CG1 4.2Å; F128-V184 HydrophobicContact CZ-CG1 4.41Å; L135-V184 HydrophobicContact CD1-CG1 4.06Å; G180-V184 WeakPolarHBondContact O-CG2 3.16Å; G180-V184 PolarHBondContact O-N 3.04Å; G180-V184 VanDerWaalsContact O-N 3.09Å; V181-V184 PolarHBondContact O-N 3.42Å; V184-T186 VanDerWaalsContact C-N 3.31Å; V184-T186 PolarHBondContact O-N 3.42Å; V184-I187 PolarHBondContact O-N 3.01Å; V184-A188 WeakPolarHBondContact O-CB 3.4Å; V184-A188 PolarHBondContact O-N 3.38Å; V184-L351 HydrophobicContact CG2-CD2 4.27Å |
| 185 | C | 92.9 | Very high | 89.3 | Confident | 5 Ų | 5 | 35.2 Ų | 35.2 | 3% | 0.034 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.4 | -36.9 | 177 | -63.3 | 0 | 0 | 0 | 0 | 111.9 | V181 G182 A183 A188 A189 F222 | V181-C185 PolarHBondContact O-N 3.29Å; V181-C185 PolarHBondContact O-SG 3.5Å; G182-C185 PolarHBondContact O-N 2.86Å; A183-C185 VanDerWaalsContact C-N 3.33Å; A183-C185 PolarHBondContact O-N 3.3Å; C185-A188 PolarHBondContact O-N 2.91Å; C185-A189 WeakPolarHBondContact O-CB 3.29Å; C185-A189 PolarHBondContact O-N 3.26Å; C185-F222 HydrophobicContact CB-CD1 4.37Å; C185-F222 HydrophobicContact CB-CE1 3.72Å |
| 186 | T | 92.1 | Very high | 87.9 | Confident | 6 Ų | 6 | 43 Ų | 43 | 4% | 0.037 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.3 | -44.1 | 176.2 | -57.4 | 0 | 0 | 0 | 0 | 111.3 | G182 A183 V184 A189 M190 F222 L223 L226 | G182-T186 WeakPolarHBondContact O-CB 3.38Å; G182-T186 PolarHBondContact O-N 3.34Å; G182-T186 PolarHBondContact O-OG1 3.41Å; A183-T186 WeakPolarHBondContact O-CB 3.43Å; A183-T186 PolarHBondContact O-N 3.36Å; A183-T186 VanDerWaalsContact O-N 3.17Å; V184-T186 VanDerWaalsContact C-N 3.31Å; V184-T186 PolarHBondContact O-N 3.42Å; T186-A189 PolarHBondContact O-N 2.91Å; T186-M190 HydrophobicContact CG2-CE 4.28Å; T186-M190 WeakPolarHBondContact O-CG 3.22Å; T186-M190 PolarHBondContact O-N 3.38Å; T186-F222 HydrophobicContact CG2-CB 4.01Å; T186-L223 HydrophobicContact CG2-CD2 4.11Å; T186-L226 HydrophobicContact CG2-CD1 4.03Å; T186-L226 WeakPolarHBondContact OG1-CD1 3.33Å |
| 187 | I | 92.1 | Very high | 86.5 | Confident | 93 Ų | 93 | 42.8 Ų | 42.8 | 48% | 0.477 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.4 | -45.8 | 175.1 | -67.2 | 165.9 | 0 | 0 | 0 | 110.5 | F128 A183 V184 A189 M190 D191 | F128-I187 HydrophobicContact CZ-CG2 4.45Å; A183-I187 WeakPolarHBondContact O-CG1 3.2Å; A183-I187 PolarHBondContact O-N 3.39Å; V184-I187 PolarHBondContact O-N 3.01Å; I187-A189 VanDerWaalsContact C-N 3.31Å; I187-A189 PolarHBondContact O-N 3.12Å; I187-M190 HydrophobicContact CB-CE 4.49Å; I187-M190 HydrophobicContact CG1-CE 4.11Å; I187-M190 PolarHBondContact O-N 3.48Å; I187-D191 PolarHBondContact O-N 2.95Å |
| 188 | A | 89.9 | Confident | 85.1 | Confident | 14 Ų | 14 | 40.4 Ų | 40.4 | 12% | 0.116 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63 | -36.5 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | F128 A132 V184 C185 D191 R192 | F128-A188 HydrophobicContact CE1-CB 3.72Å; F128-A188 HydrophobicContact CZ-CB 3.97Å; A132-A188 HydrophobicContact CB-CB 3.24Å; V184-A188 WeakPolarHBondContact O-CB 3.4Å; V184-A188 PolarHBondContact O-N 3.38Å; C185-A188 PolarHBondContact O-N 2.91Å; A188-D191 PolarHBondContact O-N 2.86Å; A188-R192 WeakPolarHBondContact O-CB 3.48Å; A188-R192 PolarHBondContact O-N 2.87Å |
| 189 | A | 87.6 | Confident | 83.8 | Confident | 7 Ų | 7 | 43.2 Ų | 43.2 | 6% | 0.058 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -65.6 | -43.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | C185 T186 I187 D191 R192 Y193 F222 | C185-A189 WeakPolarHBondContact O-CB 3.29Å; C185-A189 PolarHBondContact O-N 3.26Å; T186-A189 PolarHBondContact O-N 2.91Å; I187-A189 VanDerWaalsContact C-N 3.31Å; I187-A189 PolarHBondContact O-N 3.12Å; A189-D191 VanDerWaalsContact C-N 3.34Å; A189-D191 PolarHBondContact O-N 3.38Å; A189-R192 PolarHBondContact O-N 3.31Å; A189-Y193 HydrophobicContact CB-CD2 4.09Å; A189-Y193 HydrophobicContact CB-CE2 4.18Å; A189-Y193 VanDerWaalsContact O-CB 3.23Å; A189-Y193 WeakPolarHBondContact O-CB 3.38Å; A189-Y193 WeakPolarHBondContact O-CD2 3.46Å; A189-Y193 PolarHBondContact O-N 3.41Å; A189-F222 HydrophobicContact CB-CD2 3.48Å; A189-F222 VanDerWaalsContact CB-CD2 3.48Å; A189-F222 HydrophobicContact CB-CE2 3.38Å; A189-F222 HydrophobicContact CB-CG 4.21Å; A189-F222 HydrophobicContact CB-CZ 4.03Å |
| 190 | M | 87.5 | Confident | 82.8 | Confident | 88 Ų | 88 | 43.5 Ų | 43.5 | 43% | 0.433 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.6 | -39.9 | 175.4 | -69.6 | -173.8 | -63.1 | 0 | 0 | 112.2 | T186 I187 D194 V219 | T186-M190 HydrophobicContact CG2-CE 4.28Å; T186-M190 WeakPolarHBondContact O-CG 3.22Å; T186-M190 PolarHBondContact O-N 3.38Å; I187-M190 HydrophobicContact CB-CE 4.49Å; I187-M190 HydrophobicContact CG1-CE 4.11Å; I187-M190 PolarHBondContact O-N 3.48Å; M190-D194 PolarHBondContact O-N 3.39Å; M190-V219 HydrophobicContact CG-CG1 4.21Å |
| 191 | D | 84.7 | Confident | 81.6 | Confident | 71 Ų | 71 | 43.9 Ų | 43.9 | 38% | 0.38 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65.3 | -45.2 | 176.2 | -172.9 | 63.9 | 0 | 0 | 0 | 112 | Q125 I187 A188 A189 Y193 | Q125-D191 PolarHBondContact NE2-OD2 3.38Å; I187-D191 PolarHBondContact O-N 2.95Å; A188-D191 PolarHBondContact O-N 2.86Å; A189-D191 VanDerWaalsContact C-N 3.34Å; A189-D191 PolarHBondContact O-N 3.38Å; D191-Y193 PolarHBondContact O-N 3.07Å |
| 192 | R | 79.4 | Confident | 80.4 | Confident | 17 Ų | 17 | 46.3 Ų | 46.3 | 6% | 0.064 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.5 | -39.6 | 178.2 | -173.4 | -166.9 | -175.9 | 179.4 | 4.9 | 112.3 | Y133 A188 A189 A289 D294 | Y133-R192 WeakPolarHBondContact OH-CD 3.27Å; Y133-R192 PolarHBondContact OH-NE 3.42Å; Y133-R192 PolarHBondContact OH-NH1 3.03Å; Y133-R192 PolarHBondContact OH-NH2 3.17Å; A188-R192 WeakPolarHBondContact O-CB 3.48Å; A188-R192 PolarHBondContact O-N 2.87Å; A189-R192 PolarHBondContact O-N 3.31Å; R192-A289 PolarHBondContact NH1-O 2.96Å; R192-A289 PolarHBondContact NH2-O 2.93Å; R192-D294 IonicContact CZ-OD1 3.11Å; R192-D294 IonicContact NE-OD1 3.49Å; R192-D294 PolarHBondContact NE-OD1 2.79Å; R192-D294 IonicContact NH2-OD1 3.81Å; R192-D294 PolarHBondContact NH2-OD1 2.77Å; R192-D294 IonicContact NH2-OD2 2.78Å; R192-D294 PolarHBondContact NH2-OD2 3.09Å |
| 193 | Y | 75.2 | Confident | 79.4 | Confident | 3 Ų | 3 | 54.7 Ų | 54.7 | 1% | 0.012 | 27% | 0.274 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.8 | 15.4 | -168.7 | -61.3 | -46.9 | 0 | 0 | 0 | 114.3 | A189 D191 L195 H215 M218 V219 | A189-Y193 HydrophobicContact CB-CD2 4.09Å; A189-Y193 HydrophobicContact CB-CE2 4.18Å; A189-Y193 VanDerWaalsContact O-CB 3.23Å; A189-Y193 WeakPolarHBondContact O-CB 3.38Å; A189-Y193 WeakPolarHBondContact O-CD2 3.46Å; A189-Y193 PolarHBondContact O-N 3.41Å; D191-Y193 PolarHBondContact O-N 3.07Å; Y193-L195 WeakPolarHBondContact O-CA 3.42Å; Y193-L195 PolarHBondContact O-N 3.49Å; Y193-H215 HydrophobicContact CD1-CB 4.43Å; Y193-H215 AromaticContact CD1-CE1 3.44Å; Y193-H215 VanDerWaalsContact CD1-CE1 3.44Å; Y193-H215 WeakPolarHBondContact CD1-CE1 3.44Å; Y193-H215 AromaticContact CD1-CG 3.87Å; Y193-H215 AromaticContact CD1-ND1 2.87Å; Y193-H215 WeakPolarHBondContact CD1-ND1 3.23Å; Y193-H215 AromaticContact CE1-CE1 3.62Å; Y193-H215 AromaticContact CE1-ND1 3.23Å; Y193-H215 WeakPolarHBondContact CE1-ND1 3.22Å; Y193-H215 HydrophobicContact CG-CB 4.41Å; Y193-H215 AromaticContact CG-ND1 3.65Å; Y193-M218 HydrophobicContact CD2-CB 4.12Å; Y193-M218 HydrophobicContact CE2-CB 3.7Å; Y193-M218 HydrophobicContact CE2-CG 4.12Å; Y193-V219 HydrophobicContact CD2-CG2 4.38Å |
| 194 | D | 73.2 | Confident | 78.5 | Confident | 69 Ų | 69 | 59.2 Ų | 59.2 | 37% | 0.369 | 29% | 0.293 | S | S | . | . | trans | -14.2 | 91.9 | -178 | -174.5 | -3.9 | 0 | 0 | 0 | 112.4 | M190 Y196 Q197 S198 | M190-D194 PolarHBondContact O-N 3.39Å; D194-Y196 PolarHBondContact O-N 2.82Å; D194-Y196 WeakPolarHBondContact OD1-CB 3.34Å; D194-Y196 PolarHBondContact OD1-N 2.89Å; D194-Y196 VanDerWaalsContact OD1-N 3.15Å; D194-Q197 HydrophobicContact CB-CB 4.22Å; D194-Q197 PolarHBondContact O-N 3.33Å; D194-Q197 PolarHBondContact OD1-N 3.47Å; D194-Q197 WeakPolarHBondContact OD2-CB 3.46Å; D194-S198 WeakPolarHBondContact O-CB 3.46Å; D194-S198 PolarHBondContact O-N 2.88Å; D194-S198 PolarHBondContact O-OG 2.88Å | ||
| 195 | L | 65.9 | Low | 77.5 | Confident | 61 Ų | 61 | 60.9 Ų | 60.9 | 32% | 0.319 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -64.2 | -31.5 | -172 | -68.8 | 173.7 | 0 | 0 | 0 | 110 | Y193 S198 V199 V219 | Y193-L195 WeakPolarHBondContact O-CA 3.42Å; Y193-L195 PolarHBondContact O-N 3.49Å; L195-S198 PolarHBondContact O-N 3.36Å; L195-V199 WeakPolarHBondContact O-CB 3.43Å; L195-V199 WeakPolarHBondContact O-CG2 3.41Å; L195-V199 PolarHBondContact O-N 3.47Å; L195-V219 HydrophobicContact CD1-CG2 4.47Å |
| 196 | Y | 66.7 | Low | 76.5 | Confident | 175 Ų | 175 | 64.5 Ų | 64.5 | 69% | 0.686 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -66 | -51.9 | 179.5 | 177.5 | -94.5 | 0 | 0 | 0 | 110.7 | D194 S198 V199 E200 | D194-Y196 PolarHBondContact O-N 2.82Å; D194-Y196 WeakPolarHBondContact OD1-CB 3.34Å; D194-Y196 PolarHBondContact OD1-N 2.89Å; D194-Y196 VanDerWaalsContact OD1-N 3.15Å; Y196-S198 VanDerWaalsContact C-N 3.29Å; Y196-S198 PolarHBondContact O-N 2.86Å; Y196-V199 PolarHBondContact O-N 2.93Å; Y196-E200 PolarHBondContact O-N 3.33Å |
| 197 | Q | 68.2 | Low | 75.3 | Confident | 60 Ų | 60 | 65.5 Ų | 65.5 | 28% | 0.28 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.3 | -35.2 | 178.3 | -178.2 | 167.7 | 63.9 | 0 | 0 | 112.2 | D194 V199 E200 L201 | D194-Q197 HydrophobicContact CB-CB 4.22Å; D194-Q197 PolarHBondContact O-N 3.33Å; D194-Q197 PolarHBondContact OD1-N 3.47Å; D194-Q197 WeakPolarHBondContact OD2-CB 3.46Å; Q197-V199 VanDerWaalsContact C-N 3.33Å; Q197-V199 PolarHBondContact O-N 3.46Å; Q197-E200 PolarHBondContact O-N 3.23Å; Q197-L201 HydrophobicContact CG-CD1 4.04Å; Q197-L201 HydrophobicContact CG-CG 4.43Å; Q197-L201 WeakPolarHBondContact O-CB 3.18Å; Q197-L201 WeakPolarHBondContact O-CG 3.3Å; Q197-L201 PolarHBondContact O-N 3Å |
| 198 | S | 66.1 | Low | 74.4 | Confident | 5 Ų | 5 | 65.1 Ų | 65.1 | 4% | 0.035 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -63.6 | -39.7 | 175.8 | -61.3 | 0 | 0 | 0 | 0 | 112 | D194 L195 Y196 L202 | D194-S198 WeakPolarHBondContact O-CB 3.46Å; D194-S198 PolarHBondContact O-N 2.88Å; D194-S198 PolarHBondContact O-OG 2.88Å; L195-S198 PolarHBondContact O-N 3.36Å; Y196-S198 VanDerWaalsContact C-N 3.29Å; Y196-S198 PolarHBondContact O-N 2.86Å; S198-L202 PolarHBondContact O-N 2.89Å |
| 199 | V | 69 | Low | 73.8 | Confident | 59 Ų | 59 | 68 Ų | 68 | 36% | 0.358 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -68.7 | -43.4 | 174.9 | 169 | 0 | 0 | 0 | 0 | 110.9 | L195 Y196 Q197 L201 L202 F203 L212 | L195-V199 WeakPolarHBondContact O-CB 3.43Å; L195-V199 WeakPolarHBondContact O-CG2 3.41Å; L195-V199 PolarHBondContact O-N 3.47Å; Y196-V199 PolarHBondContact O-N 2.93Å; Q197-V199 VanDerWaalsContact C-N 3.33Å; Q197-V199 PolarHBondContact O-N 3.46Å; V199-L201 PolarHBondContact O-N 2.78Å; V199-L202 WeakPolarHBondContact O-CB 3.45Å; V199-L202 PolarHBondContact O-N 3.17Å; V199-F203 HydrophobicContact CG1-CD2 3.74Å; V199-F203 HydrophobicContact CG1-CE2 3.5Å; V199-F203 VanDerWaalsContact CG1-CE2 3.5Å; V199-F203 VanDerWaalsContact O-CD2 3.23Å; V199-F203 WeakPolarHBondContact O-CD2 3.46Å; V199-F203 PolarHBondContact O-N 3.43Å; V199-L212 HydrophobicContact CG2-CD1 4.22Å; V199-L212 HydrophobicContact CG2-CD2 4.43Å |
| 200 | E | 73.8 | Confident | 73.3 | Confident | 94 Ų | 94 | 77.7 Ų | 77.7 | 44% | 0.439 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -56.3 | -50.3 | 175 | -175.1 | -177.5 | -176.1 | 0 | 0 | 110.9 | Y196 Q197 L202 F203 L204 | Y196-E200 PolarHBondContact O-N 3.33Å; Q197-E200 PolarHBondContact O-N 3.23Å; E200-L202 VanDerWaalsContact C-N 3.28Å; E200-L202 PolarHBondContact O-N 2.88Å; E200-F203 WeakPolarHBondContact O-CB 3.49Å; E200-F203 PolarHBondContact O-N 3.18Å; E200-F203 VanDerWaalsContact O-N 3.1Å; E200-L204 HydrophobicContact CG-CD1 3.94Å; E200-L204 WeakPolarHBondContact O-CD1 3.4Å; E200-L204 PolarHBondContact O-N 3.46Å |
| 201 | L | 69.1 | Low | 72.8 | Confident | 26 Ų | 26 | 77.4 Ų | 77.4 | 14% | 0.136 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.4 | -27.8 | 178.9 | -74.2 | 169.3 | 0 | 0 | 0 | 113.7 | Q197 V199 G205 S206 L207 M295 V299 | Q197-L201 HydrophobicContact CG-CD1 4.04Å; Q197-L201 HydrophobicContact CG-CG 4.43Å; Q197-L201 WeakPolarHBondContact O-CB 3.18Å; Q197-L201 WeakPolarHBondContact O-CG 3.3Å; Q197-L201 PolarHBondContact O-N 3Å; V199-L201 PolarHBondContact O-N 2.78Å; L201-G205 PolarHBondContact O-N 3.5Å; L201-S206 PolarHBondContact O-N 2.84Å; L201-L207 HydrophobicContact CB-CD1 3.29Å; L201-L207 HydrophobicContact CB-CG 3.73Å; L201-L207 HydrophobicContact CD1-CD1 3.91Å; L201-L207 HydrophobicContact CD1-CG 4.48Å; L201-L207 HydrophobicContact CG-CD1 4.25Å; L201-M295 HydrophobicContact CD1-CE 3.99Å; L201-V299 HydrophobicContact CD1-CG2 4.25Å |
| 202 | L | 70.6 | Confident | 72.6 | Confident | 59 Ų | 59 | 75.6 Ų | 75.6 | 31% | 0.309 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -67.2 | -46 | 170.1 | -178.3 | 71.4 | 0 | 0 | 0 | 110.9 | S198 V199 E200 L204 G205 L212 | S198-L202 PolarHBondContact O-N 2.89Å; V199-L202 WeakPolarHBondContact O-CB 3.45Å; V199-L202 PolarHBondContact O-N 3.17Å; E200-L202 VanDerWaalsContact C-N 3.28Å; E200-L202 PolarHBondContact O-N 2.88Å; L202-L204 PolarHBondContact O-N 3.06Å; L202-G205 WeakPolarHBondContact O-CA 3.32Å; L202-G205 PolarHBondContact O-N 2.75Å; L202-L212 HydrophobicContact CD2-CD2 3.65Å |
| 203 | F | 73.7 | Confident | 72.8 | Confident | 177 Ų | 177 | 81.6 Ų | 81.6 | 78% | 0.776 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -61.6 | -31.5 | 175.3 | -80.9 | -69.5 | 0 | 0 | 0 | 112.5 | V199 E200 G205 | V199-F203 HydrophobicContact CG1-CD2 3.74Å; V199-F203 HydrophobicContact CG1-CE2 3.5Å; V199-F203 VanDerWaalsContact CG1-CE2 3.5Å; V199-F203 VanDerWaalsContact O-CD2 3.23Å; V199-F203 WeakPolarHBondContact O-CD2 3.46Å; V199-F203 PolarHBondContact O-N 3.43Å; E200-F203 WeakPolarHBondContact O-CB 3.49Å; E200-F203 PolarHBondContact O-N 3.18Å; E200-F203 VanDerWaalsContact O-N 3.1Å; F203-G205 PolarHBondContact O-N 2.91Å |
| 204 | L | 77.7 | Confident | 73.3 | Confident | 122 Ų | 122 | 83.6 Ų | 83.6 | 64% | 0.639 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75 | -0.5 | 172.8 | -85.6 | 78.1 | 0 | 0 | 0 | 113.6 | E200 L202 S206 | E200-L204 HydrophobicContact CG-CD1 3.94Å; E200-L204 WeakPolarHBondContact O-CD1 3.4Å; E200-L204 PolarHBondContact O-N 3.46Å; L202-L204 PolarHBondContact O-N 3.06Å; L204-S206 PolarHBondContact O-N 3.21Å |
| 205 | G | 73.1 | Confident | 73.8 | Confident | 68 Ų | 68 | 80.3 Ų | 80.3 | 70% | 0.701 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.8 | 12.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | L201 L202 F203 | L201-G205 PolarHBondContact O-N 3.5Å; L202-G205 WeakPolarHBondContact O-CA 3.32Å; L202-G205 PolarHBondContact O-N 2.75Å; F203-G205 PolarHBondContact O-N 2.91Å |
| 206 | S | 71.3 | Confident | 74.7 | Confident | 80 Ų | 80 | 82.9 Ų | 82.9 | 56% | 0.559 | 42% | 0.418 | S | S | * | . | trans | -90.3 | -12.2 | -173.8 | -176.2 | 0 | 0 | 0 | 0 | 113.8 | L201 L204 | L201-S206 PolarHBondContact O-N 2.84Å; L204-S206 PolarHBondContact O-N 3.21Å | ||
| 207 | L | 66.7 | Low | 75.8 | Confident | 27 Ų | 27 | 75.9 Ų | 75.9 | 14% | 0.141 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -120 | 140 | -177.7 | -72.4 | 176.2 | 0 | 0 | 0 | 112.4 | L201 M295 | L201-L207 HydrophobicContact CB-CD1 3.29Å; L201-L207 HydrophobicContact CB-CG 3.73Å; L201-L207 HydrophobicContact CD1-CD1 3.91Å; L201-L207 HydrophobicContact CD1-CG 4.48Å; L201-L207 HydrophobicContact CG-CD1 4.25Å; L207-M295 HydrophobicContact CD1-CE 3.42Å; L207-M295 VanDerWaalsContact CD1-CE 3.42Å; L207-M295 HydrophobicContact CD2-CE 3.67Å; L207-M295 HydrophobicContact CD2-SD 3.93Å; L207-M295 HydrophobicContact CG-CE 4.17Å |
| 208 | S | 72.6 | Confident | 76.8 | Confident | 86 Ų | 86 | 73 Ų | 73 | 60% | 0.601 | 39% | 0.385 | S | S | * | . | trans | -68.2 | 131.2 | 169 | -48.1 | 0 | 0 | 0 | 0 | 110.2 | W210 R211 | S208-W210 PolarHBondContact O-N 3.16Å; S208-W210 VanDerWaalsContact O-N 3.1Å; S208-R211 WeakPolarHBondContact O-CB 3.27Å; S208-R211 PolarHBondContact O-N 3.14Å | ||
| 209 | C | 76.9 | Confident | 78 | Confident | 75 Ų | 75 | 73.3 Ų | 73.3 | 51% | 0.507 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -50.6 | -36.5 | 177.1 | -176.9 | 0 | 0 | 0 | 0 | 113 | R211 L212 F213 | C209-R211 PolarHBondContact O-N 2.94Å; C209-L212 PolarHBondContact O-N 2.89Å; C209-L212 VanDerWaalsContact O-N 3.14Å; C209-F213 PolarHBondContact O-N 2.89Å |
| 210 | W | 77.9 | Confident | 79.1 | Confident | 209 Ų | 209 | 72.9 Ų | 72.9 | 79% | 0.792 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -53.2 | -38.5 | 174.8 | -179.3 | -105.1 | 0 | 0 | 0 | 113.5 | S208 F213 F214 | S208-W210 PolarHBondContact O-N 3.16Å; S208-W210 VanDerWaalsContact O-N 3.1Å; W210-F213 PolarHBondContact O-N 3.07Å; W210-F214 PolarHBondContact O-N 2.88Å |
| 211 | R | 77.9 | Confident | 80 | Confident | 83 Ų | 83 | 70.7 Ų | 70.7 | 31% | 0.313 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -69.8 | -41.3 | -179.6 | -169.9 | 178.4 | -60.3 | -169.5 | -2.6 | 111.4 | S208 C209 F213 F214 H215 P293 M295 | S208-R211 WeakPolarHBondContact O-CB 3.27Å; S208-R211 PolarHBondContact O-N 3.14Å; C209-R211 PolarHBondContact O-N 2.94Å; R211-F213 VanDerWaalsContact C-N 3.32Å; R211-F213 PolarHBondContact O-N 3.49Å; R211-F214 WeakPolarHBondContact O-CB 3.46Å; R211-F214 PolarHBondContact O-N 3.24Å; R211-H215 VanDerWaalsContact CG-NE2 3.29Å; R211-H215 WeakPolarHBondContact CG-NE2 3.34Å; R211-H215 PolarHBondContact O-CD2 3.35Å; R211-H215 PolarHBondContact O-N 2.99Å; R211-P293 HydrophobicContact CG-CG 4Å; R211-M295 WeakPolarHBondContact CD-SD 3.4Å; R211-M295 PolarHBondContact NH1-SD 3.26Å |
| 212 | L | 78.9 | Confident | 81.1 | Confident | 33 Ų | 33 | 69.7 Ų | 69.7 | 17% | 0.173 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 174.6 | -179.1 | 67.6 | 0 | 0 | 0 | 110.9 | V199 L202 C209 F214 H215 F216 | V199-L212 HydrophobicContact CG2-CD1 4.22Å; V199-L212 HydrophobicContact CG2-CD2 4.43Å; L202-L212 HydrophobicContact CD2-CD2 3.65Å; C209-L212 PolarHBondContact O-N 2.89Å; C209-L212 VanDerWaalsContact O-N 3.14Å; L212-F214 VanDerWaalsContact C-N 3.29Å; L212-F214 PolarHBondContact O-N 3.11Å; L212-H215 PolarHBondContact O-N 3.1Å; L212-H215 VanDerWaalsContact O-N 3.16Å; L212-F216 WeakPolarHBondContact O-CB 3.42Å; L212-F216 PolarHBondContact O-N 3.33Å |
| 213 | F | 84.2 | Confident | 82.2 | Confident | 143 Ų | 143 | 71.2 Ų | 71.2 | 63% | 0.627 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -59.3 | -40.7 | 177.5 | -119.8 | -85 | 0 | 0 | 0 | 112.2 | C209 W210 R211 G217 | C209-F213 PolarHBondContact O-N 2.89Å; W210-F213 PolarHBondContact O-N 3.07Å; R211-F213 VanDerWaalsContact C-N 3.32Å; R211-F213 PolarHBondContact O-N 3.49Å; F213-G217 PolarHBondContact O-N 2.94Å |
| 214 | F | 85.8 | Confident | 83.3 | Confident | 44 Ų | 44 | 67.1 Ų | 67.1 | 19% | 0.193 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -60.3 | -48.4 | 174.1 | -176.6 | -88.7 | 0 | 0 | 0 | 111.6 | W210 R211 L212 G217 M218 L288 P293 | W210-F214 PolarHBondContact O-N 2.88Å; R211-F214 WeakPolarHBondContact O-CB 3.46Å; R211-F214 PolarHBondContact O-N 3.24Å; L212-F214 VanDerWaalsContact C-N 3.29Å; L212-F214 PolarHBondContact O-N 3.11Å; F214-G217 PolarHBondContact O-N 3.31Å; F214-M218 HydrophobicContact CD1-CG 4.11Å; F214-M218 HydrophobicContact CE1-CG 3.76Å; F214-M218 HydrophobicContact CZ-CG 4.17Å; F214-M218 HydrophobicContact CZ-SD 4.39Å; F214-M218 VanDerWaalsContact O-CG 3.31Å; F214-M218 WeakPolarHBondContact O-CG 3.29Å; F214-M218 PolarHBondContact O-N 2.72Å; F214-L288 HydrophobicContact CE2-CB 4.47Å; F214-L288 HydrophobicContact CE2-CD2 3.82Å; F214-L288 HydrophobicContact CZ-CB 4.11Å; F214-L288 HydrophobicContact CZ-CD2 4.28Å; F214-L288 WeakPolarHBondContact CZ-O 3.35Å; F214-P293 HydrophobicContact CD1-CG 4.4Å |
| 215 | H | 83 | Confident | 84.1 | Confident | 1 Ų | 1 | 61.3 Ų | 61.3 | 1% | 0.005 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -64.5 | -46.5 | -179.6 | -67.7 | -49.1 | 0 | 0 | 0 | 112.9 | Y193 R211 L212 G217 M218 V219 M295 | Y193-H215 HydrophobicContact CD1-CB 4.43Å; Y193-H215 AromaticContact CD1-CE1 3.44Å; Y193-H215 VanDerWaalsContact CD1-CE1 3.44Å; Y193-H215 WeakPolarHBondContact CD1-CE1 3.44Å; Y193-H215 AromaticContact CD1-CG 3.87Å; Y193-H215 AromaticContact CD1-ND1 2.87Å; Y193-H215 WeakPolarHBondContact CD1-ND1 3.23Å; Y193-H215 AromaticContact CE1-CE1 3.62Å; Y193-H215 AromaticContact CE1-ND1 3.23Å; Y193-H215 WeakPolarHBondContact CE1-ND1 3.22Å; Y193-H215 HydrophobicContact CG-CB 4.41Å; Y193-H215 AromaticContact CG-ND1 3.65Å; R211-H215 VanDerWaalsContact CG-NE2 3.29Å; R211-H215 WeakPolarHBondContact CG-NE2 3.34Å; R211-H215 PolarHBondContact O-CD2 3.35Å; R211-H215 PolarHBondContact O-N 2.99Å; L212-H215 PolarHBondContact O-N 3.1Å; L212-H215 VanDerWaalsContact O-N 3.16Å; H215-G217 VanDerWaalsContact C-N 3.34Å; H215-G217 PolarHBondContact O-N 2.83Å; H215-M218 WeakPolarHBondContact O-CB 3.23Å; H215-M218 PolarHBondContact O-N 2.96Å; H215-V219 PolarHBondContact O-N 3.05Å; H215-V219 VanDerWaalsContact O-N 3.11Å; H215-M295 WeakPolarHBondContact NE2-CG 3.29Å |
| 216 | F | 86.4 | Confident | 85.2 | Confident | 115 Ų | 115 | 59.3 Ų | 59.3 | 50% | 0.504 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -60.3 | -46.3 | 174.9 | -179.7 | -101.2 | 0 | 0 | 0 | 111.1 | L212 M218 V219 C220 | L212-F216 WeakPolarHBondContact O-CB 3.42Å; L212-F216 PolarHBondContact O-N 3.33Å; F216-M218 VanDerWaalsContact C-N 3.3Å; F216-M218 PolarHBondContact O-N 3.37Å; F216-V219 PolarHBondContact O-N 3.31Å; F216-C220 WeakPolarHBondContact CE1-SG 3.24Å; F216-C220 WeakPolarHBondContact CZ-SG 3.44Å; F216-C220 PolarHBondContact O-N 2.77Å; F216-C220 PolarHBondContact O-SG 3.49Å; F216-C220 VanDerWaalsContact O-SG 3.33Å |
| 217 | G | 89.4 | Confident | 86.3 | Confident | 27 Ų | 27 | 58 Ų | 58 | 28% | 0.278 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -56 | -43.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | F213 F214 H215 C220 L221 | F213-G217 PolarHBondContact O-N 2.94Å; F214-G217 PolarHBondContact O-N 3.31Å; H215-G217 VanDerWaalsContact C-N 3.34Å; H215-G217 PolarHBondContact O-N 2.83Å; G217-C220 PolarHBondContact O-N 3.45Å; G217-L221 VanDerWaalsContact O-CG 3.27Å; G217-L221 WeakPolarHBondContact O-CG 3.27Å; G217-L221 PolarHBondContact O-N 3.28Å |
| 218 | M | 89.5 | Confident | 87.7 | Confident | 1 Ų | 1 | 57.5 Ų | 57.5 | 1% | 0.005 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.6 | -49.5 | 176.5 | -75.1 | -55 | -69.5 | 0 | 0 | 112.7 | Y193 F214 H215 F216 C220 L221 F222 T285 L288 A289 | Y193-M218 HydrophobicContact CD2-CB 4.12Å; Y193-M218 HydrophobicContact CE2-CB 3.7Å; Y193-M218 HydrophobicContact CE2-CG 4.12Å; F214-M218 HydrophobicContact CD1-CG 4.11Å; F214-M218 HydrophobicContact CE1-CG 3.76Å; F214-M218 HydrophobicContact CZ-CG 4.17Å; F214-M218 HydrophobicContact CZ-SD 4.39Å; F214-M218 VanDerWaalsContact O-CG 3.31Å; F214-M218 WeakPolarHBondContact O-CG 3.29Å; F214-M218 PolarHBondContact O-N 2.72Å; H215-M218 WeakPolarHBondContact O-CB 3.23Å; H215-M218 PolarHBondContact O-N 2.96Å; F216-M218 VanDerWaalsContact C-N 3.3Å; F216-M218 PolarHBondContact O-N 3.37Å; M218-C220 VanDerWaalsContact C-N 3.31Å; M218-C220 PolarHBondContact O-N 2.68Å; M218-L221 PolarHBondContact O-N 3.47Å; M218-L221 HydrophobicContact SD-CD1 4.28Å; M218-F222 HydrophobicContact CE-CE2 4.03Å; M218-F222 VanDerWaalsContact O-CD2 3.23Å; M218-F222 WeakPolarHBondContact O-CD2 3.45Å; M218-F222 PolarHBondContact O-N 3.37Å; M218-F222 VanDerWaalsContact O-N 3.09Å; M218-T285 WeakPolarHBondContact CE-O 3.27Å; M218-L288 HydrophobicContact CE-CB 3.66Å; M218-L288 HydrophobicContact SD-CB 3.2Å; M218-L288 WeakPolarHBondContact SD-CB 3.04Å; M218-L288 HydrophobicContact SD-CD1 3.57Å; M218-L288 VanDerWaalsContact SD-CD1 3.57Å; M218-L288 HydrophobicContact SD-CG 4Å; M218-A289 HydrophobicContact CE-CB 4.26Å |
| 219 | V | 90.1 | Very high | 88.8 | Confident | 10 Ų | 10 | 53.4 Ų | 53.4 | 6% | 0.061 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61 | -42.8 | 178.1 | 176.8 | 0 | 0 | 0 | 0 | 110.5 | M190 Y193 L195 H215 F216 L221 F222 L223 | M190-V219 HydrophobicContact CG-CG1 4.21Å; Y193-V219 HydrophobicContact CD2-CG2 4.38Å; L195-V219 HydrophobicContact CD1-CG2 4.47Å; H215-V219 PolarHBondContact O-N 3.05Å; H215-V219 VanDerWaalsContact O-N 3.11Å; F216-V219 PolarHBondContact O-N 3.31Å; V219-L221 VanDerWaalsContact C-N 3.34Å; V219-L221 PolarHBondContact O-N 2.95Å; V219-F222 PolarHBondContact O-N 2.87Å; V219-L223 HydrophobicContact CG1-CD1 4.21Å; V219-L223 HydrophobicContact CG1-CG 4.48Å; V219-L223 WeakPolarHBondContact O-CG 3.25Å; V219-L223 PolarHBondContact O-N 3.09Å |
| 220 | C | 92 | Very high | 89.7 | Confident | 50 Ų | 50 | 54.2 Ų | 54.2 | 34% | 0.338 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.5 | -39.7 | 175.4 | -70 | 0 | 0 | 0 | 0 | 112.9 | F216 G217 M218 L223 L224 | F216-C220 WeakPolarHBondContact CE1-SG 3.24Å; F216-C220 WeakPolarHBondContact CZ-SG 3.44Å; F216-C220 PolarHBondContact O-N 2.77Å; F216-C220 PolarHBondContact O-SG 3.49Å; F216-C220 VanDerWaalsContact O-SG 3.33Å; G217-C220 PolarHBondContact O-N 3.45Å; M218-C220 VanDerWaalsContact C-N 3.31Å; M218-C220 PolarHBondContact O-N 2.68Å; C220-L223 PolarHBondContact O-N 3.18Å; C220-L224 VanDerWaalsContact O-CB 3.3Å; C220-L224 WeakPolarHBondContact O-CB 3.34Å; C220-L224 PolarHBondContact O-N 3.5Å |
| 221 | L | 93.4 | Very high | 90.4 | Very high | 48 Ų | 48 | 46.1 Ų | 46.1 | 25% | 0.251 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -65.7 | -37.8 | 177 | -68.7 | 170.2 | 0 | 0 | 0 | 112 | G217 M218 V219 L224 M225 L281 T285 L288 | G217-L221 VanDerWaalsContact O-CG 3.27Å; G217-L221 WeakPolarHBondContact O-CG 3.27Å; G217-L221 PolarHBondContact O-N 3.28Å; M218-L221 PolarHBondContact O-N 3.47Å; M218-L221 HydrophobicContact SD-CD1 4.28Å; V219-L221 VanDerWaalsContact C-N 3.34Å; V219-L221 PolarHBondContact O-N 2.95Å; L221-L224 PolarHBondContact O-N 3.44Å; L221-M225 WeakPolarHBondContact O-CB 3.44Å; L221-M225 PolarHBondContact O-N 3.32Å; L221-L281 HydrophobicContact CB-CD1 4.07Å; L221-L281 HydrophobicContact CD2-CD1 3.5Å; L221-L281 HydrophobicContact CG-CD1 4.33Å; L221-T285 HydrophobicContact CB-CG2 3.51Å; L221-T285 HydrophobicContact CD1-CG2 4.31Å; L221-L288 HydrophobicContact CD1-CD1 3.6Å |
| 222 | F | 92.4 | Very high | 91.2 | Very high | 6 Ų | 6 | 42.2 Ų | 42.2 | 3% | 0.026 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -64.9 | -45.3 | 173.6 | -84.7 | -72.9 | 0 | 0 | 0 | 112.4 | H136 C185 T186 A189 M218 V219 L224 M225 L226 | H136-F222 AromaticContact CE1-CE1 3.25Å; H136-F222 WeakPolarHBondContact CE1-CE1 3.31Å; H136-F222 AromaticContact CE1-CZ 3.23Å; H136-F222 WeakPolarHBondContact CE1-CZ 3.23Å; H136-F222 AromaticContact ND1-CE1 3.34Å; H136-F222 VanDerWaalsContact ND1-CE1 3.34Å; H136-F222 WeakPolarHBondContact ND1-CE1 3.41Å; H136-F222 AromaticContact ND1-CZ 3.29Å; H136-F222 VanDerWaalsContact ND1-CZ 3.29Å; H136-F222 WeakPolarHBondContact ND1-CZ 3.49Å; C185-F222 HydrophobicContact CB-CD1 4.37Å; C185-F222 HydrophobicContact CB-CE1 3.72Å; T186-F222 HydrophobicContact CG2-CB 4.01Å; A189-F222 HydrophobicContact CB-CD2 3.48Å; A189-F222 VanDerWaalsContact CB-CD2 3.48Å; A189-F222 HydrophobicContact CB-CE2 3.38Å; A189-F222 HydrophobicContact CB-CG 4.21Å; A189-F222 HydrophobicContact CB-CZ 4.03Å; M218-F222 HydrophobicContact CE-CE2 4.03Å; M218-F222 VanDerWaalsContact O-CD2 3.23Å; M218-F222 WeakPolarHBondContact O-CD2 3.45Å; M218-F222 PolarHBondContact O-N 3.37Å; M218-F222 VanDerWaalsContact O-N 3.09Å; V219-F222 PolarHBondContact O-N 2.87Å; F222-L224 VanDerWaalsContact C-N 3.32Å; F222-L224 PolarHBondContact O-N 2.82Å; F222-M225 HydrophobicContact CD1-CE 4.03Å; F222-M225 WeakPolarHBondContact O-CB 3.24Å; F222-M225 PolarHBondContact O-N 3.04Å; F222-L226 PolarHBondContact O-N 3.44Å |
| 223 | L | 93.8 | Very high | 92 | Very high | 90 Ų | 90 | 43.1 Ų | 43.1 | 47% | 0.471 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -63 | -39.9 | 176 | -67.7 | 176.1 | 0 | 0 | 0 | 111.7 | T186 V219 C220 M225 L226 A227 | T186-L223 HydrophobicContact CG2-CD2 4.11Å; V219-L223 HydrophobicContact CG1-CD1 4.21Å; V219-L223 HydrophobicContact CG1-CG 4.48Å; V219-L223 WeakPolarHBondContact O-CG 3.25Å; V219-L223 PolarHBondContact O-N 3.09Å; C220-L223 PolarHBondContact O-N 3.18Å; L223-M225 VanDerWaalsContact C-N 3.32Å; L223-M225 PolarHBondContact O-N 2.81Å; L223-L226 PolarHBondContact O-N 3.42Å; L223-A227 WeakPolarHBondContact O-CB 3.39Å; L223-A227 PolarHBondContact O-N 3.5Å |
| 224 | L | 95.7 | Very high | 92.3 | Very high | 92 Ų | 92 | 39.2 Ų | 39.2 | 48% | 0.482 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.9 | -39.4 | 174.4 | -178.3 | 63.7 | 0 | 0 | 0 | 111.4 | C220 L221 F222 A227 V228 L281 | C220-L224 VanDerWaalsContact O-CB 3.3Å; C220-L224 WeakPolarHBondContact O-CB 3.34Å; C220-L224 PolarHBondContact O-N 3.5Å; L221-L224 PolarHBondContact O-N 3.44Å; F222-L224 VanDerWaalsContact C-N 3.32Å; F222-L224 PolarHBondContact O-N 2.82Å; L224-A227 PolarHBondContact O-N 2.63Å; L224-V228 HydrophobicContact CD1-CG2 4.49Å; L224-V228 WeakPolarHBondContact O-CG2 3.44Å; L224-V228 PolarHBondContact O-N 2.8Å; L224-L281 HydrophobicContact CB-CD2 4.01Å; L224-L281 HydrophobicContact CD2-CD1 4.43Å; L224-L281 HydrophobicContact CD2-CD2 3.96Å; L224-L281 HydrophobicContact CG-CD2 3.75Å |
| 225 | M | 95.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.2 | -41.2 | 176.9 | 176.5 | -81.7 | -66 | 0 | 0 | 111.9 | L221 F222 L223 V228 S229 L281 L282 | L221-M225 WeakPolarHBondContact O-CB 3.44Å; L221-M225 PolarHBondContact O-N 3.32Å; F222-M225 HydrophobicContact CD1-CE 4.03Å; F222-M225 WeakPolarHBondContact O-CB 3.24Å; F222-M225 PolarHBondContact O-N 3.04Å; L223-M225 VanDerWaalsContact C-N 3.32Å; L223-M225 PolarHBondContact O-N 2.81Å; M225-V228 PolarHBondContact O-N 3.16Å; M225-S229 WeakPolarHBondContact O-CB 3.47Å; M225-S229 PolarHBondContact O-N 3.44Å; M225-S229 PolarHBondContact O-OG 3.25Å; M225-L281 VanDerWaalsContact CA-CD2 3.47Å; M225-L281 HydrophobicContact CB-CD2 3.63Å; M225-L281 HydrophobicContact CB-CG 3.99Å; M225-L282 HydrophobicContact CE-CD2 4.2Å; M225-L282 HydrophobicContact CG-CD2 3.83Å; M225-L282 HydrophobicContact CG-CG 4Å; M225-L282 HydrophobicContact SD-CD2 4.12Å |
| 226 | L | 95.6 | Very high | 93.1 | Very high | 26 Ų | 26 | 37.8 Ų | 37.8 | 14% | 0.136 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -64.3 | -42.9 | 172.4 | -71.4 | 178.4 | 0 | 0 | 0 | 111.7 | F179 A183 T186 F222 L223 V228 S229 L230 | F179-L226 HydrophobicContact CD2-CD2 3.96Å; F179-L226 HydrophobicContact CE2-CD2 4.06Å; A183-L226 HydrophobicContact CB-CD2 4.46Å; T186-L226 HydrophobicContact CG2-CD1 4.03Å; T186-L226 WeakPolarHBondContact OG1-CD1 3.33Å; F222-L226 PolarHBondContact O-N 3.44Å; L223-L226 PolarHBondContact O-N 3.42Å; L226-V228 PolarHBondContact O-N 2.93Å; L226-S229 WeakPolarHBondContact O-CB 3.4Å; L226-S229 PolarHBondContact O-N 3.31Å; L226-L230 WeakPolarHBondContact O-CD1 3.29Å; L226-L230 PolarHBondContact O-N 2.94Å |
| 227 | A | 96 | Very high | 93.4 | Very high | 53 Ų | 53 | 37.1 Ų | 37.1 | 44% | 0.438 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.1 | -42.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L223 L224 S229 L230 A231 | L223-A227 WeakPolarHBondContact O-CB 3.39Å; L223-A227 PolarHBondContact O-N 3.5Å; L224-A227 PolarHBondContact O-N 2.63Å; A227-S229 VanDerWaalsContact C-N 3.33Å; A227-L230 PolarHBondContact O-N 3.26Å; A227-A231 PolarHBondContact O-N 3Å |
| 228 | V | 95.2 | Very high | 93.4 | Very high | 15 Ų | 15 | 39.9 Ų | 39.9 | 9% | 0.091 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -64.3 | -39.4 | 174 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | L224 M225 L226 A231 T232 Y274 R278 | L224-V228 HydrophobicContact CD1-CG2 4.49Å; L224-V228 WeakPolarHBondContact O-CG2 3.44Å; L224-V228 PolarHBondContact O-N 2.8Å; M225-V228 PolarHBondContact O-N 3.16Å; L226-V228 PolarHBondContact O-N 2.93Å; V228-A231 WeakPolarHBondContact O-CB 3.39Å; V228-A231 PolarHBondContact O-N 3.33Å; V228-T232 PolarHBondContact O-N 3.48Å; V228-T232 VanDerWaalsContact O-N 3.13Å; V228-Y274 HydrophobicContact CG1-CD1 4.16Å; V228-R278 HydrophobicContact CG1-CB 3.96Å |
| 229 | S | 94.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -62.7 | -44 | 175.5 | -57.6 | 0 | 0 | 0 | 0 | 111.1 | H175 M225 L226 A227 A231 T232 L233 R278 | H175-S229 PolarHBondContact CE1-O 3.09Å; M225-S229 WeakPolarHBondContact O-CB 3.47Å; M225-S229 PolarHBondContact O-N 3.44Å; M225-S229 PolarHBondContact O-OG 3.25Å; L226-S229 WeakPolarHBondContact O-CB 3.4Å; L226-S229 PolarHBondContact O-N 3.31Å; A227-S229 VanDerWaalsContact C-N 3.33Å; S229-A231 VanDerWaalsContact C-N 3.33Å; S229-A231 PolarHBondContact O-N 3.42Å; S229-T232 PolarHBondContact O-N 2.94Å; S229-T232 PolarHBondContact O-OG1 2.93Å; S229-L233 PolarHBondContact O-N 3.49Å; S229-R278 WeakPolarHBondContact OG-CD 3.09Å |
| 230 | L | 95.9 | Very high | 93.4 | Very high | 92 Ų | 92 | 40.2 Ų | 40.2 | 48% | 0.482 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.8 | -40 | 172.5 | -99.4 | 66.5 | 0 | 0 | 0 | 112.6 | F179 L226 A227 T232 L233 | F179-L230 HydrophobicContact CD2-CD1 3.4Å; F179-L230 VanDerWaalsContact CD2-CD1 3.4Å; F179-L230 HydrophobicContact CE2-CD1 3.11Å; F179-L230 HydrophobicContact CG-CD1 4.46Å; F179-L230 HydrophobicContact CZ-CD1 3.96Å; L226-L230 WeakPolarHBondContact O-CD1 3.29Å; L226-L230 PolarHBondContact O-N 2.94Å; A227-L230 PolarHBondContact O-N 3.26Å; L230-T232 PolarHBondContact O-N 3.21Å; L230-L233 WeakPolarHBondContact O-CB 3.12Å; L230-L233 PolarHBondContact O-N 3.42Å |
| 231 | A | 94.4 | Very high | 93.2 | Very high | 40 Ų | 40 | 40.8 Ų | 40.8 | 33% | 0.331 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.7 | -29.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | A227 V228 S229 L233 Y274 | A227-A231 PolarHBondContact O-N 3Å; V228-A231 WeakPolarHBondContact O-CB 3.39Å; V228-A231 PolarHBondContact O-N 3.33Å; S229-A231 VanDerWaalsContact C-N 3.33Å; S229-A231 PolarHBondContact O-N 3.42Å; A231-L233 VanDerWaalsContact C-N 3.34Å; A231-Y274 HydrophobicContact CB-CE1 4.24Å |
| 232 | T | 93.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -77.2 | -16 | 174.7 | 51.5 | 0 | 0 | 0 | 0 | 114.3 | V228 S229 L230 S234 I235 D236 Y274 R278 | V228-T232 PolarHBondContact O-N 3.48Å; V228-T232 VanDerWaalsContact O-N 3.13Å; S229-T232 PolarHBondContact O-N 2.94Å; S229-T232 PolarHBondContact O-OG1 2.93Å; L230-T232 PolarHBondContact O-N 3.21Å; T232-S234 PolarHBondContact O-N 2.86Å; T232-I235 PolarHBondContact O-N 3.41Å; T232-I235 VanDerWaalsContact O-N 3.16Å; T232-D236 PolarHBondContact O-N 2.96Å; T232-Y274 VanDerWaalsContact CG2-CB 3.44Å; T232-Y274 HydrophobicContact CG2-CG 4.1Å; T232-R278 PolarHBondContact OG1-NH1 3.4Å |
| 233 | L | 95.2 | Very high | 92.1 | Very high | 52 Ų | 52 | 46.2 Ų | 46.2 | 27% | 0.272 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -57 | -47.9 | -173.6 | 179.9 | 59.2 | 0 | 0 | 0 | 112.6 | M172 H175 S229 L230 A231 I235 D236 E237 | M172-L233 HydrophobicContact CE-CD1 4Å; H175-L233 WeakPolarHBondContact CE1-CA 3.47Å; H175-L233 VanDerWaalsContact CE1-CB 3.41Å; H175-L233 WeakPolarHBondContact CE1-CB 3.24Å; S229-L233 PolarHBondContact O-N 3.49Å; L230-L233 WeakPolarHBondContact O-CB 3.12Å; L230-L233 PolarHBondContact O-N 3.42Å; A231-L233 VanDerWaalsContact C-N 3.34Å; L233-I235 PolarHBondContact O-N 3.27Å; L233-D236 PolarHBondContact O-N 3.4Å; L233-E237 HydrophobicContact CD1-CG 3.98Å; L233-E237 HydrophobicContact CG-CG 4.33Å; L233-E237 WeakPolarHBondContact O-CB 3.05Å; L233-E237 WeakPolarHBondContact O-CG 3.41Å; L233-E237 PolarHBondContact O-N 3.17Å |
| 234 | S | 92.1 | Very high | 91.2 | Very high | 62 Ų | 62 | 49 Ų | 49 | 43% | 0.434 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -62.9 | -29.1 | -176.6 | 60.8 | 0 | 0 | 0 | 0 | 113.1 | T232 Q238 | T232-S234 PolarHBondContact O-N 2.86Å; S234-Q238 VanDerWaalsContact O-CG 3.29Å; S234-Q238 WeakPolarHBondContact O-CG 3.27Å; S234-Q238 PolarHBondContact O-N 3.25Å; S234-Q238 PolarHBondContact O-NE2 3.07Å; S234-Q238 VanDerWaalsContact O-NE2 3.07Å |
| 235 | I | 91.5 | Very high | 89.9 | Confident | 13 Ų | 13 | 48.3 Ų | 48.3 | 7% | 0.067 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -84.6 | -40.8 | 177.7 | -51.6 | 173.5 | 0 | 0 | 0 | 109.9 | T232 L233 E237 Q238 I239 W271 | T232-I235 PolarHBondContact O-N 3.41Å; T232-I235 VanDerWaalsContact O-N 3.16Å; L233-I235 PolarHBondContact O-N 3.27Å; I235-E237 VanDerWaalsContact C-N 3.3Å; I235-E237 PolarHBondContact O-N 2.9Å; I235-Q238 PolarHBondContact O-N 3.45Å; I235-I239 HydrophobicContact CG2-CD1 4.01Å; I235-I239 HydrophobicContact CG2-CG1 4.37Å; I235-I239 WeakPolarHBondContact O-CB 3.17Å; I235-I239 VanDerWaalsContact O-CG1 3.26Å; I235-I239 WeakPolarHBondContact O-CG1 3.12Å; I235-I239 PolarHBondContact O-N 3.5Å; I235-W271 HydrophobicContact CB-CB 4.38Å; I235-W271 HydrophobicContact CB-CG 4.39Å; I235-W271 HydrophobicContact CD1-CB 3.78Å; I235-W271 HydrophobicContact CG2-CB 3.8Å; I235-W271 HydrophobicContact CG2-CG 3.84Å |
| 236 | D | 93.3 | Very high | 88.5 | Confident | 1 Ų | 1 | 51.2 Ų | 51.2 | 1% | 0.005 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61 | -38.4 | 175.5 | -69.2 | -32.7 | 0 | 0 | 0 | 111.6 | M172 H175 T232 L233 I239 S240 W271 | M172-D236 HydrophobicContact SD-CB 4.46Å; H175-D236 HydrophobicContact CB-CB 4.48Å; H175-D236 IonicContact CE1-OD2 2.97Å; H175-D236 IonicContact CG-OD2 2.68Å; H175-D236 IonicContact ND1-OD2 2.66Å; H175-D236 PolarHBondContact ND1-OD2 2.92Å; T232-D236 PolarHBondContact O-N 2.96Å; L233-D236 PolarHBondContact O-N 3.4Å; D236-I239 PolarHBondContact O-N 3.22Å; D236-S240 WeakPolarHBondContact O-CB 3.28Å; D236-S240 PolarHBondContact O-N 2.92Å; D236-W271 PolarHBondContact OD1-NE1 3.49Å |
| 237 | E | 92.4 | Very high | 86.9 | Confident | 101 Ų | 101 | 54.2 Ų | 54.2 | 47% | 0.472 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64.1 | -44.5 | 173.7 | -76.7 | 177.8 | 169.3 | 0 | 0 | 112.2 | M172 L233 I235 I239 S240 S241 | M172-E237 HydrophobicContact CE-CG 4.05Å; M172-E237 HydrophobicContact SD-CG 3.86Å; L233-E237 HydrophobicContact CD1-CG 3.98Å; L233-E237 HydrophobicContact CG-CG 4.33Å; L233-E237 WeakPolarHBondContact O-CB 3.05Å; L233-E237 WeakPolarHBondContact O-CG 3.41Å; L233-E237 PolarHBondContact O-N 3.17Å; I235-E237 VanDerWaalsContact C-N 3.3Å; I235-E237 PolarHBondContact O-N 2.9Å; E237-I239 VanDerWaalsContact C-N 3.33Å; E237-I239 PolarHBondContact O-N 2.97Å; E237-S240 PolarHBondContact O-N 3.1Å; E237-S241 WeakPolarHBondContact O-CB 3.47Å; E237-S241 PolarHBondContact O-N 2.86Å |
| 238 | Q | 89.6 | Confident | 84.8 | Confident | 86 Ų | 86 | 54.6 Ų | 54.6 | 40% | 0.402 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 174.9 | -75.5 | 175 | 59 | 0 | 0 | 111 | S234 I235 S240 S241 L242 | S234-Q238 VanDerWaalsContact O-CG 3.29Å; S234-Q238 WeakPolarHBondContact O-CG 3.27Å; S234-Q238 PolarHBondContact O-N 3.25Å; S234-Q238 PolarHBondContact O-NE2 3.07Å; S234-Q238 VanDerWaalsContact O-NE2 3.07Å; I235-Q238 PolarHBondContact O-N 3.45Å; Q238-S240 VanDerWaalsContact C-N 3.33Å; Q238-S240 PolarHBondContact O-N 3Å; Q238-S241 PolarHBondContact O-N 3.06Å; Q238-S241 PolarHBondContact O-OG 3.32Å; Q238-L242 PolarHBondContact O-N 3.18Å |
| 239 | I | 89 | Confident | 82.6 | Confident | 1 Ų | 1 | 57.7 Ų | 57.7 | 1% | 0.005 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.4 | -44.2 | 175.7 | -73.4 | 173.6 | 0 | 0 | 0 | 110.7 | M164 Y167 S168 A171 I235 D236 E237 L242 W271 | M164-I239 HydrophobicContact CE-CB 3.83Å; M164-I239 HydrophobicContact CE-CD1 4.32Å; M164-I239 HydrophobicContact CE-CG1 3.6Å; M164-I239 HydrophobicContact CE-CG2 3.41Å; M164-I239 VanDerWaalsContact CE-CG2 3.41Å; Y167-I239 HydrophobicContact CD1-CG2 3.8Å; Y167-I239 HydrophobicContact CE1-CG2 3.99Å; S168-I239 WeakPolarHBondContact CB-O 3.12Å; S168-I239 PolarHBondContact OG-O 3.49Å; A171-I239 HydrophobicContact CB-CB 4.42Å; A171-I239 HydrophobicContact CB-CG2 3.67Å; I235-I239 HydrophobicContact CG2-CD1 4.01Å; I235-I239 HydrophobicContact CG2-CG1 4.37Å; I235-I239 WeakPolarHBondContact O-CB 3.17Å; I235-I239 VanDerWaalsContact O-CG1 3.26Å; I235-I239 WeakPolarHBondContact O-CG1 3.12Å; I235-I239 PolarHBondContact O-N 3.5Å; D236-I239 PolarHBondContact O-N 3.22Å; E237-I239 VanDerWaalsContact C-N 3.33Å; E237-I239 PolarHBondContact O-N 2.97Å; I239-L242 WeakPolarHBondContact O-CB 2.96Å; I239-L242 PolarHBondContact O-N 3.3Å; I239-W271 HydrophobicContact CD1-CD2 3.92Å; I239-W271 HydrophobicContact CD1-CE3 4.23Å; I239-W271 HydrophobicContact CD1-CG 4.49Å; I239-W271 HydrophobicContact CD1-CH2 3.97Å; I239-W271 HydrophobicContact CD1-CZ2 3.65Å; I239-W271 HydrophobicContact CD1-CZ3 4.25Å |
| 240 | S | 90.5 | Very high | 80.4 | Confident | 16 Ų | 16 | 67 Ų | 67 | 11% | 0.112 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -66.6 | -37.2 | 177.9 | -174.5 | 0 | 0 | 0 | 0 | 112.6 | S168 D236 E237 Q238 L242 W243 | S168-S240 PolarHBondContact OG-O 3.24Å; D236-S240 WeakPolarHBondContact O-CB 3.28Å; D236-S240 PolarHBondContact O-N 2.92Å; E237-S240 PolarHBondContact O-N 3.1Å; Q238-S240 VanDerWaalsContact C-N 3.33Å; Q238-S240 PolarHBondContact O-N 3Å; S240-L242 PolarHBondContact O-N 3.33Å; S240-L242 VanDerWaalsContact O-N 3.15Å; S240-W243 WeakPolarHBondContact O-CB 3.49Å; S240-W243 PolarHBondContact O-N 3.27Å; S240-W243 VanDerWaalsContact O-N 3.13Å |
| 241 | S | 86.8 | Confident | 78.1 | Confident | 63 Ų | 63 | 68.4 Ų | 68.4 | 44% | 0.441 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.9 | -25.4 | 177.5 | 80.2 | 0 | 0 | 0 | 0 | 113.5 | E237 Q238 W243 Y244 N245 | E237-S241 WeakPolarHBondContact O-CB 3.47Å; E237-S241 PolarHBondContact O-N 2.86Å; Q238-S241 PolarHBondContact O-N 3.06Å; Q238-S241 PolarHBondContact O-OG 3.32Å; S241-W243 VanDerWaalsContact C-N 3.27Å; S241-W243 PolarHBondContact O-N 2.86Å; S241-Y244 PolarHBondContact O-N 3.42Å; S241-N245 PolarHBondContact O-N 3.27Å |
| 242 | L | 82.7 | Confident | 75.4 | Confident | 53 Ų | 53 | 72.4 Ų | 72.4 | 28% | 0.277 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64 | -30.5 | 177.4 | -66.6 | 169.2 | 0 | 0 | 0 | 112.8 | M164 Q238 I239 S240 N245 S246 F264 | M164-L242 HydrophobicContact CE-CD1 3.43Å; M164-L242 VanDerWaalsContact CE-CD1 3.43Å; M164-L242 HydrophobicContact CG-CD1 4.01Å; M164-L242 HydrophobicContact SD-CD1 4.41Å; Q238-L242 PolarHBondContact O-N 3.18Å; I239-L242 WeakPolarHBondContact O-CB 2.96Å; I239-L242 PolarHBondContact O-N 3.3Å; S240-L242 PolarHBondContact O-N 3.33Å; S240-L242 VanDerWaalsContact O-N 3.15Å; L242-N245 PolarHBondContact O-N 3.35Å; L242-S246 VanDerWaalsContact O-CB 3.28Å; L242-S246 WeakPolarHBondContact O-CB 3.38Å; L242-S246 PolarHBondContact O-N 2.69Å; L242-S246 PolarHBondContact O-OG 3.41Å; L242-F264 HydrophobicContact CD1-CE2 4.18Å; L242-F264 HydrophobicContact CD1-CZ 3.95Å |
| 243 | W | 80 | Confident | 72.7 | Confident | 114 Ų | 114 | 81.9 Ų | 81.9 | 43% | 0.432 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -66.8 | -46 | 176 | 179.2 | 83 | 0 | 0 | 0 | 111.5 | S168 S240 S241 N245 S246 T247 | S168-W243 WeakPolarHBondContact OG-CB 3.37Å; S168-W243 PolarHBondContact OG-N 3.46Å; S168-W243 VanDerWaalsContact OG-N 3.08Å; S240-W243 WeakPolarHBondContact O-CB 3.49Å; S240-W243 PolarHBondContact O-N 3.27Å; S240-W243 VanDerWaalsContact O-N 3.13Å; S241-W243 VanDerWaalsContact C-N 3.27Å; S241-W243 PolarHBondContact O-N 2.86Å; W243-N245 VanDerWaalsContact C-N 3.35Å; W243-N245 PolarHBondContact O-N 3.24Å; W243-S246 PolarHBondContact O-N 3.42Å; W243-T247 PolarHBondContact O-N 3.18Å; W243-T247 PolarHBondContact O-OG1 2.84Å |
| 244 | Y | 75.4 | Confident | 70.1 | Confident | 150 Ų | 150 | 88 Ų | 88 | 59% | 0.588 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -62.6 | -43 | 174.7 | -64.5 | -78.2 | 0 | 0 | 0 | 111.6 | S241 T247 S248 | S241-Y244 PolarHBondContact O-N 3.42Å; Y244-T247 PolarHBondContact O-N 2.75Å; Y244-S248 PolarHBondContact O-N 3.03Å; Y244-S248 VanDerWaalsContact O-N 3.13Å |
| 245 | N | 69.7 | Low | 67.6 | Low | 77 Ų | 77 | 89.7 Ų | 89.7 | 41% | 0.412 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67.6 | -42 | -179.8 | -163.5 | 1.1 | 0 | 0 | 0 | 111.6 | S241 L242 W243 T247 S248 I249 | S241-N245 PolarHBondContact O-N 3.27Å; L242-N245 PolarHBondContact O-N 3.35Å; W243-N245 VanDerWaalsContact C-N 3.35Å; W243-N245 PolarHBondContact O-N 3.24Å; N245-T247 PolarHBondContact O-N 3.41Å; N245-S248 WeakPolarHBondContact CA-OG 3.28Å; N245-S248 CarbonylContact O-C 3.46Å; N245-S248 WeakPolarHBondContact O-CA 3.15Å; N245-S248 PolarHBondContact O-N 3.48Å; N245-S248 PolarHBondContact O-OG 3.07Å; N245-S248 PolarHBondContact OD1-OG 2.73Å; N245-I249 HydrophobicContact CB-CD1 4.46Å; N245-I249 VanDerWaalsContact O-CG1 3.28Å; N245-I249 WeakPolarHBondContact O-CG1 3.06Å; N245-I249 PolarHBondContact O-N 2.82Å; N245-I249 WeakPolarHBondContact OD1-CD1 3.48Å; N245-I249 VanDerWaalsContact OD1-CG1 3.31Å; N245-I249 WeakPolarHBondContact OD1-CG1 3.46Å |
| 246 | S | 65 | Low | 65.4 | Low | 61 Ų | 61 | 91.9 Ų | 91.9 | 43% | 0.427 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -58.7 | -37.7 | 176.6 | -60.3 | 0 | 0 | 0 | 0 | 111.9 | L242 W243 S248 F250 | L242-S246 VanDerWaalsContact O-CB 3.28Å; L242-S246 WeakPolarHBondContact O-CB 3.38Å; L242-S246 PolarHBondContact O-N 2.69Å; L242-S246 PolarHBondContact O-OG 3.41Å; W243-S246 PolarHBondContact O-N 3.42Å; S246-S248 VanDerWaalsContact C-N 3.33Å; S246-F250 WeakPolarHBondContact O-CD2 3.11Å |
| 247 | T | 60.8 | Low | 63.3 | Low | 89 Ų | 89 | 99 Ų | 99 | 55% | 0.546 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.1 | -35.6 | 173.7 | -51.4 | 0 | 0 | 0 | 0 | 111.7 | W243 Y244 N245 | W243-T247 PolarHBondContact O-N 3.18Å; W243-T247 PolarHBondContact O-OG1 2.84Å; Y244-T247 PolarHBondContact O-N 2.75Å; N245-T247 PolarHBondContact O-N 3.41Å |
| 248 | S | 52.8 | Low | 61.2 | Low | 60 Ų | 60 | 102.9 Ų | 102.9 | 42% | 0.42 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -80.6 | -26.9 | 177.2 | 76.7 | 0 | 0 | 0 | 0 | 114.9 | Y244 N245 S246 F250 V251 N252 | Y244-S248 PolarHBondContact O-N 3.03Å; Y244-S248 VanDerWaalsContact O-N 3.13Å; N245-S248 WeakPolarHBondContact CA-OG 3.28Å; N245-S248 CarbonylContact O-C 3.46Å; N245-S248 WeakPolarHBondContact O-CA 3.15Å; N245-S248 PolarHBondContact O-N 3.48Å; N245-S248 PolarHBondContact O-OG 3.07Å; N245-S248 PolarHBondContact OD1-OG 2.73Å; S246-S248 VanDerWaalsContact C-N 3.33Å; S248-F250 VanDerWaalsContact C-N 3.28Å; S248-F250 PolarHBondContact O-N 3.41Å; S248-V251 WeakPolarHBondContact O-CA 3.4Å; S248-V251 WeakPolarHBondContact O-CB 3.1Å; S248-V251 PolarHBondContact O-N 3.04Å; S248-N252 PolarHBondContact O-N 2.77Å |
| 249 | I | 49.4 | Very low | 59.2 | Low | 81 Ų | 81 | 104.3 Ų | 104.3 | 42% | 0.415 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -71.4 | -25.2 | 179.1 | -71.4 | 162.7 | 0 | 0 | 0 | 111.1 | N245 V251 N252 | N245-I249 HydrophobicContact CB-CD1 4.46Å; N245-I249 VanDerWaalsContact O-CG1 3.28Å; N245-I249 WeakPolarHBondContact O-CG1 3.06Å; N245-I249 PolarHBondContact O-N 2.82Å; N245-I249 WeakPolarHBondContact OD1-CD1 3.48Å; N245-I249 VanDerWaalsContact OD1-CG1 3.31Å; N245-I249 WeakPolarHBondContact OD1-CG1 3.46Å; I249-V251 PolarHBondContact O-N 3.41Å; I249-V251 VanDerWaalsContact O-N 3.09Å; I249-N252 CarbonylContact O-C 3.57Å; I249-N252 PolarHBondContact O-N 2.92Å |
| 250 | F | 47.8 | Very low | 57.4 | Low | 195 Ų | 195 | 109.2 Ų | 109.2 | 86% | 0.855 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.9 | -15.4 | 164.8 | -88.7 | -79.2 | 0 | 0 | 0 | 113.1 | S246 S248 | S246-F250 WeakPolarHBondContact O-CD2 3.11Å; S248-F250 VanDerWaalsContact C-N 3.28Å; S248-F250 PolarHBondContact O-N 3.41Å |
| 251 | V | 48.6 | Very low | 55.9 | Low | 122 Ų | 122 | 114.1 Ų | 114.1 | 74% | 0.739 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.5 | -16.8 | 177.3 | -174.2 | 0 | 0 | 0 | 0 | 112.7 | S248 I249 | S248-V251 WeakPolarHBondContact O-CA 3.4Å; S248-V251 WeakPolarHBondContact O-CB 3.1Å; S248-V251 PolarHBondContact O-N 3.04Å; I249-V251 PolarHBondContact O-N 3.41Å; I249-V251 VanDerWaalsContact O-N 3.09Å |
| 252 | N | 36.7 | Very low | 54.5 | Low | 124 Ų | 124 | 115.9 Ų | 115.9 | 66% | 0.663 | 59% | 0.591 | S | S | * | * | trans | -146.1 | 116.7 | 179.7 | -117.6 | -14.1 | 0 | 0 | 0 | 112.8 | S248 I249 Y254 | S248-N252 PolarHBondContact O-N 2.77Å; I249-N252 CarbonylContact O-C 3.57Å; I249-N252 PolarHBondContact O-N 2.92Å; N252-Y254 PolarHBondContact O-N 3.28Å | ||
| 253 | E | 38.3 | Very low | 53.3 | Low | 199 Ų | 199 | 118.8 Ų | 118.8 | 93% | 0.93 | 61% | 0.606 | S | S | * | * | trans | -64.5 | 89.6 | 170.7 | -172 | 168.1 | -167.5 | 0 | 0 | 109.6 | ||||
| 254 | Y | 39.1 | Very low | 53.1 | Low | 179 Ų | 179 | 115.8 Ų | 115.8 | 70% | 0.702 | 60% | 0.596 | S | S | * | * | trans | -117.2 | 121.7 | 172 | -165.1 | -104.9 | 0 | 0 | 0 | 110.9 | N252 P256 | N252-Y254 PolarHBondContact O-N 3.28Å; Y254-P256 HydrophobicContact CD1-CB 4.28Å; Y254-P256 HydrophobicContact CD1-CG 3.68Å; Y254-P256 HydrophobicContact CE1-CB 3.78Å; Y254-P256 HydrophobicContact CE1-CG 3.64Å; Y254-P256 VanDerWaalsContact O-CD 3.29Å; Y254-P256 WeakPolarHBondContact O-CD 3.44Å | ||
| 255 | S | 39.4 | Very low | 53.4 | Low | 99 Ų | 99 | 111.7 Ų | 111.7 | 69% | 0.692 | 59% | 0.586 | S | S | * | * | trans | -106 | 100 | 178.4 | 159.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 256 | P | 45.5 | Very low | 54.1 | Low | 58 Ų | 58 | 113.7 Ų | 113.7 | 38% | 0.377 | 59% | 0.593 | S | S | . | * | trans | -118.3 | 54.6 | 159.9 | 40.1 | -28.3 | 0 | 0 | 0 | 109.9 | Y254 K258 | Y254-P256 HydrophobicContact CD1-CB 4.28Å; Y254-P256 HydrophobicContact CD1-CG 3.68Å; Y254-P256 HydrophobicContact CE1-CB 3.78Å; Y254-P256 HydrophobicContact CE1-CG 3.64Å; Y254-P256 VanDerWaalsContact O-CD 3.29Å; Y254-P256 WeakPolarHBondContact O-CD 3.44Å; P256-K258 PolarHBondContact O-N 3.25Å | ||
| 257 | Q | 50.5 | Low | 55.3 | Low | 150 Ų | 150 | 112.6 Ų | 112.6 | 70% | 0.701 | 58% | 0.582 | S | S | * | * | trans | -83.8 | -4.4 | -163.1 | -131.6 | 178.2 | 15.5 | 0 | 0 | 116.3 | Q261 | Q257-Q261 PolarHBondContact O-OE1 3.28Å; Q257-Q261 VanDerWaalsContact O-OE1 3.05Å | ||
| 258 | K | 46.6 | Very low | 56.5 | Low | 184 Ų | 184 | 108.8 Ų | 108.8 | 80% | 0.8 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -114.3 | -36.9 | -174.1 | -82.4 | -175.4 | 177.3 | 179.1 | 0 | 117.1 | P256 | P256-K258 PolarHBondContact O-N 3.25Š|
| 259 | V | 48 | Very low | 58.2 | Low | 116 Ų | 116 | 108 Ų | 108 | 70% | 0.703 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -87.1 | -45.1 | -176.4 | -168.9 | 0 | 0 | 0 | 0 | 110.8 | Q261 T262 | V259-Q261 PolarHBondContact O-N 2.89Å; V259-T262 PolarHBondContact O-N 2.96Å; V259-T262 PolarHBondContact O-OG1 3.34Å; V259-T262 VanDerWaalsContact O-OG1 3.06Å |
| 260 | N | 52.2 | Low | 60.3 | Low | 103 Ų | 103 | 106.3 Ų | 106.3 | 55% | 0.551 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.4 | -28.4 | 179.1 | -64.7 | -2.3 | 0 | 0 | 0 | 112.5 | F264 | N260-F264 WeakPolarHBondContact O-CB 3.23Å; N260-F264 PolarHBondContact O-N 3.26Å |
| 261 | Q | 59 | Low | 62.4 | Low | 119 Ų | 119 | 97.1 Ų | 97.1 | 56% | 0.556 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68.6 | -39.9 | -177.2 | -156.7 | 175.7 | 15.2 | 0 | 0 | 112.2 | Q257 V259 V265 | Q257-Q261 PolarHBondContact O-OE1 3.28Å; Q257-Q261 VanDerWaalsContact O-OE1 3.05Å; V259-Q261 PolarHBondContact O-N 2.89Å; Q261-V265 VanDerWaalsContact O-CG2 3.29Å; Q261-V265 WeakPolarHBondContact O-CG2 2.87Å; Q261-V265 PolarHBondContact O-N 2.92Å |
| 262 | T | 57.8 | Low | 64.5 | Low | 101 Ų | 101 | 92.2 Ų | 92.2 | 62% | 0.62 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -69.8 | -41.6 | 179.8 | 60.2 | 0 | 0 | 0 | 0 | 112.8 | V259 F264 V265 H266 | V259-T262 PolarHBondContact O-N 2.96Å; V259-T262 PolarHBondContact O-OG1 3.34Å; V259-T262 VanDerWaalsContact O-OG1 3.06Å; T262-F264 VanDerWaalsContact C-N 3.33Å; T262-V265 PolarHBondContact O-N 2.93Å; T262-H266 PolarHBondContact O-N 3.37Å |
| 263 | L | 57.4 | Low | 67.3 | Low | 114 Ų | 114 | 92 Ų | 92 | 60% | 0.597 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.7 | -41.2 | 176.5 | -167.9 | 141.6 | 0 | 0 | 0 | 110.6 | V265 H266 D267 | L263-V265 PolarHBondContact O-N 3.39Å; L263-H266 PolarHBondContact O-N 3.29Å; L263-D267 WeakPolarHBondContact CD2-OD2 3.03Å; L263-D267 PolarHBondContact O-N 2.92Å; L263-D267 VanDerWaalsContact O-N 3.16Å |
| 264 | F | 75.7 | Confident | 70 | Confident | 51 Ų | 51 | 86.8 Ų | 86.8 | 22% | 0.224 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -62.5 | -37.5 | 175 | -173.8 | -105.7 | 0 | 0 | 0 | 113.5 | I159 M164 L242 N260 T262 H266 D267 V268 | I159-F264 HydrophobicContact CD1-CD1 4.32Å; I159-F264 HydrophobicContact CD1-CE1 3.64Å; M164-F264 HydrophobicContact CE-CZ 4.18Å; M164-F264 HydrophobicContact SD-CZ 4.48Å; L242-F264 HydrophobicContact CD1-CE2 4.18Å; L242-F264 HydrophobicContact CD1-CZ 3.95Å; N260-F264 WeakPolarHBondContact O-CB 3.23Å; N260-F264 PolarHBondContact O-N 3.26Å; T262-F264 VanDerWaalsContact C-N 3.33Å; F264-H266 VanDerWaalsContact C-N 3.34Å; F264-H266 PolarHBondContact O-N 3.45Å; F264-D267 PolarHBondContact O-N 3.45Å; F264-V268 HydrophobicContact CD1-CG2 3.94Å; F264-V268 HydrophobicContact CD2-CG2 4.35Å; F264-V268 HydrophobicContact CE1-CG2 3.57Å; F264-V268 HydrophobicContact CE2-CG2 4.02Å; F264-V268 HydrophobicContact CG-CG2 4.32Å; F264-V268 HydrophobicContact CZ-CG2 3.61Å; F264-V268 WeakPolarHBondContact O-CB 3.44Å; F264-V268 VanDerWaalsContact O-CG2 3.25Å; F264-V268 WeakPolarHBondContact O-CG2 3.23Å; F264-V268 PolarHBondContact O-N 3.15Å |
| 265 | V | 81.5 | Confident | 72.6 | Confident | 63 Ų | 63 | 78.3 Ų | 78.3 | 38% | 0.382 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.7 | -43.1 | 176.8 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | Q261 T262 L263 V268 L269 | Q261-V265 VanDerWaalsContact O-CG2 3.29Å; Q261-V265 WeakPolarHBondContact O-CG2 2.87Å; Q261-V265 PolarHBondContact O-N 2.92Å; T262-V265 PolarHBondContact O-N 2.93Å; L263-V265 PolarHBondContact O-N 3.39Å; V265-V268 PolarHBondContact O-N 2.99Å; V265-L269 HydrophobicContact CG1-CD1 4.32Å; V265-L269 WeakPolarHBondContact O-CG 3.37Å; V265-L269 PolarHBondContact O-N 2.96Å |
| 266 | H | 85.1 | Confident | 75.3 | Confident | 120 Ų | 120 | 76.2 Ų | 76.2 | 56% | 0.556 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -62.4 | -45.4 | 176.7 | 178.7 | -85.6 | 0 | 0 | 0 | 111.5 | T262 L263 F264 V268 L269 V270 | T262-H266 PolarHBondContact O-N 3.37Å; L263-H266 PolarHBondContact O-N 3.29Å; F264-H266 VanDerWaalsContact C-N 3.34Å; F264-H266 PolarHBondContact O-N 3.45Å; H266-V268 VanDerWaalsContact C-N 3.35Å; H266-V268 PolarHBondContact O-N 2.69Å; H266-L269 WeakPolarHBondContact O-CB 3.36Å; H266-L269 PolarHBondContact O-N 3.26Å; H266-V270 WeakPolarHBondContact O-CG2 3.45Å; H266-V270 PolarHBondContact O-N 2.7Å |
| 267 | D | 88.2 | Confident | 77.7 | Confident | 38 Ų | 38 | 76.8 Ų | 76.8 | 20% | 0.203 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65.1 | -38.6 | -179.3 | -64.9 | -20.3 | 0 | 0 | 0 | 112.1 | L263 F264 V270 W271 | L263-D267 WeakPolarHBondContact CD2-OD2 3.03Å; L263-D267 PolarHBondContact O-N 2.92Å; L263-D267 VanDerWaalsContact O-N 3.16Å; F264-D267 PolarHBondContact O-N 3.45Å; D267-V270 PolarHBondContact O-N 3.4Å; D267-W271 VanDerWaalsContact O-CB 3.22Å; D267-W271 WeakPolarHBondContact O-CB 3.37Å; D267-W271 PolarHBondContact O-N 2.97Å |
| 268 | V | 87 | Confident | 79.9 | Confident | 8 Ų | 8 | 69.7 Ų | 69.7 | 5% | 0.048 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -65.6 | -38.2 | 174.9 | 170 | 0 | 0 | 0 | 0 | 111.8 | V154 I159 F264 V265 H266 W271 K272 | V154-V268 HydrophobicContact CG1-CG1 3.46Å; V154-V268 VanDerWaalsContact CG1-CG1 3.46Å; I159-V268 HydrophobicContact CD1-CG1 4.06Å; I159-V268 HydrophobicContact CD1-CG2 4.09Å; I159-V268 HydrophobicContact CG1-CG1 4.45Å; F264-V268 HydrophobicContact CD1-CG2 3.94Å; F264-V268 HydrophobicContact CD2-CG2 4.35Å; F264-V268 HydrophobicContact CE1-CG2 3.57Å; F264-V268 HydrophobicContact CE2-CG2 4.02Å; F264-V268 HydrophobicContact CG-CG2 4.32Å; F264-V268 HydrophobicContact CZ-CG2 3.61Å; F264-V268 WeakPolarHBondContact O-CB 3.44Å; F264-V268 VanDerWaalsContact O-CG2 3.25Å; F264-V268 WeakPolarHBondContact O-CG2 3.23Å; F264-V268 PolarHBondContact O-N 3.15Å; V265-V268 PolarHBondContact O-N 2.99Å; H266-V268 VanDerWaalsContact C-N 3.35Å; H266-V268 PolarHBondContact O-N 2.69Å; V268-W271 HydrophobicContact CG1-CE3 4.4Å; V268-K272 WeakPolarHBondContact O-CB 3.47Å; V268-K272 PolarHBondContact O-N 2.79Å |
| 269 | L | 89.5 | Confident | 82.3 | Confident | 43 Ų | 43 | 61.3 Ų | 61.3 | 23% | 0.225 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -64.4 | -48.5 | 174.2 | -73.9 | 174.8 | 0 | 0 | 0 | 111.3 | E156 V265 H266 W271 K272 Y273 | E156-L269 HydrophobicContact CB-CD2 4.32Å; E156-L269 HydrophobicContact CG-CD2 4.01Å; V265-L269 HydrophobicContact CG1-CD1 4.32Å; V265-L269 WeakPolarHBondContact O-CG 3.37Å; V265-L269 PolarHBondContact O-N 2.96Å; H266-L269 WeakPolarHBondContact O-CB 3.36Å; H266-L269 PolarHBondContact O-N 3.26Å; L269-W271 VanDerWaalsContact C-N 3.31Å; L269-W271 PolarHBondContact O-N 3.46Å; L269-K272 WeakPolarHBondContact O-CB 3.18Å; L269-K272 PolarHBondContact O-N 3.36Å; L269-Y273 WeakPolarHBondContact O-CD2 3.48Å; L269-Y273 PolarHBondContact O-N 2.87Å; L269-Y273 VanDerWaalsContact O-N 3.12Å |
| 270 | V | 91.8 | Very high | 84.6 | Confident | 46 Ų | 46 | 59.9 Ų | 59.9 | 28% | 0.279 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -58.5 | -45.3 | 177.1 | 169.2 | 0 | 0 | 0 | 0 | 110.8 | H266 D267 K272 Y273 Y274 | H266-V270 WeakPolarHBondContact O-CG2 3.45Å; H266-V270 PolarHBondContact O-N 2.7Å; D267-V270 PolarHBondContact O-N 3.4Å; V270-K272 PolarHBondContact O-N 3.33Å; V270-Y273 PolarHBondContact O-N 2.75Å; V270-Y274 HydrophobicContact CG1-CD2 3.62Å; V270-Y274 HydrophobicContact CG1-CE2 3.3Å; V270-Y274 VanDerWaalsContact O-CD2 3.29Å; V270-Y274 WeakPolarHBondContact O-CD2 3.41Å; V270-Y274 PolarHBondContact O-N 2.75Å |
| 271 | W | 93.3 | Very high | 86.6 | Confident | 3 Ų | 3 | 55.8 Ų | 55.8 | 1% | 0.011 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -57.8 | -45 | 175 | 174.6 | 73.7 | 0 | 0 | 0 | 113.2 | I150 V154 F163 Y167 I235 D236 I239 D267 V268 L269 Y273 Y274 I275 | I150-W271 HydrophobicContact CD1-CH2 3.51Å; I150-W271 HydrophobicContact CD1-CZ2 4.27Å; I150-W271 HydrophobicContact CD1-CZ3 4.19Å; I150-W271 HydrophobicContact CG1-CH2 4.18Å; I150-W271 HydrophobicContact CG2-CE3 4.4Å; I150-W271 HydrophobicContact CG2-CH2 4.12Å; I150-W271 HydrophobicContact CG2-CZ3 3.76Å; V154-W271 HydrophobicContact CG2-CZ3 4.37Å; F163-W271 HydrophobicContact CZ-CH2 4.43Å; Y167-W271 HydrophobicContact CD1-CH2 4.2Å; Y167-W271 HydrophobicContact CD1-CZ2 4.43Å; Y167-W271 AromaticContact CE1-CH2 3.62Å; Y167-W271 HydrophobicContact CE1-CH2 3.62Å; Y167-W271 AromaticContact CE1-CZ2 3.47Å; Y167-W271 HydrophobicContact CE1-CZ2 3.47Å; Y167-W271 VanDerWaalsContact CE1-CZ2 3.47Å; Y167-W271 AromaticContact CZ-CH2 3.96Å; Y167-W271 AromaticContact CZ-CZ2 3.72Å; I235-W271 HydrophobicContact CB-CB 4.38Å; I235-W271 HydrophobicContact CB-CG 4.39Å; I235-W271 HydrophobicContact CD1-CB 3.78Å; I235-W271 HydrophobicContact CG2-CB 3.8Å; I235-W271 HydrophobicContact CG2-CG 3.84Å; D236-W271 PolarHBondContact OD1-NE1 3.49Å; I239-W271 HydrophobicContact CD1-CD2 3.92Å; I239-W271 HydrophobicContact CD1-CE3 4.23Å; I239-W271 HydrophobicContact CD1-CG 4.49Å; I239-W271 HydrophobicContact CD1-CH2 3.97Å; I239-W271 HydrophobicContact CD1-CZ2 3.65Å; I239-W271 HydrophobicContact CD1-CZ3 4.25Å; D267-W271 VanDerWaalsContact O-CB 3.22Å; D267-W271 WeakPolarHBondContact O-CB 3.37Å; D267-W271 PolarHBondContact O-N 2.97Å; V268-W271 HydrophobicContact CG1-CE3 4.4Å; L269-W271 VanDerWaalsContact C-N 3.31Å; L269-W271 PolarHBondContact O-N 3.46Å; W271-Y273 VanDerWaalsContact C-N 3.3Å; W271-Y273 PolarHBondContact O-N 3.5Å; W271-Y274 PolarHBondContact O-N 2.9Å; W271-Y274 VanDerWaalsContact O-N 3.15Å; W271-I275 HydrophobicContact CD2-CD1 3.59Å; W271-I275 HydrophobicContact CE3-CD1 4.04Å; W271-I275 HydrophobicContact CG-CD1 4.15Å; W271-I275 HydrophobicContact CH2-CD1 3.96Å; W271-I275 HydrophobicContact CZ2-CD1 3.46Å; W271-I275 VanDerWaalsContact CZ2-CD1 3.46Å; W271-I275 HydrophobicContact CZ3-CD1 4.22Å; W271-I275 WeakPolarHBondContact O-CG1 3.36Å; W271-I275 PolarHBondContact O-N 2.94Å |
| 272 | K | 92.5 | Very high | 88.4 | Confident | 19 Ų | 19 | 50.1 Ų | 50.1 | 8% | 0.083 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.4 | -41.1 | 176 | 179.9 | 177.3 | 171.4 | 175.9 | 0 | 111.9 | I150 F151 V154 V268 L269 V270 I275 L276 | I150-K272 HydrophobicContact CG2-CG 4.43Å; F151-K272 HydrophobicContact CD1-CD 4.49Å; F151-K272 HydrophobicContact CD2-CD 4.47Å; F151-K272 HydrophobicContact CD2-CG 3.93Å; F151-K272 HydrophobicContact CE1-CD 4.3Å; F151-K272 HydrophobicContact CE1-CG 4.19Å; F151-K272 HydrophobicContact CE2-CD 4.29Å; F151-K272 HydrophobicContact CE2-CG 3.45Å; F151-K272 VanDerWaalsContact CE2-CG 3.45Å; F151-K272 HydrophobicContact CZ-CD 4.19Å; F151-K272 HydrophobicContact CZ-CG 3.58Å; V154-K272 HydrophobicContact CG1-CD 4.34Å; V154-K272 PolarHBondContact O-NZ 2.56Å; V268-K272 WeakPolarHBondContact O-CB 3.47Å; V268-K272 PolarHBondContact O-N 2.79Å; L269-K272 WeakPolarHBondContact O-CB 3.18Å; L269-K272 PolarHBondContact O-N 3.36Å; V270-K272 PolarHBondContact O-N 3.33Å; K272-I275 PolarHBondContact O-N 2.96Å; K272-L276 PolarHBondContact O-N 3.47Å; K272-L276 VanDerWaalsContact O-N 3.08Å |
| 273 | Y | 94 | Very high | 90.1 | Very high | 120 Ų | 120 | 47 Ų | 47 | 47% | 0.471 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -71.6 | -34.3 | 175.7 | -71.5 | -66.2 | 0 | 0 | 0 | 113.3 | L269 V270 W271 L276 T277 | L269-Y273 WeakPolarHBondContact O-CD2 3.48Å; L269-Y273 PolarHBondContact O-N 2.87Å; L269-Y273 VanDerWaalsContact O-N 3.12Å; V270-Y273 PolarHBondContact O-N 2.75Å; W271-Y273 VanDerWaalsContact C-N 3.3Å; W271-Y273 PolarHBondContact O-N 3.5Å; Y273-L276 PolarHBondContact O-N 3.26Å; Y273-T277 WeakPolarHBondContact O-CB 3.41Å; Y273-T277 PolarHBondContact O-N 2.84Å; Y273-T277 PolarHBondContact O-OG1 3.2Å |
| 274 | Y | 95.3 | Very high | 91.8 | Very high | 89 Ų | 89 | 47.1 Ų | 47.1 | 35% | 0.349 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.7 | -41.5 | 171.5 | -80.8 | -59.7 | 0 | 0 | 0 | 112.1 | V228 A231 T232 V270 W271 T277 R278 | V228-Y274 HydrophobicContact CG1-CD1 4.16Å; A231-Y274 HydrophobicContact CB-CE1 4.24Å; T232-Y274 VanDerWaalsContact CG2-CB 3.44Å; T232-Y274 HydrophobicContact CG2-CG 4.1Å; V270-Y274 HydrophobicContact CG1-CD2 3.62Å; V270-Y274 HydrophobicContact CG1-CE2 3.3Å; V270-Y274 VanDerWaalsContact O-CD2 3.29Å; V270-Y274 WeakPolarHBondContact O-CD2 3.41Å; V270-Y274 PolarHBondContact O-N 2.75Å; W271-Y274 PolarHBondContact O-N 2.9Å; W271-Y274 VanDerWaalsContact O-N 3.15Å; Y274-T277 PolarHBondContact O-N 2.84Å; Y274-R278 WeakPolarHBondContact O-CB 2.96Å; Y274-R278 PolarHBondContact O-N 2.75Å |
| 275 | I | 95.1 | Very high | 92.6 | Very high | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.2 | -45.5 | 175 | -71.1 | 162 | 0 | 0 | 0 | 111 | C147 I150 W271 K272 T277 R278 S279 | C147-I275 HydrophobicContact CB-CG2 4.16Å; I150-I275 HydrophobicContact CG1-CD1 4.09Å; I150-I275 HydrophobicContact CG2-CD1 4.15Å; W271-I275 HydrophobicContact CD2-CD1 3.59Å; W271-I275 HydrophobicContact CE3-CD1 4.04Å; W271-I275 HydrophobicContact CG-CD1 4.15Å; W271-I275 HydrophobicContact CH2-CD1 3.96Å; W271-I275 HydrophobicContact CZ2-CD1 3.46Å; W271-I275 VanDerWaalsContact CZ2-CD1 3.46Å; W271-I275 HydrophobicContact CZ3-CD1 4.22Å; W271-I275 WeakPolarHBondContact O-CG1 3.36Å; W271-I275 PolarHBondContact O-N 2.94Å; K272-I275 PolarHBondContact O-N 2.96Å; I275-T277 VanDerWaalsContact C-N 3.34Å; I275-T277 PolarHBondContact O-N 3.39Å; I275-R278 PolarHBondContact O-N 3.16Å; I275-S279 WeakPolarHBondContact O-CB 3.41Å; I275-S279 PolarHBondContact O-N 2.83Å |
| 276 | L | 96 | Very high | 93.1 | Very high | 56 Ų | 56 | 46.1 Ų | 46.1 | 29% | 0.293 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -58.9 | -47.5 | 175.4 | 177.9 | 63.2 | 0 | 0 | 0 | 111.1 | F151 K272 Y273 R278 S279 L280 | F151-L276 HydrophobicContact CE2-CB 4.02Å; F151-L276 HydrophobicContact CZ-CB 3.93Å; F151-L276 HydrophobicContact CZ-CD2 4.05Å; F151-L276 HydrophobicContact CZ-CG 4.39Å; K272-L276 PolarHBondContact O-N 3.47Å; K272-L276 VanDerWaalsContact O-N 3.08Å; Y273-L276 PolarHBondContact O-N 3.26Å; L276-R278 PolarHBondContact O-N 2.8Å; L276-S279 WeakPolarHBondContact O-CB 3.05Å; L276-S279 PolarHBondContact O-N 3.42Å; L276-L280 HydrophobicContact CD1-CD1 4.39Å; L276-L280 HydrophobicContact CD1-CG 4.33Å; L276-L280 HydrophobicContact CG-CD1 4.26Å; L276-L280 WeakPolarHBondContact O-CG 3.42Å; L276-L280 PolarHBondContact O-N 3.32Å |
| 277 | T | 96.2 | Very high | 93.3 | Very high | 70 Ų | 70 | 43.9 Ų | 43.9 | 43% | 0.429 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -60.7 | -44.7 | 179.2 | -57.3 | 0 | 0 | 0 | 0 | 111.3 | Y273 Y274 I275 S279 L280 L281 | Y273-T277 WeakPolarHBondContact O-CB 3.41Å; Y273-T277 PolarHBondContact O-N 2.84Å; Y273-T277 PolarHBondContact O-OG1 3.2Å; Y274-T277 PolarHBondContact O-N 2.84Å; I275-T277 VanDerWaalsContact C-N 3.34Å; I275-T277 PolarHBondContact O-N 3.39Å; T277-S279 PolarHBondContact O-N 2.82Å; T277-L280 PolarHBondContact O-N 3.38Å; T277-L281 VanDerWaalsContact O-CB 3.3Å; T277-L281 WeakPolarHBondContact O-CB 3.23Å; T277-L281 PolarHBondContact O-N 3.3Å |
| 278 | R | 95.8 | Very high | 93.3 | Very high | 1 Ų | 1 | 44.9 Ų | 44.9 | 0% | 0.004 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.2 | -44.7 | 175.3 | -176.8 | 171.3 | 64.6 | -158.1 | -0.8 | 111.5 | Y178 V228 S229 T232 Y274 I275 L276 L281 L282 | Y178-R278 VanDerWaalsContact CD2-CZ 3.43Å; V228-R278 HydrophobicContact CG1-CB 3.96Å; S229-R278 WeakPolarHBondContact OG-CD 3.09Å; T232-R278 PolarHBondContact OG1-NH1 3.4Å; Y274-R278 WeakPolarHBondContact O-CB 2.96Å; Y274-R278 PolarHBondContact O-N 2.75Å; I275-R278 PolarHBondContact O-N 3.16Å; L276-R278 PolarHBondContact O-N 2.8Å; R278-L281 PolarHBondContact O-N 2.91Å; R278-L282 HydrophobicContact CG-CD1 4.05Å; R278-L282 WeakPolarHBondContact O-CB 3.48Å; R278-L282 WeakPolarHBondContact O-CG 3.05Å; R278-L282 PolarHBondContact O-N 2.84Å |
| 279 | S | 96.4 | Very high | 93.3 | Very high | 7 Ų | 7 | 44.8 Ų | 44.8 | 5% | 0.049 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.6 | -46.8 | 179.2 | -170.1 | 0 | 0 | 0 | 0 | 112.1 | S143 I275 L276 T277 L281 L282 C283 | S143-S279 PolarHBondContact O-OG 3.24Å; S143-S279 VanDerWaalsContact OG-CA 3.26Å; S143-S279 WeakPolarHBondContact OG-CA 3.47Å; S143-S279 WeakPolarHBondContact OG-CB 3.44Å; I275-S279 WeakPolarHBondContact O-CB 3.41Å; I275-S279 PolarHBondContact O-N 2.83Å; L276-S279 WeakPolarHBondContact O-CB 3.05Å; L276-S279 PolarHBondContact O-N 3.42Å; T277-S279 PolarHBondContact O-N 2.82Å; S279-L281 PolarHBondContact O-N 3.1Å; S279-L282 PolarHBondContact O-N 2.86Å; S279-C283 PolarHBondContact O-N 3.47Å; S279-C283 PolarHBondContact O-SG 2.84Å |
| 280 | L | 95.9 | Very high | 93.1 | Very high | 87 Ų | 87 | 47.7 Ų | 47.7 | 46% | 0.455 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60.4 | -45.9 | 174.9 | -69.1 | 176.9 | 0 | 0 | 0 | 111.2 | L276 T277 L282 C283 F284 | L276-L280 HydrophobicContact CD1-CD1 4.39Å; L276-L280 HydrophobicContact CD1-CG 4.33Å; L276-L280 HydrophobicContact CG-CD1 4.26Å; L276-L280 WeakPolarHBondContact O-CG 3.42Å; L276-L280 PolarHBondContact O-N 3.32Å; T277-L280 PolarHBondContact O-N 3.38Å; L280-L282 PolarHBondContact O-N 2.93Å; L280-C283 WeakPolarHBondContact O-CB 3.4Å; L280-C283 PolarHBondContact O-N 3.48Å; L280-F284 HydrophobicContact CB-CD2 4.35Å; L280-F284 HydrophobicContact CB-CE2 4.2Å; L280-F284 WeakPolarHBondContact O-CD2 3.39Å; L280-F284 PolarHBondContact O-N 2.88Å |
| 281 | L | 96.1 | Very high | 92.6 | Very high | 16 Ų | 16 | 53.6 Ų | 53.6 | 8% | 0.084 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -64.4 | -38.8 | -179.5 | -170.7 | 56.9 | 0 | 0 | 0 | 112.4 | L221 L224 M225 T277 R278 S279 F284 T285 | L221-L281 HydrophobicContact CB-CD1 4.07Å; L221-L281 HydrophobicContact CD2-CD1 3.5Å; L221-L281 HydrophobicContact CG-CD1 4.33Å; L224-L281 HydrophobicContact CB-CD2 4.01Å; L224-L281 HydrophobicContact CD2-CD1 4.43Å; L224-L281 HydrophobicContact CD2-CD2 3.96Å; L224-L281 HydrophobicContact CG-CD2 3.75Å; M225-L281 VanDerWaalsContact CA-CD2 3.47Å; M225-L281 HydrophobicContact CB-CD2 3.63Å; M225-L281 HydrophobicContact CB-CG 3.99Å; T277-L281 VanDerWaalsContact O-CB 3.3Å; T277-L281 WeakPolarHBondContact O-CB 3.23Å; T277-L281 PolarHBondContact O-N 3.3Å; R278-L281 PolarHBondContact O-N 2.91Å; S279-L281 PolarHBondContact O-N 3.1Å; L281-F284 PolarHBondContact O-N 3.18Å; L281-T285 HydrophobicContact CD1-CG2 4.49Å; L281-T285 WeakPolarHBondContact O-CB 3.16Å; L281-T285 VanDerWaalsContact O-CG2 3.29Å; L281-T285 WeakPolarHBondContact O-CG2 3.34Å; L281-T285 PolarHBondContact O-N 2.76Å; L281-T285 PolarHBondContact O-OG1 3.47Å |
| 282 | L | 95.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65.2 | -40.7 | 173.1 | -77.7 | 168.7 | 0 | 0 | 0 | 112.2 | H136 L139 Y178 M225 R278 S279 L280 T285 W286 | H136-L282 PolarHBondContact NE2-O 2.72Å; L139-L282 HydrophobicContact CD2-CD1 4.4Å; L139-L282 HydrophobicContact CD2-CD2 3.69Å; L139-L282 HydrophobicContact CG-CD1 4.1Å; L139-L282 HydrophobicContact CG-CD2 4.06Å; Y178-L282 HydrophobicContact CD1-CD1 3.99Å; Y178-L282 HydrophobicContact CE1-CD1 3.76Å; M225-L282 HydrophobicContact CE-CD2 4.2Å; M225-L282 HydrophobicContact CG-CD2 3.83Å; M225-L282 HydrophobicContact CG-CG 4Å; M225-L282 HydrophobicContact SD-CD2 4.12Å; R278-L282 HydrophobicContact CG-CD1 4.05Å; R278-L282 WeakPolarHBondContact O-CB 3.48Å; R278-L282 WeakPolarHBondContact O-CG 3.05Å; R278-L282 PolarHBondContact O-N 2.84Å; S279-L282 PolarHBondContact O-N 2.86Å; L280-L282 PolarHBondContact O-N 2.93Å; L282-T285 WeakPolarHBondContact CA-OG1 3.22Å; L282-T285 PolarHBondContact O-OG1 2.96Å; L282-W286 VanDerWaalsContact O-CB 3.24Å; L282-W286 WeakPolarHBondContact O-CB 3.41Å; L282-W286 PolarHBondContact O-N 2.88Å |
| 283 | C | 94.5 | Very high | 90.5 | Very high | 35 Ų | 35 | 55.1 Ų | 55.1 | 24% | 0.236 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.1 | -46.2 | 174.6 | -68.2 | 0 | 0 | 0 | 0 | 111.7 | V144 S279 L280 W286 L287 | V144-C283 WeakPolarHBondContact CG2-SG 3.42Å; S279-C283 PolarHBondContact O-N 3.47Å; S279-C283 PolarHBondContact O-SG 2.84Å; L280-C283 WeakPolarHBondContact O-CB 3.4Å; L280-C283 PolarHBondContact O-N 3.48Å; C283-W286 PolarHBondContact O-N 3.18Å; C283-L287 WeakPolarHBondContact O-CG 3.44Å; C283-L287 PolarHBondContact O-N 2.94Å |
| 284 | F | 92.8 | Very high | 89.3 | Confident | 117 Ų | 117 | 52.4 Ų | 52.4 | 51% | 0.513 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -63.4 | -47.4 | 178.1 | -76.6 | -59.6 | 0 | 0 | 0 | 111.9 | L280 L281 W286 L287 L288 | L280-F284 HydrophobicContact CB-CD2 4.35Å; L280-F284 HydrophobicContact CB-CE2 4.2Å; L280-F284 WeakPolarHBondContact O-CD2 3.39Å; L280-F284 PolarHBondContact O-N 2.88Å; L281-F284 PolarHBondContact O-N 3.18Å; F284-W286 VanDerWaalsContact C-N 3.26Å; F284-W286 PolarHBondContact O-N 3.41Å; F284-L287 PolarHBondContact O-N 3.23Å; F284-L288 WeakPolarHBondContact O-CB 3.49Å; F284-L288 WeakPolarHBondContact O-CG 3.43Å; F284-L288 PolarHBondContact O-N 3.34Å |
| 285 | T | 92.4 | Very high | 87.5 | Confident | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.2 | -35.3 | 176.4 | 50.1 | 0 | 0 | 0 | 0 | 111.8 | H136 M218 L221 L281 L282 A289 | H136-T285 PolarHBondContact CE1-OG1 3.5Å; H136-T285 VanDerWaalsContact CE1-OG1 3.27Å; H136-T285 PolarHBondContact NE2-OG1 3Å; M218-T285 WeakPolarHBondContact CE-O 3.27Å; L221-T285 HydrophobicContact CB-CG2 3.51Å; L221-T285 HydrophobicContact CD1-CG2 4.31Å; L281-T285 HydrophobicContact CD1-CG2 4.49Å; L281-T285 WeakPolarHBondContact O-CB 3.16Å; L281-T285 VanDerWaalsContact O-CG2 3.29Å; L281-T285 WeakPolarHBondContact O-CG2 3.34Å; L281-T285 PolarHBondContact O-N 2.76Å; L281-T285 PolarHBondContact O-OG1 3.47Å; L282-T285 WeakPolarHBondContact CA-OG1 3.22Å; L282-T285 PolarHBondContact O-OG1 2.96Å; T285-A289 WeakPolarHBondContact O-CB 3.3Å; T285-A289 PolarHBondContact O-N 3.44Å |
| 286 | W | 91.6 | Very high | 85.6 | Confident | 94 Ų | 94 | 50.2 Ų | 50.2 | 36% | 0.356 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -65.6 | -50.8 | 175.7 | 178.7 | 69.1 | 0 | 0 | 0 | 111.5 | H136 A140 L282 C283 F284 L288 A289 Q290 | H136-W286 VanDerWaalsContact CD2-CA 3.42Å; H136-W286 WeakPolarHBondContact CD2-CA 3.24Å; H136-W286 WeakPolarHBondContact CD2-CB 3.41Å; H136-W286 AromaticContact CD2-CD1 3.59Å; H136-W286 AromaticContact CD2-CG 3.86Å; H136-W286 WeakPolarHBondContact NE2-CA 3.39Å; H136-W286 WeakPolarHBondContact NE2-CB 3.36Å; H136-W286 PolarHBondContact NE2-N 3.04Å; A140-W286 HydrophobicContact CB-CB 4Å; A140-W286 HydrophobicContact CB-CG 4.19Å; L282-W286 VanDerWaalsContact O-CB 3.24Å; L282-W286 WeakPolarHBondContact O-CB 3.41Å; L282-W286 PolarHBondContact O-N 2.88Å; C283-W286 PolarHBondContact O-N 3.18Å; F284-W286 VanDerWaalsContact C-N 3.26Å; F284-W286 PolarHBondContact O-N 3.41Å; W286-L288 VanDerWaalsContact C-N 3.33Å; W286-L288 PolarHBondContact O-N 3.39Å; W286-A289 PolarHBondContact O-N 3.21Å; W286-Q290 HydrophobicContact CZ2-CG 4.45Å; W286-Q290 WeakPolarHBondContact O-CG 3.41Å; W286-Q290 PolarHBondContact O-N 2.93Å |
| 287 | L | 89.7 | Confident | 83.8 | Confident | 73 Ų | 73 | 51.4 Ų | 51.4 | 38% | 0.382 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -58 | -47 | 177.8 | -70.6 | 171.4 | 0 | 0 | 0 | 111.2 | C283 F284 A289 Q290 F291 | C283-L287 WeakPolarHBondContact O-CG 3.44Å; C283-L287 PolarHBondContact O-N 2.94Å; F284-L287 PolarHBondContact O-N 3.23Å; L287-A289 VanDerWaalsContact C-N 3.33Å; L287-A289 PolarHBondContact O-N 2.93Å; L287-Q290 PolarHBondContact O-N 3.43Å; L287-F291 HydrophobicContact CD2-CE2 4.16Å; L287-F291 WeakPolarHBondContact O-CD2 3.31Å; L287-F291 PolarHBondContact O-N 2.91Å |
| 288 | L | 88.7 | Confident | 82.2 | Confident | 58 Ų | 58 | 50.2 Ų | 50.2 | 30% | 0.304 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -68.2 | -32.5 | 179 | -64.8 | 169.9 | 0 | 0 | 0 | 112.2 | F214 M218 L221 F284 W286 Q290 G292 | F214-L288 HydrophobicContact CE2-CB 4.47Å; F214-L288 HydrophobicContact CE2-CD2 3.82Å; F214-L288 HydrophobicContact CZ-CB 4.11Å; F214-L288 HydrophobicContact CZ-CD2 4.28Å; F214-L288 WeakPolarHBondContact CZ-O 3.35Å; M218-L288 HydrophobicContact CE-CB 3.66Å; M218-L288 HydrophobicContact SD-CB 3.2Å; M218-L288 WeakPolarHBondContact SD-CB 3.04Å; M218-L288 HydrophobicContact SD-CD1 3.57Å; M218-L288 VanDerWaalsContact SD-CD1 3.57Å; M218-L288 HydrophobicContact SD-CG 4Å; L221-L288 HydrophobicContact CD1-CD1 3.6Å; F284-L288 WeakPolarHBondContact O-CB 3.49Å; F284-L288 WeakPolarHBondContact O-CG 3.43Å; F284-L288 PolarHBondContact O-N 3.34Å; W286-L288 VanDerWaalsContact C-N 3.33Å; W286-L288 PolarHBondContact O-N 3.39Å; L288-Q290 VanDerWaalsContact C-N 3.32Å; L288-G292 VanDerWaalsContact O-CA 3.24Å; L288-G292 WeakPolarHBondContact O-CA 2.94Å; L288-G292 PolarHBondContact O-N 3.45Å |
| 289 | A | 86.2 | Confident | 80.3 | Confident | 7 Ų | 7 | 51.6 Ų | 51.6 | 6% | 0.058 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.6 | -34.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | R192 M218 T285 W286 L287 | R192-A289 PolarHBondContact NH1-O 2.96Å; R192-A289 PolarHBondContact NH2-O 2.93Å; M218-A289 HydrophobicContact CE-CB 4.26Å; T285-A289 WeakPolarHBondContact O-CB 3.3Å; T285-A289 PolarHBondContact O-N 3.44Å; W286-A289 PolarHBondContact O-N 3.21Å; L287-A289 VanDerWaalsContact C-N 3.33Å; L287-A289 PolarHBondContact O-N 2.93Å |
| 290 | Q | 85.3 | Confident | 78.6 | Confident | 104 Ų | 104 | 55.6 Ų | 55.6 | 49% | 0.486 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -74.7 | -43.5 | 177.5 | -66.4 | -65.1 | 2.3 | 0 | 0 | 112.9 | W286 L287 L288 | W286-Q290 HydrophobicContact CZ2-CG 4.45Å; W286-Q290 WeakPolarHBondContact O-CG 3.41Å; W286-Q290 PolarHBondContact O-N 2.93Å; L287-Q290 PolarHBondContact O-N 3.43Å; L288-Q290 VanDerWaalsContact C-N 3.32Å |
| 291 | F | 81.2 | Confident | 77.2 | Confident | 170 Ų | 170 | 58.1 Ų | 58.1 | 75% | 0.746 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -90.1 | -2.4 | -179.3 | -61.9 | -63.3 | 0 | 0 | 0 | 113.6 | L287 | L287-F291 HydrophobicContact CD2-CE2 4.16Å; L287-F291 WeakPolarHBondContact O-CD2 3.31Å; L287-F291 PolarHBondContact O-N 2.91Å |
| 292 | G | 73.7 | Confident | 75.8 | Confident | 8 Ų | 8 | 58.9 Ų | 58.9 | 8% | 0.082 | 31% | 0.306 | C | S | . | . | S | Bend | trans | -68.6 | 143 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L288 D294 | L288-G292 VanDerWaalsContact O-CA 3.24Å; L288-G292 WeakPolarHBondContact O-CA 2.94Å; L288-G292 PolarHBondContact O-N 3.45Å; G292-D294 PolarHBondContact O-N 3.05Å |
| 293 | P | 69 | Low | 74.4 | Confident | 45 Ų | 45 | 67.1 Ų | 67.1 | 29% | 0.292 | 34% | 0.337 | S | S | . | . | trans | -64.2 | 121.3 | 174.6 | 26.2 | -31.8 | 0 | 0 | 0 | 109.8 | R211 F214 M295 | R211-P293 HydrophobicContact CG-CG 4Å; F214-P293 HydrophobicContact CD1-CG 4.4Å; P293-M295 PolarHBondContact O-N 2.85Å | ||
| 294 | D | 67.1 | Low | 73.2 | Confident | 63 Ų | 63 | 71.2 Ų | 71.2 | 34% | 0.337 | 35% | 0.354 | S | S | . | . | trans | -69.7 | 99.4 | 171.9 | -90.7 | -45.3 | 0 | 0 | 0 | 110.8 | R192 G292 T297 A298 | R192-D294 IonicContact CZ-OD1 3.11Å; R192-D294 IonicContact NE-OD1 3.49Å; R192-D294 PolarHBondContact NE-OD1 2.79Å; R192-D294 IonicContact NH2-OD1 3.81Å; R192-D294 PolarHBondContact NH2-OD1 2.77Å; R192-D294 IonicContact NH2-OD2 2.78Å; R192-D294 PolarHBondContact NH2-OD2 3.09Å; G292-D294 PolarHBondContact O-N 3.05Å; D294-T297 HydrophobicContact CB-CG2 4.08Å; D294-T297 WeakPolarHBondContact CB-OG1 3.16Å; D294-A298 VanDerWaalsContact O-CB 3.27Å; D294-A298 WeakPolarHBondContact O-CB 3.35Å; D294-A298 PolarHBondContact O-N 2.75Å | ||
| 295 | M | 57.4 | Low | 72.3 | Confident | 10 Ų | 10 | 71.1 Ų | 71.1 | 5% | 0.049 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -70 | -41.6 | 170.8 | -79.7 | -68.1 | -78.9 | 0 | 0 | 111.5 | L201 L207 R211 H215 P293 T297 A298 V299 | L201-M295 HydrophobicContact CD1-CE 3.99Å; L207-M295 HydrophobicContact CD1-CE 3.42Å; L207-M295 VanDerWaalsContact CD1-CE 3.42Å; L207-M295 HydrophobicContact CD2-CE 3.67Å; L207-M295 HydrophobicContact CD2-SD 3.93Å; L207-M295 HydrophobicContact CG-CE 4.17Å; R211-M295 WeakPolarHBondContact CD-SD 3.4Å; R211-M295 PolarHBondContact NH1-SD 3.26Å; H215-M295 WeakPolarHBondContact NE2-CG 3.29Å; P293-M295 PolarHBondContact O-N 2.85Å; M295-T297 PolarHBondContact O-N 2.9Å; M295-A298 PolarHBondContact O-N 3.15Å; M295-V299 HydrophobicContact CE-CG2 4.48Å; M295-V299 VanDerWaalsContact O-CB 3.3Å; M295-V299 WeakPolarHBondContact O-CB 3.48Å; M295-V299 VanDerWaalsContact O-CG2 3.22Å; M295-V299 WeakPolarHBondContact O-CG2 3.05Å; M295-V299 PolarHBondContact O-N 3.12Å |
| 296 | L | 55.1 | Low | 71.1 | Confident | 34 Ų | 34 | 78.7 Ų | 78.7 | 18% | 0.178 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -60.2 | -47.2 | -177.7 | -170 | 76 | 0 | 0 | 0 | 111.4 | V299 L300 | L296-V299 PolarHBondContact O-N 2.8Å; L296-L300 HydrophobicContact CD1-CD1 4.47Å; L296-L300 HydrophobicContact CD2-CD1 4.38Å; L296-L300 HydrophobicContact CG-CD1 3.95Å; L296-L300 HydrophobicContact CG-CG 4.39Å; L296-L300 VanDerWaalsContact O-CB 3.28Å; L296-L300 WeakPolarHBondContact O-CB 3.42Å; L296-L300 VanDerWaalsContact O-CG 3.25Å; L296-L300 WeakPolarHBondContact O-CG 3.26Å; L296-L300 PolarHBondContact O-N 3.33Å |
| 297 | T | 58.6 | Low | 69.9 | Low | 81 Ų | 81 | 79.2 Ų | 79.2 | 50% | 0.497 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -69 | -38.7 | 178.9 | 67.5 | 0 | 0 | 0 | 0 | 111.5 | D294 M295 K301 | D294-T297 HydrophobicContact CB-CG2 4.08Å; D294-T297 WeakPolarHBondContact CB-OG1 3.16Å; M295-T297 PolarHBondContact O-N 2.9Å; T297-K301 WeakPolarHBondContact O-CB 3.27Å; T297-K301 PolarHBondContact O-N 3.31Å |
| 298 | A | 62.2 | Low | 68.8 | Low | 44 Ų | 44 | 82.1 Ų | 82.1 | 36% | 0.364 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -63.1 | -41.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | D294 M295 A302 | D294-A298 VanDerWaalsContact O-CB 3.27Å; D294-A298 WeakPolarHBondContact O-CB 3.35Å; D294-A298 PolarHBondContact O-N 2.75Å; M295-A298 PolarHBondContact O-N 3.15Å; A298-A302 VanDerWaalsContact O-CB 3.26Å; A298-A302 WeakPolarHBondContact O-CB 3.25Å; A298-A302 PolarHBondContact O-N 3.38Å |
| 299 | V | 57.7 | Low | 67.4 | Low | 31 Ų | 31 | 83 Ų | 83 | 19% | 0.188 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -73.6 | -45.7 | 180 | 171.4 | 0 | 0 | 0 | 0 | 111.2 | L201 M295 L296 K301 A302 R303 | L201-V299 HydrophobicContact CD1-CG2 4.25Å; M295-V299 HydrophobicContact CE-CG2 4.48Å; M295-V299 VanDerWaalsContact O-CB 3.3Å; M295-V299 WeakPolarHBondContact O-CB 3.48Å; M295-V299 VanDerWaalsContact O-CG2 3.22Å; M295-V299 WeakPolarHBondContact O-CG2 3.05Å; M295-V299 PolarHBondContact O-N 3.12Å; L296-V299 PolarHBondContact O-N 2.8Å; V299-K301 VanDerWaalsContact C-N 3.27Å; V299-K301 PolarHBondContact O-N 2.9Å; V299-A302 CarbonylContact O-C 3.59Å; V299-A302 PolarHBondContact O-N 3.15Å; V299-A302 VanDerWaalsContact O-N 3.16Å; V299-R303 WeakPolarHBondContact O-CB 3.25Å; V299-R303 PolarHBondContact O-N 3.49Å |
| 300 | L | 59.2 | Low | 65.4 | Low | 91 Ų | 91 | 89 Ų | 89 | 48% | 0.476 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -58.9 | -42.8 | 174.1 | -73.8 | 174.7 | 0 | 0 | 0 | 110.4 | L296 R303 M304 | L296-L300 HydrophobicContact CD1-CD1 4.47Å; L296-L300 HydrophobicContact CD2-CD1 4.38Å; L296-L300 HydrophobicContact CG-CD1 3.95Å; L296-L300 HydrophobicContact CG-CG 4.39Å; L296-L300 VanDerWaalsContact O-CB 3.28Å; L296-L300 WeakPolarHBondContact O-CB 3.42Å; L296-L300 VanDerWaalsContact O-CG 3.25Å; L296-L300 WeakPolarHBondContact O-CG 3.26Å; L296-L300 PolarHBondContact O-N 3.33Å; L300-R303 PolarHBondContact O-N 3.1Å; L300-M304 WeakPolarHBondContact O-CB 3.18Å; L300-M304 PolarHBondContact O-N 3.41Å |
| 301 | K | 67.5 | Low | 63.6 | Low | 139 Ų | 139 | 88.6 Ų | 88.6 | 60% | 0.604 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -63.5 | -43.5 | 174.5 | -170.4 | 173 | -174.5 | 174.4 | 0 | 111.9 | T297 V299 Q305 | T297-K301 WeakPolarHBondContact O-CB 3.27Å; T297-K301 PolarHBondContact O-N 3.31Å; V299-K301 VanDerWaalsContact C-N 3.27Å; V299-K301 PolarHBondContact O-N 2.9Å; K301-Q305 VanDerWaalsContact O-CB 3.31Å; K301-Q305 WeakPolarHBondContact O-CB 3.31Å; K301-Q305 VanDerWaalsContact O-CG 3.27Å; K301-Q305 WeakPolarHBondContact O-CG 3.35Å; K301-Q305 PolarHBondContact O-N 2.92Å |
| 302 | A | 65.3 | Low | 61.9 | Low | 33 Ų | 33 | 90 Ų | 90 | 27% | 0.273 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -66.1 | -38.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | A298 V299 Q305 R306 | A298-A302 VanDerWaalsContact O-CB 3.26Å; A298-A302 WeakPolarHBondContact O-CB 3.25Å; A298-A302 PolarHBondContact O-N 3.38Å; V299-A302 CarbonylContact O-C 3.59Å; V299-A302 PolarHBondContact O-N 3.15Å; V299-A302 VanDerWaalsContact O-N 3.16Å; A302-Q305 PolarHBondContact O-N 3.06Å; A302-R306 WeakPolarHBondContact O-CG 3.28Å; A302-R306 PolarHBondContact O-N 2.97Å |
| 303 | R | 67.1 | Low | 60.3 | Low | 172 Ų | 172 | 97.8 Ų | 97.8 | 65% | 0.649 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -70.6 | -43.1 | 178 | -164.9 | 173.3 | -171.4 | 166 | 2.2 | 111 | V299 L300 Q305 R306 T307 | V299-R303 WeakPolarHBondContact O-CB 3.25Å; V299-R303 PolarHBondContact O-N 3.49Å; L300-R303 PolarHBondContact O-N 3.1Å; R303-Q305 VanDerWaalsContact C-N 3.32Å; R303-Q305 PolarHBondContact O-N 2.99Å; R303-R306 PolarHBondContact O-N 3.27Å; R303-T307 PolarHBondContact O-N 3.46Å; R303-T307 PolarHBondContact O-OG1 3.2Å; R303-T307 VanDerWaalsContact O-OG1 3.04Å |
| 304 | M | 69 | Low | 58.9 | Low | 121 Ų | 121 | 100.9 Ų | 100.9 | 60% | 0.596 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.9 | -42.7 | 172 | -174 | -176.4 | -177.5 | 0 | 0 | 111.1 | L300 T307 L308 | L300-M304 WeakPolarHBondContact O-CB 3.18Å; L300-M304 PolarHBondContact O-N 3.41Å; M304-T307 WeakPolarHBondContact CA-OG1 3.35Å; M304-T307 PolarHBondContact O-N 2.68Å; M304-T307 PolarHBondContact O-OG1 3.01Å; M304-L308 HydrophobicContact CE-CD1 4.3Å; M304-L308 HydrophobicContact CG-CD1 4.08Å; M304-L308 WeakPolarHBondContact O-CB 3.37Å; M304-L308 VanDerWaalsContact O-CG 3.25Å; M304-L308 WeakPolarHBondContact O-CG 3.22Å; M304-L308 PolarHBondContact O-N 3.04Å |
| 305 | Q | 74.6 | Confident | 57.5 | Low | 116 Ų | 116 | 105.5 Ų | 105.5 | 54% | 0.542 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.9 | -39.1 | 174.2 | -78.9 | -178.8 | -33 | 0 | 0 | 112 | K301 A302 R303 L308 A309 | K301-Q305 VanDerWaalsContact O-CB 3.31Å; K301-Q305 WeakPolarHBondContact O-CB 3.31Å; K301-Q305 VanDerWaalsContact O-CG 3.27Å; K301-Q305 WeakPolarHBondContact O-CG 3.35Å; K301-Q305 PolarHBondContact O-N 2.92Å; A302-Q305 PolarHBondContact O-N 3.06Å; R303-Q305 VanDerWaalsContact C-N 3.32Å; R303-Q305 PolarHBondContact O-N 2.99Å; Q305-L308 PolarHBondContact O-N 3.09Å; Q305-A309 WeakPolarHBondContact O-CA 3.27Å; Q305-A309 WeakPolarHBondContact O-CB 3Å; Q305-A309 PolarHBondContact O-N 2.82Å |
| 306 | R | 67 | Low | 56.4 | Low | 159 Ų | 159 | 110.5 Ų | 110.5 | 60% | 0.6 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -68.9 | -38.1 | 176.5 | -75.4 | 178 | -165.9 | 154.5 | 3.5 | 113 | A302 R303 L308 A309 Q310 | A302-R306 WeakPolarHBondContact O-CG 3.28Å; A302-R306 PolarHBondContact O-N 2.97Å; R303-R306 PolarHBondContact O-N 3.27Å; R306-L308 VanDerWaalsContact C-N 3.32Å; R306-A309 PolarHBondContact O-N 2.66Å; R306-Q310 WeakPolarHBondContact O-CB 3.45Å; R306-Q310 VanDerWaalsContact O-CG 3.28Å; R306-Q310 WeakPolarHBondContact O-CG 3.38Å; R306-Q310 PolarHBondContact O-N 2.91Å; R306-Q310 VanDerWaalsContact O-N 3.09Å |
| 307 | T | 66.1 | Low | 55.4 | Low | 104 Ų | 104 | 117 Ų | 117 | 64% | 0.638 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.9 | -34.2 | 174.5 | 44.4 | 0 | 0 | 0 | 0 | 111.7 | R303 M304 | R303-T307 PolarHBondContact O-N 3.46Å; R303-T307 PolarHBondContact O-OG1 3.2Å; R303-T307 VanDerWaalsContact O-OG1 3.04Å; M304-T307 WeakPolarHBondContact CA-OG1 3.35Å; M304-T307 PolarHBondContact O-N 2.68Å; M304-T307 PolarHBondContact O-OG1 3.01Å |
| 308 | L | 66.9 | Low | 54 | Low | 135 Ų | 135 | 121.2 Ų | 121.2 | 71% | 0.707 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -75.4 | -34.8 | 173.1 | -70.1 | 169.1 | 0 | 0 | 0 | 113.2 | M304 Q305 R306 | M304-L308 HydrophobicContact CE-CD1 4.3Å; M304-L308 HydrophobicContact CG-CD1 4.08Å; M304-L308 WeakPolarHBondContact O-CB 3.37Å; M304-L308 VanDerWaalsContact O-CG 3.25Å; M304-L308 WeakPolarHBondContact O-CG 3.22Å; M304-L308 PolarHBondContact O-N 3.04Å; Q305-L308 PolarHBondContact O-N 3.09Å; R306-L308 VanDerWaalsContact C-N 3.32Å |
| 309 | A | 60.1 | Low | 52.5 | Low | 75 Ų | 75 | 124.9 Ų | 124.9 | 62% | 0.62 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -94.4 | 1.7 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q305 R306 P311 | Q305-A309 WeakPolarHBondContact O-CA 3.27Å; Q305-A309 WeakPolarHBondContact O-CB 3Å; Q305-A309 PolarHBondContact O-N 2.82Å; R306-A309 PolarHBondContact O-N 2.66Å; A309-P311 WeakPolarHBondContact O-CD 3.33Å |
| 310 | Q | 44 | Very low | 51.2 | Low | 134 Ų | 134 | 128 Ų | 128 | 63% | 0.626 | 66% | 0.661 | S | S | * | * | trans | -91 | 87.8 | 166.9 | -75.3 | -82.9 | -5.4 | 0 | 0 | 109 | R306 K312 | R306-Q310 WeakPolarHBondContact O-CB 3.45Å; R306-Q310 VanDerWaalsContact O-CG 3.28Å; R306-Q310 WeakPolarHBondContact O-CG 3.38Å; R306-Q310 PolarHBondContact O-N 2.91Å; R306-Q310 VanDerWaalsContact O-N 3.09Å; Q310-K312 PolarHBondContact O-N 3.31Å | ||
| 311 | P | 48 | Very low | 49.8 | Very low | 96 Ų | 96 | 127.9 Ų | 127.9 | 62% | 0.623 | 67% | 0.673 | S | S | * | * | trans | -63.3 | 120.4 | 155.4 | 29.2 | -29.7 | 0 | 0 | 0 | 105.4 | A309 K313 | A309-P311 WeakPolarHBondContact O-CD 3.33Å; P311-K313 VanDerWaalsContact C-N 3.31Å; P311-K313 PolarHBondContact O-N 2.68Å | ||
| 312 | K | 43.6 | Very low | 47.9 | Very low | 199 Ų | 199 | 130.3 Ų | 130.3 | 87% | 0.865 | 68% | 0.684 | S | S | * | * | trans | -37 | 88.3 | -178.9 | -142.5 | 178.3 | -170.2 | -177.4 | 0 | 110.7 | Q310 S314 | Q310-K312 PolarHBondContact O-N 3.31Å; K312-S314 PolarHBondContact O-N 2.75Å | ||
| 313 | K | 40.6 | Very low | 46.1 | Very low | 171 Ų | 171 | 132.2 Ų | 132.2 | 74% | 0.743 | 71% | 0.706 | S | S | * | * | trans | -71.6 | 104.8 | 175.9 | -81.3 | -175 | 178.5 | -179.2 | 0 | 105.5 | P311 L315 | P311-K313 VanDerWaalsContact C-N 3.31Å; P311-K313 PolarHBondContact O-N 2.68Å; K313-L315 PolarHBondContact O-N 2.97Å | ||
| 314 | S | 40.7 | Very low | 44 | Very low | 110 Ų | 110 | 130.5 Ų | 130.5 | 77% | 0.769 | 72% | 0.719 | S | S | * | * | trans | -43.9 | 112.5 | 165.1 | 46.8 | 0 | 0 | 0 | 0 | 108.3 | K312 | K312-S314 PolarHBondContact O-N 2.75Š| ||
| 315 | L | 36.4 | Very low | 42 | Very low | 160 Ų | 160 | 129.9 Ų | 129.9 | 84% | 0.838 | 73% | 0.726 | S | S | * | * | trans | -52.1 | 127.6 | 170.5 | -82.4 | 151.8 | 0 | 0 | 0 | 108 | K313 M317 | K313-L315 PolarHBondContact O-N 2.97Å; L315-M317 PolarHBondContact O-N 2.86Å | ||
| 316 | P | 35.1 | Very low | 39.6 | Very low | 116 Ų | 116 | 133.3 Ų | 133.3 | 75% | 0.753 | 74% | 0.743 | S | S | * | * | trans | -66.2 | 107.4 | 169.3 | 27.2 | -30 | 0 | 0 | 0 | 106.6 | Q318 | P316-Q318 PolarHBondContact O-N 3.47Š| ||
| 317 | M | 33.8 | Very low | 37.7 | Very low | 171 Ų | 171 | 131.3 Ų | 131.3 | 84% | 0.842 | 75% | 0.753 | S | S | * | * | trans | -64.5 | 90 | 169.7 | -171 | -175.5 | -88.6 | 0 | 0 | 106.8 | L315 V319 | L315-M317 PolarHBondContact O-N 2.86Å; M317-V319 VanDerWaalsContact C-N 3.35Å; M317-V319 HydrophobicContact CG-CG2 4.43Å; M317-V319 PolarHBondContact O-N 3.22Å | ||
| 318 | Q | 29.3 | Very low | 36.1 | Very low | 168 Ų | 168 | 131.6 Ų | 131.6 | 79% | 0.785 | 76% | 0.756 | S | S | * | * | trans | -64 | 103.8 | 160.1 | -93.5 | -164.5 | 3.4 | 0 | 0 | 106.5 | P316 V320 | P316-Q318 PolarHBondContact O-N 3.47Å; Q318-V320 HydrophobicContact CB-CG2 4.45Å; Q318-V320 PolarHBondContact O-N 3.5Å | ||
| 319 | V | 31.5 | Very low | 34.2 | Very low | 121 Ų | 121 | 130.3 Ų | 130.3 | 73% | 0.733 | 76% | 0.759 | S | S | * | * | trans | -68.7 | 83.5 | 165.3 | -178.8 | 0 | 0 | 0 | 0 | 106.7 | M317 A321 | M317-V319 VanDerWaalsContact C-N 3.35Å; M317-V319 HydrophobicContact CG-CG2 4.43Å; M317-V319 PolarHBondContact O-N 3.22Å; V319-A321 PolarHBondContact O-N 3.25Å | ||
| 320 | V | 30.4 | Very low | 32.7 | Very low | 97 Ų | 97 | 131.5 Ų | 131.5 | 59% | 0.588 | 76% | 0.762 | S | S | * | * | trans | -87.9 | 97.8 | 160.4 | 174.3 | 0 | 0 | 0 | 0 | 105.7 | Q318 F322 | Q318-V320 HydrophobicContact CB-CG2 4.45Å; Q318-V320 PolarHBondContact O-N 3.5Å; V320-F322 HydrophobicContact CG1-CD2 3.67Å; V320-F322 HydrophobicContact CG1-CE2 4.29Å; V320-F322 PolarHBondContact O-N 3.44Å | ||
| 321 | A | 28.3 | Very low | 31.8 | Very low | 88 Ų | 88 | 130.9 Ų | 130.9 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -63.4 | 101.6 | 170.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | V319 | V319-A321 PolarHBondContact O-N 3.25Š| ||
| 322 | F | 28.5 | Very low | 30.8 | Very low | 191 Ų | 191 | 132 Ų | 132 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | -124 | 122.1 | 162.5 | -103.2 | -91.1 | 0 | 0 | 0 | 109.4 | V320 | V320-F322 HydrophobicContact CG1-CD2 3.67Å; V320-F322 HydrophobicContact CG1-CE2 4.29Å; V320-F322 PolarHBondContact O-N 3.44Å | ||
| 323 | G | 27.9 | Very low | 29.8 | Very low | 72 Ų | 72 | 133.6 Ų | 133.6 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | trans | -64 | 154.7 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | S325 | G323-S325 PolarHBondContact O-N 3.12Š| ||
| 324 | C | 22.9 | Very low | 29.3 | Very low | 137 Ų | 137 | 131.9 Ų | 131.9 | 93% | 0.926 | 78% | 0.777 | S | S | * | * | trans | -43.9 | 122.9 | 169.3 | -65.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 325 | S | 26.9 | Very low | 28.7 | Very low | 107 Ų | 107 | 131.4 Ų | 131.4 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | trans | -160 | 112.3 | 136.5 | -168.1 | 0 | 0 | 0 | 0 | 110.2 | G323 | G323-S325 PolarHBondContact O-N 3.12Š| ||
| 326 | Q | 24.7 | Very low | 28.2 | Very low | 189 Ų | 189 | 127.7 Ų | 127.7 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | trans | 26 | 117.4 | 148.6 | -61.8 | -179.9 | -1.1 | 0 | 0 | 118.9 | ||||
| 327 | S | 26.6 | Very low | 27.9 | Very low | 116 Ų | 116 | 125.4 Ų | 125.4 | 81% | 0.811 | 77% | 0.771 | S | S | * | * | trans | -142.4 | 128.5 | 149.4 | 172.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 328 | P | 33.1 | Very low | 27.6 | Very low | 110 Ų | 110 | 128.5 Ų | 128.5 | 71% | 0.714 | 77% | 0.773 | S | S | * | * | trans | -92.2 | 155.2 | 166.7 | 35.5 | -28.7 | 0 | 0 | 0 | 111.4 | ||||
| 329 | S | 26.6 | Very low | 27.8 | Very low | 109 Ų | 109 | 126.8 Ų | 126.8 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | trans | 61.9 | 107.2 | 150 | 177.6 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 330 | S | 27.6 | Very low | 27.7 | Very low | 99 Ų | 99 | 126.4 Ų | 126.4 | 69% | 0.692 | 77% | 0.771 | S | S | * | * | 163.6 | 144.3 | 102 | 61.8 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 331 | T | 25.6 | Very low | 27.8 | Very low | 122 Ų | 122 | 126.9 Ų | 126.9 | 75% | 0.748 | 78% | 0.779 | S | S | * | * | trans | 66.2 | 110.9 | 148.1 | -13.7 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 332 | V | 26.7 | Very low | 28.1 | Very low | 120 Ų | 120 | 127.6 Ų | 127.6 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | 177.4 | 110.6 | 86.5 | 167.5 | 0 | 0 | 0 | 0 | 106.4 | V334 | V332-V334 HydrophobicContact CG1-CG2 4.06Š| |||
| 333 | R | 22.5 | Very low | 28.8 | Very low | 232 Ų | 232 | 121.1 Ų | 121.1 | 88% | 0.875 | 75% | 0.753 | S | S | * | * | trans | -91.4 | 103 | 173.8 | -160.9 | -173.3 | -72.2 | 172.6 | -3.7 | 106.7 | C335 | R333-C335 PolarHBondContact O-N 2.78Å; R333-C335 VanDerWaalsContact O-N 3.09Å | ||
| 334 | V | 30.1 | Very low | 29.5 | Very low | 134 Ų | 134 | 122.5 Ų | 122.5 | 81% | 0.812 | 74% | 0.741 | S | S | * | * | trans | -74.5 | 98.4 | 170.2 | -179.8 | 0 | 0 | 0 | 0 | 107 | V332 | V332-V334 HydrophobicContact CG1-CG2 4.06Š| ||
| 335 | C | 29 | Very low | 30.3 | Very low | 101 Ų | 101 | 123.2 Ų | 123.2 | 68% | 0.682 | 73% | 0.728 | S | S | * | * | trans | -64 | 137.3 | 173.5 | -78.1 | 0 | 0 | 0 | 0 | 110.1 | R333 G337 | R333-C335 PolarHBondContact O-N 2.78Å; R333-C335 VanDerWaalsContact O-N 3.09Å; C335-G337 PolarHBondContact O-N 2.66Å | ||
| 336 | G | 26.1 | Very low | 31.4 | Very low | 81 Ų | 81 | 124.2 Ų | 124.2 | 84% | 0.835 | 72% | 0.719 | S | S | * | * | trans | -49.3 | 107.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | R338 | G336-R338 PolarHBondContact O-N 2.84Š| ||
| 337 | G | 28.3 | Very low | 32.8 | Very low | 69 Ų | 69 | 121 Ų | 121 | 71% | 0.711 | 70% | 0.702 | S | S | * | * | trans | -68.2 | 100.3 | 163.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | C335 V339 | C335-G337 PolarHBondContact O-N 2.66Å; G337-V339 PolarHBondContact O-N 3Å | ||
| 338 | R | 26.1 | Very low | 33.5 | Very low | 236 Ų | 236 | 117.8 Ų | 117.8 | 89% | 0.891 | 68% | 0.68 | S | S | * | * | trans | -61.6 | 92.8 | 163.7 | -143.7 | -177 | -71.9 | -178.5 | -3.3 | 105.2 | G336 V340 | G336-R338 PolarHBondContact O-N 2.84Å; R338-V340 VanDerWaalsContact C-N 3.34Å; R338-V340 PolarHBondContact O-N 3.04Å | ||
| 339 | V | 34.5 | Very low | 34.4 | Very low | 132 Ų | 132 | 116.6 Ų | 116.6 | 80% | 0.8 | 67% | 0.67 | S | S | * | * | trans | -62.3 | 106.8 | 172.6 | 175.5 | 0 | 0 | 0 | 0 | 104.9 | G337 S341 | G337-V339 PolarHBondContact O-N 3Å; V339-S341 PolarHBondContact O-N 3.46Å | ||
| 340 | V | 29.1 | Very low | 36 | Very low | 113 Ų | 113 | 114.9 Ų | 114.9 | 69% | 0.685 | 65% | 0.65 | S | S | * | * | trans | -63.9 | 87.7 | 170.7 | 174.9 | 0 | 0 | 0 | 0 | 105.1 | R338 V342 | R338-V340 VanDerWaalsContact C-N 3.34Å; R338-V340 PolarHBondContact O-N 3.04Å; V340-V342 HydrophobicContact CG1-CB 4Å; V340-V342 HydrophobicContact CG1-CG2 3.25Å; V340-V342 PolarHBondContact O-N 2.89Å | ||
| 341 | S | 32.5 | Very low | 37.1 | Very low | 107 Ų | 107 | 113.1 Ų | 113.1 | 75% | 0.748 | 63% | 0.633 | S | S | * | * | trans | -68.3 | 63.3 | 159.5 | 174.8 | 0 | 0 | 0 | 0 | 106.9 | V339 S343 | V339-S341 PolarHBondContact O-N 3.46Å; S341-S343 PolarHBondContact O-N 3.04Å | ||
| 342 | V | 34.4 | Very low | 38.1 | Very low | 103 Ų | 103 | 112.1 Ų | 112.1 | 62% | 0.624 | 62% | 0.618 | S | S | * | * | trans | -58.7 | 106.1 | 153.1 | 161.8 | 0 | 0 | 0 | 0 | 103.1 | V340 M344 | V340-V342 HydrophobicContact CG1-CB 4Å; V340-V342 HydrophobicContact CG1-CG2 3.25Å; V340-V342 PolarHBondContact O-N 2.89Å; V342-M344 PolarHBondContact O-N 3.07Å | ||
| 343 | S | 43.7 | Very low | 39.5 | Very low | 55 Ų | 55 | 112 Ų | 112 | 39% | 0.385 | 61% | 0.608 | S | S | . | * | trans | -44.4 | 105.3 | -177.1 | -177.3 | 0 | 0 | 0 | 0 | 108.4 | S341 K345 K346 F347 | S341-S343 PolarHBondContact O-N 3.04Å; S343-K345 PolarHBondContact O-N 3.48Å; S343-K346 VanDerWaalsContact O-CA 3.27Å; S343-K346 WeakPolarHBondContact O-CA 3.45Å; S343-K346 VanDerWaalsContact O-CB 3.22Å; S343-K346 WeakPolarHBondContact O-CB 3.37Å; S343-K346 PolarHBondContact O-N 3.16Å; S343-F347 PolarHBondContact O-N 3.4Å; S343-F347 VanDerWaalsContact O-N 3.1Å | ||
| 344 | M | 43.3 | Very low | 41.3 | Very low | 100 Ų | 100 | 105.5 Ų | 105.5 | 49% | 0.493 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.9 | -21.8 | 177 | -168.5 | 143.6 | 68.6 | 0 | 0 | 110.2 | V342 K346 F347 C348 | V342-M344 PolarHBondContact O-N 3.07Å; M344-K346 VanDerWaalsContact C-N 3.32Å; M344-F347 PolarHBondContact O-N 2.89Å; M344-C348 WeakPolarHBondContact O-CB 3.15Å; M344-C348 PolarHBondContact O-N 2.88Å; M344-C348 PolarHBondContact O-SG 2.87Å |
| 345 | K | 39.4 | Very low | 42 | Very low | 152 Ų | 152 | 101 Ų | 101 | 66% | 0.661 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -55.5 | -46.7 | 162.5 | -71.5 | -175.8 | 176.9 | -178.1 | 0 | 111 | S343 T349 | S343-K345 PolarHBondContact O-N 3.48Å; K345-T349 WeakPolarHBondContact O-CA 3.25Å; K345-T349 WeakPolarHBondContact O-CB 3.3Å; K345-T349 PolarHBondContact O-N 2.92Å; K345-T349 PolarHBondContact O-OG1 2.99Å |
| 346 | K | 50.5 | Low | 42.8 | Very low | 129 Ų | 129 | 100.3 Ų | 100.3 | 56% | 0.561 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64 | -46.8 | 175.4 | -164.7 | 172.7 | -176.9 | 178.8 | 0 | 111.3 | S343 M344 C348 T349 E350 | S343-K346 VanDerWaalsContact O-CA 3.27Å; S343-K346 WeakPolarHBondContact O-CA 3.45Å; S343-K346 VanDerWaalsContact O-CB 3.22Å; S343-K346 WeakPolarHBondContact O-CB 3.37Å; S343-K346 PolarHBondContact O-N 3.16Å; M344-K346 VanDerWaalsContact C-N 3.32Å; K346-C348 PolarHBondContact O-N 2.87Å; K346-T349 PolarHBondContact O-N 2.9Å; K346-E350 HydrophobicContact CG-CG 3.97Å; K346-E350 WeakPolarHBondContact O-CB 3.28Å; K346-E350 VanDerWaalsContact O-CG 3.25Å; K346-E350 WeakPolarHBondContact O-CG 2.85Å; K346-E350 PolarHBondContact O-N 3.08Å |
| 347 | F | 52.5 | Low | 44.3 | Very low | 121 Ų | 121 | 100.3 Ų | 100.3 | 53% | 0.531 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.3 | -48.1 | 176.3 | 179.7 | -102 | 0 | 0 | 0 | 112.5 | S343 M344 T349 L351 | S343-F347 PolarHBondContact O-N 3.4Å; S343-F347 VanDerWaalsContact O-N 3.1Å; M344-F347 PolarHBondContact O-N 2.89Å; F347-T349 PolarHBondContact O-N 3.37Å; F347-L351 HydrophobicContact CE1-CD1 3.96Å; F347-L351 HydrophobicContact CE2-CD1 4.09Å; F347-L351 HydrophobicContact CZ-CD1 3.53Å; F347-L351 WeakPolarHBondContact O-CB 3.28Å; F347-L351 PolarHBondContact O-N 3.44Å |
| 348 | C | 41.1 | Very low | 45.4 | Very low | 49 Ų | 49 | 102.1 Ų | 102.1 | 33% | 0.331 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66 | -38.1 | 176.6 | -65 | 0 | 0 | 0 | 0 | 111.8 | M344 K346 F352 | M344-C348 WeakPolarHBondContact O-CB 3.15Å; M344-C348 PolarHBondContact O-N 2.88Å; M344-C348 PolarHBondContact O-SG 2.87Å; K346-C348 PolarHBondContact O-N 2.87Å; C348-F352 WeakPolarHBondContact O-CB 3.49Å; C348-F352 PolarHBondContact O-N 2.96Å |
| 349 | T | 52.2 | Low | 46.1 | Very low | 85 Ų | 85 | 92.6 Ų | 92.6 | 52% | 0.521 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -70.2 | -42.6 | 179.1 | -51.3 | 0 | 0 | 0 | 0 | 110.8 | K345 K346 F347 K353 | K345-T349 WeakPolarHBondContact O-CA 3.25Å; K345-T349 WeakPolarHBondContact O-CB 3.3Å; K345-T349 PolarHBondContact O-N 2.92Å; K345-T349 PolarHBondContact O-OG1 2.99Å; K346-T349 PolarHBondContact O-N 2.9Å; F347-T349 PolarHBondContact O-N 3.37Å; T349-K353 WeakPolarHBondContact O-CA 3.36Å; T349-K353 WeakPolarHBondContact O-CB 3.29Å; T349-K353 PolarHBondContact O-N 3.37Å |
| 350 | E | 60.8 | Low | 46.7 | Very low | 73 Ų | 73 | 89.8 Ų | 89.8 | 34% | 0.341 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -68 | -44.6 | 175.9 | -61.4 | -57.1 | 161.7 | 0 | 0 | 110.3 | K346 F352 K353 D354 | K346-E350 HydrophobicContact CG-CG 3.97Å; K346-E350 WeakPolarHBondContact O-CB 3.28Å; K346-E350 VanDerWaalsContact O-CG 3.25Å; K346-E350 WeakPolarHBondContact O-CG 2.85Å; K346-E350 PolarHBondContact O-N 3.08Å; E350-F352 PolarHBondContact O-N 3.06Å; E350-K353 CarbonylContact O-C 3.57Å; E350-K353 PolarHBondContact O-N 3.38Å; E350-D354 WeakPolarHBondContact O-CB 3.37Å; E350-D354 PolarHBondContact O-N 3.41Å |
| 351 | L | 51.1 | Low | 47.5 | Very low | 61 Ų | 61 | 85.7 Ų | 85.7 | 32% | 0.319 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.6 | -38.6 | 178.5 | -163.1 | 132.2 | 0 | 0 | 0 | 112.1 | V184 F347 M355 | V184-L351 HydrophobicContact CG2-CD2 4.27Å; F347-L351 HydrophobicContact CE1-CD1 3.96Å; F347-L351 HydrophobicContact CE2-CD1 4.09Å; F347-L351 HydrophobicContact CZ-CD1 3.53Å; F347-L351 WeakPolarHBondContact O-CB 3.28Å; F347-L351 PolarHBondContact O-N 3.44Å; L351-M355 WeakPolarHBondContact O-CB 3.39Å; L351-M355 PolarHBondContact O-N 3.26Å |
| 352 | F | 46.5 | Very low | 48.1 | Very low | 102 Ų | 102 | 83.2 Ų | 83.2 | 45% | 0.447 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -72.6 | -35 | 174.1 | -155 | -97.2 | 0 | 0 | 0 | 111.4 | L135 C348 E350 M355 L356 | L135-F352 HydrophobicContact CD2-CE2 4.32Å; C348-F352 WeakPolarHBondContact O-CB 3.49Å; C348-F352 PolarHBondContact O-N 2.96Å; E350-F352 PolarHBondContact O-N 3.06Å; F352-M355 HydrophobicContact CD2-CE 3.97Å; F352-M355 HydrophobicContact CE2-CE 4.29Å; F352-L356 HydrophobicContact CD1-CD1 3.98Å; F352-L356 HydrophobicContact CE1-CD1 3.45Å; F352-L356 VanDerWaalsContact CE1-CD1 3.45Å; F352-L356 HydrophobicContact CZ-CD1 4.2Å; F352-L356 WeakPolarHBondContact O-CA 3.25Å; F352-L356 WeakPolarHBondContact O-CB 3.44Å; F352-L356 PolarHBondContact O-N 3.44Å |
| 353 | K | 56.3 | Low | 48.2 | Very low | 118 Ų | 118 | 83.8 Ų | 83.8 | 51% | 0.513 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -70 | -43.7 | 176.7 | -175.4 | -177.6 | 177.4 | -163.9 | 0 | 110.9 | T349 E350 L356 V357 | T349-K353 WeakPolarHBondContact O-CA 3.36Å; T349-K353 WeakPolarHBondContact O-CB 3.29Å; T349-K353 PolarHBondContact O-N 3.37Å; E350-K353 CarbonylContact O-C 3.57Å; E350-K353 PolarHBondContact O-N 3.38Å; K353-L356 PolarHBondContact O-N 3.2Å; K353-V357 HydrophobicContact CG-CG2 4.09Å; K353-V357 WeakPolarHBondContact O-CA 3.24Å; K353-V357 WeakPolarHBondContact O-CB 3.29Å; K353-V357 WeakPolarHBondContact O-CG2 3.31Å; K353-V357 PolarHBondContact O-N 2.91Å |
| 354 | D | 59 | Low | 48.2 | Very low | 94 Ų | 94 | 84 Ų | 84 | 50% | 0.503 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -64.3 | -46.8 | 176.7 | -67.5 | -17.2 | 0 | 0 | 0 | 109.8 | E350 L356 V357 D358 | E350-D354 WeakPolarHBondContact O-CB 3.37Å; E350-D354 PolarHBondContact O-N 3.41Å; D354-L356 PolarHBondContact O-N 2.89Å; D354-V357 PolarHBondContact O-N 3.48Å; D354-D358 WeakPolarHBondContact O-CB 3.06Å; D354-D358 VanDerWaalsContact O-CG 3.29Å; D354-D358 PolarHBondContact O-N 3.31Å |
| 355 | M | 45.7 | Very low | 47.9 | Very low | 40 Ų | 40 | 86.8 Ų | 86.8 | 20% | 0.197 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -66.9 | -35.2 | 178.1 | -168.6 | 177 | 53.3 | 0 | 0 | 112.9 | L177 V181 L351 F352 A359 | L177-M355 HydrophobicContact CD1-SD 4.39Å; V181-M355 HydrophobicContact CG2-CE 4.07Å; V181-M355 HydrophobicContact CG2-SD 4Å; L351-M355 WeakPolarHBondContact O-CB 3.39Å; L351-M355 PolarHBondContact O-N 3.26Å; F352-M355 HydrophobicContact CD2-CE 3.97Å; F352-M355 HydrophobicContact CE2-CE 4.29Å; M355-A359 VanDerWaalsContact O-CB 3.27Å; M355-A359 WeakPolarHBondContact O-CB 3.33Å; M355-A359 PolarHBondContact O-N 3.08Å |
| 356 | L | 45.1 | Very low | 47.8 | Very low | 86 Ų | 86 | 85.9 Ų | 85.9 | 45% | 0.45 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -82.4 | -27.3 | 177.8 | -159.4 | 135.3 | 0 | 0 | 0 | 111.8 | F352 K353 D354 V360 | F352-L356 HydrophobicContact CD1-CD1 3.98Å; F352-L356 HydrophobicContact CE1-CD1 3.45Å; F352-L356 VanDerWaalsContact CE1-CD1 3.45Å; F352-L356 HydrophobicContact CZ-CD1 4.2Å; F352-L356 WeakPolarHBondContact O-CA 3.25Å; F352-L356 WeakPolarHBondContact O-CB 3.44Å; F352-L356 PolarHBondContact O-N 3.44Å; K353-L356 PolarHBondContact O-N 3.2Å; D354-L356 PolarHBondContact O-N 2.89Å; L356-V360 HydrophobicContact CD2-CG2 3.65Å; L356-V360 HydrophobicContact CG-CG2 4.05Å; L356-V360 WeakPolarHBondContact O-CA 3.47Å; L356-V360 WeakPolarHBondContact O-CB 3.45Å; L356-V360 WeakPolarHBondContact O-CG2 3.26Å; L356-V360 PolarHBondContact O-N 3.29Å |
| 357 | V | 59.3 | Low | 47.1 | Very low | 81 Ų | 81 | 87.2 Ų | 87.2 | 49% | 0.491 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -72.2 | -35.3 | 169.4 | 166.8 | 0 | 0 | 0 | 0 | 110.2 | K353 D354 G361 | K353-V357 HydrophobicContact CG-CG2 4.09Å; K353-V357 WeakPolarHBondContact O-CA 3.24Å; K353-V357 WeakPolarHBondContact O-CB 3.29Å; K353-V357 WeakPolarHBondContact O-CG2 3.31Å; K353-V357 PolarHBondContact O-N 2.91Å; D354-V357 PolarHBondContact O-N 3.48Å; V357-G361 WeakPolarHBondContact O-CA 3.44Å; V357-G361 PolarHBondContact O-N 3.44Å |
| 358 | D | 51.2 | Low | 46.3 | Very low | 108 Ų | 108 | 91 Ų | 91 | 58% | 0.578 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -69 | -42.4 | 171.5 | -73.5 | -17.4 | 0 | 0 | 0 | 110.8 | D354 V362 | D354-D358 WeakPolarHBondContact O-CB 3.06Å; D354-D358 VanDerWaalsContact O-CG 3.29Å; D354-D358 PolarHBondContact O-N 3.31Å; D358-V362 VanDerWaalsContact O-CG2 3.27Å; D358-V362 WeakPolarHBondContact O-CG2 3.33Å; D358-V362 PolarHBondContact O-N 3.05Å |
| 359 | A | 40.5 | Very low | 46.6 | Very low | 36 Ų | 36 | 93.1 Ų | 93.1 | 30% | 0.298 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -70.1 | -42.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | M355 L363 | M355-A359 VanDerWaalsContact O-CB 3.27Å; M355-A359 WeakPolarHBondContact O-CB 3.33Å; M355-A359 PolarHBondContact O-N 3.08Å; A359-L363 WeakPolarHBondContact O-CG 3.41Å; A359-L363 PolarHBondContact O-N 3.34Å |
| 360 | V | 46.1 | Very low | 46.3 | Very low | 72 Ų | 72 | 93.5 Ų | 93.5 | 44% | 0.436 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -81.7 | -34.3 | 179.5 | 174 | 0 | 0 | 0 | 0 | 111.4 | L356 V362 L363 A364 | L356-V360 HydrophobicContact CD2-CG2 3.65Å; L356-V360 HydrophobicContact CG-CG2 4.05Å; L356-V360 WeakPolarHBondContact O-CA 3.47Å; L356-V360 WeakPolarHBondContact O-CB 3.45Å; L356-V360 WeakPolarHBondContact O-CG2 3.26Å; L356-V360 PolarHBondContact O-N 3.29Å; V360-V362 PolarHBondContact O-N 2.85Å; V360-L363 CarbonylContact O-C 3.54Å; V360-L363 PolarHBondContact O-N 2.87Å; V360-L363 VanDerWaalsContact O-N 3.12Å; V360-A364 VanDerWaalsContact O-CB 3.28Å; V360-A364 WeakPolarHBondContact O-CB 3.42Å; V360-A364 PolarHBondContact O-N 3.35Å |
| 361 | G | 46.1 | Very low | 45.5 | Very low | 28 Ų | 28 | 94.7 Ų | 94.7 | 29% | 0.289 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -57.5 | -38.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | V357 A364 F365 | V357-G361 WeakPolarHBondContact O-CA 3.44Å; V357-G361 PolarHBondContact O-N 3.44Å; G361-A364 PolarHBondContact O-N 3.43Å; G361-F365 WeakPolarHBondContact O-CD2 3.44Å; G361-F365 PolarHBondContact O-N 3.43Å |
| 362 | V | 46.2 | Very low | 45.1 | Very low | 54 Ų | 54 | 96.6 Ų | 96.6 | 33% | 0.327 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -72.8 | -40 | 174.7 | 174.6 | 0 | 0 | 0 | 0 | 111.9 | I173 D358 V360 A364 F365 | I173-V362 HydrophobicContact CD1-CB 3.63Å; I173-V362 HydrophobicContact CD1-CG1 3.47Å; I173-V362 VanDerWaalsContact CD1-CG1 3.47Å; I173-V362 HydrophobicContact CD1-CG2 3.42Å; I173-V362 VanDerWaalsContact CD1-CG2 3.42Å; I173-V362 HydrophobicContact CG1-CG2 4.24Å; D358-V362 VanDerWaalsContact O-CG2 3.27Å; D358-V362 WeakPolarHBondContact O-CG2 3.33Å; D358-V362 PolarHBondContact O-N 3.05Å; V360-V362 PolarHBondContact O-N 2.85Å; V362-A364 VanDerWaalsContact C-N 3.27Å; V362-A364 PolarHBondContact O-N 3.36Å; V362-F365 PolarHBondContact O-N 3.15Å |
| 363 | L | 35.3 | Very low | 45.1 | Very low | 115 Ų | 115 | 96.3 Ų | 96.3 | 60% | 0.602 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -67.7 | -25.4 | 174.9 | -68.4 | 172.3 | 0 | 0 | 0 | 113.3 | A359 V360 | A359-L363 WeakPolarHBondContact O-CG 3.41Å; A359-L363 PolarHBondContact O-N 3.34Å; V360-L363 CarbonylContact O-C 3.54Å; V360-L363 PolarHBondContact O-N 2.87Å; V360-L363 VanDerWaalsContact O-N 3.12Å |
| 364 | A | 43.3 | Very low | 44.3 | Very low | 60 Ų | 60 | 94.9 Ų | 94.9 | 50% | 0.496 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -82 | -18.2 | 178 | 0 | 0 | 0 | 0 | 0 | 113 | V360 G361 V362 D366 | V360-A364 VanDerWaalsContact O-CB 3.28Å; V360-A364 WeakPolarHBondContact O-CB 3.42Å; V360-A364 PolarHBondContact O-N 3.35Å; G361-A364 PolarHBondContact O-N 3.43Å; V362-A364 VanDerWaalsContact C-N 3.27Å; V362-A364 PolarHBondContact O-N 3.36Å; A364-D366 VanDerWaalsContact C-N 3.32Å |
| 365 | F | 37.6 | Very low | 43.3 | Very low | 158 Ų | 158 | 94.9 Ų | 94.9 | 69% | 0.693 | 53% | 0.531 | S | S | * | . | G | 310 helix | trans | -81.5 | -9 | 173 | -89.5 | -70.7 | 0 | 0 | 0 | 113.5 | G361 V362 D367 | G361-F365 WeakPolarHBondContact O-CD2 3.44Å; G361-F365 PolarHBondContact O-N 3.43Å; V362-F365 PolarHBondContact O-N 3.15Å; F365-D367 VanDerWaalsContact C-N 3.3Å |
| 366 | D | 37.6 | Very low | 43.1 | Very low | 133 Ų | 133 | 99.2 Ų | 99.2 | 71% | 0.711 | 56% | 0.557 | S | S | * | * | G | 310 helix | trans | -81.6 | -3.5 | 174.1 | -87 | -22.7 | 0 | 0 | 0 | 113.8 | A364 | A364-D366 VanDerWaalsContact C-N 3.32Š|
| 367 | D | 35.5 | Very low | 42.9 | Very low | 157 Ų | 157 | 100.3 Ų | 100.3 | 84% | 0.84 | 57% | 0.566 | S | S | * | * | G | 310 helix | trans | -111.2 | 18.2 | 178.7 | -94.1 | -19 | 0 | 0 | 0 | 114.4 | F365 | F365-D367 VanDerWaalsContact C-N 3.3Š|
| 368 | I | 36.3 | Very low | 41.4 | Very low | 201 Ų | 201 | 102 Ų | 102 | 100% | 1.031 | 57% | 0.573 | S | S | * | * | trans | -128.1 | 0 | 169.8 | -56.7 | 178.5 | 0 | 0 | 0 | 109.3 |
Retrieved 368 of 368 residues in 469.3 ms
(Link to these results)