| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.8 | Very low | 51.5 | Low | 236 Ų | 236 | 152.4 Ų | 152.4 | 100% | 1.163 | 84% | 0.837 | S | S | * | * | 0 | 74.1 | 0 | -78.1 | -75 | 178.3 | 0 | 0 | 105.3 | |||||
| 2 | D | 41.5 | Very low | 51.3 | Low | 166 Ų | 166 | 152.9 Ų | 152.9 | 89% | 0.888 | 84% | 0.838 | S | S | * | * | trans | -85.9 | 126 | -165.7 | -63.6 | -81.1 | 0 | 0 | 0 | 109.7 | ||||
| 3 | G | 51.9 | Low | 51.4 | Low | 69 Ų | 69 | 153.2 Ų | 153.2 | 71% | 0.711 | 83% | 0.83 | S | S | * | * | trans | -143.8 | 59.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | V5 | G3-V5 PolarHBondContact O-N 3.39Š| ||
| 4 | R | 49.2 | Very low | 51.9 | Low | 253 Ų | 253 | 150.4 Ų | 150.4 | 96% | 0.955 | 82% | 0.823 | S | S | * | * | trans | -71.1 | 104.4 | 163.2 | -86.9 | -172.1 | -165.4 | -146 | 1.4 | 108.1 | ||||
| 5 | V | 59.2 | Low | 52.2 | Low | 135 Ų | 135 | 147.8 Ų | 147.8 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 127.5 | 164.5 | -178.1 | 0 | 0 | 0 | 0 | 107.7 | G3 | G3-V5 PolarHBondContact O-N 3.39Š|
| 6 | P | 56.5 | Low | 52.3 | Low | 115 Ų | 115 | 144.6 Ų | 144.6 | 75% | 0.747 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -73.4 | 140.9 | -177.3 | -7.8 | 24.1 | 0 | 0 | 0 | 111.1 | ||
| 7 | A | 58.5 | Low | 52.6 | Low | 87 Ų | 87 | 144.2 Ų | 144.2 | 72% | 0.719 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 143.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | L9 | A7-L9 PolarHBondContact O-N 2.87Š|
| 8 | P | 54.7 | Low | 52.7 | Low | 109 Ų | 109 | 140.6 Ų | 140.6 | 71% | 0.708 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 125.1 | 175.8 | 25.6 | -30.7 | 0 | 0 | 0 | 109.6 | F10 | P8-F10 PolarHBondContact O-N 3.24Š|
| 9 | L | 53.2 | Low | 53 | Low | 169 Ų | 169 | 142.1 Ų | 142.1 | 89% | 0.885 | 78% | 0.783 | S | S | * | * | trans | -62.5 | 104.1 | 168.5 | -73.1 | 164.8 | 0 | 0 | 0 | 107.8 | A7 L11 | A7-L9 PolarHBondContact O-N 2.87Å; L9-L11 PolarHBondContact O-N 3.47Å; L9-L11 VanDerWaalsContact O-N 3.16Å | ||
| 10 | F | 48.8 | Very low | 52.8 | Low | 180 Ų | 180 | 145.6 Ų | 145.6 | 79% | 0.789 | 79% | 0.785 | S | S | * | * | trans | -62.9 | 113.8 | 159.2 | -83.9 | -91.7 | 0 | 0 | 0 | 106.4 | P8 D12 | P8-F10 PolarHBondContact O-N 3.24Å; F10-D12 VanDerWaalsContact C-N 3.29Å; F10-D12 PolarHBondContact O-N 2.8Å | ||
| 11 | L | 49.7 | Very low | 52.3 | Low | 157 Ų | 157 | 146.7 Ų | 146.7 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | trans | -62 | 96.6 | 168.3 | -93.1 | 146.9 | 0 | 0 | 0 | 107.5 | L9 Q13 | L9-L11 PolarHBondContact O-N 3.47Å; L9-L11 VanDerWaalsContact O-N 3.16Å; L11-Q13 PolarHBondContact O-N 2.97Å | ||
| 12 | D | 48.7 | Very low | 52.4 | Low | 159 Ų | 159 | 139.7 Ų | 139.7 | 85% | 0.85 | 77% | 0.765 | S | S | * | * | trans | -64.5 | 76.8 | 162.6 | -78 | -34.4 | 0 | 0 | 0 | 108.8 | F10 | F10-D12 VanDerWaalsContact C-N 3.29Å; F10-D12 PolarHBondContact O-N 2.8Å | ||
| 13 | Q | 52.8 | Low | 52.2 | Low | 157 Ų | 157 | 143 Ų | 143 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | trans | -148.3 | 110.3 | 160.9 | -126.5 | 168.4 | -6.9 | 0 | 0 | 109 | L11 | L11-Q13 PolarHBondContact O-N 2.97Š| ||
| 14 | P | 57.8 | Low | 51.8 | Low | 114 Ų | 114 | 147 Ų | 147 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | trans | -58.7 | 137.7 | 173.1 | 24.6 | -31 | 0 | 0 | 0 | 108.3 | D16 | P14-D16 PolarHBondContact O-N 3.28Å; P14-D16 VanDerWaalsContact O-N 3.16Å | ||
| 15 | P | 57.2 | Low | 51.1 | Low | 111 Ų | 111 | 140.2 Ų | 140.2 | 72% | 0.721 | 76% | 0.757 | S | S | * | * | trans | -57.4 | 125.8 | 176.8 | 22.1 | -30.1 | 0 | 0 | 0 | 108.8 | L17 | P15-L17 VanDerWaalsContact C-N 3.34Å; P15-L17 PolarHBondContact O-N 2.85Å | ||
| 16 | D | 53.5 | Low | 50.5 | Low | 97 Ų | 97 | 144.1 Ų | 144.1 | 52% | 0.519 | 76% | 0.759 | S | S | . | * | trans | -59.2 | 92.8 | 178.8 | -176.9 | 10.5 | 0 | 0 | 0 | 109.9 | P14 A18 K19 | P14-D16 PolarHBondContact O-N 3.28Å; P14-D16 VanDerWaalsContact O-N 3.16Å; D16-A18 PolarHBondContact O-N 3.33Å; D16-A18 VanDerWaalsContact OD1-CB 3.32Å; D16-A18 WeakPolarHBondContact OD1-CB 3.33Å; D16-A18 PolarHBondContact OD1-N 2.99Å; D16-K19 PolarHBondContact O-N 2.81Å; D16-K19 VanDerWaalsContact O-N 3.13Å | ||
| 17 | L | 57.1 | Low | 49.8 | Very low | 138 Ų | 138 | 147.9 Ų | 147.9 | 72% | 0.723 | 77% | 0.766 | S | S | * | * | G | 310 helix | trans | -57.7 | -17 | 179.3 | -84 | 140.3 | 0 | 0 | 0 | 112.2 | P15 K19 H21 | P15-L17 VanDerWaalsContact C-N 3.34Å; P15-L17 PolarHBondContact O-N 2.85Å; L17-K19 VanDerWaalsContact C-N 3.31Å; L17-K19 PolarHBondContact O-N 3.43Å; L17-H21 PolarHBondContact O-CD2 2.83Å |
| 18 | A | 54.6 | Low | 48.8 | Very low | 78 Ų | 78 | 155.1 Ų | 155.1 | 65% | 0.645 | 78% | 0.777 | S | S | * | * | G | 310 helix | trans | -74.2 | -16.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | D16 | D16-A18 PolarHBondContact O-N 3.33Å; D16-A18 VanDerWaalsContact OD1-CB 3.32Å; D16-A18 WeakPolarHBondContact OD1-CB 3.33Å; D16-A18 PolarHBondContact OD1-N 2.99Å |
| 19 | K | 57.6 | Low | 47.9 | Very low | 170 Ų | 170 | 153.4 Ų | 153.4 | 74% | 0.739 | 78% | 0.779 | S | S | * | * | G | 310 helix | trans | -84.1 | -11.4 | -179.7 | -91.9 | 179.4 | 178.3 | 173.8 | 0 | 115.4 | D16 L17 | D16-K19 PolarHBondContact O-N 2.81Å; D16-K19 VanDerWaalsContact O-N 3.13Å; L17-K19 VanDerWaalsContact C-N 3.31Å; L17-K19 PolarHBondContact O-N 3.43Å |
| 20 | Y | 50.2 | Low | 47.2 | Very low | 211 Ų | 211 | 155.1 Ų | 155.1 | 83% | 0.827 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -108.4 | 6.3 | -178.3 | -71 | -81.4 | 0 | 0 | 0 | 114.5 | A22 | Y20-A22 PolarHBondContact O-N 3.37Š|
| 21 | H | 41.8 | Very low | 46.6 | Very low | 169 Ų | 169 | 156.1 Ų | 156.1 | 78% | 0.782 | 79% | 0.786 | S | S | * | * | trans | -91.2 | 68.4 | 170.9 | -80.2 | -76.7 | 0 | 0 | 0 | 111.7 | L17 | L17-H21 PolarHBondContact O-CD2 2.83Š| ||
| 22 | A | 45.3 | Very low | 46 | Very low | 90 Ų | 90 | 152.1 Ų | 152.1 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | -104.4 | 95.7 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y20 | Y20-A22 PolarHBondContact O-N 3.37Š| ||
| 23 | R | 37.3 | Very low | 45.2 | Very low | 235 Ų | 235 | 153.9 Ų | 153.9 | 89% | 0.887 | 79% | 0.786 | S | S | * | * | trans | 31.3 | 101.6 | 154.9 | -73.1 | -179.8 | -177.8 | -171.1 | -0.7 | 118.3 | ||||
| 24 | I | 43.7 | Very low | 44.5 | Very low | 152 Ų | 152 | 152.2 Ų | 152.2 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | trans | -132.7 | 109.2 | 132.3 | -54.3 | 177.5 | 0 | 0 | 0 | 106.7 | Y26 | I24-Y26 HydrophobicContact CG2-CD2 4.25Š| ||
| 25 | P | 35.5 | Very low | 43.4 | Very low | 111 Ų | 111 | 156.1 Ų | 156.1 | 72% | 0.721 | 80% | 0.798 | S | S | * | * | trans | -89.1 | 112.8 | 174.6 | 31.8 | -24.1 | 0 | 0 | 0 | 109 | ||||
| 26 | Y | 45.2 | Very low | 42.3 | Very low | 217 Ų | 217 | 158.1 Ų | 158.1 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | trans | -134.4 | 115.3 | 154.2 | -90.9 | -81 | 0 | 0 | 0 | 109 | I24 | I24-Y26 HydrophobicContact CG2-CD2 4.25Š| ||
| 27 | E | 43.1 | Very low | 41.2 | Very low | 194 Ų | 194 | 159.2 Ų | 159.2 | 91% | 0.907 | 82% | 0.818 | S | S | * | * | trans | -72.1 | 131.8 | 169.8 | -69.2 | -176.5 | 154.3 | 0 | 0 | 109.5 | G29 | E27-G29 PolarHBondContact O-N 2.82Š| ||
| 28 | Y | 37.7 | Very low | 40.1 | Very low | 240 Ų | 240 | 158.8 Ų | 158.8 | 94% | 0.941 | 82% | 0.82 | S | S | * | * | trans | -74.9 | 100.4 | 168 | -106.3 | -93.1 | 0 | 0 | 0 | 109.3 | ||||
| 29 | G | 35.9 | Very low | 39.4 | Very low | 73 Ų | 73 | 162.6 Ų | 162.6 | 75% | 0.753 | 83% | 0.828 | S | S | * | * | trans | -88.2 | 117.5 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | E27 | E27-G29 PolarHBondContact O-N 2.82Š| ||
| 30 | K | 38.1 | Very low | 38.3 | Very low | 205 Ų | 205 | 159.7 Ų | 159.7 | 89% | 0.891 | 83% | 0.829 | S | S | * | * | trans | -63.3 | 147.2 | 176.2 | -71.7 | -179.9 | 175.6 | -179.6 | 0 | 112.5 | ||||
| 31 | E | 36 | Very low | 37.6 | Very low | 200 Ų | 200 | 158.1 Ų | 158.1 | 94% | 0.935 | 83% | 0.829 | S | S | * | * | trans | -13.2 | 127.9 | 164.6 | -62.3 | 172.5 | 164 | 0 | 0 | 117.2 | ||||
| 32 | G | 36.2 | Very low | 37.4 | Very low | 74 Ų | 74 | 157.5 Ų | 157.5 | 76% | 0.763 | 83% | 0.831 | S | S | * | * | trans | -177.1 | 110.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 33 | E | 32.9 | Very low | 37.2 | Very low | 195 Ų | 195 | 161.9 Ų | 161.9 | 91% | 0.911 | 84% | 0.836 | S | S | * | * | trans | -47 | 129.2 | 175.1 | -60.9 | 166.3 | 128.3 | 0 | 0 | 113.4 | ||||
| 34 | S | 38.1 | Very low | 37.6 | Very low | 123 Ų | 123 | 160.2 Ų | 160.2 | 86% | 0.86 | 84% | 0.835 | S | S | * | * | trans | -165.3 | 126.8 | 144.1 | -96.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 35 | K | 33.8 | Very low | 37.2 | Very low | 196 Ų | 196 | 159 Ų | 159 | 85% | 0.852 | 84% | 0.838 | S | S | * | * | trans | -52.3 | 141 | 166.5 | -61.8 | 162.8 | 178.8 | 172.2 | 0 | 110.5 | ||||
| 36 | N | 34.2 | Very low | 37.3 | Very low | 153 Ų | 153 | 162.1 Ų | 162.1 | 82% | 0.818 | 85% | 0.847 | S | S | * | * | trans | 174.3 | 103.3 | 149.8 | -81.4 | -20.9 | 0 | 0 | 0 | 105.6 | ||||
| 37 | S | 30.9 | Very low | 37 | Very low | 120 Ų | 120 | 160.3 Ų | 160.3 | 84% | 0.839 | 85% | 0.846 | S | S | * | * | 55.3 | 55 | 59.4 | -171.3 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 38 | V | 34.8 | Very low | 36.7 | Very low | 129 Ų | 129 | 159.9 Ų | 159.9 | 78% | 0.782 | 84% | 0.844 | S | S | * | * | trans | -159.6 | 119.9 | 154 | -160.2 | 0 | 0 | 0 | 0 | 103.4 | ||||
| 39 | I | 39.2 | Very low | 36.8 | Very low | 158 Ų | 158 | 157.2 Ų | 157.2 | 81% | 0.81 | 85% | 0.845 | S | S | * | * | -157.3 | 109.3 | 67.3 | -68.3 | 156.3 | 0 | 0 | 0 | 106.7 | |||||
| 40 | S | 33.9 | Very low | 36.6 | Very low | 108 Ų | 108 | 160.7 Ų | 160.7 | 76% | 0.755 | 85% | 0.846 | S | S | * | * | trans | -96.1 | 159.6 | 157.1 | -64.6 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 41 | E | 35.9 | Very low | 36.4 | Very low | 179 Ų | 179 | 155.5 Ų | 155.5 | 84% | 0.836 | 84% | 0.835 | S | S | * | * | trans | 89.3 | 88.1 | 163.7 | -62.2 | 176 | 148.2 | 0 | 0 | 116.9 | ||||
| 42 | L | 38.6 | Very low | 36.4 | Very low | 156 Ų | 156 | 152.3 Ų | 152.3 | 82% | 0.817 | 83% | 0.829 | S | S | * | * | trans | -93.1 | 102.6 | 152.1 | -162.2 | 79.8 | 0 | 0 | 0 | 107.2 | ||||
| 43 | E | 41.1 | Very low | 36.5 | Very low | 181 Ų | 181 | 155.5 Ų | 155.5 | 85% | 0.846 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -66 | 140.7 | -178.6 | -70.7 | 177.1 | 142.4 | 0 | 0 | 113.1 | ||
| 44 | K | 43.8 | Very low | 36.7 | Very low | 200 Ų | 200 | 151.6 Ų | 151.6 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 150.8 | 163.9 | -96 | 179.5 | 176.2 | 179.5 | 0 | 109.8 | ||
| 45 | P | 37.2 | Very low | 36.4 | Very low | 128 Ų | 128 | 152.6 Ų | 152.6 | 83% | 0.831 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 137.9 | -162.8 | -9.7 | 27.6 | 0 | 0 | 0 | 113.9 | E47 | P45-E47 PolarHBondContact O-N 2.86Š|
| 46 | L | 37.8 | Very low | 36.7 | Very low | 175 Ų | 175 | 152.5 Ų | 152.5 | 92% | 0.916 | 81% | 0.814 | S | S | * | * | trans | -78.4 | 110.1 | 170.8 | -95.2 | 149 | 0 | 0 | 0 | 111.2 | ||||
| 47 | E | 37 | Very low | 36.6 | Very low | 180 Ų | 180 | 154 Ų | 154 | 84% | 0.841 | 82% | 0.817 | S | S | * | * | trans | -78 | 122.8 | 152.6 | -70 | 179.5 | 150.2 | 0 | 0 | 108.9 | P45 | P45-E47 PolarHBondContact O-N 2.86Š| ||
| 48 | Q | 38.1 | Very low | 36.9 | Very low | 185 Ų | 185 | 156.2 Ų | 156.2 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | trans | 162.9 | 101.7 | 145.8 | -96.4 | 175.7 | -21.2 | 0 | 0 | 109.7 | ||||
| 49 | I | 39.5 | Very low | 36.8 | Very low | 184 Ų | 184 | 158.8 Ų | 158.8 | 94% | 0.944 | 82% | 0.817 | S | S | * | * | trans | -128 | 94.4 | 157.3 | -60.8 | 176.3 | 0 | 0 | 0 | 105.8 | ||||
| 50 | D | 32.1 | Very low | 36.5 | Very low | 146 Ų | 146 | 158.9 Ų | 158.9 | 78% | 0.781 | 82% | 0.819 | S | S | * | * | trans | -128.4 | 150.3 | 162.4 | -169 | 17.1 | 0 | 0 | 0 | 108.6 | ||||
| 51 | S | 33.1 | Very low | 36.4 | Very low | 96 Ų | 96 | 158 Ų | 158 | 67% | 0.671 | 82% | 0.817 | S | S | * | * | trans | 70.7 | 109.4 | 167 | 63.2 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 52 | T | 36.3 | Very low | 36.3 | Very low | 132 Ų | 132 | 154.9 Ų | 154.9 | 81% | 0.81 | 81% | 0.814 | S | S | * | * | -169.7 | 105.4 | 116.8 | -60.7 | 0 | 0 | 0 | 0 | 109.2 | |||||
| 53 | I | 38.5 | Very low | 36 | Very low | 141 Ų | 141 | 152.4 Ų | 152.4 | 72% | 0.723 | 81% | 0.81 | S | S | * | * | trans | -88.1 | 147.3 | 155.3 | -61.6 | 168.5 | 0 | 0 | 0 | 106.2 | ||||
| 54 | P | 37.7 | Very low | 35.7 | Very low | 113 Ų | 113 | 148.9 Ų | 148.9 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | trans | -133.9 | 128.9 | 134.1 | 31.9 | -18 | 0 | 0 | 0 | 112.4 | ||||
| 55 | D | 31.5 | Very low | 35.5 | Very low | 145 Ų | 145 | 144.6 Ų | 144.6 | 78% | 0.775 | 80% | 0.801 | S | S | * | * | trans | -59.4 | 136 | 170.5 | -61.6 | -60 | 0 | 0 | 0 | 111.3 | ||||
| 56 | K | 39.7 | Very low | 35.5 | Very low | 193 Ų | 193 | 144.3 Ų | 144.3 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | trans | -108.1 | 94.1 | 165.1 | -90.4 | -175.8 | 173.9 | 179.3 | 0 | 108.7 | Q58 | K56-Q58 PolarHBondContact O-N 3.26Š| ||
| 57 | E | 31 | Very low | 35.6 | Very low | 185 Ų | 185 | 141.5 Ų | 141.5 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | trans | -70.1 | 115 | 154.7 | -82.5 | 178 | 117.7 | 0 | 0 | 108.7 | ||||
| 58 | Q | 38.9 | Very low | 35.3 | Very low | 167 Ų | 167 | 137.8 Ų | 137.8 | 78% | 0.78 | 78% | 0.782 | S | S | * | * | trans | -104.8 | 97.8 | 164.1 | -92.6 | 176.3 | -28.9 | 0 | 0 | 108.6 | K56 | K56-Q58 PolarHBondContact O-N 3.26Š| ||
| 59 | Q | 30.9 | Very low | 35.2 | Very low | 183 Ų | 183 | 134.1 Ų | 134.1 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | trans | -60.6 | 125.3 | 155.4 | -71 | 174.3 | 2.2 | 0 | 0 | 108.5 | ||||
| 60 | L | 34.9 | Very low | 35 | Very low | 160 Ų | 160 | 133.2 Ų | 133.2 | 84% | 0.838 | 76% | 0.763 | S | S | * | * | trans | -123.5 | 101 | 163.4 | -132.7 | 85.6 | 0 | 0 | 0 | 108.8 | ||||
| 61 | A | 30.5 | Very low | 35.1 | Very low | 88 Ų | 88 | 131.8 Ų | 131.8 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | trans | -84.7 | 135.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 62 | C | 33.9 | Very low | 35.5 | Very low | 114 Ų | 114 | 131.3 Ų | 131.3 | 77% | 0.77 | 77% | 0.771 | S | S | * | * | trans | -150.1 | 113.3 | 153.6 | -95.1 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 63 | S | 33.2 | Very low | 35.9 | Very low | 105 Ų | 105 | 128.7 Ų | 128.7 | 73% | 0.734 | 75% | 0.754 | S | S | * | * | 53.3 | 122.9 | 75 | -43.7 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 64 | S | 33.4 | Very low | 36.4 | Very low | 106 Ų | 106 | 126.8 Ų | 126.8 | 74% | 0.741 | 75% | 0.745 | S | S | * | * | cis | 176.8 | 177.3 | 8.6 | 38.4 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 65 | S | 39.4 | Very low | 37.5 | Very low | 111 Ų | 111 | 126.2 Ų | 126.2 | 78% | 0.776 | 74% | 0.74 | S | S | * | * | trans | 79.1 | 96.7 | 159.6 | 57.3 | 0 | 0 | 0 | 0 | 120 | ||||
| 66 | T | 37.2 | Very low | 39.2 | Very low | 122 Ų | 122 | 126.5 Ų | 126.5 | 75% | 0.748 | 74% | 0.736 | S | S | * | * | trans | -47.5 | 155.4 | 134.1 | -0.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 67 | P | 40.3 | Very low | 40.8 | Very low | 115 Ų | 115 | 121.8 Ų | 121.8 | 75% | 0.747 | 72% | 0.717 | S | S | * | * | -133.3 | 150.2 | 66.7 | 13.8 | 11.5 | 0 | 0 | 0 | 113.2 | |||||
| 68 | C | 31.4 | Very low | 42.9 | Very low | 102 Ų | 102 | 117.8 Ų | 117.8 | 69% | 0.689 | 70% | 0.701 | S | S | * | * | 50.1 | 121.8 | 89.7 | -43.8 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 69 | V | 35.9 | Very low | 44.8 | Very low | 108 Ų | 108 | 115.6 Ų | 115.6 | 66% | 0.655 | 69% | 0.691 | S | S | * | * | -179.3 | 162.1 | 51 | 178.4 | 0 | 0 | 0 | 0 | 105.3 | |||||
| 70 | E | 34.4 | Very low | 47.1 | Very low | 165 Ų | 165 | 113.9 Ų | 113.9 | 77% | 0.771 | 68% | 0.683 | S | S | * | * | trans | 73.4 | 129.5 | 153.7 | -86.7 | 146.4 | -129.8 | 0 | 0 | 115.7 | ||||
| 71 | T | 34.8 | Very low | 49.5 | Very low | 117 Ų | 117 | 112.8 Ų | 112.8 | 72% | 0.718 | 67% | 0.672 | S | S | * | * | cis | -174.5 | 133.9 | 4.6 | 6.8 | 0 | 0 | 0 | 0 | 103.9 | V73 | T71-V73 PolarHBondContact O-N 2.89Š| ||
| 72 | G | 41.7 | Very low | 52.1 | Low | 86 Ų | 86 | 112 Ų | 112 | 89% | 0.887 | 66% | 0.658 | S | S | * | * | trans | 54.2 | 56.9 | 162.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 73 | V | 44.3 | Very low | 54.6 | Low | 77 Ų | 77 | 112.7 Ų | 112.7 | 47% | 0.467 | 65% | 0.647 | S | S | . | * | trans | -99.5 | 119.4 | 166.1 | -175.6 | 0 | 0 | 0 | 0 | 106.8 | T71 V75 Q77 | T71-V73 PolarHBondContact O-N 2.89Å; V73-V75 PolarHBondContact O-N 3.47Å; V73-Q77 HydrophobicContact CG1-CB 4.13Å | ||
| 74 | D | 50.3 | Low | 57.2 | Low | 100 Ų | 100 | 109.1 Ų | 109.1 | 54% | 0.535 | 63% | 0.628 | S | S | . | * | trans | -36.9 | 123.9 | -175.9 | -68 | -53.7 | 0 | 0 | 0 | 111 | E76 Q77 L78 | D74-E76 HydrophobicContact CB-CB 4.34Å; D74-E76 PolarHBondContact O-N 3.38Å; D74-Q77 HydrophobicContact CB-CG 4.3Å; D74-Q77 PolarHBondContact O-N 3.35Å; D74-L78 PolarHBondContact O-N 2.75Å | ||
| 75 | V | 60.1 | Low | 59.7 | Low | 102 Ų | 102 | 110 Ų | 110 | 62% | 0.618 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -46.7 | -32.7 | 172 | 174.6 | 0 | 0 | 0 | 0 | 109.7 | V73 L78 E79 | V73-V75 PolarHBondContact O-N 3.47Å; V75-L78 PolarHBondContact O-N 3.34Å; V75-E79 HydrophobicContact CG1-CG 4.21Å; V75-E79 VanDerWaalsContact CG1-OE1 3.29Å; V75-E79 WeakPolarHBondContact CG1-OE1 3.15Å; V75-E79 VanDerWaalsContact O-CB 3.23Å; V75-E79 WeakPolarHBondContact O-CB 3.41Å; V75-E79 WeakPolarHBondContact O-CG 3.29Å; V75-E79 PolarHBondContact O-N 2.84Å |
| 76 | E | 67.5 | Low | 62.1 | Low | 150 Ų | 150 | 109 Ų | 109 | 70% | 0.701 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.3 | -42.2 | 173 | -61.3 | -174.8 | 168.1 | 0 | 0 | 114.7 | D74 E80 | D74-E76 HydrophobicContact CB-CB 4.34Å; D74-E76 PolarHBondContact O-N 3.38Å; E76-E80 WeakPolarHBondContact O-CB 3.24Å; E76-E80 PolarHBondContact O-N 3.32Å |
| 77 | Q | 72.5 | Confident | 64.6 | Low | 95 Ų | 95 | 107.3 Ų | 107.3 | 44% | 0.444 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -72.1 | -34.1 | 177.8 | -73.6 | -176.6 | 24.3 | 0 | 0 | 112.6 | V73 D74 K81 | V73-Q77 HydrophobicContact CG1-CB 4.13Å; D74-Q77 HydrophobicContact CB-CG 4.3Å; D74-Q77 PolarHBondContact O-N 3.35Å; Q77-K81 WeakPolarHBondContact O-CB 3.44Å; Q77-K81 WeakPolarHBondContact O-CG 3.32Å; Q77-K81 PolarHBondContact O-N 2.78Å |
| 78 | L | 74.5 | Confident | 66.9 | Low | 101 Ų | 101 | 104.2 Ų | 104.2 | 53% | 0.529 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -71 | -42.2 | 174.3 | -100.2 | 147.4 | 0 | 0 | 0 | 110.8 | D74 V75 K81 V82 | D74-L78 PolarHBondContact O-N 2.75Å; V75-L78 PolarHBondContact O-N 3.34Å; L78-K81 PolarHBondContact O-N 2.88Å; L78-V82 WeakPolarHBondContact O-CB 3.23Å; L78-V82 VanDerWaalsContact O-CG2 3.26Å; L78-V82 WeakPolarHBondContact O-CG2 3.33Å; L78-V82 PolarHBondContact O-N 2.88Å |
| 79 | E | 78.6 | Confident | 69.7 | Low | 121 Ų | 121 | 105.5 Ų | 105.5 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -61.9 | -42.2 | 173 | -77.6 | 175.6 | 178.6 | 0 | 0 | 111.6 | V75 V82 K83 | V75-E79 HydrophobicContact CG1-CG 4.21Å; V75-E79 VanDerWaalsContact CG1-OE1 3.29Å; V75-E79 WeakPolarHBondContact CG1-OE1 3.15Å; V75-E79 VanDerWaalsContact O-CB 3.23Å; V75-E79 WeakPolarHBondContact O-CB 3.41Å; V75-E79 WeakPolarHBondContact O-CG 3.29Å; V75-E79 PolarHBondContact O-N 2.84Å; E79-V82 PolarHBondContact O-N 3.41Å; E79-K83 VanDerWaalsContact O-CB 3.24Å; E79-K83 WeakPolarHBondContact O-CB 3.26Å; E79-K83 PolarHBondContact O-N 2.82Å |
| 80 | E | 80.9 | Confident | 72.4 | Confident | 147 Ų | 147 | 103.9 Ų | 103.9 | 69% | 0.687 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.8 | -40 | 175.7 | -169.8 | 173.3 | -156.7 | 0 | 0 | 111.9 | E76 K83 G84 | E76-E80 WeakPolarHBondContact O-CB 3.24Å; E76-E80 PolarHBondContact O-N 3.32Å; E80-K83 PolarHBondContact O-N 3.36Å; E80-G84 PolarHBondContact O-N 3.3Å |
| 81 | K | 85.1 | Confident | 75.1 | Confident | 137 Ų | 137 | 102.7 Ų | 102.7 | 60% | 0.596 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.3 | -42.7 | 173.2 | -79.7 | 177.6 | -179.5 | 173 | 0 | 112.5 | Q77 L78 K83 G84 L85 | Q77-K81 WeakPolarHBondContact O-CB 3.44Å; Q77-K81 WeakPolarHBondContact O-CG 3.32Å; Q77-K81 PolarHBondContact O-N 2.78Å; L78-K81 PolarHBondContact O-N 2.88Å; K81-K83 VanDerWaalsContact C-N 3.34Å; K81-G84 PolarHBondContact O-N 3.4Å; K81-L85 WeakPolarHBondContact O-CB 3.31Å; K81-L85 VanDerWaalsContact O-CG 3.27Å; K81-L85 WeakPolarHBondContact O-CG 3.44Å; K81-L85 PolarHBondContact O-N 3.03Å |
| 82 | V | 84.6 | Confident | 77.8 | Confident | 72 Ų | 72 | 102.4 Ų | 102.4 | 44% | 0.436 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.4 | -46.7 | 175.5 | 167.8 | 0 | 0 | 0 | 0 | 109.5 | L78 E79 G84 L85 E86 | L78-V82 WeakPolarHBondContact O-CB 3.23Å; L78-V82 VanDerWaalsContact O-CG2 3.26Å; L78-V82 WeakPolarHBondContact O-CG2 3.33Å; L78-V82 PolarHBondContact O-N 2.88Å; E79-V82 PolarHBondContact O-N 3.41Å; V82-G84 PolarHBondContact O-N 3.22Å; V82-L85 PolarHBondContact O-N 3.39Å; V82-E86 HydrophobicContact CG1-CG 4.33Å; V82-E86 WeakPolarHBondContact O-CB 3.31Å; V82-E86 VanDerWaalsContact O-CG 3.31Å; V82-E86 WeakPolarHBondContact O-CG 3.39Å; V82-E86 PolarHBondContact O-N 2.84Å |
| 83 | K | 86.6 | Confident | 80.3 | Confident | 127 Ų | 127 | 102.7 Ų | 102.7 | 55% | 0.552 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.2 | -42.8 | 177.1 | -167.9 | 178.5 | 177.7 | -174 | 0 | 112.1 | E79 E80 K81 E86 E87 | E79-K83 VanDerWaalsContact O-CB 3.24Å; E79-K83 WeakPolarHBondContact O-CB 3.26Å; E79-K83 PolarHBondContact O-N 2.82Å; E80-K83 PolarHBondContact O-N 3.36Å; K81-K83 VanDerWaalsContact C-N 3.34Å; K83-E86 PolarHBondContact O-N 3.28Å; K83-E87 WeakPolarHBondContact O-CB 3.27Å; K83-E87 VanDerWaalsContact O-CG 3.29Å; K83-E87 WeakPolarHBondContact O-CG 3.4Å; K83-E87 PolarHBondContact O-N 2.86Å |
| 84 | G | 87.5 | Confident | 82.5 | Confident | 31 Ų | 31 | 103.6 Ų | 103.6 | 32% | 0.32 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.6 | -38.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | E80 K81 V82 S88 | E80-G84 PolarHBondContact O-N 3.3Å; K81-G84 PolarHBondContact O-N 3.4Å; V82-G84 PolarHBondContact O-N 3.22Å; G84-S88 VanDerWaalsContact O-CB 3.32Å; G84-S88 WeakPolarHBondContact O-CB 3.34Å; G84-S88 PolarHBondContact O-N 3.42Å |
| 85 | L | 87 | Confident | 84.6 | Confident | 124 Ų | 124 | 102.9 Ų | 102.9 | 65% | 0.649 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -69.5 | -39.5 | 173.6 | -75.1 | 172.7 | 0 | 0 | 0 | 112 | K81 V82 S88 R89 | K81-L85 WeakPolarHBondContact O-CB 3.31Å; K81-L85 VanDerWaalsContact O-CG 3.27Å; K81-L85 WeakPolarHBondContact O-CG 3.44Å; K81-L85 PolarHBondContact O-N 3.03Å; V82-L85 PolarHBondContact O-N 3.39Å; L85-S88 PolarHBondContact O-N 3.36Å; L85-R89 VanDerWaalsContact O-CB 3.27Å; L85-R89 WeakPolarHBondContact O-CB 3.29Å; L85-R89 PolarHBondContact O-N 3.5Å |
| 86 | E | 89.1 | Confident | 86.1 | Confident | 90 Ų | 90 | 102.5 Ų | 102.5 | 42% | 0.421 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.5 | -43 | 174.9 | -77.2 | -177.7 | 162.4 | 0 | 0 | 111.6 | V82 K83 R89 N90 | V82-E86 HydrophobicContact CG1-CG 4.33Å; V82-E86 WeakPolarHBondContact O-CB 3.31Å; V82-E86 VanDerWaalsContact O-CG 3.31Å; V82-E86 WeakPolarHBondContact O-CG 3.39Å; V82-E86 PolarHBondContact O-N 2.84Å; K83-E86 PolarHBondContact O-N 3.28Å; E86-R89 PolarHBondContact O-N 3.46Å; E86-N90 VanDerWaalsContact O-CB 3.31Å; E86-N90 WeakPolarHBondContact O-CB 3.39Å; E86-N90 PolarHBondContact O-N 2.73Å; E86-N90 PolarHBondContact O-ND2 2.94Å; E86-N90 PolarHBondContact O-OD1 3.49Å |
| 87 | E | 89.5 | Confident | 87.3 | Confident | 87 Ų | 87 | 99.1 Ų | 99.1 | 41% | 0.407 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.2 | -42.5 | 172.3 | -74.8 | 176.7 | -166.4 | 0 | 0 | 111.4 | K83 N90 R91 | K83-E87 WeakPolarHBondContact O-CB 3.27Å; K83-E87 VanDerWaalsContact O-CG 3.29Å; K83-E87 WeakPolarHBondContact O-CG 3.4Å; K83-E87 PolarHBondContact O-N 2.86Å; E87-N90 PolarHBondContact O-N 2.82Å; E87-R91 WeakPolarHBondContact O-CB 3.27Å; E87-R91 WeakPolarHBondContact O-CG 3.47Å; E87-R91 PolarHBondContact O-N 3.16Å; E87-R91 IonicContact OE2-NH1 3.35Å |
| 88 | S | 89.1 | Confident | 88.3 | Confident | 49 Ų | 49 | 96.4 Ų | 96.4 | 34% | 0.343 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.4 | -40.8 | 175.4 | -166.1 | 0 | 0 | 0 | 0 | 112.2 | G84 L85 R91 L92 | G84-S88 VanDerWaalsContact O-CB 3.32Å; G84-S88 WeakPolarHBondContact O-CB 3.34Å; G84-S88 PolarHBondContact O-N 3.42Å; L85-S88 PolarHBondContact O-N 3.36Å; S88-R91 PolarHBondContact O-N 2.8Å; S88-L92 WeakPolarHBondContact O-CB 3.32Å; S88-L92 VanDerWaalsContact O-CG 3.29Å; S88-L92 WeakPolarHBondContact O-CG 3.34Å; S88-L92 PolarHBondContact O-N 3.44Å |
| 89 | R | 90.5 | Very high | 89.2 | Confident | 129 Ų | 129 | 96.6 Ų | 96.6 | 49% | 0.487 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.6 | -46.3 | 174.8 | -178 | -159.5 | 68.6 | -164.8 | -4.4 | 110.2 | L85 E86 L92 L93 | L85-R89 VanDerWaalsContact O-CB 3.27Å; L85-R89 WeakPolarHBondContact O-CB 3.29Å; L85-R89 PolarHBondContact O-N 3.5Å; E86-R89 PolarHBondContact O-N 3.46Å; R89-L92 PolarHBondContact O-N 3.03Å; R89-L93 HydrophobicContact CG-CD1 4.19Å; R89-L93 WeakPolarHBondContact O-CB 3.29Å; R89-L93 WeakPolarHBondContact O-CG 3.4Å; R89-L93 PolarHBondContact O-N 2.89Å |
| 90 | N | 91 | Very high | 89.9 | Confident | 75 Ų | 75 | 93.7 Ų | 93.7 | 40% | 0.401 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.8 | -40.4 | 179.2 | -66.6 | -13.6 | 0 | 0 | 0 | 111 | E86 E87 L93 V94 | E86-N90 VanDerWaalsContact O-CB 3.31Å; E86-N90 WeakPolarHBondContact O-CB 3.39Å; E86-N90 PolarHBondContact O-N 2.73Å; E86-N90 PolarHBondContact O-ND2 2.94Å; E86-N90 PolarHBondContact O-OD1 3.49Å; E87-N90 PolarHBondContact O-N 2.82Å; N90-L93 PolarHBondContact O-N 2.96Å; N90-V94 WeakPolarHBondContact O-CG2 3.42Å; N90-V94 PolarHBondContact O-N 3.47Å |
| 91 | R | 92.2 | Very high | 90.5 | Very high | 139 Ų | 139 | 94.1 Ų | 94.1 | 53% | 0.525 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.2 | -48.9 | 171.2 | -79.4 | -174.4 | -75.2 | -106.7 | -3.1 | 111.7 | E87 S88 L93 V94 D95 | E87-R91 WeakPolarHBondContact O-CB 3.27Å; E87-R91 WeakPolarHBondContact O-CG 3.47Å; E87-R91 PolarHBondContact O-N 3.16Å; E87-R91 IonicContact OE2-NH1 3.35Å; S88-R91 PolarHBondContact O-N 2.8Å; R91-L93 VanDerWaalsContact C-N 3.33Å; R91-L93 PolarHBondContact O-N 2.81Å; R91-V94 PolarHBondContact O-N 2.82Å; R91-D95 PolarHBondContact O-N 3.31Å |
| 92 | L | 91.7 | Very high | 90.9 | Very high | 111 Ų | 111 | 93.2 Ų | 93.2 | 58% | 0.581 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -63.2 | -36 | 178.4 | -74.9 | 171.4 | 0 | 0 | 0 | 113 | S88 R89 D95 N96 | S88-L92 WeakPolarHBondContact O-CB 3.32Å; S88-L92 VanDerWaalsContact O-CG 3.29Å; S88-L92 WeakPolarHBondContact O-CG 3.34Å; S88-L92 PolarHBondContact O-N 3.44Å; R89-L92 PolarHBondContact O-N 3.03Å; L92-D95 PolarHBondContact O-N 3.25Å; L92-N96 WeakPolarHBondContact O-CB 3.42Å; L92-N96 PolarHBondContact O-N 2.91Å |
| 93 | L | 93.1 | Very high | 91.4 | Very high | 93 Ų | 93 | 94.6 Ų | 94.6 | 49% | 0.487 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.9 | -44 | 174.6 | -75.2 | 171.7 | 0 | 0 | 0 | 111.2 | R89 N90 R91 D95 N96 D97 | R89-L93 HydrophobicContact CG-CD1 4.19Å; R89-L93 WeakPolarHBondContact O-CB 3.29Å; R89-L93 WeakPolarHBondContact O-CG 3.4Å; R89-L93 PolarHBondContact O-N 2.89Å; N90-L93 PolarHBondContact O-N 2.96Å; R91-L93 VanDerWaalsContact C-N 3.33Å; R91-L93 PolarHBondContact O-N 2.81Å; L93-D95 VanDerWaalsContact C-N 3.34Å; L93-D95 PolarHBondContact O-N 2.97Å; L93-N96 PolarHBondContact O-N 3.45Å; L93-D97 WeakPolarHBondContact O-CB 3.29Å; L93-D97 PolarHBondContact O-N 2.79Å |
| 94 | V | 92.2 | Very high | 91.8 | Very high | 95 Ų | 95 | 94 Ų | 94 | 58% | 0.576 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.4 | -42.8 | 174.9 | 172.3 | 0 | 0 | 0 | 0 | 111.1 | N90 R91 D97 S98 | N90-V94 WeakPolarHBondContact O-CG2 3.42Å; N90-V94 PolarHBondContact O-N 3.47Å; R91-V94 PolarHBondContact O-N 2.82Å; V94-D97 PolarHBondContact O-N 3.48Å; V94-S98 WeakPolarHBondContact O-CB 3.41Å; V94-S98 PolarHBondContact O-N 3.4Å |
| 95 | D | 93.2 | Very high | 92.1 | Very high | 86 Ų | 86 | 99.7 Ų | 99.7 | 46% | 0.46 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.5 | -43.3 | 177.1 | -71.6 | -14.7 | 0 | 0 | 0 | 111.2 | R91 L92 L93 S98 L99 | R91-D95 PolarHBondContact O-N 3.31Å; L92-D95 PolarHBondContact O-N 3.25Å; L93-D95 VanDerWaalsContact C-N 3.34Å; L93-D95 PolarHBondContact O-N 2.97Å; D95-S98 PolarHBondContact O-N 2.87Å; D95-S98 VanDerWaalsContact O-N 3.16Å; D95-S98 PolarHBondContact O-OG 3.25Å; D95-L99 WeakPolarHBondContact O-CB 3.19Å; D95-L99 VanDerWaalsContact O-CG 3.29Å; D95-L99 WeakPolarHBondContact O-CG 3.42Å; D95-L99 PolarHBondContact O-N 3.35Å |
| 96 | N | 92.8 | Very high | 92.5 | Very high | 94 Ų | 94 | 98.7 Ų | 98.7 | 50% | 0.503 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 177.1 | -166.5 | -76.7 | 0 | 0 | 0 | 111.8 | L92 L93 S98 L99 T100 | L92-N96 WeakPolarHBondContact O-CB 3.42Å; L92-N96 PolarHBondContact O-N 2.91Å; L93-N96 PolarHBondContact O-N 3.45Å; N96-S98 VanDerWaalsContact C-N 3.3Å; N96-S98 PolarHBondContact O-N 3.21Å; N96-L99 PolarHBondContact O-N 3.25Å; N96-T100 WeakPolarHBondContact O-CB 3.32Å; N96-T100 PolarHBondContact O-N 3.4Å; N96-T100 PolarHBondContact O-OG1 2.78Å; N96-T100 PolarHBondContact OD1-OG1 2.84Å |
| 97 | D | 92.4 | Very high | 92.8 | Very high | 78 Ų | 78 | 100 Ų | 100 | 42% | 0.417 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.9 | -41 | 172.9 | -80.2 | -3.2 | 0 | 0 | 0 | 111.3 | L93 V94 R101 | L93-D97 WeakPolarHBondContact O-CB 3.29Å; L93-D97 PolarHBondContact O-N 2.79Å; V94-D97 PolarHBondContact O-N 3.48Å; D97-R101 VanDerWaalsContact O-CG 3.29Å; D97-R101 WeakPolarHBondContact O-CG 3.28Å; D97-R101 PolarHBondContact O-N 3.21Å; D97-R101 IonicContact OD2-NH2 3.97Å |
| 98 | S | 92.9 | Very high | 93 | Very high | 39 Ų | 39 | 101.8 Ų | 101.8 | 27% | 0.273 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.6 | -41.2 | 177.6 | 85.1 | 0 | 0 | 0 | 0 | 112.1 | V94 D95 N96 R101 Q102 | V94-S98 WeakPolarHBondContact O-CB 3.41Å; V94-S98 PolarHBondContact O-N 3.4Å; D95-S98 PolarHBondContact O-N 2.87Å; D95-S98 VanDerWaalsContact O-N 3.16Å; D95-S98 PolarHBondContact O-OG 3.25Å; N96-S98 VanDerWaalsContact C-N 3.3Å; N96-S98 PolarHBondContact O-N 3.21Å; S98-R101 PolarHBondContact O-N 3.46Å; S98-Q102 VanDerWaalsContact O-CG 3.31Å; S98-Q102 WeakPolarHBondContact O-CG 3.44Å; S98-Q102 PolarHBondContact O-N 2.89Å |
| 99 | L | 93.9 | Very high | 93.3 | Very high | 105 Ų | 105 | 101.4 Ų | 101.4 | 55% | 0.55 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -68.9 | -39.5 | 177.9 | -74.3 | 170.6 | 0 | 0 | 0 | 111.1 | D95 N96 Q102 L103 | D95-L99 WeakPolarHBondContact O-CB 3.19Å; D95-L99 VanDerWaalsContact O-CG 3.29Å; D95-L99 WeakPolarHBondContact O-CG 3.42Å; D95-L99 PolarHBondContact O-N 3.35Å; N96-L99 PolarHBondContact O-N 3.25Å; L99-Q102 PolarHBondContact O-N 3.25Å; L99-L103 WeakPolarHBondContact O-CB 3.31Å; L99-L103 PolarHBondContact O-N 2.9Å |
| 100 | T | 93.5 | Very high | 93.5 | Very high | 60 Ų | 60 | 99.8 Ų | 99.8 | 37% | 0.368 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.6 | -46.5 | 175.6 | -58.8 | 0 | 0 | 0 | 0 | 110.4 | N96 Q102 L103 E104 | N96-T100 WeakPolarHBondContact O-CB 3.32Å; N96-T100 PolarHBondContact O-N 3.4Å; N96-T100 PolarHBondContact O-OG1 2.78Å; N96-T100 PolarHBondContact OD1-OG1 2.84Å; T100-Q102 VanDerWaalsContact C-N 3.33Å; T100-Q102 PolarHBondContact O-N 3.42Å; T100-L103 PolarHBondContact O-N 2.93Å; T100-E104 WeakPolarHBondContact O-CG 3.41Å; T100-E104 PolarHBondContact O-N 3.44Å |
| 101 | R | 92.9 | Very high | 93.7 | Very high | 155 Ų | 155 | 98.7 Ų | 98.7 | 59% | 0.585 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.4 | -39.2 | 173.9 | -70.6 | 177.2 | -161.7 | 121.7 | 8.3 | 112.7 | D97 S98 Y105 | D97-R101 VanDerWaalsContact O-CG 3.29Å; D97-R101 WeakPolarHBondContact O-CG 3.28Å; D97-R101 PolarHBondContact O-N 3.21Å; D97-R101 IonicContact OD2-NH2 3.97Å; S98-R101 PolarHBondContact O-N 3.46Å; R101-Y105 WeakPolarHBondContact O-CB 3.29Å; R101-Y105 PolarHBondContact O-N 2.8Å |
| 102 | Q | 94.2 | Very high | 93.8 | Very high | 118 Ų | 118 | 96 Ų | 96 | 55% | 0.551 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -66.3 | -41 | 175.6 | -75.6 | 178.5 | 31.6 | 0 | 0 | 111.9 | S98 L99 T100 Y105 Q106 | S98-Q102 VanDerWaalsContact O-CG 3.31Å; S98-Q102 WeakPolarHBondContact O-CG 3.44Å; S98-Q102 PolarHBondContact O-N 2.89Å; L99-Q102 PolarHBondContact O-N 3.25Å; T100-Q102 VanDerWaalsContact C-N 3.33Å; T100-Q102 PolarHBondContact O-N 3.42Å; Q102-Y105 PolarHBondContact O-N 3.45Å; Q102-Q106 WeakPolarHBondContact O-CB 3.48Å; Q102-Q106 VanDerWaalsContact O-CG 3.28Å; Q102-Q106 WeakPolarHBondContact O-CG 3.28Å; Q102-Q106 PolarHBondContact O-N 2.86Å |
| 103 | L | 94.5 | Very high | 94 | Very high | 102 Ų | 102 | 95.5 Ų | 95.5 | 53% | 0.534 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 176.1 | -172.9 | 76.5 | 0 | 0 | 0 | 110.9 | L99 T100 Y105 Q106 Q107 | L99-L103 WeakPolarHBondContact O-CB 3.31Å; L99-L103 PolarHBondContact O-N 2.9Å; T100-L103 PolarHBondContact O-N 2.93Å; L103-Y105 VanDerWaalsContact C-N 3.33Å; L103-Y105 PolarHBondContact O-N 2.7Å; L103-Q106 PolarHBondContact O-N 3.15Å; L103-Q107 WeakPolarHBondContact O-CB 3.42Å; L103-Q107 VanDerWaalsContact O-CG 3.3Å; L103-Q107 WeakPolarHBondContact O-CG 3.3Å; L103-Q107 PolarHBondContact O-N 2.86Å |
| 104 | E | 94.5 | Very high | 94.1 | Very high | 114 Ų | 114 | 97.8 Ų | 97.8 | 53% | 0.533 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59 | -44 | 175.3 | -73.4 | 174.6 | 178.2 | 0 | 0 | 111.5 | T100 Q107 K108 | T100-E104 WeakPolarHBondContact O-CG 3.41Å; T100-E104 PolarHBondContact O-N 3.44Å; E104-Q107 PolarHBondContact O-N 3.14Å; E104-K108 WeakPolarHBondContact O-CB 3.37Å; E104-K108 PolarHBondContact O-N 3.41Å |
| 105 | Y | 94.3 | Very high | 94.2 | Very high | 151 Ų | 151 | 100.1 Ų | 100.1 | 59% | 0.592 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.5 | -45.5 | 174.9 | 179.6 | -97.8 | 0 | 0 | 0 | 111.7 | R101 Q102 L103 K108 V109 | R101-Y105 WeakPolarHBondContact O-CB 3.29Å; R101-Y105 PolarHBondContact O-N 2.8Å; Q102-Y105 PolarHBondContact O-N 3.45Å; L103-Y105 VanDerWaalsContact C-N 3.33Å; L103-Y105 PolarHBondContact O-N 2.7Å; Y105-K108 WeakPolarHBondContact O-CB 3.37Å; Y105-K108 PolarHBondContact O-N 3.45Å; Y105-V109 HydrophobicContact CD1-CG2 4.18Å; Y105-V109 HydrophobicContact CE1-CG2 3.73Å; Y105-V109 HydrophobicContact CE2-CG2 4.16Å; Y105-V109 WeakPolarHBondContact O-CG2 3.41Å; Y105-V109 PolarHBondContact O-N 2.8Å |
| 106 | Q | 94.9 | Very high | 94.2 | Very high | 103 Ų | 103 | 102.9 Ų | 102.9 | 48% | 0.481 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.2 | -39.5 | 177.4 | -73.2 | -65.2 | -18.8 | 0 | 0 | 112.4 | Q102 L103 K108 V109 N110 | Q102-Q106 WeakPolarHBondContact O-CB 3.48Å; Q102-Q106 VanDerWaalsContact O-CG 3.28Å; Q102-Q106 WeakPolarHBondContact O-CG 3.28Å; Q102-Q106 PolarHBondContact O-N 2.86Å; L103-Q106 PolarHBondContact O-N 3.15Å; Q106-K108 VanDerWaalsContact C-N 3.33Å; Q106-V109 PolarHBondContact O-N 3.49Å; Q106-N110 VanDerWaalsContact O-CB 3.28Å; Q106-N110 WeakPolarHBondContact O-CB 3.3Å; Q106-N110 VanDerWaalsContact O-CG 3.31Å; Q106-N110 PolarHBondContact O-N 3.36Å; Q106-N110 PolarHBondContact O-ND2 3.38Å |
| 107 | Q | 95.1 | Very high | 94.3 | Very high | 116 Ų | 116 | 103.3 Ų | 103.3 | 54% | 0.542 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 173.5 | -75.5 | 176.5 | -7.2 | 0 | 0 | 111 | L103 E104 N110 S111 | L103-Q107 WeakPolarHBondContact O-CB 3.42Å; L103-Q107 VanDerWaalsContact O-CG 3.3Å; L103-Q107 WeakPolarHBondContact O-CG 3.3Å; L103-Q107 PolarHBondContact O-N 2.86Å; E104-Q107 PolarHBondContact O-N 3.14Å; Q107-N110 PolarHBondContact O-N 2.79Å; Q107-S111 WeakPolarHBondContact O-CB 3.21Å; Q107-S111 PolarHBondContact O-N 3.04Å |
| 108 | K | 95 | Very high | 94.3 | Very high | 125 Ų | 125 | 104.5 Ų | 104.5 | 54% | 0.543 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.9 | -51.1 | 175.7 | -173.6 | 175.7 | 179.7 | -179.6 | 0 | 111.3 | E104 Y105 Q106 N110 S111 E112 | E104-K108 WeakPolarHBondContact O-CB 3.37Å; E104-K108 PolarHBondContact O-N 3.41Å; Y105-K108 WeakPolarHBondContact O-CB 3.37Å; Y105-K108 PolarHBondContact O-N 3.45Å; Q106-K108 VanDerWaalsContact C-N 3.33Å; K108-N110 PolarHBondContact O-N 3.01Å; K108-S111 PolarHBondContact O-N 2.81Å; K108-S111 VanDerWaalsContact O-N 3.15Å; K108-S111 PolarHBondContact O-OG 3.23Å; K108-E112 WeakPolarHBondContact CE-OE1 3.06Å; K108-E112 WeakPolarHBondContact O-CG 3.34Å; K108-E112 PolarHBondContact O-N 3.16Å |
| 109 | V | 95 | Very high | 94.2 | Very high | 41 Ų | 41 | 106.6 Ų | 106.6 | 25% | 0.248 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -59.8 | -44.2 | 177.5 | 172.7 | 0 | 0 | 0 | 0 | 111.2 | Y105 Q106 S111 E112 L113 | Y105-V109 HydrophobicContact CD1-CG2 4.18Å; Y105-V109 HydrophobicContact CE1-CG2 3.73Å; Y105-V109 HydrophobicContact CE2-CG2 4.16Å; Y105-V109 WeakPolarHBondContact O-CG2 3.41Å; Y105-V109 PolarHBondContact O-N 2.8Å; Q106-V109 PolarHBondContact O-N 3.49Å; V109-S111 VanDerWaalsContact C-N 3.33Å; V109-S111 PolarHBondContact O-N 2.89Å; V109-E112 PolarHBondContact O-N 3.42Å; V109-L113 HydrophobicContact CG1-CD1 3.84Å; V109-L113 HydrophobicContact CG1-CG 4.18Å; V109-L113 WeakPolarHBondContact O-CB 3.45Å; V109-L113 VanDerWaalsContact O-CG 3.3Å; V109-L113 WeakPolarHBondContact O-CG 3.49Å; V109-L113 PolarHBondContact O-N 2.68Å |
| 110 | N | 95.3 | Very high | 94 | Very high | 96 Ų | 96 | 105.1 Ų | 105.1 | 51% | 0.513 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.1 | -38.2 | 175.9 | -79.3 | -31.6 | 0 | 0 | 0 | 112.5 | Q106 Q107 K108 K114 | Q106-N110 VanDerWaalsContact O-CB 3.28Å; Q106-N110 WeakPolarHBondContact O-CB 3.3Å; Q106-N110 VanDerWaalsContact O-CG 3.31Å; Q106-N110 PolarHBondContact O-N 3.36Å; Q106-N110 PolarHBondContact O-ND2 3.38Å; Q107-N110 PolarHBondContact O-N 2.79Å; K108-N110 PolarHBondContact O-N 3.01Å; N110-K114 VanDerWaalsContact O-CB 3.24Å; N110-K114 WeakPolarHBondContact O-CB 3.39Å; N110-K114 PolarHBondContact O-N 2.95Å |
| 111 | S | 94 | Very high | 94 | Very high | 51 Ų | 51 | 107.3 Ų | 107.3 | 36% | 0.357 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66 | -40.1 | 176.1 | 81.2 | 0 | 0 | 0 | 0 | 111.7 | Q107 K108 V109 K115 | Q107-S111 WeakPolarHBondContact O-CB 3.21Å; Q107-S111 PolarHBondContact O-N 3.04Å; K108-S111 PolarHBondContact O-N 2.81Å; K108-S111 VanDerWaalsContact O-N 3.15Å; K108-S111 PolarHBondContact O-OG 3.23Å; V109-S111 VanDerWaalsContact C-N 3.33Å; V109-S111 PolarHBondContact O-N 2.89Å; S111-K115 WeakPolarHBondContact O-CB 3.37Å; S111-K115 VanDerWaalsContact O-CG 3.26Å; S111-K115 WeakPolarHBondContact O-CG 3.19Å; S111-K115 PolarHBondContact O-N 2.81Å |
| 112 | E | 93.7 | Very high | 93.9 | Very high | 83 Ų | 83 | 101.7 Ų | 101.7 | 39% | 0.388 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -68.8 | -47 | 176.3 | -72.4 | 179.3 | -169.8 | 0 | 0 | 110.5 | K108 V109 K114 K115 F116 | K108-E112 WeakPolarHBondContact CE-OE1 3.06Å; K108-E112 WeakPolarHBondContact O-CG 3.34Å; K108-E112 PolarHBondContact O-N 3.16Å; V109-E112 PolarHBondContact O-N 3.42Å; E112-K114 VanDerWaalsContact C-N 3.35Å; E112-K114 PolarHBondContact O-N 3.2Å; E112-K115 WeakPolarHBondContact O-CB 3.24Å; E112-K115 PolarHBondContact O-N 3.36Å; E112-K115 VanDerWaalsContact O-N 3.14Å; E112-F116 HydrophobicContact CB-CD2 4.36Å; E112-F116 HydrophobicContact CB-CE2 4.29Å; E112-F116 WeakPolarHBondContact O-CD2 3.26Å; E112-F116 PolarHBondContact O-N 2.81Å |
| 113 | L | 95.9 | Very high | 93.8 | Very high | 101 Ų | 101 | 99.2 Ų | 99.2 | 53% | 0.529 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.2 | -42.5 | 175.2 | -72.7 | 174.9 | 0 | 0 | 0 | 112.2 | V109 F116 L117 | V109-L113 HydrophobicContact CG1-CD1 3.84Å; V109-L113 HydrophobicContact CG1-CG 4.18Å; V109-L113 WeakPolarHBondContact O-CB 3.45Å; V109-L113 VanDerWaalsContact O-CG 3.3Å; V109-L113 WeakPolarHBondContact O-CG 3.49Å; V109-L113 PolarHBondContact O-N 2.68Å; L113-F116 PolarHBondContact O-N 3.4Å; L113-L117 VanDerWaalsContact O-CB 3.26Å; L113-L117 WeakPolarHBondContact O-CB 3.3Å; L113-L117 PolarHBondContact O-N 3.48Å |
| 114 | K | 96.7 | Very high | 93.9 | Very high | 141 Ų | 141 | 97.9 Ų | 97.9 | 61% | 0.613 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.6 | -44.7 | 174.5 | -178.8 | 178.1 | 177.9 | -178.5 | 0 | 111 | N110 E112 L117 I118 | N110-K114 VanDerWaalsContact O-CB 3.24Å; N110-K114 WeakPolarHBondContact O-CB 3.39Å; N110-K114 PolarHBondContact O-N 2.95Å; E112-K114 VanDerWaalsContact C-N 3.35Å; E112-K114 PolarHBondContact O-N 3.2Å; K114-L117 PolarHBondContact O-N 3.02Å; K114-I118 HydrophobicContact CD-CD1 4.4Å; K114-I118 HydrophobicContact CG-CD1 3.71Å; K114-I118 HydrophobicContact CG-CG1 4.38Å; K114-I118 WeakPolarHBondContact O-CB 3.26Å; K114-I118 WeakPolarHBondContact O-CG1 3.48Å; K114-I118 PolarHBondContact O-N 3.4Å |
| 115 | K | 94.2 | Very high | 93.9 | Very high | 144 Ų | 144 | 97.1 Ų | 97.1 | 63% | 0.626 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.5 | -46.4 | 175.4 | -75.2 | 172.3 | -178.4 | 178.2 | 0 | 111.6 | S111 E112 I118 S119 | S111-K115 WeakPolarHBondContact O-CB 3.37Å; S111-K115 VanDerWaalsContact O-CG 3.26Å; S111-K115 WeakPolarHBondContact O-CG 3.19Å; S111-K115 PolarHBondContact O-N 2.81Å; E112-K115 WeakPolarHBondContact O-CB 3.24Å; E112-K115 PolarHBondContact O-N 3.36Å; E112-K115 VanDerWaalsContact O-N 3.14Å; K115-I118 PolarHBondContact O-N 2.95Å; K115-S119 VanDerWaalsContact O-CB 3.26Å; K115-S119 WeakPolarHBondContact O-CB 3.3Å; K115-S119 PolarHBondContact O-N 3.46Å |
| 116 | F | 92.4 | Very high | 93.9 | Very high | 143 Ų | 143 | 97 Ų | 97 | 63% | 0.627 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.3 | -43.3 | 176.8 | -79.1 | -64.3 | 0 | 0 | 0 | 111.8 | E112 L113 S119 S120 | E112-F116 HydrophobicContact CB-CD2 4.36Å; E112-F116 HydrophobicContact CB-CE2 4.29Å; E112-F116 WeakPolarHBondContact O-CD2 3.26Å; E112-F116 PolarHBondContact O-N 2.81Å; L113-F116 PolarHBondContact O-N 3.4Å; F116-S119 PolarHBondContact O-N 2.87Å; F116-S120 VanDerWaalsContact O-CB 3.3Å; F116-S120 WeakPolarHBondContact O-CB 3.34Å; F116-S120 PolarHBondContact O-N 2.97Å |
| 117 | L | 94.9 | Very high | 93.9 | Very high | 104 Ų | 104 | 97.6 Ų | 97.6 | 55% | 0.545 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.8 | -48.2 | 178 | -175 | 70.1 | 0 | 0 | 0 | 111.4 | L113 K114 S119 S120 M121 | L113-L117 VanDerWaalsContact O-CB 3.26Å; L113-L117 WeakPolarHBondContact O-CB 3.3Å; L113-L117 PolarHBondContact O-N 3.48Å; K114-L117 PolarHBondContact O-N 3.02Å; L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 2.86Å; L117-S120 PolarHBondContact O-N 3.49Å; L117-M121 HydrophobicContact CD1-CG 4.14Å; L117-M121 HydrophobicContact CD1-SD 3.89Å; L117-M121 HydrophobicContact CD2-SD 4.31Å; L117-M121 HydrophobicContact CG-CG 4.32Å; L117-M121 HydrophobicContact CG-SD 3.83Å; L117-M121 WeakPolarHBondContact O-CB 3.26Å; L117-M121 WeakPolarHBondContact O-CG 3.43Å; L117-M121 PolarHBondContact O-N 2.95Å |
| 118 | I | 93.4 | Very high | 94 | Very high | 103 Ų | 103 | 97.1 Ų | 97.1 | 53% | 0.528 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.4 | -43.4 | 176 | -68.7 | 168.2 | 0 | 0 | 0 | 109.9 | K114 K115 G122 | K114-I118 HydrophobicContact CD-CD1 4.4Å; K114-I118 HydrophobicContact CG-CD1 3.71Å; K114-I118 HydrophobicContact CG-CG1 4.38Å; K114-I118 WeakPolarHBondContact O-CB 3.26Å; K114-I118 WeakPolarHBondContact O-CG1 3.48Å; K114-I118 PolarHBondContact O-N 3.4Å; K115-I118 PolarHBondContact O-N 2.95Å; I118-G122 WeakPolarHBondContact O-CA 3.26Å; I118-G122 PolarHBondContact O-N 2.96Å |
| 119 | S | 89.6 | Confident | 94.1 | Very high | 82 Ų | 82 | 96.8 Ų | 96.8 | 57% | 0.573 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.8 | -40.3 | 177.6 | -174.4 | 0 | 0 | 0 | 0 | 112.4 | K115 F116 L117 S123 | K115-S119 VanDerWaalsContact O-CB 3.26Å; K115-S119 WeakPolarHBondContact O-CB 3.3Å; K115-S119 PolarHBondContact O-N 3.46Å; F116-S119 PolarHBondContact O-N 2.87Å; L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 2.86Å; S119-S123 PolarHBondContact O-N 3.35Å; S119-S123 PolarHBondContact O-OG 3.4Å |
| 120 | S | 91.1 | Very high | 94.2 | Very high | 75 Ų | 75 | 96.3 Ų | 96.3 | 52% | 0.524 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -73 | -38.3 | 179.5 | -174 | 0 | 0 | 0 | 0 | 112.7 | F116 L117 S123 D124 | F116-S120 VanDerWaalsContact O-CB 3.3Å; F116-S120 WeakPolarHBondContact O-CB 3.34Å; F116-S120 PolarHBondContact O-N 2.97Å; L117-S120 PolarHBondContact O-N 3.49Å; S120-S123 PolarHBondContact O-OG 3.39Å; S120-S123 VanDerWaalsContact O-OG 3.04Å; S120-D124 PolarHBondContact O-N 3.19Å |
| 121 | M | 92.6 | Very high | 94.2 | Very high | 106 Ų | 106 | 95 Ų | 95 | 52% | 0.522 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -77.2 | -36.1 | 177.5 | -67.4 | -177.4 | 77.4 | 0 | 0 | 111.3 | L117 D124 L125 | L117-M121 HydrophobicContact CD1-CG 4.14Å; L117-M121 HydrophobicContact CD1-SD 3.89Å; L117-M121 HydrophobicContact CD2-SD 4.31Å; L117-M121 HydrophobicContact CG-CG 4.32Å; L117-M121 HydrophobicContact CG-SD 3.83Å; L117-M121 WeakPolarHBondContact O-CB 3.26Å; L117-M121 WeakPolarHBondContact O-CG 3.43Å; L117-M121 PolarHBondContact O-N 2.95Å; M121-D124 PolarHBondContact O-N 3.21Å; M121-L125 WeakPolarHBondContact O-CB 3.33Å; M121-L125 VanDerWaalsContact O-CG 3.26Å; M121-L125 WeakPolarHBondContact O-CG 3.38Å; M121-L125 PolarHBondContact O-N 3.46Å |
| 122 | G | 91.6 | Very high | 94.4 | Very high | 36 Ų | 36 | 97.6 Ų | 97.6 | 37% | 0.371 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.9 | -43.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | I118 Q126 | I118-G122 WeakPolarHBondContact O-CA 3.26Å; I118-G122 PolarHBondContact O-N 2.96Å; G122-Q126 VanDerWaalsContact O-CB 3.28Å; G122-Q126 WeakPolarHBondContact O-CB 3.42Å; G122-Q126 PolarHBondContact O-N 3.17Å |
| 123 | S | 91.6 | Very high | 94.6 | Very high | 67 Ų | 67 | 96.2 Ų | 96.2 | 47% | 0.469 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.4 | -42.8 | 177.4 | 60.8 | 0 | 0 | 0 | 0 | 113 | S119 S120 Q126 L127 | S119-S123 PolarHBondContact O-N 3.35Å; S119-S123 PolarHBondContact O-OG 3.4Å; S120-S123 PolarHBondContact O-OG 3.39Å; S120-S123 VanDerWaalsContact O-OG 3.04Å; S123-Q126 PolarHBondContact O-N 3.43Å; S123-L127 PolarHBondContact O-N 2.95Å |
| 124 | D | 95.2 | Very high | 94.6 | Very high | 73 Ų | 73 | 98.3 Ų | 98.3 | 39% | 0.39 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.4 | -43 | 176.4 | -179.9 | 59.9 | 0 | 0 | 0 | 112 | S120 M121 L127 K128 | S120-D124 PolarHBondContact O-N 3.19Å; M121-D124 PolarHBondContact O-N 3.21Å; D124-L127 PolarHBondContact O-N 2.93Å; D124-K128 WeakPolarHBondContact O-CB 3.28Å; D124-K128 WeakPolarHBondContact O-CG 3.41Å; D124-K128 PolarHBondContact O-N 3.47Å; D124-K128 WeakPolarHBondContact OD1-CE 3.39Å; D124-K128 IonicContact OD1-NZ 3.89Å; D124-K128 VanDerWaalsContact OD2-CE 3.3Å; D124-K128 WeakPolarHBondContact OD2-CE 3.5Å; D124-K128 IonicContact OD2-NZ 3.91Å; D124-K128 PolarHBondContact OD2-NZ 3.38Å |
| 125 | L | 94.8 | Very high | 94.7 | Very high | 98 Ų | 98 | 95.6 Ų | 95.6 | 51% | 0.513 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.8 | -42.8 | 175.4 | -74.6 | 171.6 | 0 | 0 | 0 | 112 | M121 L127 K128 L129 | M121-L125 WeakPolarHBondContact O-CB 3.33Å; M121-L125 VanDerWaalsContact O-CG 3.26Å; M121-L125 WeakPolarHBondContact O-CG 3.38Å; M121-L125 PolarHBondContact O-N 3.46Å; L125-L127 VanDerWaalsContact C-N 3.33Å; L125-L127 PolarHBondContact O-N 2.93Å; L125-K128 PolarHBondContact O-N 3.38Å; L125-L129 WeakPolarHBondContact O-CB 3.32Å; L125-L129 WeakPolarHBondContact O-CG 3.36Å; L125-L129 PolarHBondContact O-N 3.47Å |
| 126 | Q | 94.6 | Very high | 94.8 | Very high | 150 Ų | 150 | 94.5 Ų | 94.5 | 70% | 0.701 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.7 | -40.9 | 178.2 | -172.8 | 173.6 | 19.6 | 0 | 0 | 111.6 | G122 S123 G130 | G122-Q126 VanDerWaalsContact O-CB 3.28Å; G122-Q126 WeakPolarHBondContact O-CB 3.42Å; G122-Q126 PolarHBondContact O-N 3.17Å; S123-Q126 PolarHBondContact O-N 3.43Å; Q126-G130 PolarHBondContact O-N 2.9Å |
| 127 | L | 95.3 | Very high | 95.1 | Very high | 114 Ų | 114 | 91.3 Ų | 91.3 | 60% | 0.597 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.2 | -46.8 | 175.8 | -175.3 | 139.9 | 0 | 0 | 0 | 111.5 | S123 D124 L125 L129 G130 C131 | S123-L127 PolarHBondContact O-N 2.95Å; D124-L127 PolarHBondContact O-N 2.93Å; L125-L127 VanDerWaalsContact C-N 3.33Å; L125-L127 PolarHBondContact O-N 2.93Å; L127-L129 PolarHBondContact O-N 3.39Å; L127-G130 PolarHBondContact O-N 3.24Å; L127-C131 PolarHBondContact O-N 2.87Å; L127-C131 PolarHBondContact O-SG 2.93Å; L127-C131 VanDerWaalsContact O-SG 3.39Å |
| 128 | K | 96.9 | Very high | 95.2 | Very high | 107 Ų | 107 | 92.6 Ų | 92.6 | 47% | 0.465 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.9 | -43.1 | 176.9 | -75.5 | 172.1 | 178.8 | 164.7 | 0 | 112.4 | D124 L125 G130 C131 L132 | D124-K128 WeakPolarHBondContact O-CB 3.28Å; D124-K128 WeakPolarHBondContact O-CG 3.41Å; D124-K128 PolarHBondContact O-N 3.47Å; D124-K128 WeakPolarHBondContact OD1-CE 3.39Å; D124-K128 IonicContact OD1-NZ 3.89Å; D124-K128 VanDerWaalsContact OD2-CE 3.3Å; D124-K128 WeakPolarHBondContact OD2-CE 3.5Å; D124-K128 IonicContact OD2-NZ 3.91Å; D124-K128 PolarHBondContact OD2-NZ 3.38Å; L125-K128 PolarHBondContact O-N 3.38Å; K128-G130 VanDerWaalsContact C-N 3.33Å; K128-C131 PolarHBondContact O-N 2.9Å; K128-L132 WeakPolarHBondContact O-CB 3.31Å; K128-L132 VanDerWaalsContact O-CG 3.31Å; K128-L132 WeakPolarHBondContact O-CG 3.25Å; K128-L132 PolarHBondContact O-N 3.37Å |
| 129 | L | 97.2 | Very high | 95.5 | Very high | 118 Ų | 118 | 92.4 Ų | 92.4 | 62% | 0.618 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.4 | -39.4 | 175.2 | -76.3 | 171.5 | 0 | 0 | 0 | 111.8 | L125 L127 L132 A133 | L125-L129 WeakPolarHBondContact O-CB 3.32Å; L125-L129 WeakPolarHBondContact O-CG 3.36Å; L125-L129 PolarHBondContact O-N 3.47Å; L127-L129 PolarHBondContact O-N 3.39Å; L129-L132 PolarHBondContact O-N 3.49Å; L129-A133 VanDerWaalsContact O-CB 3.25Å; L129-A133 WeakPolarHBondContact O-CB 3.4Å; L129-A133 PolarHBondContact O-N 2.86Å |
| 130 | G | 96.4 | Very high | 95.9 | Very high | 30 Ų | 30 | 92.2 Ų | 92.2 | 31% | 0.309 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.1 | -53.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q126 L127 K128 L132 A133 E134 | Q126-G130 PolarHBondContact O-N 2.9Å; L127-G130 PolarHBondContact O-N 3.24Å; K128-G130 VanDerWaalsContact C-N 3.33Å; G130-L132 VanDerWaalsContact C-N 3.33Å; G130-L132 PolarHBondContact O-N 3.29Å; G130-A133 PolarHBondContact O-N 3.45Å; G130-E134 WeakPolarHBondContact O-CG 3.43Å; G130-E134 PolarHBondContact O-N 3.48Å |
| 131 | C | 96.7 | Very high | 96.2 | Very high | 68 Ų | 68 | 93.4 Ų | 93.4 | 46% | 0.459 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -59.3 | -42.1 | 177.8 | -64.5 | 0 | 0 | 0 | 0 | 112.5 | L127 K128 E134 E135 | L127-C131 PolarHBondContact O-N 2.87Å; L127-C131 PolarHBondContact O-SG 2.93Å; L127-C131 VanDerWaalsContact O-SG 3.39Å; K128-C131 PolarHBondContact O-N 2.9Å; C131-E134 PolarHBondContact O-N 3.32Å; C131-E135 WeakPolarHBondContact O-CB 3.29Å; C131-E135 PolarHBondContact O-N 3.47Å |
| 132 | L | 97.3 | Very high | 96.5 | Very high | 107 Ų | 107 | 90.6 Ų | 90.6 | 56% | 0.56 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -67.6 | -36.8 | 177.1 | -74.1 | 171.7 | 0 | 0 | 0 | 112.4 | K128 L129 G130 K136 | K128-L132 WeakPolarHBondContact O-CB 3.31Å; K128-L132 VanDerWaalsContact O-CG 3.31Å; K128-L132 WeakPolarHBondContact O-CG 3.25Å; K128-L132 PolarHBondContact O-N 3.37Å; L129-L132 PolarHBondContact O-N 3.49Å; G130-L132 VanDerWaalsContact C-N 3.33Å; G130-L132 PolarHBondContact O-N 3.29Å; L132-K136 VanDerWaalsContact O-CB 3.29Å; L132-K136 WeakPolarHBondContact O-CB 3.3Å; L132-K136 PolarHBondContact O-N 2.69Å |
| 133 | A | 97.3 | Very high | 96.8 | Very high | 54 Ų | 54 | 95.7 Ų | 95.7 | 45% | 0.446 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.8 | -43.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | L129 G130 K136 V137 | L129-A133 VanDerWaalsContact O-CB 3.25Å; L129-A133 WeakPolarHBondContact O-CB 3.4Å; L129-A133 PolarHBondContact O-N 2.86Å; G130-A133 PolarHBondContact O-N 3.45Å; A133-K136 PolarHBondContact O-N 3.21Å; A133-V137 WeakPolarHBondContact O-CG2 3.39Å; A133-V137 PolarHBondContact O-N 2.95Å |
| 134 | E | 97.3 | Very high | 97.1 | Very high | 144 Ų | 144 | 95.4 Ų | 95.4 | 67% | 0.673 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.5 | -45.6 | 174.1 | -72.7 | 174.8 | -175 | 0 | 0 | 111.8 | G130 C131 K136 V137 R138 | G130-E134 WeakPolarHBondContact O-CG 3.43Å; G130-E134 PolarHBondContact O-N 3.48Å; C131-E134 PolarHBondContact O-N 3.32Å; E134-K136 PolarHBondContact O-N 3.15Å; E134-V137 PolarHBondContact O-N 2.98Å; E134-R138 PolarHBondContact O-N 3.25Å |
| 135 | E | 97.9 | Very high | 97.2 | Very high | 84 Ų | 84 | 98.7 Ų | 98.7 | 39% | 0.393 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64 | -40.1 | 176.9 | 178.9 | 164.3 | -142.1 | 0 | 0 | 112.1 | C131 V137 R138 L139 | C131-E135 WeakPolarHBondContact O-CB 3.29Å; C131-E135 PolarHBondContact O-N 3.47Å; E135-V137 PolarHBondContact O-N 2.89Å; E135-R138 PolarHBondContact O-N 3.28Å; E135-R138 IonicContact OE1-NH2 2.68Å; E135-R138 PolarHBondContact OE1-NH2 2.94Å; E135-L139 HydrophobicContact CG-CD1 4.05Å; E135-L139 HydrophobicContact CG-CG 4.37Å; E135-L139 WeakPolarHBondContact O-CB 3.38Å; E135-L139 WeakPolarHBondContact O-CG 3.45Å; E135-L139 PolarHBondContact O-N 3.36Å |
| 136 | K | 97.6 | Very high | 97.4 | Very high | 121 Ų | 121 | 101.5 Ų | 101.5 | 53% | 0.526 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.3 | -45.6 | 174.6 | -178.2 | 179.9 | 177.8 | 179.1 | 0 | 111.1 | L132 A133 E134 L139 T140 | L132-K136 VanDerWaalsContact O-CB 3.29Å; L132-K136 WeakPolarHBondContact O-CB 3.3Å; L132-K136 PolarHBondContact O-N 2.69Å; A133-K136 PolarHBondContact O-N 3.21Å; E134-K136 PolarHBondContact O-N 3.15Å; K136-L139 PolarHBondContact O-N 2.92Å; K136-T140 WeakPolarHBondContact O-CG2 3.42Å; K136-T140 PolarHBondContact O-N 2.99Å; K136-T140 PolarHBondContact O-OG1 3.44Å |
| 137 | V | 97.5 | Very high | 97.5 | Very high | 77 Ų | 77 | 97.1 Ų | 97.1 | 47% | 0.467 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.4 | -48.6 | 176.5 | 171.3 | 0 | 0 | 0 | 0 | 110.2 | A133 E134 E135 L139 T140 E141 | A133-V137 WeakPolarHBondContact O-CG2 3.39Å; A133-V137 PolarHBondContact O-N 2.95Å; E134-V137 PolarHBondContact O-N 2.98Å; E135-V137 PolarHBondContact O-N 2.89Å; V137-L139 PolarHBondContact O-N 3.26Å; V137-T140 WeakPolarHBondContact CA-OG1 3.01Å; V137-T140 PolarHBondContact O-N 2.98Å; V137-T140 VanDerWaalsContact O-N 3.15Å; V137-T140 PolarHBondContact O-OG1 3.21Å; V137-E141 WeakPolarHBondContact O-CG 3.44Å; V137-E141 PolarHBondContact O-N 2.99Å |
| 138 | R | 98 | Very high | 97.7 | Very high | 131 Ų | 131 | 97 Ų | 97 | 49% | 0.494 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -56.9 | -46.7 | 177.1 | -173.4 | -176 | 69.4 | -162.1 | -3.3 | 112.4 | E134 E135 T140 E141 D142 | E134-R138 PolarHBondContact O-N 3.25Å; E135-R138 PolarHBondContact O-N 3.28Å; E135-R138 IonicContact OE1-NH2 2.68Å; E135-R138 PolarHBondContact OE1-NH2 2.94Å; R138-T140 VanDerWaalsContact C-N 3.34Å; R138-T140 PolarHBondContact O-N 3.13Å; R138-E141 PolarHBondContact O-N 3.43Å; R138-D142 PolarHBondContact O-N 3.04Å |
| 139 | L | 98.2 | Very high | 97.7 | Very high | 98 Ų | 98 | 97.5 Ų | 97.5 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.2 | -37.5 | 178.4 | -74.7 | 172.3 | 0 | 0 | 0 | 112.3 | E135 K136 V137 D142 M143 | E135-L139 HydrophobicContact CG-CD1 4.05Å; E135-L139 HydrophobicContact CG-CG 4.37Å; E135-L139 WeakPolarHBondContact O-CB 3.38Å; E135-L139 WeakPolarHBondContact O-CG 3.45Å; E135-L139 PolarHBondContact O-N 3.36Å; K136-L139 PolarHBondContact O-N 2.92Å; V137-L139 PolarHBondContact O-N 3.26Å; L139-D142 PolarHBondContact O-N 3.46Å; L139-M143 VanDerWaalsContact O-CB 3.3Å; L139-M143 WeakPolarHBondContact O-CB 3.35Å; L139-M143 PolarHBondContact O-N 3.31Å |
| 140 | T | 98 | Very high | 97.8 | Very high | 78 Ų | 78 | 97.9 Ų | 97.9 | 48% | 0.479 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.2 | -36.8 | 174.7 | 53.3 | 0 | 0 | 0 | 0 | 112.5 | K136 V137 R138 A144 | K136-T140 WeakPolarHBondContact O-CG2 3.42Å; K136-T140 PolarHBondContact O-N 2.99Å; K136-T140 PolarHBondContact O-OG1 3.44Å; V137-T140 WeakPolarHBondContact CA-OG1 3.01Å; V137-T140 PolarHBondContact O-N 2.98Å; V137-T140 VanDerWaalsContact O-N 3.15Å; V137-T140 PolarHBondContact O-OG1 3.21Å; R138-T140 VanDerWaalsContact C-N 3.34Å; R138-T140 PolarHBondContact O-N 3.13Å; T140-A144 WeakPolarHBondContact O-CB 3.32Å; T140-A144 PolarHBondContact O-N 3.44Å |
| 141 | E | 98.2 | Very high | 97.9 | Very high | 100 Ų | 100 | 102.1 Ų | 102.1 | 47% | 0.467 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.1 | -44.3 | 174 | -71 | 176.5 | -179.3 | 0 | 0 | 111.5 | V137 R138 A144 R145 | V137-E141 WeakPolarHBondContact O-CG 3.44Å; V137-E141 PolarHBondContact O-N 2.99Å; R138-E141 PolarHBondContact O-N 3.43Å; E141-A144 PolarHBondContact O-N 3.01Å; E141-R145 WeakPolarHBondContact O-CG 3.31Å; E141-R145 PolarHBondContact O-N 3.16Å |
| 142 | D | 98.2 | Very high | 97.9 | Very high | 48 Ų | 48 | 103.3 Ų | 103.3 | 26% | 0.257 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.7 | -42.7 | 176.6 | -73.4 | -22.1 | 0 | 0 | 0 | 111.3 | R138 L139 A144 R145 Y146 | R138-D142 PolarHBondContact O-N 3.04Å; L139-D142 PolarHBondContact O-N 3.46Å; D142-A144 VanDerWaalsContact C-N 3.35Å; D142-A144 PolarHBondContact O-N 2.82Å; D142-R145 PolarHBondContact O-N 2.95Å; D142-R145 IonicContact OD1-NH1 3.94Å; D142-Y146 HydrophobicContact CB-CE2 4.2Å; D142-Y146 WeakPolarHBondContact O-CD2 3.34Å; D142-Y146 PolarHBondContact O-N 3.45Å |
| 143 | M | 98 | Very high | 98 | Very high | 143 Ų | 143 | 100.9 Ų | 100.9 | 70% | 0.704 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -60.6 | -42.8 | 175 | -176.3 | 178.2 | 173.3 | 0 | 0 | 111.9 | L139 Y146 S147 | L139-M143 VanDerWaalsContact O-CB 3.3Å; L139-M143 WeakPolarHBondContact O-CB 3.35Å; L139-M143 PolarHBondContact O-N 3.31Å; M143-Y146 PolarHBondContact O-N 3.16Å; M143-S147 PolarHBondContact O-N 3.48Å |
| 144 | A | 98 | Very high | 98 | Very high | 61 Ų | 61 | 103.1 Ų | 103.1 | 50% | 0.504 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | T140 E141 D142 Y146 S147 E148 | T140-A144 WeakPolarHBondContact O-CB 3.32Å; T140-A144 PolarHBondContact O-N 3.44Å; E141-A144 PolarHBondContact O-N 3.01Å; D142-A144 VanDerWaalsContact C-N 3.35Å; D142-A144 PolarHBondContact O-N 2.82Å; A144-Y146 PolarHBondContact O-N 3.47Å; A144-S147 WeakPolarHBondContact O-CB 3.44Å; A144-S147 PolarHBondContact O-N 3Å; A144-E148 PolarHBondContact O-N 3.48Å |
| 145 | R | 98.1 | Very high | 98 | Very high | 141 Ų | 141 | 100.3 Ų | 100.3 | 53% | 0.532 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.1 | -42.9 | 175.3 | -72.3 | 174.3 | -178.3 | 175.3 | 4.1 | 112.5 | E141 D142 S147 E148 Q149 | E141-R145 WeakPolarHBondContact O-CG 3.31Å; E141-R145 PolarHBondContact O-N 3.16Å; D142-R145 PolarHBondContact O-N 2.95Å; D142-R145 IonicContact OD1-NH1 3.94Å; R145-S147 VanDerWaalsContact C-N 3.34Å; R145-E148 PolarHBondContact O-N 2.9Å; R145-Q149 VanDerWaalsContact O-CG 3.31Å; R145-Q149 WeakPolarHBondContact O-CG 3.4Å; R145-Q149 PolarHBondContact O-N 3.42Å |
| 146 | Y | 98.2 | Very high | 98 | Very high | 158 Ų | 158 | 100.5 Ų | 100.5 | 62% | 0.62 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.7 | -35.1 | 177.1 | -69.6 | -54.2 | 0 | 0 | 0 | 112.3 | D142 M143 A144 Q149 L150 | D142-Y146 HydrophobicContact CB-CE2 4.2Å; D142-Y146 WeakPolarHBondContact O-CD2 3.34Å; D142-Y146 PolarHBondContact O-N 3.45Å; M143-Y146 PolarHBondContact O-N 3.16Å; A144-Y146 PolarHBondContact O-N 3.47Å; Y146-Q149 PolarHBondContact O-N 3.34Å; Y146-L150 WeakPolarHBondContact O-CB 3.36Å; Y146-L150 PolarHBondContact O-N 3.19Å |
| 147 | S | 98 | Very high | 98 | Very high | 57 Ų | 57 | 102.9 Ų | 102.9 | 40% | 0.399 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.6 | -49 | 173.4 | -163.8 | 0 | 0 | 0 | 0 | 111.3 | M143 A144 R145 Q149 L150 E151 | M143-S147 PolarHBondContact O-N 3.48Å; A144-S147 WeakPolarHBondContact O-CB 3.44Å; A144-S147 PolarHBondContact O-N 3Å; R145-S147 VanDerWaalsContact C-N 3.34Å; S147-Q149 PolarHBondContact O-N 2.93Å; S147-L150 PolarHBondContact O-N 3.07Å; S147-L150 VanDerWaalsContact O-N 3.16Å; S147-E151 WeakPolarHBondContact O-CG 3.44Å; S147-E151 PolarHBondContact O-N 3.25Å |
| 148 | E | 98.1 | Very high | 98 | Very high | 111 Ų | 111 | 103.7 Ų | 103.7 | 52% | 0.519 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.7 | -42.8 | 177.6 | -177.4 | -179.7 | -160.9 | 0 | 0 | 111.8 | A144 R145 L150 E151 H152 | A144-E148 PolarHBondContact O-N 3.48Å; R145-E148 PolarHBondContact O-N 2.9Å; E148-L150 VanDerWaalsContact C-N 3.33Å; E148-L150 PolarHBondContact O-N 3.25Å; E148-E151 PolarHBondContact O-N 2.87Å; E148-H152 PolarHBondContact O-CD2 2.93Å; E148-H152 VanDerWaalsContact O-CD2 3.25Å; E148-H152 PolarHBondContact O-N 2.89Å |
| 149 | Q | 98 | Very high | 98 | Very high | 118 Ų | 118 | 102.7 Ų | 102.7 | 55% | 0.551 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.9 | -39.6 | 175.2 | -73.4 | 174.8 | 26.4 | 0 | 0 | 112.5 | R145 Y146 S147 A153 | R145-Q149 VanDerWaalsContact O-CG 3.31Å; R145-Q149 WeakPolarHBondContact O-CG 3.4Å; R145-Q149 PolarHBondContact O-N 3.42Å; Y146-Q149 PolarHBondContact O-N 3.34Å; S147-Q149 PolarHBondContact O-N 2.93Å; Q149-A153 WeakPolarHBondContact O-CB 3.42Å; Q149-A153 PolarHBondContact O-N 3.28Å |
| 150 | L | 98.4 | Very high | 98 | Very high | 127 Ų | 127 | 103.1 Ų | 103.1 | 67% | 0.665 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -67.7 | -41.5 | 178.1 | -173.2 | 66.6 | 0 | 0 | 0 | 111.2 | Y146 S147 E148 A153 H154 | Y146-L150 WeakPolarHBondContact O-CB 3.36Å; Y146-L150 PolarHBondContact O-N 3.19Å; S147-L150 PolarHBondContact O-N 3.07Å; S147-L150 VanDerWaalsContact O-N 3.16Å; E148-L150 VanDerWaalsContact C-N 3.33Å; E148-L150 PolarHBondContact O-N 3.25Å; L150-A153 PolarHBondContact O-N 2.91Å; L150-H154 WeakPolarHBondContact O-CB 3.49Å; L150-H154 PolarHBondContact O-N 3.41Å |
| 151 | E | 97.9 | Very high | 97.9 | Very high | 118 Ų | 118 | 100.9 Ų | 100.9 | 55% | 0.551 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -59.6 | -48.9 | 174 | -74.5 | 172.9 | -168.1 | 0 | 0 | 111.1 | S147 E148 A153 H154 E155 | S147-E151 WeakPolarHBondContact O-CG 3.44Å; S147-E151 PolarHBondContact O-N 3.25Å; E148-E151 PolarHBondContact O-N 2.87Å; E151-A153 PolarHBondContact O-N 3.06Å; E151-H154 WeakPolarHBondContact O-CB 3.49Å; E151-H154 PolarHBondContact O-N 2.96Å; E151-E155 WeakPolarHBondContact O-CG 3.34Å; E151-E155 PolarHBondContact O-N 3.18Å |
| 152 | H | 97.9 | Very high | 97.8 | Very high | 94 Ų | 94 | 101.2 Ų | 101.2 | 44% | 0.435 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.7 | -39.6 | 175.8 | -75.5 | -46.1 | 0 | 0 | 0 | 113.6 | E148 H154 E155 N156 | E148-H152 PolarHBondContact O-CD2 2.93Å; E148-H152 VanDerWaalsContact O-CD2 3.25Å; E148-H152 PolarHBondContact O-N 2.89Å; H152-H154 VanDerWaalsContact C-N 3.31Å; H152-E155 IonicContact ND1-OE2 3.58Å; H152-N156 WeakPolarHBondContact O-CB 3.48Å; H152-N156 VanDerWaalsContact O-CG 3.25Å; H152-N156 PolarHBondContact O-N 2.97Å; H152-N156 PolarHBondContact O-ND2 3.38Å |
| 153 | A | 98.1 | Very high | 97.7 | Very high | 56 Ų | 56 | 104.4 Ų | 104.4 | 46% | 0.463 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.5 | -38.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q149 L150 E151 N156 W157 | Q149-A153 WeakPolarHBondContact O-CB 3.42Å; Q149-A153 PolarHBondContact O-N 3.28Å; L150-A153 PolarHBondContact O-N 2.91Å; E151-A153 PolarHBondContact O-N 3.06Å; A153-N156 PolarHBondContact O-N 3.18Å; A153-W157 WeakPolarHBondContact O-CB 3.48Å; A153-W157 PolarHBondContact O-N 2.87Å |
| 154 | H | 98.2 | Very high | 97.6 | Very high | 100 Ų | 100 | 100.9 Ų | 100.9 | 46% | 0.463 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.5 | -48.9 | 176 | -175.5 | 61.8 | 0 | 0 | 0 | 111.7 | L150 E151 H152 N156 W157 E158 | L150-H154 WeakPolarHBondContact O-CB 3.49Å; L150-H154 PolarHBondContact O-N 3.41Å; E151-H154 WeakPolarHBondContact O-CB 3.49Å; E151-H154 PolarHBondContact O-N 2.96Å; H152-H154 VanDerWaalsContact C-N 3.31Å; H154-N156 VanDerWaalsContact C-N 3.26Å; H154-N156 PolarHBondContact O-N 3.35Å; H154-W157 WeakPolarHBondContact O-CB 3.17Å; H154-W157 PolarHBondContact O-N 3.16Å; H154-E158 IonicContact CE1-OE1 2.85Å; H154-E158 IonicContact NE2-OE1 3.91Å; H154-E158 PolarHBondContact NE2-OE1 2.91Å; H154-E158 WeakPolarHBondContact O-CG 3.42Å; H154-E158 PolarHBondContact O-N 3.04Å |
| 155 | E | 97.5 | Very high | 97.6 | Very high | 86 Ų | 86 | 104.2 Ų | 104.2 | 40% | 0.402 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.1 | -40.1 | 174.9 | -71.6 | -178.5 | 177.7 | 0 | 0 | 112.4 | E151 H152 E158 K159 | E151-E155 WeakPolarHBondContact O-CG 3.34Å; E151-E155 PolarHBondContact O-N 3.18Å; H152-E155 IonicContact ND1-OE2 3.58Å; E155-E158 PolarHBondContact O-N 3.23Å; E155-K159 VanDerWaalsContact O-CG 3.26Å; E155-K159 WeakPolarHBondContact O-CG 3.33Å; E155-K159 PolarHBondContact O-N 3.29Å; E155-K159 IonicContact OE2-NZ 3.9Å |
| 156 | N | 97.9 | Very high | 97.4 | Very high | 87 Ų | 87 | 100.6 Ų | 100.6 | 47% | 0.465 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.6 | -40.2 | 176.9 | -73.2 | -26.8 | 0 | 0 | 0 | 111.6 | H152 A153 H154 K159 L160 | H152-N156 WeakPolarHBondContact O-CB 3.48Å; H152-N156 VanDerWaalsContact O-CG 3.25Å; H152-N156 PolarHBondContact O-N 2.97Å; H152-N156 PolarHBondContact O-ND2 3.38Å; A153-N156 PolarHBondContact O-N 3.18Å; H154-N156 VanDerWaalsContact C-N 3.26Å; H154-N156 PolarHBondContact O-N 3.35Å; N156-K159 PolarHBondContact O-N 3.43Å; N156-L160 WeakPolarHBondContact O-CD1 3.4Å; N156-L160 PolarHBondContact O-N 3Å |
| 157 | W | 98 | Very high | 97.3 | Very high | 172 Ų | 172 | 101.2 Ų | 101.2 | 65% | 0.652 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.8 | -43.9 | 175.1 | -177 | 85.7 | 0 | 0 | 0 | 111.7 | A153 H154 K159 L160 A161 | A153-W157 WeakPolarHBondContact O-CB 3.48Å; A153-W157 PolarHBondContact O-N 2.87Å; H154-W157 WeakPolarHBondContact O-CB 3.17Å; H154-W157 PolarHBondContact O-N 3.16Å; W157-K159 PolarHBondContact O-N 3.24Å; W157-L160 PolarHBondContact O-N 3.48Å; W157-A161 WeakPolarHBondContact O-CB 3.4Å; W157-A161 PolarHBondContact O-N 3.47Å |
| 158 | E | 97.5 | Very high | 97.3 | Very high | 94 Ų | 94 | 105.1 Ų | 105.1 | 44% | 0.439 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.1 | -43.6 | 175.2 | -69.2 | -172.7 | 145.3 | 0 | 0 | 112 | H154 E155 L160 A161 I162 | H154-E158 IonicContact CE1-OE1 2.85Å; H154-E158 IonicContact NE2-OE1 3.91Å; H154-E158 PolarHBondContact NE2-OE1 2.91Å; H154-E158 WeakPolarHBondContact O-CG 3.42Å; H154-E158 PolarHBondContact O-N 3.04Å; E155-E158 PolarHBondContact O-N 3.23Å; E158-L160 VanDerWaalsContact C-N 3.35Å; E158-L160 PolarHBondContact O-N 3.38Å; E158-A161 PolarHBondContact O-N 3.01Å; E158-I162 WeakPolarHBondContact O-CG1 3.33Å; E158-I162 PolarHBondContact O-N 2.84Å |
| 159 | K | 97.6 | Very high | 97.2 | Very high | 109 Ų | 109 | 103.5 Ų | 103.5 | 47% | 0.474 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.6 | -44.7 | 174.5 | -73.6 | 166.4 | -170.4 | 157.7 | 0 | 111.8 | E155 N156 W157 Q163 | E155-K159 VanDerWaalsContact O-CG 3.26Å; E155-K159 WeakPolarHBondContact O-CG 3.33Å; E155-K159 PolarHBondContact O-N 3.29Å; E155-K159 IonicContact OE2-NZ 3.9Å; N156-K159 PolarHBondContact O-N 3.43Å; W157-K159 PolarHBondContact O-N 3.24Å; K159-Q163 WeakPolarHBondContact O-CG 3.26Å; K159-Q163 PolarHBondContact O-N 3.38Å; K159-Q163 VanDerWaalsContact O-N 3.13Å |
| 160 | L | 97.3 | Very high | 97 | Very high | 107 Ų | 107 | 103.5 Ų | 103.5 | 56% | 0.56 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.2 | -38.4 | 177 | -94.1 | 80.4 | 0 | 0 | 0 | 112 | N156 W157 E158 Q163 C164 | N156-L160 WeakPolarHBondContact O-CD1 3.4Å; N156-L160 PolarHBondContact O-N 3Å; W157-L160 PolarHBondContact O-N 3.48Å; E158-L160 VanDerWaalsContact C-N 3.35Å; E158-L160 PolarHBondContact O-N 3.38Å; L160-Q163 PolarHBondContact O-N 3Å; L160-C164 PolarHBondContact O-N 2.98Å; L160-C164 PolarHBondContact O-SG 2.95Å |
| 161 | A | 97.3 | Very high | 96.8 | Very high | 32 Ų | 32 | 104 Ų | 104 | 26% | 0.264 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.2 | -47.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111 | W157 E158 Q163 C164 E165 | W157-A161 WeakPolarHBondContact O-CB 3.4Å; W157-A161 PolarHBondContact O-N 3.47Å; E158-A161 PolarHBondContact O-N 3.01Å; A161-Q163 VanDerWaalsContact C-N 3.34Å; A161-Q163 PolarHBondContact O-N 2.88Å; A161-C164 WeakPolarHBondContact O-CB 3.44Å; A161-C164 PolarHBondContact O-N 3.46Å; A161-C164 VanDerWaalsContact O-N 3.15Å; A161-E165 PolarHBondContact O-N 3.28Å |
| 162 | I | 96.1 | Very high | 96.7 | Very high | 106 Ų | 106 | 103.7 Ų | 103.7 | 54% | 0.544 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.3 | -44.5 | 175.5 | -65.9 | 165 | 0 | 0 | 0 | 110.8 | E158 C164 E165 V166 | E158-I162 WeakPolarHBondContact O-CG1 3.33Å; E158-I162 PolarHBondContact O-N 2.84Å; I162-C164 VanDerWaalsContact C-N 3.32Å; I162-C164 PolarHBondContact O-N 2.91Å; I162-E165 PolarHBondContact O-N 3.37Å; I162-V166 WeakPolarHBondContact O-CG2 3.26Å; I162-V166 PolarHBondContact O-N 2.86Å |
| 163 | Q | 95.9 | Very high | 96.3 | Very high | 116 Ų | 116 | 101.6 Ų | 101.6 | 54% | 0.542 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.6 | -41.2 | 176.9 | -74.3 | -177.4 | 0.7 | 0 | 0 | 112.1 | K159 L160 A161 E165 V166 W167 | K159-Q163 WeakPolarHBondContact O-CG 3.26Å; K159-Q163 PolarHBondContact O-N 3.38Å; K159-Q163 VanDerWaalsContact O-N 3.13Å; L160-Q163 PolarHBondContact O-N 3Å; A161-Q163 VanDerWaalsContact C-N 3.34Å; A161-Q163 PolarHBondContact O-N 2.88Å; Q163-E165 VanDerWaalsContact C-N 3.32Å; Q163-E165 PolarHBondContact O-N 3.42Å; Q163-V166 PolarHBondContact O-N 3.15Å; Q163-W167 PolarHBondContact O-N 3.3Å |
| 164 | C | 96.1 | Very high | 96 | Very high | 69 Ų | 69 | 102.1 Ų | 102.1 | 47% | 0.466 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.9 | -41.5 | 176 | -68.9 | 0 | 0 | 0 | 0 | 111.5 | L160 A161 I162 W167 K168 | L160-C164 PolarHBondContact O-N 2.98Å; L160-C164 PolarHBondContact O-SG 2.95Å; A161-C164 WeakPolarHBondContact O-CB 3.44Å; A161-C164 PolarHBondContact O-N 3.46Å; A161-C164 VanDerWaalsContact O-N 3.15Å; I162-C164 VanDerWaalsContact C-N 3.32Å; I162-C164 PolarHBondContact O-N 2.91Å; C164-W167 PolarHBondContact O-N 3.41Å; C164-K168 WeakPolarHBondContact O-CB 3.4Å; C164-K168 VanDerWaalsContact O-CG 3.26Å; C164-K168 WeakPolarHBondContact O-CG 3.33Å; C164-K168 PolarHBondContact O-N 3.13Å |
| 165 | E | 96.6 | Very high | 95.7 | Very high | 131 Ų | 131 | 99.3 Ų | 99.3 | 61% | 0.612 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.6 | -42.7 | 175.5 | -69.2 | -175.1 | 165.4 | 0 | 0 | 112.5 | A161 I162 Q163 W167 K168 S169 | A161-E165 PolarHBondContact O-N 3.28Å; I162-E165 PolarHBondContact O-N 3.37Å; Q163-E165 VanDerWaalsContact C-N 3.32Å; Q163-E165 PolarHBondContact O-N 3.42Å; E165-W167 VanDerWaalsContact C-N 3.33Å; E165-W167 PolarHBondContact O-N 3.42Å; E165-K168 PolarHBondContact O-N 3.23Å; E165-S169 WeakPolarHBondContact O-CB 3.48Å; E165-S169 PolarHBondContact O-N 2.87Å |
| 166 | V | 95.5 | Very high | 95.4 | Very high | 65 Ų | 65 | 99 Ų | 99 | 39% | 0.394 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.9 | -43.4 | 174.9 | 171.8 | 0 | 0 | 0 | 0 | 111 | I162 Q163 S169 K170 | I162-V166 WeakPolarHBondContact O-CG2 3.26Å; I162-V166 PolarHBondContact O-N 2.86Å; Q163-V166 PolarHBondContact O-N 3.15Å; V166-S169 PolarHBondContact O-N 3.45Å; V166-K170 HydrophobicContact CG1-CD 4.02Å; V166-K170 HydrophobicContact CG1-CG 4.44Å; V166-K170 WeakPolarHBondContact O-CB 3.29Å; V166-K170 VanDerWaalsContact O-CG 3.29Å; V166-K170 WeakPolarHBondContact O-CG 3.42Å; V166-K170 PolarHBondContact O-N 2.93Å |
| 167 | W | 95.7 | Very high | 95 | Very high | 171 Ų | 171 | 96.2 Ų | 96.2 | 65% | 0.648 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.5 | -41.4 | 176.9 | -80.5 | 114.5 | 0 | 0 | 0 | 112.5 | Q163 C164 E165 K170 F171 | Q163-W167 PolarHBondContact O-N 3.3Å; C164-W167 PolarHBondContact O-N 3.41Å; E165-W167 VanDerWaalsContact C-N 3.33Å; E165-W167 PolarHBondContact O-N 3.42Å; W167-K170 HydrophobicContact CE3-CD 4.39Å; W167-K170 PolarHBondContact O-N 3.31Å; W167-F171 VanDerWaalsContact O-CB 3.29Å; W167-F171 WeakPolarHBondContact O-CB 3.5Å; W167-F171 PolarHBondContact O-N 2.97Å |
| 168 | K | 97.7 | Very high | 94.7 | Very high | 139 Ų | 139 | 91.5 Ų | 91.5 | 60% | 0.604 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -57.9 | -48 | 172.6 | -75.5 | 172 | -179 | 179.5 | 0 | 111.2 | C164 E165 F171 L172 | C164-K168 WeakPolarHBondContact O-CB 3.4Å; C164-K168 VanDerWaalsContact O-CG 3.26Å; C164-K168 WeakPolarHBondContact O-CG 3.33Å; C164-K168 PolarHBondContact O-N 3.13Å; E165-K168 PolarHBondContact O-N 3.23Å; K168-F171 PolarHBondContact O-N 3.2Å; K168-L172 WeakPolarHBondContact O-CB 3.4Å; K168-L172 WeakPolarHBondContact O-CG 3.42Å; K168-L172 PolarHBondContact O-N 3.41Å |
| 169 | S | 95.3 | Very high | 94.4 | Very high | 77 Ų | 77 | 91.6 Ų | 91.6 | 54% | 0.538 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.1 | -46.2 | 178.2 | 178.4 | 0 | 0 | 0 | 0 | 112.3 | E165 V166 F171 L172 A173 | E165-S169 WeakPolarHBondContact O-CB 3.48Å; E165-S169 PolarHBondContact O-N 2.87Å; V166-S169 PolarHBondContact O-N 3.45Å; S169-F171 PolarHBondContact O-N 3.32Å; S169-L172 PolarHBondContact O-N 2.85Å; S169-A173 WeakPolarHBondContact O-CB 3.38Å; S169-A173 PolarHBondContact O-N 3.44Å |
| 170 | K | 94.6 | Very high | 93.9 | Very high | 118 Ų | 118 | 90.5 Ų | 90.5 | 51% | 0.513 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61 | -43.3 | 175.6 | -75.5 | 174.5 | 179.4 | 175.1 | 0 | 112.6 | V166 W167 S174 | V166-K170 HydrophobicContact CG1-CD 4.02Å; V166-K170 HydrophobicContact CG1-CG 4.44Å; V166-K170 WeakPolarHBondContact O-CB 3.29Å; V166-K170 VanDerWaalsContact O-CG 3.29Å; V166-K170 WeakPolarHBondContact O-CG 3.42Å; V166-K170 PolarHBondContact O-N 2.93Å; W167-K170 HydrophobicContact CE3-CD 4.39Å; W167-K170 PolarHBondContact O-N 3.31Å; K170-S174 WeakPolarHBondContact O-CB 3.33Å; K170-S174 PolarHBondContact O-N 3.4Å |
| 171 | F | 94.7 | Very high | 93.5 | Very high | 138 Ų | 138 | 89 Ų | 89 | 61% | 0.605 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -62.8 | -49 | 178 | 178.1 | -100.8 | 0 | 0 | 0 | 110.8 | W167 K168 S169 A173 S174 C175 | W167-F171 VanDerWaalsContact O-CB 3.29Å; W167-F171 WeakPolarHBondContact O-CB 3.5Å; W167-F171 PolarHBondContact O-N 2.97Å; K168-F171 PolarHBondContact O-N 3.2Å; S169-F171 PolarHBondContact O-N 3.32Å; F171-A173 PolarHBondContact O-N 2.92Å; F171-S174 WeakPolarHBondContact O-CB 3.45Å; F171-S174 PolarHBondContact O-N 3.22Å; F171-S174 VanDerWaalsContact O-N 3.17Å; F171-C175 VanDerWaalsContact CE1-SG 3.53Å; F171-C175 VanDerWaalsContact CZ-SG 3.52Å; F171-C175 PolarHBondContact O-N 3.38Å; F171-C175 PolarHBondContact O-SG 2.95Å |
| 172 | L | 95.6 | Very high | 93.3 | Very high | 111 Ų | 111 | 90.6 Ų | 90.6 | 58% | 0.581 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -60 | -44.7 | 177.2 | -72.6 | 171.3 | 0 | 0 | 0 | 112.3 | K168 S169 S174 C175 V176 | K168-L172 WeakPolarHBondContact O-CB 3.4Å; K168-L172 WeakPolarHBondContact O-CG 3.42Å; K168-L172 PolarHBondContact O-N 3.41Å; S169-L172 PolarHBondContact O-N 2.85Å; L172-S174 VanDerWaalsContact C-N 3.33Å; L172-S174 PolarHBondContact O-N 3.44Å; L172-C175 WeakPolarHBondContact O-CB 3.42Å; L172-C175 PolarHBondContact O-N 3.17Å; L172-V176 WeakPolarHBondContact O-CG2 3.37Å; L172-V176 PolarHBondContact O-N 2.9Å |
| 173 | A | 89 | Confident | 93 | Very high | 50 Ų | 50 | 89.2 Ų | 89.2 | 41% | 0.413 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -60.1 | -43.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S169 F171 V176 I177 | S169-A173 WeakPolarHBondContact O-CB 3.38Å; S169-A173 PolarHBondContact O-N 3.44Å; F171-A173 PolarHBondContact O-N 2.92Å; A173-V176 PolarHBondContact O-N 3.42Å; A173-I177 WeakPolarHBondContact O-CD1 3.29Å; A173-I177 VanDerWaalsContact O-CG1 3.25Å; A173-I177 WeakPolarHBondContact O-CG1 3.39Å; A173-I177 PolarHBondContact O-N 2.98Å |
| 174 | S | 90.8 | Very high | 92.6 | Very high | 66 Ų | 66 | 84 Ų | 84 | 46% | 0.462 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63 | -41 | 175.3 | -171.5 | 0 | 0 | 0 | 0 | 112.2 | K170 F171 L172 I177 V178 | K170-S174 WeakPolarHBondContact O-CB 3.33Å; K170-S174 PolarHBondContact O-N 3.4Å; F171-S174 WeakPolarHBondContact O-CB 3.45Å; F171-S174 PolarHBondContact O-N 3.22Å; F171-S174 VanDerWaalsContact O-N 3.17Å; L172-S174 VanDerWaalsContact C-N 3.33Å; L172-S174 PolarHBondContact O-N 3.44Å; S174-I177 PolarHBondContact O-N 2.89Å; S174-V178 WeakPolarHBondContact O-CG2 3.26Å; S174-V178 PolarHBondContact O-N 2.85Å |
| 175 | C | 93.4 | Very high | 92.3 | Very high | 41 Ų | 41 | 89.2 Ų | 89.2 | 28% | 0.277 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -61.2 | -48.9 | 175.4 | -70.5 | 0 | 0 | 0 | 0 | 111.1 | F171 L172 I177 V178 D179 | F171-C175 VanDerWaalsContact CE1-SG 3.53Å; F171-C175 VanDerWaalsContact CZ-SG 3.52Å; F171-C175 PolarHBondContact O-N 3.38Å; F171-C175 PolarHBondContact O-SG 2.95Å; L172-C175 WeakPolarHBondContact O-CB 3.42Å; L172-C175 PolarHBondContact O-N 3.17Å; C175-I177 VanDerWaalsContact C-N 3.28Å; C175-I177 PolarHBondContact O-N 3.46Å; C175-V178 PolarHBondContact O-N 3.37Å; C175-V178 VanDerWaalsContact O-N 3.1Å; C175-D179 VanDerWaalsContact O-CG 3.29Å; C175-D179 PolarHBondContact O-N 3.1Å |
| 176 | V | 90.7 | Very high | 92.1 | Very high | 81 Ų | 81 | 88.5 Ų | 88.5 | 49% | 0.491 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -58.1 | -41.6 | 177.6 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | L172 A173 D179 Q180 | L172-V176 WeakPolarHBondContact O-CG2 3.37Å; L172-V176 PolarHBondContact O-N 2.9Å; A173-V176 PolarHBondContact O-N 3.42Å; V176-D179 PolarHBondContact O-N 3Å; V176-Q180 HydrophobicContact CG1-CG 4.43Å; V176-Q180 WeakPolarHBondContact O-CB 3.34Å; V176-Q180 VanDerWaalsContact O-CG 3.26Å; V176-Q180 WeakPolarHBondContact O-CG 3.45Å; V176-Q180 PolarHBondContact O-N 3.31Å |
| 177 | I | 89.9 | Confident | 91.8 | Very high | 27 Ų | 27 | 88.2 Ų | 88.2 | 14% | 0.138 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -62.9 | -45 | 176.3 | -67.4 | 160.1 | 0 | 0 | 0 | 111.5 | A173 S174 C175 D179 Q180 L181 F299 L302 L303 I306 | A173-I177 WeakPolarHBondContact O-CD1 3.29Å; A173-I177 VanDerWaalsContact O-CG1 3.25Å; A173-I177 WeakPolarHBondContact O-CG1 3.39Å; A173-I177 PolarHBondContact O-N 2.98Å; S174-I177 PolarHBondContact O-N 2.89Å; C175-I177 VanDerWaalsContact C-N 3.28Å; C175-I177 PolarHBondContact O-N 3.46Å; I177-D179 VanDerWaalsContact C-N 3.35Å; I177-Q180 PolarHBondContact O-N 2.97Å; I177-L181 HydrophobicContact CG2-CD1 3.86Å; I177-L181 HydrophobicContact CG2-CG 4.31Å; I177-L181 WeakPolarHBondContact O-CB 3.25Å; I177-L181 VanDerWaalsContact O-CG 3.25Å; I177-L181 WeakPolarHBondContact O-CG 3.39Å; I177-L181 PolarHBondContact O-N 3.39Å; I177-F299 HydrophobicContact CB-CE2 4.41Å; I177-F299 HydrophobicContact CG1-CE2 4.16Å; I177-F299 HydrophobicContact CG2-CE2 4.49Å; I177-F299 HydrophobicContact CG2-CZ 4.18Å; I177-L302 HydrophobicContact CD1-CD2 4.3Å; I177-L302 HydrophobicContact CG1-CD2 4.06Å; I177-L303 HydrophobicContact CG2-CD2 4Å; I177-I306 HydrophobicContact CD1-CD1 3.33Å; I177-I306 HydrophobicContact CG1-CD1 4.46Å |
| 178 | V | 90.8 | Very high | 91.5 | Very high | 74 Ų | 74 | 83.4 Ų | 83.4 | 45% | 0.448 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.6 | -41.2 | 177.4 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | S174 C175 Q180 L181 T182 | S174-V178 WeakPolarHBondContact O-CG2 3.26Å; S174-V178 PolarHBondContact O-N 2.85Å; C175-V178 PolarHBondContact O-N 3.37Å; C175-V178 VanDerWaalsContact O-N 3.1Å; V178-Q180 PolarHBondContact O-N 3.32Å; V178-L181 PolarHBondContact O-N 3.49Å; V178-T182 HydrophobicContact CG1-CG2 4.22Å; V178-T182 WeakPolarHBondContact O-CB 3.35Å; V178-T182 VanDerWaalsContact O-CG2 3.26Å; V178-T182 WeakPolarHBondContact O-CG2 3.26Å; V178-T182 PolarHBondContact O-N 2.83Å; V178-T182 PolarHBondContact O-OG1 2.76Å |
| 179 | D | 91.5 | Very high | 91.3 | Very high | 96 Ų | 96 | 82.5 Ų | 82.5 | 51% | 0.513 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 177.8 | -69 | -17.1 | 0 | 0 | 0 | 111.6 | C175 V176 I177 T182 T183 | C175-D179 VanDerWaalsContact O-CG 3.29Å; C175-D179 PolarHBondContact O-N 3.1Å; V176-D179 PolarHBondContact O-N 3Å; I177-D179 VanDerWaalsContact C-N 3.35Å; D179-T182 WeakPolarHBondContact CA-OG1 3.48Å; D179-T182 PolarHBondContact O-OG1 2.96Å; D179-T183 WeakPolarHBondContact O-CB 3.09Å; D179-T183 PolarHBondContact O-N 3.33Å; D179-T183 PolarHBondContact O-OG1 3.22Å |
| 180 | Q | 88.2 | Confident | 91.1 | Very high | 86 Ų | 86 | 82.9 Ų | 82.9 | 40% | 0.402 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -68.2 | -41.2 | 175 | -68.3 | -62 | -18.6 | 0 | 0 | 112 | V176 I177 V178 T183 S184 F299 | V176-Q180 HydrophobicContact CG1-CG 4.43Å; V176-Q180 WeakPolarHBondContact O-CB 3.34Å; V176-Q180 VanDerWaalsContact O-CG 3.26Å; V176-Q180 WeakPolarHBondContact O-CG 3.45Å; V176-Q180 PolarHBondContact O-N 3.31Å; I177-Q180 PolarHBondContact O-N 2.97Å; V178-Q180 PolarHBondContact O-N 3.32Å; Q180-T183 PolarHBondContact O-N 3.33Å; Q180-S184 VanDerWaalsContact O-CB 3.25Å; Q180-S184 WeakPolarHBondContact O-CB 3.2Å; Q180-S184 PolarHBondContact O-N 2.9Å; Q180-F299 HydrophobicContact CB-CD1 4.5Å; Q180-F299 HydrophobicContact CB-CD2 3.96Å; Q180-F299 HydrophobicContact CB-CE1 3.93Å; Q180-F299 HydrophobicContact CB-CE2 3.38Å; Q180-F299 HydrophobicContact CB-CG 4.48Å; Q180-F299 HydrophobicContact CB-CZ 3.34Å; Q180-F299 HydrophobicContact CG-CD2 3.94Å; Q180-F299 HydrophobicContact CG-CE2 3.71Å; Q180-F299 HydrophobicContact CG-CZ 4.2Å |
| 181 | L | 89 | Confident | 90.9 | Very high | 76 Ų | 76 | 79.8 Ų | 79.8 | 40% | 0.398 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.3 | -41.5 | 175.7 | -74.8 | 172.9 | 0 | 0 | 0 | 112.4 | I177 V178 S184 R185 F299 L303 | I177-L181 HydrophobicContact CG2-CD1 3.86Å; I177-L181 HydrophobicContact CG2-CG 4.31Å; I177-L181 WeakPolarHBondContact O-CB 3.25Å; I177-L181 VanDerWaalsContact O-CG 3.25Å; I177-L181 WeakPolarHBondContact O-CG 3.39Å; I177-L181 PolarHBondContact O-N 3.39Å; V178-L181 PolarHBondContact O-N 3.49Å; L181-S184 PolarHBondContact O-N 3.01Å; L181-R185 VanDerWaalsContact O-CB 3.31Å; L181-R185 WeakPolarHBondContact O-CB 3.25Å; L181-R185 PolarHBondContact O-N 3.46Å; L181-F299 HydrophobicContact CG-CZ 4.42Å; L181-L303 HydrophobicContact CD2-CD1 4.27Å |
| 182 | T | 91.6 | Very high | 90.7 | Very high | 64 Ų | 64 | 77.1 Ų | 77.1 | 39% | 0.393 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -66.9 | -41.6 | 177.1 | 52.8 | 0 | 0 | 0 | 0 | 111.2 | V178 D179 R185 M186 | V178-T182 HydrophobicContact CG1-CG2 4.22Å; V178-T182 WeakPolarHBondContact O-CB 3.35Å; V178-T182 VanDerWaalsContact O-CG2 3.26Å; V178-T182 WeakPolarHBondContact O-CG2 3.26Å; V178-T182 PolarHBondContact O-N 2.83Å; V178-T182 PolarHBondContact O-OG1 2.76Å; D179-T182 WeakPolarHBondContact CA-OG1 3.48Å; D179-T182 PolarHBondContact O-OG1 2.96Å; T182-R185 PolarHBondContact O-N 3.22Å; T182-M186 WeakPolarHBondContact O-CG 3.32Å; T182-M186 PolarHBondContact O-N 3.37Å |
| 183 | T | 90 | Very high | 90.7 | Very high | 77 Ų | 77 | 76.2 Ų | 76.2 | 47% | 0.472 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60.1 | -47 | 173.6 | -58.1 | 0 | 0 | 0 | 0 | 111.7 | D179 Q180 R185 M186 C187 | D179-T183 WeakPolarHBondContact O-CB 3.09Å; D179-T183 PolarHBondContact O-N 3.33Å; D179-T183 PolarHBondContact O-OG1 3.22Å; Q180-T183 PolarHBondContact O-N 3.33Å; T183-R185 PolarHBondContact O-N 2.94Å; T183-M186 PolarHBondContact O-N 2.87Å; T183-C187 PolarHBondContact O-N 2.88Å |
| 184 | S | 87.1 | Confident | 90.9 | Very high | 6 Ų | 6 | 78.6 Ų | 78.6 | 4% | 0.042 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 178.2 | -161.2 | 0 | 0 | 0 | 0 | 112.2 | Q180 L181 M186 C187 L188 M294 F295 | Q180-S184 VanDerWaalsContact O-CB 3.25Å; Q180-S184 WeakPolarHBondContact O-CB 3.2Å; Q180-S184 PolarHBondContact O-N 2.9Å; L181-S184 PolarHBondContact O-N 3.01Å; S184-M186 PolarHBondContact O-N 3.49Å; S184-C187 WeakPolarHBondContact O-CB 3.47Å; S184-C187 PolarHBondContact O-N 3.39Å; S184-L188 PolarHBondContact O-N 3.25Å; S184-M294 WeakPolarHBondContact OG-CE 3.45Å; S184-M294 PolarHBondContact OG-O 2.07Å; S184-F295 WeakPolarHBondContact OG-CE1 3.32Å; S184-F295 VanDerWaalsContact OG-CZ 3.25Å; S184-F295 WeakPolarHBondContact OG-CZ 3.31Å |
| 185 | R | 91.6 | Very high | 90.9 | Very high | 180 Ų | 180 | 77.4 Ų | 77.4 | 68% | 0.679 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -59.4 | -44.2 | 172.5 | 178.2 | -177.7 | 171.4 | 177.6 | -0.4 | 112 | L181 T182 T183 C187 L188 Q189 | L181-R185 VanDerWaalsContact O-CB 3.31Å; L181-R185 WeakPolarHBondContact O-CB 3.25Å; L181-R185 PolarHBondContact O-N 3.46Å; T182-R185 PolarHBondContact O-N 3.22Å; T183-R185 PolarHBondContact O-N 2.94Å; R185-C187 VanDerWaalsContact C-N 3.33Å; R185-L188 PolarHBondContact O-N 2.91Å; R185-Q189 WeakPolarHBondContact O-CB 3.39Å; R185-Q189 PolarHBondContact O-N 3.45Å |
| 186 | M | 92 | Very high | 91 | Very high | 115 Ų | 115 | 80.6 Ų | 80.6 | 57% | 0.567 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -63.1 | -40.3 | 177.3 | -73.3 | -175.2 | -70.6 | 0 | 0 | 111.7 | T182 T183 S184 Q189 N190 | T182-M186 WeakPolarHBondContact O-CG 3.32Å; T182-M186 PolarHBondContact O-N 3.37Å; T183-M186 PolarHBondContact O-N 2.87Å; S184-M186 PolarHBondContact O-N 3.49Å; M186-Q189 PolarHBondContact O-N 2.9Å; M186-N190 WeakPolarHBondContact O-CB 3.46Å; M186-N190 PolarHBondContact O-N 3.45Å |
| 187 | C | 89.5 | Confident | 91.2 | Very high | 59 Ų | 59 | 80.7 Ų | 80.7 | 40% | 0.399 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62 | -49.5 | 175.9 | -171.9 | 0 | 0 | 0 | 0 | 111.9 | T183 S184 R185 Q189 N190 Q191 I292 | T183-C187 PolarHBondContact O-N 2.88Å; S184-C187 WeakPolarHBondContact O-CB 3.47Å; S184-C187 PolarHBondContact O-N 3.39Å; R185-C187 VanDerWaalsContact C-N 3.33Å; C187-Q189 PolarHBondContact O-N 3.47Å; C187-N190 WeakPolarHBondContact O-CB 3.25Å; C187-N190 PolarHBondContact O-N 3.28Å; C187-Q191 PolarHBondContact O-N 2.95Å; C187-I292 VanDerWaalsContact SG-CG2 3.54Å |
| 188 | L | 89 | Confident | 91.4 | Very high | 70 Ų | 70 | 80.3 Ų | 80.3 | 37% | 0.366 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.3 | -45 | 175.5 | -85.7 | 173 | 0 | 0 | 0 | 112.7 | S184 R185 N190 Q191 C192 I292 M294 | S184-L188 PolarHBondContact O-N 3.25Å; R185-L188 PolarHBondContact O-N 2.91Å; L188-N190 VanDerWaalsContact C-N 3.3Å; L188-N190 PolarHBondContact O-N 2.98Å; L188-Q191 PolarHBondContact O-N 2.99Å; L188-C192 WeakPolarHBondContact O-CB 3.38Å; L188-C192 PolarHBondContact O-N 2.88Å; L188-I292 HydrophobicContact CD2-CD1 3.3Å; L188-I292 HydrophobicContact CG-CD1 4.17Å; L188-M294 HydrophobicContact CD1-CE 3.19Å; L188-M294 HydrophobicContact CD1-SD 3.62Å; L188-M294 HydrophobicContact CD2-CE 4.4Å; L188-M294 HydrophobicContact CD2-SD 3.69Å; L188-M294 HydrophobicContact CG-CE 3.71Å; L188-M294 HydrophobicContact CG-CG 4.41Å; L188-M294 HydrophobicContact CG-SD 3.59Å; L188-M294 VanDerWaalsContact CG-SD 3.59Å |
| 189 | Q | 92.7 | Very high | 91.6 | Very high | 120 Ų | 120 | 80.6 Ų | 80.6 | 56% | 0.561 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -62.7 | -39.8 | 179.1 | -175.7 | 175.7 | -12.2 | 0 | 0 | 111.2 | R185 M186 C187 C192 Q193 | R185-Q189 WeakPolarHBondContact O-CB 3.39Å; R185-Q189 PolarHBondContact O-N 3.45Å; M186-Q189 PolarHBondContact O-N 2.9Å; C187-Q189 PolarHBondContact O-N 3.47Å; Q189-C192 PolarHBondContact O-N 3.38Å; Q189-Q193 WeakPolarHBondContact O-CB 3.45Å; Q189-Q193 PolarHBondContact O-N 2.85Å |
| 190 | N | 91.7 | Very high | 91.8 | Very high | 85 Ų | 85 | 79.1 Ų | 79.1 | 46% | 0.455 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.7 | -43.8 | 174.3 | -173.9 | -52.4 | 0 | 0 | 0 | 111.6 | M186 C187 L188 Q193 K194 | M186-N190 WeakPolarHBondContact O-CB 3.46Å; M186-N190 PolarHBondContact O-N 3.45Å; C187-N190 WeakPolarHBondContact O-CB 3.25Å; C187-N190 PolarHBondContact O-N 3.28Å; L188-N190 VanDerWaalsContact C-N 3.3Å; L188-N190 PolarHBondContact O-N 2.98Å; N190-Q193 PolarHBondContact O-N 2.93Å; N190-K194 WeakPolarHBondContact O-CG 3.41Å; N190-K194 PolarHBondContact O-N 3.47Å; N190-K194 WeakPolarHBondContact OD1-CD 3.37Å; N190-K194 WeakPolarHBondContact OD1-CE 3.5Å; N190-K194 PolarHBondContact OD1-NZ 3.27Å |
| 191 | Q | 89.8 | Confident | 92.1 | Very high | 53 Ų | 53 | 77.1 Ų | 77.1 | 25% | 0.248 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -65 | -41.5 | 177 | -162 | -159.8 | 39 | 0 | 0 | 112 | C187 L188 Q193 K194 A195 D290 I292 | C187-Q191 PolarHBondContact O-N 2.95Å; L188-Q191 PolarHBondContact O-N 2.99Å; Q191-Q193 VanDerWaalsContact C-N 3.32Å; Q191-Q193 PolarHBondContact O-N 3.46Å; Q191-K194 PolarHBondContact O-N 3.46Å; Q191-A195 WeakPolarHBondContact O-CB 3.4Å; Q191-A195 PolarHBondContact O-N 2.84Å; Q191-D290 PolarHBondContact NE2-O 2.94Å; Q191-I292 HydrophobicContact CB-CD1 4.23Å; Q191-I292 HydrophobicContact CG-CD1 4.37Å; Q191-I292 HydrophobicContact CG-CG1 4.39Å; Q191-I292 VanDerWaalsContact NE2-CG1 3.26Å; Q191-I292 VanDerWaalsContact OE1-CG1 3.27Å |
| 192 | C | 91.8 | Very high | 92.3 | Very high | 83 Ų | 83 | 76.2 Ų | 76.2 | 56% | 0.561 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -60.6 | -42.7 | 174.9 | -175.5 | 0 | 0 | 0 | 0 | 111.3 | L188 Q189 A195 Q196 | L188-C192 WeakPolarHBondContact O-CB 3.38Å; L188-C192 PolarHBondContact O-N 2.88Å; Q189-C192 PolarHBondContact O-N 3.38Å; C192-A195 PolarHBondContact O-N 2.94Å; C192-Q196 WeakPolarHBondContact O-CB 3.39Å; C192-Q196 PolarHBondContact O-N 3.43Å |
| 193 | Q | 94.6 | Very high | 92.5 | Very high | 92 Ų | 92 | 78.5 Ų | 78.5 | 43% | 0.43 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.3 | -48 | 174.4 | -172.4 | 62.7 | 51.2 | 0 | 0 | 111.5 | Q189 N190 Q191 A195 Q196 D197 | Q189-Q193 WeakPolarHBondContact O-CB 3.45Å; Q189-Q193 PolarHBondContact O-N 2.85Å; N190-Q193 PolarHBondContact O-N 2.93Å; Q191-Q193 VanDerWaalsContact C-N 3.32Å; Q191-Q193 PolarHBondContact O-N 3.46Å; Q193-A195 VanDerWaalsContact C-N 3.32Å; Q193-A195 PolarHBondContact O-N 3.31Å; Q193-Q196 WeakPolarHBondContact O-CB 2.92Å; Q193-Q196 PolarHBondContact O-N 2.76Å; Q193-Q196 VanDerWaalsContact O-N 3.16Å; Q193-D197 PolarHBondContact NE2-OD1 3.26Å; Q193-D197 PolarHBondContact O-N 3.45Å |
| 194 | K | 92.6 | Very high | 92.6 | Very high | 100 Ų | 100 | 80.3 Ų | 80.3 | 44% | 0.435 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58 | -43.5 | 176.1 | -74.4 | 170 | 173.6 | 164.3 | 0 | 112.3 | N190 Q191 Q196 D197 V198 V287 | N190-K194 WeakPolarHBondContact O-CG 3.41Å; N190-K194 PolarHBondContact O-N 3.47Å; N190-K194 WeakPolarHBondContact OD1-CD 3.37Å; N190-K194 WeakPolarHBondContact OD1-CE 3.5Å; N190-K194 PolarHBondContact OD1-NZ 3.27Å; Q191-K194 PolarHBondContact O-N 3.46Å; K194-Q196 VanDerWaalsContact C-N 3.35Å; K194-D197 PolarHBondContact O-N 3.46Å; K194-V198 WeakPolarHBondContact O-CG2 3.38Å; K194-V198 PolarHBondContact O-N 2.92Å; K194-V198 VanDerWaalsContact O-N 3.07Å; K194-V287 HydrophobicContact CB-CG2 4.38Å |
| 195 | A | 92.2 | Very high | 92.9 | Very high | 40 Ų | 40 | 82 Ų | 82 | 33% | 0.331 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.8 | -41.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q191 C192 Q193 V198 V199 V287 | Q191-A195 WeakPolarHBondContact O-CB 3.4Å; Q191-A195 PolarHBondContact O-N 2.84Å; C192-A195 PolarHBondContact O-N 2.94Å; Q193-A195 VanDerWaalsContact C-N 3.32Å; Q193-A195 PolarHBondContact O-N 3.31Å; A195-V198 PolarHBondContact O-N 2.88Å; A195-V199 WeakPolarHBondContact O-CG2 2.98Å; A195-V199 PolarHBondContact O-N 3.23Å; A195-V287 HydrophobicContact CB-CG1 3.95Å |
| 196 | Q | 95.2 | Very high | 92.9 | Very high | 109 Ų | 109 | 77.7 Ų | 77.7 | 51% | 0.509 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.7 | -46.7 | 175.1 | -176.1 | 177.8 | 2.1 | 0 | 0 | 111.8 | C192 Q193 K194 V198 V199 V200 | C192-Q196 WeakPolarHBondContact O-CB 3.39Å; C192-Q196 PolarHBondContact O-N 3.43Å; Q193-Q196 WeakPolarHBondContact O-CB 2.92Å; Q193-Q196 PolarHBondContact O-N 2.76Å; Q193-Q196 VanDerWaalsContact O-N 3.16Å; K194-Q196 VanDerWaalsContact C-N 3.35Å; Q196-V198 VanDerWaalsContact C-N 3.29Å; Q196-V198 PolarHBondContact O-N 3.36Å; Q196-V199 PolarHBondContact O-N 2.94Å; Q196-V200 WeakPolarHBondContact O-CG2 3.25Å; Q196-V200 PolarHBondContact O-N 3.17Å |
| 197 | D | 94.8 | Very high | 92.9 | Very high | 83 Ų | 83 | 74.9 Ų | 74.9 | 44% | 0.444 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60.5 | -39.8 | 179.7 | -63.1 | -19 | 0 | 0 | 0 | 111.4 | Q193 K194 V200 S201 | Q193-D197 PolarHBondContact NE2-OD1 3.26Å; Q193-D197 PolarHBondContact O-N 3.45Å; K194-D197 PolarHBondContact O-N 3.46Å; D197-V200 PolarHBondContact O-N 3.38Å; D197-S201 PolarHBondContact O-N 3.26Å; D197-S201 PolarHBondContact O-OG 2.79Å |
| 198 | V | 94.3 | Very high | 93 | Very high | 18 Ų | 18 | 77.1 Ų | 77.1 | 11% | 0.109 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -68.3 | -40.9 | 175.8 | 174.1 | 0 | 0 | 0 | 0 | 112 | K194 A195 Q196 V200 S201 L202 L283 A284 V287 | K194-V198 WeakPolarHBondContact O-CG2 3.38Å; K194-V198 PolarHBondContact O-N 2.92Å; K194-V198 VanDerWaalsContact O-N 3.07Å; A195-V198 PolarHBondContact O-N 2.88Å; Q196-V198 VanDerWaalsContact C-N 3.29Å; Q196-V198 PolarHBondContact O-N 3.36Å; V198-V200 VanDerWaalsContact C-N 3.33Å; V198-V200 PolarHBondContact O-N 2.96Å; V198-S201 PolarHBondContact O-N 2.97Å; V198-L202 HydrophobicContact CG1-CD1 4.14Å; V198-L202 HydrophobicContact CG1-CG 4.4Å; V198-L202 WeakPolarHBondContact O-CG 3.34Å; V198-L202 PolarHBondContact O-N 2.97Å; V198-L283 HydrophobicContact CG2-CB 4.22Å; V198-A284 HydrophobicContact CG1-CB 3.5Å; V198-V287 HydrophobicContact CG2-CG2 4.04Å |
| 199 | V | 94.3 | Very high | 93.1 | Very high | 80 Ų | 80 | 80 Ų | 80 | 49% | 0.485 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 175.7 | 169 | 0 | 0 | 0 | 0 | 111 | A195 Q196 S201 L202 L203 | A195-V199 WeakPolarHBondContact O-CG2 2.98Å; A195-V199 PolarHBondContact O-N 3.23Å; Q196-V199 PolarHBondContact O-N 2.94Å; V199-S201 VanDerWaalsContact C-N 3.34Å; V199-S201 PolarHBondContact O-N 3.34Å; V199-L202 PolarHBondContact O-N 3.28Å; V199-L203 HydrophobicContact CG1-CD1 4.18Å; V199-L203 WeakPolarHBondContact O-CG 3.4Å; V199-L203 PolarHBondContact O-N 3.5Å |
| 200 | V | 95.7 | Very high | 93.1 | Very high | 66 Ų | 66 | 76.6 Ų | 76.6 | 40% | 0.4 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59.6 | -47.3 | 175 | 173 | 0 | 0 | 0 | 0 | 110.4 | Q196 D197 V198 L202 L203 E204 | Q196-V200 WeakPolarHBondContact O-CG2 3.25Å; Q196-V200 PolarHBondContact O-N 3.17Å; D197-V200 PolarHBondContact O-N 3.38Å; V198-V200 VanDerWaalsContact C-N 3.33Å; V198-V200 PolarHBondContact O-N 2.96Å; V200-L202 VanDerWaalsContact C-N 3.33Å; V200-L202 PolarHBondContact O-N 3.18Å; V200-L203 PolarHBondContact O-N 2.88Å; V200-L203 VanDerWaalsContact O-N 3.13Å; V200-E204 WeakPolarHBondContact O-CG 3.48Å; V200-E204 PolarHBondContact O-N 2.93Å |
| 201 | S | 94.2 | Very high | 93.1 | Very high | 44 Ų | 44 | 76.8 Ų | 76.8 | 31% | 0.308 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62 | -37.7 | 178.6 | -53.2 | 0 | 0 | 0 | 0 | 112.8 | D197 V198 V199 E204 E205 | D197-S201 PolarHBondContact O-N 3.26Å; D197-S201 PolarHBondContact O-OG 2.79Å; V198-S201 PolarHBondContact O-N 2.97Å; V199-S201 VanDerWaalsContact C-N 3.34Å; V199-S201 PolarHBondContact O-N 3.34Å; S201-E204 PolarHBondContact O-N 3.42Å; S201-E205 PolarHBondContact O-N 3.46Å |
| 202 | L | 94.2 | Very high | 93.2 | Very high | 57 Ų | 57 | 77.4 Ų | 77.4 | 30% | 0.298 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -66.9 | -36.9 | 174.9 | -78 | 170 | 0 | 0 | 0 | 112.3 | V198 V199 V200 H206 T280 E281 A284 | V198-L202 HydrophobicContact CG1-CD1 4.14Å; V198-L202 HydrophobicContact CG1-CG 4.4Å; V198-L202 WeakPolarHBondContact O-CG 3.34Å; V198-L202 PolarHBondContact O-N 2.97Å; V199-L202 PolarHBondContact O-N 3.28Å; V200-L202 VanDerWaalsContact C-N 3.33Å; V200-L202 PolarHBondContact O-N 3.18Å; L202-H206 WeakPolarHBondContact O-CB 3.45Å; L202-H206 PolarHBondContact O-N 3.01Å; L202-T280 WeakPolarHBondContact CD2-OG1 3.13Å; L202-E281 HydrophobicContact CD2-CG 4.03Å; L202-A284 HydrophobicContact CD1-CB 3.96Å |
| 203 | L | 94.4 | Very high | 93.2 | Very high | 112 Ų | 112 | 75.3 Ų | 75.3 | 59% | 0.586 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -69.1 | -36.6 | 175.7 | -70.9 | 172.9 | 0 | 0 | 0 | 111.6 | V199 V200 H206 S207 | V199-L203 HydrophobicContact CG1-CD1 4.18Å; V199-L203 WeakPolarHBondContact O-CG 3.4Å; V199-L203 PolarHBondContact O-N 3.5Å; V200-L203 PolarHBondContact O-N 2.88Å; V200-L203 VanDerWaalsContact O-N 3.13Å; L203-H206 PolarHBondContact O-N 3.28Å; L203-S207 PolarHBondContact O-N 3.19Å |
| 204 | E | 93.9 | Very high | 93 | Very high | 115 Ų | 115 | 72.4 Ų | 72.4 | 54% | 0.537 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -62.9 | -52.7 | 172.4 | -71.5 | 175.6 | 177.5 | 0 | 0 | 111 | V200 S201 H206 S207 D208 | V200-E204 WeakPolarHBondContact O-CG 3.48Å; V200-E204 PolarHBondContact O-N 2.93Å; S201-E204 PolarHBondContact O-N 3.42Å; E204-H206 VanDerWaalsContact C-N 3.29Å; E204-H206 PolarHBondContact O-N 3.26Å; E204-S207 WeakPolarHBondContact O-CB 3.44Å; E204-S207 PolarHBondContact O-N 2.9Å; E204-S207 PolarHBondContact O-OG 2.8Å; E204-D208 PolarHBondContact O-N 2.81Å |
| 205 | E | 92.5 | Very high | 93 | Very high | 42 Ų | 42 | 73.1 Ų | 73.1 | 20% | 0.196 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -58.3 | -41.1 | 175.4 | -78.8 | -168.5 | 179 | 0 | 0 | 112 | S201 S207 D208 Y209 T278 T280 | S201-E205 PolarHBondContact O-N 3.46Å; E205-S207 VanDerWaalsContact C-N 3.3Å; E205-S207 PolarHBondContact O-N 3.09Å; E205-D208 PolarHBondContact O-N 3.37Å; E205-Y209 HydrophobicContact CB-CD2 4.38Å; E205-Y209 HydrophobicContact CB-CE2 3.96Å; E205-Y209 WeakPolarHBondContact O-CD2 3.49Å; E205-Y209 PolarHBondContact O-N 2.96Å; E205-T278 WeakPolarHBondContact OE2-CB 3.39Å; E205-T278 PolarHBondContact OE2-OG1 3.18Å; E205-T280 VanDerWaalsContact CD-CG2 3.48Å; E205-T280 HydrophobicContact CG-CG2 4.08Å; E205-T280 WeakPolarHBondContact OE1-CG2 3.49Å; E205-T280 PolarHBondContact OE1-OG1 2.92Å; E205-T280 PolarHBondContact OE2-OG1 3.35Å |
| 206 | H | 91.5 | Very high | 92.9 | Very high | 89 Ų | 89 | 74 Ų | 74 | 41% | 0.412 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -60.4 | -39.7 | 175.5 | 177.7 | -81.2 | 0 | 0 | 0 | 111.9 | L202 L203 E204 F210 L243 | L202-H206 WeakPolarHBondContact O-CB 3.45Å; L202-H206 PolarHBondContact O-N 3.01Å; L203-H206 PolarHBondContact O-N 3.28Å; E204-H206 VanDerWaalsContact C-N 3.29Å; E204-H206 PolarHBondContact O-N 3.26Å; H206-F210 WeakPolarHBondContact O-CB 3.33Å; H206-F210 PolarHBondContact O-N 2.99Å; H206-L243 WeakPolarHBondContact NE2-CD2 2.99Å |
| 207 | S | 92.2 | Very high | 92.6 | Very high | 55 Ų | 55 | 69.2 Ų | 69.2 | 39% | 0.385 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66 | -41.5 | 175.7 | 73.6 | 0 | 0 | 0 | 0 | 112.1 | L203 E204 E205 Y209 F210 D211 | L203-S207 PolarHBondContact O-N 3.19Å; E204-S207 WeakPolarHBondContact O-CB 3.44Å; E204-S207 PolarHBondContact O-N 2.9Å; E204-S207 PolarHBondContact O-OG 2.8Å; E205-S207 VanDerWaalsContact C-N 3.3Å; E205-S207 PolarHBondContact O-N 3.09Å; S207-Y209 PolarHBondContact O-N 2.95Å; S207-F210 PolarHBondContact O-N 3.42Å; S207-D211 PolarHBondContact O-N 3.18Å |
| 208 | D | 92.4 | Very high | 92.3 | Very high | 106 Ų | 106 | 72.1 Ų | 72.1 | 57% | 0.567 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -63 | -42.9 | 176 | -71.4 | -22.1 | 0 | 0 | 0 | 111.7 | E204 E205 D211 S212 | E204-D208 PolarHBondContact O-N 2.81Å; E205-D208 PolarHBondContact O-N 3.37Å; D208-D211 PolarHBondContact O-N 3.37Å; D208-S212 WeakPolarHBondContact O-CB 3.34Å; D208-S212 PolarHBondContact O-N 3.16Å |
| 209 | Y | 90.6 | Very high | 92.1 | Very high | 131 Ų | 131 | 76.7 Ų | 76.7 | 51% | 0.514 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65.5 | -40 | 175.6 | -68.1 | -46.5 | 0 | 0 | 0 | 112.2 | E205 S207 S212 L213 T278 | E205-Y209 HydrophobicContact CB-CD2 4.38Å; E205-Y209 HydrophobicContact CB-CE2 3.96Å; E205-Y209 WeakPolarHBondContact O-CD2 3.49Å; E205-Y209 PolarHBondContact O-N 2.96Å; S207-Y209 PolarHBondContact O-N 2.95Å; Y209-S212 PolarHBondContact O-N 2.91Å; Y209-L213 VanDerWaalsContact O-CB 3.28Å; Y209-L213 WeakPolarHBondContact O-CB 3.4Å; Y209-L213 PolarHBondContact O-N 2.84Å; Y209-T278 HydrophobicContact CE2-CG2 4.21Å; Y209-T278 WeakPolarHBondContact OH-CG2 3.33Å |
| 210 | F | 92 | Very high | 91.8 | Very high | 49 Ų | 49 | 74.7 Ų | 74.7 | 22% | 0.215 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -62.4 | -45.2 | 176 | -177.8 | -90.4 | 0 | 0 | 0 | 111.3 | H206 S207 L213 H214 F241 L243 L246 | H206-F210 WeakPolarHBondContact O-CB 3.33Å; H206-F210 PolarHBondContact O-N 2.99Å; S207-F210 PolarHBondContact O-N 3.42Å; F210-L213 PolarHBondContact O-N 2.83Å; F210-H214 VanDerWaalsContact O-CB 3.27Å; F210-H214 WeakPolarHBondContact O-CB 3.48Å; F210-H214 PolarHBondContact O-N 3.49Å; F210-F241 HydrophobicContact CE2-CB 4.19Å; F210-F241 HydrophobicContact CZ-CB 3.92Å; F210-L243 HydrophobicContact CD2-CD1 4.11Å; F210-L246 HydrophobicContact CD2-CD2 4.2Å; F210-L246 HydrophobicContact CE2-CD2 3.99Å; F210-L246 HydrophobicContact CZ-CD2 4.38Å |
| 211 | D | 92.3 | Very high | 91.3 | Very high | 89 Ų | 89 | 74.8 Ų | 74.8 | 48% | 0.476 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 178 | -80.7 | -12.6 | 0 | 0 | 0 | 112.2 | S207 D208 H214 Q215 | S207-D211 PolarHBondContact O-N 3.18Å; D208-D211 PolarHBondContact O-N 3.37Å; D211-H214 PolarHBondContact O-N 3.26Å; D211-Q215 VanDerWaalsContact O-CG 3.3Å; D211-Q215 WeakPolarHBondContact O-CG 3.48Å; D211-Q215 PolarHBondContact O-N 3.07Å |
| 212 | S | 92.4 | Very high | 91 | Very high | 66 Ų | 66 | 76.3 Ų | 76.3 | 46% | 0.462 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.9 | -46.4 | 174.4 | -177.5 | 0 | 0 | 0 | 0 | 111.8 | D208 Y209 H214 Q215 T216 | D208-S212 WeakPolarHBondContact O-CB 3.34Å; D208-S212 PolarHBondContact O-N 3.16Å; Y209-S212 PolarHBondContact O-N 2.91Å; S212-H214 VanDerWaalsContact C-N 3.31Å; S212-H214 PolarHBondContact O-N 3.42Å; S212-Q215 WeakPolarHBondContact O-CB 3.39Å; S212-Q215 PolarHBondContact O-N 3.41Å; S212-T216 WeakPolarHBondContact O-CG2 3.44Å; S212-T216 PolarHBondContact O-N 2.87Å; S212-T216 PolarHBondContact O-OG1 3.34Å |
| 213 | L | 91 | Very high | 90.6 | Very high | 38 Ų | 38 | 78.1 Ų | 78.1 | 20% | 0.199 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -64.5 | -37.6 | 176.6 | -173 | 66.8 | 0 | 0 | 0 | 111.4 | Y209 F210 Q215 T216 F217 L243 L246 I247 C250 | Y209-L213 VanDerWaalsContact O-CB 3.28Å; Y209-L213 WeakPolarHBondContact O-CB 3.4Å; Y209-L213 PolarHBondContact O-N 2.84Å; F210-L213 PolarHBondContact O-N 2.83Å; L213-Q215 VanDerWaalsContact C-N 3.35Å; L213-Q215 PolarHBondContact O-N 2.99Å; L213-T216 WeakPolarHBondContact CA-OG1 3.47Å; L213-T216 PolarHBondContact O-N 3.21Å; L213-T216 PolarHBondContact O-OG1 3.02Å; L213-F217 WeakPolarHBondContact O-CB 3.34Å; L213-F217 PolarHBondContact O-N 2.88Å; L213-L243 HydrophobicContact CD2-CD1 3.94Å; L213-L246 HydrophobicContact CB-CD2 4.08Å; L213-L246 HydrophobicContact CD2-CB 4.17Å; L213-L246 HydrophobicContact CD2-CD2 3.8Å; L213-L246 HydrophobicContact CD2-CG 3.77Å; L213-L246 HydrophobicContact CG-CD2 3.84Å; L213-L246 HydrophobicContact CG-CG 3.89Å; L213-I247 HydrophobicContact CD2-CB 4.41Å; L213-I247 HydrophobicContact CD2-CD1 4.43Å; L213-I247 HydrophobicContact CD2-CG1 3.4Å; L213-C250 HydrophobicContact CD1-CB 4.38Å |
| 214 | H | 90.6 | Very high | 90 | Very high | 31 Ų | 31 | 73.1 Ų | 73.1 | 14% | 0.144 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -67.5 | -36.4 | 176.5 | -170.9 | -68.3 | 0 | 0 | 0 | 111.6 | F210 D211 S212 F217 R218 F241 L246 | F210-H214 VanDerWaalsContact O-CB 3.27Å; F210-H214 WeakPolarHBondContact O-CB 3.48Å; F210-H214 PolarHBondContact O-N 3.49Å; D211-H214 PolarHBondContact O-N 3.26Å; S212-H214 VanDerWaalsContact C-N 3.31Å; S212-H214 PolarHBondContact O-N 3.42Å; H214-F217 PolarHBondContact O-N 3.38Å; H214-R218 PolarHBondContact CE1-NE 2.65Å; H214-R218 VanDerWaalsContact CE1-NE 3.26Å; H214-R218 PolarHBondContact CE1-NH2 3.48Å; H214-R218 VanDerWaalsContact ND1-CZ 3.33Å; H214-R218 WeakPolarHBondContact O-CG 3.22Å; H214-R218 PolarHBondContact O-N 3.17Å; H214-F241 AromaticContact NE2-CE2 3.95Å; H214-L246 HydrophobicContact CB-CD2 4.06Å |
| 215 | Q | 91.8 | Very high | 89.5 | Confident | 116 Ų | 116 | 73.2 Ų | 73.2 | 54% | 0.542 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.5 | -44.9 | 172.3 | -72.1 | 172.7 | 38.8 | 0 | 0 | 111.6 | D211 S212 L213 F217 R218 L219 | D211-Q215 VanDerWaalsContact O-CG 3.3Å; D211-Q215 WeakPolarHBondContact O-CG 3.48Å; D211-Q215 PolarHBondContact O-N 3.07Å; S212-Q215 WeakPolarHBondContact O-CB 3.39Å; S212-Q215 PolarHBondContact O-N 3.41Å; L213-Q215 VanDerWaalsContact C-N 3.35Å; L213-Q215 PolarHBondContact O-N 2.99Å; Q215-F217 VanDerWaalsContact C-N 3.35Å; Q215-F217 PolarHBondContact O-N 3.21Å; Q215-R218 WeakPolarHBondContact O-CB 3.35Å; Q215-R218 PolarHBondContact O-N 2.97Å; Q215-L219 WeakPolarHBondContact O-CG 3.49Å; Q215-L219 PolarHBondContact O-N 3.48Å |
| 216 | T | 91.3 | Very high | 89 | Confident | 59 Ų | 59 | 78.1 Ų | 78.1 | 36% | 0.362 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.3 | -39.3 | 175.2 | 58.9 | 0 | 0 | 0 | 0 | 112.2 | S212 L213 R218 L219 L220 | S212-T216 WeakPolarHBondContact O-CG2 3.44Å; S212-T216 PolarHBondContact O-N 2.87Å; S212-T216 PolarHBondContact O-OG1 3.34Å; L213-T216 WeakPolarHBondContact CA-OG1 3.47Å; L213-T216 PolarHBondContact O-N 3.21Å; L213-T216 PolarHBondContact O-OG1 3.02Å; T216-R218 PolarHBondContact O-N 2.84Å; T216-L219 PolarHBondContact O-N 2.89Å; T216-L220 WeakPolarHBondContact O-CB 3.35Å; T216-L220 WeakPolarHBondContact O-CG 3.43Å; T216-L220 PolarHBondContact O-N 3.42Å |
| 217 | F | 89.3 | Confident | 88.4 | Confident | 8 Ų | 8 | 80.8 Ų | 80.8 | 4% | 0.035 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -57.5 | -47 | 171.8 | 177.9 | -99.9 | 0 | 0 | 0 | 111.9 | L213 H214 Q215 L219 L220 K221 T234 F241 L246 D249 C250 M253 | L213-F217 WeakPolarHBondContact O-CB 3.34Å; L213-F217 PolarHBondContact O-N 2.88Å; H214-F217 PolarHBondContact O-N 3.38Å; Q215-F217 VanDerWaalsContact C-N 3.35Å; Q215-F217 PolarHBondContact O-N 3.21Å; F217-L219 VanDerWaalsContact C-N 3.35Å; F217-L219 PolarHBondContact O-N 2.99Å; F217-L220 PolarHBondContact O-N 2.97Å; F217-K221 HydrophobicContact CE1-CD 4.18Å; F217-K221 HydrophobicContact CZ-CD 4.48Å; F217-K221 VanDerWaalsContact O-CB 3.24Å; F217-K221 WeakPolarHBondContact O-CB 3.07Å; F217-K221 PolarHBondContact O-N 2.93Å; F217-T234 HydrophobicContact CZ-CG2 4.16Å; F217-F241 HydrophobicContact CD1-CZ 4.45Å; F217-F241 HydrophobicContact CE1-CE1 4.23Å; F217-F241 AromaticContact CE1-CZ 3.85Å; F217-F241 HydrophobicContact CE1-CZ 3.85Å; F217-F241 HydrophobicContact CZ-CE1 4.24Å; F217-F241 HydrophobicContact CZ-CZ 4.21Å; F217-L246 HydrophobicContact CB-CD1 3.64Å; F217-L246 HydrophobicContact CD1-CD1 4.12Å; F217-L246 HydrophobicContact CD2-CD1 3.88Å; F217-L246 HydrophobicContact CG-CD1 3.6Å; F217-D249 HydrophobicContact CD2-CB 4.15Å; F217-D249 HydrophobicContact CE2-CB 3.63Å; F217-C250 VanDerWaalsContact CB-SG 3.55Å; F217-M253 HydrophobicContact CD2-CE 3.07Å; F217-M253 HydrophobicContact CD2-SD 4.44Å; F217-M253 HydrophobicContact CE2-CE 3.12Å; F217-M253 HydrophobicContact CE2-SD 3.96Å; F217-M253 HydrophobicContact CG-CE 3.96Å; F217-M253 HydrophobicContact CZ-CE 4.08Å |
| 218 | R | 88.4 | Confident | 87.5 | Confident | 143 Ų | 143 | 80.2 Ų | 80.2 | 54% | 0.54 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -58.9 | -45.6 | 176 | -75.2 | -175.7 | -175.8 | 129.2 | 4.3 | 111.5 | H214 Q215 T216 K221 D222 | H214-R218 PolarHBondContact CE1-NE 2.65Å; H214-R218 VanDerWaalsContact CE1-NE 3.26Å; H214-R218 PolarHBondContact CE1-NH2 3.48Å; H214-R218 VanDerWaalsContact ND1-CZ 3.33Å; H214-R218 WeakPolarHBondContact O-CG 3.22Å; H214-R218 PolarHBondContact O-N 3.17Å; Q215-R218 WeakPolarHBondContact O-CB 3.35Å; Q215-R218 PolarHBondContact O-N 2.97Å; T216-R218 PolarHBondContact O-N 2.84Å; R218-K221 PolarHBondContact O-N 3.15Å; R218-D222 PolarHBondContact O-N 2.95Å |
| 219 | L | 89.6 | Confident | 86.4 | Confident | 114 Ų | 114 | 80.5 Ų | 80.5 | 60% | 0.597 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -62.2 | -47.4 | 177.6 | -69.3 | 172.4 | 0 | 0 | 0 | 112 | Q215 T216 F217 K221 D222 L223 | Q215-L219 WeakPolarHBondContact O-CG 3.49Å; Q215-L219 PolarHBondContact O-N 3.48Å; T216-L219 PolarHBondContact O-N 2.89Å; F217-L219 VanDerWaalsContact C-N 3.35Å; F217-L219 PolarHBondContact O-N 2.99Å; L219-K221 VanDerWaalsContact C-N 3.32Å; L219-K221 PolarHBondContact O-N 3.03Å; L219-D222 PolarHBondContact O-N 3.32Å; L219-L223 WeakPolarHBondContact O-CB 3.47Å; L219-L223 VanDerWaalsContact O-CG 3.31Å; L219-L223 WeakPolarHBondContact O-CG 3.25Å; L219-L223 PolarHBondContact O-N 3Å |
| 220 | L | 87.9 | Confident | 85.2 | Confident | 38 Ų | 38 | 83.1 Ų | 83.1 | 20% | 0.199 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -61.3 | -40.8 | 176.4 | -72.9 | 172.9 | 0 | 0 | 0 | 111.7 | T216 F217 L223 N224 C250 M253 L257 | T216-L220 WeakPolarHBondContact O-CB 3.35Å; T216-L220 WeakPolarHBondContact O-CG 3.43Å; T216-L220 PolarHBondContact O-N 3.42Å; F217-L220 PolarHBondContact O-N 2.97Å; L220-L223 PolarHBondContact O-N 2.89Å; L220-N224 VanDerWaalsContact O-CB 3.32Å; L220-N224 WeakPolarHBondContact O-CB 3.47Å; L220-N224 PolarHBondContact O-N 3.03Å; L220-C250 HydrophobicContact CD1-CB 4.23Å; L220-M253 HydrophobicContact CB-CB 4.33Å; L220-M253 HydrophobicContact CB-CE 3.68Å; L220-M253 HydrophobicContact CB-SD 4.43Å; L220-M253 HydrophobicContact CD1-CE 4.44Å; L220-L257 HydrophobicContact CD2-CD1 3.84Å |
| 221 | K | 85.5 | Confident | 83.7 | Confident | 68 Ų | 68 | 85.8 Ų | 85.8 | 30% | 0.296 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.5 | -44 | 175.5 | -178.2 | 174.5 | -173.8 | 164.1 | 0 | 111.3 | F217 R218 L219 N224 K225 T234 M253 | F217-K221 HydrophobicContact CE1-CD 4.18Å; F217-K221 HydrophobicContact CZ-CD 4.48Å; F217-K221 VanDerWaalsContact O-CB 3.24Å; F217-K221 WeakPolarHBondContact O-CB 3.07Å; F217-K221 PolarHBondContact O-N 2.93Å; R218-K221 PolarHBondContact O-N 3.15Å; L219-K221 VanDerWaalsContact C-N 3.32Å; L219-K221 PolarHBondContact O-N 3.03Å; K221-N224 PolarHBondContact O-N 2.62Å; K221-K225 WeakPolarHBondContact O-CG 3.4Å; K221-K225 PolarHBondContact O-N 3.13Å; K221-T234 HydrophobicContact CD-CG2 3.83Å; K221-T234 HydrophobicContact CG-CG2 3.94Å; K221-M253 HydrophobicContact CB-CE 4.5Å; K221-M253 HydrophobicContact CB-SD 4.06Å |
| 222 | D | 86.8 | Confident | 82.3 | Confident | 77 Ų | 77 | 86.7 Ų | 86.7 | 41% | 0.412 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -70.3 | -39.7 | 178.9 | -70 | -20.8 | 0 | 0 | 0 | 112.1 | R218 L219 N224 K225 L226 | R218-D222 PolarHBondContact O-N 2.95Å; L219-D222 PolarHBondContact O-N 3.32Å; D222-N224 PolarHBondContact O-N 2.99Å; D222-K225 PolarHBondContact O-N 3.38Å; D222-K225 IonicContact OD1-NZ 3.21Å; D222-K225 PolarHBondContact OD1-NZ 3.14Å; D222-L226 WeakPolarHBondContact O-CD1 3.38Å; D222-L226 PolarHBondContact O-N 3.31Å; D222-L226 VanDerWaalsContact O-N 3.12Å |
| 223 | L | 86 | Confident | 81 | Confident | 94 Ų | 94 | 86.2 Ų | 86.2 | 49% | 0.492 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62 | -41.3 | 172 | -70.9 | 177.5 | 0 | 0 | 0 | 112.2 | L219 L220 L226 R227 L257 | L219-L223 WeakPolarHBondContact O-CB 3.47Å; L219-L223 VanDerWaalsContact O-CG 3.31Å; L219-L223 WeakPolarHBondContact O-CG 3.25Å; L219-L223 PolarHBondContact O-N 3Å; L220-L223 PolarHBondContact O-N 2.89Å; L223-L226 PolarHBondContact O-N 3.29Å; L223-R227 PolarHBondContact O-N 3.4Å; L223-L257 HydrophobicContact CB-CD1 4.18Å |
| 224 | N | 83.2 | Confident | 79.6 | Confident | 7 Ų | 7 | 85.9 Ų | 85.9 | 4% | 0.037 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 176.8 | -172.7 | 42.2 | 0 | 0 | 0 | 111.9 | L220 K221 D222 L226 R227 N228 M231 L257 | L220-N224 VanDerWaalsContact O-CB 3.32Å; L220-N224 WeakPolarHBondContact O-CB 3.47Å; L220-N224 PolarHBondContact O-N 3.03Å; K221-N224 PolarHBondContact O-N 2.62Å; D222-N224 PolarHBondContact O-N 2.99Å; N224-L226 VanDerWaalsContact C-N 3.3Å; N224-L226 PolarHBondContact O-N 3.12Å; N224-R227 PolarHBondContact O-N 3.18Å; N224-N228 CarbonylContact O-C 3.55Å; N224-N228 PolarHBondContact O-N 3.4Å; N224-M231 PolarHBondContact ND2-O 2.71Å; N224-L257 HydrophobicContact CB-CD2 4.3Å |
| 225 | K | 82.9 | Confident | 78.5 | Confident | 118 Ų | 118 | 92.1 Ų | 92.1 | 51% | 0.513 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.2 | -39.3 | 173.7 | -71.1 | 171.8 | -165.2 | 155.8 | 0 | 112.7 | K221 D222 | K221-K225 WeakPolarHBondContact O-CG 3.4Å; K221-K225 PolarHBondContact O-N 3.13Å; D222-K225 PolarHBondContact O-N 3.38Å; D222-K225 IonicContact OD1-NZ 3.21Å; D222-K225 PolarHBondContact OD1-NZ 3.14Å |
| 226 | L | 82.3 | Confident | 77.2 | Confident | 145 Ų | 145 | 94.5 Ų | 94.5 | 76% | 0.759 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -68.6 | -38.2 | 179 | -82.1 | 152 | 0 | 0 | 0 | 112.4 | D222 L223 N224 | D222-L226 WeakPolarHBondContact O-CD1 3.38Å; D222-L226 PolarHBondContact O-N 3.31Å; D222-L226 VanDerWaalsContact O-N 3.12Å; L223-L226 PolarHBondContact O-N 3.29Å; N224-L226 VanDerWaalsContact C-N 3.3Å; N224-L226 PolarHBondContact O-N 3.12Å |
| 227 | R | 78.7 | Confident | 75.7 | Confident | 144 Ų | 144 | 94.1 Ų | 94.1 | 54% | 0.543 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -88.4 | -43.1 | -173.8 | -176 | 60.8 | 173 | -174.2 | -0.4 | 113.3 | L223 N224 L257 S260 | L223-R227 PolarHBondContact O-N 3.4Å; N224-R227 PolarHBondContact O-N 3.18Å; R227-L257 HydrophobicContact CB-CD2 4.31Å; R227-S260 PolarHBondContact NH2-O 2.79Å |
| 228 | N | 72.1 | Confident | 74.4 | Confident | 44 Ų | 44 | 96.1 Ų | 96.1 | 24% | 0.235 | 49% | 0.486 | C | S | . | . | trans | -133.5 | 78 | -173.4 | -57.4 | -62.3 | 0 | 0 | 0 | 109.9 | N224 E230 M231 | N224-N228 CarbonylContact O-C 3.55Å; N224-N228 PolarHBondContact O-N 3.4Å; N228-E230 PolarHBondContact O-N 2.91Å; N228-E230 VanDerWaalsContact O-N 3.08Å; N228-M231 HydrophobicContact CB-CB 3.93Å; N228-M231 HydrophobicContact CB-CG 4.29Å; N228-M231 PolarHBondContact O-N 3.41Å | ||
| 229 | P | 70.3 | Confident | 73.4 | Confident | 112 Ų | 112 | 95.4 Ų | 95.4 | 73% | 0.727 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.9 | -20.8 | 179.9 | 24.5 | -33.7 | 0 | 0 | 0 | 113 | ||
| 230 | E | 64 | Low | 72.6 | Confident | 186 Ų | 186 | 95.3 Ų | 95.3 | 87% | 0.869 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.6 | -16 | 179 | -58.1 | -168.8 | 165.9 | 0 | 0 | 113.6 | N228 | N228-E230 PolarHBondContact O-N 2.91Å; N228-E230 VanDerWaalsContact O-N 3.08Å |
| 231 | M | 62.3 | Low | 71.8 | Confident | 104 Ų | 104 | 95.5 Ų | 95.5 | 51% | 0.512 | 51% | 0.506 | S | S | . | . | trans | -105.6 | 81.5 | -176.7 | -69.6 | -66.4 | -69.5 | 0 | 0 | 111.2 | N224 N228 L233 | N224-M231 PolarHBondContact ND2-O 2.71Å; N228-M231 HydrophobicContact CB-CB 3.93Å; N228-M231 HydrophobicContact CB-CG 4.29Å; N228-M231 PolarHBondContact O-N 3.41Å; M231-L233 HydrophobicContact CB-CG 4.48Å; M231-L233 HydrophobicContact CE-CD2 3.89Å; M231-L233 PolarHBondContact O-N 2.91Å | ||
| 232 | C | 63 | Low | 71.8 | Confident | 109 Ų | 109 | 95.4 Ų | 95.4 | 74% | 0.736 | 51% | 0.514 | S | S | * | . | trans | -76.9 | 91 | 170.2 | -161.2 | 0 | 0 | 0 | 0 | 109.7 | T234 | C232-T234 VanDerWaalsContact C-N 3.3Š| ||
| 233 | L | 63.8 | Low | 71.8 | Confident | 56 Ų | 56 | 94.2 Ų | 94.2 | 29% | 0.293 | 51% | 0.507 | S | S | . | . | trans | -86.1 | -2.4 | -178.8 | -67.4 | 172.6 | 0 | 0 | 0 | 113.7 | M231 R235 M253 A256 | M231-L233 HydrophobicContact CB-CG 4.48Å; M231-L233 HydrophobicContact CE-CD2 3.89Å; M231-L233 PolarHBondContact O-N 2.91Å; L233-R235 PolarHBondContact O-N 3.27Å; L233-M253 HydrophobicContact CB-CG 4.46Å; L233-A256 HydrophobicContact CD1-CB 3.11Å | ||
| 234 | T | 62.3 | Low | 71.9 | Confident | 31 Ų | 31 | 95.4 Ų | 95.4 | 19% | 0.19 | 51% | 0.514 | C | S | . | . | trans | -83.4 | 121.7 | -178.3 | 59.2 | 0 | 0 | 0 | 0 | 110.1 | F217 K221 C232 M253 | F217-T234 HydrophobicContact CZ-CG2 4.16Å; K221-T234 HydrophobicContact CD-CG2 3.83Å; K221-T234 HydrophobicContact CG-CG2 3.94Å; C232-T234 VanDerWaalsContact C-N 3.3Å; T234-M253 HydrophobicContact CG2-SD 4.13Å | ||
| 235 | R | 67.2 | Low | 72.1 | Confident | 162 Ų | 162 | 97.1 Ų | 97.1 | 61% | 0.611 | 53% | 0.525 | S | S | * | . | trans | -59.5 | 140.5 | 158 | -78.8 | 172.1 | 170.2 | 173.3 | -3 | 108.6 | L233 H237 | L233-R235 PolarHBondContact O-N 3.27Å; R235-H237 VanDerWaalsContact CB-CE1 3.44Å; R235-H237 WeakPolarHBondContact CB-CE1 3.2Å; R235-H237 WeakPolarHBondContact CB-NE2 3.33Å; R235-H237 PolarHBondContact O-N 3.45Å | ||
| 236 | D | 64.8 | Low | 72.3 | Confident | 166 Ų | 166 | 91.5 Ų | 91.5 | 89% | 0.888 | 50% | 0.501 | S | S | * | . | trans | -74.1 | 79.4 | 173.6 | -162.4 | 11.8 | 0 | 0 | 0 | 108.4 | ||||
| 237 | H | 59.9 | Low | 72.7 | Confident | 51 Ų | 51 | 87.2 Ų | 87.2 | 24% | 0.236 | 48% | 0.478 | C | S | . | . | trans | -81.2 | 116.4 | 169.3 | -63.5 | -49.6 | 0 | 0 | 0 | 106.1 | R235 F241 D249 | R235-H237 VanDerWaalsContact CB-CE1 3.44Å; R235-H237 WeakPolarHBondContact CB-CE1 3.2Å; R235-H237 WeakPolarHBondContact CB-NE2 3.33Å; R235-H237 PolarHBondContact O-N 3.45Å; H237-F241 HydrophobicContact CB-CD1 4.23Å; H237-F241 HydrophobicContact CB-CE1 3.72Å; H237-F241 HydrophobicContact CB-CE2 4.18Å; H237-F241 HydrophobicContact CB-CZ 3.68Å; H237-F241 AromaticContact CD2-CE1 3.53Å; H237-F241 AromaticContact CG-CE1 3.88Å; H237-D249 IonicContact CD2-OD2 2.97Å; H237-D249 PolarHBondContact CD2-OD2 3.16Å; H237-D249 IonicContact NE2-OD1 3.98Å; H237-D249 IonicContact NE2-OD2 3.88Å; H237-D249 PolarHBondContact NE2-OD2 3.26Å | ||
| 238 | G | 62.4 | Low | 73.2 | Confident | 50 Ų | 50 | 82.4 Ų | 82.4 | 52% | 0.515 | 47% | 0.469 | S | S | . | . | trans | -56.5 | -164.5 | 166.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | T240 | G238-T240 PolarHBondContact O-N 3.37Š| ||
| 239 | S | 67.5 | Low | 73.9 | Confident | 128 Ų | 128 | 80.7 Ų | 80.7 | 90% | 0.895 | 46% | 0.46 | S | S | * | . | S | Bend | trans | -63.6 | 6.6 | -176.2 | 59.7 | 0 | 0 | 0 | 0 | 116.2 | ||
| 240 | T | 72.3 | Confident | 74.7 | Confident | 112 Ų | 112 | 76 Ų | 76 | 69% | 0.687 | 43% | 0.429 | S | S | * | . | trans | -122.4 | 112 | -177 | 56.6 | 0 | 0 | 0 | 0 | 110.7 | G238 | G238-T240 PolarHBondContact O-N 3.37Š| ||
| 241 | F | 71.3 | Confident | 75.9 | Confident | 42 Ų | 42 | 75 Ų | 75 | 18% | 0.184 | 42% | 0.418 | C | S | . | . | trans | -103 | 132.1 | 166.4 | -76.5 | -91.5 | 0 | 0 | 0 | 109.2 | F210 H214 F217 H237 L246 | F210-F241 HydrophobicContact CE2-CB 4.19Å; F210-F241 HydrophobicContact CZ-CB 3.92Å; H214-F241 AromaticContact NE2-CE2 3.95Å; F217-F241 HydrophobicContact CD1-CZ 4.45Å; F217-F241 HydrophobicContact CE1-CE1 4.23Å; F217-F241 AromaticContact CE1-CZ 3.85Å; F217-F241 HydrophobicContact CE1-CZ 3.85Å; F217-F241 HydrophobicContact CZ-CE1 4.24Å; F217-F241 HydrophobicContact CZ-CZ 4.21Å; H237-F241 HydrophobicContact CB-CD1 4.23Å; H237-F241 HydrophobicContact CB-CE1 3.72Å; H237-F241 HydrophobicContact CB-CE2 4.18Å; H237-F241 HydrophobicContact CB-CZ 3.68Å; H237-F241 AromaticContact CD2-CE1 3.53Å; H237-F241 AromaticContact CG-CE1 3.88Å; F241-L246 HydrophobicContact CB-CB 4.38Å; F241-L246 HydrophobicContact CD1-CB 4.18Å; F241-L246 HydrophobicContact CD1-CD1 3.82Å; F241-L246 HydrophobicContact CE1-CD1 4.05Å; F241-L246 HydrophobicContact CG-CD1 4.28Å | ||
| 242 | S | 84.5 | Confident | 77.1 | Confident | 66 Ų | 66 | 73.4 Ų | 73.4 | 46% | 0.462 | 41% | 0.414 | S | S | . | . | trans | -79 | 145.9 | 158.6 | 176.3 | 0 | 0 | 0 | 0 | 108.5 | D244 T245 L246 | S242-D244 PolarHBondContact O-N 3.47Å; S242-T245 WeakPolarHBondContact CA-OG1 3.48Å; S242-T245 WeakPolarHBondContact CB-OG1 3.39Å; S242-T245 PolarHBondContact N-OG1 3.08Å; S242-T245 PolarHBondContact O-N 3Å; S242-T245 VanDerWaalsContact O-N 3.09Å; S242-T245 PolarHBondContact O-OG1 3.02Å; S242-L246 PolarHBondContact O-N 3Å | ||
| 243 | L | 86.5 | Confident | 78.1 | Confident | 51 Ų | 51 | 68.2 Ų | 68.2 | 27% | 0.267 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -53.3 | -44.7 | 178.7 | 179.7 | 67.1 | 0 | 0 | 0 | 111.1 | H206 F210 L213 T245 L246 I247 | H206-L243 WeakPolarHBondContact NE2-CD2 2.99Å; F210-L243 HydrophobicContact CD2-CD1 4.11Å; L213-L243 HydrophobicContact CD2-CD1 3.94Å; L243-T245 VanDerWaalsContact C-N 3.34Å; L243-T245 PolarHBondContact O-N 3.49Å; L243-L246 PolarHBondContact O-N 3.47Å; L243-I247 HydrophobicContact CD1-CD1 4.19Å; L243-I247 HydrophobicContact CD1-CG1 4.39Å; L243-I247 HydrophobicContact CD2-CD1 4.45Å; L243-I247 HydrophobicContact CG-CD1 3.91Å; L243-I247 HydrophobicContact CG-CG1 4.48Å; L243-I247 WeakPolarHBondContact O-CG1 3.46Å; L243-I247 PolarHBondContact O-N 3.42Å |
| 244 | D | 88 | Confident | 79.2 | Confident | 120 Ų | 120 | 67.1 Ų | 67.1 | 64% | 0.642 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -62.6 | -39.7 | 179.8 | -64.4 | -33.8 | 0 | 0 | 0 | 112.5 | S242 A248 | S242-D244 PolarHBondContact O-N 3.47Å; D244-A248 WeakPolarHBondContact O-CB 3.2Å; D244-A248 PolarHBondContact O-N 3.48Å |
| 245 | T | 87.2 | Confident | 80.3 | Confident | 43 Ų | 43 | 70.4 Ų | 70.4 | 26% | 0.264 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -68.3 | -40 | 177.6 | 52.8 | 0 | 0 | 0 | 0 | 111.5 | S242 L243 A248 D249 | S242-T245 WeakPolarHBondContact CA-OG1 3.48Å; S242-T245 WeakPolarHBondContact CB-OG1 3.39Å; S242-T245 PolarHBondContact N-OG1 3.08Å; S242-T245 PolarHBondContact O-N 3Å; S242-T245 VanDerWaalsContact O-N 3.09Å; S242-T245 PolarHBondContact O-OG1 3.02Å; L243-T245 VanDerWaalsContact C-N 3.34Å; L243-T245 PolarHBondContact O-N 3.49Å; T245-A248 PolarHBondContact O-N 2.96Å; T245-D249 WeakPolarHBondContact O-CB 3.21Å; T245-D249 VanDerWaalsContact O-CG 3.3Å; T245-D249 PolarHBondContact O-N 2.97Å |
| 246 | L | 87.9 | Confident | 81 | Confident | 0 Ų | 0 | 63.8 Ų | 63.8 | 0% | 0 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -66 | -41.9 | 178 | -174.3 | 62.6 | 0 | 0 | 0 | 111.4 | F210 L213 H214 F217 F241 S242 L243 D249 C250 | F210-L246 HydrophobicContact CD2-CD2 4.2Å; F210-L246 HydrophobicContact CE2-CD2 3.99Å; F210-L246 HydrophobicContact CZ-CD2 4.38Å; L213-L246 HydrophobicContact CB-CD2 4.08Å; L213-L246 HydrophobicContact CD2-CB 4.17Å; L213-L246 HydrophobicContact CD2-CD2 3.8Å; L213-L246 HydrophobicContact CD2-CG 3.77Å; L213-L246 HydrophobicContact CG-CD2 3.84Å; L213-L246 HydrophobicContact CG-CG 3.89Å; H214-L246 HydrophobicContact CB-CD2 4.06Å; F217-L246 HydrophobicContact CB-CD1 3.64Å; F217-L246 HydrophobicContact CD1-CD1 4.12Å; F217-L246 HydrophobicContact CD2-CD1 3.88Å; F217-L246 HydrophobicContact CG-CD1 3.6Å; F241-L246 HydrophobicContact CB-CB 4.38Å; F241-L246 HydrophobicContact CD1-CB 4.18Å; F241-L246 HydrophobicContact CD1-CD1 3.82Å; F241-L246 HydrophobicContact CE1-CD1 4.05Å; F241-L246 HydrophobicContact CG-CD1 4.28Å; S242-L246 PolarHBondContact O-N 3Å; L243-L246 PolarHBondContact O-N 3.47Å; L246-D249 PolarHBondContact O-N 3.26Å; L246-C250 WeakPolarHBondContact O-CB 3.15Å; L246-C250 PolarHBondContact O-N 3.33Å; L246-C250 PolarHBondContact O-SG 3.22Å; L246-C250 VanDerWaalsContact O-SG 3.37Å |
| 247 | I | 90.4 | Very high | 81.9 | Confident | 54 Ų | 54 | 56.7 Ų | 56.7 | 28% | 0.277 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 174.3 | -67.1 | 170 | 0 | 0 | 0 | 110.6 | L213 L243 D249 C250 R251 | L213-I247 HydrophobicContact CD2-CB 4.41Å; L213-I247 HydrophobicContact CD2-CD1 4.43Å; L213-I247 HydrophobicContact CD2-CG1 3.4Å; L243-I247 HydrophobicContact CD1-CD1 4.19Å; L243-I247 HydrophobicContact CD1-CG1 4.39Å; L243-I247 HydrophobicContact CD2-CD1 4.45Å; L243-I247 HydrophobicContact CG-CD1 3.91Å; L243-I247 HydrophobicContact CG-CG1 4.48Å; L243-I247 WeakPolarHBondContact O-CG1 3.46Å; L243-I247 PolarHBondContact O-N 3.42Å; I247-D249 VanDerWaalsContact C-N 3.35Å; I247-D249 PolarHBondContact O-N 3.4Å; I247-C250 PolarHBondContact O-N 2.96Å; I247-R251 WeakPolarHBondContact O-CG 3.31Å; I247-R251 PolarHBondContact O-N 2.93Å |
| 248 | A | 88.9 | Confident | 83 | Confident | 44 Ų | 44 | 57.4 Ų | 57.4 | 36% | 0.364 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.9 | -43.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | D244 T245 R251 T252 | D244-A248 WeakPolarHBondContact O-CB 3.2Å; D244-A248 PolarHBondContact O-N 3.48Å; T245-A248 PolarHBondContact O-N 2.96Å; A248-R251 PolarHBondContact O-N 2.9Å; A248-T252 WeakPolarHBondContact O-CG2 3.28Å; A248-T252 PolarHBondContact O-N 3.25Å; A248-T252 PolarHBondContact O-OG1 2.91Å |
| 249 | D | 86.7 | Confident | 83.7 | Confident | 8 Ų | 8 | 61.1 Ų | 61.1 | 4% | 0.043 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -69.6 | -39.5 | 179 | -69.6 | -5.6 | 0 | 0 | 0 | 112.4 | F217 H237 T245 L246 I247 R251 T252 M253 | F217-D249 HydrophobicContact CD2-CB 4.15Å; F217-D249 HydrophobicContact CE2-CB 3.63Å; H237-D249 IonicContact CD2-OD2 2.97Å; H237-D249 PolarHBondContact CD2-OD2 3.16Å; H237-D249 IonicContact NE2-OD1 3.98Å; H237-D249 IonicContact NE2-OD2 3.88Å; H237-D249 PolarHBondContact NE2-OD2 3.26Å; T245-D249 WeakPolarHBondContact O-CB 3.21Å; T245-D249 VanDerWaalsContact O-CG 3.3Å; T245-D249 PolarHBondContact O-N 2.97Å; L246-D249 PolarHBondContact O-N 3.26Å; I247-D249 VanDerWaalsContact C-N 3.35Å; I247-D249 PolarHBondContact O-N 3.4Å; D249-R251 VanDerWaalsContact C-N 3.32Å; D249-R251 PolarHBondContact O-N 2.93Å; D249-T252 WeakPolarHBondContact CA-OG1 3.27Å; D249-T252 PolarHBondContact O-N 2.9Å; D249-T252 PolarHBondContact O-OG1 2.85Å; D249-M253 WeakPolarHBondContact O-CB 3.32Å; D249-M253 WeakPolarHBondContact O-CG 3.3Å; D249-M253 PolarHBondContact O-N 2.91Å |
| 250 | C | 88.8 | Confident | 84.1 | Confident | 12 Ų | 12 | 56.5 Ų | 56.5 | 8% | 0.081 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -57.2 | -45.3 | 171.3 | -79.4 | 0 | 0 | 0 | 0 | 111.5 | L213 F217 L220 L246 I247 A254 | L213-C250 HydrophobicContact CD1-CB 4.38Å; F217-C250 VanDerWaalsContact CB-SG 3.55Å; L220-C250 HydrophobicContact CD1-CB 4.23Å; L246-C250 WeakPolarHBondContact O-CB 3.15Å; L246-C250 PolarHBondContact O-N 3.33Å; L246-C250 PolarHBondContact O-SG 3.22Å; L246-C250 VanDerWaalsContact O-SG 3.37Å; I247-C250 PolarHBondContact O-N 2.96Å; C250-A254 VanDerWaalsContact O-CB 3.3Å; C250-A254 WeakPolarHBondContact O-CB 3.37Å; C250-A254 PolarHBondContact O-N 3.5Å |
| 251 | R | 88.4 | Confident | 84.1 | Confident | 167 Ų | 167 | 55.5 Ų | 55.5 | 63% | 0.63 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -62.4 | -50.1 | 177.3 | -74.9 | 179.3 | -179.9 | 170.2 | 1.3 | 111.8 | I247 A248 D249 M253 A254 D255 | I247-R251 WeakPolarHBondContact O-CG 3.31Å; I247-R251 PolarHBondContact O-N 2.93Å; A248-R251 PolarHBondContact O-N 2.9Å; D249-R251 VanDerWaalsContact C-N 3.32Å; D249-R251 PolarHBondContact O-N 2.93Å; R251-M253 VanDerWaalsContact C-N 3.32Å; R251-M253 PolarHBondContact O-N 3.42Å; R251-A254 PolarHBondContact O-N 3.33Å; R251-A254 VanDerWaalsContact O-N 3.17Å; R251-D255 WeakPolarHBondContact O-CB 3.49Å; R251-D255 VanDerWaalsContact O-CG 3.28Å; R251-D255 PolarHBondContact O-N 2.81Å |
| 252 | T | 87.1 | Confident | 83.6 | Confident | 69 Ų | 69 | 57.7 Ų | 57.7 | 42% | 0.423 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -62 | -37.8 | -179.6 | 55.7 | 0 | 0 | 0 | 0 | 112.9 | A248 D249 A256 | A248-T252 WeakPolarHBondContact O-CG2 3.28Å; A248-T252 PolarHBondContact O-N 3.25Å; A248-T252 PolarHBondContact O-OG1 2.91Å; D249-T252 WeakPolarHBondContact CA-OG1 3.27Å; D249-T252 PolarHBondContact O-N 2.9Å; D249-T252 PolarHBondContact O-OG1 2.85Å; T252-A256 WeakPolarHBondContact O-CB 3.5Å; T252-A256 PolarHBondContact O-N 3.36Å |
| 253 | M | 84 | Confident | 82.1 | Confident | 1 Ų | 1 | 60.4 Ų | 60.4 | 1% | 0.005 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -69.6 | -41 | 173.9 | -72.3 | -168.7 | -57.5 | 0 | 0 | 112.5 | F217 L220 K221 L233 T234 D249 R251 A256 L257 | F217-M253 HydrophobicContact CD2-CE 3.07Å; F217-M253 HydrophobicContact CD2-SD 4.44Å; F217-M253 HydrophobicContact CE2-CE 3.12Å; F217-M253 HydrophobicContact CE2-SD 3.96Å; F217-M253 HydrophobicContact CG-CE 3.96Å; F217-M253 HydrophobicContact CZ-CE 4.08Å; L220-M253 HydrophobicContact CB-CB 4.33Å; L220-M253 HydrophobicContact CB-CE 3.68Å; L220-M253 HydrophobicContact CB-SD 4.43Å; L220-M253 HydrophobicContact CD1-CE 4.44Å; K221-M253 HydrophobicContact CB-CE 4.5Å; K221-M253 HydrophobicContact CB-SD 4.06Å; L233-M253 HydrophobicContact CB-CG 4.46Å; T234-M253 HydrophobicContact CG2-SD 4.13Å; D249-M253 WeakPolarHBondContact O-CB 3.32Å; D249-M253 WeakPolarHBondContact O-CG 3.3Å; D249-M253 PolarHBondContact O-N 2.91Å; R251-M253 VanDerWaalsContact C-N 3.32Å; R251-M253 PolarHBondContact O-N 3.42Å; M253-A256 PolarHBondContact O-N 2.88Å; M253-L257 WeakPolarHBondContact O-CB 3.46Å; M253-L257 WeakPolarHBondContact O-CG 3.45Å; M253-L257 PolarHBondContact O-N 2.81Å |
| 254 | A | 87.6 | Confident | 80.3 | Confident | 33 Ų | 33 | 62.8 Ų | 62.8 | 27% | 0.273 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.1 | -46 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | C250 R251 A256 L257 C258 | C250-A254 VanDerWaalsContact O-CB 3.3Å; C250-A254 WeakPolarHBondContact O-CB 3.37Å; C250-A254 PolarHBondContact O-N 3.5Å; R251-A254 PolarHBondContact O-N 3.33Å; R251-A254 VanDerWaalsContact O-N 3.17Å; A254-A256 PolarHBondContact O-N 3.45Å; A254-L257 PolarHBondContact O-N 2.76Å; A254-C258 WeakPolarHBondContact O-CB 3.45Å; A254-C258 PolarHBondContact O-N 3.02Å; A254-C258 PolarHBondContact O-SG 3.44Å |
| 255 | D | 84.9 | Confident | 78.4 | Confident | 100 Ų | 100 | 61.9 Ų | 61.9 | 54% | 0.535 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.2 | -43.4 | 177.3 | -70.2 | -23.1 | 0 | 0 | 0 | 111.6 | R251 C258 L259 | R251-D255 WeakPolarHBondContact O-CB 3.49Å; R251-D255 VanDerWaalsContact O-CG 3.28Å; R251-D255 PolarHBondContact O-N 2.81Å; D255-C258 WeakPolarHBondContact O-CB 3.31Å; D255-C258 PolarHBondContact O-N 2.88Å; D255-L259 WeakPolarHBondContact O-CG 3.5Å; D255-L259 PolarHBondContact O-N 2.93Å |
| 256 | A | 82.8 | Confident | 76.4 | Confident | 22 Ų | 22 | 65.9 Ų | 65.9 | 18% | 0.182 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.7 | -39.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L233 T252 M253 A254 L259 S260 | L233-A256 HydrophobicContact CD1-CB 3.11Å; T252-A256 WeakPolarHBondContact O-CB 3.5Å; T252-A256 PolarHBondContact O-N 3.36Å; M253-A256 PolarHBondContact O-N 2.88Å; A254-A256 PolarHBondContact O-N 3.45Å; A256-L259 PolarHBondContact O-N 2.98Å; A256-S260 PolarHBondContact O-N 3.28Å |
| 257 | L | 82.3 | Confident | 74.7 | Confident | 17 Ų | 17 | 73.2 Ų | 73.2 | 9% | 0.089 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -63.5 | -46.1 | 172.8 | -75.8 | 172.2 | 0 | 0 | 0 | 110.6 | L220 L223 N224 R227 M253 A254 L259 S260 L261 | L220-L257 HydrophobicContact CD2-CD1 3.84Å; L223-L257 HydrophobicContact CB-CD1 4.18Å; N224-L257 HydrophobicContact CB-CD2 4.3Å; R227-L257 HydrophobicContact CB-CD2 4.31Å; M253-L257 WeakPolarHBondContact O-CB 3.46Å; M253-L257 WeakPolarHBondContact O-CG 3.45Å; M253-L257 PolarHBondContact O-N 2.81Å; A254-L257 PolarHBondContact O-N 2.76Å; L257-L259 PolarHBondContact O-N 2.97Å; L257-S260 CarbonylContact O-C 3.55Å; L257-S260 WeakPolarHBondContact O-CA 3.47Å; L257-S260 PolarHBondContact O-N 2.67Å; L257-S260 PolarHBondContact O-OG 3.09Å; L257-L261 WeakPolarHBondContact O-CB 3.24Å; L257-L261 WeakPolarHBondContact O-CD1 3.47Å; L257-L261 WeakPolarHBondContact O-CG 3.37Å; L257-L261 PolarHBondContact O-N 3.27Å |
| 258 | C | 82.7 | Confident | 72.8 | Confident | 66 Ų | 66 | 77.8 Ų | 77.8 | 45% | 0.446 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -56.2 | -46.4 | 174.9 | -75.7 | 0 | 0 | 0 | 0 | 111.9 | A254 D255 S260 L261 S262 | A254-C258 WeakPolarHBondContact O-CB 3.45Å; A254-C258 PolarHBondContact O-N 3.02Å; A254-C258 PolarHBondContact O-SG 3.44Å; D255-C258 WeakPolarHBondContact O-CB 3.31Å; D255-C258 PolarHBondContact O-N 2.88Å; C258-S260 VanDerWaalsContact C-N 3.3Å; C258-S260 PolarHBondContact O-N 2.85Å; C258-L261 CarbonylContact O-C 3.53Å; C258-L261 PolarHBondContact O-N 3.46Å; C258-L261 VanDerWaalsContact O-N 3.11Å; C258-S262 PolarHBondContact O-N 3.24Å; C258-S262 VanDerWaalsContact O-N 3.13Å |
| 259 | L | 78.8 | Confident | 71 | Confident | 129 Ų | 129 | 85.2 Ų | 85.2 | 68% | 0.675 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62 | -36.5 | 174.9 | -70.9 | 173.3 | 0 | 0 | 0 | 111.9 | D255 A256 L257 L261 S262 | D255-L259 WeakPolarHBondContact O-CG 3.5Å; D255-L259 PolarHBondContact O-N 2.93Å; A256-L259 PolarHBondContact O-N 2.98Å; L257-L259 PolarHBondContact O-N 2.97Å; L259-L261 VanDerWaalsContact C-N 3.28Å; L259-L261 PolarHBondContact O-N 3.24Å; L259-S262 VanDerWaalsContact O-CB 3.29Å; L259-S262 WeakPolarHBondContact O-CB 3.47Å; L259-S262 PolarHBondContact O-N 3.34Å; L259-S262 PolarHBondContact O-OG 3.37Å |
| 260 | S | 75 | Confident | 69.3 | Low | 31 Ų | 31 | 87.5 Ų | 87.5 | 22% | 0.217 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -74.9 | -16.1 | 176.1 | 79.1 | 0 | 0 | 0 | 0 | 114.4 | R227 A256 L257 C258 | R227-S260 PolarHBondContact NH2-O 2.79Å; A256-S260 PolarHBondContact O-N 3.28Å; L257-S260 CarbonylContact O-C 3.55Å; L257-S260 WeakPolarHBondContact O-CA 3.47Å; L257-S260 PolarHBondContact O-N 2.67Å; L257-S260 PolarHBondContact O-OG 3.09Å; C258-S260 VanDerWaalsContact C-N 3.3Å; C258-S260 PolarHBondContact O-N 2.85Å |
| 261 | L | 71.8 | Confident | 67.7 | Low | 91 Ų | 91 | 94.3 Ų | 94.3 | 48% | 0.476 | 55% | 0.549 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | -0.6 | 177.8 | -77.3 | 155.1 | 0 | 0 | 0 | 112.6 | L257 C258 L259 S263 C264 | L257-L261 WeakPolarHBondContact O-CB 3.24Å; L257-L261 WeakPolarHBondContact O-CD1 3.47Å; L257-L261 WeakPolarHBondContact O-CG 3.37Å; L257-L261 PolarHBondContact O-N 3.27Å; C258-L261 CarbonylContact O-C 3.53Å; C258-L261 PolarHBondContact O-N 3.46Å; C258-L261 VanDerWaalsContact O-N 3.11Å; L259-L261 VanDerWaalsContact C-N 3.28Å; L259-L261 PolarHBondContact O-N 3.24Å; L261-S263 CarbonylContact O-C 3.57Å; L261-S263 WeakPolarHBondContact O-CA 3.46Å; L261-S263 PolarHBondContact O-N 3.01Å; L261-S263 PolarHBondContact O-OG 3.47Å; L261-C264 PolarHBondContact O-N 3.22Å |
| 262 | S | 60.9 | Low | 66.2 | Low | 87 Ų | 87 | 91.7 Ų | 91.7 | 61% | 0.608 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | 24.9 | -169.2 | 60.9 | 0 | 0 | 0 | 0 | 117.1 | C258 L259 | C258-S262 PolarHBondContact O-N 3.24Å; C258-S262 VanDerWaalsContact O-N 3.13Å; L259-S262 VanDerWaalsContact O-CB 3.29Å; L259-S262 WeakPolarHBondContact O-CB 3.47Å; L259-S262 PolarHBondContact O-N 3.34Å; L259-S262 PolarHBondContact O-OG 3.37Å |
| 263 | S | 53.6 | Low | 65.1 | Low | 124 Ų | 124 | 94.6 Ų | 94.6 | 87% | 0.867 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | -2.7 | 138.3 | 50.2 | 0 | 0 | 0 | 0 | 113.5 | L261 | L261-S263 CarbonylContact O-C 3.57Å; L261-S263 WeakPolarHBondContact O-CA 3.46Å; L261-S263 PolarHBondContact O-N 3.01Å; L261-S263 PolarHBondContact O-OG 3.47Å |
| 264 | C | 49.5 | Very low | 64.2 | Low | 101 Ų | 101 | 103.1 Ų | 103.1 | 68% | 0.682 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -102.9 | 95.8 | 177.1 | -151.8 | 0 | 0 | 0 | 0 | 110.9 | L261 | L261-C264 PolarHBondContact O-N 3.22Š|
| 265 | S | 48.1 | Very low | 63.5 | Low | 100 Ų | 100 | 109.7 Ų | 109.7 | 70% | 0.699 | 63% | 0.632 | S | S | * | * | trans | -60.1 | 129.7 | 170.4 | 45.8 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 266 | T | 43.3 | Very low | 63.3 | Low | 128 Ų | 128 | 110 Ų | 110 | 79% | 0.785 | 64% | 0.642 | S | S | * | * | trans | 55.8 | 84 | 155.6 | 61.6 | 0 | 0 | 0 | 0 | 115.8 | D268 | T266-D268 PolarHBondContact O-N 2.84Š| ||
| 267 | L | 52.2 | Low | 63.2 | Low | 153 Ų | 153 | 114 Ų | 114 | 80% | 0.801 | 65% | 0.653 | S | S | * | * | trans | -68.7 | 111.4 | 149.6 | -73.6 | 173.1 | 0 | 0 | 0 | 107 | E269 | L267-E269 PolarHBondContact O-N 3.02Å; L267-E269 VanDerWaalsContact O-N 3.17Å | ||
| 268 | D | 50.6 | Low | 63.5 | Low | 151 Ų | 151 | 114.5 Ų | 114.5 | 81% | 0.807 | 66% | 0.656 | S | S | * | * | trans | -52 | 107.7 | -179.7 | -155.9 | 14.8 | 0 | 0 | 0 | 110.6 | T266 G270 | T266-D268 PolarHBondContact O-N 2.84Å; D268-G270 PolarHBondContact O-N 3.48Å | ||
| 269 | E | 51.5 | Low | 63.7 | Low | 200 Ų | 200 | 117 Ų | 117 | 94% | 0.935 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.1 | 83.2 | 166.3 | -76.1 | -165.3 | 149.3 | 0 | 0 | 108 | L267 | L267-E269 PolarHBondContact O-N 3.02Å; L267-E269 VanDerWaalsContact O-N 3.17Å |
| 270 | G | 51.4 | Low | 64.1 | Low | 56 Ų | 56 | 111.7 Ų | 111.7 | 58% | 0.577 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -155.6 | -21 | -172.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | D268 S272 | D268-G270 PolarHBondContact O-N 3.48Å; G270-S272 PolarHBondContact O-N 3.49Å |
| 271 | D | 55.4 | Low | 64.8 | Low | 154 Ų | 154 | 112.3 Ų | 112.3 | 82% | 0.824 | 64% | 0.638 | S | S | * | * | trans | -85 | 102.3 | -179.3 | -118.6 | -3.9 | 0 | 0 | 0 | 110.1 | V273 | D271-V273 PolarHBondContact O-N 2.85Š| ||
| 272 | S | 56.6 | Low | 65.7 | Low | 113 Ų | 113 | 113.5 Ų | 113.5 | 79% | 0.79 | 64% | 0.639 | S | S | * | * | trans | -66 | 84 | 169.5 | 55.9 | 0 | 0 | 0 | 0 | 109.1 | G270 Q274 | G270-S272 PolarHBondContact O-N 3.49Å; S272-Q274 VanDerWaalsContact C-N 3.3Å; S272-Q274 PolarHBondContact O-N 3.37Å | ||
| 273 | V | 63.3 | Low | 67.1 | Low | 129 Ų | 129 | 113.9 Ų | 113.9 | 78% | 0.782 | 63% | 0.634 | S | S | * | * | trans | -64.8 | 95.9 | 173.7 | -179 | 0 | 0 | 0 | 0 | 107.6 | D271 R275 | D271-V273 PolarHBondContact O-N 2.85Å; V273-R275 PolarHBondContact O-N 2.77Å | ||
| 274 | Q | 66.7 | Low | 68.8 | Low | 180 Ų | 180 | 109.2 Ų | 109.2 | 84% | 0.841 | 60% | 0.603 | S | S | * | * | trans | -64.9 | 121.1 | 173.9 | -171.2 | 165.4 | -14.6 | 0 | 0 | 108 | S272 S276 | S272-Q274 VanDerWaalsContact C-N 3.3Å; S272-Q274 PolarHBondContact O-N 3.37Å; Q274-S276 PolarHBondContact O-N 2.94Å | ||
| 275 | R | 72.6 | Confident | 70.7 | Confident | 171 Ų | 171 | 108 Ų | 108 | 65% | 0.645 | 59% | 0.589 | S | S | * | * | trans | -55.6 | 110.7 | 178.4 | -177.5 | 179.1 | 179 | 179.5 | -0.5 | 109.4 | V273 E281 | V273-R275 PolarHBondContact O-N 2.77Å; R275-E281 IonicContact CZ-OE1 2.99Å; R275-E281 IonicContact NH2-OE1 2.85Å; R275-E281 PolarHBondContact NH2-OE1 3.35Å | ||
| 276 | S | 79.8 | Confident | 72.6 | Confident | 106 Ų | 106 | 109.2 Ų | 109.2 | 74% | 0.741 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -86 | 120.5 | 168.9 | 51.6 | 0 | 0 | 0 | 0 | 108.6 | Q274 | Q274-S276 PolarHBondContact O-N 2.94Š|
| 277 | Y | 82.3 | Confident | 74.8 | Confident | 108 Ų | 108 | 104.4 Ų | 104.4 | 42% | 0.424 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -67.3 | 138.3 | 174.7 | -67.7 | -78.1 | 0 | 0 | 0 | 110.6 | E281 K282 L285 | Y277-E281 WeakPolarHBondContact CA-OE2 3.32Å; Y277-E281 HydrophobicContact CD1-CB 4.04Å; Y277-E281 WeakPolarHBondContact CD1-OE2 3.4Å; Y277-K282 VanDerWaalsContact O-CE 3.31Å; Y277-K282 WeakPolarHBondContact O-CE 3.42Å; Y277-L285 HydrophobicContact CD1-CD1 4.22Å; Y277-L285 HydrophobicContact CE1-CD1 4.15Å; Y277-L285 HydrophobicContact CE2-CD1 4.47Å; Y277-L285 HydrophobicContact CG-CD1 4.4Å |
| 278 | T | 86.8 | Confident | 76.3 | Confident | 26 Ų | 26 | 101 Ų | 101 | 16% | 0.16 | 55% | 0.547 | C | S | . | . | P | Polyproline II helix | trans | -63.9 | 163 | 170.6 | 75 | 0 | 0 | 0 | 0 | 110.1 | E205 Y209 T280 E281 K282 | E205-T278 WeakPolarHBondContact OE2-CB 3.39Å; E205-T278 PolarHBondContact OE2-OG1 3.18Å; Y209-T278 HydrophobicContact CE2-CG2 4.21Å; Y209-T278 WeakPolarHBondContact OH-CG2 3.33Å; T278-T280 PolarHBondContact O-N 2.85Å; T278-T280 PolarHBondContact OG1-OG1 3.39Å; T278-E281 PolarHBondContact N-OE2 2.79Å; T278-E281 PolarHBondContact O-N 3.12Å; T278-E281 WeakPolarHBondContact OG1-CG 3.32Å; T278-E281 PolarHBondContact OG1-N 2.82Å; T278-E281 VanDerWaalsContact OG1-N 3.14Å; T278-K282 WeakPolarHBondContact O-CG 3.48Å; T278-K282 PolarHBondContact O-N 3.5Å |
| 279 | N | 87.1 | Confident | 78 | Confident | 119 Ų | 119 | 100.7 Ų | 100.7 | 64% | 0.636 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.5 | -34.8 | 180 | -71.2 | -32.4 | 0 | 0 | 0 | 111.3 | K282 L283 | N279-K282 PolarHBondContact O-N 3.46Å; N279-L283 WeakPolarHBondContact O-CG 3.4Å; N279-L283 PolarHBondContact O-N 2.85Å; N279-L283 VanDerWaalsContact O-N 3.08Å |
| 280 | T | 88.3 | Confident | 79.4 | Confident | 17 Ų | 17 | 94.9 Ų | 94.9 | 10% | 0.104 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -70.4 | -38.8 | 174.8 | 66.5 | 0 | 0 | 0 | 0 | 111.7 | L202 E205 T278 K282 L283 A284 | L202-T280 WeakPolarHBondContact CD2-OG1 3.13Å; E205-T280 VanDerWaalsContact CD-CG2 3.48Å; E205-T280 HydrophobicContact CG-CG2 4.08Å; E205-T280 WeakPolarHBondContact OE1-CG2 3.49Å; E205-T280 PolarHBondContact OE1-OG1 2.92Å; E205-T280 PolarHBondContact OE2-OG1 3.35Å; T278-T280 PolarHBondContact O-N 2.85Å; T278-T280 PolarHBondContact OG1-OG1 3.39Å; T280-K282 VanDerWaalsContact C-N 3.31Å; T280-K282 PolarHBondContact O-N 2.99Å; T280-L283 CarbonylContact O-C 3.57Å; T280-L283 WeakPolarHBondContact O-CB 3.38Å; T280-L283 PolarHBondContact O-N 2.97Å; T280-L283 VanDerWaalsContact O-N 3.12Å; T280-A284 WeakPolarHBondContact O-CB 3.44Å; T280-A284 PolarHBondContact O-N 3.23Å |
| 281 | E | 90 | Very high | 80.3 | Confident | 45 Ų | 45 | 99.3 Ų | 99.3 | 21% | 0.21 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -61.4 | -40.1 | 174.3 | -77.4 | -179.4 | 140.5 | 0 | 0 | 111.2 | L202 R275 Y277 T278 L283 A284 L285 | L202-E281 HydrophobicContact CD2-CG 4.03Å; R275-E281 IonicContact CZ-OE1 2.99Å; R275-E281 IonicContact NH2-OE1 2.85Å; R275-E281 PolarHBondContact NH2-OE1 3.35Å; Y277-E281 WeakPolarHBondContact CA-OE2 3.32Å; Y277-E281 HydrophobicContact CD1-CB 4.04Å; Y277-E281 WeakPolarHBondContact CD1-OE2 3.4Å; T278-E281 PolarHBondContact N-OE2 2.79Å; T278-E281 PolarHBondContact O-N 3.12Å; T278-E281 WeakPolarHBondContact OG1-CG 3.32Å; T278-E281 PolarHBondContact OG1-N 2.82Å; T278-E281 VanDerWaalsContact OG1-N 3.14Å; E281-L283 VanDerWaalsContact C-N 3.35Å; E281-A284 WeakPolarHBondContact O-CB 3.39Å; E281-A284 PolarHBondContact O-N 3.4Å; E281-L285 WeakPolarHBondContact O-CG 3.44Å; E281-L285 PolarHBondContact O-N 2.98Å |
| 282 | K | 90.3 | Very high | 80.9 | Confident | 115 Ų | 115 | 94.3 Ų | 94.3 | 50% | 0.5 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 173.7 | -69.9 | 172 | -173.2 | 164.3 | 0 | 112 | Y277 T278 N279 T280 K286 | Y277-K282 VanDerWaalsContact O-CE 3.31Å; Y277-K282 WeakPolarHBondContact O-CE 3.42Å; T278-K282 WeakPolarHBondContact O-CG 3.48Å; T278-K282 PolarHBondContact O-N 3.5Å; N279-K282 PolarHBondContact O-N 3.46Å; T280-K282 VanDerWaalsContact C-N 3.31Å; T280-K282 PolarHBondContact O-N 2.99Å; K282-K286 WeakPolarHBondContact O-CB 3.35Å; K282-K286 PolarHBondContact O-N 3.41Å |
| 283 | L | 89.4 | Confident | 81.3 | Confident | 96 Ų | 96 | 97.7 Ų | 97.7 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.2 | -38.6 | 174.6 | -71.9 | 171.7 | 0 | 0 | 0 | 111.5 | V198 N279 T280 E281 K286 V287 | V198-L283 HydrophobicContact CG2-CB 4.22Å; N279-L283 WeakPolarHBondContact O-CG 3.4Å; N279-L283 PolarHBondContact O-N 2.85Å; N279-L283 VanDerWaalsContact O-N 3.08Å; T280-L283 CarbonylContact O-C 3.57Å; T280-L283 WeakPolarHBondContact O-CB 3.38Å; T280-L283 PolarHBondContact O-N 2.97Å; T280-L283 VanDerWaalsContact O-N 3.12Å; E281-L283 VanDerWaalsContact C-N 3.35Å; L283-K286 WeakPolarHBondContact O-CB 3.36Å; L283-K286 PolarHBondContact O-N 3.44Å; L283-V287 WeakPolarHBondContact O-CG2 3.36Å; L283-V287 PolarHBondContact O-N 3.05Å |
| 284 | A | 90.1 | Very high | 81.3 | Confident | 26 Ų | 26 | 94.5 Ų | 94.5 | 22% | 0.215 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -62.8 | -45.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | V198 L202 T280 E281 K286 V287 A288 | V198-A284 HydrophobicContact CG1-CB 3.5Å; L202-A284 HydrophobicContact CD1-CB 3.96Å; T280-A284 WeakPolarHBondContact O-CB 3.44Å; T280-A284 PolarHBondContact O-N 3.23Å; E281-A284 WeakPolarHBondContact O-CB 3.39Å; E281-A284 PolarHBondContact O-N 3.4Å; A284-K286 VanDerWaalsContact C-N 3.28Å; A284-K286 PolarHBondContact O-N 2.92Å; A284-V287 PolarHBondContact O-N 3.44Å; A284-A288 VanDerWaalsContact O-CB 3.25Å; A284-A288 WeakPolarHBondContact O-CB 3.3Å; A284-A288 PolarHBondContact O-N 2.96Å |
| 285 | L | 88.6 | Confident | 81.1 | Confident | 75 Ų | 75 | 89.1 Ų | 89.1 | 39% | 0.393 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -60.5 | -40.2 | 173.8 | -72.7 | 172.7 | 0 | 0 | 0 | 111.4 | Y277 E281 A288 Q289 | Y277-L285 HydrophobicContact CD1-CD1 4.22Å; Y277-L285 HydrophobicContact CE1-CD1 4.15Å; Y277-L285 HydrophobicContact CE2-CD1 4.47Å; Y277-L285 HydrophobicContact CG-CD1 4.4Å; E281-L285 WeakPolarHBondContact O-CG 3.44Å; E281-L285 PolarHBondContact O-N 2.98Å; L285-A288 PolarHBondContact O-N 2.99Å; L285-Q289 WeakPolarHBondContact O-CB 3.33Å; L285-Q289 WeakPolarHBondContact O-CG 3.43Å; L285-Q289 PolarHBondContact O-N 2.94Å |
| 286 | K | 89.6 | Confident | 80.9 | Confident | 126 Ų | 126 | 87 Ų | 87 | 55% | 0.548 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.2 | -48.5 | 177.4 | -170.8 | 176.8 | -179.6 | 179.5 | 0 | 112.1 | K282 L283 A284 A288 Q289 D290 | K282-K286 WeakPolarHBondContact O-CB 3.35Å; K282-K286 PolarHBondContact O-N 3.41Å; L283-K286 WeakPolarHBondContact O-CB 3.36Å; L283-K286 PolarHBondContact O-N 3.44Å; A284-K286 VanDerWaalsContact C-N 3.28Å; A284-K286 PolarHBondContact O-N 2.92Å; K286-A288 VanDerWaalsContact C-N 3.26Å; K286-A288 PolarHBondContact O-N 2.98Å; K286-Q289 PolarHBondContact O-N 3.44Å; K286-Q289 VanDerWaalsContact O-N 3.17Å; K286-D290 VanDerWaalsContact O-CG 3.32Å; K286-D290 PolarHBondContact O-N 3.48Å |
| 287 | V | 88.3 | Confident | 80.5 | Confident | 26 Ų | 26 | 86.2 Ų | 86.2 | 16% | 0.158 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -64.4 | -33.5 | 178.6 | 174.3 | 0 | 0 | 0 | 0 | 111.6 | K194 A195 V198 L283 A284 | K194-V287 HydrophobicContact CB-CG2 4.38Å; A195-V287 HydrophobicContact CB-CG1 3.95Å; V198-V287 HydrophobicContact CG2-CG2 4.04Å; L283-V287 WeakPolarHBondContact O-CG2 3.36Å; L283-V287 PolarHBondContact O-N 3.05Å; A284-V287 PolarHBondContact O-N 3.44Å |
| 288 | A | 84.4 | Confident | 80.1 | Confident | 83 Ų | 83 | 87 Ų | 87 | 69% | 0.686 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -73.4 | -26.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | A284 L285 K286 | A284-A288 VanDerWaalsContact O-CB 3.25Å; A284-A288 WeakPolarHBondContact O-CB 3.3Å; A284-A288 PolarHBondContact O-N 2.96Å; L285-A288 PolarHBondContact O-N 2.99Å; K286-A288 VanDerWaalsContact C-N 3.26Å; K286-A288 PolarHBondContact O-N 2.98Å |
| 289 | Q | 85.5 | Confident | 79.6 | Confident | 144 Ų | 144 | 86.7 Ų | 86.7 | 67% | 0.673 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -91.3 | -15.7 | 178.5 | -73.9 | 174.8 | -5.6 | 0 | 0 | 113.6 | L285 K286 D291 | L285-Q289 WeakPolarHBondContact O-CB 3.33Å; L285-Q289 WeakPolarHBondContact O-CG 3.43Å; L285-Q289 PolarHBondContact O-N 2.94Å; K286-Q289 PolarHBondContact O-N 3.44Å; K286-Q289 VanDerWaalsContact O-N 3.17Å; Q289-D291 VanDerWaalsContact C-N 3.3Å; Q289-D291 PolarHBondContact O-N 3.07Å |
| 290 | D | 80.7 | Confident | 79 | Confident | 77 Ų | 77 | 83 Ų | 83 | 41% | 0.412 | 44% | 0.443 | S | S | . | . | trans | -67.4 | 88.8 | 176.2 | -80.5 | -10.2 | 0 | 0 | 0 | 109.2 | Q191 K286 I292 | Q191-D290 PolarHBondContact NE2-O 2.94Å; K286-D290 VanDerWaalsContact O-CG 3.32Å; K286-D290 PolarHBondContact O-N 3.48Å; D290-I292 PolarHBondContact O-N 3.46Å | ||
| 291 | D | 71.1 | Confident | 78.4 | Confident | 150 Ų | 150 | 85 Ų | 85 | 80% | 0.802 | 46% | 0.461 | S | S | * | . | trans | -61.4 | 116.4 | 169.2 | -83.9 | -24.2 | 0 | 0 | 0 | 108.8 | Q289 Q293 | Q289-D291 VanDerWaalsContact C-N 3.3Å; Q289-D291 PolarHBondContact O-N 3.07Å; D291-Q293 PolarHBondContact O-N 2.87Å | ||
| 292 | I | 66.9 | Low | 77.5 | Confident | 48 Ų | 48 | 86.6 Ų | 86.6 | 25% | 0.246 | 47% | 0.471 | C | S | . | . | trans | -72.6 | 104.7 | 173 | -41.7 | 170.8 | 0 | 0 | 0 | 107.7 | C187 L188 Q191 D290 M294 | C187-I292 VanDerWaalsContact SG-CG2 3.54Å; L188-I292 HydrophobicContact CD2-CD1 3.3Å; L188-I292 HydrophobicContact CG-CD1 4.17Å; Q191-I292 HydrophobicContact CB-CD1 4.23Å; Q191-I292 HydrophobicContact CG-CD1 4.37Å; Q191-I292 HydrophobicContact CG-CG1 4.39Å; Q191-I292 VanDerWaalsContact NE2-CG1 3.26Å; Q191-I292 VanDerWaalsContact OE1-CG1 3.27Å; D290-I292 PolarHBondContact O-N 3.46Å; I292-M294 HydrophobicContact CB-CG 3.84Å; I292-M294 HydrophobicContact CD1-CG 4.47Å; I292-M294 HydrophobicContact CG2-CB 4.27Å; I292-M294 HydrophobicContact CG2-CG 3.33Å; I292-M294 PolarHBondContact O-N 3.38Å | ||
| 293 | Q | 66.6 | Low | 76.6 | Confident | 185 Ų | 185 | 83.6 Ų | 83.6 | 86% | 0.864 | 46% | 0.46 | S | S | * | . | trans | -70 | 78.3 | 160.1 | -66.5 | -170.6 | -8.1 | 0 | 0 | 108.2 | D291 F295 | D291-Q293 PolarHBondContact O-N 2.87Å; Q293-F295 VanDerWaalsContact C-N 3.28Å; Q293-F295 PolarHBondContact O-N 3.29Å | ||
| 294 | M | 61.7 | Low | 75.8 | Confident | 61 Ų | 61 | 83 Ų | 83 | 30% | 0.3 | 46% | 0.464 | S | S | . | . | trans | -70.1 | -26.5 | -175 | -86.5 | -177.4 | 67.3 | 0 | 0 | 113.1 | S184 L188 I292 | S184-M294 WeakPolarHBondContact OG-CE 3.45Å; S184-M294 PolarHBondContact OG-O 2.07Å; L188-M294 HydrophobicContact CD1-CE 3.19Å; L188-M294 HydrophobicContact CD1-SD 3.62Å; L188-M294 HydrophobicContact CD2-CE 4.4Å; L188-M294 HydrophobicContact CD2-SD 3.69Å; L188-M294 HydrophobicContact CG-CE 3.71Å; L188-M294 HydrophobicContact CG-CG 4.41Å; L188-M294 HydrophobicContact CG-SD 3.59Å; L188-M294 VanDerWaalsContact CG-SD 3.59Å; I292-M294 HydrophobicContact CB-CG 3.84Å; I292-M294 HydrophobicContact CD1-CG 4.47Å; I292-M294 HydrophobicContact CG2-CB 4.27Å; I292-M294 HydrophobicContact CG2-CG 3.33Å; I292-M294 PolarHBondContact O-N 3.38Å | ||
| 295 | F | 63.8 | Low | 75 | Confident | 68 Ų | 68 | 85.7 Ų | 85.7 | 30% | 0.298 | 49% | 0.486 | S | S | . | . | S | Bend | trans | -145.2 | 140.2 | -173.6 | -59.5 | -60.3 | 0 | 0 | 0 | 110.3 | S184 Q293 F299 A300 L303 | S184-F295 WeakPolarHBondContact OG-CE1 3.32Å; S184-F295 VanDerWaalsContact OG-CZ 3.25Å; S184-F295 WeakPolarHBondContact OG-CZ 3.31Å; Q293-F295 VanDerWaalsContact C-N 3.28Å; Q293-F295 PolarHBondContact O-N 3.29Å; F295-F299 HydrophobicContact CB-CB 4.41Å; F295-F299 HydrophobicContact CB-CD1 4.2Å; F295-F299 AromaticContact CD1-CD1 3.1Å; F295-F299 HydrophobicContact CD1-CD1 3.1Å; F295-F299 AromaticContact CD1-CE1 3.46Å; F295-F299 HydrophobicContact CD1-CE1 3.46Å; F295-F299 VanDerWaalsContact CD1-CE1 3.46Å; F295-F299 HydrophobicContact CD1-CG 4.15Å; F295-F299 AromaticContact CE1-CD1 3.55Å; F295-F299 HydrophobicContact CE1-CD1 3.55Å; F295-F299 AromaticContact CE1-CE1 3.34Å; F295-F299 HydrophobicContact CE1-CE1 3.34Å; F295-F299 AromaticContact CG-CD1 3.78Å; F295-F299 HydrophobicContact CG-CD1 3.78Å; F295-F299 HydrophobicContact CG-CE1 4.41Å; F295-F299 HydrophobicContact CZ-CE1 4.24Å; F295-A300 HydrophobicContact CB-CB 4.33Å; F295-L303 HydrophobicContact CZ-CD1 4.42Å |
| 296 | D | 68.3 | Low | 74.1 | Confident | 126 Ų | 126 | 87.3 Ų | 87.3 | 67% | 0.674 | 49% | 0.494 | S | S | * | . | trans | -61.3 | 144.6 | 159.3 | -149.7 | -16.8 | 0 | 0 | 0 | 108.4 | D298 F299 A300 | D296-D298 PolarHBondContact O-N 3.01Å; D296-F299 PolarHBondContact O-N 2.94Å; D296-A300 PolarHBondContact O-N 3.25Å | ||
| 297 | S | 71.4 | Confident | 72.8 | Confident | 90 Ų | 90 | 83 Ų | 83 | 63% | 0.629 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -51.9 | -33.5 | -175.4 | -178.5 | 0 | 0 | 0 | 0 | 111.6 | A301 | S297-A301 PolarHBondContact O-N 3.29Å; S297-A301 VanDerWaalsContact O-N 3.09Å |
| 298 | D | 74.3 | Confident | 70.7 | Confident | 124 Ų | 124 | 84 Ų | 84 | 66% | 0.663 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -69.7 | -35.7 | -179.6 | -66.1 | -9.1 | 0 | 0 | 0 | 112.9 | D296 A301 L302 | D296-D298 PolarHBondContact O-N 3.01Å; D298-A301 PolarHBondContact O-N 3.25Å; D298-L302 WeakPolarHBondContact O-CB 3.44Å; D298-L302 PolarHBondContact O-N 3.04Å |
| 299 | F | 75 | Confident | 68.8 | Low | 19 Ų | 19 | 89.5 Ų | 89.5 | 8% | 0.083 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -73.3 | -37.9 | 178 | -173.4 | -95.7 | 0 | 0 | 0 | 111.7 | I177 Q180 L181 F295 D296 A301 L302 L303 | I177-F299 HydrophobicContact CB-CE2 4.41Å; I177-F299 HydrophobicContact CG1-CE2 4.16Å; I177-F299 HydrophobicContact CG2-CE2 4.49Å; I177-F299 HydrophobicContact CG2-CZ 4.18Å; Q180-F299 HydrophobicContact CB-CD1 4.5Å; Q180-F299 HydrophobicContact CB-CD2 3.96Å; Q180-F299 HydrophobicContact CB-CE1 3.93Å; Q180-F299 HydrophobicContact CB-CE2 3.38Å; Q180-F299 HydrophobicContact CB-CG 4.48Å; Q180-F299 HydrophobicContact CB-CZ 3.34Å; Q180-F299 HydrophobicContact CG-CD2 3.94Å; Q180-F299 HydrophobicContact CG-CE2 3.71Å; Q180-F299 HydrophobicContact CG-CZ 4.2Å; L181-F299 HydrophobicContact CG-CZ 4.42Å; F295-F299 HydrophobicContact CB-CB 4.41Å; F295-F299 HydrophobicContact CB-CD1 4.2Å; F295-F299 AromaticContact CD1-CD1 3.1Å; F295-F299 HydrophobicContact CD1-CD1 3.1Å; F295-F299 AromaticContact CD1-CE1 3.46Å; F295-F299 HydrophobicContact CD1-CE1 3.46Å; F295-F299 VanDerWaalsContact CD1-CE1 3.46Å; F295-F299 HydrophobicContact CD1-CG 4.15Å; F295-F299 AromaticContact CE1-CD1 3.55Å; F295-F299 HydrophobicContact CE1-CD1 3.55Å; F295-F299 AromaticContact CE1-CE1 3.34Å; F295-F299 HydrophobicContact CE1-CE1 3.34Å; F295-F299 AromaticContact CG-CD1 3.78Å; F295-F299 HydrophobicContact CG-CD1 3.78Å; F295-F299 HydrophobicContact CG-CE1 4.41Å; F295-F299 HydrophobicContact CZ-CE1 4.24Å; D296-F299 PolarHBondContact O-N 2.94Å; F299-A301 VanDerWaalsContact C-N 3.32Å; F299-A301 PolarHBondContact O-N 3.33Å; F299-L302 HydrophobicContact CD2-CD2 4.34Å; F299-L302 WeakPolarHBondContact O-CB 3.42Å; F299-L302 PolarHBondContact O-N 3.06Å; F299-L303 HydrophobicContact CD1-CD1 3.8Å; F299-L303 HydrophobicContact CD1-CG 4.04Å; F299-L303 HydrophobicContact CE1-CD1 3.29Å; F299-L303 HydrophobicContact CE1-CD2 4.23Å; F299-L303 HydrophobicContact CE1-CG 3.63Å; F299-L303 HydrophobicContact CZ-CD1 4.01Å; F299-L303 HydrophobicContact CZ-CD2 4.12Å; F299-L303 HydrophobicContact CZ-CG 3.96Å; F299-L303 PolarHBondContact O-N 2.95Å |
| 300 | A | 73.9 | Confident | 66.8 | Low | 41 Ų | 41 | 89.4 Ų | 89.4 | 34% | 0.339 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.9 | -40.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | F295 D296 S304 | F295-A300 HydrophobicContact CB-CB 4.33Å; D296-A300 PolarHBondContact O-N 3.25Å; A300-S304 WeakPolarHBondContact O-CB 3.38Å; A300-S304 PolarHBondContact O-N 3.44Å; A300-S304 PolarHBondContact O-OG 3.45Å |
| 301 | A | 76.1 | Confident | 64.8 | Low | 59 Ų | 59 | 93.2 Ų | 93.2 | 49% | 0.488 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | S297 D298 F299 S304 A305 | S297-A301 PolarHBondContact O-N 3.29Å; S297-A301 VanDerWaalsContact O-N 3.09Å; D298-A301 PolarHBondContact O-N 3.25Å; F299-A301 VanDerWaalsContact C-N 3.32Å; F299-A301 PolarHBondContact O-N 3.33Å; A301-S304 WeakPolarHBondContact O-CB 3.35Å; A301-S304 PolarHBondContact O-N 3.17Å; A301-A305 WeakPolarHBondContact O-CB 3.39Å; A301-A305 PolarHBondContact O-N 2.83Å |
| 302 | L | 71.8 | Confident | 63.6 | Low | 80 Ų | 80 | 96.7 Ų | 96.7 | 42% | 0.419 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60.5 | -48.3 | 176.2 | -175.6 | 77.4 | 0 | 0 | 0 | 111.7 | I177 D298 F299 S304 A305 I306 | I177-L302 HydrophobicContact CD1-CD2 4.3Å; I177-L302 HydrophobicContact CG1-CD2 4.06Å; D298-L302 WeakPolarHBondContact O-CB 3.44Å; D298-L302 PolarHBondContact O-N 3.04Å; F299-L302 HydrophobicContact CD2-CD2 4.34Å; F299-L302 WeakPolarHBondContact O-CB 3.42Å; F299-L302 PolarHBondContact O-N 3.06Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.35Å; L302-A305 PolarHBondContact O-N 3.31Å; L302-I306 HydrophobicContact CD1-CD1 4.36Å; L302-I306 HydrophobicContact CD2-CD1 4.39Å; L302-I306 HydrophobicContact CG-CD1 3.93Å; L302-I306 WeakPolarHBondContact O-CG1 3.45Å; L302-I306 PolarHBondContact O-N 3.05Å |
| 303 | L | 72.2 | Confident | 62 | Low | 51 Ų | 51 | 98.7 Ų | 98.7 | 27% | 0.267 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -61.4 | -39.2 | 176 | -77.8 | -177 | 0 | 0 | 0 | 111.8 | I177 L181 F295 F299 A305 I306 G307 | I177-L303 HydrophobicContact CG2-CD2 4Å; L181-L303 HydrophobicContact CD2-CD1 4.27Å; F295-L303 HydrophobicContact CZ-CD1 4.42Å; F299-L303 HydrophobicContact CD1-CD1 3.8Å; F299-L303 HydrophobicContact CD1-CG 4.04Å; F299-L303 HydrophobicContact CE1-CD1 3.29Å; F299-L303 HydrophobicContact CE1-CD2 4.23Å; F299-L303 HydrophobicContact CE1-CG 3.63Å; F299-L303 HydrophobicContact CZ-CD1 4.01Å; F299-L303 HydrophobicContact CZ-CD2 4.12Å; F299-L303 HydrophobicContact CZ-CG 3.96Å; F299-L303 PolarHBondContact O-N 2.95Å; L303-A305 VanDerWaalsContact C-N 3.31Å; L303-A305 PolarHBondContact O-N 2.83Å; L303-I306 PolarHBondContact O-N 3.43Å; L303-G307 WeakPolarHBondContact O-CA 3.49Å; L303-G307 PolarHBondContact O-N 2.96Å |
| 304 | S | 72.4 | Confident | 60.5 | Low | 84 Ų | 84 | 93 Ų | 93 | 59% | 0.587 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.5 | -38.5 | 176 | -60.3 | 0 | 0 | 0 | 0 | 111.8 | A300 A301 L302 G308 | A300-S304 WeakPolarHBondContact O-CB 3.38Å; A300-S304 PolarHBondContact O-N 3.44Å; A300-S304 PolarHBondContact O-OG 3.45Å; A301-S304 WeakPolarHBondContact O-CB 3.35Å; A301-S304 PolarHBondContact O-N 3.17Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.35Å; S304-G308 PolarHBondContact O-N 3.31Å |
| 305 | A | 73.4 | Confident | 59.2 | Low | 83 Ų | 83 | 95.5 Ų | 95.5 | 69% | 0.686 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -70.4 | -37.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A301 L302 L303 | A301-A305 WeakPolarHBondContact O-CB 3.39Å; A301-A305 PolarHBondContact O-N 2.83Å; L302-A305 PolarHBondContact O-N 3.31Å; L303-A305 VanDerWaalsContact C-N 3.31Å; L303-A305 PolarHBondContact O-N 2.83Å |
| 306 | I | 69.6 | Low | 57.8 | Low | 108 Ų | 108 | 100.9 Ų | 100.9 | 55% | 0.554 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -75.4 | -40.6 | 177.4 | -65.6 | 170.2 | 0 | 0 | 0 | 111 | I177 L302 L303 | I177-I306 HydrophobicContact CD1-CD1 3.33Å; I177-I306 HydrophobicContact CG1-CD1 4.46Å; L302-I306 HydrophobicContact CD1-CD1 4.36Å; L302-I306 HydrophobicContact CD2-CD1 4.39Å; L302-I306 HydrophobicContact CG-CD1 3.93Å; L302-I306 WeakPolarHBondContact O-CG1 3.45Å; L302-I306 PolarHBondContact O-N 3.05Å; L303-I306 PolarHBondContact O-N 3.43Å |
| 307 | G | 60.6 | Low | 56.1 | Low | 37 Ų | 37 | 101.4 Ų | 101.4 | 38% | 0.381 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -79.3 | -16 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | L303 | L303-G307 WeakPolarHBondContact O-CA 3.49Å; L303-G307 PolarHBondContact O-N 2.96Å |
| 308 | G | 45.7 | Very low | 54.2 | Low | 47 Ų | 47 | 100.1 Ų | 100.1 | 49% | 0.485 | 61% | 0.607 | S | S | . | * | trans | 50.8 | 91.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | S304 H310 | S304-G308 PolarHBondContact O-N 3.31Å; G308-H310 PolarHBondContact O-N 2.72Å | ||
| 309 | Q | 44.4 | Very low | 52.5 | Low | 198 Ų | 198 | 102.4 Ų | 102.4 | 93% | 0.925 | 62% | 0.62 | S | S | * | * | S | Bend | trans | 43.7 | 38.2 | 171.8 | -73.3 | -162.9 | -54.5 | 0 | 0 | 115.7 | ||
| 310 | H | 43.9 | Very low | 51.1 | Low | 142 Ų | 142 | 110.2 Ų | 110.2 | 66% | 0.657 | 66% | 0.656 | S | S | * | * | trans | -92.3 | 100.2 | 159 | -86.3 | -79.4 | 0 | 0 | 0 | 107.3 | G308 Y312 | G308-H310 PolarHBondContact O-N 2.72Å; H310-Y312 VanDerWaalsContact C-N 3.28Å; H310-Y312 HydrophobicContact CB-CD2 4.31Å; H310-Y312 HydrophobicContact CB-CE2 4.1Å; H310-Y312 WeakPolarHBondContact O-CD2 3.34Å; H310-Y312 PolarHBondContact O-N 3.25Å | ||
| 311 | D | 37 | Very low | 49.6 | Very low | 156 Ų | 156 | 112.2 Ų | 112.2 | 83% | 0.834 | 67% | 0.668 | S | S | * | * | trans | -52.8 | 94.2 | 164.1 | -80.7 | -34 | 0 | 0 | 0 | 108.4 | A313 | D311-A313 PolarHBondContact O-N 3.17Š| ||
| 312 | Y | 45.6 | Very low | 48.1 | Very low | 224 Ų | 224 | 118.2 Ų | 118.2 | 88% | 0.878 | 69% | 0.691 | S | S | * | * | trans | -76 | 59.9 | 165.7 | -82.2 | -87.4 | 0 | 0 | 0 | 108.7 | H310 | H310-Y312 VanDerWaalsContact C-N 3.28Å; H310-Y312 HydrophobicContact CB-CD2 4.31Å; H310-Y312 HydrophobicContact CB-CE2 4.1Å; H310-Y312 WeakPolarHBondContact O-CD2 3.34Å; H310-Y312 PolarHBondContact O-N 3.25Å | ||
| 313 | A | 35.3 | Very low | 46.9 | Very low | 90 Ų | 90 | 123 Ų | 123 | 74% | 0.744 | 71% | 0.708 | S | S | * | * | trans | -139.8 | 80.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | D311 | D311-A313 PolarHBondContact O-N 3.17Š| ||
| 314 | G | 33.2 | Very low | 45.7 | Very low | 66 Ų | 66 | 124.6 Ų | 124.6 | 68% | 0.68 | 72% | 0.724 | S | S | * | * | S | Bend | trans | 127 | 122.7 | 165.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 315 | C | 35.3 | Very low | 44.5 | Very low | 112 Ų | 112 | 123.7 Ų | 123.7 | 76% | 0.757 | 72% | 0.717 | S | S | * | * | trans | 74 | 83.3 | 152.8 | -58.4 | 0 | 0 | 0 | 0 | 117.5 | N317 | C315-N317 PolarHBondContact O-N 3.08Š| ||
| 316 | L | 34 | Very low | 43.5 | Very low | 181 Ų | 181 | 128.2 Ų | 128.2 | 95% | 0.948 | 73% | 0.73 | S | S | * | * | trans | -60.2 | 87.4 | 142.3 | -72.3 | 167.5 | 0 | 0 | 0 | 108.9 | ||||
| 317 | N | 34 | Very low | 42.7 | Very low | 138 Ų | 138 | 134.8 Ų | 134.8 | 74% | 0.738 | 75% | 0.747 | S | S | * | * | trans | -144.7 | 106.4 | 166.1 | -85.3 | -35.9 | 0 | 0 | 0 | 109.1 | C315 | C315-N317 PolarHBondContact O-N 3.08Š| ||
| 318 | G | 30.7 | Very low | 42.3 | Very low | 62 Ų | 62 | 136.3 Ų | 136.3 | 64% | 0.639 | 75% | 0.751 | S | S | * | * | S | Bend | trans | 70.9 | 113.2 | 152 | 0 | 0 | 0 | 0 | 0 | 118.8 | Q320 | G318-Q320 PolarHBondContact O-N 3.06Å; G318-Q320 VanDerWaalsContact O-N 3.15Å |
| 319 | D | 37.4 | Very low | 42.4 | Very low | 173 Ų | 173 | 145 Ų | 145 | 93% | 0.925 | 78% | 0.776 | S | S | * | * | trans | 63.4 | 21.6 | 141.4 | -76.1 | -6.1 | 0 | 0 | 0 | 121.4 | S321 | D319-S321 PolarHBondContact O-N 2.98Š| ||
| 320 | Q | 47.2 | Very low | 42.3 | Very low | 182 Ų | 182 | 138 Ų | 138 | 85% | 0.85 | 76% | 0.757 | S | S | * | * | trans | -94.6 | 98.1 | 172.5 | -66.3 | -173.2 | 37.6 | 0 | 0 | 112 | G318 L322 | G318-Q320 PolarHBondContact O-N 3.06Å; G318-Q320 VanDerWaalsContact O-N 3.15Å; Q320-L322 PolarHBondContact O-N 3.05Å | ||
| 321 | S | 41.8 | Very low | 42.2 | Very low | 83 Ų | 83 | 136.4 Ų | 136.4 | 58% | 0.58 | 76% | 0.762 | S | S | * | * | trans | -38.5 | 129.7 | 166.1 | 62.4 | 0 | 0 | 0 | 0 | 111.8 | D319 K323 | D319-S321 PolarHBondContact O-N 2.98Å; S321-K323 VanDerWaalsContact C-N 3.34Å; S321-K323 PolarHBondContact O-N 3.46Å | ||
| 322 | L | 44.3 | Very low | 42.6 | Very low | 186 Ų | 186 | 137.3 Ų | 137.3 | 97% | 0.974 | 77% | 0.766 | S | S | * | * | trans | -54.1 | 96.5 | 165.9 | -107.1 | 93.1 | 0 | 0 | 0 | 109 | Q320 S324 | Q320-L322 PolarHBondContact O-N 3.05Å; L322-S324 PolarHBondContact O-N 3.44Å | ||
| 323 | K | 46.1 | Very low | 42.4 | Very low | 179 Ų | 179 | 135.3 Ų | 135.3 | 78% | 0.778 | 76% | 0.761 | S | S | * | * | trans | -81.7 | 111.9 | 172.9 | -74.3 | -178.8 | -179.2 | 174.7 | 0 | 107.8 | S321 | S321-K323 VanDerWaalsContact C-N 3.34Å; S321-K323 PolarHBondContact O-N 3.46Å | ||
| 324 | S | 48.4 | Very low | 42.7 | Very low | 85 Ų | 85 | 139.5 Ų | 139.5 | 59% | 0.594 | 77% | 0.771 | S | S | * | * | trans | -2.2 | 125.9 | 166 | 54.2 | 0 | 0 | 0 | 0 | 118.1 | L322 | L322-S324 PolarHBondContact O-N 3.44Š| ||
| 325 | C | 46.7 | Very low | 43 | Very low | 66 Ų | 66 | 146.2 Ų | 146.2 | 45% | 0.446 | 80% | 0.798 | S | S | . | * | trans | -49.5 | 134.3 | 163.6 | 136.1 | 0 | 0 | 0 | 0 | 112.5 | R327 C328 | C325-R327 PolarHBondContact O-N 3.11Å; C325-R327 PolarHBondContact SG-N 2.58Å; C325-C328 HydrophobicContact CB-CB 3.81Å; C325-C328 WeakPolarHBondContact CB-SG 3.5Å; C325-C328 PolarHBondContact O-N 3.39Å; C325-C328 WeakPolarHBondContact SG-CB 3.29Å; C325-C328 PolarHBondContact SG-N 3.44Å; C325-C328 CovalentContact SG-SG 2.07Å; C325-C328 PolarHBondContact SG-SG 2.87Å | ||
| 326 | N | 52.5 | Low | 43.4 | Very low | 178 Ų | 178 | 148 Ų | 148 | 95% | 0.952 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -4.3 | 179.6 | -68.3 | -26.9 | 0 | 0 | 0 | 114.9 | ||
| 327 | R | 53.7 | Low | 43.9 | Very low | 245 Ų | 245 | 146.2 Ų | 146.2 | 93% | 0.925 | 79% | 0.792 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.4 | -6.9 | 175.5 | -104.6 | 177.8 | 172.9 | -179.3 | -2.1 | 113.8 | C325 | C325-R327 PolarHBondContact O-N 3.11Å; C325-R327 PolarHBondContact SG-N 2.58Å |
| 328 | C | 52.2 | Low | 44.4 | Very low | 69 Ų | 69 | 146.7 Ų | 146.7 | 47% | 0.466 | 80% | 0.795 | S | S | . | * | trans | -123.6 | 92.9 | -166.5 | -40.6 | 0 | 0 | 0 | 0 | 109.8 | C325 G330 | C325-C328 HydrophobicContact CB-CB 3.81Å; C325-C328 WeakPolarHBondContact CB-SG 3.5Å; C325-C328 PolarHBondContact O-N 3.39Å; C325-C328 WeakPolarHBondContact SG-CB 3.29Å; C325-C328 PolarHBondContact SG-N 3.44Å; C325-C328 CovalentContact SG-SG 2.07Å; C325-C328 PolarHBondContact SG-SG 2.87Å; C328-G330 PolarHBondContact O-N 3.13Å | ||
| 329 | K | 47.2 | Very low | 45.2 | Very low | 229 Ų | 229 | 151.6 Ų | 151.6 | 100% | 0.996 | 80% | 0.804 | S | S | * | * | trans | -74 | 36.7 | 173.2 | -78 | -172.1 | 175.6 | -179.3 | 0 | 113.5 | ||||
| 330 | G | 42.4 | Very low | 45.7 | Very low | 51 Ų | 51 | 150.3 Ų | 150.3 | 53% | 0.526 | 80% | 0.797 | S | S | . | * | trans | -113.8 | 108.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | C328 L332 | C328-G330 PolarHBondContact O-N 3.13Å; G330-L332 PolarHBondContact O-N 2.99Å | ||
| 331 | S | 41.1 | Very low | 45.6 | Very low | 110 Ų | 110 | 148.2 Ų | 148.2 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | -68 | 108.6 | 166 | 54.9 | 0 | 0 | 0 | 0 | 109.1 | K333 | S331-K333 PolarHBondContact O-N 3.2Š| ||
| 332 | L | 44.8 | Very low | 45.9 | Very low | 174 Ų | 174 | 152.9 Ų | 152.9 | 91% | 0.911 | 81% | 0.809 | S | S | * | * | trans | -78.3 | 106.3 | 165.8 | -80.8 | 158.8 | 0 | 0 | 0 | 107.9 | G330 | G330-L332 PolarHBondContact O-N 2.99Š| ||
| 333 | K | 43.1 | Very low | 46 | Very low | 182 Ų | 182 | 150.3 Ų | 150.3 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | trans | -84.7 | 116.4 | 160.1 | -74 | -175.9 | 178.1 | 178.6 | 0 | 107 | S331 V335 | S331-K333 PolarHBondContact O-N 3.2Å; K333-V335 PolarHBondContact O-N 2.71Å | ||
| 334 | L | 40.9 | Very low | 46 | Very low | 179 Ų | 179 | 147.9 Ų | 147.9 | 94% | 0.937 | 80% | 0.797 | S | S | * | * | trans | -63.7 | 119.2 | 159.7 | -78 | 149.5 | 0 | 0 | 0 | 106.7 | ||||
| 335 | V | 39.7 | Very low | 45.8 | Very low | 207 Ų | 207 | 153.6 Ų | 153.6 | 100% | 1.255 | 82% | 0.816 | S | S | * | * | trans | -94.7 | 0 | 167.1 | 174.5 | 0 | 0 | 0 | 0 | 107.9 | K333 | K333-V335 PolarHBondContact O-N 2.71Š|
Retrieved 335 of 335 residues in 144.9 ms
(Link to these results)