| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 47.8 | Very low | 46.7 | Very low | 239 Ų | 239 | 172.2 Ų | 172.2 | 100% | 1.177 | 87% | 0.868 | S | S | * | * | 0 | 96 | 0 | -78.9 | -70.8 | -169.7 | 0 | 0 | 109.6 | |||||
| 2 | P | 49.2 | Very low | 45.7 | Very low | 121 Ų | 121 | 163.3 Ų | 163.3 | 79% | 0.786 | 85% | 0.852 | S | S | * | * | trans | -119 | 133.8 | 155.4 | 33.9 | -20.9 | 0 | 0 | 0 | 109.7 | ||||
| 3 | L | 51.9 | Low | 45 | Very low | 175 Ų | 175 | 164.3 Ų | 164.3 | 92% | 0.916 | 85% | 0.85 | S | S | * | * | trans | -95.7 | 124.2 | 170.5 | -71.4 | 174.3 | 0 | 0 | 0 | 109.1 | ||||
| 4 | P | 61.1 | Low | 44.3 | Very low | 105 Ų | 105 | 159.9 Ų | 159.9 | 68% | 0.682 | 84% | 0.84 | S | S | * | * | trans | -105.2 | 148.5 | 163 | 36.1 | -27.1 | 0 | 0 | 0 | 110.1 | ||||
| 5 | R | 48.5 | Very low | 43.5 | Very low | 240 Ų | 240 | 157.9 Ų | 157.9 | 91% | 0.906 | 85% | 0.845 | S | S | * | * | trans | 174.1 | 146 | 155.6 | -98.6 | 153.7 | -174.1 | -158.7 | 2.2 | 108.5 | ||||
| 6 | R | 45.9 | Very low | 43.3 | Very low | 233 Ų | 233 | 154.6 Ų | 154.6 | 88% | 0.879 | 84% | 0.839 | S | S | * | * | cis | 179.9 | 139.8 | -23.6 | -120.4 | -177.7 | -174.8 | -107.6 | 0.9 | 102.8 | ||||
| 7 | H | 43.4 | Very low | 42.7 | Very low | 185 Ų | 185 | 156.5 Ų | 156.5 | 86% | 0.856 | 84% | 0.84 | S | S | * | * | trans | -64.2 | 152 | 167.9 | -72.9 | -93.4 | 0 | 0 | 0 | 111.8 | ||||
| 8 | S | 38.6 | Very low | 42.5 | Very low | 121 Ų | 121 | 161 Ų | 161 | 85% | 0.846 | 84% | 0.844 | S | S | * | * | trans | -150.2 | 108.6 | 148 | 61.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 9 | S | 43.8 | Very low | 42.6 | Very low | 109 Ų | 109 | 159.1 Ų | 159.1 | 76% | 0.762 | 84% | 0.841 | S | S | * | * | trans | -85.1 | 144 | 152.8 | 23.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 10 | F | 42.2 | Very low | 42.1 | Very low | 209 Ų | 209 | 156.4 Ų | 156.4 | 92% | 0.917 | 84% | 0.843 | S | S | * | * | trans | -140.5 | 134 | 164.8 | -140.8 | -92.6 | 0 | 0 | 0 | 111.3 | ||||
| 11 | L | 41 | Very low | 41.7 | Very low | 157 Ų | 157 | 153.8 Ų | 153.8 | 82% | 0.822 | 84% | 0.843 | S | S | * | * | trans | -82.2 | 165.6 | -178.1 | -83.6 | 111.7 | 0 | 0 | 0 | 113.3 | ||||
| 12 | G | 34.7 | Very low | 40.9 | Very low | 66 Ų | 66 | 147.3 Ų | 147.3 | 68% | 0.68 | 83% | 0.828 | S | S | * | * | trans | 147.2 | 93.6 | 147 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 13 | Q | 36.7 | Very low | 40.1 | Very low | 176 Ų | 176 | 146.9 Ų | 146.9 | 82% | 0.822 | 83% | 0.828 | S | S | * | * | 58.8 | 104 | 95.2 | -79.2 | -177.6 | -0.5 | 0 | 0 | 113.6 | |||||
| 14 | S | 35.5 | Very low | 39.1 | Very low | 102 Ų | 102 | 144.7 Ų | 144.7 | 71% | 0.713 | 83% | 0.827 | S | S | * | * | 72.6 | 112.4 | 80.5 | 73.8 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 15 | S | 32.8 | Very low | 37.6 | Very low | 130 Ų | 130 | 142.5 Ų | 142.5 | 91% | 0.909 | 82% | 0.823 | S | S | * | * | trans | -174.6 | 148.1 | 138.1 | 36.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 16 | S | 39.5 | Very low | 37 | Very low | 106 Ų | 106 | 142.2 Ų | 142.2 | 74% | 0.741 | 82% | 0.822 | S | S | * | * | trans | -71.1 | 152.2 | -176.3 | 162.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 17 | E | 33.8 | Very low | 36.2 | Very low | 186 Ų | 186 | 136.6 Ų | 136.6 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | 177.5 | 138.4 | 121.7 | -96.2 | 171.4 | 179.5 | 0 | 0 | 113.4 | |||||
| 18 | R | 38 | Very low | 35.7 | Very low | 238 Ų | 238 | 133 Ų | 133 | 90% | 0.898 | 81% | 0.809 | S | S | * | * | trans | -86.3 | 155.4 | 161.8 | -108.4 | 178.5 | 176.3 | 171.4 | -0.7 | 107.4 | ||||
| 19 | P | 45 | Very low | 35.3 | Very low | 124 Ų | 124 | 131.4 Ų | 131.4 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | -158.6 | 176.1 | 76.7 | 40.3 | -18.6 | 0 | 0 | 0 | 118.6 | |||||
| 20 | A | 33.2 | Very low | 35 | Very low | 105 Ų | 105 | 133 Ų | 133 | 87% | 0.868 | 81% | 0.808 | S | S | * | * | trans | 75.7 | 144.2 | 144.7 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 21 | A | 33.2 | Very low | 34.4 | Very low | 102 Ų | 102 | 126.2 Ų | 126.2 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | -90.7 | 156.5 | -166.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 22 | A | 31 | Very low | 34.1 | Very low | 104 Ų | 104 | 123 Ų | 123 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -168.8 | 164.6 | 142.5 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 23 | S | 32.4 | Very low | 34.1 | Very low | 112 Ų | 112 | 126.1 Ų | 126.1 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | trans | -97.5 | 179.3 | -153.2 | 49.9 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 24 | S | 31.6 | Very low | 34.2 | Very low | 129 Ų | 129 | 126.2 Ų | 126.2 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | trans | 81.8 | 128.5 | 162.2 | -143.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 25 | G | 28.7 | Very low | 34.9 | Very low | 58 Ų | 58 | 127.4 Ų | 127.4 | 60% | 0.598 | 81% | 0.807 | S | S | * | * | cis | 150.4 | 159.8 | 13.6 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 26 | R | 35.3 | Very low | 35.2 | Very low | 235 Ų | 235 | 133.2 Ų | 133.2 | 89% | 0.887 | 81% | 0.81 | S | S | * | * | trans | 78.6 | 144.9 | 167.6 | -57.7 | 176.3 | 65.3 | 178.4 | 1.5 | 115.7 | ||||
| 27 | T | 30.9 | Very low | 34.8 | Very low | 114 Ų | 114 | 131.5 Ų | 131.5 | 70% | 0.699 | 81% | 0.808 | S | S | * | * | cis | -175.1 | 168.1 | 0.2 | 22.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 28 | S | 32.1 | Very low | 35 | Very low | 110 Ų | 110 | 127.4 Ų | 127.4 | 77% | 0.769 | 81% | 0.806 | S | S | * | * | trans | 99.4 | 104.1 | 160.2 | 127.2 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 29 | A | 31.1 | Very low | 35.3 | Very low | 88 Ų | 88 | 121.9 Ų | 121.9 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | 86.1 | 124.4 | 84.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | |||||
| 30 | V | 35.8 | Very low | 35 | Very low | 142 Ų | 142 | 123.2 Ų | 123.2 | 86% | 0.861 | 81% | 0.807 | S | S | * | * | -157.6 | 131.9 | 71.2 | 167.3 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 31 | G | 31.3 | Very low | 35 | Very low | 67 Ų | 67 | 121.5 Ų | 121.5 | 69% | 0.691 | 80% | 0.799 | S | S | * | * | trans | -91.1 | 151.8 | 158 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 32 | A | 33.2 | Very low | 35.5 | Very low | 90 Ų | 90 | 123.1 Ų | 123.1 | 74% | 0.744 | 80% | 0.801 | S | S | * | * | 175 | 136.2 | 126.5 | 0 | 0 | 0 | 0 | 0 | 112 | |||||
| 33 | T | 34.7 | Very low | 35.4 | Very low | 131 Ų | 131 | 121.8 Ų | 121.8 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | trans | 65.3 | 110.2 | 138.4 | 40.5 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 34 | M | 40.1 | Very low | 35.3 | Very low | 177 Ų | 177 | 121.2 Ų | 121.2 | 87% | 0.872 | 80% | 0.799 | S | S | * | * | trans | -46.3 | 156.1 | 135.9 | -70.5 | -79.9 | -174 | 0 | 0 | 112.3 | ||||
| 35 | P | 49.2 | Very low | 35.4 | Very low | 127 Ų | 127 | 119.6 Ų | 119.6 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | -129.3 | 163.9 | 127.3 | 36.5 | -26.6 | 0 | 0 | 0 | 113.6 | |||||
| 36 | R | 39.3 | Very low | 35.7 | Very low | 253 Ų | 253 | 123.2 Ų | 123.2 | 96% | 0.955 | 81% | 0.808 | S | S | * | * | trans | -109.7 | 141.3 | -169.6 | -178.4 | -179 | 173.6 | 153.7 | 0.5 | 108.4 | ||||
| 37 | G | 30.7 | Very low | 35.5 | Very low | 69 Ų | 69 | 115.7 Ų | 115.7 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | trans | 172.9 | 95 | 166.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 38 | A | 37.9 | Very low | 35.9 | Very low | 101 Ų | 101 | 118.5 Ų | 118.5 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | 87.4 | 144.6 | 78 | 0 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 39 | P | 45.6 | Very low | 36.1 | Very low | 122 Ų | 122 | 116.5 Ų | 116.5 | 79% | 0.792 | 81% | 0.811 | S | S | * | * | trans | -108 | 157.6 | -145.3 | 37.8 | -27.7 | 0 | 0 | 0 | 113.5 | ||||
| 40 | V | 38.4 | Very low | 36.5 | Very low | 151 Ų | 151 | 118.8 Ų | 118.8 | 92% | 0.915 | 82% | 0.816 | S | S | * | * | trans | -123 | 102.8 | 167.2 | 178.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 41 | G | 33.1 | Very low | 36.6 | Very low | 69 Ų | 69 | 123.4 Ų | 123.4 | 71% | 0.711 | 82% | 0.818 | S | S | * | * | 66.9 | 150.5 | 120.9 | 0 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 42 | P | 43.1 | Very low | 36.8 | Very low | 137 Ų | 137 | 126.3 Ų | 126.3 | 89% | 0.89 | 82% | 0.822 | S | S | * | * | trans | -115.2 | 160.2 | -146.8 | 36.4 | -21 | 0 | 0 | 0 | 114.3 | ||||
| 43 | G | 28.8 | Very low | 36.8 | Very low | 75 Ų | 75 | 127 Ų | 127 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | 170.2 | 131.4 | 163.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 44 | A | 31.4 | Very low | 37 | Very low | 100 Ų | 100 | 132.1 Ų | 132.1 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | trans | 74.7 | 89.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 45 | A | 32.3 | Very low | 36.8 | Very low | 95 Ų | 95 | 134.4 Ų | 134.4 | 79% | 0.785 | 83% | 0.825 | S | S | * | * | 57.2 | 91.4 | 70.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 46 | C | 34.9 | Very low | 36.4 | Very low | 134 Ų | 134 | 132.8 Ų | 132.8 | 91% | 0.905 | 82% | 0.822 | S | S | * | * | trans | -164.8 | 83.8 | 139.1 | -97.8 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 47 | G | 30.7 | Very low | 36.4 | Very low | 78 Ų | 78 | 128.7 Ų | 128.7 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | -86.2 | 114.4 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 48 | L | 41.2 | Very low | 36.5 | Very low | 172 Ų | 172 | 128.6 Ų | 128.6 | 90% | 0.901 | 82% | 0.818 | S | S | * | * | trans | -108.3 | 70.6 | 158.4 | -80.1 | 164 | 0 | 0 | 0 | 107.7 | T50 | L48-T50 PolarHBondContact O-N 2.62Š| ||
| 49 | G | 35.6 | Very low | 36.6 | Very low | 68 Ų | 68 | 131.5 Ų | 131.5 | 70% | 0.701 | 82% | 0.818 | S | S | * | * | trans | -75.4 | 108.5 | 163.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | R51 | G49-R51 VanDerWaalsContact C-N 3.31Å; G49-R51 PolarHBondContact O-N 3.07Å | ||
| 50 | T | 38.3 | Very low | 36 | Very low | 137 Ų | 137 | 130.1 Ų | 130.1 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | trans | -65.6 | 89.5 | 167 | 45.7 | 0 | 0 | 0 | 0 | 109.2 | L48 V52 | L48-T50 PolarHBondContact O-N 2.62Å; T50-V52 PolarHBondContact O-N 3.19Å | ||
| 51 | R | 39.8 | Very low | 35.9 | Very low | 239 Ų | 239 | 128.5 Ų | 128.5 | 90% | 0.902 | 81% | 0.806 | S | S | * | * | trans | -76.3 | 108.7 | 163.3 | -73.9 | -169.3 | -179.3 | -149.6 | 1 | 108.2 | G49 S53 | G49-R51 VanDerWaalsContact C-N 3.31Å; G49-R51 PolarHBondContact O-N 3.07Å; R51-S53 PolarHBondContact O-N 3.26Å | ||
| 52 | V | 33.9 | Very low | 36.5 | Very low | 127 Ų | 127 | 130.9 Ų | 130.9 | 77% | 0.77 | 81% | 0.807 | S | S | * | * | trans | -60.9 | 103.2 | 166.1 | 176.2 | 0 | 0 | 0 | 0 | 108 | T50 R54 | T50-V52 PolarHBondContact O-N 3.19Å; V52-R54 PolarHBondContact O-N 3.39Å | ||
| 53 | S | 33.8 | Very low | 36.2 | Very low | 104 Ų | 104 | 133.9 Ų | 133.9 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -78.2 | 104.2 | 171 | -161.5 | 0 | 0 | 0 | 0 | 107.9 | R51 R55 | R51-S53 PolarHBondContact O-N 3.26Å; S53-R55 PolarHBondContact O-N 3.27Å | ||
| 54 | R | 38.1 | Very low | 36.6 | Very low | 240 Ų | 240 | 138.8 Ų | 138.8 | 91% | 0.906 | 81% | 0.814 | S | S | * | * | trans | -68.6 | 86.7 | 165.5 | -72.8 | -174 | -178.8 | -130.3 | 1.7 | 108.1 | V52 A56 | V52-R54 PolarHBondContact O-N 3.39Å; R54-A56 PolarHBondContact O-N 2.86Å | ||
| 55 | R | 37.3 | Very low | 37.2 | Very low | 225 Ų | 225 | 143.7 Ų | 143.7 | 85% | 0.849 | 82% | 0.819 | S | S | * | * | trans | -76.4 | 103.2 | 163.5 | -133.9 | 176.2 | -166.5 | 131.7 | 0.4 | 106.5 | S53 L57 | S53-R55 PolarHBondContact O-N 3.27Å; R55-L57 PolarHBondContact O-N 3.41Å; R55-L57 VanDerWaalsContact O-N 3.14Å | ||
| 56 | A | 39.5 | Very low | 37.2 | Very low | 93 Ų | 93 | 142.2 Ų | 142.2 | 77% | 0.769 | 81% | 0.814 | S | S | * | * | trans | -56 | 117.4 | 166 | 0 | 0 | 0 | 0 | 0 | 107.7 | R54 G58 | R54-A56 PolarHBondContact O-N 2.86Å; A56-G58 PolarHBondContact O-N 3.49Å | ||
| 57 | L | 40.4 | Very low | 37.5 | Very low | 166 Ų | 166 | 139.8 Ų | 139.8 | 87% | 0.869 | 81% | 0.811 | S | S | * | * | trans | -68.2 | 85.6 | 167.3 | -72.2 | 168.2 | 0 | 0 | 0 | 107.2 | R55 I59 | R55-L57 PolarHBondContact O-N 3.41Å; R55-L57 VanDerWaalsContact O-N 3.14Å; L57-I59 VanDerWaalsContact C-N 3.35Å; L57-I59 PolarHBondContact O-N 3.06Å; L57-I59 VanDerWaalsContact O-N 3.09Å | ||
| 58 | G | 33.3 | Very low | 37.7 | Very low | 68 Ų | 68 | 144.8 Ų | 144.8 | 70% | 0.701 | 82% | 0.816 | S | S | * | * | trans | -65.2 | 100.7 | 157.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | A56 S60 | A56-G58 PolarHBondContact O-N 3.49Å; G58-S60 PolarHBondContact O-N 3.01Å | ||
| 59 | I | 39.8 | Very low | 37.6 | Very low | 162 Ų | 162 | 147.7 Ų | 147.7 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | trans | -67.7 | 91.9 | 166.8 | -52.8 | 173.9 | 0 | 0 | 0 | 105.3 | L57 S61 | L57-I59 VanDerWaalsContact C-N 3.35Å; L57-I59 PolarHBondContact O-N 3.06Å; L57-I59 VanDerWaalsContact O-N 3.09Å; I59-S61 PolarHBondContact O-N 2.93Å | ||
| 60 | S | 32.5 | Very low | 37.7 | Very low | 92 Ų | 92 | 150.1 Ų | 150.1 | 64% | 0.643 | 82% | 0.821 | S | S | * | * | trans | -58.3 | 100.9 | 168.5 | 150.1 | 0 | 0 | 0 | 0 | 108 | G58 V62 | G58-S60 PolarHBondContact O-N 3.01Å; S60-V62 PolarHBondContact O-N 3.31Å; S60-V62 WeakPolarHBondContact OG-CG2 3.47Å | ||
| 61 | S | 36.6 | Very low | 37.5 | Very low | 117 Ų | 117 | 149.4 Ų | 149.4 | 82% | 0.818 | 82% | 0.82 | S | S | * | * | trans | -72 | 65.8 | 167.9 | 51.6 | 0 | 0 | 0 | 0 | 110.4 | I59 F63 | I59-S61 PolarHBondContact O-N 2.93Å; S61-F63 VanDerWaalsContact C-N 3.3Å; S61-F63 PolarHBondContact O-N 2.93Å | ||
| 62 | V | 44.2 | Very low | 37.4 | Very low | 120 Ų | 120 | 142.1 Ų | 142.1 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | -94.7 | 70.7 | 166.6 | -175.5 | 0 | 0 | 0 | 0 | 107.1 | S60 | S60-V62 PolarHBondContact O-N 3.31Å; S60-V62 WeakPolarHBondContact OG-CG2 3.47Å | ||
| 63 | F | 37.3 | Very low | 37.6 | Very low | 199 Ų | 199 | 139.9 Ų | 139.9 | 87% | 0.873 | 81% | 0.806 | S | S | * | * | trans | -156.1 | 67 | 163.9 | -143.5 | -91.2 | 0 | 0 | 0 | 110.5 | S61 | S61-F63 VanDerWaalsContact C-N 3.3Å; S61-F63 PolarHBondContact O-N 2.93Å | ||
| 64 | L | 38.8 | Very low | 38 | Very low | 179 Ų | 179 | 140.1 Ų | 140.1 | 94% | 0.937 | 81% | 0.805 | S | S | * | * | trans | -153.8 | 33.8 | 162.7 | -107.5 | 157.4 | 0 | 0 | 0 | 111.2 | ||||
| 65 | Q | 42.1 | Very low | 38.5 | Very low | 202 Ų | 202 | 135.1 Ų | 135.1 | 94% | 0.944 | 80% | 0.801 | S | S | * | * | trans | -115.1 | 65.2 | 169.4 | -158.9 | 144.6 | -0.1 | 0 | 0 | 108.7 | ||||
| 66 | G | 33.5 | Very low | 39 | Very low | 65 Ų | 65 | 131.8 Ų | 131.8 | 67% | 0.67 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -134 | 111.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 107.6 | M68 | G66-M68 PolarHBondContact O-N 3.07Š|
| 67 | G | 40.4 | Very low | 39.4 | Very low | 82 Ų | 82 | 131.6 Ų | 131.6 | 85% | 0.845 | 79% | 0.79 | S | S | * | * | trans | -49.8 | 114.5 | -163.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 68 | M | 36.3 | Very low | 39.6 | Very low | 184 Ų | 184 | 135.2 Ų | 135.2 | 91% | 0.906 | 79% | 0.792 | S | S | * | * | trans | -93.6 | 95.6 | 150.6 | -69.5 | -103.2 | 90.9 | 0 | 0 | 106.2 | G66 S70 | G66-M68 PolarHBondContact O-N 3.07Å; M68-S70 PolarHBondContact O-N 2.94Å | ||
| 69 | R | 38.7 | Very low | 40 | Very low | 233 Ų | 233 | 136.4 Ų | 136.4 | 88% | 0.879 | 80% | 0.795 | S | S | * | * | trans | -54.4 | 127.7 | 162.2 | -86.3 | 176.3 | 159.4 | 174.4 | -6.1 | 107.1 | C71 | R69-C71 PolarHBondContact O-N 3.31Š| ||
| 70 | S | 37 | Very low | 40.1 | Very low | 118 Ų | 118 | 133.2 Ų | 133.2 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | trans | -50.4 | 102.6 | 168.6 | -176.1 | 0 | 0 | 0 | 0 | 109.2 | M68 A72 | M68-S70 PolarHBondContact O-N 2.94Å; S70-A72 PolarHBondContact O-N 2.87Å | ||
| 71 | C | 34.2 | Very low | 40.6 | Very low | 122 Ų | 122 | 132.6 Ų | 132.6 | 82% | 0.824 | 80% | 0.801 | S | S | * | * | trans | -77.1 | 104.2 | 161.5 | -70.8 | 0 | 0 | 0 | 0 | 105.4 | R69 A73 | R69-C71 PolarHBondContact O-N 3.31Å; C71-A73 PolarHBondContact O-N 3.33Å | ||
| 72 | A | 38.4 | Very low | 41 | Very low | 86 Ų | 86 | 130.4 Ų | 130.4 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | -47.6 | 130.3 | 170.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | S70 | S70-A72 PolarHBondContact O-N 2.87Š| ||
| 73 | A | 36.8 | Very low | 40.9 | Very low | 81 Ų | 81 | 127.5 Ų | 127.5 | 67% | 0.669 | 79% | 0.792 | S | S | * | * | trans | -50 | 133.2 | 171 | 0 | 0 | 0 | 0 | 0 | 109.2 | C71 V75 | C71-A73 PolarHBondContact O-N 3.33Å; A73-V75 PolarHBondContact O-N 3.15Å | ||
| 74 | P | 42.5 | Very low | 41.9 | Very low | 109 Ų | 109 | 122.2 Ų | 122.2 | 71% | 0.708 | 79% | 0.785 | S | S | * | * | trans | -69.5 | 105.4 | 174 | 28.8 | -29.3 | 0 | 0 | 0 | 106.9 | L76 | P74-L76 PolarHBondContact O-N 3.05Š| ||
| 75 | V | 48.8 | Very low | 43 | Very low | 134 Ų | 134 | 119 Ų | 119 | 81% | 0.812 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 118.5 | 167.2 | 173.6 | 0 | 0 | 0 | 0 | 107 | A73 | A73-V75 PolarHBondContact O-N 3.15Š|
| 76 | L | 49.1 | Very low | 44.2 | Very low | 156 Ų | 156 | 111 Ų | 111 | 82% | 0.817 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 126.9 | 169.3 | -79.7 | 160.5 | 0 | 0 | 0 | 108.7 | P74 R78 | P74-L76 PolarHBondContact O-N 3.05Å; L76-R78 PolarHBondContact O-N 3.38Å; L76-R78 VanDerWaalsContact O-N 3.15Å |
| 77 | P | 46.6 | Very low | 46.1 | Very low | 89 Ų | 89 | 114 Ų | 114 | 58% | 0.578 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 120.2 | 168.8 | 26.1 | -27.7 | 0 | 0 | 0 | 107.6 | A79 | P77-A79 PolarHBondContact O-N 2.82Š|
| 78 | R | 44.7 | Very low | 47.9 | Very low | 241 Ų | 241 | 114.7 Ų | 114.7 | 91% | 0.909 | 73% | 0.728 | S | S | * | * | trans | -56.8 | 104.8 | 170.4 | -174.9 | 161.9 | 82.8 | 130 | -1.5 | 107.9 | L76 A80 | L76-R78 PolarHBondContact O-N 3.38Å; L76-R78 VanDerWaalsContact O-N 3.15Å; R78-A80 PolarHBondContact O-N 3.47Å | ||
| 79 | A | 42.3 | Very low | 50 | Low | 93 Ų | 93 | 108.7 Ų | 108.7 | 77% | 0.769 | 70% | 0.704 | S | S | * | * | trans | -63.2 | 98.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | P77 | P77-A79 PolarHBondContact O-N 2.82Š| ||
| 80 | A | 41.7 | Very low | 52.1 | Low | 95 Ų | 95 | 100.2 Ų | 100.2 | 79% | 0.785 | 68% | 0.681 | S | S | * | * | trans | -85.9 | 108.3 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108 | R78 | R78-A80 PolarHBondContact O-N 3.47Š| ||
| 81 | G | 42 | Very low | 54.5 | Low | 79 Ų | 79 | 100 Ų | 100 | 81% | 0.814 | 67% | 0.669 | S | S | * | * | S | Bend | trans | 69.8 | 112.9 | 151.7 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||
| 82 | G | 45.2 | Very low | 57.1 | Low | 72 Ų | 72 | 98.5 Ų | 98.5 | 74% | 0.742 | 65% | 0.651 | S | S | * | * | trans | 105.1 | 109.9 | 139.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 83 | G | 43.7 | Very low | 59.5 | Low | 59 Ų | 59 | 99.1 Ų | 99.1 | 61% | 0.608 | 64% | 0.64 | S | S | * | * | S | Bend | trans | 87.3 | 147.7 | 156 | 0 | 0 | 0 | 0 | 0 | 116.1 | T85 G86 | G83-T85 PolarHBondContact O-N 3.37Å; G83-G86 PolarHBondContact O-N 2.89Å |
| 84 | A | 58.3 | Low | 62.1 | Low | 88 Ų | 88 | 102.8 Ų | 102.8 | 73% | 0.727 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -53.1 | -6.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | N88 | A84-N88 WeakPolarHBondContact O-CB 3.19Å |
| 85 | T | 59.8 | Low | 64.4 | Low | 111 Ų | 111 | 104.6 Ų | 104.6 | 68% | 0.681 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -78.7 | -35.1 | 179.2 | 49.2 | 0 | 0 | 0 | 0 | 113.7 | G83 N88 S89 | G83-T85 PolarHBondContact O-N 3.37Å; T85-N88 PolarHBondContact O-N 3.41Å; T85-S89 PolarHBondContact O-N 3.27Å; T85-S89 VanDerWaalsContact O-N 3.08Å |
| 86 | G | 68.8 | Low | 66.6 | Low | 33 Ų | 33 | 102 Ų | 102 | 34% | 0.34 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -77.2 | -30.8 | -178 | 0 | 0 | 0 | 0 | 0 | 114.8 | G83 S89 C90 | G83-G86 PolarHBondContact O-N 2.89Å; G86-S89 PolarHBondContact O-OG 2.81Å; G86-C90 PolarHBondContact O-N 3.3Å; G86-C90 PolarHBondContact O-SG 3.01Å |
| 87 | L | 72.8 | Confident | 68.7 | Low | 129 Ų | 129 | 99.7 Ų | 99.7 | 68% | 0.675 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -70.8 | -36.8 | 170.1 | -75.8 | 166.6 | 0 | 0 | 0 | 111 | C90 L91 | L87-C90 PolarHBondContact O-N 3.49Å; L87-L91 WeakPolarHBondContact O-CB 3.49Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 2.92Å |
| 88 | N | 78.7 | Confident | 71 | Confident | 96 Ų | 96 | 97.5 Ų | 97.5 | 51% | 0.513 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.4 | -39.1 | 177.3 | -159.9 | 13.2 | 0 | 0 | 0 | 111.5 | A84 T85 L91 M92 | A84-N88 WeakPolarHBondContact O-CB 3.19Å; T85-N88 PolarHBondContact O-N 3.41Å; N88-L91 PolarHBondContact O-N 3.46Å; N88-M92 WeakPolarHBondContact O-CB 3.16Å; N88-M92 VanDerWaalsContact O-CG 3.24Å; N88-M92 WeakPolarHBondContact O-CG 3.41Å; N88-M92 PolarHBondContact O-N 3.31Å |
| 89 | S | 79.6 | Confident | 73.4 | Confident | 58 Ų | 58 | 90.9 Ų | 90.9 | 41% | 0.406 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.7 | -43.3 | 173.7 | 57.6 | 0 | 0 | 0 | 0 | 112.6 | T85 G86 L91 M92 E93 | T85-S89 PolarHBondContact O-N 3.27Å; T85-S89 VanDerWaalsContact O-N 3.08Å; G86-S89 PolarHBondContact O-OG 2.81Å; S89-L91 PolarHBondContact O-N 3.25Å; S89-M92 PolarHBondContact O-N 2.86Å; S89-E93 WeakPolarHBondContact O-CG 3.44Å; S89-E93 PolarHBondContact O-N 3.42Å |
| 90 | C | 83.1 | Confident | 75.9 | Confident | 56 Ų | 56 | 89 Ų | 89 | 38% | 0.378 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.5 | -38.5 | 176.3 | -69.5 | 0 | 0 | 0 | 0 | 112.8 | G86 L87 E93 Y94 | G86-C90 PolarHBondContact O-N 3.3Å; G86-C90 PolarHBondContact O-SG 3.01Å; L87-C90 PolarHBondContact O-N 3.49Å; C90-E93 PolarHBondContact O-N 2.87Å; C90-Y94 PolarHBondContact O-N 2.99Å |
| 91 | L | 88.5 | Confident | 78.4 | Confident | 112 Ų | 112 | 90 Ų | 90 | 59% | 0.586 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -67.6 | -38.3 | 175.8 | -76.7 | 171.4 | 0 | 0 | 0 | 112.2 | L87 N88 S89 Y94 R95 | L87-L91 WeakPolarHBondContact O-CB 3.49Å; L87-L91 WeakPolarHBondContact O-CG 3.45Å; L87-L91 PolarHBondContact O-N 2.92Å; N88-L91 PolarHBondContact O-N 3.46Å; S89-L91 PolarHBondContact O-N 3.25Å; L91-Y94 PolarHBondContact O-N 3.47Å; L91-R95 WeakPolarHBondContact O-CB 3.49Å; L91-R95 PolarHBondContact O-N 2.82Å |
| 92 | M | 86.8 | Confident | 80.9 | Confident | 91 Ų | 91 | 91.2 Ų | 91.2 | 45% | 0.448 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.1 | -45.2 | 174 | -72.2 | -61.1 | -64.4 | 0 | 0 | 111.3 | N88 S89 Y94 R95 D96 | N88-M92 WeakPolarHBondContact O-CB 3.16Å; N88-M92 VanDerWaalsContact O-CG 3.24Å; N88-M92 WeakPolarHBondContact O-CG 3.41Å; N88-M92 PolarHBondContact O-N 3.31Å; S89-M92 PolarHBondContact O-N 2.86Å; M92-Y94 VanDerWaalsContact C-N 3.33Å; M92-Y94 PolarHBondContact O-N 2.78Å; M92-R95 PolarHBondContact O-N 3.34Å; M92-D96 PolarHBondContact O-N 2.9Å |
| 93 | E | 89 | Confident | 83.4 | Confident | 99 Ų | 99 | 93.2 Ų | 93.2 | 46% | 0.463 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.8 | -39 | 174.4 | -73.7 | 178.6 | -161.8 | 0 | 0 | 112.9 | S89 C90 K97 | S89-E93 WeakPolarHBondContact O-CG 3.44Å; S89-E93 PolarHBondContact O-N 3.42Å; C90-E93 PolarHBondContact O-N 2.87Å; E93-K97 VanDerWaalsContact O-CG 3.31Å; E93-K97 WeakPolarHBondContact O-CG 3.45Å; E93-K97 PolarHBondContact O-N 3.44Å |
| 94 | Y | 92.2 | Very high | 85.8 | Confident | 158 Ų | 158 | 94.8 Ų | 94.8 | 62% | 0.62 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.5 | -43.2 | 174.5 | -179.2 | -100.9 | 0 | 0 | 0 | 111.3 | C90 L91 M92 D96 K97 V98 | C90-Y94 PolarHBondContact O-N 2.99Å; L91-Y94 PolarHBondContact O-N 3.47Å; M92-Y94 VanDerWaalsContact C-N 3.33Å; M92-Y94 PolarHBondContact O-N 2.78Å; Y94-D96 VanDerWaalsContact C-N 3.32Å; Y94-D96 PolarHBondContact O-N 3.36Å; Y94-K97 PolarHBondContact O-N 3.18Å; Y94-V98 HydrophobicContact CD1-CG2 4.09Å; Y94-V98 HydrophobicContact CE1-CG2 3.69Å; Y94-V98 HydrophobicContact CE2-CG2 4.32Å; Y94-V98 WeakPolarHBondContact O-CG2 3.26Å; Y94-V98 PolarHBondContact O-N 3.16Å |
| 95 | R | 91.4 | Very high | 87.6 | Confident | 147 Ų | 147 | 94.8 Ų | 94.8 | 56% | 0.555 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.7 | -38.4 | 177.6 | -168.3 | 177.7 | -179.9 | 114.4 | 3.4 | 112.1 | L91 M92 V98 R99 | L91-R95 WeakPolarHBondContact O-CB 3.49Å; L91-R95 PolarHBondContact O-N 2.82Å; M92-R95 PolarHBondContact O-N 3.34Å; R95-V98 PolarHBondContact O-N 3.46Å; R95-R99 WeakPolarHBondContact O-CG 3.37Å; R95-R99 PolarHBondContact O-N 2.96Å |
| 96 | D | 93.6 | Very high | 89.3 | Confident | 80 Ų | 80 | 94.7 Ų | 94.7 | 43% | 0.428 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -72.2 | -34.6 | 176.8 | -67.5 | -23.3 | 0 | 0 | 0 | 112 | M92 Y94 R99 A100 | M92-D96 PolarHBondContact O-N 2.9Å; Y94-D96 VanDerWaalsContact C-N 3.32Å; Y94-D96 PolarHBondContact O-N 3.36Å; D96-R99 PolarHBondContact O-N 2.88Å; D96-R99 IonicContact OD1-NH1 2.97Å; D96-R99 PolarHBondContact OD1-NH1 2.86Å; D96-A100 WeakPolarHBondContact O-CB 3.22Å; D96-A100 PolarHBondContact O-N 3.22Å |
| 97 | K | 94 | Very high | 90.7 | Very high | 107 Ų | 107 | 98.5 Ų | 98.5 | 47% | 0.465 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 169.9 | -74.8 | 168.6 | -175.6 | 165.4 | 0 | 112.1 | E93 Y94 A100 L101 | E93-K97 VanDerWaalsContact O-CG 3.31Å; E93-K97 WeakPolarHBondContact O-CG 3.45Å; E93-K97 PolarHBondContact O-N 3.44Å; Y94-K97 PolarHBondContact O-N 3.18Å; K97-A100 PolarHBondContact O-N 3.44Å; K97-L101 WeakPolarHBondContact O-CB 3.35Å; K97-L101 VanDerWaalsContact O-CG 3.31Å; K97-L101 WeakPolarHBondContact O-CG 3.38Å; K97-L101 PolarHBondContact O-N 2.89Å |
| 98 | V | 95.3 | Very high | 91.8 | Very high | 44 Ų | 44 | 96.2 Ų | 96.2 | 27% | 0.267 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.5 | -46.1 | 175.8 | 171.4 | 0 | 0 | 0 | 0 | 110.3 | Y94 R95 A100 L101 E102 | Y94-V98 HydrophobicContact CD1-CG2 4.09Å; Y94-V98 HydrophobicContact CE1-CG2 3.69Å; Y94-V98 HydrophobicContact CE2-CG2 4.32Å; Y94-V98 WeakPolarHBondContact O-CG2 3.26Å; Y94-V98 PolarHBondContact O-N 3.16Å; R95-V98 PolarHBondContact O-N 3.46Å; V98-A100 PolarHBondContact O-N 2.86Å; V98-L101 PolarHBondContact O-N 3.35Å; V98-E102 HydrophobicContact CG1-CG 4.32Å; V98-E102 WeakPolarHBondContact CG1-OE1 3.47Å; V98-E102 WeakPolarHBondContact O-CB 3.44Å; V98-E102 VanDerWaalsContact O-CG 3.29Å; V98-E102 WeakPolarHBondContact O-CG 3.38Å; V98-E102 PolarHBondContact O-N 3.04Å |
| 99 | R | 94.8 | Very high | 92.5 | Very high | 102 Ų | 102 | 95.5 Ų | 95.5 | 39% | 0.385 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.4 | -45.1 | 174.8 | -73.4 | 169.6 | 177.2 | 159 | -8.4 | 112.7 | R95 D96 L101 E102 E103 | R95-R99 WeakPolarHBondContact O-CG 3.37Å; R95-R99 PolarHBondContact O-N 2.96Å; D96-R99 PolarHBondContact O-N 2.88Å; D96-R99 IonicContact OD1-NH1 2.97Å; D96-R99 PolarHBondContact OD1-NH1 2.86Å; R99-L101 VanDerWaalsContact C-N 3.31Å; R99-L101 PolarHBondContact O-N 3.12Å; R99-E102 PolarHBondContact O-N 3.41Å; R99-E103 WeakPolarHBondContact O-CB 3.44Å; R99-E103 WeakPolarHBondContact O-CG 3.32Å; R99-E103 PolarHBondContact O-N 2.9Å |
| 100 | A | 95 | Very high | 93.3 | Very high | 54 Ų | 54 | 98.1 Ų | 98.1 | 45% | 0.446 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.4 | -37.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | D96 K97 V98 L104 | D96-A100 WeakPolarHBondContact O-CB 3.22Å; D96-A100 PolarHBondContact O-N 3.22Å; K97-A100 PolarHBondContact O-N 3.44Å; V98-A100 PolarHBondContact O-N 2.86Å; A100-L104 VanDerWaalsContact O-CB 3.27Å; A100-L104 WeakPolarHBondContact O-CB 3.46Å; A100-L104 PolarHBondContact O-N 3.49Å |
| 101 | L | 94.8 | Very high | 94 | Very high | 116 Ų | 116 | 101.3 Ų | 101.3 | 61% | 0.607 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -70.1 | -38.3 | 173.8 | -73.3 | 173 | 0 | 0 | 0 | 112.1 | K97 V98 R99 L104 N105 | K97-L101 WeakPolarHBondContact O-CB 3.35Å; K97-L101 VanDerWaalsContact O-CG 3.31Å; K97-L101 WeakPolarHBondContact O-CG 3.38Å; K97-L101 PolarHBondContact O-N 2.89Å; V98-L101 PolarHBondContact O-N 3.35Å; R99-L101 VanDerWaalsContact C-N 3.31Å; R99-L101 PolarHBondContact O-N 3.12Å; L101-L104 PolarHBondContact O-N 3.25Å; L101-N105 WeakPolarHBondContact O-CB 3.31Å; L101-N105 PolarHBondContact O-N 2.91Å |
| 102 | E | 94.4 | Very high | 94.3 | Very high | 103 Ų | 103 | 100.6 Ų | 100.6 | 48% | 0.481 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63 | -45.4 | 174.2 | -74.5 | 169.8 | 175 | 0 | 0 | 111.2 | V98 R99 N105 Q106 | V98-E102 HydrophobicContact CG1-CG 4.32Å; V98-E102 WeakPolarHBondContact CG1-OE1 3.47Å; V98-E102 WeakPolarHBondContact O-CB 3.44Å; V98-E102 VanDerWaalsContact O-CG 3.29Å; V98-E102 WeakPolarHBondContact O-CG 3.38Å; V98-E102 PolarHBondContact O-N 3.04Å; R99-E102 PolarHBondContact O-N 3.41Å; E102-N105 PolarHBondContact O-N 2.99Å; E102-Q106 WeakPolarHBondContact O-CB 3.25Å; E102-Q106 VanDerWaalsContact O-CG 3.22Å; E102-Q106 WeakPolarHBondContact O-CG 3.46Å; E102-Q106 PolarHBondContact O-N 2.98Å |
| 103 | E | 95.9 | Very high | 94.7 | Very high | 115 Ų | 115 | 103.3 Ų | 103.3 | 54% | 0.537 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.5 | -44.5 | 175.5 | -73.3 | 173.3 | -170.3 | 0 | 0 | 111.7 | R99 Q106 Q107 | R99-E103 WeakPolarHBondContact O-CB 3.44Å; R99-E103 WeakPolarHBondContact O-CG 3.32Å; R99-E103 PolarHBondContact O-N 2.9Å; E103-Q106 PolarHBondContact O-N 2.94Å; E103-Q107 VanDerWaalsContact O-CG 3.31Å; E103-Q107 WeakPolarHBondContact O-CG 3.45Å; E103-Q107 PolarHBondContact O-N 3.15Å |
| 104 | L | 95.9 | Very high | 94.9 | Very high | 91 Ų | 91 | 102.8 Ų | 102.8 | 48% | 0.476 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -67.3 | -38 | 177.9 | -170.9 | 142 | 0 | 0 | 0 | 111.6 | A100 L101 Q107 L108 | A100-L104 VanDerWaalsContact O-CB 3.27Å; A100-L104 WeakPolarHBondContact O-CB 3.46Å; A100-L104 PolarHBondContact O-N 3.49Å; L101-L104 PolarHBondContact O-N 3.25Å; L104-Q107 PolarHBondContact O-N 3.34Å; L104-L108 HydrophobicContact CD2-CD1 3.58Å; L104-L108 HydrophobicContact CD2-CG 4.11Å; L104-L108 WeakPolarHBondContact O-CG 3.47Å; L104-L108 PolarHBondContact O-N 3.29Å |
| 105 | N | 95.1 | Very high | 94.9 | Very high | 89 Ų | 89 | 97.3 Ų | 97.3 | 48% | 0.476 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -66.3 | -42.7 | 175.7 | -163.1 | 1.9 | 0 | 0 | 0 | 111 | L101 E102 Q107 L108 E109 | L101-N105 WeakPolarHBondContact O-CB 3.31Å; L101-N105 PolarHBondContact O-N 2.91Å; E102-N105 PolarHBondContact O-N 2.99Å; N105-Q107 VanDerWaalsContact C-N 3.3Å; N105-Q107 PolarHBondContact O-N 3.06Å; N105-L108 PolarHBondContact O-N 2.96Å; N105-E109 WeakPolarHBondContact O-CB 3.47Å; N105-E109 WeakPolarHBondContact O-CG 3.4Å; N105-E109 PolarHBondContact O-N 3.08Å |
| 106 | Q | 96.5 | Very high | 94.8 | Very high | 109 Ų | 109 | 95 Ų | 95 | 51% | 0.509 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -59.3 | -40.8 | 172.9 | -72.9 | 170 | 27.8 | 0 | 0 | 112.1 | E102 E103 E109 Q110 | E102-Q106 WeakPolarHBondContact O-CB 3.25Å; E102-Q106 VanDerWaalsContact O-CG 3.22Å; E102-Q106 WeakPolarHBondContact O-CG 3.46Å; E102-Q106 PolarHBondContact O-N 2.98Å; E103-Q106 PolarHBondContact O-N 2.94Å; Q106-E109 PolarHBondContact O-N 3.48Å; Q106-Q110 VanDerWaalsContact O-CG 3.25Å; Q106-Q110 WeakPolarHBondContact O-CG 2.87Å; Q106-Q110 PolarHBondContact O-N 3.48Å |
| 107 | Q | 96.9 | Very high | 94.6 | Very high | 113 Ų | 113 | 96.2 Ų | 96.2 | 53% | 0.528 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.1 | -43.3 | 175 | -71.8 | 173 | 16 | 0 | 0 | 112 | E103 L104 N105 Q110 Q111 | E103-Q107 VanDerWaalsContact O-CG 3.31Å; E103-Q107 WeakPolarHBondContact O-CG 3.45Å; E103-Q107 PolarHBondContact O-N 3.15Å; L104-Q107 PolarHBondContact O-N 3.34Å; N105-Q107 VanDerWaalsContact C-N 3.3Å; N105-Q107 PolarHBondContact O-N 3.06Å; Q107-Q110 PolarHBondContact O-N 3.21Å; Q107-Q111 WeakPolarHBondContact O-CG 3.4Å; Q107-Q111 PolarHBondContact O-N 3.48Å |
| 108 | L | 95.5 | Very high | 94.2 | Very high | 80 Ų | 80 | 99.6 Ų | 99.6 | 42% | 0.419 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.7 | -42.9 | 176 | -73.5 | 176.8 | 0 | 0 | 0 | 111.7 | L104 N105 Q110 Q111 I112 | L104-L108 HydrophobicContact CD2-CD1 3.58Å; L104-L108 HydrophobicContact CD2-CG 4.11Å; L104-L108 WeakPolarHBondContact O-CG 3.47Å; L104-L108 PolarHBondContact O-N 3.29Å; N105-L108 PolarHBondContact O-N 2.96Å; L108-Q110 VanDerWaalsContact C-N 3.32Å; L108-Q110 PolarHBondContact O-N 3Å; L108-Q111 PolarHBondContact O-N 2.93Å; L108-I112 VanDerWaalsContact O-CG1 3.27Å; L108-I112 WeakPolarHBondContact O-CG1 3.5Å; L108-I112 PolarHBondContact O-N 3.43Å |
| 109 | E | 94.9 | Very high | 93.7 | Very high | 82 Ų | 82 | 104.1 Ų | 104.1 | 38% | 0.383 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.5 | -42.8 | 174.7 | -75.8 | -176 | -168.1 | 0 | 0 | 111.8 | N105 Q106 I112 R113 | N105-E109 WeakPolarHBondContact O-CB 3.47Å; N105-E109 WeakPolarHBondContact O-CG 3.4Å; N105-E109 PolarHBondContact O-N 3.08Å; Q106-E109 PolarHBondContact O-N 3.48Å; E109-I112 PolarHBondContact O-N 3.41Å; E109-R113 VanDerWaalsContact O-CG 3.3Å; E109-R113 WeakPolarHBondContact O-CG 3.3Å; E109-R113 PolarHBondContact O-N 2.91Å; E109-R113 IonicContact OE2-NH2 3.32Å; E109-R113 PolarHBondContact OE2-NH2 2.9Å |
| 110 | Q | 96.7 | Very high | 93 | Very high | 112 Ų | 112 | 102.4 Ų | 102.4 | 52% | 0.523 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 175.4 | -72.1 | 171.8 | 26 | 0 | 0 | 111.6 | Q106 Q107 L108 I112 R113 L114 | Q106-Q110 VanDerWaalsContact O-CG 3.25Å; Q106-Q110 WeakPolarHBondContact O-CG 2.87Å; Q106-Q110 PolarHBondContact O-N 3.48Å; Q107-Q110 PolarHBondContact O-N 3.21Å; L108-Q110 VanDerWaalsContact C-N 3.32Å; L108-Q110 PolarHBondContact O-N 3Å; Q110-I112 VanDerWaalsContact C-N 3.35Å; Q110-I112 PolarHBondContact O-N 3Å; Q110-R113 PolarHBondContact O-N 2.85Å; Q110-L114 WeakPolarHBondContact O-CB 3.45Å; Q110-L114 VanDerWaalsContact O-CG 3.3Å; Q110-L114 WeakPolarHBondContact O-CG 3.49Å; Q110-L114 PolarHBondContact O-N 3.16Å |
| 111 | Q | 96.1 | Very high | 92.1 | Very high | 123 Ų | 123 | 103.4 Ų | 103.4 | 58% | 0.575 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.3 | -40.2 | 175.9 | -73.6 | -178.4 | -7.4 | 0 | 0 | 112.2 | Q107 L108 S115 | Q107-Q111 WeakPolarHBondContact O-CG 3.4Å; Q107-Q111 PolarHBondContact O-N 3.48Å; L108-Q111 PolarHBondContact O-N 2.93Å; Q111-S115 WeakPolarHBondContact O-CB 3.47Å; Q111-S115 PolarHBondContact O-N 3.1Å |
| 112 | I | 95 | Very high | 91.2 | Very high | 97 Ų | 97 | 101.1 Ų | 101.1 | 50% | 0.497 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.4 | -50 | 175.1 | -70.2 | 166.2 | 0 | 0 | 0 | 109.8 | L108 E109 Q110 L114 S115 L116 | L108-I112 VanDerWaalsContact O-CG1 3.27Å; L108-I112 WeakPolarHBondContact O-CG1 3.5Å; L108-I112 PolarHBondContact O-N 3.43Å; E109-I112 PolarHBondContact O-N 3.41Å; Q110-I112 VanDerWaalsContact C-N 3.35Å; Q110-I112 PolarHBondContact O-N 3Å; I112-L114 PolarHBondContact O-N 3.23Å; I112-S115 PolarHBondContact O-N 2.91Å; I112-S115 VanDerWaalsContact O-N 3.11Å; I112-S115 PolarHBondContact O-OG 3.32Å; I112-L116 HydrophobicContact CG2-CD1 3.88Å; I112-L116 HydrophobicContact CG2-CG 4.32Å; I112-L116 WeakPolarHBondContact O-CG 3.45Å; I112-L116 PolarHBondContact O-N 3.35Å |
| 113 | R | 94.7 | Very high | 90.3 | Very high | 149 Ų | 149 | 99 Ų | 99 | 56% | 0.562 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -56.7 | -49.9 | 178.1 | -71.6 | 175.7 | -164.2 | 172.1 | 10.7 | 111.7 | E109 Q110 S115 L116 D117 | E109-R113 VanDerWaalsContact O-CG 3.3Å; E109-R113 WeakPolarHBondContact O-CG 3.3Å; E109-R113 PolarHBondContact O-N 2.91Å; E109-R113 IonicContact OE2-NH2 3.32Å; E109-R113 PolarHBondContact OE2-NH2 2.9Å; Q110-R113 PolarHBondContact O-N 2.85Å; R113-S115 VanDerWaalsContact C-N 3.28Å; R113-S115 PolarHBondContact O-N 3.42Å; R113-L116 PolarHBondContact O-N 3.35Å; R113-L116 VanDerWaalsContact O-N 3.1Å; R113-D117 VanDerWaalsContact O-CG 3.28Å; R113-D117 PolarHBondContact O-N 2.85Å |
| 114 | L | 94.6 | Very high | 89.2 | Confident | 88 Ų | 88 | 96.1 Ų | 96.1 | 46% | 0.461 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.5 | -37 | 176.6 | -69.5 | 173 | 0 | 0 | 0 | 112.8 | Q110 I112 R118 | Q110-L114 WeakPolarHBondContact O-CB 3.45Å; Q110-L114 VanDerWaalsContact O-CG 3.3Å; Q110-L114 WeakPolarHBondContact O-CG 3.49Å; Q110-L114 PolarHBondContact O-N 3.16Å; I112-L114 PolarHBondContact O-N 3.23Å; L114-R118 WeakPolarHBondContact O-CB 3.5Å; L114-R118 WeakPolarHBondContact O-CD 3.42Å; L114-R118 WeakPolarHBondContact O-CG 3.26Å; L114-R118 PolarHBondContact O-N 2.92Å |
| 115 | S | 91.8 | Very high | 88.3 | Confident | 43 Ų | 43 | 94.9 Ų | 94.9 | 30% | 0.301 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68.1 | -36.7 | 176.6 | 80.8 | 0 | 0 | 0 | 0 | 112.3 | Q111 I112 R113 K119 | Q111-S115 WeakPolarHBondContact O-CB 3.47Å; Q111-S115 PolarHBondContact O-N 3.1Å; I112-S115 PolarHBondContact O-N 2.91Å; I112-S115 VanDerWaalsContact O-N 3.11Å; I112-S115 PolarHBondContact O-OG 3.32Å; R113-S115 VanDerWaalsContact C-N 3.28Å; R113-S115 PolarHBondContact O-N 3.42Å; S115-K119 VanDerWaalsContact O-CG 3.27Å; S115-K119 WeakPolarHBondContact O-CG 3.26Å; S115-K119 PolarHBondContact O-N 3.3Å; S115-K119 VanDerWaalsContact O-N 3.13Å |
| 116 | L | 89.9 | Confident | 87.6 | Confident | 99 Ų | 99 | 98.8 Ų | 98.8 | 52% | 0.518 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -71.5 | -43 | 177 | -69 | 174.7 | 0 | 0 | 0 | 110.9 | I112 R113 R118 K119 A120 | I112-L116 HydrophobicContact CG2-CD1 3.88Å; I112-L116 HydrophobicContact CG2-CG 4.32Å; I112-L116 WeakPolarHBondContact O-CG 3.45Å; I112-L116 PolarHBondContact O-N 3.35Å; R113-L116 PolarHBondContact O-N 3.35Å; R113-L116 VanDerWaalsContact O-N 3.1Å; L116-R118 PolarHBondContact O-N 3.44Å; L116-K119 PolarHBondContact O-N 2.83Å; L116-K119 VanDerWaalsContact O-N 3.16Å; L116-A120 WeakPolarHBondContact O-CB 3.42Å; L116-A120 PolarHBondContact O-N 2.92Å |
| 117 | D | 88.7 | Confident | 87.1 | Confident | 104 Ų | 104 | 94.8 Ų | 94.8 | 56% | 0.556 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.1 | -42 | 177.2 | -67.2 | -22 | 0 | 0 | 0 | 111.6 | R113 K119 A120 A121 | R113-D117 VanDerWaalsContact O-CG 3.28Å; R113-D117 PolarHBondContact O-N 2.85Å; D117-K119 VanDerWaalsContact C-N 3.34Å; D117-K119 PolarHBondContact O-N 2.88Å; D117-A120 PolarHBondContact O-N 3Å; D117-A121 WeakPolarHBondContact O-CB 3.46Å; D117-A121 PolarHBondContact O-N 2.98Å |
| 118 | R | 86.4 | Confident | 86.7 | Confident | 179 Ų | 179 | 92.2 Ų | 92.2 | 68% | 0.675 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61 | -41.8 | 173.4 | -74.1 | 171.3 | -171.6 | 155.3 | 3.4 | 111.9 | L114 L116 S122 | L114-R118 WeakPolarHBondContact O-CB 3.5Å; L114-R118 WeakPolarHBondContact O-CD 3.42Å; L114-R118 WeakPolarHBondContact O-CG 3.26Å; L114-R118 PolarHBondContact O-N 2.92Å; L116-R118 PolarHBondContact O-N 3.44Å; R118-S122 PolarHBondContact O-N 3.4Å; R118-S122 PolarHBondContact O-OG 3.39Å |
| 119 | K | 83.9 | Confident | 86.4 | Confident | 138 Ų | 138 | 91.5 Ų | 91.5 | 60% | 0.6 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.7 | -42.8 | 176.6 | -75.3 | 173.6 | -179 | 179 | 0 | 111.5 | S115 L116 D117 S122 A123 | S115-K119 VanDerWaalsContact O-CG 3.27Å; S115-K119 WeakPolarHBondContact O-CG 3.26Å; S115-K119 PolarHBondContact O-N 3.3Å; S115-K119 VanDerWaalsContact O-N 3.13Å; L116-K119 PolarHBondContact O-N 2.83Å; L116-K119 VanDerWaalsContact O-N 3.16Å; D117-K119 VanDerWaalsContact C-N 3.34Å; D117-K119 PolarHBondContact O-N 2.88Å; K119-S122 WeakPolarHBondContact CA-OG 3.28Å; K119-S122 PolarHBondContact O-N 2.98Å; K119-S122 PolarHBondContact O-OG 3.39Å; K119-A123 PolarHBondContact O-N 2.85Å |
| 120 | A | 79.6 | Confident | 86.2 | Confident | 66 Ų | 66 | 95.4 Ų | 95.4 | 55% | 0.545 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63 | -43.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | L116 D117 S122 A123 G124 | L116-A120 WeakPolarHBondContact O-CB 3.42Å; L116-A120 PolarHBondContact O-N 2.92Å; D117-A120 PolarHBondContact O-N 3Å; A120-S122 VanDerWaalsContact C-N 3.34Å; A120-S122 PolarHBondContact O-N 3.12Å; A120-A123 WeakPolarHBondContact O-CB 3.48Å; A120-A123 PolarHBondContact O-N 3.26Å; A120-G124 PolarHBondContact O-N 2.84Å |
| 121 | A | 77.6 | Confident | 86.1 | Confident | 76 Ų | 76 | 97.7 Ų | 97.7 | 63% | 0.628 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.1 | -40.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | D117 A123 G124 | D117-A121 WeakPolarHBondContact O-CB 3.46Å; D117-A121 PolarHBondContact O-N 2.98Å; A121-A123 VanDerWaalsContact C-N 3.31Å; A121-A123 PolarHBondContact O-N 2.71Å; A121-G124 PolarHBondContact O-N 2.98Å |
| 122 | S | 75.9 | Confident | 86 | Confident | 68 Ų | 68 | 97.3 Ų | 97.3 | 48% | 0.476 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -68 | -28.1 | 175.6 | 73.6 | 0 | 0 | 0 | 0 | 113.5 | R118 K119 A120 G124 A125 | R118-S122 PolarHBondContact O-N 3.4Å; R118-S122 PolarHBondContact O-OG 3.39Å; K119-S122 WeakPolarHBondContact CA-OG 3.28Å; K119-S122 PolarHBondContact O-N 2.98Å; K119-S122 PolarHBondContact O-OG 3.39Å; A120-S122 VanDerWaalsContact C-N 3.34Å; A120-S122 PolarHBondContact O-N 3.12Å; S122-G124 VanDerWaalsContact C-N 3.33Å; S122-G124 PolarHBondContact O-N 2.98Å; S122-A125 WeakPolarHBondContact O-CB 3.29Å; S122-A125 PolarHBondContact O-N 3.46Å |
| 123 | A | 73.8 | Confident | 86 | Confident | 58 Ų | 58 | 99.4 Ų | 99.4 | 48% | 0.479 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69.3 | -30.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | K119 A120 A121 A125 W126 | K119-A123 PolarHBondContact O-N 2.85Å; A120-A123 WeakPolarHBondContact O-CB 3.48Å; A120-A123 PolarHBondContact O-N 3.26Å; A121-A123 VanDerWaalsContact C-N 3.31Å; A121-A123 PolarHBondContact O-N 2.71Å; A123-A125 PolarHBondContact O-N 2.87Å; A123-W126 PolarHBondContact O-N 2.69Å |
| 124 | G | 73.8 | Confident | 86.1 | Confident | 55 Ų | 55 | 97.5 Ų | 97.5 | 57% | 0.567 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.1 | -21.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | A120 A121 S122 W126 G127 | A120-G124 PolarHBondContact O-N 2.84Å; A121-G124 PolarHBondContact O-N 2.98Å; S122-G124 VanDerWaalsContact C-N 3.33Å; S122-G124 PolarHBondContact O-N 2.98Å; G124-W126 VanDerWaalsContact C-N 3.25Å; G124-W126 PolarHBondContact O-N 2.89Å; G124-G127 PolarHBondContact O-N 3.41Å |
| 125 | A | 76.5 | Confident | 86.2 | Confident | 65 Ų | 65 | 96.7 Ų | 96.7 | 54% | 0.537 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | -15.6 | -180 | 0 | 0 | 0 | 0 | 0 | 113.9 | S122 A123 P128 | S122-A125 WeakPolarHBondContact O-CB 3.29Å; S122-A125 PolarHBondContact O-N 3.46Å; A123-A125 PolarHBondContact O-N 2.87Å; A125-P128 WeakPolarHBondContact O-CD 3.23Å; A125-P128 WeakPolarHBondContact O-CG 3.35Å |
| 126 | W | 80.2 | Confident | 86.5 | Confident | 170 Ų | 170 | 99 Ų | 99 | 64% | 0.644 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -78.8 | -20 | 178.4 | -65.6 | 101 | 0 | 0 | 0 | 114 | A123 G124 L129 R130 | A123-W126 PolarHBondContact O-N 2.69Å; G124-W126 VanDerWaalsContact C-N 3.25Å; G124-W126 PolarHBondContact O-N 2.89Å; W126-L129 HydrophobicContact CE3-CD2 3.88Å; W126-L129 HydrophobicContact CZ3-CD2 3.8Å; W126-R130 VanDerWaalsContact O-CB 3.3Å; W126-R130 WeakPolarHBondContact O-CB 3.49Å; W126-R130 PolarHBondContact O-N 3.15Å |
| 127 | G | 87.3 | Confident | 86.9 | Confident | 26 Ų | 26 | 101.7 Ų | 101.7 | 27% | 0.268 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59 | -54.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | G124 R130 R131 | G124-G127 PolarHBondContact O-N 3.41Å; G127-R130 PolarHBondContact O-N 3.48Å; G127-R131 WeakPolarHBondContact O-CG 3.44Å; G127-R131 PolarHBondContact O-N 3.18Å; G127-R131 VanDerWaalsContact O-N 3.16Å |
| 128 | P | 88.8 | Confident | 87.3 | Confident | 58 Ų | 58 | 102.1 Ų | 102.1 | 38% | 0.377 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -43.5 | 177.8 | 22.5 | -32.5 | 0 | 0 | 0 | 112.4 | A125 R130 R131 E132 | A125-P128 WeakPolarHBondContact O-CD 3.23Å; A125-P128 WeakPolarHBondContact O-CG 3.35Å; P128-R130 VanDerWaalsContact C-N 3.31Å; P128-R130 PolarHBondContact O-N 3.44Å; P128-R131 PolarHBondContact O-N 3.39Å; P128-R131 VanDerWaalsContact O-N 3.09Å; P128-E132 PolarHBondContact O-N 3.45Å |
| 129 | L | 88.4 | Confident | 87.9 | Confident | 66 Ų | 66 | 98.9 Ų | 98.9 | 35% | 0.346 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.9 | -42.8 | 176.7 | -177.1 | 61.8 | 0 | 0 | 0 | 111.4 | W126 R131 E132 W133 | W126-L129 HydrophobicContact CE3-CD2 3.88Å; W126-L129 HydrophobicContact CZ3-CD2 3.8Å; L129-R131 VanDerWaalsContact C-N 3.34Å; L129-R131 PolarHBondContact O-N 2.99Å; L129-E132 PolarHBondContact O-N 2.94Å; L129-W133 PolarHBondContact O-N 2.85Å |
| 130 | R | 90.4 | Very high | 88.6 | Confident | 163 Ų | 163 | 95.9 Ų | 95.9 | 62% | 0.615 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58.7 | -43.5 | 175 | 174.3 | -179.7 | -62.6 | -79.3 | -2.1 | 112.3 | W126 G127 P128 W133 E134 | W126-R130 VanDerWaalsContact O-CB 3.3Å; W126-R130 WeakPolarHBondContact O-CB 3.49Å; W126-R130 PolarHBondContact O-N 3.15Å; G127-R130 PolarHBondContact O-N 3.48Å; P128-R130 VanDerWaalsContact C-N 3.31Å; P128-R130 PolarHBondContact O-N 3.44Å; R130-W133 PolarHBondContact O-N 2.94Å; R130-E134 WeakPolarHBondContact CD-OE1 3.42Å; R130-E134 HydrophobicContact CG-CG 4.49Å; R130-E134 WeakPolarHBondContact CG-OE1 3.34Å; R130-E134 WeakPolarHBondContact O-CG 2.91Å; R130-E134 PolarHBondContact O-N 2.88Å |
| 131 | R | 94.1 | Very high | 89.4 | Confident | 160 Ų | 160 | 95.4 Ų | 95.4 | 60% | 0.604 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.2 | -42.2 | 178.4 | -66.5 | 178 | -162.5 | 127.6 | 0.6 | 111.7 | G127 P128 L129 W133 E134 D135 | G127-R131 WeakPolarHBondContact O-CG 3.44Å; G127-R131 PolarHBondContact O-N 3.18Å; G127-R131 VanDerWaalsContact O-N 3.16Å; P128-R131 PolarHBondContact O-N 3.39Å; P128-R131 VanDerWaalsContact O-N 3.09Å; L129-R131 VanDerWaalsContact C-N 3.34Å; L129-R131 PolarHBondContact O-N 2.99Å; R131-W133 VanDerWaalsContact C-N 3.32Å; R131-W133 PolarHBondContact O-N 2.89Å; R131-E134 PolarHBondContact O-N 3.09Å; R131-D135 WeakPolarHBondContact O-CB 3.39Å; R131-D135 PolarHBondContact O-N 2.85Å |
| 132 | E | 95.1 | Very high | 90.4 | Very high | 116 Ų | 116 | 95.7 Ų | 95.7 | 54% | 0.542 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59.6 | -43.6 | 174.6 | -70.5 | 170.4 | -167.2 | 0 | 0 | 111.5 | P128 L129 D135 I136 | P128-E132 PolarHBondContact O-N 3.45Å; L129-E132 PolarHBondContact O-N 2.94Å; E132-D135 PolarHBondContact O-N 3.43Å; E132-I136 WeakPolarHBondContact O-CD1 3.33Å; E132-I136 VanDerWaalsContact O-CG1 3.22Å; E132-I136 WeakPolarHBondContact O-CG1 3.26Å; E132-I136 PolarHBondContact O-N 2.84Å |
| 133 | W | 94.2 | Very high | 91.4 | Very high | 140 Ų | 140 | 95 Ų | 95 | 53% | 0.53 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -60.3 | -48.2 | 173.3 | -85.9 | 101 | 0 | 0 | 0 | 112.1 | L129 R130 R131 D135 I136 Y137 | L129-W133 PolarHBondContact O-N 2.85Å; R130-W133 PolarHBondContact O-N 2.94Å; R131-W133 VanDerWaalsContact C-N 3.32Å; R131-W133 PolarHBondContact O-N 2.89Å; W133-D135 VanDerWaalsContact C-N 3.33Å; W133-D135 PolarHBondContact O-N 2.82Å; W133-I136 PolarHBondContact O-N 3.5Å; W133-Y137 HydrophobicContact CE3-CD2 4.32Å; W133-Y137 AromaticContact CE3-CE2 3.7Å; W133-Y137 HydrophobicContact CE3-CE2 3.7Å; W133-Y137 HydrophobicContact CZ3-CE2 4.26Å; W133-Y137 WeakPolarHBondContact O-CD2 3.41Å; W133-Y137 PolarHBondContact O-N 2.85Å |
| 134 | E | 97.1 | Very high | 92.5 | Very high | 109 Ų | 109 | 97.4 Ų | 97.4 | 51% | 0.509 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60 | -41.3 | 177.9 | -74 | 165.7 | -171.7 | 0 | 0 | 111.9 | R130 R131 Y137 R138 | R130-E134 WeakPolarHBondContact CD-OE1 3.42Å; R130-E134 HydrophobicContact CG-CG 4.49Å; R130-E134 WeakPolarHBondContact CG-OE1 3.34Å; R130-E134 WeakPolarHBondContact O-CG 2.91Å; R130-E134 PolarHBondContact O-N 2.88Å; R131-E134 PolarHBondContact O-N 3.09Å; E134-Y137 PolarHBondContact O-N 3.42Å; E134-R138 WeakPolarHBondContact O-CB 3.48Å; E134-R138 PolarHBondContact O-N 2.78Å |
| 135 | D | 97.7 | Very high | 93.7 | Very high | 72 Ų | 72 | 100.8 Ų | 100.8 | 39% | 0.385 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.4 | -41.7 | 175.5 | -85.4 | -39.5 | 0 | 0 | 0 | 112.4 | R131 E132 W133 R138 Q139 | R131-D135 WeakPolarHBondContact O-CB 3.39Å; R131-D135 PolarHBondContact O-N 2.85Å; E132-D135 PolarHBondContact O-N 3.43Å; W133-D135 VanDerWaalsContact C-N 3.33Å; W133-D135 PolarHBondContact O-N 2.82Å; D135-R138 PolarHBondContact O-N 3.47Å; D135-R138 IonicContact OD1-CZ 2.85Å; D135-R138 IonicContact OD1-NE 3.06Å; D135-R138 IonicContact OD1-NH2 3.34Å; D135-R138 PolarHBondContact OD1-NH2 3.48Å; D135-Q139 VanDerWaalsContact O-CG 3.28Å; D135-Q139 WeakPolarHBondContact O-CG 3.45Å; D135-Q139 PolarHBondContact O-N 3.45Å |
| 136 | I | 97.7 | Very high | 94.7 | Very high | 91 Ų | 91 | 103.6 Ų | 103.6 | 47% | 0.467 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.4 | -45.2 | 174.9 | -69.1 | 163.7 | 0 | 0 | 0 | 110.2 | E132 W133 R138 Q139 V140 | E132-I136 WeakPolarHBondContact O-CD1 3.33Å; E132-I136 VanDerWaalsContact O-CG1 3.22Å; E132-I136 WeakPolarHBondContact O-CG1 3.26Å; E132-I136 PolarHBondContact O-N 2.84Å; W133-I136 PolarHBondContact O-N 3.5Å; I136-R138 VanDerWaalsContact C-N 3.3Å; I136-R138 PolarHBondContact O-N 3.31Å; I136-Q139 PolarHBondContact O-N 3.43Å; I136-V140 HydrophobicContact CG2-CG2 4.36Å; I136-V140 VanDerWaalsContact O-CG2 3.3Å; I136-V140 WeakPolarHBondContact O-CG2 3.42Å; I136-V140 PolarHBondContact O-N 2.79Å |
| 137 | Y | 97.4 | Very high | 95.5 | Very high | 155 Ų | 155 | 100.1 Ų | 100.1 | 61% | 0.608 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -59.8 | -42.5 | 176.5 | -87.8 | -68.5 | 0 | 0 | 0 | 111.9 | W133 E134 V140 S141 | W133-Y137 HydrophobicContact CE3-CD2 4.32Å; W133-Y137 AromaticContact CE3-CE2 3.7Å; W133-Y137 HydrophobicContact CE3-CE2 3.7Å; W133-Y137 HydrophobicContact CZ3-CE2 4.26Å; W133-Y137 WeakPolarHBondContact O-CD2 3.41Å; W133-Y137 PolarHBondContact O-N 2.85Å; E134-Y137 PolarHBondContact O-N 3.42Å; Y137-V140 PolarHBondContact O-N 3.27Å; Y137-S141 WeakPolarHBondContact O-CB 3.36Å; Y137-S141 PolarHBondContact O-N 3.41Å; Y137-S141 PolarHBondContact O-OG 3.45Å |
| 138 | R | 98.1 | Very high | 95.8 | Very high | 114 Ų | 114 | 101.1 Ų | 101.1 | 43% | 0.43 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.5 | -49.1 | 175.5 | -177.2 | 177.9 | 57.5 | 77.4 | 2.3 | 111.3 | E134 D135 I136 V140 S141 E142 | E134-R138 WeakPolarHBondContact O-CB 3.48Å; E134-R138 PolarHBondContact O-N 2.78Å; D135-R138 PolarHBondContact O-N 3.47Å; D135-R138 IonicContact OD1-CZ 2.85Å; D135-R138 IonicContact OD1-NE 3.06Å; D135-R138 IonicContact OD1-NH2 3.34Å; D135-R138 PolarHBondContact OD1-NH2 3.48Å; I136-R138 VanDerWaalsContact C-N 3.3Å; I136-R138 PolarHBondContact O-N 3.31Å; R138-V140 VanDerWaalsContact C-N 3.32Å; R138-V140 PolarHBondContact O-N 2.81Å; R138-S141 PolarHBondContact O-N 2.82Å; R138-S141 VanDerWaalsContact O-N 3.12Å; R138-S141 PolarHBondContact O-OG 2.78Å; R138-E142 HydrophobicContact CG-CG 4.47Å; R138-E142 VanDerWaalsContact CG-OE1 3.3Å; R138-E142 WeakPolarHBondContact CG-OE1 3.24Å; R138-E142 IonicContact CZ-OE1 2.91Å; R138-E142 IonicContact NH1-OE1 3.97Å; R138-E142 PolarHBondContact NH1-OE1 2.76Å; R138-E142 IonicContact NH1-OE2 3.28Å; R138-E142 PolarHBondContact NH1-OE2 3.02Å; R138-E142 WeakPolarHBondContact O-CG 3.1Å; R138-E142 PolarHBondContact O-N 3.26Å |
| 139 | Q | 98.3 | Very high | 96.1 | Very high | 110 Ų | 110 | 106.6 Ų | 106.6 | 51% | 0.514 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59 | -42 | 177.3 | -72.7 | 171.2 | 28.1 | 0 | 0 | 112.3 | D135 I136 E142 A143 | D135-Q139 VanDerWaalsContact O-CG 3.28Å; D135-Q139 WeakPolarHBondContact O-CG 3.45Å; D135-Q139 PolarHBondContact O-N 3.45Å; I136-Q139 PolarHBondContact O-N 3.43Å; Q139-E142 PolarHBondContact O-N 2.86Å; Q139-A143 WeakPolarHBondContact O-CB 3.11Å; Q139-A143 PolarHBondContact O-N 2.85Å |
| 140 | V | 98.2 | Very high | 96.4 | Very high | 75 Ų | 75 | 108.2 Ų | 108.2 | 46% | 0.455 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 176 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | I136 Y137 R138 A143 I144 | I136-V140 HydrophobicContact CG2-CG2 4.36Å; I136-V140 VanDerWaalsContact O-CG2 3.3Å; I136-V140 WeakPolarHBondContact O-CG2 3.42Å; I136-V140 PolarHBondContact O-N 2.79Å; Y137-V140 PolarHBondContact O-N 3.27Å; R138-V140 VanDerWaalsContact C-N 3.32Å; R138-V140 PolarHBondContact O-N 2.81Å; V140-A143 PolarHBondContact O-N 3.47Å; V140-I144 HydrophobicContact CG1-CD1 3.85Å; V140-I144 HydrophobicContact CG1-CG1 4.48Å; V140-I144 VanDerWaalsContact O-CG1 3.25Å; V140-I144 WeakPolarHBondContact O-CG1 3.45Å; V140-I144 PolarHBondContact O-N 3.42Å |
| 141 | S | 97 | Very high | 96.6 | Very high | 57 Ų | 57 | 105.5 Ų | 105.5 | 40% | 0.399 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -41 | 177.6 | 72.8 | 0 | 0 | 0 | 0 | 112.7 | Y137 R138 I144 L145 | Y137-S141 WeakPolarHBondContact O-CB 3.36Å; Y137-S141 PolarHBondContact O-N 3.41Å; Y137-S141 PolarHBondContact O-OG 3.45Å; R138-S141 PolarHBondContact O-N 2.82Å; R138-S141 VanDerWaalsContact O-N 3.12Å; R138-S141 PolarHBondContact O-OG 2.78Å; S141-I144 PolarHBondContact O-N 2.94Å; S141-L145 WeakPolarHBondContact O-CG 3Å; S141-L145 PolarHBondContact O-N 2.75Å; S141-L145 VanDerWaalsContact O-N 3.09Å |
| 142 | E | 98.2 | Very high | 96.6 | Very high | 81 Ų | 81 | 103.4 Ų | 103.4 | 38% | 0.379 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62 | -46.8 | 174.7 | -72.9 | 168.8 | -174 | 0 | 0 | 110.1 | R138 Q139 I144 L145 E146 | R138-E142 HydrophobicContact CG-CG 4.47Å; R138-E142 VanDerWaalsContact CG-OE1 3.3Å; R138-E142 WeakPolarHBondContact CG-OE1 3.24Å; R138-E142 IonicContact CZ-OE1 2.91Å; R138-E142 IonicContact NH1-OE1 3.97Å; R138-E142 PolarHBondContact NH1-OE1 2.76Å; R138-E142 IonicContact NH1-OE2 3.28Å; R138-E142 PolarHBondContact NH1-OE2 3.02Å; R138-E142 WeakPolarHBondContact O-CG 3.1Å; R138-E142 PolarHBondContact O-N 3.26Å; Q139-E142 PolarHBondContact O-N 2.86Å; E142-I144 VanDerWaalsContact C-N 3.34Å; E142-I144 PolarHBondContact O-N 3.33Å; E142-L145 PolarHBondContact O-N 2.92Å; E142-E146 WeakPolarHBondContact O-CG 3.46Å; E142-E146 PolarHBondContact O-N 3.26Å |
| 143 | A | 97.1 | Very high | 96.5 | Very high | 53 Ų | 53 | 102.5 Ų | 102.5 | 44% | 0.438 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.2 | -36.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q139 V140 N147 | Q139-A143 WeakPolarHBondContact O-CB 3.11Å; Q139-A143 PolarHBondContact O-N 2.85Å; V140-A143 PolarHBondContact O-N 3.47Å; A143-N147 VanDerWaalsContact O-CB 3.27Å; A143-N147 WeakPolarHBondContact O-CB 3.47Å; A143-N147 PolarHBondContact O-N 2.83Å |
| 144 | I | 97.2 | Very high | 96.4 | Very high | 109 Ų | 109 | 99.4 Ų | 99.4 | 56% | 0.559 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65 | -44.3 | 175.1 | -70.4 | 164.4 | 0 | 0 | 0 | 110.6 | V140 S141 E142 N147 A148 | V140-I144 HydrophobicContact CG1-CD1 3.85Å; V140-I144 HydrophobicContact CG1-CG1 4.48Å; V140-I144 VanDerWaalsContact O-CG1 3.25Å; V140-I144 WeakPolarHBondContact O-CG1 3.45Å; V140-I144 PolarHBondContact O-N 3.42Å; S141-I144 PolarHBondContact O-N 2.94Å; E142-I144 VanDerWaalsContact C-N 3.34Å; E142-I144 PolarHBondContact O-N 3.33Å; I144-N147 PolarHBondContact O-N 3.35Å; I144-A148 PolarHBondContact O-N 2.83Å |
| 145 | L | 97.9 | Very high | 96.2 | Very high | 126 Ų | 126 | 99.2 Ų | 99.2 | 66% | 0.66 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.3 | -40.8 | 177.9 | -69.1 | 174.3 | 0 | 0 | 0 | 111.9 | S141 E142 A148 R149 | S141-L145 WeakPolarHBondContact O-CG 3Å; S141-L145 PolarHBondContact O-N 2.75Å; S141-L145 VanDerWaalsContact O-N 3.09Å; E142-L145 PolarHBondContact O-N 2.92Å; L145-A148 PolarHBondContact O-N 2.91Å; L145-R149 WeakPolarHBondContact O-CB 3.28Å; L145-R149 PolarHBondContact O-N 3.46Å |
| 146 | E | 97.9 | Very high | 95.8 | Very high | 125 Ų | 125 | 100.3 Ų | 100.3 | 58% | 0.584 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.2 | -42.5 | 174.2 | -74 | 179.2 | 179 | 0 | 0 | 111.7 | E142 R149 L150 | E142-E146 WeakPolarHBondContact O-CG 3.46Å; E142-E146 PolarHBondContact O-N 3.26Å; E146-R149 WeakPolarHBondContact O-CB 3.45Å; E146-R149 PolarHBondContact O-N 2.97Å; E146-L150 WeakPolarHBondContact O-CG 3.4Å; E146-L150 PolarHBondContact O-N 3.4Å |
| 147 | N | 96.6 | Very high | 95.6 | Very high | 97 Ų | 97 | 100.6 Ų | 100.6 | 52% | 0.519 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.7 | -45.8 | 175.8 | -169.4 | -86.1 | 0 | 0 | 0 | 111.4 | A143 I144 R149 L150 M151 | A143-N147 VanDerWaalsContact O-CB 3.27Å; A143-N147 WeakPolarHBondContact O-CB 3.47Å; A143-N147 PolarHBondContact O-N 2.83Å; I144-N147 PolarHBondContact O-N 3.35Å; N147-R149 VanDerWaalsContact C-N 3.31Å; N147-R149 PolarHBondContact O-N 3.43Å; N147-L150 PolarHBondContact O-N 3.25Å; N147-M151 VanDerWaalsContact O-CG 3.3Å; N147-M151 WeakPolarHBondContact O-CG 3.37Å; N147-M151 PolarHBondContact O-N 2.98Å |
| 148 | A | 94 | Very high | 95.2 | Very high | 46 Ų | 46 | 98.5 Ų | 98.5 | 38% | 0.38 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.9 | -41.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I144 L145 M151 L152 | I144-A148 PolarHBondContact O-N 2.83Å; L145-A148 PolarHBondContact O-N 2.91Å; A148-M151 PolarHBondContact O-N 2.82Å; A148-L152 WeakPolarHBondContact O-CG 3.31Å; A148-L152 PolarHBondContact O-N 2.9Å |
| 149 | R | 96.5 | Very high | 94.6 | Very high | 173 Ų | 173 | 95.1 Ų | 95.1 | 65% | 0.653 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.2 | -43.7 | 175.6 | -175.1 | 179.6 | -179.3 | 172.2 | 1.9 | 112.1 | L145 E146 N147 L152 Q153 | L145-R149 WeakPolarHBondContact O-CB 3.28Å; L145-R149 PolarHBondContact O-N 3.46Å; E146-R149 WeakPolarHBondContact O-CB 3.45Å; E146-R149 PolarHBondContact O-N 2.97Å; N147-R149 VanDerWaalsContact C-N 3.31Å; N147-R149 PolarHBondContact O-N 3.43Å; R149-L152 PolarHBondContact O-N 3.32Å; R149-Q153 WeakPolarHBondContact O-CG 3.35Å; R149-Q153 PolarHBondContact O-N 2.75Å |
| 150 | L | 94.8 | Very high | 94 | Very high | 100 Ų | 100 | 93 Ų | 93 | 52% | 0.524 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66 | -37.6 | 177.3 | -73 | 173 | 0 | 0 | 0 | 111.9 | E146 N147 Q153 T154 | E146-L150 WeakPolarHBondContact O-CG 3.4Å; E146-L150 PolarHBondContact O-N 3.4Å; N147-L150 PolarHBondContact O-N 3.25Å; L150-Q153 PolarHBondContact O-N 2.9Å; L150-T154 WeakPolarHBondContact O-CB 3.2Å; L150-T154 PolarHBondContact O-N 2.91Å; L150-T154 PolarHBondContact O-OG1 3.36Å |
| 151 | M | 93.7 | Very high | 93.5 | Very high | 107 Ų | 107 | 92 Ų | 92 | 53% | 0.527 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.2 | -49.1 | 173.5 | -69.3 | -131.6 | -56.7 | 0 | 0 | 111.1 | N147 A148 Q153 T154 E155 | N147-M151 VanDerWaalsContact O-CG 3.3Å; N147-M151 WeakPolarHBondContact O-CG 3.37Å; N147-M151 PolarHBondContact O-N 2.98Å; A148-M151 PolarHBondContact O-N 2.82Å; M151-Q153 VanDerWaalsContact C-N 3.3Å; M151-Q153 PolarHBondContact O-N 3.4Å; M151-T154 WeakPolarHBondContact O-CA 3.45Å; M151-T154 WeakPolarHBondContact O-CB 3.32Å; M151-T154 PolarHBondContact O-N 2.78Å; M151-E155 WeakPolarHBondContact O-CG 3.4Å; M151-E155 PolarHBondContact O-N 3.5Å |
| 152 | L | 94.1 | Very high | 93.1 | Very high | 115 Ų | 115 | 95.2 Ų | 95.2 | 60% | 0.602 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.3 | -39.3 | 176.8 | -70.1 | 173.9 | 0 | 0 | 0 | 112.5 | A148 R149 T154 N156 | A148-L152 WeakPolarHBondContact O-CG 3.31Å; A148-L152 PolarHBondContact O-N 2.9Å; R149-L152 PolarHBondContact O-N 3.32Å; L152-T154 VanDerWaalsContact C-N 3.33Å; L152-N156 WeakPolarHBondContact O-CB 3.35Å; L152-N156 PolarHBondContact O-N 3.44Å |
| 153 | Q | 92.1 | Very high | 92.8 | Very high | 98 Ų | 98 | 94.9 Ų | 94.9 | 46% | 0.458 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.8 | -39.2 | 174.2 | -75.1 | -179.8 | -21 | 0 | 0 | 111.9 | R149 L150 M151 N156 V157 | R149-Q153 WeakPolarHBondContact O-CG 3.35Å; R149-Q153 PolarHBondContact O-N 2.75Å; L150-Q153 PolarHBondContact O-N 2.9Å; M151-Q153 VanDerWaalsContact C-N 3.3Å; M151-Q153 PolarHBondContact O-N 3.4Å; Q153-N156 PolarHBondContact O-N 2.98Å; Q153-V157 VanDerWaalsContact O-CG2 3.29Å; Q153-V157 WeakPolarHBondContact O-CG2 3.25Å; Q153-V157 PolarHBondContact O-N 2.73Å |
| 154 | T | 92.9 | Very high | 92.4 | Very high | 74 Ų | 74 | 98.5 Ų | 98.5 | 45% | 0.454 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.8 | -47.4 | 177.3 | -56.7 | 0 | 0 | 0 | 0 | 110.7 | L150 M151 L152 N156 V157 Q158 | L150-T154 WeakPolarHBondContact O-CB 3.2Å; L150-T154 PolarHBondContact O-N 2.91Å; L150-T154 PolarHBondContact O-OG1 3.36Å; M151-T154 WeakPolarHBondContact O-CA 3.45Å; M151-T154 WeakPolarHBondContact O-CB 3.32Å; M151-T154 PolarHBondContact O-N 2.78Å; L152-T154 VanDerWaalsContact C-N 3.33Å; T154-N156 VanDerWaalsContact C-N 3.33Å; T154-N156 PolarHBondContact O-N 3.07Å; T154-V157 PolarHBondContact O-N 2.72Å; T154-Q158 WeakPolarHBondContact O-CB 3.4Å; T154-Q158 VanDerWaalsContact O-CG 3.28Å; T154-Q158 WeakPolarHBondContact O-CG 3.24Å; T154-Q158 PolarHBondContact O-N 3.3Å |
| 155 | E | 92.8 | Very high | 92.2 | Very high | 105 Ų | 105 | 99.5 Ų | 99.5 | 49% | 0.491 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.5 | -41.7 | 175.5 | -71 | 174.6 | -179 | 0 | 0 | 111.4 | M151 Q158 A159 | M151-E155 WeakPolarHBondContact O-CG 3.4Å; M151-E155 PolarHBondContact O-N 3.5Å; E155-Q158 PolarHBondContact O-N 3.28Å; E155-A159 WeakPolarHBondContact O-CB 3.45Å; E155-A159 PolarHBondContact O-N 3.47Å |
| 156 | N | 88.9 | Confident | 91.7 | Very high | 96 Ų | 96 | 99.9 Ų | 99.9 | 51% | 0.513 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.4 | -44.2 | 176.1 | -173.7 | -91.6 | 0 | 0 | 0 | 112.2 | L152 Q153 T154 Q158 A159 N160 | L152-N156 WeakPolarHBondContact O-CB 3.35Å; L152-N156 PolarHBondContact O-N 3.44Å; Q153-N156 PolarHBondContact O-N 2.98Å; T154-N156 VanDerWaalsContact C-N 3.33Å; T154-N156 PolarHBondContact O-N 3.07Å; N156-Q158 VanDerWaalsContact C-N 3.33Å; N156-A159 PolarHBondContact O-N 2.8Å; N156-N160 WeakPolarHBondContact O-CB 3.12Å; N156-N160 PolarHBondContact O-N 2.78Å; N156-N160 PolarHBondContact O-ND2 3.08Å; N156-N160 PolarHBondContact OD1-ND2 3.08Å |
| 157 | V | 92.9 | Very high | 91.4 | Very high | 97 Ų | 97 | 101.1 Ų | 101.1 | 59% | 0.588 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.9 | -38.6 | 176.7 | 170.9 | 0 | 0 | 0 | 0 | 111.1 | Q153 T154 N160 A161 | Q153-V157 VanDerWaalsContact O-CG2 3.29Å; Q153-V157 WeakPolarHBondContact O-CG2 3.25Å; Q153-V157 PolarHBondContact O-N 2.73Å; T154-V157 PolarHBondContact O-N 2.72Å; V157-N160 PolarHBondContact O-N 3.47Å; V157-A161 WeakPolarHBondContact O-CB 3.15Å; V157-A161 PolarHBondContact O-N 3.27Å |
| 158 | Q | 90.1 | Very high | 91.3 | Very high | 110 Ų | 110 | 101.6 Ų | 101.6 | 51% | 0.514 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.9 | -48.7 | 175.3 | -74.8 | 173 | -4.9 | 0 | 0 | 111.6 | T154 E155 N156 N160 A161 E162 | T154-Q158 WeakPolarHBondContact O-CB 3.4Å; T154-Q158 VanDerWaalsContact O-CG 3.28Å; T154-Q158 WeakPolarHBondContact O-CG 3.24Å; T154-Q158 PolarHBondContact O-N 3.3Å; E155-Q158 PolarHBondContact O-N 3.28Å; N156-Q158 VanDerWaalsContact C-N 3.33Å; Q158-N160 VanDerWaalsContact C-N 3.34Å; Q158-N160 PolarHBondContact O-N 2.81Å; Q158-A161 WeakPolarHBondContact O-CB 3.14Å; Q158-A161 PolarHBondContact O-N 2.83Å; Q158-A161 VanDerWaalsContact O-N 3.08Å; Q158-E162 WeakPolarHBondContact O-CG 3.17Å; Q158-E162 PolarHBondContact O-N 2.84Å |
| 159 | A | 85.6 | Confident | 91.1 | Very high | 43 Ų | 43 | 104.1 Ų | 104.1 | 36% | 0.355 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.9 | -44.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | E155 N156 A161 E162 D163 | E155-A159 WeakPolarHBondContact O-CB 3.45Å; E155-A159 PolarHBondContact O-N 3.47Å; N156-A159 PolarHBondContact O-N 2.8Å; A159-A161 VanDerWaalsContact C-N 3.31Å; A159-A161 PolarHBondContact O-N 2.85Å; A159-E162 PolarHBondContact O-N 2.88Å; A159-D163 PolarHBondContact O-N 3.07Å |
| 160 | N | 86.1 | Confident | 90.5 | Very high | 65 Ų | 65 | 98.7 Ų | 98.7 | 35% | 0.348 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.5 | -37.7 | 175.3 | -67.6 | -33.8 | 0 | 0 | 0 | 112.1 | N156 V157 Q158 D163 F164 | N156-N160 WeakPolarHBondContact O-CB 3.12Å; N156-N160 PolarHBondContact O-N 2.78Å; N156-N160 PolarHBondContact O-ND2 3.08Å; N156-N160 PolarHBondContact OD1-ND2 3.08Å; V157-N160 PolarHBondContact O-N 3.47Å; Q158-N160 VanDerWaalsContact C-N 3.34Å; Q158-N160 PolarHBondContact O-N 2.81Å; N160-D163 PolarHBondContact O-N 2.91Å; N160-F164 WeakPolarHBondContact O-CD2 3.31Å; N160-F164 WeakPolarHBondContact O-CG 3.14Å; N160-F164 PolarHBondContact O-N 3.26Å |
| 161 | A | 87.1 | Confident | 90.4 | Very high | 56 Ų | 56 | 98 Ų | 98 | 46% | 0.463 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.7 | -38.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | V157 Q158 A159 F164 K165 | V157-A161 WeakPolarHBondContact O-CB 3.15Å; V157-A161 PolarHBondContact O-N 3.27Å; Q158-A161 WeakPolarHBondContact O-CB 3.14Å; Q158-A161 PolarHBondContact O-N 2.83Å; Q158-A161 VanDerWaalsContact O-N 3.08Å; A159-A161 VanDerWaalsContact C-N 3.31Å; A159-A161 PolarHBondContact O-N 2.85Å; A161-F164 PolarHBondContact O-N 3.36Å; A161-K165 WeakPolarHBondContact O-CB 3.46Å; A161-K165 PolarHBondContact O-N 2.77Å |
| 162 | E | 89.6 | Confident | 90.2 | Very high | 123 Ų | 123 | 95.4 Ų | 95.4 | 58% | 0.575 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.9 | -45.5 | 172.8 | -71 | 173.8 | 178.6 | 0 | 0 | 111.1 | Q158 A159 F164 K165 E166 | Q158-E162 WeakPolarHBondContact O-CG 3.17Å; Q158-E162 PolarHBondContact O-N 2.84Å; A159-E162 PolarHBondContact O-N 2.88Å; E162-F164 VanDerWaalsContact C-N 3.31Å; E162-F164 PolarHBondContact O-N 2.92Å; E162-K165 WeakPolarHBondContact O-CA 3.44Å; E162-K165 WeakPolarHBondContact O-CB 3.38Å; E162-K165 PolarHBondContact O-N 3.2Å; E162-E166 PolarHBondContact O-N 2.76Å |
| 163 | D | 91.4 | Very high | 89.8 | Confident | 75 Ų | 75 | 93.3 Ų | 93.3 | 40% | 0.401 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -56.6 | -43.3 | 174 | -74.9 | -12.1 | 0 | 0 | 0 | 111.9 | A159 N160 K165 R167 | A159-D163 PolarHBondContact O-N 3.07Å; N160-D163 PolarHBondContact O-N 2.91Å; D163-K165 VanDerWaalsContact C-N 3.35Å; D163-R167 VanDerWaalsContact O-CG 3.25Å; D163-R167 WeakPolarHBondContact O-CG 3.37Å; D163-R167 PolarHBondContact O-N 3.1Å |
| 164 | F | 88 | Confident | 89.7 | Confident | 128 Ų | 128 | 94.2 Ų | 94.2 | 56% | 0.561 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.4 | -38 | 175.8 | -73.4 | -54.6 | 0 | 0 | 0 | 112.2 | N160 A161 E162 R167 L168 | N160-F164 WeakPolarHBondContact O-CD2 3.31Å; N160-F164 WeakPolarHBondContact O-CG 3.14Å; N160-F164 PolarHBondContact O-N 3.26Å; A161-F164 PolarHBondContact O-N 3.36Å; E162-F164 VanDerWaalsContact C-N 3.31Å; E162-F164 PolarHBondContact O-N 2.92Å; F164-R167 PolarHBondContact O-N 3.47Å; F164-L168 VanDerWaalsContact O-CG 3.28Å; F164-L168 WeakPolarHBondContact O-CG 3.46Å; F164-L168 PolarHBondContact O-N 2.88Å |
| 165 | K | 94.1 | Very high | 89.7 | Confident | 131 Ų | 131 | 97.2 Ų | 97.2 | 57% | 0.57 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.8 | -47 | 176.5 | -174.1 | -175 | 173.6 | -170.5 | 0 | 111.3 | A161 E162 D163 R167 L168 D169 | A161-K165 WeakPolarHBondContact O-CB 3.46Å; A161-K165 PolarHBondContact O-N 2.77Å; E162-K165 WeakPolarHBondContact O-CA 3.44Å; E162-K165 WeakPolarHBondContact O-CB 3.38Å; E162-K165 PolarHBondContact O-N 3.2Å; D163-K165 VanDerWaalsContact C-N 3.35Å; K165-R167 VanDerWaalsContact C-N 3.28Å; K165-R167 PolarHBondContact O-N 3.38Å; K165-L168 PolarHBondContact O-N 2.9Å; K165-L168 VanDerWaalsContact O-N 3.12Å; K165-D169 PolarHBondContact O-N 3.38Å |
| 166 | E | 86.9 | Confident | 89.8 | Confident | 134 Ų | 134 | 94.4 Ų | 94.4 | 63% | 0.626 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.1 | -39.2 | 176.1 | -69.9 | -174.4 | 176.2 | 0 | 0 | 112.1 | E162 D169 S170 | E162-E166 PolarHBondContact O-N 2.76Å; E166-D169 PolarHBondContact O-N 3.38Å; E166-S170 WeakPolarHBondContact O-CB 3.41Å; E166-S170 PolarHBondContact O-N 3.44Å; E166-S170 PolarHBondContact O-OG 2.98Å |
| 167 | R | 92.3 | Very high | 90 | Very high | 151 Ų | 151 | 92 Ų | 92 | 57% | 0.57 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.4 | -42.1 | 173.7 | -72.4 | 174.4 | -170.4 | -170.1 | 6.4 | 112.2 | D163 F164 K165 S170 E171 | D163-R167 VanDerWaalsContact O-CG 3.25Å; D163-R167 WeakPolarHBondContact O-CG 3.37Å; D163-R167 PolarHBondContact O-N 3.1Å; F164-R167 PolarHBondContact O-N 3.47Å; K165-R167 VanDerWaalsContact C-N 3.28Å; K165-R167 PolarHBondContact O-N 3.38Å; R167-S170 WeakPolarHBondContact CA-OG 3.39Å; R167-S170 PolarHBondContact O-OG 3.04Å; R167-E171 WeakPolarHBondContact O-CB 3.41Å; R167-E171 WeakPolarHBondContact O-CG 3.35Å; R167-E171 PolarHBondContact O-N 3.49Å |
| 168 | L | 93.3 | Very high | 90.1 | Very high | 107 Ų | 107 | 91.2 Ų | 91.2 | 56% | 0.56 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.2 | -42.1 | 177.1 | -72.9 | 172.6 | 0 | 0 | 0 | 111.9 | F164 K165 E171 A172 | F164-L168 VanDerWaalsContact O-CG 3.28Å; F164-L168 WeakPolarHBondContact O-CG 3.46Å; F164-L168 PolarHBondContact O-N 2.88Å; K165-L168 PolarHBondContact O-N 2.9Å; K165-L168 VanDerWaalsContact O-N 3.12Å; L168-E171 PolarHBondContact O-N 3.12Å; L168-A172 VanDerWaalsContact O-CB 3.23Å; L168-A172 WeakPolarHBondContact O-CB 3.34Å; L168-A172 PolarHBondContact O-N 2.87Å |
| 169 | D | 90.8 | Very high | 90.5 | Very high | 98 Ų | 98 | 92.4 Ų | 92.4 | 52% | 0.524 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 178.8 | -70 | -19.2 | 0 | 0 | 0 | 111 | K165 E166 A172 S173 | K165-D169 PolarHBondContact O-N 3.38Å; E166-D169 PolarHBondContact O-N 3.38Å; D169-A172 PolarHBondContact O-N 3.44Å; D169-S173 PolarHBondContact O-N 2.8Å |
| 170 | S | 83.4 | Confident | 91 | Very high | 59 Ų | 59 | 96.2 Ų | 96.2 | 41% | 0.413 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65 | -45.2 | 174.4 | 56.7 | 0 | 0 | 0 | 0 | 112 | E166 R167 A172 S173 L174 | E166-S170 WeakPolarHBondContact O-CB 3.41Å; E166-S170 PolarHBondContact O-N 3.44Å; E166-S170 PolarHBondContact O-OG 2.98Å; R167-S170 WeakPolarHBondContact CA-OG 3.39Å; R167-S170 PolarHBondContact O-OG 3.04Å; S170-A172 VanDerWaalsContact C-N 3.34Å; S170-A172 PolarHBondContact O-N 3.49Å; S170-S173 PolarHBondContact O-N 3.32Å; S170-S173 PolarHBondContact O-OG 3.08Å; S170-L174 WeakPolarHBondContact O-CG 3.37Å; S170-L174 PolarHBondContact O-N 3.29Å |
| 171 | E | 92.1 | Very high | 91.5 | Very high | 85 Ų | 85 | 99 Ų | 99 | 40% | 0.397 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.5 | -38.8 | 174.1 | -77.9 | -171 | -167.7 | 0 | 0 | 112.7 | R167 L168 S173 L174 R175 | R167-E171 WeakPolarHBondContact O-CB 3.41Å; R167-E171 WeakPolarHBondContact O-CG 3.35Å; R167-E171 PolarHBondContact O-N 3.49Å; L168-E171 PolarHBondContact O-N 3.12Å; E171-S173 VanDerWaalsContact C-N 3.34Å; E171-L174 PolarHBondContact O-N 3.34Å; E171-R175 WeakPolarHBondContact O-CB 3.46Å; E171-R175 WeakPolarHBondContact O-CG 3.34Å; E171-R175 PolarHBondContact O-N 2.93Å; E171-R175 IonicContact OE2-CZ 3.54Å; E171-R175 IonicContact OE2-NH1 2.85Å; E171-R175 PolarHBondContact OE2-NH1 3.14Å; E171-R175 IonicContact OE2-NH2 3.72Å; E171-R175 PolarHBondContact OE2-NH2 3.4Å |
| 172 | A | 89.9 | Confident | 92 | Very high | 53 Ų | 53 | 99 Ų | 99 | 44% | 0.438 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -42.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | L168 D169 S170 L174 R175 A176 | L168-A172 VanDerWaalsContact O-CB 3.23Å; L168-A172 WeakPolarHBondContact O-CB 3.34Å; L168-A172 PolarHBondContact O-N 2.87Å; D169-A172 PolarHBondContact O-N 3.44Å; S170-A172 VanDerWaalsContact C-N 3.34Å; S170-A172 PolarHBondContact O-N 3.49Å; A172-L174 VanDerWaalsContact C-N 3.35Å; A172-L174 PolarHBondContact O-N 2.88Å; A172-R175 PolarHBondContact O-N 3.1Å; A172-A176 PolarHBondContact O-N 2.89Å |
| 173 | S | 85.1 | Confident | 92.4 | Very high | 72 Ų | 72 | 94.5 Ų | 94.5 | 50% | 0.503 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.8 | -40.1 | 175 | 74.9 | 0 | 0 | 0 | 0 | 112.6 | D169 S170 E171 A176 A177 | D169-S173 PolarHBondContact O-N 2.8Å; S170-S173 PolarHBondContact O-N 3.32Å; S170-S173 PolarHBondContact O-OG 3.08Å; E171-S173 VanDerWaalsContact C-N 3.34Å; S173-A176 PolarHBondContact O-N 3.31Å; S173-A177 PolarHBondContact O-N 3.03Å; S173-A177 VanDerWaalsContact O-N 3.08Å |
| 174 | L | 90.7 | Very high | 92.7 | Very high | 116 Ų | 116 | 93.7 Ų | 93.7 | 61% | 0.607 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67.8 | -41.1 | 175.7 | -69.8 | 171.7 | 0 | 0 | 0 | 111.7 | S170 E171 A172 A177 V178 | S170-L174 WeakPolarHBondContact O-CG 3.37Å; S170-L174 PolarHBondContact O-N 3.29Å; E171-L174 PolarHBondContact O-N 3.34Å; A172-L174 VanDerWaalsContact C-N 3.35Å; A172-L174 PolarHBondContact O-N 2.88Å; L174-A177 PolarHBondContact O-N 3.49Å; L174-V178 WeakPolarHBondContact O-CG2 3.04Å; L174-V178 PolarHBondContact O-N 3.41Å |
| 175 | R | 93.6 | Very high | 93.1 | Very high | 137 Ų | 137 | 92.9 Ų | 92.9 | 52% | 0.517 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.4 | -46 | 175 | -77.6 | -174.4 | -176.4 | 93.9 | 8.3 | 111.1 | E171 A172 A177 V178 E179 | E171-R175 WeakPolarHBondContact O-CB 3.46Å; E171-R175 WeakPolarHBondContact O-CG 3.34Å; E171-R175 PolarHBondContact O-N 2.93Å; E171-R175 IonicContact OE2-CZ 3.54Å; E171-R175 IonicContact OE2-NH1 2.85Å; E171-R175 PolarHBondContact OE2-NH1 3.14Å; E171-R175 IonicContact OE2-NH2 3.72Å; E171-R175 PolarHBondContact OE2-NH2 3.4Å; A172-R175 PolarHBondContact O-N 3.1Å; R175-A177 PolarHBondContact O-N 3.35Å; R175-V178 PolarHBondContact O-N 2.89Å; R175-E179 WeakPolarHBondContact O-CB 3.12Å; R175-E179 VanDerWaalsContact O-CG 3.31Å; R175-E179 WeakPolarHBondContact O-CG 3.3Å; R175-E179 PolarHBondContact O-N 3.47Å |
| 176 | A | 93.9 | Very high | 93.3 | Very high | 46 Ų | 46 | 94.2 Ų | 94.2 | 38% | 0.38 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.9 | -45.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A172 S173 V178 E179 D180 | A172-A176 PolarHBondContact O-N 2.89Å; S173-A176 PolarHBondContact O-N 3.31Å; A176-V178 PolarHBondContact O-N 3.24Å; A176-E179 PolarHBondContact O-N 3.07Å; A176-D180 PolarHBondContact O-N 2.96Å |
| 177 | A | 92.7 | Very high | 93.9 | Very high | 46 Ų | 46 | 96 Ų | 96 | 38% | 0.38 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.5 | -43.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S173 L174 R175 D180 E181 | S173-A177 PolarHBondContact O-N 3.03Å; S173-A177 VanDerWaalsContact O-N 3.08Å; L174-A177 PolarHBondContact O-N 3.49Å; R175-A177 PolarHBondContact O-N 3.35Å; A177-D180 PolarHBondContact O-N 3.08Å; A177-E181 WeakPolarHBondContact O-CG 3.44Å; A177-E181 PolarHBondContact O-N 2.95Å |
| 178 | V | 96.2 | Very high | 94.2 | Very high | 81 Ų | 81 | 92.9 Ų | 92.9 | 49% | 0.491 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.6 | -38.9 | 176.9 | 172.3 | 0 | 0 | 0 | 0 | 111.6 | L174 R175 A176 D180 E181 V182 | L174-V178 WeakPolarHBondContact O-CG2 3.04Å; L174-V178 PolarHBondContact O-N 3.41Å; R175-V178 PolarHBondContact O-N 2.89Å; A176-V178 PolarHBondContact O-N 3.24Å; V178-D180 VanDerWaalsContact C-N 3.34Å; V178-E181 PolarHBondContact O-N 2.94Å; V178-V182 HydrophobicContact CG1-CG2 4.35Å; V178-V182 WeakPolarHBondContact O-CB 3.28Å; V178-V182 VanDerWaalsContact O-CG2 3.28Å; V178-V182 WeakPolarHBondContact O-CG2 3.28Å; V178-V182 PolarHBondContact O-N 2.87Å |
| 179 | E | 97.1 | Very high | 94.4 | Very high | 135 Ų | 135 | 94.3 Ų | 94.3 | 63% | 0.631 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.3 | -40.3 | 175.6 | -76.1 | 174.6 | -175.6 | 0 | 0 | 111.6 | R175 A176 V182 G183 | R175-E179 WeakPolarHBondContact O-CB 3.12Å; R175-E179 VanDerWaalsContact O-CG 3.31Å; R175-E179 WeakPolarHBondContact O-CG 3.3Å; R175-E179 PolarHBondContact O-N 3.47Å; A176-E179 PolarHBondContact O-N 3.07Å; E179-V182 PolarHBondContact O-N 3.32Å; E179-G183 PolarHBondContact O-N 2.96Å |
| 180 | D | 95.9 | Very high | 94.8 | Very high | 123 Ų | 123 | 95.9 Ų | 95.9 | 66% | 0.658 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.8 | -44.6 | 173.7 | -74.3 | -21.4 | 0 | 0 | 0 | 111.6 | A176 A177 V178 G183 S184 | A176-D180 PolarHBondContact O-N 2.96Å; A177-D180 PolarHBondContact O-N 3.08Å; V178-D180 VanDerWaalsContact C-N 3.34Å; D180-G183 PolarHBondContact O-N 3.33Å; D180-S184 PolarHBondContact O-N 3.36Å |
| 181 | E | 97.4 | Very high | 95.5 | Very high | 122 Ų | 122 | 98.9 Ų | 98.9 | 57% | 0.57 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.6 | -48.1 | 174.9 | -76 | 178.9 | -173.8 | 0 | 0 | 111.5 | A177 V178 G183 S184 L185 | A177-E181 WeakPolarHBondContact O-CG 3.44Å; A177-E181 PolarHBondContact O-N 2.95Å; V178-E181 PolarHBondContact O-N 2.94Å; E181-G183 VanDerWaalsContact C-N 3.29Å; E181-G183 PolarHBondContact O-N 2.88Å; E181-S184 PolarHBondContact O-N 3.38Å; E181-S184 VanDerWaalsContact O-N 3.15Å; E181-S184 PolarHBondContact O-OG 3.41Å; E181-L185 WeakPolarHBondContact O-CG 3.4Å; E181-L185 PolarHBondContact O-N 2.9Å |
| 182 | V | 97.4 | Very high | 95.8 | Very high | 58 Ų | 58 | 97.4 Ų | 97.4 | 35% | 0.352 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -40.8 | 175.7 | 169.7 | 0 | 0 | 0 | 0 | 110.9 | V178 E179 L185 R186 | V178-V182 HydrophobicContact CG1-CG2 4.35Å; V178-V182 WeakPolarHBondContact O-CB 3.28Å; V178-V182 VanDerWaalsContact O-CG2 3.28Å; V178-V182 WeakPolarHBondContact O-CG2 3.28Å; V178-V182 PolarHBondContact O-N 2.87Å; E179-V182 PolarHBondContact O-N 3.32Å; V182-L185 PolarHBondContact O-N 3.5Å; V182-R186 WeakPolarHBondContact O-CG 3.26Å; V182-R186 PolarHBondContact O-N 3.04Å |
| 183 | G | 98.1 | Very high | 96.2 | Very high | 27 Ų | 27 | 97.4 Ų | 97.4 | 28% | 0.278 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.2 | -44.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112.3 | E179 D180 E181 R186 R187 | E179-G183 PolarHBondContact O-N 2.96Å; D180-G183 PolarHBondContact O-N 3.33Å; E181-G183 VanDerWaalsContact C-N 3.29Å; E181-G183 PolarHBondContact O-N 2.88Å; G183-R186 PolarHBondContact O-N 3.25Å; G183-R187 WeakPolarHBondContact O-CG 3.27Å; G183-R187 PolarHBondContact O-N 3.41Å; G183-R187 VanDerWaalsContact O-N 3.12Å |
| 184 | S | 97.6 | Very high | 96.8 | Very high | 59 Ų | 59 | 97.9 Ų | 97.9 | 41% | 0.413 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.8 | -42.1 | 176.9 | 78.1 | 0 | 0 | 0 | 0 | 112.3 | D180 E181 R186 R187 V188 | D180-S184 PolarHBondContact O-N 3.36Å; E181-S184 PolarHBondContact O-N 3.38Å; E181-S184 VanDerWaalsContact O-N 3.15Å; E181-S184 PolarHBondContact O-OG 3.41Å; S184-R186 VanDerWaalsContact C-N 3.33Å; S184-R186 PolarHBondContact O-N 2.94Å; S184-R187 WeakPolarHBondContact O-CB 3.33Å; S184-R187 PolarHBondContact O-N 3.04Å; S184-V188 WeakPolarHBondContact O-CG2 3.34Å; S184-V188 PolarHBondContact O-N 2.92Å |
| 185 | L | 97.4 | Very high | 97.2 | Very high | 110 Ų | 110 | 95.6 Ų | 95.6 | 58% | 0.576 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.3 | -38.3 | 177.2 | -71.9 | 174.8 | 0 | 0 | 0 | 111.7 | E181 V182 V188 M189 | E181-L185 WeakPolarHBondContact O-CG 3.4Å; E181-L185 PolarHBondContact O-N 2.9Å; V182-L185 PolarHBondContact O-N 3.5Å; L185-V188 PolarHBondContact O-N 2.69Å; L185-M189 WeakPolarHBondContact O-CG 3.3Å; L185-M189 PolarHBondContact O-N 3.45Å |
| 186 | R | 98.3 | Very high | 97.4 | Very high | 160 Ų | 160 | 95 Ų | 95 | 60% | 0.604 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.2 | -42.5 | 173.4 | -74.7 | 176.4 | -174.6 | 166.8 | 4.5 | 111.9 | V182 G183 S184 M189 E190 | V182-R186 WeakPolarHBondContact O-CG 3.26Å; V182-R186 PolarHBondContact O-N 3.04Å; G183-R186 PolarHBondContact O-N 3.25Å; S184-R186 VanDerWaalsContact C-N 3.33Å; S184-R186 PolarHBondContact O-N 2.94Å; R186-M189 WeakPolarHBondContact O-CB 3.43Å; R186-M189 PolarHBondContact O-N 2.94Å; R186-E190 WeakPolarHBondContact O-CG 3.42Å; R186-E190 PolarHBondContact O-N 3.4Å |
| 187 | R | 98.4 | Very high | 97.7 | Very high | 170 Ų | 170 | 96.2 Ų | 96.2 | 64% | 0.642 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.3 | -46.6 | 175.2 | -68.8 | 176.3 | -175.1 | 162.9 | 4.1 | 111.7 | G183 S184 M189 E190 E191 | G183-R187 WeakPolarHBondContact O-CG 3.27Å; G183-R187 PolarHBondContact O-N 3.41Å; G183-R187 VanDerWaalsContact O-N 3.12Å; S184-R187 WeakPolarHBondContact O-CB 3.33Å; S184-R187 PolarHBondContact O-N 3.04Å; R187-M189 VanDerWaalsContact C-N 3.27Å; R187-M189 PolarHBondContact O-N 3.03Å; R187-E190 WeakPolarHBondContact O-CB 3.31Å; R187-E190 PolarHBondContact O-N 3.07Å; R187-E190 VanDerWaalsContact O-N 3.1Å; R187-E191 WeakPolarHBondContact O-CG 3.27Å; R187-E191 PolarHBondContact O-N 2.89Å |
| 188 | V | 98.5 | Very high | 97.9 | Very high | 87 Ų | 87 | 97.5 Ų | 97.5 | 53% | 0.527 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.4 | -39 | 176 | 173.6 | 0 | 0 | 0 | 0 | 111.3 | S184 L185 A192 | S184-V188 WeakPolarHBondContact O-CG2 3.34Å; S184-V188 PolarHBondContact O-N 2.92Å; L185-V188 PolarHBondContact O-N 2.69Å; V188-A192 VanDerWaalsContact O-CB 3.26Å; V188-A192 WeakPolarHBondContact O-CB 3.46Å; V188-A192 PolarHBondContact O-N 2.95Å |
| 189 | M | 98.4 | Very high | 98 | Very high | 136 Ų | 136 | 98.4 Ų | 98.4 | 67% | 0.67 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.8 | -42.2 | 173.5 | -78.9 | -178.9 | 47.5 | 0 | 0 | 112.8 | L185 R186 R187 A192 A193 | L185-M189 WeakPolarHBondContact O-CG 3.3Å; L185-M189 PolarHBondContact O-N 3.45Å; R186-M189 WeakPolarHBondContact O-CB 3.43Å; R186-M189 PolarHBondContact O-N 2.94Å; R187-M189 VanDerWaalsContact C-N 3.27Å; R187-M189 PolarHBondContact O-N 3.03Å; M189-A192 PolarHBondContact O-N 3.47Å; M189-A193 WeakPolarHBondContact O-CB 3.44Å; M189-A193 PolarHBondContact O-N 2.89Å |
| 190 | E | 98.4 | Very high | 98.1 | Very high | 131 Ų | 131 | 95.7 Ų | 95.7 | 61% | 0.612 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.7 | -45.1 | 176.2 | -73 | 169.7 | -170 | 0 | 0 | 111.1 | R186 R187 A192 A193 V194 | R186-E190 WeakPolarHBondContact O-CG 3.42Å; R186-E190 PolarHBondContact O-N 3.4Å; R187-E190 WeakPolarHBondContact O-CB 3.31Å; R187-E190 PolarHBondContact O-N 3.07Å; R187-E190 VanDerWaalsContact O-N 3.1Å; E190-A192 PolarHBondContact O-N 2.87Å; E190-A193 WeakPolarHBondContact O-CB 3.41Å; E190-A193 PolarHBondContact O-N 2.95Å; E190-A193 VanDerWaalsContact O-N 3.16Å; E190-V194 WeakPolarHBondContact O-CG2 3.27Å; E190-V194 PolarHBondContact O-N 3.31Å |
| 191 | E | 98.3 | Very high | 98.2 | Very high | 123 Ų | 123 | 95.7 Ų | 95.7 | 58% | 0.575 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.1 | -43 | 174.3 | -70.8 | 170.2 | -166.9 | 0 | 0 | 111.9 | R187 A193 V194 T195 | R187-E191 WeakPolarHBondContact O-CG 3.27Å; R187-E191 PolarHBondContact O-N 2.89Å; E191-A193 VanDerWaalsContact C-N 3.3Å; E191-A193 PolarHBondContact O-N 3.44Å; E191-V194 PolarHBondContact O-N 2.75Å; E191-T195 WeakPolarHBondContact O-CG2 3.45Å; E191-T195 PolarHBondContact O-N 3.38Å; E191-T195 PolarHBondContact O-OG1 2.9Å |
| 192 | A | 98.4 | Very high | 98.2 | Very high | 53 Ų | 53 | 96.3 Ų | 96.3 | 44% | 0.438 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.3 | -36.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | V188 M189 E190 T195 K196 | V188-A192 VanDerWaalsContact O-CB 3.26Å; V188-A192 WeakPolarHBondContact O-CB 3.46Å; V188-A192 PolarHBondContact O-N 2.95Å; M189-A192 PolarHBondContact O-N 3.47Å; E190-A192 PolarHBondContact O-N 2.87Å; A192-T195 WeakPolarHBondContact CA-OG1 3.26Å; A192-T195 PolarHBondContact O-OG1 3.29Å; A192-K196 VanDerWaalsContact O-CB 3.28Å; A192-K196 WeakPolarHBondContact O-CB 3.38Å; A192-K196 PolarHBondContact O-N 3.5Å |
| 193 | A | 98.4 | Very high | 98.3 | Very high | 53 Ų | 53 | 98.5 Ų | 98.5 | 44% | 0.438 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.2 | -42.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | M189 E190 E191 K196 V197 | M189-A193 WeakPolarHBondContact O-CB 3.44Å; M189-A193 PolarHBondContact O-N 2.89Å; E190-A193 WeakPolarHBondContact O-CB 3.41Å; E190-A193 PolarHBondContact O-N 2.95Å; E190-A193 VanDerWaalsContact O-N 3.16Å; E191-A193 VanDerWaalsContact C-N 3.3Å; E191-A193 PolarHBondContact O-N 3.44Å; A193-K196 WeakPolarHBondContact O-CB 3.31Å; A193-K196 PolarHBondContact O-N 3.09Å; A193-V197 WeakPolarHBondContact O-CG2 3.28Å; A193-V197 PolarHBondContact O-N 2.96Å; A193-V197 VanDerWaalsContact O-N 3.08Å |
| 194 | V | 98.5 | Very high | 98.3 | Very high | 82 Ų | 82 | 103.6 Ų | 103.6 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.4 | -51 | 175.8 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | E190 E191 K196 V197 E198 | E190-V194 WeakPolarHBondContact O-CG2 3.27Å; E190-V194 PolarHBondContact O-N 3.31Å; E191-V194 PolarHBondContact O-N 2.75Å; V194-K196 VanDerWaalsContact C-N 3.26Å; V194-K196 PolarHBondContact O-N 2.97Å; V194-V197 PolarHBondContact O-N 3.4Å; V194-E198 HydrophobicContact CG1-CG 4.5Å; V194-E198 WeakPolarHBondContact O-CG 2.97Å; V194-E198 PolarHBondContact O-N 3.24Å |
| 195 | T | 98.2 | Very high | 98.3 | Very high | 69 Ų | 69 | 103.6 Ų | 103.6 | 42% | 0.423 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.3 | -35.1 | 178.9 | 52.4 | 0 | 0 | 0 | 0 | 112.5 | E191 A192 E198 L199 | E191-T195 WeakPolarHBondContact O-CG2 3.45Å; E191-T195 PolarHBondContact O-N 3.38Å; E191-T195 PolarHBondContact O-OG1 2.9Å; A192-T195 WeakPolarHBondContact CA-OG1 3.26Å; A192-T195 PolarHBondContact O-OG1 3.29Å; T195-E198 PolarHBondContact O-N 2.88Å; T195-L199 WeakPolarHBondContact O-CB 3.43Å; T195-L199 VanDerWaalsContact O-CG 3.29Å; T195-L199 WeakPolarHBondContact O-CG 3.41Å; T195-L199 PolarHBondContact O-N 2.87Å |
| 196 | K | 98.4 | Very high | 98.3 | Very high | 123 Ų | 123 | 104.3 Ų | 104.3 | 54% | 0.535 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60 | -49.9 | 171.4 | 178.2 | -172.1 | 165 | -171.1 | 0 | 111.4 | A192 A193 V194 E198 L199 E200 | A192-K196 VanDerWaalsContact O-CB 3.28Å; A192-K196 WeakPolarHBondContact O-CB 3.38Å; A192-K196 PolarHBondContact O-N 3.5Å; A193-K196 WeakPolarHBondContact O-CB 3.31Å; A193-K196 PolarHBondContact O-N 3.09Å; V194-K196 VanDerWaalsContact C-N 3.26Å; V194-K196 PolarHBondContact O-N 2.97Å; K196-E198 VanDerWaalsContact C-N 3.34Å; K196-E198 PolarHBondContact O-N 3.38Å; K196-L199 PolarHBondContact O-N 2.75Å; K196-E200 WeakPolarHBondContact CE-OE1 3.45Å; K196-E200 IonicContact NZ-OE1 3.72Å; K196-E200 WeakPolarHBondContact O-CG 2.97Å; K196-E200 PolarHBondContact O-N 3.04Å |
| 197 | V | 98.6 | Very high | 98.3 | Very high | 73 Ų | 73 | 102.1 Ų | 102.1 | 44% | 0.442 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.6 | -44.5 | 178.8 | 172.8 | 0 | 0 | 0 | 0 | 110.6 | A193 V194 L199 E200 E201 | A193-V197 WeakPolarHBondContact O-CG2 3.28Å; A193-V197 PolarHBondContact O-N 2.96Å; A193-V197 VanDerWaalsContact O-N 3.08Å; V194-V197 PolarHBondContact O-N 3.4Å; V197-L199 VanDerWaalsContact C-N 3.31Å; V197-L199 PolarHBondContact O-N 2.87Å; V197-E200 WeakPolarHBondContact O-CB 3.29Å; V197-E200 PolarHBondContact O-N 2.68Å; V197-E200 VanDerWaalsContact O-N 3.15Å; V197-E201 WeakPolarHBondContact O-CG 3.25Å; V197-E201 PolarHBondContact O-N 2.87Å |
| 198 | E | 98.3 | Very high | 98.3 | Very high | 72 Ų | 72 | 95.5 Ų | 95.5 | 34% | 0.336 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.9 | -39.7 | 176.2 | -68 | -179.4 | -169.7 | 0 | 0 | 112.8 | V194 T195 K196 E201 R202 | V194-E198 HydrophobicContact CG1-CG 4.5Å; V194-E198 WeakPolarHBondContact O-CG 2.97Å; V194-E198 PolarHBondContact O-N 3.24Å; T195-E198 PolarHBondContact O-N 2.88Å; K196-E198 VanDerWaalsContact C-N 3.34Å; K196-E198 PolarHBondContact O-N 3.38Å; E198-E201 PolarHBondContact O-N 3.34Å; E198-R202 VanDerWaalsContact O-CG 3.26Å; E198-R202 WeakPolarHBondContact O-CG 3.36Å; E198-R202 PolarHBondContact O-N 3.45Å; E198-R202 IonicContact OE2-CZ 3.75Å; E198-R202 IonicContact OE2-NH1 2.86Å; E198-R202 PolarHBondContact OE2-NH1 3.23Å; E198-R202 IonicContact OE2-NH2 3.6Å; E198-R202 PolarHBondContact OE2-NH2 3.4Å |
| 199 | L | 98.3 | Very high | 98.2 | Very high | 100 Ų | 100 | 96 Ų | 96 | 52% | 0.524 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.7 | -37.8 | 176.2 | -72.4 | 172 | 0 | 0 | 0 | 111.7 | T195 K196 V197 R202 M203 | T195-L199 WeakPolarHBondContact O-CB 3.43Å; T195-L199 VanDerWaalsContact O-CG 3.29Å; T195-L199 WeakPolarHBondContact O-CG 3.41Å; T195-L199 PolarHBondContact O-N 2.87Å; K196-L199 PolarHBondContact O-N 2.75Å; V197-L199 VanDerWaalsContact C-N 3.31Å; V197-L199 PolarHBondContact O-N 2.87Å; L199-R202 PolarHBondContact O-N 3.26Å; L199-M203 WeakPolarHBondContact O-CB 3.35Å; L199-M203 WeakPolarHBondContact O-CG 3.23Å; L199-M203 PolarHBondContact O-N 2.97Å |
| 200 | E | 98.1 | Very high | 98.2 | Very high | 78 Ų | 78 | 94.5 Ų | 94.5 | 36% | 0.364 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.8 | -46.3 | 172.7 | -73.2 | 173.9 | 168.3 | 0 | 0 | 111 | K196 V197 M203 E204 | K196-E200 WeakPolarHBondContact CE-OE1 3.45Å; K196-E200 IonicContact NZ-OE1 3.72Å; K196-E200 WeakPolarHBondContact O-CG 2.97Å; K196-E200 PolarHBondContact O-N 3.04Å; V197-E200 WeakPolarHBondContact O-CB 3.29Å; V197-E200 PolarHBondContact O-N 2.68Å; V197-E200 VanDerWaalsContact O-N 3.15Å; E200-M203 HydrophobicContact CB-CE 4.49Å; E200-M203 HydrophobicContact CG-CE 4.07Å; E200-M203 WeakPolarHBondContact O-CB 3.41Å; E200-M203 PolarHBondContact O-N 3.39Å; E200-E204 WeakPolarHBondContact O-CG 3.41Å; E200-E204 PolarHBondContact O-N 2.86Å |
| 201 | E | 98.3 | Very high | 98.1 | Very high | 123 Ų | 123 | 96 Ų | 96 | 58% | 0.575 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61 | -45.2 | 175 | -71.8 | 179.9 | 173.1 | 0 | 0 | 112.4 | V197 E198 M203 E204 S205 | V197-E201 WeakPolarHBondContact O-CG 3.25Å; V197-E201 PolarHBondContact O-N 2.87Å; E198-E201 PolarHBondContact O-N 3.34Å; E201-M203 VanDerWaalsContact C-N 3.33Å; E201-M203 PolarHBondContact O-N 2.85Å; E201-E204 PolarHBondContact O-N 3.38Å; E201-S205 WeakPolarHBondContact O-CB 3.47Å; E201-S205 PolarHBondContact O-N 3.37Å |
| 202 | R | 98.3 | Very high | 98.1 | Very high | 136 Ų | 136 | 98.6 Ų | 98.6 | 51% | 0.513 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.5 | -42.8 | 175.4 | -72.3 | 173.9 | -167.7 | 118.5 | 5.1 | 111.3 | E198 L199 S205 M206 | E198-R202 VanDerWaalsContact O-CG 3.26Å; E198-R202 WeakPolarHBondContact O-CG 3.36Å; E198-R202 PolarHBondContact O-N 3.45Å; E198-R202 IonicContact OE2-CZ 3.75Å; E198-R202 IonicContact OE2-NH1 2.86Å; E198-R202 PolarHBondContact OE2-NH1 3.23Å; E198-R202 IonicContact OE2-NH2 3.6Å; E198-R202 PolarHBondContact OE2-NH2 3.4Å; L199-R202 PolarHBondContact O-N 3.26Å; R202-S205 PolarHBondContact O-N 2.86Å; R202-M206 VanDerWaalsContact O-CG 3.26Å; R202-M206 WeakPolarHBondContact O-CG 3.36Å; R202-M206 PolarHBondContact O-N 2.99Å |
| 203 | M | 98.3 | Very high | 98 | Very high | 103 Ų | 103 | 101.6 Ų | 101.6 | 51% | 0.507 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 175.1 | -78.2 | -165.6 | -60.5 | 0 | 0 | 112 | L199 E200 E201 K207 | L199-M203 WeakPolarHBondContact O-CB 3.35Å; L199-M203 WeakPolarHBondContact O-CG 3.23Å; L199-M203 PolarHBondContact O-N 2.97Å; E200-M203 HydrophobicContact CB-CE 4.49Å; E200-M203 HydrophobicContact CG-CE 4.07Å; E200-M203 WeakPolarHBondContact O-CB 3.41Å; E200-M203 PolarHBondContact O-N 3.39Å; E201-M203 VanDerWaalsContact C-N 3.33Å; E201-M203 PolarHBondContact O-N 2.85Å; M203-K207 WeakPolarHBondContact O-CB 3.44Å; M203-K207 VanDerWaalsContact O-CG 3.25Å; M203-K207 WeakPolarHBondContact O-CG 3.43Å; M203-K207 PolarHBondContact O-N 3.41Å |
| 204 | E | 98.1 | Very high | 98 | Very high | 135 Ų | 135 | 104.1 Ų | 104.1 | 63% | 0.631 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.3 | -40.8 | 177.5 | -72.9 | -172.8 | 170.7 | 0 | 0 | 112.2 | E200 E201 K207 A208 | E200-E204 WeakPolarHBondContact O-CG 3.41Å; E200-E204 PolarHBondContact O-N 2.86Å; E201-E204 PolarHBondContact O-N 3.38Å; E204-K207 PolarHBondContact O-N 2.87Å; E204-A208 WeakPolarHBondContact O-CB 3.46Å; E204-A208 PolarHBondContact O-N 3.19Å |
| 205 | S | 98.1 | Very high | 97.9 | Very high | 58 Ų | 58 | 102.7 Ų | 102.7 | 41% | 0.406 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.9 | -50.6 | 174 | -171.6 | 0 | 0 | 0 | 0 | 111.6 | E201 R202 K207 A208 E209 | E201-S205 WeakPolarHBondContact O-CB 3.47Å; E201-S205 PolarHBondContact O-N 3.37Å; R202-S205 PolarHBondContact O-N 2.86Å; S205-K207 VanDerWaalsContact C-N 3.3Å; S205-K207 PolarHBondContact O-N 3.24Å; S205-A208 WeakPolarHBondContact O-CB 3.43Å; S205-A208 PolarHBondContact O-N 2.92Å; S205-E209 PolarHBondContact O-N 2.86Å |
| 206 | M | 97.7 | Very high | 97.8 | Very high | 126 Ų | 126 | 107 Ų | 107 | 62% | 0.621 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.5 | -39.3 | 178 | -68.5 | -66.8 | -73 | 0 | 0 | 111.8 | R202 E209 L210 | R202-M206 VanDerWaalsContact O-CG 3.26Å; R202-M206 WeakPolarHBondContact O-CG 3.36Å; R202-M206 PolarHBondContact O-N 2.99Å; M206-E209 PolarHBondContact O-N 3.37Å; M206-L210 WeakPolarHBondContact O-CB 3.46Å; M206-L210 PolarHBondContact O-N 2.88Å |
| 207 | K | 98.1 | Very high | 97.7 | Very high | 114 Ų | 114 | 106.8 Ų | 106.8 | 50% | 0.496 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64 | -39.5 | 173.4 | -74.6 | 170.1 | -176.6 | 171.7 | 0 | 112 | M203 E204 S205 R211 | M203-K207 WeakPolarHBondContact O-CB 3.44Å; M203-K207 VanDerWaalsContact O-CG 3.25Å; M203-K207 WeakPolarHBondContact O-CG 3.43Å; M203-K207 PolarHBondContact O-N 3.41Å; E204-K207 PolarHBondContact O-N 2.87Å; S205-K207 VanDerWaalsContact C-N 3.3Å; S205-K207 PolarHBondContact O-N 3.24Å; K207-R211 WeakPolarHBondContact O-CG 3.45Å; K207-R211 PolarHBondContact O-N 2.93Å; K207-R211 VanDerWaalsContact O-N 3.16Å |
| 208 | A | 97.9 | Very high | 97.5 | Very high | 30 Ų | 30 | 108 Ų | 108 | 25% | 0.248 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -67.8 | -39.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | E204 S205 R211 R212 | E204-A208 WeakPolarHBondContact O-CB 3.46Å; E204-A208 PolarHBondContact O-N 3.19Å; S205-A208 WeakPolarHBondContact O-CB 3.43Å; S205-A208 PolarHBondContact O-N 2.92Å; A208-R211 PolarHBondContact O-N 3.04Å; A208-R212 WeakPolarHBondContact O-CG 3.2Å; A208-R212 PolarHBondContact O-N 2.92Å |
| 209 | E | 97.7 | Very high | 97.3 | Very high | 98 Ų | 98 | 109.8 Ų | 109.8 | 46% | 0.458 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.8 | -43.6 | 173.7 | -73.7 | 178.3 | -166.8 | 0 | 0 | 112.2 | S205 M206 R211 R212 L213 | S205-E209 PolarHBondContact O-N 2.86Å; M206-E209 PolarHBondContact O-N 3.37Å; E209-R211 PolarHBondContact O-N 3.29Å; E209-R212 WeakPolarHBondContact O-CB 3.31Å; E209-R212 PolarHBondContact O-N 3.47Å; E209-L213 WeakPolarHBondContact O-CB 3.48Å; E209-L213 PolarHBondContact O-N 3.48Å |
| 210 | L | 97.4 | Very high | 97.1 | Very high | 104 Ų | 104 | 108.7 Ų | 108.7 | 55% | 0.545 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -56.6 | -50.4 | 175.2 | -163.8 | 93 | 0 | 0 | 0 | 111.1 | M206 R212 L213 E214 | M206-L210 WeakPolarHBondContact O-CB 3.46Å; M206-L210 PolarHBondContact O-N 2.88Å; L210-R212 VanDerWaalsContact C-N 3.31Å; L210-R212 PolarHBondContact O-N 3.24Å; L210-L213 PolarHBondContact O-N 3.3Å; L210-L213 VanDerWaalsContact O-N 3.12Å; L210-E214 WeakPolarHBondContact O-CG 3.44Å; L210-E214 PolarHBondContact O-N 2.89Å |
| 211 | R | 97.4 | Very high | 96.8 | Very high | 163 Ų | 163 | 107.2 Ų | 107.2 | 62% | 0.615 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.4 | -38.9 | 177.2 | -68 | 178.8 | -148.7 | 146.8 | 3.7 | 112.4 | K207 A208 E209 S215 | K207-R211 WeakPolarHBondContact O-CG 3.45Å; K207-R211 PolarHBondContact O-N 2.93Å; K207-R211 VanDerWaalsContact O-N 3.16Å; A208-R211 PolarHBondContact O-N 3.04Å; E209-R211 PolarHBondContact O-N 3.29Å; R211-S215 WeakPolarHBondContact O-CB 3.38Å; R211-S215 PolarHBondContact O-N 3.48Å |
| 212 | R | 97.2 | Very high | 96.4 | Very high | 177 Ų | 177 | 108.9 Ų | 108.9 | 67% | 0.668 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.1 | -42.6 | 175.4 | -74.9 | 174.3 | -175.1 | 153.7 | 1.6 | 111.1 | A208 E209 L210 S215 R216 | A208-R212 WeakPolarHBondContact O-CG 3.2Å; A208-R212 PolarHBondContact O-N 2.92Å; E209-R212 WeakPolarHBondContact O-CB 3.31Å; E209-R212 PolarHBondContact O-N 3.47Å; L210-R212 VanDerWaalsContact C-N 3.31Å; L210-R212 PolarHBondContact O-N 3.24Å; R212-S215 PolarHBondContact O-N 2.91Å; R212-R216 VanDerWaalsContact O-CB 3.31Å; R212-R216 WeakPolarHBondContact O-CB 3.48Å; R212-R216 PolarHBondContact O-N 2.97Å |
| 213 | L | 97.5 | Very high | 96 | Very high | 117 Ų | 117 | 104.8 Ų | 104.8 | 61% | 0.613 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -67.2 | -42.1 | 179.3 | -170.7 | 65.9 | 0 | 0 | 0 | 111.6 | E209 L210 R216 H217 | E209-L213 WeakPolarHBondContact O-CB 3.48Å; E209-L213 PolarHBondContact O-N 3.48Å; L210-L213 PolarHBondContact O-N 3.3Å; L210-L213 VanDerWaalsContact O-N 3.12Å; L213-R216 PolarHBondContact O-N 3.32Å; L213-H217 VanDerWaalsContact O-CB 3.3Å; L213-H217 WeakPolarHBondContact O-CB 3.38Å; L213-H217 PolarHBondContact O-N 3.27Å |
| 214 | E | 96.9 | Very high | 95.5 | Very high | 106 Ų | 106 | 104.2 Ų | 104.2 | 50% | 0.495 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -58.4 | -50.7 | 173.1 | -72.5 | 170.2 | 167.6 | 0 | 0 | 111 | L210 R216 H217 E218 | L210-E214 WeakPolarHBondContact O-CG 3.44Å; L210-E214 PolarHBondContact O-N 2.89Å; E214-R216 VanDerWaalsContact C-N 3.34Å; E214-R216 PolarHBondContact O-N 3.35Å; E214-H217 PolarHBondContact O-N 3.41Å; E214-E218 WeakPolarHBondContact O-CG 3.49Å; E214-E218 PolarHBondContact O-N 3.27Å |
| 215 | S | 96.9 | Very high | 94.6 | Very high | 52 Ų | 52 | 106.4 Ų | 106.4 | 36% | 0.364 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -40.2 | 178.2 | -172 | 0 | 0 | 0 | 0 | 112.6 | R211 R212 E218 Q219 | R211-S215 WeakPolarHBondContact O-CB 3.38Å; R211-S215 PolarHBondContact O-N 3.48Å; R212-S215 PolarHBondContact O-N 2.91Å; S215-E218 PolarHBondContact O-N 3.26Å; S215-Q219 VanDerWaalsContact O-CG 3.26Å; S215-Q219 WeakPolarHBondContact O-CG 3.29Å; S215-Q219 PolarHBondContact O-N 3.41Å; S215-Q219 PolarHBondContact OG-NE2 3.32Å |
| 216 | R | 96.5 | Very high | 93.8 | Very high | 159 Ų | 159 | 107.6 Ų | 107.6 | 60% | 0.6 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65 | -44.5 | 175.6 | -177.1 | 177.9 | 177.6 | 171.2 | 2.8 | 111.3 | R212 L213 E214 E218 Q219 D220 | R212-R216 VanDerWaalsContact O-CB 3.31Å; R212-R216 WeakPolarHBondContact O-CB 3.48Å; R212-R216 PolarHBondContact O-N 2.97Å; L213-R216 PolarHBondContact O-N 3.32Å; E214-R216 VanDerWaalsContact C-N 3.34Å; E214-R216 PolarHBondContact O-N 3.35Å; R216-E218 VanDerWaalsContact C-N 3.34Å; R216-E218 PolarHBondContact O-N 3.09Å; R216-Q219 WeakPolarHBondContact O-CB 3.46Å; R216-Q219 PolarHBondContact O-N 2.89Å; R216-Q219 VanDerWaalsContact O-N 3.15Å; R216-D220 IonicContact NE-OD2 3.77Å; R216-D220 WeakPolarHBondContact O-CB 3.43Å; R216-D220 PolarHBondContact O-N 2.93Å |
| 217 | H | 96.2 | Very high | 92.9 | Very high | 119 Ų | 119 | 109.4 Ų | 109.4 | 55% | 0.551 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60 | -44.9 | 176.6 | 179.5 | 66.1 | 0 | 0 | 0 | 111.2 | L213 E214 Q219 D220 V221 | L213-H217 VanDerWaalsContact O-CB 3.3Å; L213-H217 WeakPolarHBondContact O-CB 3.38Å; L213-H217 PolarHBondContact O-N 3.27Å; E214-H217 PolarHBondContact O-N 3.41Å; H217-Q219 VanDerWaalsContact C-N 3.3Å; H217-Q219 PolarHBondContact O-N 2.9Å; H217-D220 PolarHBondContact O-N 3.37Å; H217-V221 VanDerWaalsContact CE1-CG2 3.46Å; H217-V221 WeakPolarHBondContact CE1-CG2 3.3Å; H217-V221 WeakPolarHBondContact O-CB 3.46Å; H217-V221 WeakPolarHBondContact O-CG2 3.37Å; H217-V221 PolarHBondContact O-N 2.89Å |
| 218 | E | 95.1 | Very high | 91.4 | Very high | 98 Ų | 98 | 109 Ų | 109 | 46% | 0.458 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.8 | -42.2 | 174 | -74 | -178.2 | -167.8 | 0 | 0 | 112.5 | E214 S215 R216 R222 | E214-E218 WeakPolarHBondContact O-CG 3.49Å; E214-E218 PolarHBondContact O-N 3.27Å; S215-E218 PolarHBondContact O-N 3.26Å; R216-E218 VanDerWaalsContact C-N 3.34Å; R216-E218 PolarHBondContact O-N 3.09Å; E218-R222 WeakPolarHBondContact O-CB 3.49Å; E218-R222 WeakPolarHBondContact O-CG 3.4Å; E218-R222 PolarHBondContact O-N 2.95Å; E218-R222 IonicContact OE2-CZ 3.91Å; E218-R222 IonicContact OE2-NH2 2.93Å; E218-R222 PolarHBondContact OE2-NH2 3.41Å |
| 219 | Q | 94.3 | Very high | 89.6 | Confident | 109 Ų | 109 | 112 Ų | 112 | 51% | 0.509 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.8 | -45.7 | 177.2 | -70 | 169.3 | 31.2 | 0 | 0 | 112 | S215 R216 H217 R222 A223 | S215-Q219 VanDerWaalsContact O-CG 3.26Å; S215-Q219 WeakPolarHBondContact O-CG 3.29Å; S215-Q219 PolarHBondContact O-N 3.41Å; S215-Q219 PolarHBondContact OG-NE2 3.32Å; R216-Q219 WeakPolarHBondContact O-CB 3.46Å; R216-Q219 PolarHBondContact O-N 2.89Å; R216-Q219 VanDerWaalsContact O-N 3.15Å; H217-Q219 VanDerWaalsContact C-N 3.3Å; H217-Q219 PolarHBondContact O-N 2.9Å; Q219-R222 WeakPolarHBondContact O-CB 3.34Å; Q219-R222 PolarHBondContact O-N 3.35Å; Q219-A223 WeakPolarHBondContact O-CB 3.37Å; Q219-A223 PolarHBondContact O-N 3.38Å |
| 220 | D | 93.1 | Very high | 87.8 | Confident | 78 Ų | 78 | 110.6 Ų | 110.6 | 42% | 0.417 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.3 | -41.3 | 179.5 | -74 | -19.3 | 0 | 0 | 0 | 111.1 | R216 H217 A223 L224 | R216-D220 IonicContact NE-OD2 3.77Å; R216-D220 WeakPolarHBondContact O-CB 3.43Å; R216-D220 PolarHBondContact O-N 2.93Å; H217-D220 PolarHBondContact O-N 3.37Å; D220-A223 PolarHBondContact O-N 3.41Å; D220-L224 WeakPolarHBondContact O-CB 3.28Å; D220-L224 WeakPolarHBondContact O-CG 3.36Å; D220-L224 PolarHBondContact O-N 3.36Å |
| 221 | V | 91.9 | Very high | 85.5 | Confident | 46 Ų | 46 | 114.9 Ų | 114.9 | 28% | 0.279 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -61.1 | -47.7 | 173.8 | 169.7 | 0 | 0 | 0 | 0 | 110.4 | H217 A223 L224 Y225 | H217-V221 VanDerWaalsContact CE1-CG2 3.46Å; H217-V221 WeakPolarHBondContact CE1-CG2 3.3Å; H217-V221 WeakPolarHBondContact O-CB 3.46Å; H217-V221 WeakPolarHBondContact O-CG2 3.37Å; H217-V221 PolarHBondContact O-N 2.89Å; V221-A223 VanDerWaalsContact C-N 3.31Å; V221-A223 PolarHBondContact O-N 3.38Å; V221-L224 PolarHBondContact O-N 2.85Å; V221-Y225 HydrophobicContact CG1-CD2 3.57Å; V221-Y225 HydrophobicContact CG1-CE2 3.41Å; V221-Y225 VanDerWaalsContact CG1-CE2 3.41Å; V221-Y225 WeakPolarHBondContact O-CD2 3.3Å; V221-Y225 PolarHBondContact O-N 3.01Å |
| 222 | R | 89.9 | Confident | 82.9 | Confident | 159 Ų | 159 | 114.4 Ų | 114.4 | 60% | 0.6 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -57.6 | -43.5 | 174.6 | -72.3 | 170.2 | -163.8 | 153.6 | 14.2 | 111.6 | E218 Q219 S226 | E218-R222 WeakPolarHBondContact O-CB 3.49Å; E218-R222 WeakPolarHBondContact O-CG 3.4Å; E218-R222 PolarHBondContact O-N 2.95Å; E218-R222 IonicContact OE2-CZ 3.91Å; E218-R222 IonicContact OE2-NH2 2.93Å; E218-R222 PolarHBondContact OE2-NH2 3.41Å; Q219-R222 WeakPolarHBondContact O-CB 3.34Å; Q219-R222 PolarHBondContact O-N 3.35Å; R222-S226 PolarHBondContact O-N 3.22Å |
| 223 | A | 89.7 | Confident | 80.6 | Confident | 50 Ų | 50 | 112.1 Ų | 112.1 | 41% | 0.413 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -66.2 | -43 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q219 D220 V221 S226 R227 | Q219-A223 WeakPolarHBondContact O-CB 3.37Å; Q219-A223 PolarHBondContact O-N 3.38Å; D220-A223 PolarHBondContact O-N 3.41Å; V221-A223 VanDerWaalsContact C-N 3.31Å; V221-A223 PolarHBondContact O-N 3.38Å; A223-S226 PolarHBondContact O-N 2.84Å; A223-S226 PolarHBondContact O-OG 2.88Å; A223-R227 PolarHBondContact O-N 2.69Å |
| 224 | L | 87.6 | Confident | 77.9 | Confident | 91 Ų | 91 | 114 Ų | 114 | 48% | 0.476 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -63.1 | -46.3 | 175.8 | -74.9 | 174.4 | 0 | 0 | 0 | 111.3 | D220 V221 S226 R227 T228 | D220-L224 WeakPolarHBondContact O-CB 3.28Å; D220-L224 WeakPolarHBondContact O-CG 3.36Å; D220-L224 PolarHBondContact O-N 3.36Å; V221-L224 PolarHBondContact O-N 2.85Å; L224-S226 PolarHBondContact O-N 2.92Å; L224-R227 PolarHBondContact O-N 3.12Å; L224-T228 PolarHBondContact O-N 2.96Å; L224-T228 PolarHBondContact O-OG1 3.41Å |
| 225 | Y | 79.9 | Confident | 75.2 | Confident | 180 Ų | 180 | 117.4 Ų | 117.4 | 71% | 0.706 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -56.1 | -38.9 | 173.5 | -82.7 | -66.7 | 0 | 0 | 0 | 112.1 | V221 A229 | V221-Y225 HydrophobicContact CG1-CD2 3.57Å; V221-Y225 HydrophobicContact CG1-CE2 3.41Å; V221-Y225 VanDerWaalsContact CG1-CE2 3.41Å; V221-Y225 WeakPolarHBondContact O-CD2 3.3Å; V221-Y225 PolarHBondContact O-N 3.01Å; Y225-A229 WeakPolarHBondContact O-CB 3.37Å; Y225-A229 PolarHBondContact O-N 3.41Å |
| 226 | S | 81 | Confident | 72.7 | Confident | 84 Ų | 84 | 121 Ų | 121 | 59% | 0.587 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -67.7 | -34.3 | 174.7 | 77.2 | 0 | 0 | 0 | 0 | 113.7 | R222 A223 L224 | R222-S226 PolarHBondContact O-N 3.22Å; A223-S226 PolarHBondContact O-N 2.84Å; A223-S226 PolarHBondContact O-OG 2.88Å; L224-S226 PolarHBondContact O-N 2.92Å |
| 227 | R | 77.9 | Confident | 69.7 | Low | 164 Ų | 164 | 121.4 Ų | 121.4 | 62% | 0.619 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -78.6 | -41.4 | -178.9 | -166.5 | 174.9 | 86.1 | 177.3 | 4.9 | 112.7 | A223 L224 A229 G230 R231 | A223-R227 PolarHBondContact O-N 2.69Å; L224-R227 PolarHBondContact O-N 3.12Å; R227-A229 PolarHBondContact O-N 3.47Å; R227-G230 PolarHBondContact O-N 3.09Å; R227-R231 PolarHBondContact O-N 2.94Å |
| 228 | T | 67.3 | Low | 67 | Low | 106 Ų | 106 | 119.9 Ų | 119.9 | 65% | 0.65 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -69.1 | -25.6 | 178.6 | -31.9 | 0 | 0 | 0 | 0 | 111.4 | L224 G230 | L224-T228 PolarHBondContact O-N 2.96Å; L224-T228 PolarHBondContact O-OG1 3.41Å; T228-G230 PolarHBondContact O-N 2.89Å |
| 229 | A | 61 | Low | 64.9 | Low | 92 Ų | 92 | 120.8 Ų | 120.8 | 76% | 0.76 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.7 | -9.9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 114 | Y225 R227 | Y225-A229 WeakPolarHBondContact O-CB 3.37Å; Y225-A229 PolarHBondContact O-N 3.41Å; R227-A229 PolarHBondContact O-N 3.47Å |
| 230 | G | 59.3 | Low | 62.4 | Low | 69 Ų | 69 | 122.2 Ų | 122.2 | 71% | 0.711 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.3 | 11.9 | -173.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | R227 T228 | R227-G230 PolarHBondContact O-N 3.09Å; T228-G230 PolarHBondContact O-N 2.89Å |
| 231 | R | 49.6 | Very low | 60.4 | Low | 193 Ų | 193 | 127.2 Ų | 127.2 | 73% | 0.728 | 70% | 0.7 | S | S | * | * | trans | -125.6 | 97.6 | -178.5 | -163.1 | 175.3 | -173.1 | -171.3 | 1.5 | 112.1 | R227 | R227-R231 PolarHBondContact O-N 2.94Š| ||
| 232 | D | 42.7 | Very low | 58.6 | Low | 154 Ų | 154 | 128.8 Ų | 128.8 | 82% | 0.824 | 71% | 0.71 | S | S | * | * | trans | -65.4 | 140.8 | 157.7 | -71.1 | -43.3 | 0 | 0 | 0 | 109.6 | D234 | D232-D234 PolarHBondContact O-N 3.42Š| ||
| 233 | V | 48.4 | Very low | 57.3 | Low | 129 Ų | 129 | 123.7 Ų | 123.7 | 78% | 0.782 | 71% | 0.707 | S | S | * | * | trans | -83.6 | 109.4 | -174.3 | 174.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 234 | D | 40.2 | Very low | 56.1 | Low | 155 Ų | 155 | 127.3 Ų | 127.3 | 83% | 0.829 | 72% | 0.719 | S | S | * | * | trans | -107.3 | 120.4 | 167.5 | -78.2 | -31.3 | 0 | 0 | 0 | 109.9 | D232 | D232-D234 PolarHBondContact O-N 3.42Š| ||
| 235 | E | 40.1 | Very low | 55 | Low | 179 Ų | 179 | 129.2 Ų | 129.2 | 84% | 0.836 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 126.9 | -179.3 | -162.7 | 156.7 | -159.4 | 0 | 0 | 108.8 | ||
| 236 | P | 44.6 | Very low | 54.4 | Low | 126 Ų | 126 | 129.6 Ų | 129.6 | 82% | 0.818 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 118.4 | -179 | 31.2 | -29.7 | 0 | 0 | 0 | 112.5 | ||
| 237 | D | 33.3 | Very low | 53.9 | Low | 168 Ų | 168 | 128.7 Ų | 128.7 | 90% | 0.898 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 139.2 | 164.2 | -87.8 | -37.2 | 0 | 0 | 0 | 112 | ||
| 238 | A | 40.3 | Very low | 53.7 | Low | 88 Ų | 88 | 125.3 Ų | 125.3 | 73% | 0.727 | 71% | 0.711 | S | S | * | * | trans | -90 | -176 | 162.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 239 | P | 51.8 | Low | 54.2 | Low | 117 Ų | 117 | 122.9 Ų | 122.9 | 76% | 0.76 | 70% | 0.702 | S | S | * | * | cis | -130.2 | 169.4 | -20.9 | 35.7 | -19 | 0 | 0 | 0 | 111.4 | ||||
| 240 | V | 40.8 | Very low | 55.1 | Low | 138 Ų | 138 | 124.4 Ų | 124.4 | 84% | 0.836 | 69% | 0.693 | S | S | * | * | trans | -137.7 | 129.3 | 162.7 | -176.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 241 | E | 51.6 | Low | 56.2 | Low | 184 Ų | 184 | 124.5 Ų | 124.5 | 86% | 0.86 | 68% | 0.676 | S | S | * | * | trans | -46.6 | 131 | 175.4 | -56.9 | 166.9 | 162 | 0 | 0 | 113.6 | ||||
| 242 | T | 53 | Low | 57.8 | Low | 78 Ų | 78 | 123.7 Ų | 123.7 | 48% | 0.479 | 67% | 0.673 | S | S | . | * | trans | -132.3 | 139 | 161.1 | 52.7 | 0 | 0 | 0 | 0 | 109 | I247 | T242-I247 WeakPolarHBondContact O-CD1 3.44Å; T242-I247 VanDerWaalsContact O-CG1 3.23Å; T242-I247 WeakPolarHBondContact O-CG1 3.41Å | ||
| 243 | G | 62.5 | Low | 59.8 | Low | 53 Ų | 53 | 119.2 Ų | 119.2 | 55% | 0.546 | 65% | 0.652 | S | S | . | * | trans | -51.4 | 141.5 | -170 | 0 | 0 | 0 | 0 | 0 | 113.5 | D245 R246 I247 | G243-D245 PolarHBondContact O-N 3.39Å; G243-R246 WeakPolarHBondContact O-CA 3.48Å; G243-R246 WeakPolarHBondContact O-CB 3.28Å; G243-R246 PolarHBondContact O-N 3.41Å; G243-I247 PolarHBondContact O-N 3.38Å | ||
| 244 | L | 64.7 | Low | 61.7 | Low | 126 Ų | 126 | 117.2 Ų | 117.2 | 66% | 0.66 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -47.9 | -34.9 | -173.8 | -157.4 | 80.7 | 0 | 0 | 0 | 112.9 | I247 L248 | L244-I247 CarbonylContact O-C 3.55Å; L244-I247 PolarHBondContact O-N 3.5Å; L244-L248 HydrophobicContact CD2-CD1 4.39Å; L244-L248 HydrophobicContact CG-CD1 4.24Å; L244-L248 VanDerWaalsContact O-CB 3.31Å; L244-L248 WeakPolarHBondContact O-CB 3.4Å; L244-L248 WeakPolarHBondContact O-CG 3.38Å; L244-L248 PolarHBondContact O-N 3.31Å |
| 245 | D | 64.6 | Low | 63.9 | Low | 131 Ų | 131 | 117 Ų | 117 | 70% | 0.701 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -73.2 | -33.7 | 179.5 | -59.1 | -34.2 | 0 | 0 | 0 | 113.4 | G243 A249 | G243-D245 PolarHBondContact O-N 3.39Å; D245-A249 WeakPolarHBondContact O-CB 3.49Å; D245-A249 PolarHBondContact O-N 3.21Å |
| 246 | R | 67.1 | Low | 66.2 | Low | 188 Ų | 188 | 113.1 Ų | 113.1 | 71% | 0.709 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -74.5 | -35.9 | 172.9 | -159.2 | 176.5 | 179.3 | 176.7 | -1.6 | 110.4 | G243 H250 | G243-R246 WeakPolarHBondContact O-CA 3.48Å; G243-R246 WeakPolarHBondContact O-CB 3.28Å; G243-R246 PolarHBondContact O-N 3.41Å; R246-H250 WeakPolarHBondContact O-CB 3.44Å; R246-H250 PolarHBondContact O-N 3.45Å |
| 247 | I | 70.3 | Confident | 68.3 | Low | 64 Ų | 64 | 113.6 Ų | 113.6 | 33% | 0.328 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -63.7 | -44.8 | 170.1 | -69.2 | 177.7 | 0 | 0 | 0 | 110.3 | T242 G243 L244 H250 I251 | T242-I247 WeakPolarHBondContact O-CD1 3.44Å; T242-I247 VanDerWaalsContact O-CG1 3.23Å; T242-I247 WeakPolarHBondContact O-CG1 3.41Å; G243-I247 PolarHBondContact O-N 3.38Å; L244-I247 CarbonylContact O-C 3.55Å; L244-I247 PolarHBondContact O-N 3.5Å; I247-H250 CarbonylContact O-C 3.54Å; I247-H250 PolarHBondContact O-N 3.33Å; I247-I251 HydrophobicContact CG2-CD1 3.46Å; I247-I251 VanDerWaalsContact CG2-CD1 3.46Å; I247-I251 HydrophobicContact CG2-CG1 4.07Å; I247-I251 VanDerWaalsContact O-CB 3.24Å; I247-I251 WeakPolarHBondContact O-CB 3.45Å; I247-I251 WeakPolarHBondContact O-CG1 3.3Å; I247-I251 PolarHBondContact O-N 2.92Å |
| 248 | L | 74.6 | Confident | 71 | Confident | 94 Ų | 94 | 108.8 Ų | 108.8 | 49% | 0.492 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.3 | -39.8 | 179.5 | -74.1 | 167.7 | 0 | 0 | 0 | 112 | L244 R252 | L244-L248 HydrophobicContact CD2-CD1 4.39Å; L244-L248 HydrophobicContact CG-CD1 4.24Å; L244-L248 VanDerWaalsContact O-CB 3.31Å; L244-L248 WeakPolarHBondContact O-CB 3.4Å; L244-L248 WeakPolarHBondContact O-CG 3.38Å; L244-L248 PolarHBondContact O-N 3.31Å; L248-R252 WeakPolarHBondContact O-CB 3.41Å; L248-R252 PolarHBondContact O-N 3.3Å |
| 249 | A | 77.1 | Confident | 73.2 | Confident | 55 Ų | 55 | 108.5 Ų | 108.5 | 46% | 0.455 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -67.4 | -38.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | D245 R252 T253 | D245-A249 WeakPolarHBondContact O-CB 3.49Å; D245-A249 PolarHBondContact O-N 3.21Å; A249-R252 PolarHBondContact O-N 3.37Å; A249-T253 WeakPolarHBondContact O-CG2 3.47Å; A249-T253 PolarHBondContact O-N 3.35Å; A249-T253 PolarHBondContact O-OG1 2.94Å |
| 250 | H | 80.3 | Confident | 75 | Confident | 123 Ų | 123 | 109.1 Ų | 109.1 | 57% | 0.569 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.5 | -42.2 | 174.3 | -174.3 | 61.5 | 0 | 0 | 0 | 111.8 | R246 I247 R252 T253 H254 | R246-H250 WeakPolarHBondContact O-CB 3.44Å; R246-H250 PolarHBondContact O-N 3.45Å; I247-H250 CarbonylContact O-C 3.54Å; I247-H250 PolarHBondContact O-N 3.33Å; H250-R252 VanDerWaalsContact C-N 3.31Å; H250-R252 PolarHBondContact O-N 3.4Å; H250-T253 WeakPolarHBondContact CA-OG1 3.37Å; H250-T253 PolarHBondContact O-N 3.45Å; H250-T253 PolarHBondContact O-OG1 3.36Å; H250-T253 VanDerWaalsContact O-OG1 3.09Å; H250-H254 WeakPolarHBondContact O-CA 3.32Å; H250-H254 WeakPolarHBondContact O-CB 3.3Å; H250-H254 PolarHBondContact O-N 3.43Å |
| 251 | I | 81.9 | Confident | 77.4 | Confident | 71 Ų | 71 | 110.6 Ų | 110.6 | 36% | 0.364 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -60.4 | -44.2 | 173.9 | -75 | 169.8 | 0 | 0 | 0 | 109.4 | I247 H254 W255 | I247-I251 HydrophobicContact CG2-CD1 3.46Å; I247-I251 VanDerWaalsContact CG2-CD1 3.46Å; I247-I251 HydrophobicContact CG2-CG1 4.07Å; I247-I251 VanDerWaalsContact O-CB 3.24Å; I247-I251 WeakPolarHBondContact O-CB 3.45Å; I247-I251 WeakPolarHBondContact O-CG1 3.3Å; I247-I251 PolarHBondContact O-N 2.92Å; I251-H254 PolarHBondContact O-N 2.98Å; I251-W255 WeakPolarHBondContact O-CB 3.33Å; I251-W255 PolarHBondContact O-N 2.9Å |
| 252 | R | 84.3 | Confident | 79.1 | Confident | 176 Ų | 176 | 106.7 Ų | 106.7 | 66% | 0.664 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.7 | -51.1 | 178.3 | -172.6 | 174.3 | -177 | 158.2 | 4.7 | 112.3 | L248 A249 H250 H254 W255 E256 | L248-R252 WeakPolarHBondContact O-CB 3.41Å; L248-R252 PolarHBondContact O-N 3.3Å; A249-R252 PolarHBondContact O-N 3.37Å; H250-R252 VanDerWaalsContact C-N 3.31Å; H250-R252 PolarHBondContact O-N 3.4Å; R252-H254 VanDerWaalsContact C-N 3.29Å; R252-H254 PolarHBondContact O-N 3.45Å; R252-W255 PolarHBondContact O-N 3.34Å; R252-E256 WeakPolarHBondContact CG-OE1 3.3Å; R252-E256 IonicContact NE-OE1 3.76Å; R252-E256 PolarHBondContact NE-OE1 3.42Å; R252-E256 WeakPolarHBondContact O-CB 3.41Å; R252-E256 WeakPolarHBondContact O-CG 3.22Å; R252-E256 PolarHBondContact O-N 3.45Å |
| 253 | T | 83.9 | Confident | 80.9 | Confident | 60 Ų | 60 | 110.6 Ų | 110.6 | 37% | 0.368 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.9 | -33.3 | 176.9 | 49.5 | 0 | 0 | 0 | 0 | 112.4 | A249 H250 Q257 | A249-T253 WeakPolarHBondContact O-CG2 3.47Å; A249-T253 PolarHBondContact O-N 3.35Å; A249-T253 PolarHBondContact O-OG1 2.94Å; H250-T253 WeakPolarHBondContact CA-OG1 3.37Å; H250-T253 PolarHBondContact O-N 3.45Å; H250-T253 PolarHBondContact O-OG1 3.36Å; H250-T253 VanDerWaalsContact O-OG1 3.09Å; T253-Q257 VanDerWaalsContact O-CB 3.32Å; T253-Q257 WeakPolarHBondContact O-CB 3.33Å; T253-Q257 WeakPolarHBondContact O-CG 3.25Å; T253-Q257 PolarHBondContact O-N 2.75Å |
| 254 | H | 87.8 | Confident | 82.2 | Confident | 88 Ų | 88 | 110.9 Ų | 110.9 | 41% | 0.407 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.7 | -43.1 | 173.7 | 176 | -87.3 | 0 | 0 | 0 | 111.8 | H250 I251 R252 Q257 L258 | H250-H254 WeakPolarHBondContact O-CA 3.32Å; H250-H254 WeakPolarHBondContact O-CB 3.3Å; H250-H254 PolarHBondContact O-N 3.43Å; I251-H254 PolarHBondContact O-N 2.98Å; R252-H254 VanDerWaalsContact C-N 3.29Å; R252-H254 PolarHBondContact O-N 3.45Å; H254-Q257 PolarHBondContact O-N 3.42Å; H254-L258 WeakPolarHBondContact O-CB 3.27Å; H254-L258 PolarHBondContact O-N 3.2Å |
| 255 | W | 88.4 | Confident | 83.4 | Confident | 150 Ų | 150 | 109.2 Ų | 109.2 | 57% | 0.568 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67.2 | -41 | 174.3 | -78.3 | 115.3 | 0 | 0 | 0 | 111.5 | I251 R252 L258 T259 | I251-W255 WeakPolarHBondContact O-CB 3.33Å; I251-W255 PolarHBondContact O-N 2.9Å; R252-W255 PolarHBondContact O-N 3.34Å; W255-L258 HydrophobicContact CE3-CD2 3.89Å; W255-L258 HydrophobicContact CZ3-CD2 3.72Å; W255-L258 PolarHBondContact O-N 2.89Å; W255-T259 WeakPolarHBondContact O-CB 3.39Å; W255-T259 VanDerWaalsContact O-CG2 3.31Å; W255-T259 WeakPolarHBondContact O-CG2 3.36Å; W255-T259 PolarHBondContact O-N 2.9Å; W255-T259 PolarHBondContact O-OG1 2.92Å |
| 256 | E | 87.1 | Confident | 84.4 | Confident | 98 Ų | 98 | 105.9 Ų | 105.9 | 46% | 0.458 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60 | -46.8 | 174.4 | -74.9 | 167.1 | -174.3 | 0 | 0 | 110.8 | R252 L258 T259 E260 | R252-E256 WeakPolarHBondContact CG-OE1 3.3Å; R252-E256 IonicContact NE-OE1 3.76Å; R252-E256 PolarHBondContact NE-OE1 3.42Å; R252-E256 WeakPolarHBondContact O-CB 3.41Å; R252-E256 WeakPolarHBondContact O-CG 3.22Å; R252-E256 PolarHBondContact O-N 3.45Å; E256-L258 PolarHBondContact O-N 3.39Å; E256-T259 WeakPolarHBondContact CA-OG1 3.46Å; E256-T259 PolarHBondContact O-N 2.95Å; E256-T259 PolarHBondContact O-OG1 2.93Å; E256-E260 WeakPolarHBondContact O-CB 3.46Å; E256-E260 PolarHBondContact O-N 3.22Å |
| 257 | Q | 88.9 | Confident | 85.4 | Confident | 135 Ų | 135 | 100.3 Ų | 100.3 | 63% | 0.631 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.4 | -39.3 | 174.3 | -74.9 | 172.8 | 17.3 | 0 | 0 | 112.8 | T253 H254 E260 R261 | T253-Q257 VanDerWaalsContact O-CB 3.32Å; T253-Q257 WeakPolarHBondContact O-CB 3.33Å; T253-Q257 WeakPolarHBondContact O-CG 3.25Å; T253-Q257 PolarHBondContact O-N 2.75Å; H254-Q257 PolarHBondContact O-N 3.42Å; Q257-E260 PolarHBondContact O-N 2.9Å; Q257-R261 WeakPolarHBondContact O-CB 3.45Å; Q257-R261 PolarHBondContact O-N 3.35Å |
| 258 | L | 89.4 | Confident | 86.2 | Confident | 67 Ų | 67 | 98.8 Ų | 98.8 | 35% | 0.351 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.9 | -37.9 | 178.9 | -171.4 | 66.2 | 0 | 0 | 0 | 110.7 | H254 W255 E256 N262 | H254-L258 WeakPolarHBondContact O-CB 3.27Å; H254-L258 PolarHBondContact O-N 3.2Å; W255-L258 HydrophobicContact CE3-CD2 3.89Å; W255-L258 HydrophobicContact CZ3-CD2 3.72Å; W255-L258 PolarHBondContact O-N 2.89Å; E256-L258 PolarHBondContact O-N 3.39Å; L258-N262 WeakPolarHBondContact O-CB 3.25Å; L258-N262 PolarHBondContact O-N 3.19Å |
| 259 | T | 86.6 | Confident | 86.7 | Confident | 83 Ų | 83 | 101 Ų | 101 | 51% | 0.509 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68.6 | -40.7 | 174.4 | 50.1 | 0 | 0 | 0 | 0 | 111.7 | W255 E256 N262 R263 | W255-T259 WeakPolarHBondContact O-CB 3.39Å; W255-T259 VanDerWaalsContact O-CG2 3.31Å; W255-T259 WeakPolarHBondContact O-CG2 3.36Å; W255-T259 PolarHBondContact O-N 2.9Å; W255-T259 PolarHBondContact O-OG1 2.92Å; E256-T259 WeakPolarHBondContact CA-OG1 3.46Å; E256-T259 PolarHBondContact O-N 2.95Å; E256-T259 PolarHBondContact O-OG1 2.93Å; T259-N262 PolarHBondContact O-N 3.47Å; T259-R263 VanDerWaalsContact O-CB 3.3Å; T259-R263 WeakPolarHBondContact O-CB 3.41Å; T259-R263 PolarHBondContact O-N 3.04Å |
| 260 | E | 89.9 | Confident | 87 | Confident | 130 Ų | 130 | 102.6 Ų | 102.6 | 61% | 0.607 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -67 | -42.3 | 177 | -158.9 | 68.7 | -155.2 | 0 | 0 | 110.8 | E256 Q257 R263 A264 | E256-E260 WeakPolarHBondContact O-CB 3.46Å; E256-E260 PolarHBondContact O-N 3.22Å; Q257-E260 PolarHBondContact O-N 2.9Å; E260-R263 PolarHBondContact O-N 3.46Å; E260-A264 WeakPolarHBondContact O-CB 3.34Å; E260-A264 PolarHBondContact O-N 3.33Å |
| 261 | R | 90.6 | Very high | 87.2 | Confident | 168 Ų | 168 | 103.2 Ų | 103.2 | 63% | 0.634 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.1 | -43.8 | 174.3 | -178.4 | 178.1 | 173.6 | 175.7 | 1.7 | 111.7 | Q257 R263 A264 D265 | Q257-R261 WeakPolarHBondContact O-CB 3.45Å; Q257-R261 PolarHBondContact O-N 3.35Å; R261-R263 VanDerWaalsContact C-N 3.27Å; R261-R263 PolarHBondContact O-N 3.16Å; R261-A264 PolarHBondContact O-N 2.92Å; R261-D265 IonicContact NE-OD2 3.35Å; R261-D265 VanDerWaalsContact O-CB 3.24Å; R261-D265 WeakPolarHBondContact O-CB 3.41Å; R261-D265 PolarHBondContact O-N 3.5Å |
| 262 | N | 88.8 | Confident | 87.1 | Confident | 102 Ų | 102 | 103.3 Ų | 103.3 | 55% | 0.545 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.9 | -39.4 | 177.2 | -157.3 | -87.3 | 0 | 0 | 0 | 110.5 | L258 T259 D265 T266 | L258-N262 WeakPolarHBondContact O-CB 3.25Å; L258-N262 PolarHBondContact O-N 3.19Å; T259-N262 PolarHBondContact O-N 3.47Å; N262-D265 PolarHBondContact O-N 3.26Å; N262-T266 WeakPolarHBondContact O-CB 3.42Å; N262-T266 VanDerWaalsContact O-CG2 3.27Å; N262-T266 WeakPolarHBondContact O-CG2 3.4Å; N262-T266 PolarHBondContact O-N 2.99Å; N262-T266 PolarHBondContact O-OG1 3.18Å; N262-T266 VanDerWaalsContact O-OG1 3.08Å |
| 263 | R | 89.6 | Confident | 86.8 | Confident | 160 Ų | 160 | 100.6 Ų | 100.6 | 60% | 0.604 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.7 | -47.9 | 174.1 | -172.9 | 178.8 | -179.6 | 140.3 | 2.9 | 112.2 | T259 E260 R261 D265 T266 D267 | T259-R263 VanDerWaalsContact O-CB 3.3Å; T259-R263 WeakPolarHBondContact O-CB 3.41Å; T259-R263 PolarHBondContact O-N 3.04Å; E260-R263 PolarHBondContact O-N 3.46Å; R261-R263 VanDerWaalsContact C-N 3.27Å; R261-R263 PolarHBondContact O-N 3.16Å; R263-D265 VanDerWaalsContact C-N 3.34Å; R263-D265 PolarHBondContact O-N 3.06Å; R263-T266 WeakPolarHBondContact CA-OG1 3.17Å; R263-T266 PolarHBondContact O-N 3.5Å; R263-T266 PolarHBondContact O-OG1 2.86Å; R263-D267 WeakPolarHBondContact O-CB 3.23Å; R263-D267 PolarHBondContact O-N 3.33Å |
| 264 | A | 90.6 | Very high | 86.2 | Confident | 59 Ų | 59 | 103.3 Ų | 103.3 | 49% | 0.488 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.8 | -38.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | E260 R261 D267 G268 | E260-A264 WeakPolarHBondContact O-CB 3.34Å; E260-A264 PolarHBondContact O-N 3.33Å; R261-A264 PolarHBondContact O-N 2.92Å; A264-D267 PolarHBondContact O-N 2.89Å; A264-G268 PolarHBondContact O-N 2.7Å |
| 265 | D | 90 | Very high | 85.2 | Confident | 91 Ų | 91 | 101.9 Ų | 101.9 | 49% | 0.487 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.7 | -37.7 | 175.8 | -71 | -18.7 | 0 | 0 | 0 | 110.8 | R261 N262 R263 Y269 | R261-D265 IonicContact NE-OD2 3.35Å; R261-D265 VanDerWaalsContact O-CB 3.24Å; R261-D265 WeakPolarHBondContact O-CB 3.41Å; R261-D265 PolarHBondContact O-N 3.5Å; N262-D265 PolarHBondContact O-N 3.26Å; R263-D265 VanDerWaalsContact C-N 3.34Å; R263-D265 PolarHBondContact O-N 3.06Å; D265-Y269 WeakPolarHBondContact O-CB 3.45Å; D265-Y269 PolarHBondContact O-N 3.45Å |
| 266 | T | 86 | Confident | 84 | Confident | 61 Ų | 61 | 98.6 Ų | 98.6 | 37% | 0.374 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69.8 | -41.5 | 173.7 | 52.8 | 0 | 0 | 0 | 0 | 112.1 | N262 R263 Y269 L270 | N262-T266 WeakPolarHBondContact O-CB 3.42Å; N262-T266 VanDerWaalsContact O-CG2 3.27Å; N262-T266 WeakPolarHBondContact O-CG2 3.4Å; N262-T266 PolarHBondContact O-N 2.99Å; N262-T266 PolarHBondContact O-OG1 3.18Å; N262-T266 VanDerWaalsContact O-OG1 3.08Å; R263-T266 WeakPolarHBondContact CA-OG1 3.17Å; R263-T266 PolarHBondContact O-N 3.5Å; R263-T266 PolarHBondContact O-OG1 2.86Å; T266-Y269 PolarHBondContact O-N 3.47Å; T266-L270 WeakPolarHBondContact O-CB 3.39Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.3Å; T266-L270 PolarHBondContact O-N 3.38Å |
| 267 | D | 86.9 | Confident | 82.7 | Confident | 72 Ų | 72 | 98.7 Ų | 98.7 | 39% | 0.385 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.1 | -43.5 | 177.9 | -69.1 | -14.7 | 0 | 0 | 0 | 109.4 | R263 A264 Y269 L270 E271 | R263-D267 WeakPolarHBondContact O-CB 3.23Å; R263-D267 PolarHBondContact O-N 3.33Å; A264-D267 PolarHBondContact O-N 2.89Å; D267-Y269 PolarHBondContact O-N 3.36Å; D267-L270 PolarHBondContact O-N 3.42Å; D267-E271 WeakPolarHBondContact O-CB 3.39Å; D267-E271 WeakPolarHBondContact O-CG 3.19Å; D267-E271 PolarHBondContact O-N 3.35Å |
| 268 | G | 87.1 | Confident | 81.2 | Confident | 32 Ų | 32 | 96.5 Ų | 96.5 | 33% | 0.33 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.7 | -33.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114 | A264 S272 | A264-G268 PolarHBondContact O-N 2.7Å; G268-S272 VanDerWaalsContact O-CB 3.25Å; G268-S272 WeakPolarHBondContact O-CB 3.49Å; G268-S272 PolarHBondContact O-N 3.13Å; G268-S272 PolarHBondContact O-OG 2.89Å |
| 269 | Y | 86.4 | Confident | 79.6 | Confident | 140 Ų | 140 | 96.8 Ų | 96.8 | 55% | 0.549 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -68.7 | -39.9 | 172.4 | 179.9 | -98.9 | 0 | 0 | 0 | 111.8 | D265 T266 D267 S272 K273 | D265-Y269 WeakPolarHBondContact O-CB 3.45Å; D265-Y269 PolarHBondContact O-N 3.45Å; T266-Y269 PolarHBondContact O-N 3.47Å; D267-Y269 PolarHBondContact O-N 3.36Å; Y269-S272 WeakPolarHBondContact CA-OG 3.34Å; Y269-S272 PolarHBondContact O-OG 3.49Å; Y269-K273 HydrophobicContact CD1-CG 4.44Å; Y269-K273 HydrophobicContact CE1-CG 4.08Å; Y269-K273 HydrophobicContact CE2-CG 4.36Å; Y269-K273 WeakPolarHBondContact O-CB 3.49Å; Y269-K273 VanDerWaalsContact O-CG 3.26Å; Y269-K273 WeakPolarHBondContact O-CG 3.49Å; Y269-K273 PolarHBondContact O-N 2.95Å; Y269-K273 VanDerWaalsContact OH-CE 3.29Å; Y269-K273 WeakPolarHBondContact OH-CE 3.19Å |
| 270 | L | 83.1 | Confident | 78 | Confident | 88 Ų | 88 | 96.5 Ų | 96.5 | 46% | 0.461 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -67.1 | -48 | 174.3 | -71.4 | 174.1 | 0 | 0 | 0 | 110.5 | T266 D267 S272 K273 E274 | T266-L270 WeakPolarHBondContact O-CB 3.39Å; T266-L270 VanDerWaalsContact O-CG 3.26Å; T266-L270 WeakPolarHBondContact O-CG 3.3Å; T266-L270 PolarHBondContact O-N 3.38Å; D267-L270 PolarHBondContact O-N 3.42Å; L270-S272 VanDerWaalsContact C-N 3.33Å; L270-S272 PolarHBondContact O-N 3.36Å; L270-K273 CarbonylContact O-C 3.59Å; L270-K273 PolarHBondContact O-N 2.86Å; L270-K273 VanDerWaalsContact O-N 3.08Å; L270-E274 VanDerWaalsContact O-CB 3.28Å; L270-E274 WeakPolarHBondContact O-CB 3.42Å; L270-E274 VanDerWaalsContact O-CG 3.28Å; L270-E274 WeakPolarHBondContact O-CG 3.21Å; L270-E274 PolarHBondContact O-N 2.89Å |
| 271 | E | 83.1 | Confident | 76.4 | Confident | 137 Ų | 137 | 100.6 Ų | 100.6 | 64% | 0.64 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -59.8 | -40.3 | 176 | -75.2 | 178.3 | 176.6 | 0 | 0 | 112.3 | D267 K273 E274 A275 | D267-E271 WeakPolarHBondContact O-CB 3.39Å; D267-E271 WeakPolarHBondContact O-CG 3.19Å; D267-E271 PolarHBondContact O-N 3.35Å; E271-K273 VanDerWaalsContact C-N 3.33Å; E271-K273 PolarHBondContact O-N 3.08Å; E271-E274 PolarHBondContact O-N 3.24Å; E271-A275 WeakPolarHBondContact O-CB 3.45Å; E271-A275 PolarHBondContact O-N 2.93Å |
| 272 | S | 80.9 | Confident | 75 | Confident | 73 Ų | 73 | 96.4 Ų | 96.4 | 51% | 0.51 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -72.7 | -21.9 | 176.3 | 60.3 | 0 | 0 | 0 | 0 | 114.1 | G268 Y269 L270 P276 | G268-S272 VanDerWaalsContact O-CB 3.25Å; G268-S272 WeakPolarHBondContact O-CB 3.49Å; G268-S272 PolarHBondContact O-N 3.13Å; G268-S272 PolarHBondContact O-OG 2.89Å; Y269-S272 WeakPolarHBondContact CA-OG 3.34Å; Y269-S272 PolarHBondContact O-OG 3.49Å; L270-S272 VanDerWaalsContact C-N 3.33Å; L270-S272 PolarHBondContact O-N 3.36Å; S272-P276 WeakPolarHBondContact O-CD 3.39Å; S272-P276 WeakPolarHBondContact O-CG 3.39Å |
| 273 | K | 77.3 | Confident | 74.2 | Confident | 118 Ų | 118 | 94 Ų | 94 | 51% | 0.513 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -85.1 | -34.2 | 170.7 | -75.8 | -71.7 | -178.2 | -177.8 | 0 | 112.6 | Y269 L270 E271 P276 | Y269-K273 HydrophobicContact CD1-CG 4.44Å; Y269-K273 HydrophobicContact CE1-CG 4.08Å; Y269-K273 HydrophobicContact CE2-CG 4.36Å; Y269-K273 WeakPolarHBondContact O-CB 3.49Å; Y269-K273 VanDerWaalsContact O-CG 3.26Å; Y269-K273 WeakPolarHBondContact O-CG 3.49Å; Y269-K273 PolarHBondContact O-N 2.95Å; Y269-K273 VanDerWaalsContact OH-CE 3.29Å; Y269-K273 WeakPolarHBondContact OH-CE 3.19Å; L270-K273 CarbonylContact O-C 3.59Å; L270-K273 PolarHBondContact O-N 2.86Å; L270-K273 VanDerWaalsContact O-N 3.08Å; E271-K273 VanDerWaalsContact C-N 3.33Å; E271-K273 PolarHBondContact O-N 3.08Å; K273-P276 WeakPolarHBondContact O-CD 3.46Å; K273-P276 WeakPolarHBondContact O-CG 3.5Å |
| 274 | E | 71.3 | Confident | 73.7 | Confident | 117 Ų | 117 | 89.6 Ų | 89.6 | 55% | 0.547 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -79.1 | -34.1 | 178.5 | -72.5 | 180 | -178.1 | 0 | 0 | 111.7 | L270 E271 C277 A278 | L270-E274 VanDerWaalsContact O-CB 3.28Å; L270-E274 WeakPolarHBondContact O-CB 3.42Å; L270-E274 VanDerWaalsContact O-CG 3.28Å; L270-E274 WeakPolarHBondContact O-CG 3.21Å; L270-E274 PolarHBondContact O-N 2.89Å; E271-E274 PolarHBondContact O-N 3.24Å; E274-C277 CarbonylContact O-C 3.58Å; E274-C277 PolarHBondContact O-N 3.29Å; E274-C277 VanDerWaalsContact O-N 3.07Å; E274-A278 VanDerWaalsContact O-CB 3.3Å; E274-A278 WeakPolarHBondContact O-CB 3.4Å; E274-A278 PolarHBondContact O-N 3.11Å |
| 275 | A | 67.1 | Low | 73.1 | Confident | 58 Ų | 58 | 93.8 Ų | 93.8 | 48% | 0.479 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -54 | -47.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | E271 A279 | E271-A275 WeakPolarHBondContact O-CB 3.45Å; E271-A275 PolarHBondContact O-N 2.93Å; A275-A279 WeakPolarHBondContact O-CB 3.45Å; A275-A279 PolarHBondContact O-N 3.44Å |
| 276 | P | 63.7 | Low | 72.9 | Confident | 82 Ų | 82 | 94.2 Ų | 94.2 | 53% | 0.532 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -72.1 | -26.7 | 174.5 | 24.6 | -31.3 | 0 | 0 | 0 | 113.6 | S272 K273 S280 | S272-P276 WeakPolarHBondContact O-CD 3.39Å; S272-P276 WeakPolarHBondContact O-CG 3.39Å; K273-P276 WeakPolarHBondContact O-CD 3.46Å; K273-P276 WeakPolarHBondContact O-CG 3.5Å; P276-S280 VanDerWaalsContact O-CB 3.27Å; P276-S280 WeakPolarHBondContact O-CB 3.48Å; P276-S280 PolarHBondContact O-N 3.1Å |
| 277 | C | 60.4 | Low | 72.9 | Confident | 100 Ų | 100 | 96.5 Ų | 96.5 | 68% | 0.676 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -77.5 | -35.7 | 175.2 | -85.5 | 0 | 0 | 0 | 0 | 113.2 | E274 S280 | E274-C277 CarbonylContact O-C 3.58Å; E274-C277 PolarHBondContact O-N 3.29Å; E274-C277 VanDerWaalsContact O-N 3.07Å; C277-S280 WeakPolarHBondContact O-CB 3.46Å |
| 278 | A | 57.5 | Low | 73 | Confident | 88 Ų | 88 | 99 Ų | 99 | 73% | 0.727 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -80.4 | -29.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | E274 S280 | E274-A278 VanDerWaalsContact O-CB 3.3Å; E274-A278 WeakPolarHBondContact O-CB 3.4Å; E274-A278 PolarHBondContact O-N 3.11Å; A278-S280 VanDerWaalsContact C-N 3.34Å |
| 279 | A | 54.5 | Low | 73.2 | Confident | 74 Ų | 74 | 99.4 Ų | 99.4 | 61% | 0.612 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -84.5 | -5.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A275 R281 | A275-A279 WeakPolarHBondContact O-CB 3.45Å; A275-A279 PolarHBondContact O-N 3.44Å; A279-R281 PolarHBondContact O-N 2.86Å |
| 280 | S | 53.2 | Low | 73.4 | Confident | 76 Ų | 76 | 97.8 Ų | 97.8 | 53% | 0.531 | 55% | 0.546 | S | S | . | . | trans | -69.2 | 62 | 164.8 | 174 | 0 | 0 | 0 | 0 | 109.8 | P276 C277 A278 L282 | P276-S280 VanDerWaalsContact O-CB 3.27Å; P276-S280 WeakPolarHBondContact O-CB 3.48Å; P276-S280 PolarHBondContact O-N 3.1Å; C277-S280 WeakPolarHBondContact O-CB 3.46Å; A278-S280 VanDerWaalsContact C-N 3.34Å; S280-L282 PolarHBondContact O-N 3.16Å | ||
| 281 | R | 57 | Low | 73.9 | Confident | 217 Ų | 217 | 95.9 Ų | 95.9 | 82% | 0.819 | 54% | 0.543 | S | S | * | . | trans | -52.2 | 125.3 | 141.9 | -68.3 | 176.1 | 171 | 179.6 | -3.6 | 104.9 | A279 S283 | A279-R281 PolarHBondContact O-N 2.86Å; R281-S283 PolarHBondContact O-N 3.13Å; R281-S283 VanDerWaalsContact O-N 3.1Å | ||
| 282 | L | 60 | Low | 74.4 | Confident | 80 Ų | 80 | 94.2 Ų | 94.2 | 42% | 0.419 | 54% | 0.537 | S | S | . | . | trans | -23.6 | 116.4 | 175.5 | -63.2 | 167.6 | 0 | 0 | 0 | 109.5 | S280 A284 E286 Q287 | S280-L282 PolarHBondContact O-N 3.16Å; L282-A284 PolarHBondContact O-N 2.91Å; L282-E286 WeakPolarHBondContact CA-OE2 2.8Å; L282-E286 HydrophobicContact CB-CB 4.09Å; L282-E286 HydrophobicContact CD2-CB 4.49Å; L282-E286 WeakPolarHBondContact CD2-OE2 3.34Å; L282-Q287 HydrophobicContact CB-CG 4.09Å; L282-Q287 PolarHBondContact O-NE2 3.44Å; L282-Q287 VanDerWaalsContact O-NE2 3.1Å | ||
| 283 | S | 73.6 | Confident | 75.1 | Confident | 52 Ų | 52 | 97.7 Ų | 97.7 | 36% | 0.364 | 54% | 0.543 | S | S | . | . | trans | -45.2 | 144.4 | -179.2 | 152.8 | 0 | 0 | 0 | 0 | 108.6 | R281 E285 E286 Q287 | R281-S283 PolarHBondContact O-N 3.13Å; R281-S283 VanDerWaalsContact O-N 3.1Å; S283-E285 PolarHBondContact O-N 2.89Å; S283-E285 WeakPolarHBondContact OG-CB 3.3Å; S283-E285 PolarHBondContact OG-N 2.96Å; S283-E286 PolarHBondContact N-OE2 2.82Å; S283-E286 WeakPolarHBondContact O-CA 3.39Å; S283-E286 WeakPolarHBondContact O-CB 3.25Å; S283-E286 PolarHBondContact O-N 2.91Å; S283-Q287 PolarHBondContact O-N 3.36Å | ||
| 284 | A | 77.9 | Confident | 76 | Confident | 67 Ų | 67 | 94.3 Ų | 94.3 | 55% | 0.554 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -50.3 | -28.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | L282 Q288 | L282-A284 PolarHBondContact O-N 2.91Å; A284-Q288 VanDerWaalsContact O-CG 3.27Å; A284-Q288 WeakPolarHBondContact O-CG 3.27Å; A284-Q288 PolarHBondContact O-N 3.19Å; A284-Q288 VanDerWaalsContact O-N 3.07Å |
| 285 | E | 79.1 | Confident | 77.2 | Confident | 147 Ų | 147 | 94.2 Ų | 94.2 | 69% | 0.687 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -69.2 | -37.3 | 174.1 | -55.4 | 177 | 159.4 | 0 | 0 | 113.4 | S283 Q288 A289 | S283-E285 PolarHBondContact O-N 2.89Å; S283-E285 WeakPolarHBondContact OG-CB 3.3Å; S283-E285 PolarHBondContact OG-N 2.96Å; E285-Q288 PolarHBondContact O-N 3.35Å; E285-A289 VanDerWaalsContact O-CB 3.31Å; E285-A289 WeakPolarHBondContact O-CB 3.49Å; E285-A289 PolarHBondContact O-N 3.46Å |
| 286 | E | 84.6 | Confident | 78.7 | Confident | 99 Ų | 99 | 95.4 Ų | 95.4 | 46% | 0.463 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.9 | -40.9 | 174 | -96.1 | 173.9 | 151.5 | 0 | 0 | 111.6 | L282 S283 A289 E290 | L282-E286 WeakPolarHBondContact CA-OE2 2.8Å; L282-E286 HydrophobicContact CB-CB 4.09Å; L282-E286 HydrophobicContact CD2-CB 4.49Å; L282-E286 WeakPolarHBondContact CD2-OE2 3.34Å; S283-E286 PolarHBondContact N-OE2 2.82Å; S283-E286 WeakPolarHBondContact O-CA 3.39Å; S283-E286 WeakPolarHBondContact O-CB 3.25Å; S283-E286 PolarHBondContact O-N 2.91Å; E286-A289 PolarHBondContact O-N 3.09Å; E286-E290 WeakPolarHBondContact O-CG 3.43Å; E286-E290 PolarHBondContact O-N 2.94Å |
| 287 | Q | 86.3 | Confident | 80.3 | Confident | 109 Ų | 109 | 94.2 Ų | 94.2 | 51% | 0.509 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.2 | -41 | 176.4 | -64.3 | 176.8 | 17.5 | 0 | 0 | 111.5 | L282 S283 E290 A291 | L282-Q287 HydrophobicContact CB-CG 4.09Å; L282-Q287 PolarHBondContact O-NE2 3.44Å; L282-Q287 VanDerWaalsContact O-NE2 3.1Å; S283-Q287 PolarHBondContact O-N 3.36Å; Q287-E290 PolarHBondContact O-N 3.35Å; Q287-A291 WeakPolarHBondContact O-CB 3.48Å; Q287-A291 PolarHBondContact O-N 2.92Å |
| 288 | Q | 89.1 | Confident | 82 | Confident | 126 Ų | 126 | 93.4 Ų | 93.4 | 59% | 0.589 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.4 | -40.8 | 172.9 | -73.8 | 174.6 | -1.1 | 0 | 0 | 111.6 | A284 E285 E290 A291 L292 | A284-Q288 VanDerWaalsContact O-CG 3.27Å; A284-Q288 WeakPolarHBondContact O-CG 3.27Å; A284-Q288 PolarHBondContact O-N 3.19Å; A284-Q288 VanDerWaalsContact O-N 3.07Å; E285-Q288 PolarHBondContact O-N 3.35Å; Q288-E290 VanDerWaalsContact C-N 3.34Å; Q288-E290 PolarHBondContact O-N 3.33Å; Q288-A291 PolarHBondContact O-N 2.87Å; Q288-L292 VanDerWaalsContact O-CG 3.31Å; Q288-L292 WeakPolarHBondContact O-CG 3.46Å; Q288-L292 PolarHBondContact O-N 3.31Å |
| 289 | A | 90.6 | Very high | 83.9 | Confident | 40 Ų | 40 | 92.5 Ų | 92.5 | 33% | 0.331 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.7 | -37.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | E285 E286 K293 | E285-A289 VanDerWaalsContact O-CB 3.31Å; E285-A289 WeakPolarHBondContact O-CB 3.49Å; E285-A289 PolarHBondContact O-N 3.46Å; E286-A289 PolarHBondContact O-N 3.09Å; A289-K293 WeakPolarHBondContact O-CB 3.35Å; A289-K293 WeakPolarHBondContact O-CD 3.36Å; A289-K293 WeakPolarHBondContact O-CG 3.44Å; A289-K293 PolarHBondContact O-N 3.26Å |
| 290 | E | 91.3 | Very high | 86 | Confident | 106 Ų | 106 | 91.8 Ų | 91.8 | 50% | 0.495 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.4 | -41.1 | 173.4 | -73.7 | -178.2 | 172 | 0 | 0 | 112.3 | E286 Q287 Q288 K293 A294 | E286-E290 WeakPolarHBondContact O-CG 3.43Å; E286-E290 PolarHBondContact O-N 2.94Å; Q287-E290 PolarHBondContact O-N 3.35Å; Q288-E290 VanDerWaalsContact C-N 3.34Å; Q288-E290 PolarHBondContact O-N 3.33Å; E290-K293 PolarHBondContact O-N 2.99Å; E290-A294 PolarHBondContact O-N 3.32Å |
| 291 | A | 92.7 | Very high | 88.1 | Confident | 48 Ų | 48 | 91.8 Ų | 91.8 | 40% | 0.397 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.6 | -47.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q287 Q288 K293 A294 E295 | Q287-A291 WeakPolarHBondContact O-CB 3.48Å; Q287-A291 PolarHBondContact O-N 2.92Å; Q288-A291 PolarHBondContact O-N 2.87Å; A291-K293 VanDerWaalsContact C-N 3.33Å; A291-K293 PolarHBondContact O-N 3.44Å; A291-A294 WeakPolarHBondContact O-CB 3.29Å; A291-A294 PolarHBondContact O-N 3.41Å; A291-A294 VanDerWaalsContact O-N 3.14Å; A291-E295 WeakPolarHBondContact O-CG 3.48Å; A291-E295 PolarHBondContact O-N 2.98Å |
| 292 | L | 94.9 | Very high | 90 | Very high | 101 Ų | 101 | 89.1 Ų | 89.1 | 53% | 0.529 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.9 | -35.7 | 177.1 | -69.4 | 174 | 0 | 0 | 0 | 112.8 | Q288 E295 C296 | Q288-L292 VanDerWaalsContact O-CG 3.31Å; Q288-L292 WeakPolarHBondContact O-CG 3.46Å; Q288-L292 PolarHBondContact O-N 3.31Å; L292-E295 PolarHBondContact O-N 3.39Å; L292-C296 WeakPolarHBondContact O-CB 3.47Å; L292-C296 PolarHBondContact O-N 3.22Å; L292-C296 PolarHBondContact O-SG 3.36Å |
| 293 | K | 96 | Very high | 91.8 | Very high | 146 Ų | 146 | 89.3 Ų | 89.3 | 64% | 0.635 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.2 | -42.7 | 172.2 | -76 | 168.4 | -173.5 | 170.7 | 0 | 111.6 | A289 E290 A291 C296 S297 | A289-K293 WeakPolarHBondContact O-CB 3.35Å; A289-K293 WeakPolarHBondContact O-CD 3.36Å; A289-K293 WeakPolarHBondContact O-CG 3.44Å; A289-K293 PolarHBondContact O-N 3.26Å; E290-K293 PolarHBondContact O-N 2.99Å; A291-K293 VanDerWaalsContact C-N 3.33Å; A291-K293 PolarHBondContact O-N 3.44Å; K293-C296 PolarHBondContact O-N 2.94Å; K293-S297 PolarHBondContact O-N 3.36Å |
| 294 | A | 95.5 | Very high | 92.9 | Very high | 47 Ų | 47 | 92.8 Ų | 92.8 | 39% | 0.388 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | E290 A291 C296 S297 D298 | E290-A294 PolarHBondContact O-N 3.32Å; A291-A294 WeakPolarHBondContact O-CB 3.29Å; A291-A294 PolarHBondContact O-N 3.41Å; A291-A294 VanDerWaalsContact O-N 3.14Å; A294-C296 VanDerWaalsContact C-N 3.35Å; A294-C296 PolarHBondContact O-N 3.43Å; A294-S297 PolarHBondContact O-N 2.81Å; A294-S297 VanDerWaalsContact O-N 3.09Å; A294-S297 PolarHBondContact O-OG 3.02Å; A294-D298 PolarHBondContact O-N 3.5Å |
| 295 | E | 97.1 | Very high | 93.7 | Very high | 115 Ų | 115 | 92.5 Ų | 92.5 | 54% | 0.537 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.5 | -42.5 | 175.4 | -71.7 | 176.8 | -172.2 | 0 | 0 | 112.4 | A291 L292 S297 D298 V299 | A291-E295 WeakPolarHBondContact O-CG 3.48Å; A291-E295 PolarHBondContact O-N 2.98Å; L292-E295 PolarHBondContact O-N 3.39Å; E295-S297 VanDerWaalsContact C-N 3.31Å; E295-S297 PolarHBondContact O-N 2.84Å; E295-D298 PolarHBondContact O-N 2.89Å; E295-V299 WeakPolarHBondContact O-CB 3.37Å; E295-V299 VanDerWaalsContact O-CG2 3.3Å; E295-V299 WeakPolarHBondContact O-CG2 3.45Å; E295-V299 PolarHBondContact O-N 2.9Å |
| 296 | C | 97.3 | Very high | 94.5 | Very high | 83 Ų | 83 | 90.4 Ų | 90.4 | 56% | 0.561 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.2 | -37.9 | 175.2 | -74.9 | 0 | 0 | 0 | 0 | 112 | L292 K293 A294 S300 | L292-C296 WeakPolarHBondContact O-CB 3.47Å; L292-C296 PolarHBondContact O-N 3.22Å; L292-C296 PolarHBondContact O-SG 3.36Å; K293-C296 PolarHBondContact O-N 2.94Å; A294-C296 VanDerWaalsContact C-N 3.35Å; A294-C296 PolarHBondContact O-N 3.43Å; C296-S300 WeakPolarHBondContact O-CB 3.44Å; C296-S300 PolarHBondContact O-N 3.33Å; C296-S300 PolarHBondContact O-OG 2.92Å |
| 297 | S | 97.2 | Very high | 95 | Very high | 58 Ų | 58 | 90.5 Ų | 90.5 | 41% | 0.406 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -68 | -40.2 | 175.4 | 74 | 0 | 0 | 0 | 0 | 112 | K293 A294 E295 S300 C301 | K293-S297 PolarHBondContact O-N 3.36Å; A294-S297 PolarHBondContact O-N 2.81Å; A294-S297 VanDerWaalsContact O-N 3.09Å; A294-S297 PolarHBondContact O-OG 3.02Å; E295-S297 VanDerWaalsContact C-N 3.31Å; E295-S297 PolarHBondContact O-N 2.84Å; S297-S300 WeakPolarHBondContact O-CB 3.31Å; S297-S300 PolarHBondContact O-N 2.7Å; S297-C301 PolarHBondContact O-N 3.01Å; S297-C301 PolarHBondContact O-SG 3.18Å |
| 298 | D | 97.4 | Very high | 95.4 | Very high | 82 Ų | 82 | 87.9 Ų | 87.9 | 44% | 0.439 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.9 | -45 | 176.7 | -77.5 | -8.6 | 0 | 0 | 0 | 111.6 | A294 E295 S300 C301 R302 | A294-D298 PolarHBondContact O-N 3.5Å; E295-D298 PolarHBondContact O-N 2.89Å; D298-S300 VanDerWaalsContact C-N 3.31Å; D298-S300 PolarHBondContact O-N 2.99Å; D298-C301 PolarHBondContact O-N 3.5Å; D298-R302 WeakPolarHBondContact O-CG 3.27Å; D298-R302 PolarHBondContact O-N 3.19Å |
| 299 | V | 97.3 | Very high | 95.7 | Very high | 70 Ų | 70 | 86.6 Ų | 86.6 | 42% | 0.424 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.4 | -41.2 | 174.8 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | E295 C301 R302 I303 | E295-V299 WeakPolarHBondContact O-CB 3.37Å; E295-V299 VanDerWaalsContact O-CG2 3.3Å; E295-V299 WeakPolarHBondContact O-CG2 3.45Å; E295-V299 PolarHBondContact O-N 2.9Å; V299-C301 PolarHBondContact O-N 3.22Å; V299-R302 PolarHBondContact O-N 3.42Å; V299-I303 HydrophobicContact CG1-CD1 3.9Å; V299-I303 HydrophobicContact CG1-CG1 4.41Å; V299-I303 VanDerWaalsContact O-CG1 3.3Å; V299-I303 WeakPolarHBondContact O-CG1 3.35Å; V299-I303 PolarHBondContact O-N 2.96Å |
| 300 | S | 97.5 | Very high | 95.7 | Very high | 59 Ų | 59 | 87.4 Ų | 87.4 | 41% | 0.413 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62 | -42.8 | 175.9 | -61.5 | 0 | 0 | 0 | 0 | 112.1 | C296 S297 D298 I303 Q304 | C296-S300 WeakPolarHBondContact O-CB 3.44Å; C296-S300 PolarHBondContact O-N 3.33Å; C296-S300 PolarHBondContact O-OG 2.92Å; S297-S300 WeakPolarHBondContact O-CB 3.31Å; S297-S300 PolarHBondContact O-N 2.7Å; D298-S300 VanDerWaalsContact C-N 3.31Å; D298-S300 PolarHBondContact O-N 2.99Å; S300-I303 PolarHBondContact O-N 2.96Å; S300-Q304 WeakPolarHBondContact O-CG 3.3Å; S300-Q304 PolarHBondContact O-N 3.28Å |
| 301 | C | 97.7 | Very high | 95.9 | Very high | 75 Ų | 75 | 88.1 Ų | 88.1 | 51% | 0.507 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.7 | -41.8 | 174.1 | -72.1 | 0 | 0 | 0 | 0 | 112 | S297 D298 V299 Q304 S305 | S297-C301 PolarHBondContact O-N 3.01Å; S297-C301 PolarHBondContact O-SG 3.18Å; D298-C301 PolarHBondContact O-N 3.5Å; V299-C301 PolarHBondContact O-N 3.22Å; C301-Q304 PolarHBondContact O-N 2.9Å; C301-S305 PolarHBondContact O-N 3.45Å |
| 302 | R | 97.1 | Very high | 95.9 | Very high | 161 Ų | 161 | 89.4 Ų | 89.4 | 61% | 0.608 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.2 | -42.9 | 175.5 | -71.5 | 172.5 | -166.1 | 163.1 | 8 | 111.8 | D298 V299 Q304 S305 L306 | D298-R302 WeakPolarHBondContact O-CG 3.27Å; D298-R302 PolarHBondContact O-N 3.19Å; V299-R302 PolarHBondContact O-N 3.42Å; R302-Q304 VanDerWaalsContact C-N 3.33Å; R302-Q304 PolarHBondContact O-N 2.85Å; R302-S305 PolarHBondContact O-N 3.44Å; R302-L306 WeakPolarHBondContact O-CG 3.29Å; R302-L306 PolarHBondContact O-N 3.43Å |
| 303 | I | 97.3 | Very high | 95.7 | Very high | 84 Ų | 84 | 89.9 Ų | 89.9 | 43% | 0.431 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.7 | -45.8 | 175.5 | -70.7 | 166.9 | 0 | 0 | 0 | 110.3 | V299 S300 S305 L306 Q307 | V299-I303 HydrophobicContact CG1-CD1 3.9Å; V299-I303 HydrophobicContact CG1-CG1 4.41Å; V299-I303 VanDerWaalsContact O-CG1 3.3Å; V299-I303 WeakPolarHBondContact O-CG1 3.35Å; V299-I303 PolarHBondContact O-N 2.96Å; S300-I303 PolarHBondContact O-N 2.96Å; I303-S305 PolarHBondContact O-N 2.88Å; I303-L306 PolarHBondContact O-N 3.38Å; I303-Q307 HydrophobicContact CG2-CG 4.36Å; I303-Q307 WeakPolarHBondContact O-CB 3.35Å; I303-Q307 VanDerWaalsContact O-CG 3.25Å; I303-Q307 WeakPolarHBondContact O-CG 3.36Å; I303-Q307 PolarHBondContact O-N 3.36Å |
| 304 | Q | 96.3 | Very high | 95.4 | Very high | 125 Ų | 125 | 89.4 Ų | 89.4 | 58% | 0.584 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.6 | -40.5 | 177.7 | -71 | 173.6 | 18.6 | 0 | 0 | 112.3 | S300 C301 R302 Q307 A308 | S300-Q304 WeakPolarHBondContact O-CG 3.3Å; S300-Q304 PolarHBondContact O-N 3.28Å; C301-Q304 PolarHBondContact O-N 2.9Å; R302-Q304 VanDerWaalsContact C-N 3.33Å; R302-Q304 PolarHBondContact O-N 2.85Å; Q304-Q307 PolarHBondContact O-N 2.97Å; Q304-A308 WeakPolarHBondContact O-CB 3.46Å; Q304-A308 PolarHBondContact O-N 2.87Å |
| 305 | S | 96.3 | Very high | 95.2 | Very high | 61 Ų | 61 | 89.3 Ų | 89.3 | 43% | 0.427 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.2 | -50.1 | 174.7 | -169 | 0 | 0 | 0 | 0 | 111.4 | C301 R302 I303 Q307 A308 E309 | C301-S305 PolarHBondContact O-N 3.45Å; R302-S305 PolarHBondContact O-N 3.44Å; I303-S305 PolarHBondContact O-N 2.88Å; S305-Q307 VanDerWaalsContact C-N 3.31Å; S305-Q307 PolarHBondContact O-N 3.22Å; S305-A308 PolarHBondContact O-N 2.79Å; S305-E309 WeakPolarHBondContact O-CG 3.4Å; S305-E309 PolarHBondContact O-N 3.22Å; S305-E309 PolarHBondContact OG-OE1 3.37Å |
| 306 | L | 94.8 | Very high | 94.9 | Very high | 103 Ų | 103 | 89.1 Ų | 89.1 | 54% | 0.539 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.2 | -38.1 | 178 | -69.6 | 173.3 | 0 | 0 | 0 | 111.6 | R302 I303 E309 T310 | R302-L306 WeakPolarHBondContact O-CG 3.29Å; R302-L306 PolarHBondContact O-N 3.43Å; I303-L306 PolarHBondContact O-N 3.38Å; L306-E309 PolarHBondContact O-N 2.82Å; L306-T310 WeakPolarHBondContact O-CG2 3.37Å; L306-T310 PolarHBondContact O-N 2.81Å; L306-T310 PolarHBondContact O-OG1 3.22Å |
| 307 | Q | 95.8 | Very high | 94.5 | Very high | 101 Ų | 101 | 91 Ų | 91 | 47% | 0.472 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.8 | -48.7 | 173.7 | -77 | 173 | -10.1 | 0 | 0 | 111.2 | I303 Q304 S305 E309 T310 E311 | I303-Q307 HydrophobicContact CG2-CG 4.36Å; I303-Q307 WeakPolarHBondContact O-CB 3.35Å; I303-Q307 VanDerWaalsContact O-CG 3.25Å; I303-Q307 WeakPolarHBondContact O-CG 3.36Å; I303-Q307 PolarHBondContact O-N 3.36Å; Q304-Q307 PolarHBondContact O-N 2.97Å; S305-Q307 VanDerWaalsContact C-N 3.31Å; S305-Q307 PolarHBondContact O-N 3.22Å; Q307-E309 VanDerWaalsContact C-N 3.34Å; Q307-E309 PolarHBondContact O-N 3.46Å; Q307-T310 PolarHBondContact O-N 3.45Å; Q307-T310 PolarHBondContact O-OG1 3.44Å; Q307-E311 WeakPolarHBondContact O-CG 3.46Å; Q307-E311 PolarHBondContact O-N 2.91Å |
| 308 | A | 93.8 | Very high | 94.2 | Very high | 55 Ų | 55 | 94.9 Ų | 94.9 | 46% | 0.455 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.6 | -41.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q304 S305 E311 S312 | Q304-A308 WeakPolarHBondContact O-CB 3.46Å; Q304-A308 PolarHBondContact O-N 2.87Å; S305-A308 PolarHBondContact O-N 2.79Å; A308-E311 PolarHBondContact O-N 3.42Å; A308-S312 WeakPolarHBondContact O-CB 3.33Å; A308-S312 PolarHBondContact O-N 3.26Å |
| 309 | E | 95.5 | Very high | 93.8 | Very high | 99 Ų | 99 | 92.8 Ų | 92.8 | 46% | 0.463 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.1 | -46.8 | 174.3 | -74.7 | 171 | -150.9 | 0 | 0 | 111.5 | S305 L306 Q307 E311 S312 I313 | S305-E309 WeakPolarHBondContact O-CG 3.4Å; S305-E309 PolarHBondContact O-N 3.22Å; S305-E309 PolarHBondContact OG-OE1 3.37Å; L306-E309 PolarHBondContact O-N 2.82Å; Q307-E309 VanDerWaalsContact C-N 3.34Å; Q307-E309 PolarHBondContact O-N 3.46Å; E309-E311 VanDerWaalsContact C-N 3.32Å; E309-E311 PolarHBondContact O-N 3.39Å; E309-S312 PolarHBondContact O-N 2.9Å; E309-S312 PolarHBondContact O-OG 3.32Å; E309-I313 WeakPolarHBondContact O-CG1 3.22Å; E309-I313 PolarHBondContact O-N 3.42Å |
| 310 | T | 92.2 | Very high | 93.4 | Very high | 57 Ų | 57 | 94.8 Ų | 94.8 | 35% | 0.35 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.6 | -37.9 | 177.7 | 66 | 0 | 0 | 0 | 0 | 112.1 | L306 Q307 R314 | L306-T310 WeakPolarHBondContact O-CG2 3.37Å; L306-T310 PolarHBondContact O-N 2.81Å; L306-T310 PolarHBondContact O-OG1 3.22Å; Q307-T310 PolarHBondContact O-N 3.45Å; Q307-T310 PolarHBondContact O-OG1 3.44Å; T310-R314 WeakPolarHBondContact O-CB 3.35Å; T310-R314 VanDerWaalsContact O-CG 3.23Å; T310-R314 WeakPolarHBondContact O-CG 3.27Å; T310-R314 PolarHBondContact O-N 2.85Å; T310-R314 PolarHBondContact OG1-NH1 2.84Å |
| 311 | E | 95 | Very high | 93 | Very high | 120 Ų | 120 | 96.3 Ų | 96.3 | 56% | 0.561 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -66.6 | -39.9 | 175.2 | -73.2 | 176.7 | -173.8 | 0 | 0 | 111.9 | Q307 A308 E309 R314 A315 | Q307-E311 WeakPolarHBondContact O-CG 3.46Å; Q307-E311 PolarHBondContact O-N 2.91Å; A308-E311 PolarHBondContact O-N 3.42Å; E309-E311 VanDerWaalsContact C-N 3.32Å; E309-E311 PolarHBondContact O-N 3.39Å; E311-R314 PolarHBondContact O-N 3.49Å; E311-A315 WeakPolarHBondContact O-CB 3.36Å; E311-A315 PolarHBondContact O-N 3.43Å |
| 312 | S | 91.8 | Very high | 92.7 | Very high | 76 Ų | 76 | 97.4 Ų | 97.4 | 53% | 0.531 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.9 | -44.5 | 175.8 | 104.5 | 0 | 0 | 0 | 0 | 111.4 | A308 E309 R314 A315 L316 | A308-S312 WeakPolarHBondContact O-CB 3.33Å; A308-S312 PolarHBondContact O-N 3.26Å; E309-S312 PolarHBondContact O-N 2.9Å; E309-S312 PolarHBondContact O-OG 3.32Å; S312-R314 PolarHBondContact O-N 2.93Å; S312-A315 WeakPolarHBondContact O-CB 3.49Å; S312-A315 PolarHBondContact O-N 3.27Å; S312-A315 VanDerWaalsContact O-N 3.13Å; S312-L316 PolarHBondContact O-N 2.96Å |
| 313 | I | 91.3 | Very high | 92.3 | Very high | 110 Ų | 110 | 93.3 Ų | 93.3 | 56% | 0.564 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -65 | -41 | 176.9 | -66.4 | 167.1 | 0 | 0 | 0 | 110.3 | E309 A315 L316 K317 | E309-I313 WeakPolarHBondContact O-CG1 3.22Å; E309-I313 PolarHBondContact O-N 3.42Å; I313-A315 VanDerWaalsContact C-N 3.3Å; I313-A315 PolarHBondContact O-N 3.48Å; I313-L316 PolarHBondContact O-N 3.43Å; I313-K317 WeakPolarHBondContact O-CB 3.18Å; I313-K317 PolarHBondContact O-N 3.2Å |
| 314 | R | 90.3 | Very high | 91.8 | Very high | 136 Ų | 136 | 93.3 Ų | 93.3 | 51% | 0.513 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.2 | -37 | 173.5 | -73.8 | 179.3 | -160.8 | 105.9 | 2.1 | 112 | T310 E311 S312 R318 | T310-R314 WeakPolarHBondContact O-CB 3.35Å; T310-R314 VanDerWaalsContact O-CG 3.23Å; T310-R314 WeakPolarHBondContact O-CG 3.27Å; T310-R314 PolarHBondContact O-N 2.85Å; T310-R314 PolarHBondContact OG1-NH1 2.84Å; E311-R314 PolarHBondContact O-N 3.49Å; S312-R314 PolarHBondContact O-N 2.93Å; R314-R318 WeakPolarHBondContact O-CG 3.38Å; R314-R318 PolarHBondContact O-N 2.82Å; R314-R318 VanDerWaalsContact O-N 3.08Å; R314-R318 PolarHBondContact O-NE 3.42Å |
| 315 | A | 90.8 | Very high | 91.4 | Very high | 45 Ų | 45 | 90.9 Ų | 90.9 | 37% | 0.372 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.9 | -42.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | E311 S312 I313 R318 G319 | E311-A315 WeakPolarHBondContact O-CB 3.36Å; E311-A315 PolarHBondContact O-N 3.43Å; S312-A315 WeakPolarHBondContact O-CB 3.49Å; S312-A315 PolarHBondContact O-N 3.27Å; S312-A315 VanDerWaalsContact O-N 3.13Å; I313-A315 VanDerWaalsContact C-N 3.3Å; I313-A315 PolarHBondContact O-N 3.48Å; A315-R318 PolarHBondContact O-N 2.91Å; A315-G319 PolarHBondContact O-N 2.91Å |
| 316 | L | 91.1 | Very high | 91.2 | Very high | 111 Ų | 111 | 92.4 Ų | 92.4 | 58% | 0.581 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.8 | -46.9 | 174.4 | 179.8 | 63.6 | 0 | 0 | 0 | 111.2 | S312 I313 R318 G319 L320 | S312-L316 PolarHBondContact O-N 2.96Å; I313-L316 PolarHBondContact O-N 3.43Å; L316-R318 PolarHBondContact O-N 3.01Å; L316-G319 WeakPolarHBondContact O-CA 3.41Å; L316-G319 PolarHBondContact O-N 3.01Å; L316-G319 VanDerWaalsContact O-N 3.09Å; L316-L320 HydrophobicContact CD1-CD1 4.5Å; L316-L320 HydrophobicContact CD1-CG 4.39Å; L316-L320 HydrophobicContact CG-CD1 4.24Å; L316-L320 WeakPolarHBondContact O-CG 3.47Å; L316-L320 PolarHBondContact O-N 2.92Å |
| 317 | K | 88.6 | Confident | 90.9 | Very high | 124 Ų | 124 | 89.4 Ų | 89.4 | 54% | 0.539 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -55.4 | -50.3 | 175.7 | 177.4 | 177.1 | 170 | 176.8 | 0 | 111.3 | I313 G319 L320 E321 | I313-K317 WeakPolarHBondContact O-CB 3.18Å; I313-K317 PolarHBondContact O-N 3.2Å; K317-G319 VanDerWaalsContact C-N 3.28Å; K317-G319 PolarHBondContact O-N 3.35Å; K317-L320 PolarHBondContact O-N 3.44Å; K317-E321 WeakPolarHBondContact CE-OE1 3.41Å; K317-E321 HydrophobicContact CG-CG 4.38Å; K317-E321 IonicContact NZ-OE1 2.9Å; K317-E321 WeakPolarHBondContact O-CB 3.48Å; K317-E321 WeakPolarHBondContact O-CG 3.43Å; K317-E321 PolarHBondContact O-N 2.88Å |
| 318 | R | 90.7 | Very high | 90.6 | Very high | 138 Ų | 138 | 91.6 Ų | 91.6 | 52% | 0.521 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.9 | -40.3 | 175.7 | -77.7 | -179.5 | -88.9 | 115.4 | -6.9 | 112.2 | R314 A315 L316 N322 | R314-R318 WeakPolarHBondContact O-CG 3.38Å; R314-R318 PolarHBondContact O-N 2.82Å; R314-R318 VanDerWaalsContact O-N 3.08Å; R314-R318 PolarHBondContact O-NE 3.42Å; A315-R318 PolarHBondContact O-N 2.91Å; L316-R318 PolarHBondContact O-N 3.01Å; R318-N322 WeakPolarHBondContact O-CB 3.48Å; R318-N322 PolarHBondContact O-N 3.21Å; R318-N322 PolarHBondContact O-ND2 2.91Å; R318-N322 PolarHBondContact O-OD1 3.35Å |
| 319 | G | 88.1 | Confident | 90.5 | Very high | 39 Ų | 39 | 94.3 Ų | 94.3 | 40% | 0.402 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | A315 L316 K317 N322 S323 | A315-G319 PolarHBondContact O-N 2.91Å; L316-G319 WeakPolarHBondContact O-CA 3.41Å; L316-G319 PolarHBondContact O-N 3.01Å; L316-G319 VanDerWaalsContact O-N 3.09Å; K317-G319 VanDerWaalsContact C-N 3.28Å; K317-G319 PolarHBondContact O-N 3.35Å; G319-N322 PolarHBondContact O-N 3.4Å; G319-S323 PolarHBondContact O-N 3.17Å |
| 320 | L | 88.8 | Confident | 90.4 | Very high | 112 Ų | 112 | 98 Ų | 98 | 59% | 0.586 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -68.1 | -40.4 | 177.2 | -67.7 | 175.6 | 0 | 0 | 0 | 112.1 | L316 K317 S323 L324 | L316-L320 HydrophobicContact CD1-CD1 4.5Å; L316-L320 HydrophobicContact CD1-CG 4.39Å; L316-L320 HydrophobicContact CG-CD1 4.24Å; L316-L320 WeakPolarHBondContact O-CG 3.47Å; L316-L320 PolarHBondContact O-N 2.92Å; K317-L320 PolarHBondContact O-N 3.44Å; L320-S323 PolarHBondContact O-N 2.95Å; L320-L324 WeakPolarHBondContact O-CB 3.33Å; L320-L324 PolarHBondContact O-N 3.41Å |
| 321 | E | 90.6 | Very high | 90.3 | Very high | 90 Ų | 90 | 101.3 Ų | 101.3 | 42% | 0.421 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.4 | -45.5 | 174.4 | -73.8 | 171.3 | 161.4 | 0 | 0 | 111.1 | K317 L324 T325 | K317-E321 WeakPolarHBondContact CE-OE1 3.41Å; K317-E321 HydrophobicContact CG-CG 4.38Å; K317-E321 IonicContact NZ-OE1 2.9Å; K317-E321 WeakPolarHBondContact O-CB 3.48Å; K317-E321 WeakPolarHBondContact O-CG 3.43Å; K317-E321 PolarHBondContact O-N 2.88Å; E321-L324 WeakPolarHBondContact O-CB 3.35Å; E321-L324 PolarHBondContact O-N 3.5Å; E321-T325 WeakPolarHBondContact O-CG2 3.5Å; E321-T325 PolarHBondContact O-N 3.24Å; E321-T325 PolarHBondContact O-OG1 3.43Å |
| 322 | N | 90.1 | Very high | 90.3 | Very high | 98 Ų | 98 | 100.3 Ų | 100.3 | 52% | 0.524 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.2 | -44.9 | 176 | -69.3 | -9.8 | 0 | 0 | 0 | 112 | R318 G319 L324 T325 D326 | R318-N322 WeakPolarHBondContact O-CB 3.48Å; R318-N322 PolarHBondContact O-N 3.21Å; R318-N322 PolarHBondContact O-ND2 2.91Å; R318-N322 PolarHBondContact O-OD1 3.35Å; G319-N322 PolarHBondContact O-N 3.4Å; N322-L324 PolarHBondContact O-N 3.31Å; N322-T325 WeakPolarHBondContact CA-OG1 3.4Å; N322-T325 PolarHBondContact O-N 2.87Å; N322-T325 PolarHBondContact O-OG1 3.49Å; N322-D326 WeakPolarHBondContact O-CB 3.31Å; N322-D326 VanDerWaalsContact O-CG 3.22Å; N322-D326 PolarHBondContact O-N 3.14Å |
| 323 | S | 88.3 | Confident | 90.3 | Very high | 75 Ų | 75 | 98.7 Ų | 98.7 | 52% | 0.524 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.9 | -35.4 | 176.6 | -176.4 | 0 | 0 | 0 | 0 | 112.1 | G319 L320 A327 | G319-S323 PolarHBondContact O-N 3.17Å; L320-S323 PolarHBondContact O-N 2.95Å; S323-A327 WeakPolarHBondContact O-CB 3.44Å; S323-A327 PolarHBondContact O-N 2.93Å |
| 324 | L | 87.8 | Confident | 90.6 | Very high | 85 Ų | 85 | 98.1 Ų | 98.1 | 45% | 0.445 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -69.3 | -42.9 | 175.9 | 179.2 | 65.6 | 0 | 0 | 0 | 111.4 | L320 E321 N322 D326 A327 R328 | L320-L324 WeakPolarHBondContact O-CB 3.33Å; L320-L324 PolarHBondContact O-N 3.41Å; E321-L324 WeakPolarHBondContact O-CB 3.35Å; E321-L324 PolarHBondContact O-N 3.5Å; N322-L324 PolarHBondContact O-N 3.31Å; L324-D326 VanDerWaalsContact C-N 3.33Å; L324-A327 PolarHBondContact O-N 3.3Å; L324-R328 WeakPolarHBondContact O-CB 3.29Å; L324-R328 VanDerWaalsContact O-CG 3.29Å; L324-R328 WeakPolarHBondContact O-CG 3.48Å; L324-R328 PolarHBondContact O-N 2.93Å |
| 325 | T | 88.5 | Confident | 90.8 | Very high | 74 Ų | 74 | 97 Ų | 97 | 45% | 0.454 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.2 | -39.4 | 175.9 | 52.3 | 0 | 0 | 0 | 0 | 111.7 | E321 N322 R328 H329 | E321-T325 WeakPolarHBondContact O-CG2 3.5Å; E321-T325 PolarHBondContact O-N 3.24Å; E321-T325 PolarHBondContact O-OG1 3.43Å; N322-T325 WeakPolarHBondContact CA-OG1 3.4Å; N322-T325 PolarHBondContact O-N 2.87Å; N322-T325 PolarHBondContact O-OG1 3.49Å; T325-R328 PolarHBondContact O-N 3.43Å; T325-H329 WeakPolarHBondContact O-CB 3.24Å; T325-H329 PolarHBondContact O-N 3.44Å |
| 326 | D | 91.2 | Very high | 91 | Very high | 92 Ų | 92 | 101.8 Ų | 101.8 | 49% | 0.492 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65 | -46.7 | 176.8 | -69.7 | -13.2 | 0 | 0 | 0 | 110.9 | N322 L324 R328 H329 W330 | N322-D326 WeakPolarHBondContact O-CB 3.31Å; N322-D326 VanDerWaalsContact O-CG 3.22Å; N322-D326 PolarHBondContact O-N 3.14Å; L324-D326 VanDerWaalsContact C-N 3.33Å; D326-R328 VanDerWaalsContact C-N 3.35Å; D326-R328 PolarHBondContact O-N 2.87Å; D326-H329 PolarHBondContact O-N 2.67Å; D326-W330 PolarHBondContact O-N 2.91Å |
| 327 | A | 88.9 | Confident | 91.3 | Very high | 40 Ų | 40 | 100.2 Ų | 100.2 | 33% | 0.331 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.7 | -44.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | S323 L324 H329 W330 H331 | S323-A327 WeakPolarHBondContact O-CB 3.44Å; S323-A327 PolarHBondContact O-N 2.93Å; L324-A327 PolarHBondContact O-N 3.3Å; A327-H329 PolarHBondContact O-N 3.12Å; A327-W330 PolarHBondContact O-N 3.25Å; A327-H331 PolarHBondContact O-CD2 2.91Å; A327-H331 PolarHBondContact O-N 3.12Å |
| 328 | R | 88.7 | Confident | 91.6 | Very high | 148 Ų | 148 | 98.9 Ų | 98.9 | 56% | 0.558 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -59.2 | -46.9 | 174.6 | -74.5 | 173.4 | 178.7 | 177 | -0.6 | 111.5 | L324 T325 D326 W330 H331 D332 | L324-R328 WeakPolarHBondContact O-CB 3.29Å; L324-R328 VanDerWaalsContact O-CG 3.29Å; L324-R328 WeakPolarHBondContact O-CG 3.48Å; L324-R328 PolarHBondContact O-N 2.93Å; T325-R328 PolarHBondContact O-N 3.43Å; D326-R328 VanDerWaalsContact C-N 3.35Å; D326-R328 PolarHBondContact O-N 2.87Å; R328-W330 PolarHBondContact O-N 2.99Å; R328-H331 PolarHBondContact O-N 3.21Å; R328-D332 VanDerWaalsContact O-CG 3.25Å; R328-D332 PolarHBondContact O-N 3.03Å |
| 329 | H | 91.3 | Very high | 91.9 | Very high | 112 Ų | 112 | 94.2 Ų | 94.2 | 52% | 0.519 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.2 | -45.1 | 178.1 | -179.3 | 59.8 | 0 | 0 | 0 | 112.3 | T325 D326 A327 H331 D332 V333 | T325-H329 WeakPolarHBondContact O-CB 3.24Å; T325-H329 PolarHBondContact O-N 3.44Å; D326-H329 PolarHBondContact O-N 2.67Å; A327-H329 PolarHBondContact O-N 3.12Å; H329-H331 PolarHBondContact O-N 2.97Å; H329-D332 PolarHBondContact O-N 3.3Å; H329-V333 WeakPolarHBondContact O-CG2 3.44Å; H329-V333 PolarHBondContact O-N 2.89Å |
| 330 | W | 93.6 | Very high | 92.4 | Very high | 177 Ų | 177 | 95.3 Ų | 95.3 | 67% | 0.67 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.3 | -40.8 | 176.2 | -75.6 | 115.1 | 0 | 0 | 0 | 112.5 | D326 A327 R328 V333 E334 | D326-W330 PolarHBondContact O-N 2.91Å; A327-W330 PolarHBondContact O-N 3.25Å; R328-W330 PolarHBondContact O-N 2.99Å; W330-V333 PolarHBondContact O-N 2.89Å; W330-E334 WeakPolarHBondContact O-CB 3.37Å; W330-E334 PolarHBondContact O-N 3.02Å |
| 331 | H | 90.8 | Very high | 92.8 | Very high | 125 Ų | 125 | 93.7 Ų | 93.7 | 58% | 0.579 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.8 | -40.9 | 175.1 | -73.3 | -51.5 | 0 | 0 | 0 | 112.3 | A327 R328 H329 V333 E334 L335 | A327-H331 PolarHBondContact O-CD2 2.91Å; A327-H331 PolarHBondContact O-N 3.12Å; R328-H331 PolarHBondContact O-N 3.21Å; H329-H331 PolarHBondContact O-N 2.97Å; H331-V333 VanDerWaalsContact C-N 3.34Å; H331-V333 PolarHBondContact O-N 3.02Å; H331-E334 PolarHBondContact O-N 2.85Å; H331-L335 WeakPolarHBondContact O-CB 3.32Å; H331-L335 VanDerWaalsContact O-CG 3.29Å; H331-L335 WeakPolarHBondContact O-CG 3.48Å; H331-L335 PolarHBondContact O-N 3.27Å |
| 332 | D | 94.2 | Very high | 93.2 | Very high | 99 Ų | 99 | 91.6 Ų | 91.6 | 53% | 0.529 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 176.6 | -69 | -23.6 | 0 | 0 | 0 | 111.4 | R328 H329 L335 Q336 | R328-D332 VanDerWaalsContact O-CG 3.25Å; R328-D332 PolarHBondContact O-N 3.03Å; H329-D332 PolarHBondContact O-N 3.3Å; D332-L335 PolarHBondContact O-N 3.31Å; D332-Q336 WeakPolarHBondContact O-CB 3.38Å; D332-Q336 PolarHBondContact O-N 3.01Å |
| 333 | V | 93.4 | Very high | 93.5 | Very high | 43 Ų | 43 | 89.4 Ų | 89.4 | 26% | 0.261 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.8 | -44 | 174.7 | 170.9 | 0 | 0 | 0 | 0 | 111.1 | H329 W330 H331 Q336 N337 | H329-V333 WeakPolarHBondContact O-CG2 3.44Å; H329-V333 PolarHBondContact O-N 2.89Å; W330-V333 PolarHBondContact O-N 2.89Å; H331-V333 VanDerWaalsContact C-N 3.34Å; H331-V333 PolarHBondContact O-N 3.02Å; V333-Q336 PolarHBondContact O-N 3.08Å; V333-N337 PolarHBondContact O-N 2.94Å; V333-N337 PolarHBondContact O-ND2 3.4Å |
| 334 | E | 95.9 | Very high | 94 | Very high | 97 Ų | 97 | 93.7 Ų | 93.7 | 45% | 0.453 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.6 | -41.2 | 178.1 | -172.6 | 58.7 | -160.1 | 0 | 0 | 111.9 | W330 H331 Q336 N337 L338 | W330-E334 WeakPolarHBondContact O-CB 3.37Å; W330-E334 PolarHBondContact O-N 3.02Å; H331-E334 PolarHBondContact O-N 2.85Å; E334-Q336 VanDerWaalsContact C-N 3.31Å; E334-Q336 PolarHBondContact O-N 3.09Å; E334-N337 WeakPolarHBondContact O-CB 3.47Å; E334-N337 PolarHBondContact O-N 2.87Å; E334-L338 HydrophobicContact CG-CD1 4.28Å; E334-L338 WeakPolarHBondContact O-CB 3.48Å; E334-L338 WeakPolarHBondContact O-CG 3.28Å; E334-L338 PolarHBondContact O-N 3.14Å |
| 335 | L | 94.7 | Very high | 94.5 | Very high | 113 Ų | 113 | 94 Ų | 94 | 59% | 0.592 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -61.6 | -40.3 | 173.6 | -74 | 173.2 | 0 | 0 | 0 | 111.6 | H331 D332 L338 G339 | H331-L335 WeakPolarHBondContact O-CB 3.32Å; H331-L335 VanDerWaalsContact O-CG 3.29Å; H331-L335 WeakPolarHBondContact O-CG 3.48Å; H331-L335 PolarHBondContact O-N 3.27Å; D332-L335 PolarHBondContact O-N 3.31Å; L335-L338 PolarHBondContact O-N 3.39Å; L335-G339 PolarHBondContact O-N 3.48Å |
| 336 | Q | 96.1 | Very high | 95 | Very high | 146 Ų | 146 | 96.7 Ų | 96.7 | 68% | 0.682 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -65.2 | -40.7 | 175.3 | -170.6 | 174.6 | 11.6 | 0 | 0 | 111.6 | D332 V333 E334 G339 S340 | D332-Q336 WeakPolarHBondContact O-CB 3.38Å; D332-Q336 PolarHBondContact O-N 3.01Å; V333-Q336 PolarHBondContact O-N 3.08Å; E334-Q336 VanDerWaalsContact C-N 3.31Å; E334-Q336 PolarHBondContact O-N 3.09Å; Q336-G339 PolarHBondContact O-N 2.98Å; Q336-S340 PolarHBondContact O-N 2.92Å |
| 337 | N | 96.3 | Very high | 95.3 | Very high | 77 Ų | 77 | 94.5 Ų | 94.5 | 41% | 0.412 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.5 | -50.7 | 175.3 | -69.3 | -25.8 | 0 | 0 | 0 | 111.1 | V333 E334 G339 S340 V341 | V333-N337 PolarHBondContact O-N 2.94Å; V333-N337 PolarHBondContact O-ND2 3.4Å; E334-N337 WeakPolarHBondContact O-CB 3.47Å; E334-N337 PolarHBondContact O-N 2.87Å; N337-G339 VanDerWaalsContact C-N 3.31Å; N337-G339 PolarHBondContact O-N 3.32Å; N337-S340 WeakPolarHBondContact O-CB 3.17Å; N337-S340 PolarHBondContact O-N 3.47Å; N337-S340 VanDerWaalsContact O-N 3.12Å; N337-S340 PolarHBondContact O-OG 2.94Å; N337-V341 WeakPolarHBondContact O-CG2 3.31Å; N337-V341 PolarHBondContact O-N 2.92Å |
| 338 | L | 96.6 | Very high | 95.8 | Very high | 96 Ų | 96 | 97.3 Ų | 97.3 | 50% | 0.503 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.9 | -41 | 177 | -69.2 | 175 | 0 | 0 | 0 | 111.5 | E334 L335 S340 V341 A342 | E334-L338 HydrophobicContact CG-CD1 4.28Å; E334-L338 WeakPolarHBondContact O-CB 3.48Å; E334-L338 WeakPolarHBondContact O-CG 3.28Å; E334-L338 PolarHBondContact O-N 3.14Å; L335-L338 PolarHBondContact O-N 3.39Å; L338-S340 VanDerWaalsContact C-N 3.32Å; L338-S340 PolarHBondContact O-N 2.99Å; L338-V341 PolarHBondContact O-N 3.35Å; L338-A342 WeakPolarHBondContact O-CB 3.46Å; L338-A342 PolarHBondContact O-N 3.42Å |
| 339 | G | 96.8 | Very high | 96.2 | Very high | 40 Ų | 40 | 95.5 Ų | 95.5 | 41% | 0.412 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.9 | -40.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L335 Q336 N337 A342 A343 | L335-G339 PolarHBondContact O-N 3.48Å; Q336-G339 PolarHBondContact O-N 2.98Å; N337-G339 VanDerWaalsContact C-N 3.31Å; N337-G339 PolarHBondContact O-N 3.32Å; G339-A342 PolarHBondContact O-N 3.03Å; G339-A343 WeakPolarHBondContact O-CB 3.5Å; G339-A343 PolarHBondContact O-N 2.93Å |
| 340 | S | 97.6 | Very high | 96.6 | Very high | 63 Ų | 63 | 93 Ų | 93 | 44% | 0.441 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.1 | -34.8 | 176 | 81 | 0 | 0 | 0 | 0 | 113 | Q336 N337 L338 R344 | Q336-S340 PolarHBondContact O-N 2.92Å; N337-S340 WeakPolarHBondContact O-CB 3.17Å; N337-S340 PolarHBondContact O-N 3.47Å; N337-S340 VanDerWaalsContact O-N 3.12Å; N337-S340 PolarHBondContact O-OG 2.94Å; L338-S340 VanDerWaalsContact C-N 3.32Å; L338-S340 PolarHBondContact O-N 2.99Å; S340-R344 WeakPolarHBondContact O-CB 3.45Å; S340-R344 PolarHBondContact O-N 2.97Å; S340-R344 VanDerWaalsContact O-N 3.12Å |
| 341 | V | 98.2 | Very high | 96.8 | Very high | 78 Ų | 78 | 89 Ų | 89 | 47% | 0.473 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -70.5 | -45 | 175.4 | 173 | 0 | 0 | 0 | 0 | 110.3 | N337 L338 R344 L345 | N337-V341 WeakPolarHBondContact O-CG2 3.31Å; N337-V341 PolarHBondContact O-N 2.92Å; L338-V341 PolarHBondContact O-N 3.35Å; V341-R344 PolarHBondContact O-N 3.48Å; V341-L345 HydrophobicContact CG1-CD1 4.18Å; V341-L345 WeakPolarHBondContact O-CG 3.42Å; V341-L345 PolarHBondContact O-N 3.4Å |
| 342 | A | 97.6 | Very high | 97.1 | Very high | 45 Ų | 45 | 86.6 Ų | 86.6 | 37% | 0.372 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -58.2 | -49.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | L338 G339 R344 L345 E346 | L338-A342 WeakPolarHBondContact O-CB 3.46Å; L338-A342 PolarHBondContact O-N 3.42Å; G339-A342 PolarHBondContact O-N 3.03Å; A342-R344 VanDerWaalsContact C-N 3.28Å; A342-R344 PolarHBondContact O-N 3.44Å; A342-L345 PolarHBondContact O-N 3.24Å; A342-L345 VanDerWaalsContact O-N 3.14Å; A342-E346 WeakPolarHBondContact O-CG 3.48Å; A342-E346 PolarHBondContact O-N 2.97Å |
| 343 | A | 98.1 | Very high | 97.3 | Very high | 52 Ų | 52 | 87.9 Ų | 87.9 | 43% | 0.43 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -59.9 | -36.8 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | G339 A347 | G339-A343 WeakPolarHBondContact O-CB 3.5Å; G339-A343 PolarHBondContact O-N 2.93Å; A343-A347 WeakPolarHBondContact O-CB 3.45Å; A343-A347 PolarHBondContact O-N 3.06Å |
| 344 | R | 98.4 | Very high | 97.6 | Very high | 166 Ų | 166 | 89 Ų | 89 | 63% | 0.626 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -66 | -45.6 | 174.8 | -173 | -174.4 | -54.3 | -136.9 | -0.9 | 111.8 | S340 V341 A342 E346 A347 E348 | S340-R344 WeakPolarHBondContact O-CB 3.45Å; S340-R344 PolarHBondContact O-N 2.97Å; S340-R344 VanDerWaalsContact O-N 3.12Å; V341-R344 PolarHBondContact O-N 3.48Å; A342-R344 VanDerWaalsContact C-N 3.28Å; A342-R344 PolarHBondContact O-N 3.44Å; R344-E346 VanDerWaalsContact C-N 3.32Å; R344-E346 PolarHBondContact O-N 3.08Å; R344-A347 WeakPolarHBondContact O-CB 3.33Å; R344-A347 PolarHBondContact O-N 3.41Å; R344-E348 WeakPolarHBondContact O-CG 3.34Å; R344-E348 PolarHBondContact O-N 3.32Å |
| 345 | L | 98.1 | Very high | 97.7 | Very high | 91 Ų | 91 | 89.9 Ų | 89.9 | 48% | 0.476 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.4 | -36.6 | 177.9 | -68.7 | 175.1 | 0 | 0 | 0 | 111.8 | V341 A342 E348 L349 | V341-L345 HydrophobicContact CG1-CD1 4.18Å; V341-L345 WeakPolarHBondContact O-CG 3.42Å; V341-L345 PolarHBondContact O-N 3.4Å; A342-L345 PolarHBondContact O-N 3.24Å; A342-L345 VanDerWaalsContact O-N 3.14Å; L345-E348 PolarHBondContact O-N 3.48Å; L345-L349 WeakPolarHBondContact O-CB 3.42Å; L345-L349 WeakPolarHBondContact O-CG 3.48Å; L345-L349 PolarHBondContact O-N 3.38Å |
| 346 | E | 98.1 | Very high | 97.9 | Very high | 131 Ų | 131 | 87.8 Ų | 87.8 | 61% | 0.612 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -62.5 | -42.7 | 172.7 | -73.7 | 173.9 | 176.2 | 0 | 0 | 111.7 | A342 R344 L349 S350 | A342-E346 WeakPolarHBondContact O-CG 3.48Å; A342-E346 PolarHBondContact O-N 2.97Å; R344-E346 VanDerWaalsContact C-N 3.32Å; R344-E346 PolarHBondContact O-N 3.08Å; E346-L349 PolarHBondContact O-N 2.95Å; E346-S350 PolarHBondContact O-N 3.37Å |
| 347 | A | 98.1 | Very high | 98 | Very high | 46 Ų | 46 | 83.9 Ų | 83.9 | 38% | 0.38 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.3 | -48.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | A343 R344 L349 S350 D351 | A343-A347 WeakPolarHBondContact O-CB 3.45Å; A343-A347 PolarHBondContact O-N 3.06Å; R344-A347 WeakPolarHBondContact O-CB 3.33Å; R344-A347 PolarHBondContact O-N 3.41Å; A347-L349 VanDerWaalsContact C-N 3.31Å; A347-L349 PolarHBondContact O-N 3.48Å; A347-S350 PolarHBondContact O-N 2.9Å; A347-S350 PolarHBondContact O-OG 2.69Å; A347-D351 PolarHBondContact O-N 3.07Å |
| 348 | E | 98.5 | Very high | 98.1 | Very high | 98 Ų | 98 | 84.3 Ų | 84.3 | 46% | 0.458 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -58.8 | -40.5 | 176.6 | -72.2 | 173.6 | -167.4 | 0 | 0 | 112.2 | R344 L345 D351 V352 | R344-E348 WeakPolarHBondContact O-CG 3.34Å; R344-E348 PolarHBondContact O-N 3.32Å; L345-E348 PolarHBondContact O-N 3.48Å; E348-D351 PolarHBondContact O-N 2.98Å; E348-V352 WeakPolarHBondContact O-CG2 3.26Å; E348-V352 PolarHBondContact O-N 3.36Å |
| 349 | L | 98.4 | Very high | 98.2 | Very high | 111 Ų | 111 | 84.8 Ų | 84.8 | 58% | 0.581 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -63.9 | -41 | 174.4 | -77.1 | 173.2 | 0 | 0 | 0 | 112.1 | L345 E346 A347 V352 Q353 | L345-L349 WeakPolarHBondContact O-CB 3.42Å; L345-L349 WeakPolarHBondContact O-CG 3.48Å; L345-L349 PolarHBondContact O-N 3.38Å; E346-L349 PolarHBondContact O-N 2.95Å; A347-L349 VanDerWaalsContact C-N 3.31Å; A347-L349 PolarHBondContact O-N 3.48Å; L349-V352 PolarHBondContact O-N 2.92Å; L349-Q353 VanDerWaalsContact O-CG 3.28Å; L349-Q353 WeakPolarHBondContact O-CG 3.38Å; L349-Q353 PolarHBondContact O-N 3.43Å |
| 350 | S | 98.3 | Very high | 98.2 | Very high | 59 Ų | 59 | 90.1 Ų | 90.1 | 41% | 0.413 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.3 | -38.2 | 177.6 | 75.5 | 0 | 0 | 0 | 0 | 112.2 | E346 A347 Q353 S354 | E346-S350 PolarHBondContact O-N 3.37Å; A347-S350 PolarHBondContact O-N 2.9Å; A347-S350 PolarHBondContact O-OG 2.69Å; S350-Q353 PolarHBondContact O-N 3.19Å; S350-S354 PolarHBondContact O-N 3.36Å |
| 351 | D | 98.4 | Very high | 98.3 | Very high | 94 Ų | 94 | 93.6 Ų | 93.6 | 50% | 0.503 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.2 | -49.5 | 175.6 | -71.7 | -20 | 0 | 0 | 0 | 110.2 | A347 E348 Q353 S354 E355 | A347-D351 PolarHBondContact O-N 3.07Å; E348-D351 PolarHBondContact O-N 2.98Å; D351-Q353 VanDerWaalsContact C-N 3.32Å; D351-Q353 PolarHBondContact O-N 3.23Å; D351-S354 WeakPolarHBondContact O-CB 3.31Å; D351-S354 PolarHBondContact O-N 3.31Å; D351-S354 VanDerWaalsContact O-N 3.08Å; D351-S354 PolarHBondContact O-OG 3.29Å; D351-E355 WeakPolarHBondContact O-CG 3.47Å; D351-E355 PolarHBondContact O-N 3.27Å |
| 352 | V | 98.3 | Very high | 98.3 | Very high | 74 Ų | 74 | 93.6 Ų | 93.6 | 45% | 0.448 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.7 | -39.5 | 177.3 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | E348 L349 S354 E355 I356 | E348-V352 WeakPolarHBondContact O-CG2 3.26Å; E348-V352 PolarHBondContact O-N 3.36Å; L349-V352 PolarHBondContact O-N 2.92Å; V352-S354 VanDerWaalsContact C-N 3.34Å; V352-E355 PolarHBondContact O-N 3.3Å; V352-I356 HydrophobicContact CG1-CD1 3.88Å; V352-I356 HydrophobicContact CG1-CG1 4.45Å; V352-I356 VanDerWaalsContact O-CG1 3.26Å; V352-I356 WeakPolarHBondContact O-CG1 3.42Å; V352-I356 PolarHBondContact O-N 2.84Å |
| 353 | Q | 98.5 | Very high | 98.3 | Very high | 125 Ų | 125 | 97.8 Ų | 97.8 | 58% | 0.584 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.7 | -44.1 | 174.4 | -75.7 | 173 | 2.3 | 0 | 0 | 111.4 | L349 S350 D351 E355 I356 D357 | L349-Q353 VanDerWaalsContact O-CG 3.28Å; L349-Q353 WeakPolarHBondContact O-CG 3.38Å; L349-Q353 PolarHBondContact O-N 3.43Å; S350-Q353 PolarHBondContact O-N 3.19Å; D351-Q353 VanDerWaalsContact C-N 3.32Å; D351-Q353 PolarHBondContact O-N 3.23Å; Q353-E355 VanDerWaalsContact C-N 3.34Å; Q353-E355 PolarHBondContact O-N 3.43Å; Q353-I356 PolarHBondContact O-N 2.81Å; Q353-D357 PolarHBondContact O-N 2.91Å |
| 354 | S | 98.3 | Very high | 98.3 | Very high | 66 Ų | 66 | 100.5 Ų | 100.5 | 46% | 0.462 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.8 | -38.7 | 177.6 | 83.5 | 0 | 0 | 0 | 0 | 112.3 | S350 D351 V352 D357 Q358 | S350-S354 PolarHBondContact O-N 3.36Å; D351-S354 WeakPolarHBondContact O-CB 3.31Å; D351-S354 PolarHBondContact O-N 3.31Å; D351-S354 VanDerWaalsContact O-N 3.08Å; D351-S354 PolarHBondContact O-OG 3.29Å; V352-S354 VanDerWaalsContact C-N 3.34Å; S354-D357 PolarHBondContact O-N 3.35Å; S354-Q358 WeakPolarHBondContact O-CB 2.99Å; S354-Q358 PolarHBondContact O-N 3.24Å |
| 355 | E | 98.6 | Very high | 98.3 | Very high | 117 Ų | 117 | 98.1 Ų | 98.1 | 55% | 0.547 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.1 | -43.6 | 175.2 | -72.9 | -178.5 | 176.5 | 0 | 0 | 111.5 | D351 V352 Q353 D357 Q358 Q359 | D351-E355 WeakPolarHBondContact O-CG 3.47Å; D351-E355 PolarHBondContact O-N 3.27Å; V352-E355 PolarHBondContact O-N 3.3Å; Q353-E355 VanDerWaalsContact C-N 3.34Å; Q353-E355 PolarHBondContact O-N 3.43Å; E355-D357 VanDerWaalsContact C-N 3.34Å; E355-D357 PolarHBondContact O-N 3.47Å; E355-Q358 PolarHBondContact O-N 2.95Å; E355-Q359 WeakPolarHBondContact O-CG 3.5Å; E355-Q359 PolarHBondContact O-N 3.47Å |
| 356 | I | 98.3 | Very high | 98.3 | Very high | 69 Ų | 69 | 99.1 Ų | 99.1 | 35% | 0.354 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 175.9 | -71.1 | 165.5 | 0 | 0 | 0 | 110.5 | V352 Q353 Q358 Q359 R360 | V352-I356 HydrophobicContact CG1-CD1 3.88Å; V352-I356 HydrophobicContact CG1-CG1 4.45Å; V352-I356 VanDerWaalsContact O-CG1 3.26Å; V352-I356 WeakPolarHBondContact O-CG1 3.42Å; V352-I356 PolarHBondContact O-N 2.84Å; Q353-I356 PolarHBondContact O-N 2.81Å; I356-Q358 VanDerWaalsContact C-N 3.31Å; I356-Q358 PolarHBondContact O-N 3.45Å; I356-Q359 PolarHBondContact O-N 2.87Å; I356-R360 VanDerWaalsContact O-CG 3.31Å; I356-R360 WeakPolarHBondContact O-CG 3.34Å; I356-R360 PolarHBondContact O-N 3.26Å |
| 357 | D | 98.2 | Very high | 98.3 | Very high | 64 Ų | 64 | 96.7 Ų | 96.7 | 34% | 0.342 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.1 | -34.8 | 178.4 | -75.3 | -20.7 | 0 | 0 | 0 | 111.9 | Q353 S354 E355 R360 R361 | Q353-D357 PolarHBondContact O-N 2.91Å; S354-D357 PolarHBondContact O-N 3.35Å; E355-D357 VanDerWaalsContact C-N 3.34Å; E355-D357 PolarHBondContact O-N 3.47Å; D357-R360 PolarHBondContact O-N 2.9Å; D357-R360 IonicContact OD1-CZ 3.39Å; D357-R360 IonicContact OD1-NH1 3.9Å; D357-R360 PolarHBondContact OD1-NH1 2.96Å; D357-R361 WeakPolarHBondContact O-CG 3.3Å; D357-R361 PolarHBondContact O-N 3.38Å; D357-R361 VanDerWaalsContact O-N 3.16Å |
| 358 | Q | 98.4 | Very high | 98.3 | Very high | 86 Ų | 86 | 97 Ų | 97 | 40% | 0.402 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.9 | -47 | 171.8 | -174.8 | 56.6 | 33.2 | 0 | 0 | 111.6 | S354 E355 I356 R360 R361 D362 | S354-Q358 WeakPolarHBondContact O-CB 2.99Å; S354-Q358 PolarHBondContact O-N 3.24Å; E355-Q358 PolarHBondContact O-N 2.95Å; I356-Q358 VanDerWaalsContact C-N 3.31Å; I356-Q358 PolarHBondContact O-N 3.45Å; Q358-R360 VanDerWaalsContact C-N 3.29Å; Q358-R360 PolarHBondContact O-N 2.7Å; Q358-R361 WeakPolarHBondContact O-CB 3.46Å; Q358-R361 PolarHBondContact O-N 3.31Å; Q358-R361 VanDerWaalsContact O-N 3.15Å; Q358-D362 PolarHBondContact NE2-OD1 3.15Å; Q358-D362 VanDerWaalsContact NE2-OD1 3.07Å; Q358-D362 PolarHBondContact O-N 3Å |
| 359 | Q | 98.3 | Very high | 98.3 | Very high | 106 Ų | 106 | 96 Ų | 96 | 50% | 0.495 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -57.6 | -42.3 | 175.7 | -74.1 | 176.7 | -2.4 | 0 | 0 | 111.6 | E355 I356 R361 D362 F363 | E355-Q359 WeakPolarHBondContact O-CG 3.5Å; E355-Q359 PolarHBondContact O-N 3.47Å; I356-Q359 PolarHBondContact O-N 2.87Å; Q359-R361 PolarHBondContact O-N 3.32Å; Q359-D362 PolarHBondContact O-N 2.85Å; Q359-F363 HydrophobicContact CB-CD2 4.38Å; Q359-F363 HydrophobicContact CB-CE2 4.22Å; Q359-F363 WeakPolarHBondContact O-CD2 3.49Å; Q359-F363 WeakPolarHBondContact O-CG 3.36Å; Q359-F363 PolarHBondContact O-N 3.49Å |
| 360 | R | 98.4 | Very high | 98.3 | Very high | 151 Ų | 151 | 97.7 Ų | 97.7 | 57% | 0.57 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -57.5 | -47.4 | 175.6 | -76 | 170.1 | 175 | 174.9 | -4.6 | 112 | I356 D357 Q358 D362 F363 D364 | I356-R360 VanDerWaalsContact O-CG 3.31Å; I356-R360 WeakPolarHBondContact O-CG 3.34Å; I356-R360 PolarHBondContact O-N 3.26Å; D357-R360 PolarHBondContact O-N 2.9Å; D357-R360 IonicContact OD1-CZ 3.39Å; D357-R360 IonicContact OD1-NH1 3.9Å; D357-R360 PolarHBondContact OD1-NH1 2.96Å; Q358-R360 VanDerWaalsContact C-N 3.29Å; Q358-R360 PolarHBondContact O-N 2.7Å; R360-D362 VanDerWaalsContact C-N 3.33Å; R360-D362 PolarHBondContact O-N 3.41Å; R360-F363 PolarHBondContact O-N 2.93Å; R360-D364 PolarHBondContact O-N 3.36Å |
| 361 | R | 98.3 | Very high | 98.3 | Very high | 136 Ų | 136 | 99.3 Ų | 99.3 | 51% | 0.513 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 176.6 | -65.8 | 171.9 | -154.9 | 132.4 | 5.6 | 111.4 | D357 Q358 Q359 F363 D364 M365 | D357-R361 WeakPolarHBondContact O-CG 3.3Å; D357-R361 PolarHBondContact O-N 3.38Å; D357-R361 VanDerWaalsContact O-N 3.16Å; Q358-R361 WeakPolarHBondContact O-CB 3.46Å; Q358-R361 PolarHBondContact O-N 3.31Å; Q358-R361 VanDerWaalsContact O-N 3.15Å; Q359-R361 PolarHBondContact O-N 3.32Å; R361-F363 VanDerWaalsContact C-N 3.34Å; R361-F363 PolarHBondContact O-N 3.16Å; R361-D364 PolarHBondContact O-N 2.95Å; R361-M365 VanDerWaalsContact O-CG 3.3Å; R361-M365 WeakPolarHBondContact O-CG 3.46Å; R361-M365 PolarHBondContact O-N 3.44Å |
| 362 | D | 98.3 | Very high | 98.3 | Very high | 79 Ų | 79 | 102.2 Ų | 102.2 | 42% | 0.422 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.5 | -39.6 | 179 | -64.6 | -20.5 | 0 | 0 | 0 | 111.4 | Q358 Q359 R360 M365 L366 | Q358-D362 PolarHBondContact NE2-OD1 3.15Å; Q358-D362 VanDerWaalsContact NE2-OD1 3.07Å; Q358-D362 PolarHBondContact O-N 3Å; Q359-D362 PolarHBondContact O-N 2.85Å; R360-D362 VanDerWaalsContact C-N 3.33Å; R360-D362 PolarHBondContact O-N 3.41Å; D362-M365 PolarHBondContact O-N 2.86Å; D362-L366 WeakPolarHBondContact O-CG 3.47Å; D362-L366 PolarHBondContact O-N 3.05Å |
| 363 | F | 98.4 | Very high | 98.3 | Very high | 133 Ų | 133 | 103.2 Ų | 103.2 | 58% | 0.583 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.7 | -44.7 | 173.3 | -78.3 | -60.5 | 0 | 0 | 0 | 112.5 | Q359 R360 R361 M365 L366 L367 | Q359-F363 HydrophobicContact CB-CD2 4.38Å; Q359-F363 HydrophobicContact CB-CE2 4.22Å; Q359-F363 WeakPolarHBondContact O-CD2 3.49Å; Q359-F363 WeakPolarHBondContact O-CG 3.36Å; Q359-F363 PolarHBondContact O-N 3.49Å; R360-F363 PolarHBondContact O-N 2.93Å; R361-F363 VanDerWaalsContact C-N 3.34Å; R361-F363 PolarHBondContact O-N 3.16Å; F363-M365 VanDerWaalsContact C-N 3.3Å; F363-M365 PolarHBondContact O-N 2.9Å; F363-L366 PolarHBondContact O-N 2.91Å; F363-L367 WeakPolarHBondContact O-CB 3.38Å; F363-L367 PolarHBondContact O-N 3.15Å |
| 364 | D | 98.2 | Very high | 98.2 | Very high | 109 Ų | 109 | 101.6 Ų | 101.6 | 58% | 0.583 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.1 | -40 | 177 | -70.7 | -24.4 | 0 | 0 | 0 | 111.3 | R360 R361 L367 S368 | R360-D364 PolarHBondContact O-N 3.36Å; R361-D364 PolarHBondContact O-N 2.95Å; D364-L367 PolarHBondContact O-N 2.76Å; D364-S368 PolarHBondContact O-N 2.72Å; D364-S368 PolarHBondContact O-OG 3.25Å |
| 365 | M | 98.3 | Very high | 98.2 | Very high | 115 Ų | 115 | 104.6 Ų | 104.6 | 57% | 0.567 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63.6 | -44.4 | 174.2 | -72.4 | -62.5 | -64 | 0 | 0 | 112 | R361 D362 F363 L367 S368 N369 | R361-M365 VanDerWaalsContact O-CG 3.3Å; R361-M365 WeakPolarHBondContact O-CG 3.46Å; R361-M365 PolarHBondContact O-N 3.44Å; D362-M365 PolarHBondContact O-N 2.86Å; F363-M365 VanDerWaalsContact C-N 3.3Å; F363-M365 PolarHBondContact O-N 2.9Å; M365-L367 VanDerWaalsContact C-N 3.34Å; M365-L367 PolarHBondContact O-N 3.46Å; M365-S368 PolarHBondContact O-N 3.38Å; M365-S368 PolarHBondContact O-OG 3.3Å; M365-N369 WeakPolarHBondContact O-CB 3.44Å; M365-N369 PolarHBondContact O-N 3.41Å; M365-N369 PolarHBondContact O-ND2 3.49Å |
| 366 | L | 98.4 | Very high | 98.1 | Very high | 112 Ų | 112 | 102.2 Ų | 102.2 | 59% | 0.586 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -63.7 | -39.8 | 175.3 | -73.6 | 172.3 | 0 | 0 | 0 | 112.2 | D362 F363 N369 R370 | D362-L366 WeakPolarHBondContact O-CG 3.47Å; D362-L366 PolarHBondContact O-N 3.05Å; F363-L366 PolarHBondContact O-N 2.91Å; L366-N369 PolarHBondContact O-N 2.92Å; L366-R370 WeakPolarHBondContact O-CB 3.37Å; L366-R370 PolarHBondContact O-N 3.26Å |
| 367 | L | 98.3 | Very high | 98 | Very high | 81 Ų | 81 | 103.2 Ų | 103.2 | 42% | 0.424 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.8 | -45.4 | 177 | -174.8 | 67 | 0 | 0 | 0 | 111.2 | F363 D364 M365 N369 R370 Q371 | F363-L367 WeakPolarHBondContact O-CB 3.38Å; F363-L367 PolarHBondContact O-N 3.15Å; D364-L367 PolarHBondContact O-N 2.76Å; M365-L367 VanDerWaalsContact C-N 3.34Å; M365-L367 PolarHBondContact O-N 3.46Å; L367-N369 PolarHBondContact O-N 2.99Å; L367-R370 WeakPolarHBondContact O-CB 3.31Å; L367-R370 PolarHBondContact O-N 2.86Å; L367-Q371 WeakPolarHBondContact O-CG 3.34Å; L367-Q371 PolarHBondContact O-N 3.49Å |
| 368 | S | 98.3 | Very high | 97.9 | Very high | 53 Ų | 53 | 102.3 Ų | 102.3 | 37% | 0.371 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 176.8 | 69.3 | 0 | 0 | 0 | 0 | 112.2 | D364 M365 Q371 R372 | D364-S368 PolarHBondContact O-N 2.72Å; D364-S368 PolarHBondContact O-OG 3.25Å; M365-S368 PolarHBondContact O-N 3.38Å; M365-S368 PolarHBondContact O-OG 3.3Å; S368-Q371 PolarHBondContact O-N 3.41Å; S368-R372 PolarHBondContact O-N 3.41Å |
| 369 | N | 98.1 | Very high | 97.8 | Very high | 77 Ų | 77 | 103.9 Ų | 103.9 | 41% | 0.412 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.3 | -43 | 173.7 | -76.6 | -29.9 | 0 | 0 | 0 | 111.9 | M365 L366 L367 R372 L373 | M365-N369 WeakPolarHBondContact O-CB 3.44Å; M365-N369 PolarHBondContact O-N 3.41Å; M365-N369 PolarHBondContact O-ND2 3.49Å; L366-N369 PolarHBondContact O-N 2.92Å; L367-N369 PolarHBondContact O-N 2.99Å; N369-R372 PolarHBondContact O-N 3.49Å; N369-L373 WeakPolarHBondContact O-CG 3.48Å; N369-L373 PolarHBondContact O-N 2.93Å |
| 370 | R | 98.1 | Very high | 97.7 | Very high | 145 Ų | 145 | 105.6 Ų | 105.6 | 55% | 0.547 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.3 | -49.2 | 175.5 | -172.5 | -165 | 121.9 | 169.7 | 3.9 | 110.9 | L366 L367 R372 L373 E374 | L366-R370 WeakPolarHBondContact O-CB 3.37Å; L366-R370 PolarHBondContact O-N 3.26Å; L367-R370 WeakPolarHBondContact O-CB 3.31Å; L367-R370 PolarHBondContact O-N 2.86Å; R370-R372 VanDerWaalsContact C-N 3.3Å; R370-R372 PolarHBondContact O-N 3.31Å; R370-L373 PolarHBondContact O-N 3.07Å; R370-L373 VanDerWaalsContact O-N 3.16Å; R370-E374 IonicContact CZ-OE1 3.12Å; R370-E374 IonicContact NE-OE1 2.72Å; R370-E374 PolarHBondContact NE-OE1 3.21Å; R370-E374 IonicContact NE-OE2 3.83Å; R370-E374 IonicContact NH2-OE1 2.76Å; R370-E374 PolarHBondContact NH2-OE1 3.48Å; R370-E374 IonicContact NH2-OE2 3.82Å; R370-E374 WeakPolarHBondContact O-CG 3.37Å; R370-E374 PolarHBondContact O-N 3.44Å |
| 371 | Q | 97.9 | Very high | 97.6 | Very high | 94 Ų | 94 | 103.5 Ų | 103.5 | 44% | 0.439 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.8 | -41.5 | 177.8 | -72.1 | 173.1 | 1.2 | 0 | 0 | 111.8 | L367 S368 E374 Q375 | L367-Q371 WeakPolarHBondContact O-CG 3.34Å; L367-Q371 PolarHBondContact O-N 3.49Å; S368-Q371 PolarHBondContact O-N 3.41Å; Q371-E374 PolarHBondContact O-N 3Å; Q371-Q375 VanDerWaalsContact O-CG 3.31Å; Q371-Q375 WeakPolarHBondContact O-CG 3.35Å; Q371-Q375 PolarHBondContact O-N 2.81Å |
| 372 | R | 98.4 | Very high | 97.4 | Very high | 154 Ų | 154 | 99.2 Ų | 99.2 | 58% | 0.581 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.6 | -43.4 | 174.7 | 176.3 | -179.6 | 165.7 | 176.8 | -2.1 | 112.3 | S368 N369 R370 Q375 Q376 | S368-R372 PolarHBondContact O-N 3.41Å; N369-R372 PolarHBondContact O-N 3.49Å; R370-R372 VanDerWaalsContact C-N 3.3Å; R370-R372 PolarHBondContact O-N 3.31Å; R372-Q375 WeakPolarHBondContact O-CB 3.36Å; R372-Q375 PolarHBondContact O-N 3.04Å; R372-Q376 WeakPolarHBondContact O-CG 3.48Å; R372-Q376 PolarHBondContact O-N 3.48Å |
| 373 | L | 97.9 | Very high | 97.2 | Very high | 96 Ų | 96 | 100 Ų | 100 | 50% | 0.503 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.7 | -40.9 | 177.7 | -72.1 | 172.2 | 0 | 0 | 0 | 111.6 | N369 R370 Q375 Q376 I377 | N369-L373 WeakPolarHBondContact O-CG 3.48Å; N369-L373 PolarHBondContact O-N 2.93Å; R370-L373 PolarHBondContact O-N 3.07Å; R370-L373 VanDerWaalsContact O-N 3.16Å; L373-Q375 VanDerWaalsContact C-N 3.31Å; L373-Q375 PolarHBondContact O-N 3.28Å; L373-Q376 PolarHBondContact O-N 2.96Å; L373-I377 WeakPolarHBondContact O-CG1 3.48Å; L373-I377 PolarHBondContact O-N 3.42Å |
| 374 | E | 97.4 | Very high | 96.9 | Very high | 90 Ų | 90 | 97.8 Ų | 97.8 | 42% | 0.421 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.1 | -42.2 | 173.8 | -74.1 | 172.4 | 169.2 | 0 | 0 | 111.6 | R370 Q371 I377 G378 | R370-E374 IonicContact CZ-OE1 3.12Å; R370-E374 IonicContact NE-OE1 2.72Å; R370-E374 PolarHBondContact NE-OE1 3.21Å; R370-E374 IonicContact NE-OE2 3.83Å; R370-E374 IonicContact NH2-OE1 2.76Å; R370-E374 PolarHBondContact NH2-OE1 3.48Å; R370-E374 IonicContact NH2-OE2 3.82Å; R370-E374 WeakPolarHBondContact O-CG 3.37Å; R370-E374 PolarHBondContact O-N 3.44Å; Q371-E374 PolarHBondContact O-N 3Å; E374-I377 PolarHBondContact O-N 2.87Å; E374-G378 PolarHBondContact O-N 3.36Å |
| 375 | Q | 97.1 | Very high | 96.4 | Very high | 130 Ų | 130 | 96.6 Ų | 96.6 | 61% | 0.607 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.5 | -45.2 | 173.4 | -70.5 | 168.6 | 14.7 | 0 | 0 | 111.8 | Q371 R372 L373 G378 L379 | Q371-Q375 VanDerWaalsContact O-CG 3.31Å; Q371-Q375 WeakPolarHBondContact O-CG 3.35Å; Q371-Q375 PolarHBondContact O-N 2.81Å; R372-Q375 WeakPolarHBondContact O-CB 3.36Å; R372-Q375 PolarHBondContact O-N 3.04Å; L373-Q375 VanDerWaalsContact C-N 3.31Å; L373-Q375 PolarHBondContact O-N 3.28Å; Q375-G378 PolarHBondContact O-N 2.87Å; Q375-L379 WeakPolarHBondContact O-CG 3.33Å; Q375-L379 PolarHBondContact O-N 3.03Å |
| 376 | Q | 97.4 | Very high | 95.8 | Very high | 66 Ų | 66 | 92.3 Ų | 92.3 | 31% | 0.308 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 177.4 | -72.8 | -178 | -28 | 0 | 0 | 112.1 | R372 L373 G378 L379 Y380 | R372-Q376 WeakPolarHBondContact O-CG 3.48Å; R372-Q376 PolarHBondContact O-N 3.48Å; L373-Q376 PolarHBondContact O-N 2.96Å; Q376-G378 VanDerWaalsContact C-N 3.33Å; Q376-G378 PolarHBondContact O-N 3.17Å; Q376-L379 WeakPolarHBondContact O-CB 3.47Å; Q376-L379 PolarHBondContact O-N 3.29Å; Q376-Y380 HydrophobicContact CB-CD2 4.46Å; Q376-Y380 HydrophobicContact CB-CE2 4.05Å; Q376-Y380 WeakPolarHBondContact O-CD2 3.45Å; Q376-Y380 PolarHBondContact O-N 2.94Å |
| 377 | I | 95.9 | Very high | 95 | Very high | 90 Ų | 90 | 91.1 Ų | 91.1 | 46% | 0.462 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.2 | -43.9 | 175 | -70.5 | 164.9 | 0 | 0 | 0 | 110.6 | L373 E374 L379 Y380 H381 | L373-I377 WeakPolarHBondContact O-CG1 3.48Å; L373-I377 PolarHBondContact O-N 3.42Å; E374-I377 PolarHBondContact O-N 2.87Å; I377-L379 VanDerWaalsContact C-N 3.33Å; I377-L379 PolarHBondContact O-N 3.32Å; I377-Y380 PolarHBondContact O-N 3.44Å; I377-H381 PolarHBondContact O-CD2 3.4Å; I377-H381 VanDerWaalsContact O-CD2 3.29Å; I377-H381 PolarHBondContact O-N 3.25Å |
| 378 | G | 96.4 | Very high | 94.1 | Very high | 45 Ų | 45 | 92.6 Ų | 92.6 | 46% | 0.464 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.2 | -40.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | E374 Q375 Q376 H381 G382 | E374-G378 PolarHBondContact O-N 3.36Å; Q375-G378 PolarHBondContact O-N 2.87Å; Q376-G378 VanDerWaalsContact C-N 3.33Å; Q376-G378 PolarHBondContact O-N 3.17Å; G378-H381 PolarHBondContact O-N 3.16Å; G378-G382 PolarHBondContact O-N 2.91Å |
| 379 | L | 95.9 | Very high | 93 | Very high | 120 Ų | 120 | 96.1 Ų | 96.1 | 63% | 0.628 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -64.5 | -43 | 173.7 | -67.5 | 173.3 | 0 | 0 | 0 | 111.9 | Q375 Q376 I377 G382 I383 | Q375-L379 WeakPolarHBondContact O-CG 3.33Å; Q375-L379 PolarHBondContact O-N 3.03Å; Q376-L379 WeakPolarHBondContact O-CB 3.47Å; Q376-L379 PolarHBondContact O-N 3.29Å; I377-L379 VanDerWaalsContact C-N 3.33Å; I377-L379 PolarHBondContact O-N 3.32Å; L379-G382 PolarHBondContact O-N 2.91Å; L379-I383 WeakPolarHBondContact O-CG1 3Å; L379-I383 PolarHBondContact O-N 2.85Å |
| 380 | Y | 96.8 | Very high | 91.8 | Very high | 142 Ų | 142 | 101.1 Ų | 101.1 | 56% | 0.557 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.5 | -41.6 | 176.9 | -67.2 | -51.5 | 0 | 0 | 0 | 112.1 | Q376 I377 I383 L384 | Q376-Y380 HydrophobicContact CB-CD2 4.46Å; Q376-Y380 HydrophobicContact CB-CE2 4.05Å; Q376-Y380 WeakPolarHBondContact O-CD2 3.45Å; Q376-Y380 PolarHBondContact O-N 2.94Å; I377-Y380 PolarHBondContact O-N 3.44Å; Y380-I383 PolarHBondContact O-N 3.37Å; Y380-L384 WeakPolarHBondContact O-CG 3.48Å; Y380-L384 PolarHBondContact O-N 3Å |
| 381 | H | 95.6 | Very high | 90.2 | Very high | 107 Ų | 107 | 102.2 Ų | 102.2 | 50% | 0.495 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.4 | -46 | 172.5 | -82.9 | -63.8 | 0 | 0 | 0 | 111.8 | I377 G378 I383 L384 D385 | I377-H381 PolarHBondContact O-CD2 3.4Å; I377-H381 VanDerWaalsContact O-CD2 3.29Å; I377-H381 PolarHBondContact O-N 3.25Å; G378-H381 PolarHBondContact O-N 3.16Å; H381-I383 VanDerWaalsContact C-N 3.29Å; H381-I383 PolarHBondContact O-N 3.3Å; H381-L384 PolarHBondContact O-N 3.3Å; H381-L384 VanDerWaalsContact O-N 3.14Å; H381-D385 PolarHBondContact O-N 3.3Å |
| 382 | G | 93.6 | Very high | 88.4 | Confident | 45 Ų | 45 | 103.6 Ų | 103.6 | 46% | 0.464 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.4 | -32.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | G378 L379 G386 | G378-G382 PolarHBondContact O-N 2.91Å; L379-G382 PolarHBondContact O-N 2.91Å; G382-G386 PolarHBondContact O-N 2.99Å |
| 383 | I | 93.7 | Very high | 86.3 | Confident | 96 Ų | 96 | 101.1 Ų | 101.1 | 49% | 0.492 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -69.8 | -45 | 173.2 | -66 | 167.2 | 0 | 0 | 0 | 110.6 | L379 Y380 H381 G386 E387 | L379-I383 WeakPolarHBondContact O-CG1 3Å; L379-I383 PolarHBondContact O-N 2.85Å; Y380-I383 PolarHBondContact O-N 3.37Å; H381-I383 VanDerWaalsContact C-N 3.29Å; H381-I383 PolarHBondContact O-N 3.3Å; I383-G386 PolarHBondContact O-N 3.06Å; I383-E387 PolarHBondContact O-N 3.14Å |
| 384 | L | 92.3 | Very high | 84.3 | Confident | 86 Ų | 86 | 101.9 Ų | 101.9 | 45% | 0.45 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.5 | -49.2 | 178.5 | -79.3 | 161.4 | 0 | 0 | 0 | 111.6 | Y380 H381 G386 E387 E388 | Y380-L384 WeakPolarHBondContact O-CG 3.48Å; Y380-L384 PolarHBondContact O-N 3Å; H381-L384 PolarHBondContact O-N 3.3Å; H381-L384 VanDerWaalsContact O-N 3.14Å; L384-G386 VanDerWaalsContact C-N 3.28Å; L384-G386 PolarHBondContact O-N 3.29Å; L384-E387 CarbonylContact O-C 3.56Å; L384-E387 WeakPolarHBondContact O-CA 3.41Å; L384-E387 PolarHBondContact O-N 3.3Å; L384-E388 WeakPolarHBondContact O-CG 3.36Å; L384-E388 PolarHBondContact O-N 3.43Å |
| 385 | D | 88.4 | Confident | 82.1 | Confident | 85 Ų | 85 | 105.3 Ų | 105.3 | 46% | 0.455 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -57.4 | -42.9 | 177.6 | -63.8 | -16.8 | 0 | 0 | 0 | 110.8 | H381 E387 E388 D389 | H381-D385 PolarHBondContact O-N 3.3Å; D385-E387 VanDerWaalsContact C-N 3.31Å; D385-E387 PolarHBondContact O-N 2.88Å; D385-E388 PolarHBondContact O-N 3.21Å; D385-D389 WeakPolarHBondContact O-CB 3.45Å; D385-D389 PolarHBondContact O-N 2.88Å |
| 386 | G | 85.3 | Confident | 79.9 | Confident | 25 Ų | 25 | 102.4 Ų | 102.4 | 26% | 0.258 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -70.1 | -21.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | G382 I383 L384 R390 | G382-G386 PolarHBondContact O-N 2.99Å; I383-G386 PolarHBondContact O-N 3.06Å; L384-G386 VanDerWaalsContact C-N 3.28Å; L384-G386 PolarHBondContact O-N 3.29Å; G386-R390 WeakPolarHBondContact O-CG 3.46Å; G386-R390 PolarHBondContact O-NE 3.06Å; G386-R390 VanDerWaalsContact O-NE 3.12Å |
| 387 | E | 82.6 | Confident | 77.6 | Confident | 87 Ų | 87 | 109 Ų | 109 | 41% | 0.407 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -80.6 | -41.6 | 168.4 | -74.4 | -172.7 | 174.8 | 0 | 0 | 111.7 | I383 L384 D385 D389 R390 F391 | I383-E387 PolarHBondContact O-N 3.14Å; L384-E387 CarbonylContact O-C 3.56Å; L384-E387 WeakPolarHBondContact O-CA 3.41Å; L384-E387 PolarHBondContact O-N 3.3Å; D385-E387 VanDerWaalsContact C-N 3.31Å; D385-E387 PolarHBondContact O-N 2.88Å; E387-D389 VanDerWaalsContact C-N 3.31Å; E387-D389 PolarHBondContact O-N 2.82Å; E387-R390 WeakPolarHBondContact O-CA 3.49Å; E387-R390 WeakPolarHBondContact O-CB 3.45Å; E387-R390 PolarHBondContact O-N 2.72Å; E387-F391 HydrophobicContact CB-CE2 4.47Å; E387-F391 WeakPolarHBondContact O-CD2 3.1Å; E387-F391 PolarHBondContact O-N 3.35Å |
| 388 | E | 79.4 | Confident | 76.7 | Confident | 112 Ų | 112 | 109.9 Ų | 109.9 | 52% | 0.523 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -59.5 | -41.6 | 174.3 | -70.2 | -178.1 | -179.4 | 0 | 0 | 111.6 | L384 D385 R390 F391 L392 | L384-E388 WeakPolarHBondContact O-CG 3.36Å; L384-E388 PolarHBondContact O-N 3.43Å; D385-E388 PolarHBondContact O-N 3.21Å; E388-R390 PolarHBondContact O-N 2.88Å; E388-F391 PolarHBondContact O-N 3.12Å; E388-F391 VanDerWaalsContact O-N 3.12Å; E388-L392 WeakPolarHBondContact O-CB 3.49Å; E388-L392 PolarHBondContact O-N 3.25Å |
| 389 | D | 74.5 | Confident | 75.6 | Confident | 126 Ų | 126 | 113.3 Ų | 113.3 | 67% | 0.674 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -62.5 | -23.7 | 172.7 | -76.3 | -21.2 | 0 | 0 | 0 | 113.4 | D385 E387 | D385-D389 WeakPolarHBondContact O-CB 3.45Å; D385-D389 PolarHBondContact O-N 2.88Å; E387-D389 VanDerWaalsContact C-N 3.31Å; E387-D389 PolarHBondContact O-N 2.82Å |
| 390 | R | 72.9 | Confident | 74.5 | Confident | 182 Ų | 182 | 112.9 Ų | 112.9 | 69% | 0.687 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -83.1 | -31 | 173.6 | -79 | -177.3 | -80.8 | -127.1 | -0.2 | 112.8 | G386 E387 E388 | G386-R390 WeakPolarHBondContact O-CG 3.46Å; G386-R390 PolarHBondContact O-NE 3.06Å; G386-R390 VanDerWaalsContact O-NE 3.12Å; E387-R390 WeakPolarHBondContact O-CA 3.49Å; E387-R390 WeakPolarHBondContact O-CB 3.45Å; E387-R390 PolarHBondContact O-N 2.72Å; E388-R390 PolarHBondContact O-N 2.88Å |
| 391 | F | 65.3 | Low | 73.2 | Confident | 169 Ų | 169 | 111.2 Ų | 111.2 | 74% | 0.741 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -89.4 | -21.8 | -178.9 | -73 | -68.9 | 0 | 0 | 0 | 113.6 | E387 E388 P393 | E387-F391 HydrophobicContact CB-CE2 4.47Å; E387-F391 WeakPolarHBondContact O-CD2 3.1Å; E387-F391 PolarHBondContact O-N 3.35Å; E388-F391 PolarHBondContact O-N 3.12Å; E388-F391 VanDerWaalsContact O-N 3.12Å; F391-P393 WeakPolarHBondContact O-CD 3.17Å |
| 392 | L | 58.7 | Low | 71.8 | Confident | 122 Ų | 122 | 111.5 Ų | 111.5 | 64% | 0.639 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -87.7 | 102.5 | 169 | -68.5 | 171.6 | 0 | 0 | 0 | 109 | E388 S394 | E388-L392 WeakPolarHBondContact O-CB 3.49Å; E388-L392 PolarHBondContact O-N 3.25Å; L392-S394 PolarHBondContact O-N 2.97Å |
| 393 | P | 54.5 | Low | 70.3 | Confident | 102 Ų | 102 | 115.9 Ų | 115.9 | 66% | 0.662 | 64% | 0.635 | S | S | * | * | trans | -59.9 | 137.4 | 166.3 | 27.9 | -32 | 0 | 0 | 0 | 107.5 | F391 N395 | F391-P393 WeakPolarHBondContact O-CD 3.17Å; P393-N395 VanDerWaalsContact C-N 3.3Å; P393-N395 PolarHBondContact O-N 2.98Å | ||
| 394 | S | 55.7 | Low | 68.7 | Low | 112 Ų | 112 | 117.4 Ų | 117.4 | 78% | 0.783 | 65% | 0.645 | S | S | * | * | trans | -47.6 | 92.8 | 172.2 | 179.6 | 0 | 0 | 0 | 0 | 110.5 | L392 A396 | L392-S394 PolarHBondContact O-N 2.97Å; S394-A396 PolarHBondContact O-N 3.12Å | ||
| 395 | N | 53 | Low | 66.9 | Low | 163 Ų | 163 | 119.8 Ų | 119.8 | 87% | 0.872 | 66% | 0.661 | S | S | * | * | trans | -87 | 73.9 | 158.2 | -87.3 | -23 | 0 | 0 | 0 | 106.1 | P393 | P393-N395 VanDerWaalsContact C-N 3.3Å; P393-N395 PolarHBondContact O-N 2.98Å | ||
| 396 | A | 50.3 | Low | 65.1 | Low | 68 Ų | 68 | 122.7 Ų | 122.7 | 56% | 0.562 | 68% | 0.678 | S | S | * | * | trans | -89.5 | 149.2 | 153.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | S394 | S394-A396 PolarHBondContact O-N 3.12Š| ||
| 397 | P | 48.4 | Very low | 63.2 | Low | 204 Ų | 204 | 131.5 Ų | 131.5 | 100% | 1.325 | 72% | 0.716 | S | S | * | * | trans | -59.9 | 0 | 173.7 | 27.7 | -36 | 0 | 0 | 0 | 113.5 |
Retrieved 397 of 397 residues in 443.7 ms
(Link to these results)