| 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 | 32.5 | Very low | 47.5 | Very low | 244 Ų | 244 | 153.5 Ų | 153.5 | 100% | 1.202 | 81% | 0.812 | S | S | * | * | 0 | 114.9 | 0 | -70.9 | -63.6 | -162 | 0 | 0 | 107.2 | |||||
| 2 | D | 52 | Low | 47.5 | Very low | 160 Ų | 160 | 151.8 Ų | 151.8 | 86% | 0.856 | 82% | 0.817 | S | S | * | * | trans | -56.2 | 177.5 | 177 | -110.9 | -48.6 | 0 | 0 | 0 | 113.7 | ||||
| 3 | P | 59.5 | Low | 47.3 | Very low | 99 Ų | 99 | 148.3 Ų | 148.3 | 64% | 0.643 | 81% | 0.811 | S | S | * | * | cis | -137.8 | -174.5 | -2.3 | 29.6 | -5.2 | 0 | 0 | 0 | 113.7 | ||||
| 4 | L | 48.8 | Very low | 46.7 | Very low | 144 Ų | 144 | 152.6 Ų | 152.6 | 75% | 0.754 | 82% | 0.818 | S | S | * | * | trans | 167.1 | 100 | 139.5 | -88.3 | 151.8 | 0 | 0 | 0 | 112.1 | ||||
| 5 | Q | 53 | Low | 46.8 | Very low | 167 Ų | 167 | 149.9 Ų | 149.9 | 78% | 0.78 | 82% | 0.815 | S | S | * | * | 71.9 | 99.3 | 106 | -73.5 | -162.3 | 46.2 | 0 | 0 | 118.1 | |||||
| 6 | K | 51.3 | Low | 46.7 | Very low | 183 Ų | 183 | 147.1 Ų | 147.1 | 80% | 0.796 | 81% | 0.811 | S | S | * | * | 31 | 109.8 | 116.9 | -156.9 | -179.2 | -170.9 | -172.9 | 0 | 116.6 | |||||
| 7 | R | 40 | Very low | 47.2 | Very low | 243 Ų | 243 | 144.6 Ų | 144.6 | 92% | 0.917 | 80% | 0.803 | S | S | * | * | trans | -137.4 | 105.5 | 154.1 | -162.5 | 172.6 | -175.3 | 170.5 | 1 | 111.5 | ||||
| 8 | N | 52.8 | Low | 46.6 | Very low | 121 Ų | 121 | 146.3 Ų | 146.3 | 65% | 0.647 | 81% | 0.806 | S | S | * | * | trans | -74.1 | 145.3 | 161.2 | -63.5 | -47 | 0 | 0 | 0 | 108.9 | A10 | N8-A10 PolarHBondContact O-N 3.27Š| ||
| 9 | P | 49.7 | Very low | 46 | Very low | 135 Ų | 135 | 145.9 Ų | 145.9 | 88% | 0.877 | 81% | 0.809 | S | S | * | * | trans | -80.6 | 107.4 | 156.3 | 23.7 | -17.4 | 0 | 0 | 0 | 109.5 | ||||
| 10 | A | 36.6 | Very low | 45.9 | Very low | 91 Ų | 91 | 143.5 Ų | 143.5 | 75% | 0.752 | 81% | 0.808 | S | S | * | * | trans | -67.7 | 145.8 | 165.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | N8 | N8-A10 PolarHBondContact O-N 3.27Š| ||
| 11 | S | 46.7 | Very low | 45.7 | Very low | 102 Ų | 102 | 141.3 Ų | 141.3 | 71% | 0.713 | 81% | 0.808 | S | S | * | * | trans | -59 | 147.7 | 168.7 | 38.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 12 | P | 47.2 | Very low | 46.3 | Very low | 133 Ų | 133 | 138.9 Ų | 138.9 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -85.4 | 110.6 | 155.4 | 29.4 | -26.9 | 0 | 0 | 0 | 110.2 | ||||
| 13 | S | 45 | Very low | 45.7 | Very low | 106 Ų | 106 | 137.8 Ų | 137.8 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -70.6 | 141 | 153.2 | -72 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 14 | K | 39.4 | Very low | 45.2 | Very low | 208 Ų | 208 | 138.1 Ų | 138.1 | 90% | 0.904 | 80% | 0.798 | S | S | * | * | 179.9 | 127 | 122.9 | -99.7 | 168.6 | 178.4 | -178.7 | 0 | 112.2 | |||||
| 15 | S | 46.8 | Very low | 45.1 | Very low | 112 Ų | 112 | 140.8 Ų | 140.8 | 78% | 0.783 | 81% | 0.807 | S | S | * | * | trans | -72.5 | 157.8 | 164.9 | 50 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 16 | S | 46.3 | Very low | 44.5 | Very low | 106 Ų | 106 | 141.8 Ų | 141.8 | 74% | 0.741 | 81% | 0.811 | S | S | * | * | 147.2 | 177.2 | 84.3 | -158.9 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 17 | P | 55.7 | Low | 43.9 | Very low | 105 Ų | 105 | 136.4 Ų | 136.4 | 68% | 0.682 | 81% | 0.808 | S | S | * | * | cis | -129.2 | 172.1 | -31.2 | 20.1 | 4.3 | 0 | 0 | 0 | 115.4 | ||||
| 18 | M | 35.3 | Very low | 44.3 | Very low | 174 Ų | 174 | 131.1 Ų | 131.1 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | trans | 39.3 | 140.4 | 138.6 | -53.3 | -89.1 | 138.8 | 0 | 0 | 120 | ||||
| 19 | T | 34.9 | Very low | 44.5 | Very low | 139 Ų | 139 | 129.3 Ų | 129.3 | 85% | 0.853 | 81% | 0.807 | S | S | * | * | 179.7 | 161.3 | 64.7 | -33.7 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 20 | A | 44.3 | Very low | 44.2 | Very low | 97 Ų | 97 | 129.1 Ų | 129.1 | 80% | 0.802 | 81% | 0.806 | S | S | * | * | trans | -72 | 161.1 | -170.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 21 | A | 41.4 | Very low | 44.8 | Very low | 98 Ų | 98 | 130.4 Ų | 130.4 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | trans | -159.7 | 113.9 | 142 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 22 | E | 46.4 | Very low | 45.2 | Very low | 194 Ų | 194 | 134.3 Ų | 134.3 | 91% | 0.907 | 82% | 0.816 | S | S | * | * | trans | -70.9 | 136.6 | 158.9 | -72.5 | 173.7 | 98.8 | 0 | 0 | 108.7 | ||||
| 23 | T | 37.8 | Very low | 45.2 | Very low | 137 Ų | 137 | 133.7 Ų | 133.7 | 84% | 0.84 | 81% | 0.812 | S | S | * | * | trans | -148.7 | 117.6 | 151.9 | -46.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 24 | S | 50.3 | Low | 44.9 | Very low | 105 Ų | 105 | 134.3 Ų | 134.3 | 73% | 0.734 | 82% | 0.816 | S | S | * | * | trans | -67.7 | 136.8 | 170.4 | -172.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 25 | Q | 45.4 | Very low | 45.3 | Very low | 201 Ų | 201 | 135.5 Ų | 135.5 | 94% | 0.939 | 82% | 0.817 | S | S | * | * | trans | -154.3 | 137.6 | 148.6 | -124.9 | 179.5 | -6.8 | 0 | 0 | 112.7 | ||||
| 26 | E | 40.8 | Very low | 45.3 | Very low | 187 Ų | 187 | 134.2 Ų | 134.2 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | trans | -104.4 | 138.8 | -165.9 | -177.5 | 166.2 | 115.2 | 0 | 0 | 111.4 | ||||
| 27 | G | 39.9 | Very low | 45.4 | Very low | 71 Ų | 71 | 137.9 Ų | 137.9 | 73% | 0.732 | 81% | 0.813 | S | S | * | * | trans | 77.5 | 163.4 | 156.5 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 28 | P | 48 | Very low | 45.4 | Very low | 132 Ų | 132 | 141.6 Ų | 141.6 | 86% | 0.857 | 82% | 0.822 | S | S | * | * | cis | -126.6 | 169.2 | 10.3 | 36 | -17.3 | 0 | 0 | 0 | 115.9 | ||||
| 29 | A | 56.1 | Low | 46.5 | Very low | 82 Ų | 82 | 138.4 Ų | 138.4 | 68% | 0.678 | 81% | 0.814 | S | S | * | * | trans | -60.3 | 155.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | S31 | A29-S31 PolarHBondContact O-N 3.39Š| ||
| 30 | P | 44.4 | Very low | 47 | Very low | 132 Ų | 132 | 139.1 Ų | 139.1 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | trans | -73 | 113.7 | 173.6 | 28 | -31.3 | 0 | 0 | 0 | 111.3 | ||||
| 31 | S | 49.9 | Very low | 47.1 | Very low | 117 Ų | 117 | 143 Ų | 143 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -66.7 | 127.8 | 169.3 | -51.6 | 0 | 0 | 0 | 0 | 110.7 | A29 | A29-S31 PolarHBondContact O-N 3.39Š| ||
| 32 | Q | 54.5 | Low | 47.2 | Very low | 185 Ų | 185 | 141.5 Ų | 141.5 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | trans | -61.8 | 141.8 | 171.1 | -77.3 | -164.5 | -45.4 | 0 | 0 | 111.4 | S34 | Q32-S34 PolarHBondContact O-N 3.01Š| ||
| 33 | P | 46.5 | Very low | 47.5 | Very low | 119 Ų | 119 | 141 Ų | 141 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | -80.2 | 115 | 165.8 | 24.7 | -18.4 | 0 | 0 | 0 | 110.1 | ||||
| 34 | S | 39.1 | Very low | 48 | Very low | 119 Ų | 119 | 139 Ų | 139 | 83% | 0.832 | 80% | 0.801 | S | S | * | * | trans | -68.1 | 122 | 166.1 | -170.2 | 0 | 0 | 0 | 0 | 109.1 | Q32 | Q32-S34 PolarHBondContact O-N 3.01Š| ||
| 35 | Y | 48.3 | Very low | 48 | Very low | 233 Ų | 233 | 141.3 Ų | 141.3 | 91% | 0.914 | 81% | 0.805 | S | S | * | * | trans | -84.3 | 124 | 176.6 | -125.5 | -96 | 0 | 0 | 0 | 108.8 | ||||
| 36 | S | 47 | Very low | 48.1 | Very low | 86 Ų | 86 | 139.8 Ų | 139.8 | 60% | 0.601 | 80% | 0.803 | S | S | * | * | trans | -134.1 | 122.7 | 174.7 | -170.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 37 | E | 47.7 | Very low | 48.5 | Very low | 182 Ų | 182 | 136.6 Ų | 136.6 | 85% | 0.85 | 80% | 0.801 | S | S | * | * | trans | 76.4 | 100.4 | 148.4 | -66.8 | 173.1 | 159.8 | 0 | 0 | 120.1 | ||||
| 38 | Q | 54.8 | Low | 48.9 | Very low | 184 Ų | 184 | 139.2 Ų | 139.2 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -69.4 | 159.1 | 139.3 | -83.7 | -171.7 | -28.4 | 0 | 0 | 109.4 | ||||
| 39 | P | 58.2 | Low | 48.9 | Very low | 106 Ų | 106 | 135.5 Ų | 135.5 | 69% | 0.688 | 79% | 0.791 | S | S | * | * | -157.6 | 172.4 | 50.7 | 40.8 | -17.5 | 0 | 0 | 0 | 120.2 | |||||
| 40 | M | 46.8 | Very low | 48.7 | Very low | 155 Ų | 155 | 138.5 Ų | 138.5 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | trans | 63.4 | 126.6 | 143.4 | -94 | -173.3 | -89.6 | 0 | 0 | 124.5 | ||||
| 41 | M | 45.9 | Very low | 48.6 | Very low | 178 Ų | 178 | 134.8 Ų | 134.8 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | 67.2 | 116 | 142 | -73.8 | -179.4 | -161.2 | 0 | 0 | 120.2 | ||||
| 42 | G | 42.9 | Very low | 48.3 | Very low | 67 Ų | 67 | 134.9 Ų | 134.9 | 69% | 0.691 | 79% | 0.787 | S | S | * | * | trans | -179.7 | 51.9 | 163.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | S44 | G42-S44 VanDerWaalsContact C-N 3.3Å; G42-S44 PolarHBondContact O-N 3.38Å | ||
| 43 | L | 54.1 | Low | 48.1 | Very low | 182 Ų | 182 | 132 Ų | 132 | 95% | 0.953 | 79% | 0.788 | S | S | * | * | trans | -71.2 | 93.4 | 165.5 | -72.7 | 174.5 | 0 | 0 | 0 | 107.4 | ||||
| 44 | S | 46.6 | Very low | 48.2 | Very low | 96 Ų | 96 | 134.7 Ų | 134.7 | 67% | 0.671 | 79% | 0.79 | S | S | * | * | trans | -143 | 93.3 | 175.4 | -61.2 | 0 | 0 | 0 | 0 | 109.7 | G42 | G42-S44 VanDerWaalsContact C-N 3.3Å; G42-S44 PolarHBondContact O-N 3.38Å | ||
| 45 | N | 51.4 | Low | 49 | Very low | 153 Ų | 153 | 133.1 Ų | 133.1 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | 43.8 | 90.4 | 144.6 | -55.3 | -40.5 | 0 | 0 | 0 | 117.5 | ||||
| 46 | L | 46.4 | Very low | 49.4 | Very low | 169 Ų | 169 | 128 Ų | 128 | 89% | 0.885 | 78% | 0.777 | S | S | * | * | trans | -135.4 | 106.1 | 140.9 | -69 | 175.8 | 0 | 0 | 0 | 107.6 | P48 | L46-P48 WeakPolarHBondContact O-CD 3.37Š| ||
| 47 | S | 50.9 | Low | 50.1 | Low | 120 Ų | 120 | 128.5 Ų | 128.5 | 84% | 0.839 | 78% | 0.778 | S | S | * | * | trans | -53.1 | 123.1 | 167.2 | -61.9 | 0 | 0 | 0 | 0 | 109.5 | G49 | S47-G49 PolarHBondContact O-N 2.69Š| ||
| 48 | P | 46.5 | Very low | 50.8 | Low | 126 Ų | 126 | 125.3 Ų | 125.3 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | trans | -79.8 | 112 | 159.4 | 10.3 | 7.1 | 0 | 0 | 0 | 106 | L46 | L46-P48 WeakPolarHBondContact O-CD 3.37Š| ||
| 49 | G | 49.3 | Very low | 51.7 | Low | 54 Ų | 54 | 119.7 Ų | 119.7 | 56% | 0.557 | 75% | 0.746 | S | S | * | * | trans | -53.7 | 165.3 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | S47 G51 | S47-G49 PolarHBondContact O-N 2.69Å; G49-G51 PolarHBondContact O-N 2.89Å | ||
| 50 | P | 51.4 | Low | 52.6 | Low | 145 Ų | 145 | 121.5 Ų | 121.5 | 94% | 0.942 | 75% | 0.745 | S | S | * | * | trans | -68 | 81.9 | 176.5 | 28.7 | -32 | 0 | 0 | 0 | 109.2 | ||||
| 51 | G | 41.9 | Very low | 54.3 | Low | 55 Ų | 55 | 116.7 Ų | 116.7 | 57% | 0.567 | 74% | 0.735 | S | S | * | * | trans | -73.2 | 136.2 | 168.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | G49 S53 | G49-G51 PolarHBondContact O-N 2.89Å; G51-S53 PolarHBondContact O-N 2.86Å | ||
| 52 | P | 44.7 | Very low | 56.2 | Low | 119 Ų | 119 | 113.4 Ų | 113.4 | 77% | 0.773 | 72% | 0.72 | S | S | * | * | trans | -59 | 127.3 | -179 | 26.1 | -31.8 | 0 | 0 | 0 | 108 | Q54 | P52-Q54 VanDerWaalsContact C-N 3.31Å; P52-Q54 PolarHBondContact O-N 2.76Å | ||
| 53 | S | 49.4 | Very low | 58.3 | Low | 124 Ų | 124 | 114.7 Ų | 114.7 | 87% | 0.867 | 71% | 0.711 | S | S | * | * | trans | -49.5 | 97.7 | 169.7 | -53.4 | 0 | 0 | 0 | 0 | 108.3 | G51 A55 | G51-S53 PolarHBondContact O-N 2.86Å; S53-A55 PolarHBondContact O-N 3.17Å | ||
| 54 | Q | 48.2 | Very low | 59.9 | Low | 175 Ų | 175 | 114.8 Ų | 114.8 | 82% | 0.818 | 70% | 0.699 | S | S | * | * | trans | -67 | 96.2 | 164.5 | -81.7 | -172.3 | 42.7 | 0 | 0 | 105 | P52 V56 | P52-Q54 VanDerWaalsContact C-N 3.31Å; P52-Q54 PolarHBondContact O-N 2.76Å; Q54-V56 VanDerWaalsContact C-N 3.25Å; Q54-V56 PolarHBondContact O-N 2.84Å | ||
| 55 | A | 56.8 | Low | 62 | Low | 87 Ų | 87 | 115.2 Ų | 115.2 | 72% | 0.719 | 69% | 0.69 | S | S | * | * | trans | -54.4 | 103.6 | 156.3 | 0 | 0 | 0 | 0 | 0 | 105.3 | S53 P57 | S53-A55 PolarHBondContact O-N 3.17Å; A55-P57 VanDerWaalsContact O-CD 3.24Å; A55-P57 WeakPolarHBondContact O-CD 3.24Å | ||
| 56 | V | 56.9 | Low | 63.9 | Low | 126 Ų | 126 | 116.5 Ų | 116.5 | 76% | 0.764 | 68% | 0.683 | S | S | * | * | trans | -49.5 | 116.7 | 171.7 | 173.2 | 0 | 0 | 0 | 0 | 106 | Q54 L58 | Q54-V56 VanDerWaalsContact C-N 3.25Å; Q54-V56 PolarHBondContact O-N 2.84Å; V56-L58 PolarHBondContact O-N 2.86Å | ||
| 57 | P | 61.4 | Low | 66 | Low | 95 Ų | 95 | 116.4 Ų | 116.4 | 62% | 0.617 | 67% | 0.672 | S | S | * | * | trans | -61.5 | 115.3 | 175.9 | -17.3 | 29.8 | 0 | 0 | 0 | 106.2 | A55 P59 | A55-P57 VanDerWaalsContact O-CD 3.24Å; A55-P57 WeakPolarHBondContact O-CD 3.24Å; P57-P59 VanDerWaalsContact O-N 3.13Å | ||
| 58 | L | 62.2 | Low | 68 | Low | 115 Ų | 115 | 119 Ų | 119 | 60% | 0.602 | 66% | 0.664 | S | S | * | * | trans | -50.9 | 122.7 | 170.5 | -176.6 | 75.7 | 0 | 0 | 0 | 106.5 | V56 E60 L63 | V56-L58 PolarHBondContact O-N 2.86Å; L58-E60 PolarHBondContact O-N 2.9Å; L58-L63 HydrophobicContact CD2-CD1 3.39Å; L58-L63 HydrophobicContact CD2-CD2 4.37Å; L58-L63 HydrophobicContact CD2-CG 3.89Å; L58-L63 HydrophobicContact CG-CD1 4.33Å | ||
| 59 | P | 73.8 | Confident | 70.3 | Confident | 67 Ų | 67 | 117.5 Ų | 117.5 | 44% | 0.435 | 65% | 0.646 | S | S | . | * | trans | -64 | 107 | -169.4 | -19.4 | 30.6 | 0 | 0 | 0 | 108.7 | P57 G61 L62 | P57-P59 VanDerWaalsContact O-N 3.13Å; P59-G61 PolarHBondContact O-N 3Å; P59-L62 HydrophobicContact CB-CB 4.38Å; P59-L62 HydrophobicContact CB-CD1 4Å; P59-L62 HydrophobicContact CB-CG 3.98Å; P59-L62 HydrophobicContact CG-CD1 3.79Å; P59-L62 HydrophobicContact CG-CG 4.35Å; P59-L62 PolarHBondContact O-N 2.99Å | ||
| 60 | E | 78 | Confident | 72.3 | Confident | 144 Ų | 144 | 120.8 Ų | 120.8 | 67% | 0.673 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -59.5 | -24 | -175.2 | -65.8 | 103 | 172 | 0 | 0 | 111.5 | L58 R64 | L58-E60 PolarHBondContact O-N 2.9Å; E60-R64 WeakPolarHBondContact O-CB 3.42Å; E60-R64 PolarHBondContact O-N 3.47Å |
| 61 | G | 81.8 | Confident | 74.3 | Confident | 53 Ų | 53 | 118.7 Ų | 118.7 | 55% | 0.546 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -61.1 | -39.4 | 171.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | P59 R64 Q65 | P59-G61 PolarHBondContact O-N 3Å; G61-R64 PolarHBondContact O-N 3.04Å; G61-Q65 VanDerWaalsContact O-CB 3.3Å; G61-Q65 WeakPolarHBondContact O-CB 3.47Å; G61-Q65 PolarHBondContact O-N 2.85Å |
| 62 | L | 86.5 | Confident | 76.7 | Confident | 110 Ų | 110 | 119.5 Ų | 119.5 | 58% | 0.576 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -70.7 | -40.9 | 178.9 | -70.3 | 178.6 | 0 | 0 | 0 | 111.6 | P59 R64 Q65 R66 | P59-L62 HydrophobicContact CB-CB 4.38Å; P59-L62 HydrophobicContact CB-CD1 4Å; P59-L62 HydrophobicContact CB-CG 3.98Å; P59-L62 HydrophobicContact CG-CD1 3.79Å; P59-L62 HydrophobicContact CG-CG 4.35Å; P59-L62 PolarHBondContact O-N 2.99Å; L62-R64 VanDerWaalsContact C-N 3.34Å; L62-Q65 PolarHBondContact O-N 2.69Å; L62-R66 WeakPolarHBondContact O-CB 3.24Å; L62-R66 PolarHBondContact O-N 3.17Å |
| 63 | L | 86 | Confident | 79.1 | Confident | 93 Ų | 93 | 118.7 Ų | 118.7 | 49% | 0.487 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -61.9 | -44.5 | 174.4 | -81.9 | 177.8 | 0 | 0 | 0 | 111.4 | L58 R66 Y67 | L58-L63 HydrophobicContact CD2-CD1 3.39Å; L58-L63 HydrophobicContact CD2-CD2 4.37Å; L58-L63 HydrophobicContact CD2-CG 3.89Å; L58-L63 HydrophobicContact CG-CD1 4.33Å; L63-R66 PolarHBondContact O-N 3.49Å; L63-Y67 WeakPolarHBondContact O-CB 3.3Å; L63-Y67 PolarHBondContact O-N 2.9Å |
| 64 | R | 88.3 | Confident | 81.1 | Confident | 185 Ų | 185 | 119.1 Ų | 119.1 | 70% | 0.698 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -67.3 | -36.7 | 179.2 | -171.8 | 170.7 | 174.7 | -147.4 | 0.8 | 112.5 | E60 G61 L62 R68 | E60-R64 WeakPolarHBondContact O-CB 3.42Å; E60-R64 PolarHBondContact O-N 3.47Å; G61-R64 PolarHBondContact O-N 3.04Å; L62-R64 VanDerWaalsContact C-N 3.34Å; R64-R68 WeakPolarHBondContact O-CB 3.36Å; R64-R68 PolarHBondContact O-N 3.07Å; R64-R68 VanDerWaalsContact O-N 3.08Å |
| 65 | Q | 90.9 | Very high | 83.1 | Confident | 105 Ų | 105 | 114.7 Ų | 114.7 | 49% | 0.491 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.6 | -49.1 | 173 | 178.1 | 175.1 | -8.8 | 0 | 0 | 111 | G61 L62 Y67 R68 E69 | G61-Q65 VanDerWaalsContact O-CB 3.3Å; G61-Q65 WeakPolarHBondContact O-CB 3.47Å; G61-Q65 PolarHBondContact O-N 2.85Å; L62-Q65 PolarHBondContact O-N 2.69Å; Q65-Y67 VanDerWaalsContact C-N 3.31Å; Q65-Y67 PolarHBondContact O-N 3.47Å; Q65-R68 WeakPolarHBondContact O-CB 3.42Å; Q65-R68 PolarHBondContact O-N 3.08Å; Q65-R68 VanDerWaalsContact O-N 3.07Å; Q65-E69 HydrophobicContact CG-CG 4.45Å; Q65-E69 VanDerWaalsContact CG-OE1 3.24Å; Q65-E69 WeakPolarHBondContact CG-OE1 3.35Å; Q65-E69 PolarHBondContact NE2-OE1 3.38Å; Q65-E69 WeakPolarHBondContact O-CG 3.4Å; Q65-E69 PolarHBondContact O-N 3.37Å |
| 66 | R | 91.2 | Very high | 84.9 | Confident | 180 Ų | 180 | 118.2 Ų | 118.2 | 68% | 0.679 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -58.3 | -43.7 | 178.4 | -164.4 | -173.1 | -159.7 | -160.5 | 5.8 | 111.9 | L62 L63 R68 E69 E70 | L62-R66 WeakPolarHBondContact O-CB 3.24Å; L62-R66 PolarHBondContact O-N 3.17Å; L63-R66 PolarHBondContact O-N 3.49Å; R66-R68 VanDerWaalsContact C-N 3.34Å; R66-R68 PolarHBondContact O-N 3.36Å; R66-E69 PolarHBondContact O-N 2.9Å; R66-E70 WeakPolarHBondContact O-CB 3.47Å; R66-E70 PolarHBondContact O-N 3.34Å |
| 67 | Y | 90.8 | Very high | 86.6 | Confident | 166 Ų | 166 | 121.1 Ų | 121.1 | 65% | 0.651 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.4 | -43.3 | 175.2 | 174.7 | -101.4 | 0 | 0 | 0 | 112.1 | L63 Q65 K71 | L63-Y67 WeakPolarHBondContact O-CB 3.3Å; L63-Y67 PolarHBondContact O-N 2.9Å; Q65-Y67 VanDerWaalsContact C-N 3.31Å; Q65-Y67 PolarHBondContact O-N 3.47Å; Y67-K71 WeakPolarHBondContact O-CB 3.39Å; Y67-K71 PolarHBondContact O-N 3.1Å; Y67-K71 VanDerWaalsContact O-N 3.08Å |
| 68 | R | 92.2 | Very high | 87.8 | Confident | 175 Ų | 175 | 124.9 Ų | 124.9 | 66% | 0.66 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -64.6 | -43.5 | 177.9 | -167.6 | -170.3 | -89.2 | -163.2 | -4.7 | 111.2 | R64 Q65 R66 K71 T72 | R64-R68 WeakPolarHBondContact O-CB 3.36Å; R64-R68 PolarHBondContact O-N 3.07Å; R64-R68 VanDerWaalsContact O-N 3.08Å; Q65-R68 WeakPolarHBondContact O-CB 3.42Å; Q65-R68 PolarHBondContact O-N 3.08Å; Q65-R68 VanDerWaalsContact O-N 3.07Å; R66-R68 VanDerWaalsContact C-N 3.34Å; R66-R68 PolarHBondContact O-N 3.36Å; R68-K71 PolarHBondContact O-N 2.94Å; R68-T72 WeakPolarHBondContact O-CG2 3.49Å; R68-T72 PolarHBondContact O-N 2.88Å |
| 69 | E | 93.6 | Very high | 89.3 | Confident | 94 Ų | 94 | 125.7 Ų | 125.7 | 44% | 0.439 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.5 | -44.9 | 177.9 | -71.3 | 171.3 | -172.5 | 0 | 0 | 111.9 | Q65 R66 K71 T72 L73 | Q65-E69 HydrophobicContact CG-CG 4.45Å; Q65-E69 VanDerWaalsContact CG-OE1 3.24Å; Q65-E69 WeakPolarHBondContact CG-OE1 3.35Å; Q65-E69 PolarHBondContact NE2-OE1 3.38Å; Q65-E69 WeakPolarHBondContact O-CG 3.4Å; Q65-E69 PolarHBondContact O-N 3.37Å; R66-E69 PolarHBondContact O-N 2.9Å; E69-K71 VanDerWaalsContact C-N 3.34Å; E69-K71 PolarHBondContact O-N 3.41Å; E69-T72 PolarHBondContact O-N 3.47Å; E69-T72 VanDerWaalsContact O-N 3.17Å; E69-T72 PolarHBondContact O-OG1 3.39Å; E69-L73 WeakPolarHBondContact O-CG 3.35Å; E69-L73 PolarHBondContact O-N 2.97Å |
| 70 | E | 93.1 | Very high | 90.3 | Very high | 124 Ų | 124 | 130 Ų | 130 | 58% | 0.579 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -59 | -44.7 | 177.3 | -174.8 | 168.8 | -156.3 | 0 | 0 | 111.8 | R66 T72 L73 E74 | R66-E70 WeakPolarHBondContact O-CB 3.47Å; R66-E70 PolarHBondContact O-N 3.34Å; E70-T72 VanDerWaalsContact C-N 3.33Å; E70-T72 PolarHBondContact O-N 3.04Å; E70-L73 WeakPolarHBondContact O-CB 3.15Å; E70-L73 PolarHBondContact O-N 3.42Å; E70-L73 VanDerWaalsContact O-N 3.15Å; E70-E74 PolarHBondContact O-N 3.15Å |
| 71 | K | 91.8 | Very high | 91.1 | Very high | 101 Ų | 101 | 127.4 Ų | 127.4 | 44% | 0.439 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -59.8 | -41.2 | 176.1 | -167.7 | -100.2 | -170.6 | -178.3 | 0 | 112.2 | Y67 R68 E69 E74 E75 | Y67-K71 WeakPolarHBondContact O-CB 3.39Å; Y67-K71 PolarHBondContact O-N 3.1Å; Y67-K71 VanDerWaalsContact O-N 3.08Å; R68-K71 PolarHBondContact O-N 2.94Å; E69-K71 VanDerWaalsContact C-N 3.34Å; E69-K71 PolarHBondContact O-N 3.41Å; K71-E74 PolarHBondContact O-N 2.97Å; K71-E75 WeakPolarHBondContact CE-OE1 3.32Å; K71-E75 IonicContact NZ-OE1 3.68Å; K71-E75 PolarHBondContact NZ-OE1 2.61Å; K71-E75 IonicContact NZ-OE2 2.78Å; K71-E75 WeakPolarHBondContact O-CG 3.43Å; K71-E75 PolarHBondContact O-N 3.1Å |
| 72 | T | 93.3 | Very high | 91.7 | Very high | 71 Ų | 71 | 129.2 Ų | 129.2 | 44% | 0.436 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -69.1 | -34.1 | 176.2 | 61.1 | 0 | 0 | 0 | 0 | 113.2 | R68 E69 E70 R76 | R68-T72 WeakPolarHBondContact O-CG2 3.49Å; R68-T72 PolarHBondContact O-N 2.88Å; E69-T72 PolarHBondContact O-N 3.47Å; E69-T72 VanDerWaalsContact O-N 3.17Å; E69-T72 PolarHBondContact O-OG1 3.39Å; E70-T72 VanDerWaalsContact C-N 3.33Å; E70-T72 PolarHBondContact O-N 3.04Å; T72-R76 WeakPolarHBondContact O-CB 3.39Å; T72-R76 PolarHBondContact O-N 3.38Å |
| 73 | L | 94.8 | Very high | 92.1 | Very high | 103 Ų | 103 | 130.1 Ų | 130.1 | 54% | 0.539 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.6 | -39.5 | 175.2 | -73.1 | 172.8 | 0 | 0 | 0 | 111.4 | E69 E70 R76 R77 | E69-L73 WeakPolarHBondContact O-CG 3.35Å; E69-L73 PolarHBondContact O-N 2.97Å; E70-L73 WeakPolarHBondContact O-CB 3.15Å; E70-L73 PolarHBondContact O-N 3.42Å; E70-L73 VanDerWaalsContact O-N 3.15Å; L73-R76 PolarHBondContact O-N 3.17Å; L73-R77 WeakPolarHBondContact O-CG 3.45Å; L73-R77 PolarHBondContact O-N 2.95Å |
| 74 | E | 91.8 | Very high | 92.5 | Very high | 132 Ų | 132 | 130 Ų | 130 | 62% | 0.617 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -65.4 | -45.8 | 176 | -172.1 | 162.9 | -152.2 | 0 | 0 | 111.8 | E70 K71 R76 R77 W78 | E70-E74 PolarHBondContact O-N 3.15Å; K71-E74 PolarHBondContact O-N 2.97Å; E74-R76 VanDerWaalsContact C-N 3.34Å; E74-R76 PolarHBondContact O-N 3.04Å; E74-R77 WeakPolarHBondContact O-CB 3.43Å; E74-R77 PolarHBondContact O-N 3.41Å; E74-R77 VanDerWaalsContact O-N 3.08Å; E74-W78 PolarHBondContact O-N 2.93Å |
| 75 | E | 90.6 | Very high | 92.9 | Very high | 83 Ų | 83 | 127.8 Ų | 127.8 | 39% | 0.388 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -55.9 | -48.1 | 173.2 | -75.2 | 175.6 | 154.8 | 0 | 0 | 111.6 | K71 R77 W78 E79 | K71-E75 WeakPolarHBondContact CE-OE1 3.32Å; K71-E75 IonicContact NZ-OE1 3.68Å; K71-E75 PolarHBondContact NZ-OE1 2.61Å; K71-E75 IonicContact NZ-OE2 2.78Å; K71-E75 WeakPolarHBondContact O-CG 3.43Å; K71-E75 PolarHBondContact O-N 3.1Å; E75-R77 VanDerWaalsContact C-N 3.28Å; E75-R77 PolarHBondContact O-N 3.08Å; E75-W78 WeakPolarHBondContact O-CA 3.35Å; E75-W78 WeakPolarHBondContact O-CB 3.39Å; E75-W78 PolarHBondContact O-N 3.16Å; E75-E79 WeakPolarHBondContact O-CG 3.47Å; E75-E79 PolarHBondContact O-N 2.87Å |
| 76 | R | 93.9 | Very high | 93.1 | Very high | 161 Ų | 161 | 130.9 Ų | 130.9 | 61% | 0.608 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -62.4 | -34.3 | 177.3 | -176.6 | 178.1 | -105.9 | -132.8 | -3.1 | 112.6 | T72 L73 E74 R80 | T72-R76 WeakPolarHBondContact O-CB 3.39Å; T72-R76 PolarHBondContact O-N 3.38Å; L73-R76 PolarHBondContact O-N 3.17Å; E74-R76 VanDerWaalsContact C-N 3.34Å; E74-R76 PolarHBondContact O-N 3.04Å; R76-R80 WeakPolarHBondContact O-CB 3.49Å; R76-R80 PolarHBondContact O-N 3.48Å; R76-R80 VanDerWaalsContact O-N 3.1Å |
| 77 | R | 93.6 | Very high | 93.4 | Very high | 187 Ų | 187 | 127.5 Ų | 127.5 | 71% | 0.706 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66 | -41.9 | 173.5 | -77.1 | 174.4 | -179.3 | -164.5 | 2.1 | 110.7 | L73 E74 E75 R80 L81 | L73-R77 WeakPolarHBondContact O-CG 3.45Å; L73-R77 PolarHBondContact O-N 2.95Å; E74-R77 WeakPolarHBondContact O-CB 3.43Å; E74-R77 PolarHBondContact O-N 3.41Å; E74-R77 VanDerWaalsContact O-N 3.08Å; E75-R77 VanDerWaalsContact C-N 3.28Å; E75-R77 PolarHBondContact O-N 3.08Å; R77-R80 PolarHBondContact O-N 3.49Å; R77-L81 PolarHBondContact O-N 3.39Å |
| 78 | W | 86.4 | Confident | 93.7 | Very high | 173 Ų | 173 | 127.1 Ų | 127.1 | 66% | 0.655 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64.6 | -45.9 | 176.4 | -112.6 | -158.3 | 0 | 0 | 0 | 113.1 | E74 E75 R80 L81 E82 | E74-W78 PolarHBondContact O-N 2.93Å; E75-W78 WeakPolarHBondContact O-CA 3.35Å; E75-W78 WeakPolarHBondContact O-CB 3.39Å; E75-W78 PolarHBondContact O-N 3.16Å; W78-R80 VanDerWaalsContact C-N 3.28Å; W78-R80 PolarHBondContact O-N 2.94Å; W78-L81 HydrophobicContact CE3-CB 4.22Å; W78-L81 HydrophobicContact CE3-CD2 3.84Å; W78-L81 HydrophobicContact CH2-CD2 3.78Å; W78-L81 HydrophobicContact CZ3-CB 4.43Å; W78-L81 HydrophobicContact CZ3-CD2 3.24Å; W78-L81 HydrophobicContact CZ3-CG 4.45Å; W78-L81 PolarHBondContact O-N 2.87Å; W78-L81 VanDerWaalsContact O-N 3.1Å; W78-E82 PolarHBondContact O-N 3.07Å |
| 79 | E | 92.3 | Very high | 93.9 | Very high | 132 Ų | 132 | 121 Ų | 121 | 62% | 0.617 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -57.2 | -43 | 173.3 | -70.7 | 175.3 | 172.7 | 0 | 0 | 112 | E75 L81 E82 F83 | E75-E79 WeakPolarHBondContact O-CG 3.47Å; E75-E79 PolarHBondContact O-N 2.87Å; E79-L81 VanDerWaalsContact C-N 3.35Å; E79-L81 PolarHBondContact O-N 3.1Å; E79-E82 PolarHBondContact O-N 3.33Å; E79-F83 WeakPolarHBondContact O-CB 3.32Å; E79-F83 PolarHBondContact O-N 3.36Å |
| 80 | R | 94.8 | Very high | 94.1 | Very high | 157 Ų | 157 | 122.7 Ų | 122.7 | 59% | 0.592 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -64 | -40.7 | 176.9 | -172.3 | -178.2 | -65.6 | -176.4 | -1.8 | 111.6 | R76 R77 W78 F83 L84 | R76-R80 WeakPolarHBondContact O-CB 3.49Å; R76-R80 PolarHBondContact O-N 3.48Å; R76-R80 VanDerWaalsContact O-N 3.1Å; R77-R80 PolarHBondContact O-N 3.49Å; W78-R80 VanDerWaalsContact C-N 3.28Å; W78-R80 PolarHBondContact O-N 2.94Å; R80-F83 PolarHBondContact O-N 2.96Å; R80-L84 HydrophobicContact CG-CD1 4.43Å; R80-L84 VanDerWaalsContact O-CG 3.28Å; R80-L84 WeakPolarHBondContact O-CG 3.38Å; R80-L84 PolarHBondContact O-N 3.12Å |
| 81 | L | 95.4 | Very high | 94.3 | Very high | 90 Ų | 90 | 120.2 Ų | 120.2 | 47% | 0.471 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68.3 | -43.8 | 179.3 | -169 | 66.2 | 0 | 0 | 0 | 111.5 | R77 W78 E79 F83 L84 Q85 | R77-L81 PolarHBondContact O-N 3.39Å; W78-L81 HydrophobicContact CE3-CB 4.22Å; W78-L81 HydrophobicContact CE3-CD2 3.84Å; W78-L81 HydrophobicContact CH2-CD2 3.78Å; W78-L81 HydrophobicContact CZ3-CB 4.43Å; W78-L81 HydrophobicContact CZ3-CD2 3.24Å; W78-L81 HydrophobicContact CZ3-CG 4.45Å; W78-L81 PolarHBondContact O-N 2.87Å; W78-L81 VanDerWaalsContact O-N 3.1Å; E79-L81 VanDerWaalsContact C-N 3.35Å; E79-L81 PolarHBondContact O-N 3.1Å; L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.32Å; L81-L84 PolarHBondContact O-N 2.78Å; L81-Q85 PolarHBondContact O-N 3.5Å |
| 82 | E | 94.4 | Very high | 94.6 | Very high | 91 Ų | 91 | 123.8 Ų | 123.8 | 43% | 0.425 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -59.6 | -44.1 | 174.1 | -73.7 | -159.9 | 177.6 | 0 | 0 | 111.7 | W78 E79 L84 Q85 R86 | W78-E82 PolarHBondContact O-N 3.07Å; E79-E82 PolarHBondContact O-N 3.33Å; E82-L84 VanDerWaalsContact C-N 3.35Å; E82-L84 PolarHBondContact O-N 3.22Å; E82-Q85 PolarHBondContact O-N 3.46Å; E82-R86 VanDerWaalsContact O-CG 3.32Å; E82-R86 WeakPolarHBondContact O-CG 3.28Å; E82-R86 PolarHBondContact O-N 2.94Å; E82-R86 IonicContact OE2-CZ 2.61Å; E82-R86 IonicContact OE2-NH2 3.68Å; E82-R86 PolarHBondContact OE2-NH2 3.43Å |
| 83 | F | 94.5 | Very high | 94.8 | Very high | 130 Ų | 130 | 125.3 Ų | 125.3 | 57% | 0.57 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -59.1 | -45.8 | 175.8 | 174.1 | -97.8 | 0 | 0 | 0 | 111.7 | E79 R80 L81 Q85 R86 K87 | E79-F83 WeakPolarHBondContact O-CB 3.32Å; E79-F83 PolarHBondContact O-N 3.36Å; R80-F83 PolarHBondContact O-N 2.96Å; L81-F83 VanDerWaalsContact C-N 3.32Å; L81-F83 PolarHBondContact O-N 3.32Å; F83-Q85 VanDerWaalsContact C-N 3.31Å; F83-Q85 PolarHBondContact O-N 2.87Å; F83-R86 PolarHBondContact O-N 3.08Å; F83-K87 HydrophobicContact CE1-CD 4.44Å; F83-K87 WeakPolarHBondContact O-CB 3.49Å; F83-K87 PolarHBondContact O-N 3.21Å |
| 84 | L | 95.5 | Very high | 94.9 | Very high | 90 Ų | 90 | 123.6 Ų | 123.6 | 47% | 0.471 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.4 | -40.1 | 176.5 | -73.7 | 171.5 | 0 | 0 | 0 | 111.8 | R80 L81 E82 K87 K88 | R80-L84 HydrophobicContact CG-CD1 4.43Å; R80-L84 VanDerWaalsContact O-CG 3.28Å; R80-L84 WeakPolarHBondContact O-CG 3.38Å; R80-L84 PolarHBondContact O-N 3.12Å; L81-L84 PolarHBondContact O-N 2.78Å; E82-L84 VanDerWaalsContact C-N 3.35Å; E82-L84 PolarHBondContact O-N 3.22Å; L84-K87 PolarHBondContact O-N 2.92Å; L84-K88 WeakPolarHBondContact O-CB 3.35Å; L84-K88 PolarHBondContact O-N 3.17Å |
| 85 | Q | 95.8 | Very high | 95.1 | Very high | 139 Ų | 139 | 123.7 Ų | 123.7 | 65% | 0.65 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -65.4 | -46.1 | 177.3 | -166.3 | -176 | 22.2 | 0 | 0 | 111.7 | L81 E82 F83 K87 K88 A89 | L81-Q85 PolarHBondContact O-N 3.5Å; E82-Q85 PolarHBondContact O-N 3.46Å; F83-Q85 VanDerWaalsContact C-N 3.31Å; F83-Q85 PolarHBondContact O-N 2.87Å; Q85-K87 PolarHBondContact O-N 2.92Å; Q85-K88 WeakPolarHBondContact O-CB 3.45Å; Q85-K88 PolarHBondContact O-N 3.45Å; Q85-A89 PolarHBondContact O-N 3Å |
| 86 | R | 95.8 | Very high | 95.4 | Very high | 169 Ų | 169 | 127.5 Ų | 127.5 | 64% | 0.638 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -61 | -44.1 | 175.4 | -68.8 | 174.6 | -165 | -175.8 | 7.2 | 111.2 | E82 F83 K88 A89 F90 | E82-R86 VanDerWaalsContact O-CG 3.32Å; E82-R86 WeakPolarHBondContact O-CG 3.28Å; E82-R86 PolarHBondContact O-N 2.94Å; E82-R86 IonicContact OE2-CZ 2.61Å; E82-R86 IonicContact OE2-NH2 3.68Å; E82-R86 PolarHBondContact OE2-NH2 3.43Å; F83-R86 PolarHBondContact O-N 3.08Å; R86-K88 PolarHBondContact O-N 3.23Å; R86-A89 PolarHBondContact O-N 3.35Å; R86-F90 PolarHBondContact O-N 2.88Å |
| 87 | K | 96.4 | Very high | 95.5 | Very high | 110 Ų | 110 | 127.5 Ų | 127.5 | 48% | 0.478 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -58.9 | -44.5 | 173.9 | -178.5 | 179.6 | 177.1 | 179.3 | 0 | 111.7 | F83 L84 Q85 A89 F90 L91 | F83-K87 HydrophobicContact CE1-CD 4.44Å; F83-K87 WeakPolarHBondContact O-CB 3.49Å; F83-K87 PolarHBondContact O-N 3.21Å; L84-K87 PolarHBondContact O-N 2.92Å; Q85-K87 PolarHBondContact O-N 2.92Å; K87-A89 VanDerWaalsContact C-N 3.35Å; K87-A89 PolarHBondContact O-N 3.45Å; K87-F90 PolarHBondContact O-N 2.89Å; K87-L91 HydrophobicContact CG-CD1 4.22Å; K87-L91 WeakPolarHBondContact O-CG 3.35Å; K87-L91 PolarHBondContact O-N 3.35Å |
| 88 | K | 97.4 | Very high | 95.5 | Very high | 157 Ų | 157 | 124.2 Ų | 124.2 | 68% | 0.683 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -61.4 | -43.1 | 177 | -173.3 | -178.7 | -175.7 | -178.5 | 0 | 111.5 | L84 Q85 R86 L91 R92 | L84-K88 WeakPolarHBondContact O-CB 3.35Å; L84-K88 PolarHBondContact O-N 3.17Å; Q85-K88 WeakPolarHBondContact O-CB 3.45Å; Q85-K88 PolarHBondContact O-N 3.45Å; R86-K88 PolarHBondContact O-N 3.23Å; K88-L91 PolarHBondContact O-N 3.16Å; K88-R92 WeakPolarHBondContact O-CB 3.48Å; K88-R92 PolarHBondContact O-N 3.2Å |
| 89 | A | 97.3 | Very high | 95.8 | Very high | 47 Ų | 47 | 124.6 Ų | 124.6 | 39% | 0.388 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q85 R86 K87 R92 H93 | Q85-A89 PolarHBondContact O-N 3Å; R86-A89 PolarHBondContact O-N 3.35Å; K87-A89 VanDerWaalsContact C-N 3.35Å; K87-A89 PolarHBondContact O-N 3.45Å; A89-R92 WeakPolarHBondContact O-CB 3.47Å; A89-R92 PolarHBondContact O-N 3.39Å; A89-H93 PolarHBondContact O-N 3.47Å |
| 90 | F | 97.8 | Very high | 95.8 | Very high | 129 Ų | 129 | 122.2 Ų | 122.2 | 57% | 0.566 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -58.9 | -50.6 | 175 | 174.8 | -98.9 | 0 | 0 | 0 | 111.9 | R86 K87 R92 H93 V94 | R86-F90 PolarHBondContact O-N 2.88Å; K87-F90 PolarHBondContact O-N 2.89Å; F90-R92 VanDerWaalsContact C-N 3.28Å; F90-R92 PolarHBondContact O-N 3Å; F90-H93 WeakPolarHBondContact O-CA 3.45Å; F90-H93 WeakPolarHBondContact O-CB 3.35Å; F90-H93 PolarHBondContact O-N 3.1Å; F90-V94 HydrophobicContact CD1-CG2 4.23Å; F90-V94 HydrophobicContact CE1-CG2 3.75Å; F90-V94 HydrophobicContact CE2-CG2 4.08Å; F90-V94 HydrophobicContact CZ-CG2 3.67Å; F90-V94 WeakPolarHBondContact O-CG2 3.37Å; F90-V94 PolarHBondContact O-N 2.94Å |
| 91 | L | 97.5 | Very high | 95.6 | Very high | 73 Ų | 73 | 120.6 Ų | 120.6 | 38% | 0.382 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.7 | -36.9 | 178.5 | -69.7 | 175.8 | 0 | 0 | 0 | 112.3 | K87 K88 H93 V94 R95 | K87-L91 HydrophobicContact CG-CD1 4.22Å; K87-L91 WeakPolarHBondContact O-CG 3.35Å; K87-L91 PolarHBondContact O-N 3.35Å; K88-L91 PolarHBondContact O-N 3.16Å; L91-H93 VanDerWaalsContact C-N 3.33Å; L91-V94 PolarHBondContact O-N 3.48Å; L91-R95 WeakPolarHBondContact O-CB 3.48Å; L91-R95 WeakPolarHBondContact O-CG 3.42Å; L91-R95 PolarHBondContact O-N 3.32Å |
| 92 | R | 97.4 | Very high | 95.3 | Very high | 176 Ų | 176 | 120.1 Ų | 120.1 | 66% | 0.664 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.7 | -42.9 | 173.1 | -176.2 | -177.6 | 66.9 | 174 | 0.6 | 111.2 | K88 A89 F90 R96 | K88-R92 WeakPolarHBondContact O-CB 3.48Å; K88-R92 PolarHBondContact O-N 3.2Å; A89-R92 WeakPolarHBondContact O-CB 3.47Å; A89-R92 PolarHBondContact O-N 3.39Å; F90-R92 VanDerWaalsContact C-N 3.28Å; F90-R92 PolarHBondContact O-N 3Å; R92-R96 WeakPolarHBondContact O-CB 3.37Å; R92-R96 PolarHBondContact O-N 2.99Å |
| 93 | H | 97.6 | Very high | 94.8 | Very high | 102 Ų | 102 | 118.5 Ų | 118.5 | 47% | 0.472 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.2 | -49.2 | 177 | 179.5 | 81 | 0 | 0 | 0 | 111.6 | A89 F90 L91 R95 R96 R97 | A89-H93 PolarHBondContact O-N 3.47Å; F90-H93 WeakPolarHBondContact O-CA 3.45Å; F90-H93 WeakPolarHBondContact O-CB 3.35Å; F90-H93 PolarHBondContact O-N 3.1Å; L91-H93 VanDerWaalsContact C-N 3.33Å; H93-R95 PolarHBondContact O-N 3.3Å; H93-R96 PolarHBondContact O-N 3.48Å; H93-R96 VanDerWaalsContact O-N 3.16Å; H93-R97 WeakPolarHBondContact O-CG 3.34Å; H93-R97 PolarHBondContact O-N 3.34Å |
| 94 | V | 97.1 | Very high | 94.3 | Very high | 67 Ų | 67 | 116.8 Ų | 116.8 | 41% | 0.406 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -57.5 | -48 | 177.7 | 173.7 | 0 | 0 | 0 | 0 | 111.2 | F90 L91 R96 R97 H98 | F90-V94 HydrophobicContact CD1-CG2 4.23Å; F90-V94 HydrophobicContact CE1-CG2 3.75Å; F90-V94 HydrophobicContact CE2-CG2 4.08Å; F90-V94 HydrophobicContact CZ-CG2 3.67Å; F90-V94 WeakPolarHBondContact O-CG2 3.37Å; F90-V94 PolarHBondContact O-N 2.94Å; L91-V94 PolarHBondContact O-N 3.48Å; V94-R96 VanDerWaalsContact C-N 3.31Å; V94-R96 PolarHBondContact O-N 2.93Å; V94-R97 PolarHBondContact O-N 2.92Å; V94-H98 WeakPolarHBondContact O-CB 3.29Å; V94-H98 PolarHBondContact O-N 3.24Å |
| 95 | R | 96.5 | Very high | 93.6 | Very high | 135 Ų | 135 | 120.2 Ų | 120.2 | 51% | 0.509 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -59.9 | -40.7 | 177.5 | -74.4 | -168.4 | -57.8 | -102.3 | 1.7 | 112.5 | L91 H93 R99 | L91-R95 WeakPolarHBondContact O-CB 3.48Å; L91-R95 WeakPolarHBondContact O-CG 3.42Å; L91-R95 PolarHBondContact O-N 3.32Å; H93-R95 PolarHBondContact O-N 3.3Å; R95-R99 WeakPolarHBondContact O-CG 3.49Å; R95-R99 PolarHBondContact O-N 3.37Å |
| 96 | R | 95.9 | Very high | 92.4 | Very high | 162 Ų | 162 | 115.8 Ų | 115.8 | 61% | 0.611 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.4 | -49.6 | 177.3 | -178.3 | 173.2 | 177.7 | -121.4 | -0.3 | 110.9 | R92 H93 V94 H98 R99 D100 | R92-R96 WeakPolarHBondContact O-CB 3.37Å; R92-R96 PolarHBondContact O-N 2.99Å; H93-R96 PolarHBondContact O-N 3.48Å; H93-R96 VanDerWaalsContact O-N 3.16Å; V94-R96 VanDerWaalsContact C-N 3.31Å; V94-R96 PolarHBondContact O-N 2.93Å; R96-H98 VanDerWaalsContact C-N 3.29Å; R96-H98 PolarHBondContact O-N 2.97Å; R96-R99 PolarHBondContact O-N 3.03Å; R96-R99 VanDerWaalsContact O-N 3.1Å; R96-D100 IonicContact NE-OD2 3.97Å; R96-D100 PolarHBondContact O-N 2.92Å |
| 97 | R | 95.8 | Very high | 90.9 | Very high | 162 Ų | 162 | 113.9 Ų | 113.9 | 61% | 0.611 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -59.7 | -40.8 | 178.7 | -64.9 | -69.8 | -97 | -170 | -6 | 112.2 | H93 V94 D100 H101 | H93-R97 WeakPolarHBondContact O-CG 3.34Å; H93-R97 PolarHBondContact O-N 3.34Å; V94-R97 PolarHBondContact O-N 2.92Å; R97-D100 PolarHBondContact O-N 2.99Å; R97-H101 WeakPolarHBondContact O-CB 3.49Å; R97-H101 PolarHBondContact O-N 3.48Å |
| 98 | H | 94.8 | Very high | 89 | Confident | 117 Ų | 117 | 112 Ų | 112 | 54% | 0.542 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.2 | -47 | 174.5 | 177.8 | 68.3 | 0 | 0 | 0 | 111.8 | V94 R96 H101 M102 | V94-H98 WeakPolarHBondContact O-CB 3.29Å; V94-H98 PolarHBondContact O-N 3.24Å; R96-H98 VanDerWaalsContact C-N 3.29Å; R96-H98 PolarHBondContact O-N 2.97Å; H98-H101 PolarHBondContact O-N 3.45Å; H98-M102 WeakPolarHBondContact O-CB 3.44Å; H98-M102 VanDerWaalsContact O-CG 3.27Å; H98-M102 WeakPolarHBondContact O-CG 3.27Å; H98-M102 PolarHBondContact O-N 3.22Å |
| 99 | R | 91.7 | Very high | 87.3 | Confident | 182 Ų | 182 | 115.3 Ų | 115.3 | 69% | 0.687 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.7 | -45.3 | 176.4 | -73.4 | 177.7 | -179.9 | -176.8 | -2.6 | 112.4 | R95 R96 H101 M102 A103 | R95-R99 WeakPolarHBondContact O-CG 3.49Å; R95-R99 PolarHBondContact O-N 3.37Å; R96-R99 PolarHBondContact O-N 3.03Å; R96-R99 VanDerWaalsContact O-N 3.1Å; R99-H101 VanDerWaalsContact C-N 3.27Å; R99-H101 PolarHBondContact O-N 2.92Å; R99-M102 CarbonylContact O-C 3.54Å; R99-M102 PolarHBondContact O-N 3.33Å; R99-M102 VanDerWaalsContact O-N 3.12Å; R99-A103 PolarHBondContact O-N 2.96Å |
| 100 | D | 91.6 | Very high | 85.4 | Confident | 82 Ų | 82 | 120.5 Ų | 120.5 | 44% | 0.439 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -60.6 | -40.1 | 179 | -61.4 | -19.5 | 0 | 0 | 0 | 110.8 | R96 R97 A103 | R96-D100 IonicContact NE-OD2 3.97Å; R96-D100 PolarHBondContact O-N 2.92Å; R97-D100 PolarHBondContact O-N 2.99Å; D100-A103 WeakPolarHBondContact O-CB 3.46Å; D100-A103 PolarHBondContact O-N 3.06Å |
| 101 | H | 92 | Very high | 83.1 | Confident | 122 Ų | 122 | 117.8 Ų | 117.8 | 57% | 0.565 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -68.1 | -36.3 | 174.9 | 179.7 | 69.5 | 0 | 0 | 0 | 113.1 | R97 H98 R99 P104 | R97-H101 WeakPolarHBondContact O-CB 3.49Å; R97-H101 PolarHBondContact O-N 3.48Å; H98-H101 PolarHBondContact O-N 3.45Å; R99-H101 VanDerWaalsContact C-N 3.27Å; R99-H101 PolarHBondContact O-N 2.92Å; H101-P104 VanDerWaalsContact O-CD 3.31Å; H101-P104 WeakPolarHBondContact O-CD 3.27Å |
| 102 | M | 89.4 | Confident | 80.9 | Confident | 80 Ų | 80 | 126.5 Ų | 126.5 | 39% | 0.394 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -81.2 | -12.7 | 179 | -68.1 | -57.7 | -65.4 | 0 | 0 | 113.5 | H98 R99 P104 Y105 A106 | H98-M102 WeakPolarHBondContact O-CB 3.44Å; H98-M102 VanDerWaalsContact O-CG 3.27Å; H98-M102 WeakPolarHBondContact O-CG 3.27Å; H98-M102 PolarHBondContact O-N 3.22Å; R99-M102 CarbonylContact O-C 3.54Å; R99-M102 PolarHBondContact O-N 3.33Å; R99-M102 VanDerWaalsContact O-N 3.12Å; M102-P104 VanDerWaalsContact C-CD 3.46Å; M102-Y105 CarbonylContact O-C 3.54Å; M102-Y105 WeakPolarHBondContact O-CA 3.42Å; M102-Y105 PolarHBondContact O-N 3.46Å; M102-A106 PolarHBondContact O-N 3.29Å |
| 103 | A | 83.6 | Confident | 78.6 | Confident | 58 Ų | 58 | 124.7 Ų | 124.7 | 48% | 0.479 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -53.7 | -41.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | R99 D100 Y105 A106 | R99-A103 PolarHBondContact O-N 2.96Å; D100-A103 WeakPolarHBondContact O-CB 3.46Å; D100-A103 PolarHBondContact O-N 3.06Å; A103-Y105 PolarHBondContact O-N 2.93Å; A103-A106 PolarHBondContact O-N 2.96Å |
| 104 | P | 83.6 | Confident | 76.4 | Confident | 94 Ų | 94 | 125.2 Ų | 125.2 | 61% | 0.61 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -66.6 | -22.7 | 175.8 | -20.8 | 34.9 | 0 | 0 | 0 | 114 | H101 M102 | H101-P104 VanDerWaalsContact O-CD 3.31Å; H101-P104 WeakPolarHBondContact O-CD 3.27Å; M102-P104 VanDerWaalsContact C-CD 3.46Å |
| 105 | Y | 80.5 | Confident | 73.9 | Confident | 162 Ų | 162 | 127.4 Ų | 127.4 | 64% | 0.635 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -97.8 | -10.9 | -178.6 | -55.9 | -75.9 | 0 | 0 | 0 | 113 | M102 A103 V107 | M102-Y105 CarbonylContact O-C 3.54Å; M102-Y105 WeakPolarHBondContact O-CA 3.42Å; M102-Y105 PolarHBondContact O-N 3.46Å; A103-Y105 PolarHBondContact O-N 2.93Å; Y105-V107 VanDerWaalsContact C-N 3.29Å; Y105-V107 PolarHBondContact O-N 3.34Å |
| 106 | A | 70.8 | Confident | 71.8 | Confident | 46 Ų | 46 | 129.8 Ų | 129.8 | 38% | 0.38 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -73 | -20.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113 | M102 A103 G108 R109 | M102-A106 PolarHBondContact O-N 3.29Å; A103-A106 PolarHBondContact O-N 2.96Å; A106-G108 PolarHBondContact O-N 3.37Å; A106-R109 PolarHBondContact O-N 3.16Å |
| 107 | V | 63.8 | Low | 69.5 | Low | 128 Ų | 128 | 124.8 Ų | 124.8 | 78% | 0.776 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.6 | -13.2 | -175 | -174 | 0 | 0 | 0 | 0 | 113.9 | Y105 | Y105-V107 VanDerWaalsContact C-N 3.29Å; Y105-V107 PolarHBondContact O-N 3.34Å |
| 108 | G | 57.2 | Low | 67.2 | Low | 72 Ų | 72 | 122.3 Ų | 122.3 | 74% | 0.742 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.3 | -2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | A106 | A106-G108 PolarHBondContact O-N 3.37Š|
| 109 | R | 60.7 | Low | 65.1 | Low | 226 Ų | 226 | 129.3 Ų | 129.3 | 85% | 0.853 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.7 | -19.2 | -173 | -70.6 | -172.6 | -177.9 | -108.7 | 1 | 115.7 | A106 A111 | A106-R109 PolarHBondContact O-N 3.16Å; R109-A111 PolarHBondContact O-N 3.04Å |
| 110 | E | 57.6 | Low | 63.5 | Low | 155 Ų | 155 | 123.8 Ų | 123.8 | 72% | 0.724 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -96.3 | 87.2 | 171.3 | -74.4 | 78.6 | -163.6 | 0 | 0 | 111.8 | ||
| 111 | A | 49.8 | Very low | 61.8 | Low | 72 Ų | 72 | 128.2 Ų | 128.2 | 60% | 0.595 | 68% | 0.684 | S | S | * | * | trans | 158.1 | 87.2 | 140.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | R109 I113 | R109-A111 PolarHBondContact O-N 3.04Å; A111-I113 HydrophobicContact CB-CB 4.46Å; A111-I113 PolarHBondContact O-N 2.99Å | ||
| 112 | R | 51.5 | Low | 60 | Low | 256 Ų | 256 | 129.1 Ų | 129.1 | 97% | 0.966 | 69% | 0.693 | S | S | * | * | trans | -80.1 | 46 | 143 | -61.8 | -171.1 | -169.3 | -176.6 | 3.3 | 109.6 | ||||
| 113 | I | 48.5 | Very low | 58.6 | Low | 138 Ų | 138 | 132.1 Ų | 132.1 | 71% | 0.708 | 70% | 0.7 | S | S | * | * | trans | -113.1 | 102.4 | 169 | -50.9 | 176.7 | 0 | 0 | 0 | 103.8 | A111 P115 | A111-I113 HydrophobicContact CB-CB 4.46Å; A111-I113 PolarHBondContact O-N 2.99Å; I113-P115 VanDerWaalsContact O-CD 3.23Å; I113-P115 WeakPolarHBondContact O-CD 3.47Å | ||
| 114 | S | 52.4 | Low | 57.4 | Low | 114 Ų | 114 | 138.6 Ų | 138.6 | 80% | 0.797 | 72% | 0.718 | S | S | * | * | trans | -51 | 123.8 | 176.1 | -53.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 115 | P | 43.8 | Very low | 56.7 | Low | 112 Ų | 112 | 140.9 Ų | 140.9 | 73% | 0.727 | 71% | 0.714 | S | S | * | * | trans | -94.7 | 100 | 147 | 20.9 | -1.4 | 0 | 0 | 0 | 105.8 | I113 G117 | I113-P115 VanDerWaalsContact O-CD 3.23Å; I113-P115 WeakPolarHBondContact O-CD 3.47Å; P115-G117 PolarHBondContact O-N 3.42Å | ||
| 116 | L | 53.6 | Low | 56.4 | Low | 186 Ų | 186 | 136.8 Ų | 136.8 | 97% | 0.974 | 71% | 0.709 | S | S | * | * | trans | -62.9 | 87.4 | 152.7 | 178.9 | 67.7 | 0 | 0 | 0 | 105.7 | ||||
| 117 | G | 46.4 | Very low | 56.8 | Low | 56 Ų | 56 | 142.3 Ų | 142.3 | 58% | 0.577 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -176.7 | 84.7 | -168 | 0 | 0 | 0 | 0 | 0 | 112.1 | P115 | P115-G117 PolarHBondContact O-N 3.42Š|
| 118 | D | 47.3 | Very low | 57.8 | Low | 110 Ų | 110 | 139 Ų | 139 | 59% | 0.588 | 71% | 0.708 | S | S | * | * | trans | 50.1 | 100.4 | 156.8 | -164.2 | 14.5 | 0 | 0 | 0 | 118.6 | S120 | D118-S120 PolarHBondContact O-N 2.91Å; D118-S120 VanDerWaalsContact OD1-CB 3.24Å; D118-S120 WeakPolarHBondContact OD1-CB 3.35Å; D118-S120 PolarHBondContact OD1-N 3.2Å; D118-S120 PolarHBondContact OD1-OG 2.97Å; D118-S120 PolarHBondContact OD2-OG 3.47Å | ||
| 119 | R | 51.6 | Low | 58.7 | Low | 265 Ų | 265 | 146.2 Ų | 146.2 | 100% | 1 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | 15.4 | 172.8 | -95.1 | -180 | 162.2 | -174 | -4 | 115 | ||
| 120 | S | 57.1 | Low | 59.5 | Low | 66 Ų | 66 | 143 Ų | 143 | 46% | 0.462 | 70% | 0.702 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.8 | -20.2 | -170.2 | 78.1 | 0 | 0 | 0 | 0 | 115.8 | D118 N122 | D118-S120 PolarHBondContact O-N 2.91Å; D118-S120 VanDerWaalsContact OD1-CB 3.24Å; D118-S120 WeakPolarHBondContact OD1-CB 3.35Å; D118-S120 PolarHBondContact OD1-N 3.2Å; D118-S120 PolarHBondContact OD1-OG 2.97Å; D118-S120 PolarHBondContact OD2-OG 3.47Å; S120-N122 PolarHBondContact O-N 3.4Å |
| 121 | Q | 57.3 | Low | 60.6 | Low | 175 Ų | 175 | 138 Ų | 138 | 82% | 0.818 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -85.7 | -10.6 | -163.5 | -68.7 | -173.4 | 24.2 | 0 | 0 | 116.4 | ||
| 122 | N | 54.3 | Low | 61.8 | Low | 140 Ų | 140 | 140.6 Ų | 140.6 | 75% | 0.749 | 68% | 0.684 | S | S | * | * | trans | -113.5 | 58.5 | 179.4 | -134.4 | -17.9 | 0 | 0 | 0 | 112.1 | S120 | S120-N122 PolarHBondContact O-N 3.4Š| ||
| 123 | R | 60.1 | Low | 62.9 | Low | 143 Ų | 143 | 132.7 Ų | 132.7 | 54% | 0.54 | 67% | 0.668 | S | S | . | * | trans | -109.2 | 81.1 | 167.4 | -97.9 | -175.2 | -174.8 | -139.5 | -0.1 | 108.8 | R125 | R123-R125 HydrophobicContact CB-CG 4.07Å; R123-R125 PolarHBondContact O-N 3.5Å | ||
| 124 | F | 58.3 | Low | 63.9 | Low | 195 Ų | 195 | 131.6 Ų | 131.6 | 86% | 0.855 | 66% | 0.659 | S | S | * | * | trans | -60 | 97 | 151.3 | -74.4 | -82.6 | 0 | 0 | 0 | 106.8 | C126 | F124-C126 PolarHBondContact O-N 2.93Š| ||
| 125 | R | 68.3 | Low | 64.8 | Low | 141 Ų | 141 | 131.7 Ų | 131.7 | 53% | 0.532 | 64% | 0.642 | S | S | . | * | trans | -79.8 | 107.5 | 179.4 | -66.9 | 177.6 | -179.3 | -126.1 | 1.5 | 105.8 | R123 E127 R135 | R123-R125 HydrophobicContact CB-CG 4.07Å; R123-R125 PolarHBondContact O-N 3.5Å; R125-E127 PolarHBondContact O-N 3.11Å; R125-R135 VanDerWaalsContact CD-NH2 3.3Å; R125-R135 VanDerWaalsContact NH1-CZ 3.32Å | ||
| 126 | C | 74 | Confident | 65.8 | Low | 77 Ų | 77 | 131 Ų | 131 | 52% | 0.52 | 64% | 0.638 | S | S | . | * | trans | -60.6 | 122.5 | 170.6 | -176.1 | 0 | 0 | 0 | 0 | 109 | F124 C128 C131 | F124-C126 PolarHBondContact O-N 2.93Å; C126-C128 VanDerWaalsContact C-N 3.33Å; C126-C128 PolarHBondContact SG-SG 3.33Å; C126-C131 HydrophobicContact CB-CB 3.98Å; C126-C131 WeakPolarHBondContact O-CB 3.38Å; C126-C131 VanDerWaalsContact SG-SG 3.67Å | ||
| 127 | E | 79.5 | Confident | 65.9 | Low | 162 Ų | 162 | 129 Ų | 129 | 76% | 0.757 | 63% | 0.628 | S | S | * | * | trans | -90 | 4.7 | -178.3 | -64.6 | -178.7 | 173.3 | 0 | 0 | 112.9 | R125 Q132 | R125-E127 PolarHBondContact O-N 3.11Å; E127-Q132 PolarHBondContact O-NE2 3.34Å | ||
| 128 | C | 84 | Confident | 66.3 | Low | 57 Ų | 57 | 133.2 Ų | 133.2 | 39% | 0.385 | 64% | 0.637 | S | S | . | * | S | Bend | trans | -64.7 | 150 | 179.2 | 80.8 | 0 | 0 | 0 | 0 | 111.3 | C126 Y130 C131 Q132 | C126-C128 VanDerWaalsContact C-N 3.33Å; C126-C128 PolarHBondContact SG-SG 3.33Å; C128-Y130 PolarHBondContact O-N 3.48Å; C128-Y130 VanDerWaalsContact O-N 3.08Å; C128-C131 PolarHBondContact O-N 2.87Å; C128-C131 PolarHBondContact SG-N 3.03Å; C128-C131 VanDerWaalsContact SG-N 3.44Å; C128-C131 PolarHBondContact SG-SG 3.12Å; C128-Q132 PolarHBondContact O-N 3.1Å; C128-Q132 VanDerWaalsContact O-N 3.13Å |
| 129 | R | 76.4 | Confident | 66.9 | Low | 225 Ų | 225 | 133.4 Ų | 133.4 | 85% | 0.849 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -54.2 | -33.4 | -178.1 | -75.1 | -169.3 | 174 | -175.6 | -0.8 | 113.1 | Q132 S133 | R129-Q132 PolarHBondContact O-N 2.99Å; R129-S133 PolarHBondContact O-N 3.38Å; R129-S133 VanDerWaalsContact O-N 3.1Å; R129-S133 PolarHBondContact O-OG 2.92Å |
| 130 | Y | 77.1 | Confident | 66.3 | Low | 157 Ų | 157 | 123.8 Ų | 123.8 | 62% | 0.616 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -65.3 | -47.4 | 177.5 | -179.1 | -98.5 | 0 | 0 | 0 | 112.6 | C128 Q132 S133 H134 | C128-Y130 PolarHBondContact O-N 3.48Å; C128-Y130 VanDerWaalsContact O-N 3.08Å; Y130-Q132 VanDerWaalsContact C-N 3.29Å; Y130-Q132 PolarHBondContact O-N 3.36Å; Y130-S133 PolarHBondContact O-N 3.48Å; Y130-S133 PolarHBondContact O-OG 3.29Å; Y130-H134 AromaticContact CE2-CD2 3.77Å; Y130-H134 AromaticContact CE2-NE2 3.86Å; Y130-H134 PolarHBondContact O-N 2.89Å; Y130-H134 VanDerWaalsContact O-N 3.13Å |
| 131 | C | 80.7 | Confident | 65.7 | Low | 52 Ų | 52 | 128 Ų | 128 | 35% | 0.351 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -70.4 | -26.1 | 178.7 | -68.2 | 0 | 0 | 0 | 0 | 113.1 | C126 C128 | C126-C131 HydrophobicContact CB-CB 3.98Å; C126-C131 WeakPolarHBondContact O-CB 3.38Å; C126-C131 VanDerWaalsContact SG-SG 3.67Å; C128-C131 PolarHBondContact O-N 2.87Å; C128-C131 PolarHBondContact SG-N 3.03Å; C128-C131 VanDerWaalsContact SG-N 3.44Å; C128-C131 PolarHBondContact SG-SG 3.12Å |
| 132 | Q | 76.3 | Confident | 65.3 | Low | 125 Ų | 125 | 126.4 Ų | 126.4 | 58% | 0.584 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -70.9 | -43.4 | 172.9 | -66.2 | -175.3 | 28.1 | 0 | 0 | 112 | E127 C128 R129 Y130 R135 | E127-Q132 PolarHBondContact O-NE2 3.34Å; C128-Q132 PolarHBondContact O-N 3.1Å; C128-Q132 VanDerWaalsContact O-N 3.13Å; R129-Q132 PolarHBondContact O-N 2.99Å; Y130-Q132 VanDerWaalsContact C-N 3.29Å; Y130-Q132 PolarHBondContact O-N 3.36Å; Q132-R135 PolarHBondContact O-N 2.63Å |
| 133 | S | 73.6 | Confident | 64.9 | Low | 91 Ų | 91 | 122.5 Ų | 122.5 | 64% | 0.636 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -75.6 | -25.3 | -176.6 | 37.6 | 0 | 0 | 0 | 0 | 113.7 | R129 Y130 | R129-S133 PolarHBondContact O-N 3.38Å; R129-S133 VanDerWaalsContact O-N 3.1Å; R129-S133 PolarHBondContact O-OG 2.92Å; Y130-S133 PolarHBondContact O-N 3.48Å; Y130-S133 PolarHBondContact O-OG 3.29Å |
| 134 | H | 70.4 | Confident | 64.3 | Low | 114 Ų | 114 | 124.3 Ų | 124.3 | 53% | 0.528 | 66% | 0.658 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.6 | 12.2 | 176.2 | -78.3 | -89.2 | 0 | 0 | 0 | 114.1 | Y130 P136 | Y130-H134 AromaticContact CE2-CD2 3.77Å; Y130-H134 AromaticContact CE2-NE2 3.86Å; Y130-H134 PolarHBondContact O-N 2.89Å; Y130-H134 VanDerWaalsContact O-N 3.13Å; H134-P136 VanDerWaalsContact O-CD 3.28Å; H134-P136 WeakPolarHBondContact O-CD 3.31Å |
| 135 | R | 70.3 | Confident | 63.6 | Low | 116 Ų | 116 | 119.5 Ų | 119.5 | 44% | 0.438 | 65% | 0.648 | S | S | . | * | trans | -72.7 | 119.6 | 179.4 | -154.1 | -176.7 | -157.5 | 141.4 | 26.3 | 109.7 | R125 Q132 N137 | R125-R135 VanDerWaalsContact CD-NH2 3.3Å; R125-R135 VanDerWaalsContact NH1-CZ 3.32Å; Q132-R135 PolarHBondContact O-N 2.63Å; R135-N137 PolarHBondContact O-N 2.88Å | ||
| 136 | P | 64.7 | Low | 62.6 | Low | 97 Ų | 97 | 120.2 Ų | 120.2 | 63% | 0.63 | 66% | 0.663 | S | S | * | * | trans | -66.7 | 125.1 | 171.6 | 13.2 | -8.8 | 0 | 0 | 0 | 108.3 | H134 L138 | H134-P136 VanDerWaalsContact O-CD 3.28Å; H134-P136 WeakPolarHBondContact O-CD 3.31Å; P136-L138 PolarHBondContact O-N 2.85Å | ||
| 137 | N | 55.8 | Low | 61.5 | Low | 146 Ų | 146 | 126.9 Ų | 126.9 | 78% | 0.781 | 68% | 0.677 | S | S | * | * | trans | -63.4 | 97.8 | 171.5 | -77.1 | -42.5 | 0 | 0 | 0 | 108 | R135 S139 | R135-N137 PolarHBondContact O-N 2.88Å; N137-S139 PolarHBondContact O-N 3.3Å; N137-S139 VanDerWaalsContact O-N 3.16Å | ||
| 138 | L | 55.8 | Low | 60.4 | Low | 144 Ų | 144 | 123.3 Ų | 123.3 | 75% | 0.754 | 68% | 0.675 | S | S | * | * | trans | -78.8 | 18 | 173.5 | -64.9 | 174.2 | 0 | 0 | 0 | 112.2 | P136 | P136-L138 PolarHBondContact O-N 2.85Š| ||
| 139 | S | 59.8 | Low | 59.2 | Low | 113 Ų | 113 | 126.6 Ų | 126.6 | 79% | 0.79 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -123 | 95.9 | 176.4 | 169 | 0 | 0 | 0 | 0 | 106.6 | N137 | N137-S139 PolarHBondContact O-N 3.3Å; N137-S139 VanDerWaalsContact O-N 3.16Å |
| 140 | G | 39.7 | Very low | 58.2 | Low | 63 Ų | 63 | 123.5 Ų | 123.5 | 65% | 0.649 | 69% | 0.691 | S | S | * | * | S | Bend | trans | 143.9 | 97.4 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 141 | I | 42.4 | Very low | 57.2 | Low | 155 Ų | 155 | 119.6 Ų | 119.6 | 80% | 0.795 | 68% | 0.684 | S | S | * | * | trans | 25.1 | 127.4 | 147.7 | -49.9 | -175.4 | 0 | 0 | 0 | 117 | G143 | I141-G143 PolarHBondContact O-N 3.23Š| ||
| 142 | P | 49.1 | Very low | 56.2 | Low | 141 Ų | 141 | 120.3 Ų | 120.3 | 92% | 0.916 | 69% | 0.69 | S | S | * | * | trans | -74.3 | 81 | 174.6 | 33.6 | -32.2 | 0 | 0 | 0 | 109.6 | ||||
| 143 | G | 46 | Very low | 55.6 | Low | 58 Ų | 58 | 119.1 Ų | 119.1 | 60% | 0.598 | 70% | 0.695 | S | S | * | * | trans | -124.3 | 97.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | I141 S145 | I141-G143 PolarHBondContact O-N 3.23Å; G143-S145 PolarHBondContact O-N 3.21Å | ||
| 144 | E | 48.2 | Very low | 55.1 | Low | 182 Ų | 182 | 122.9 Ų | 122.9 | 85% | 0.85 | 70% | 0.696 | S | S | * | * | trans | 40.8 | 81 | 143.2 | -159.2 | 163.5 | -166.5 | 0 | 0 | 116.5 | ||||
| 145 | S | 44.5 | Very low | 55 | Low | 93 Ų | 93 | 121.6 Ų | 121.6 | 65% | 0.65 | 69% | 0.69 | S | S | * | * | trans | -113.4 | 104.4 | 159.4 | 160.5 | 0 | 0 | 0 | 0 | 108 | G143 R147 | G143-S145 PolarHBondContact O-N 3.21Å; S145-R147 PolarHBondContact O-N 2.9Å | ||
| 146 | N | 46.4 | Very low | 54.9 | Low | 157 Ų | 157 | 120 Ų | 120 | 84% | 0.84 | 69% | 0.694 | S | S | * | * | trans | -57.8 | 72.9 | 164.3 | -75.8 | -58.8 | 0 | 0 | 0 | 111 | ||||
| 147 | R | 51 | Low | 55.2 | Low | 217 Ų | 217 | 120.1 Ų | 120.1 | 82% | 0.819 | 69% | 0.688 | S | S | * | * | trans | -113.9 | 121 | 169.2 | -123.9 | 175.2 | -174.2 | 163.4 | 2.1 | 106.8 | S145 | S145-R147 PolarHBondContact O-N 2.9Š| ||
| 148 | A | 57.2 | Low | 55.9 | Low | 87 Ų | 87 | 116.5 Ų | 116.5 | 72% | 0.719 | 67% | 0.671 | S | S | * | * | trans | -44.8 | 137.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | H150 | A148-H150 PolarHBondContact O-N 3.49Š| ||
| 149 | P | 57.7 | Low | 56.7 | Low | 125 Ų | 125 | 116 Ų | 116 | 81% | 0.812 | 67% | 0.665 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 122.1 | 178.5 | 0.2 | -2.8 | 0 | 0 | 0 | 107.8 | P151 | P149-P151 WeakPolarHBondContact O-CD 3.47Å; P149-P151 VanDerWaalsContact O-N 3.09Å |
| 150 | H | 56.6 | Low | 57.1 | Low | 161 Ų | 161 | 113 Ų | 113 | 75% | 0.745 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 121.5 | 176.9 | -148.7 | -67.3 | 0 | 0 | 0 | 106.4 | A148 S152 | A148-H150 PolarHBondContact O-N 3.49Å; H150-S152 PolarHBondContact O-N 3.42Å |
| 151 | P | 55.7 | Low | 58.6 | Low | 74 Ų | 74 | 115.2 Ų | 115.2 | 48% | 0.481 | 65% | 0.648 | S | S | . | * | P | Polyproline II helix | trans | -58.1 | 133.6 | -177 | 21.1 | -30.5 | 0 | 0 | 0 | 108 | P149 S153 E155 | P149-P151 WeakPolarHBondContact O-CD 3.47Å; P149-P151 VanDerWaalsContact O-N 3.09Å; P151-S153 PolarHBondContact O-N 3.49Å; P151-E155 HydrophobicContact CB-CB 4.42Å |
| 152 | S | 58.6 | Low | 59.7 | Low | 68 Ų | 68 | 112.5 Ų | 112.5 | 48% | 0.476 | 64% | 0.643 | S | S | . | * | trans | -43.9 | 131.2 | 168.7 | 7.9 | 0 | 0 | 0 | 0 | 107.7 | H150 W154 E155 | H150-S152 PolarHBondContact O-N 3.42Å; S152-W154 PolarHBondContact O-N 3.44Å; S152-E155 WeakPolarHBondContact CB-OE2 3.44Å; S152-E155 PolarHBondContact O-N 3.24Å; S152-E155 PolarHBondContact OG-OE2 3.49Å | ||
| 153 | S | 63.7 | Low | 60.4 | Low | 100 Ų | 100 | 108.5 Ų | 108.5 | 70% | 0.699 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -53.3 | -21.3 | -179.4 | 54.8 | 0 | 0 | 0 | 0 | 113.2 | P151 L157 | P151-S153 PolarHBondContact O-N 3.49Å; S153-L157 PolarHBondContact O-N 3.13Å |
| 154 | W | 62.5 | Low | 61.5 | Low | 169 Ų | 169 | 111.4 Ų | 111.4 | 64% | 0.64 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -67.9 | -44.5 | 172.2 | -173.6 | -112.1 | 0 | 0 | 0 | 114 | S152 T156 L157 V158 | S152-W154 PolarHBondContact O-N 3.44Å; W154-T156 VanDerWaalsContact C-N 3.27Å; W154-T156 PolarHBondContact O-N 3.02Å; W154-L157 HydrophobicContact CE3-CD1 4.44Å; W154-L157 WeakPolarHBondContact O-CB 3.49Å; W154-L157 PolarHBondContact O-N 3.4Å; W154-L157 VanDerWaalsContact O-N 3.11Å; W154-V158 HydrophobicContact CD2-CG2 4.21Å; W154-V158 HydrophobicContact CG-CG2 4.46Å; W154-V158 HydrophobicContact CZ2-CG2 4.02Å; W154-V158 WeakPolarHBondContact O-CG2 3.47Å; W154-V158 PolarHBondContact O-N 3.06Å |
| 155 | E | 68.7 | Low | 62.1 | Low | 88 Ų | 88 | 108.8 Ų | 108.8 | 41% | 0.411 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -59.1 | -40.1 | 177.1 | -106.6 | 67.3 | -149.5 | 0 | 0 | 111.5 | P151 S152 L157 V158 Q159 | P151-E155 HydrophobicContact CB-CB 4.42Å; S152-E155 WeakPolarHBondContact CB-OE2 3.44Å; S152-E155 PolarHBondContact O-N 3.24Å; S152-E155 PolarHBondContact OG-OE2 3.49Å; E155-L157 VanDerWaalsContact C-N 3.35Å; E155-L157 PolarHBondContact O-N 3.17Å; E155-V158 PolarHBondContact O-N 2.65Å; E155-Q159 WeakPolarHBondContact O-CB 3.5Å; E155-Q159 VanDerWaalsContact O-CG 3.27Å; E155-Q159 WeakPolarHBondContact O-CG 3.28Å; E155-Q159 PolarHBondContact O-N 3.08Å |
| 156 | T | 68.7 | Low | 62.8 | Low | 83 Ų | 83 | 112.5 Ų | 112.5 | 51% | 0.509 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -66.4 | -36.4 | 177.1 | -48.4 | 0 | 0 | 0 | 0 | 112.2 | W154 G160 | W154-T156 VanDerWaalsContact C-N 3.27Å; W154-T156 PolarHBondContact O-N 3.02Å; T156-G160 PolarHBondContact O-N 2.8Å |
| 157 | L | 70.6 | Confident | 63.4 | Low | 99 Ų | 99 | 110.3 Ų | 110.3 | 52% | 0.518 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -68.4 | -43.8 | 175.6 | -90.1 | 162.1 | 0 | 0 | 0 | 111.6 | S153 W154 E155 Q159 G160 L161 | S153-L157 PolarHBondContact O-N 3.13Å; W154-L157 HydrophobicContact CE3-CD1 4.44Å; W154-L157 WeakPolarHBondContact O-CB 3.49Å; W154-L157 PolarHBondContact O-N 3.4Å; W154-L157 VanDerWaalsContact O-N 3.11Å; E155-L157 VanDerWaalsContact C-N 3.35Å; E155-L157 PolarHBondContact O-N 3.17Å; L157-Q159 VanDerWaalsContact C-N 3.32Å; L157-Q159 PolarHBondContact O-N 3.1Å; L157-G160 PolarHBondContact O-N 3.23Å; L157-L161 VanDerWaalsContact O-CG 3.29Å; L157-L161 WeakPolarHBondContact O-CG 3.23Å; L157-L161 PolarHBondContact O-N 3.49Å |
| 158 | V | 71.7 | Confident | 63.4 | Low | 70 Ų | 70 | 108.1 Ų | 108.1 | 42% | 0.424 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -64.1 | -40.3 | 178.5 | 175.3 | 0 | 0 | 0 | 0 | 110.7 | W154 E155 L161 S162 | W154-V158 HydrophobicContact CD2-CG2 4.21Å; W154-V158 HydrophobicContact CG-CG2 4.46Å; W154-V158 HydrophobicContact CZ2-CG2 4.02Å; W154-V158 WeakPolarHBondContact O-CG2 3.47Å; W154-V158 PolarHBondContact O-N 3.06Å; E155-V158 PolarHBondContact O-N 2.65Å; V158-L161 PolarHBondContact O-N 3.13Å; V158-S162 PolarHBondContact O-N 3.35Å; V158-S162 PolarHBondContact O-OG 3.29Å |
| 159 | Q | 72.8 | Confident | 62.9 | Low | 133 Ų | 133 | 107.3 Ų | 107.3 | 62% | 0.621 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -69.6 | -32.6 | 174.1 | -70.6 | 174 | 19.1 | 0 | 0 | 113.2 | E155 L157 L161 S162 | E155-Q159 WeakPolarHBondContact O-CB 3.5Å; E155-Q159 VanDerWaalsContact O-CG 3.27Å; E155-Q159 WeakPolarHBondContact O-CG 3.28Å; E155-Q159 PolarHBondContact O-N 3.08Å; L157-Q159 VanDerWaalsContact C-N 3.32Å; L157-Q159 PolarHBondContact O-N 3.1Å; Q159-L161 VanDerWaalsContact C-N 3.32Å; Q159-S162 WeakPolarHBondContact CA-OG 3.24Å; Q159-S162 PolarHBondContact O-OG 2.86Å |
| 160 | G | 68.1 | Low | 62.4 | Low | 49 Ų | 49 | 107.7 Ų | 107.7 | 51% | 0.505 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -69.4 | -30.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | T156 L157 | T156-G160 PolarHBondContact O-N 2.8Å; L157-G160 PolarHBondContact O-N 3.23Å |
| 161 | L | 70.9 | Confident | 62.2 | Low | 110 Ų | 110 | 107.8 Ų | 107.8 | 58% | 0.576 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -86.5 | -26.4 | 179.7 | -68.4 | 171.1 | 0 | 0 | 0 | 113.1 | L157 V158 Q159 G163 L164 | L157-L161 VanDerWaalsContact O-CG 3.29Å; L157-L161 WeakPolarHBondContact O-CG 3.23Å; L157-L161 PolarHBondContact O-N 3.49Å; V158-L161 PolarHBondContact O-N 3.13Å; Q159-L161 VanDerWaalsContact C-N 3.32Å; L161-G163 PolarHBondContact O-N 2.73Å; L161-L164 HydrophobicContact CD2-CD1 3.87Å; L161-L164 PolarHBondContact O-N 2.86Å; L161-L164 VanDerWaalsContact O-N 3.16Å |
| 162 | S | 66.1 | Low | 62.2 | Low | 99 Ų | 99 | 112.4 Ų | 112.4 | 69% | 0.692 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | -14.8 | 178.2 | 54.8 | 0 | 0 | 0 | 0 | 113.8 | V158 Q159 | V158-S162 PolarHBondContact O-N 3.35Å; V158-S162 PolarHBondContact O-OG 3.29Å; Q159-S162 WeakPolarHBondContact CA-OG 3.24Å; Q159-S162 PolarHBondContact O-OG 2.86Å |
| 163 | G | 63.8 | Low | 61.7 | Low | 57 Ų | 57 | 114.9 Ų | 114.9 | 59% | 0.588 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -5.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.6 | L161 T165 | L161-G163 PolarHBondContact O-N 2.73Å; G163-T165 PolarHBondContact O-N 3.25Å |
| 164 | L | 68.3 | Low | 60.7 | Low | 118 Ų | 118 | 113.2 Ų | 113.2 | 62% | 0.618 | 67% | 0.672 | S | S | * | * | trans | -89.7 | 82.8 | -175.8 | -63.1 | 179.4 | 0 | 0 | 0 | 111.2 | L161 L166 | L161-L164 HydrophobicContact CD2-CD1 3.87Å; L161-L164 PolarHBondContact O-N 2.86Å; L161-L164 VanDerWaalsContact O-N 3.16Å; L164-L166 PolarHBondContact O-N 2.92Å | ||
| 165 | T | 61.3 | Low | 60.1 | Low | 128 Ų | 128 | 111.4 Ų | 111.4 | 79% | 0.785 | 68% | 0.682 | S | S | * | * | trans | -74.4 | 102 | 161.7 | 18.1 | 0 | 0 | 0 | 0 | 108.3 | G163 S167 | G163-T165 PolarHBondContact O-N 3.25Å; T165-S167 VanDerWaalsContact C-N 3.34Å; T165-S167 PolarHBondContact O-N 3.48Å | ||
| 166 | L | 59.5 | Low | 59.1 | Low | 170 Ų | 170 | 114.9 Ų | 114.9 | 89% | 0.89 | 70% | 0.702 | S | S | * | * | trans | -65.2 | 94.2 | 173.7 | -67.1 | 173.7 | 0 | 0 | 0 | 109.2 | L164 L168 | L164-L166 PolarHBondContact O-N 2.92Å; L166-L168 PolarHBondContact O-N 3.16Å; L166-L168 VanDerWaalsContact O-N 3.16Å | ||
| 167 | S | 58.4 | Low | 58.1 | Low | 112 Ų | 112 | 116.7 Ų | 116.7 | 78% | 0.783 | 72% | 0.716 | S | S | * | * | trans | -73.7 | 103.3 | 170.9 | -62.2 | 0 | 0 | 0 | 0 | 107.9 | T165 G169 | T165-S167 VanDerWaalsContact C-N 3.34Å; T165-S167 PolarHBondContact O-N 3.48Å; S167-G169 PolarHBondContact O-N 2.92Å | ||
| 168 | L | 51.3 | Low | 56.9 | Low | 171 Ų | 171 | 120.9 Ų | 120.9 | 90% | 0.895 | 73% | 0.733 | S | S | * | * | trans | -65.3 | 99 | 173.8 | -163 | 73.3 | 0 | 0 | 0 | 107.7 | L166 T170 | L166-L168 PolarHBondContact O-N 3.16Å; L166-L168 VanDerWaalsContact O-N 3.16Å; L168-T170 PolarHBondContact O-N 3.26Å; L168-T170 VanDerWaalsContact O-N 3.1Å | ||
| 169 | G | 46.6 | Very low | 55.2 | Low | 69 Ų | 69 | 122 Ų | 122 | 71% | 0.711 | 75% | 0.75 | S | S | * | * | trans | -55.5 | 112.4 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | S167 | S167-G169 PolarHBondContact O-N 2.92Š| ||
| 170 | T | 46.5 | Very low | 53.5 | Low | 133 Ų | 133 | 120.4 Ų | 120.4 | 82% | 0.816 | 76% | 0.759 | S | S | * | * | trans | -91.4 | 123.4 | 152.2 | 44.9 | 0 | 0 | 0 | 0 | 107 | L168 Q172 | L168-T170 PolarHBondContact O-N 3.26Å; L168-T170 VanDerWaalsContact O-N 3.1Å; T170-Q172 PolarHBondContact O-N 3.45Å; T170-Q172 VanDerWaalsContact O-N 3.1Å | ||
| 171 | N | 53.7 | Low | 52.5 | Low | 164 Ų | 164 | 126.2 Ų | 126.2 | 88% | 0.877 | 78% | 0.777 | S | S | * | * | trans | -61.1 | 107.4 | -179 | -68.9 | -78.6 | 0 | 0 | 0 | 110.8 | ||||
| 172 | Q | 55.3 | Low | 50.9 | Low | 170 Ų | 170 | 129.3 Ų | 129.3 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | -142.9 | 133.2 | 155.6 | -80.6 | -67.2 | 18.9 | 0 | 0 | 109.7 | T170 G174 | T170-Q172 PolarHBondContact O-N 3.45Å; T170-Q172 VanDerWaalsContact O-N 3.1Å; Q172-G174 PolarHBondContact O-N 2.79Å | ||
| 173 | P | 47.7 | Very low | 49.9 | Very low | 121 Ų | 121 | 130.3 Ų | 130.3 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 119.7 | 168.7 | 24.5 | -20.5 | 0 | 0 | 0 | 109.3 | ||
| 174 | G | 43.2 | Very low | 48.7 | Very low | 65 Ų | 65 | 139.9 Ų | 139.9 | 67% | 0.67 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 152.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q172 | Q172-G174 PolarHBondContact O-N 2.79Š|
| 175 | P | 49.8 | Very low | 47.7 | Very low | 131 Ų | 131 | 141 Ų | 141 | 85% | 0.851 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 140.9 | -179.1 | 30 | -32.9 | 0 | 0 | 0 | 111.4 | ||
| 176 | L | 46.6 | Very low | 47 | Very low | 160 Ų | 160 | 141.7 Ų | 141.7 | 84% | 0.838 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 134.2 | 172.7 | -169.5 | 100.5 | 0 | 0 | 0 | 110.1 | E178 | L176-E178 PolarHBondContact O-N 2.66Å; L176-E178 VanDerWaalsContact O-N 3.12Å |
| 177 | P | 48.6 | Very low | 46.3 | Very low | 122 Ų | 122 | 140.1 Ų | 140.1 | 79% | 0.792 | 83% | 0.832 | S | S | * | * | trans | -71.4 | 110.9 | 174.7 | 26.6 | -30.6 | 0 | 0 | 0 | 110.4 | ||||
| 178 | E | 44.4 | Very low | 45.6 | Very low | 187 Ų | 187 | 141.8 Ų | 141.8 | 87% | 0.874 | 84% | 0.835 | S | S | * | * | trans | -75.5 | 114.4 | 163.1 | -174 | 161 | 158.7 | 0 | 0 | 109.1 | L176 | L176-E178 PolarHBondContact O-N 2.66Å; L176-E178 VanDerWaalsContact O-N 3.12Å | ||
| 179 | A | 36.9 | Very low | 45.3 | Very low | 94 Ų | 94 | 139.9 Ų | 139.9 | 78% | 0.777 | 83% | 0.831 | S | S | * | * | trans | 160.5 | 115.7 | 136.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 180 | A | 36.8 | Very low | 45.2 | Very low | 99 Ų | 99 | 144.7 Ų | 144.7 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | -162.2 | 84.1 | 125 | 0 | 0 | 0 | 0 | 0 | 107.9 | Q182 | A180-Q182 PolarHBondContact O-N 3.2Š| |||
| 181 | L | 46 | Very low | 45.1 | Very low | 171 Ų | 171 | 145.5 Ų | 145.5 | 90% | 0.895 | 84% | 0.841 | S | S | * | * | trans | -64.8 | 117.8 | 159 | -74.8 | 166.6 | 0 | 0 | 0 | 107.6 | ||||
| 182 | Q | 39.1 | Very low | 44.4 | Very low | 174 Ų | 174 | 144.1 Ų | 144.1 | 81% | 0.813 | 84% | 0.838 | S | S | * | * | trans | -65.2 | 147 | 159.3 | -83 | -125.3 | 6.5 | 0 | 0 | 109.8 | A180 | A180-Q182 PolarHBondContact O-N 3.2Š| ||
| 183 | P | 43.8 | Very low | 43.5 | Very low | 121 Ų | 121 | 141.9 Ų | 141.9 | 79% | 0.786 | 84% | 0.842 | S | S | * | * | -128.6 | 156.2 | 129.2 | 26.1 | -9.6 | 0 | 0 | 0 | 113.2 | |||||
| 184 | Q | 39.2 | Very low | 43.1 | Very low | 258 Ų | 258 | 143.8 Ų | 143.8 | 100% | 1.206 | 85% | 0.847 | S | S | * | * | trans | -64.4 | 0 | -175.1 | -166.8 | -179.7 | 1.5 | 0 | 0 | 114.2 |
Retrieved 184 of 184 residues in 50.7 ms
(Link to these results)