| 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 | 35.2 | Very low | 37 | Very low | 228 Ų | 228 | 149.9 Ų | 149.9 | 100% | 1.123 | 82% | 0.818 | S | S | * | * | 0 | 135.8 | 0 | -65.8 | 171 | 111.2 | 0 | 0 | 107.6 | |||||
| 2 | Q | 37.3 | Very low | 36.9 | Very low | 179 Ų | 179 | 154 Ų | 154 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | trans | 30.6 | 142.8 | 136.6 | -65.8 | 176.9 | -0.6 | 0 | 0 | 119.9 | ||||
| 3 | S | 38.5 | Very low | 36.9 | Very low | 101 Ų | 101 | 153.8 Ų | 153.8 | 71% | 0.706 | 80% | 0.804 | S | S | * | * | cis | -176.9 | -171.4 | -11 | -119.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 4 | T | 41.4 | Very low | 36.2 | Very low | 121 Ų | 121 | 151.2 Ų | 151.2 | 74% | 0.742 | 80% | 0.798 | S | S | * | * | trans | 89.4 | 104.8 | 166.9 | 73.1 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 5 | M | 38 | Very low | 36.1 | Very low | 182 Ų | 182 | 147.8 Ų | 147.8 | 90% | 0.897 | 79% | 0.792 | S | S | * | * | 83.1 | 145.3 | 80 | -74.4 | 170.8 | 175.5 | 0 | 0 | 111.8 | |||||
| 6 | N | 34.5 | Very low | 36.1 | Very low | 146 Ų | 146 | 148.3 Ų | 148.3 | 78% | 0.781 | 79% | 0.787 | S | S | * | * | cis | -148.8 | 178.5 | 26.4 | -161.6 | 6.2 | 0 | 0 | 0 | 113.1 | ||||
| 7 | I | 40.1 | Very low | 35.8 | Very low | 135 Ų | 135 | 148.6 Ų | 148.6 | 69% | 0.692 | 78% | 0.783 | S | S | * | * | trans | -117.9 | 153.5 | -168.8 | -41.6 | 170.4 | 0 | 0 | 0 | 110.4 | ||||
| 8 | N | 34.2 | Very low | 35.7 | Very low | 149 Ų | 149 | 148.9 Ų | 148.9 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | 134.8 | 139.1 | 138.8 | -68.9 | -43.5 | 0 | 0 | 0 | 115.5 | ||||
| 9 | G | 33.5 | Very low | 35.4 | Very low | 77 Ų | 77 | 146.8 Ų | 146.8 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | trans | 166.6 | 65.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 10 | L | 36.7 | Very low | 35 | Very low | 143 Ų | 143 | 146.3 Ų | 146.3 | 75% | 0.749 | 78% | 0.78 | S | S | * | * | trans | -81.8 | 132.7 | 177.6 | -105.1 | 89.4 | 0 | 0 | 0 | 113.2 | ||||
| 11 | Q | 37.3 | Very low | 35.1 | Very low | 188 Ų | 188 | 145.8 Ų | 145.8 | 88% | 0.879 | 78% | 0.777 | S | S | * | * | trans | -166.7 | 107.1 | 141.7 | -144.6 | 155.6 | -15.4 | 0 | 0 | 107.9 | ||||
| 12 | R | 36.1 | Very low | 34.8 | Very low | 199 Ų | 199 | 141.4 Ų | 141.4 | 75% | 0.751 | 76% | 0.758 | S | S | * | * | 49.2 | 130 | 76.1 | -71.2 | -170.2 | -177.8 | -112.5 | 0.2 | 112.4 | |||||
| 13 | Q | 37 | Very low | 34.5 | Very low | 152 Ų | 152 | 139 Ų | 139 | 71% | 0.71 | 75% | 0.751 | S | S | * | * | cis | -167.6 | 162.3 | 33.6 | -135.3 | 173.5 | -21.8 | 0 | 0 | 114 | ||||
| 14 | T | 27.3 | Very low | 34.2 | Very low | 117 Ų | 117 | 140.9 Ų | 140.9 | 72% | 0.718 | 76% | 0.759 | S | S | * | * | trans | 63.3 | 143.1 | 152.4 | 43.9 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 15 | S | 33.8 | Very low | 34.2 | Very low | 100 Ų | 100 | 142.6 Ų | 142.6 | 70% | 0.699 | 76% | 0.762 | S | S | * | * | cis | -140.2 | 142.2 | 13.6 | -70.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 16 | Q | 36.2 | Very low | 34 | Very low | 155 Ų | 155 | 143 Ų | 143 | 72% | 0.724 | 76% | 0.759 | S | S | * | * | 59.9 | 125.5 | 84 | -108.7 | -174.4 | -58.9 | 0 | 0 | 112.8 | |||||
| 17 | E | 31.9 | Very low | 34.1 | Very low | 154 Ų | 154 | 145.3 Ų | 145.3 | 72% | 0.72 | 76% | 0.762 | S | S | * | * | cis | -143 | 144.7 | 14.6 | -73.1 | 169 | 161.9 | 0 | 0 | 110 | ||||
| 18 | N | 33.6 | Very low | 34.2 | Very low | 155 Ų | 155 | 149 Ų | 149 | 83% | 0.829 | 77% | 0.773 | S | S | * | * | 52 | 136.1 | 73.3 | -83.3 | -0.2 | 0 | 0 | 0 | 113.9 | |||||
| 19 | C | 29.3 | Very low | 34.2 | Very low | 108 Ų | 108 | 146.2 Ų | 146.2 | 73% | 0.73 | 77% | 0.771 | S | S | * | * | cis | -157.8 | -171.1 | -3.9 | 54 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 20 | N | 28.5 | Very low | 34.7 | Very low | 137 Ų | 137 | 146.9 Ų | 146.9 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | cis | -158.3 | -170.6 | 11.5 | -147.1 | -1.8 | 0 | 0 | 0 | 112.5 | ||||
| 21 | L | 36.8 | Very low | 35 | Very low | 135 Ų | 135 | 147.1 Ų | 147.1 | 71% | 0.707 | 77% | 0.77 | S | S | * | * | trans | -60.4 | 171.4 | 168.3 | -75.4 | 85.3 | 0 | 0 | 0 | 114.2 | ||||
| 22 | D | 29.8 | Very low | 34.8 | Very low | 136 Ų | 136 | 150.2 Ų | 150.2 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | cis | -160.3 | 171.1 | 32.9 | -142.6 | -24.6 | 0 | 0 | 0 | 116.6 | ||||
| 23 | N | 29.9 | Very low | 34.7 | Very low | 129 Ų | 129 | 150.2 Ų | 150.2 | 69% | 0.69 | 78% | 0.775 | S | S | * | * | trans | -70.8 | 153.2 | 177.3 | -62 | -85.3 | 0 | 0 | 0 | 113.7 | ||||
| 24 | T | 32.3 | Very low | 34.6 | Very low | 141 Ų | 141 | 153.8 Ų | 153.8 | 87% | 0.865 | 78% | 0.783 | S | S | * | * | -176.7 | 150.8 | 105.5 | 22.8 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 25 | L | 41.5 | Very low | 34.9 | Very low | 157 Ų | 157 | 159.2 Ų | 159.2 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | trans | -66.9 | 143.3 | 172.1 | -55.9 | 102.5 | 0 | 0 | 0 | 112.3 | ||||
| 26 | K | 34.2 | Very low | 34.9 | Very low | 189 Ų | 189 | 159.1 Ų | 159.1 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | 176.9 | 138.1 | 121.1 | -95.5 | 150.7 | -169.5 | 168.2 | 0 | 115.4 | |||||
| 27 | K | 36.1 | Very low | 35 | Very low | 196 Ų | 196 | 159.7 Ų | 159.7 | 85% | 0.852 | 80% | 0.796 | S | S | * | * | trans | 68.4 | 124.6 | 142.4 | -68.4 | -179.1 | 176.1 | -176.2 | 0 | 121.6 | ||||
| 28 | K | 42.9 | Very low | 35.1 | Very low | 211 Ų | 211 | 164.2 Ų | 164.2 | 92% | 0.917 | 81% | 0.807 | S | S | * | * | trans | -27.9 | 137.5 | 150.4 | -62.5 | 172.6 | 171.1 | -179.9 | 0 | 115.1 | ||||
| 29 | A | 33.3 | Very low | 34.9 | Very low | 92 Ų | 92 | 160 Ų | 160 | 76% | 0.76 | 80% | 0.8 | S | S | * | * | trans | -151.2 | 125.9 | 141.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 30 | A | 45 | Very low | 35.1 | Very low | 91 Ų | 91 | 162 Ų | 162 | 75% | 0.752 | 80% | 0.804 | S | S | * | * | trans | -85.7 | 129.6 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 31 | L | 42.3 | Very low | 35.4 | Very low | 147 Ų | 147 | 162.6 Ų | 162.6 | 77% | 0.77 | 81% | 0.807 | S | S | * | * | trans | -132.7 | 79.5 | 173.8 | -73.2 | 177.2 | 0 | 0 | 0 | 110.8 | Y33 | L31-Y33 VanDerWaalsContact C-N 3.33Å; L31-Y33 PolarHBondContact O-N 3.07Å | ||
| 32 | W | 33.3 | Very low | 35.4 | Very low | 254 Ų | 254 | 162.7 Ų | 162.7 | 96% | 0.962 | 81% | 0.808 | S | S | * | * | trans | -67.6 | 92 | 158.6 | -78 | 101.7 | 0 | 0 | 0 | 109.1 | ||||
| 33 | Y | 33 | Very low | 35.8 | Very low | 198 Ų | 198 | 167.4 Ų | 167.4 | 78% | 0.776 | 82% | 0.815 | S | S | * | * | trans | -92 | 110.5 | 174.5 | -133.1 | -81.9 | 0 | 0 | 0 | 112 | L31 | L31-Y33 VanDerWaalsContact C-N 3.33Å; L31-Y33 PolarHBondContact O-N 3.07Å | ||
| 34 | R | 36.3 | Very low | 36 | Very low | 228 Ų | 228 | 169 Ų | 169 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -76.5 | 127.7 | 173 | -173.8 | -154.3 | -61.4 | -142.8 | 5.3 | 109.3 | ||||
| 35 | R | 32.3 | Very low | 36.4 | Very low | 231 Ų | 231 | 172.4 Ų | 172.4 | 87% | 0.872 | 82% | 0.815 | S | S | * | * | trans | -153 | 150.9 | 149.3 | -130.6 | 170.9 | -174.9 | 151.2 | 2.7 | 113.6 | ||||
| 36 | S | 34 | Very low | 36.1 | Very low | 98 Ų | 98 | 172.7 Ų | 172.7 | 69% | 0.685 | 81% | 0.812 | S | S | * | * | trans | -142 | 149.1 | -173.2 | -171 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 37 | L | 39.5 | Very low | 36.1 | Very low | 167 Ų | 167 | 170.2 Ų | 170.2 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | trans | 67.5 | 124.2 | 163.4 | -67.7 | 164.5 | 0 | 0 | 0 | 121.2 | ||||
| 38 | R | 33.2 | Very low | 36.2 | Very low | 248 Ų | 248 | 167 Ų | 167 | 94% | 0.936 | 81% | 0.806 | S | S | * | * | trans | 128 | 129.9 | 152.5 | -167.2 | -178.4 | -64.1 | -112.5 | 4.4 | 110.2 | ||||
| 39 | G | 30.5 | Very low | 35.8 | Very low | 66 Ų | 66 | 161.9 Ų | 161.9 | 68% | 0.68 | 80% | 0.796 | S | S | * | * | cis | 159.8 | 107.3 | -5.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 40 | N | 33 | Very low | 36.2 | Very low | 152 Ų | 152 | 164.4 Ų | 164.4 | 81% | 0.813 | 80% | 0.802 | S | S | * | * | trans | 32.1 | 125.2 | 170.4 | -78.2 | 8.8 | 0 | 0 | 0 | 121.6 | ||||
| 41 | N | 33.9 | Very low | 36.2 | Very low | 149 Ų | 149 | 167.2 Ų | 167.2 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | -173.6 | 120.2 | 100.9 | -91.2 | -20.9 | 0 | 0 | 0 | 113.8 | |||||
| 42 | D | 36.4 | Very low | 36.2 | Very low | 136 Ų | 136 | 165.8 Ų | 165.8 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | 43.4 | 105.3 | 132.2 | -102 | -6.9 | 0 | 0 | 0 | 122.1 | ||||
| 43 | R | 38 | Very low | 36.9 | Very low | 235 Ų | 235 | 164.7 Ų | 164.7 | 89% | 0.887 | 80% | 0.799 | S | S | * | * | 169.9 | 164.1 | 99.7 | -90.8 | 168.3 | -159.9 | -168 | 6.8 | 113.9 | |||||
| 44 | H | 34.3 | Very low | 37.2 | Very low | 164 Ų | 164 | 158.7 Ų | 158.7 | 76% | 0.759 | 80% | 0.797 | S | S | * | * | trans | 92.1 | 90.7 | 165.7 | -144.5 | -59.1 | 0 | 0 | 0 | 119.2 | ||||
| 45 | R | 41.1 | Very low | 37.4 | Very low | 211 Ų | 211 | 158.7 Ų | 158.7 | 80% | 0.796 | 80% | 0.799 | S | S | * | * | trans | -51.2 | 122.5 | 162.5 | 173.6 | -171.7 | -177.5 | -143 | 6.2 | 113.7 | ||||
| 46 | Q | 36 | Very low | 38.2 | Very low | 163 Ų | 163 | 156.7 Ų | 156.7 | 76% | 0.762 | 80% | 0.796 | S | S | * | * | trans | -145.3 | 141.1 | 150.5 | -81 | -61.1 | -9.8 | 0 | 0 | 108.3 | ||||
| 47 | N | 33.1 | Very low | 38.5 | Very low | 137 Ų | 137 | 157.2 Ų | 157.2 | 73% | 0.733 | 80% | 0.797 | S | S | * | * | trans | -96.5 | 113 | -174.3 | -68.5 | -17 | 0 | 0 | 0 | 111.3 | ||||
| 48 | T | 38 | Very low | 38.8 | Very low | 130 Ų | 130 | 159 Ų | 159 | 80% | 0.798 | 80% | 0.798 | S | S | * | * | trans | -148.1 | 134 | 161.9 | 45.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 49 | S | 35.1 | Very low | 39.4 | Very low | 103 Ų | 103 | 154 Ų | 154 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | trans | 43.1 | 96.4 | 161 | 58.8 | 0 | 0 | 0 | 0 | 119 | L51 | S49-L51 PolarHBondContact O-N 3.08Š| ||
| 50 | T | 41 | Very low | 40 | Very low | 145 Ų | 145 | 156.5 Ų | 156.5 | 89% | 0.89 | 79% | 0.792 | S | S | * | * | trans | -67.7 | 99.2 | 162.3 | -45.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 51 | L | 46.2 | Very low | 40.8 | Very low | 149 Ų | 149 | 154.9 Ų | 154.9 | 78% | 0.78 | 79% | 0.789 | S | S | * | * | trans | -63.7 | 130.6 | 167.9 | -73.6 | 170.5 | 0 | 0 | 0 | 109.4 | S49 R53 | S49-L51 PolarHBondContact O-N 3.08Å; L51-R53 PolarHBondContact O-N 3Å; L51-R53 VanDerWaalsContact O-N 3.08Å | ||
| 52 | P | 42.6 | Very low | 41.8 | Very low | 117 Ų | 117 | 151 Ų | 151 | 76% | 0.76 | 77% | 0.774 | S | S | * | * | trans | -66.6 | 115.3 | 179 | 26.7 | -32.6 | 0 | 0 | 0 | 109.1 | G54 | P52-G54 PolarHBondContact O-N 3.06Š| ||
| 53 | R | 47.3 | Very low | 42.9 | Very low | 232 Ų | 232 | 149.4 Ų | 149.4 | 88% | 0.875 | 77% | 0.765 | S | S | * | * | trans | -52.4 | 116.1 | 171.2 | -171 | 179.5 | -154.2 | -141.2 | 4.3 | 108.1 | L51 Y55 | L51-R53 PolarHBondContact O-N 3Å; L51-R53 VanDerWaalsContact O-N 3.08Å; R53-Y55 PolarHBondContact O-N 2.82Å | ||
| 54 | G | 38.9 | Very low | 44.5 | Very low | 71 Ų | 71 | 139.4 Ų | 139.4 | 73% | 0.732 | 73% | 0.732 | S | S | * | * | trans | -52.3 | 100.4 | -171.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | P52 K56 | P52-G54 PolarHBondContact O-N 3.06Å; G54-K56 PolarHBondContact O-N 3.3Å | ||
| 55 | Y | 40.9 | Very low | 46.2 | Very low | 229 Ų | 229 | 134.1 Ų | 134.1 | 90% | 0.898 | 71% | 0.709 | S | S | * | * | trans | -64.8 | 101.8 | 164.2 | -96.1 | -104.2 | 0 | 0 | 0 | 106.4 | R53 P57 | R53-Y55 PolarHBondContact O-N 2.82Å; Y55-P57 VanDerWaalsContact O-CD 3.29Å; Y55-P57 WeakPolarHBondContact O-CD 3.29Å | ||
| 56 | K | 48.4 | Very low | 47.8 | Very low | 189 Ų | 189 | 124.2 Ų | 124.2 | 82% | 0.822 | 67% | 0.671 | S | S | * | * | trans | -59.5 | 120.4 | 153.3 | -68.2 | -128.1 | 175.4 | -170.5 | 0 | 105.4 | G54 K58 | G54-K56 PolarHBondContact O-N 3.3Å; K56-K58 PolarHBondContact O-N 3.12Å; K56-K58 VanDerWaalsContact O-N 3.12Å | ||
| 57 | P | 41.3 | Very low | 49.6 | Very low | 109 Ų | 109 | 119.2 Ų | 119.2 | 71% | 0.708 | 65% | 0.65 | S | S | * | * | trans | -53.9 | 126.1 | 170.5 | -21.9 | 33.4 | 0 | 0 | 0 | 106.8 | Y55 L59 | Y55-P57 VanDerWaalsContact O-CD 3.29Å; Y55-P57 WeakPolarHBondContact O-CD 3.29Å; P57-L59 PolarHBondContact O-N 3.1Å | ||
| 58 | K | 45.7 | Very low | 51.6 | Low | 203 Ų | 203 | 113.4 Ų | 113.4 | 88% | 0.883 | 62% | 0.618 | S | S | * | * | trans | -62.5 | 111.1 | 160 | -69.1 | 179.9 | 179 | 179.8 | 0 | 103.7 | K56 T60 | K56-K58 PolarHBondContact O-N 3.12Å; K56-K58 VanDerWaalsContact O-N 3.12Å; K58-T60 VanDerWaalsContact C-N 3.33Å; K58-T60 PolarHBondContact O-N 2.85Å | ||
| 59 | L | 46.3 | Very low | 53.3 | Low | 143 Ų | 143 | 113.7 Ų | 113.7 | 75% | 0.749 | 61% | 0.612 | S | S | * | * | trans | -57 | 107.4 | 170 | -88.9 | 81.7 | 0 | 0 | 0 | 106 | P57 | P57-L59 PolarHBondContact O-N 3.1Š| ||
| 60 | T | 42.8 | Very low | 55.3 | Low | 120 Ų | 120 | 110.5 Ų | 110.5 | 74% | 0.736 | 59% | 0.586 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 129.1 | 152.9 | 42 | 0 | 0 | 0 | 0 | 105.7 | K58 S62 | K58-T60 VanDerWaalsContact C-N 3.33Å; K58-T60 PolarHBondContact O-N 2.85Å; T60-S62 PolarHBondContact O-N 3.42Å |
| 61 | P | 50 | Low | 56.8 | Low | 117 Ų | 117 | 109.6 Ų | 109.6 | 76% | 0.76 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 118.2 | 169.7 | -20.3 | 31.6 | 0 | 0 | 0 | 106.9 | N63 | P61-N63 PolarHBondContact O-N 3.03Š|
| 62 | S | 54.2 | Low | 58.4 | Low | 68 Ų | 68 | 109.7 Ų | 109.7 | 48% | 0.476 | 58% | 0.58 | S | S | . | * | P | Polyproline II helix | trans | -60.7 | 132.6 | 165.6 | 44.2 | 0 | 0 | 0 | 0 | 106.3 | T60 S64 | T60-S62 PolarHBondContact O-N 3.42Å; S62-S64 PolarHBondContact O-N 2.74Å; S62-S64 VanDerWaalsContact O-N 3.11Å |
| 63 | N | 60.6 | Low | 60.6 | Low | 102 Ų | 102 | 107.4 Ų | 107.4 | 55% | 0.545 | 56% | 0.556 | S | S | . | * | S | Bend | trans | -73.6 | 14.4 | 167.8 | -84.5 | -14.3 | 0 | 0 | 0 | 111.3 | P61 L97 | P61-N63 PolarHBondContact O-N 3.03Å; N63-L97 HydrophobicContact CB-CD2 3.65Å; N63-L97 WeakPolarHBondContact O-CD1 3.33Å; N63-L97 WeakPolarHBondContact O-CD2 3.34Å |
| 64 | S | 69.8 | Low | 62.7 | Low | 26 Ų | 26 | 99.3 Ų | 99.3 | 18% | 0.182 | 53% | 0.532 | C | S | . | . | trans | -95 | 138.8 | 177 | 160.5 | 0 | 0 | 0 | 0 | 109.2 | S62 V66 Y68 E104 | S62-S64 PolarHBondContact O-N 2.74Å; S62-S64 VanDerWaalsContact O-N 3.11Å; S64-V66 VanDerWaalsContact C-N 3.3Å; S64-V66 PolarHBondContact OG-N 2.67Å; S64-V66 PolarHBondContact OG-O 3.32Å; S64-Y68 WeakPolarHBondContact OG-CD2 3.38Å; S64-Y68 WeakPolarHBondContact OG-CE2 3.21Å; S64-E104 VanDerWaalsContact CA-OE2 3.29Å; S64-E104 WeakPolarHBondContact CA-OE2 3.14Å; S64-E104 WeakPolarHBondContact CB-OE1 3.37Å; S64-E104 PolarHBondContact OG-OE1 3.37Å | ||
| 65 | L | 70.8 | Confident | 65.4 | Low | 53 Ų | 53 | 99.3 Ų | 99.3 | 28% | 0.277 | 52% | 0.518 | S | S | . | . | S | Bend | trans | -78.9 | -17.4 | 179.3 | -177.3 | 54.3 | 0 | 0 | 0 | 111.9 | L95 E104 V165 I169 | L65-L95 HydrophobicContact CD2-CB 3.96Å; L65-L95 HydrophobicContact CD2-CD1 3.91Å; L65-L95 HydrophobicContact CD2-CG 4.47Å; L65-L95 HydrophobicContact CG-CD1 4.41Å; L65-E104 PolarHBondContact N-OE2 2.62Å; L65-V165 HydrophobicContact CD1-CG1 4.26Å; L65-V165 HydrophobicContact CG-CG1 3.86Å; L65-V165 WeakPolarHBondContact O-CG1 3.38Å; L65-I169 HydrophobicContact CD2-CD1 4.19Å; L65-I169 HydrophobicContact CD2-CG1 4.29Å |
| 66 | V | 73.9 | Confident | 68 | Low | 2 Ų | 2 | 89.3 Ų | 89.3 | 1% | 0.012 | 48% | 0.479 | C | S | . | . | S | Bend | trans | -98.6 | 131.9 | 169.2 | -177.2 | 0 | 0 | 0 | 0 | 108.6 | S64 Y68 C106 V128 V130 | S64-V66 VanDerWaalsContact C-N 3.3Å; S64-V66 PolarHBondContact OG-N 2.67Å; S64-V66 PolarHBondContact OG-O 3.32Å; V66-Y68 HydrophobicContact CB-CD1 4.1Å; V66-Y68 HydrophobicContact CB-CD2 4.33Å; V66-Y68 HydrophobicContact CB-CE1 3.89Å; V66-Y68 HydrophobicContact CB-CE2 4.1Å; V66-Y68 HydrophobicContact CB-CG 4.33Å; V66-Y68 HydrophobicContact CG1-CD1 3.63Å; V66-Y68 HydrophobicContact CG1-CE1 3.64Å; V66-Y68 HydrophobicContact CG1-CG 4.19Å; V66-Y68 HydrophobicContact CG2-CE1 4.39Å; V66-Y68 PolarHBondContact O-N 2.88Å; V66-C106 HydrophobicContact CG2-CB 3.99Å; V66-C106 VanDerWaalsContact CG2-SG 3.57Å; V66-V128 HydrophobicContact CG1-CG1 3.77Å; V66-V128 HydrophobicContact CG2-CG1 4.16Å; V66-V130 HydrophobicContact CG1-CG2 4.33Å |
| 67 | D | 75.6 | Confident | 70.3 | Confident | 59 Ų | 59 | 84.2 Ų | 84.2 | 32% | 0.316 | 46% | 0.464 | S | S | . | . | trans | -78.1 | 78.2 | 169.4 | -167.3 | -5.9 | 0 | 0 | 0 | 110.2 | M69 D70 | D67-M69 PolarHBondContact O-N 2.79Å; D67-M69 VanDerWaalsContact OD1-C 3.31Å; D67-M69 WeakPolarHBondContact OD1-CA 3.39Å; D67-M69 PolarHBondContact OD1-N 2.88Å; D67-D70 HydrophobicContact CB-CB 3.99Å; D67-D70 WeakPolarHBondContact O-CB 3.4Å; D67-D70 PolarHBondContact O-N 3.17Å; D67-D70 PolarHBondContact OD1-N 3.05Å | ||
| 68 | Y | 75.1 | Confident | 72.9 | Confident | 15 Ų | 15 | 79 Ų | 79 | 6% | 0.059 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -7.4 | 173.3 | -66.5 | -54.1 | 0 | 0 | 0 | 113.4 | S64 V66 R73 E104 M105 V130 E138 | S64-Y68 WeakPolarHBondContact OG-CD2 3.38Å; S64-Y68 WeakPolarHBondContact OG-CE2 3.21Å; V66-Y68 HydrophobicContact CB-CD1 4.1Å; V66-Y68 HydrophobicContact CB-CD2 4.33Å; V66-Y68 HydrophobicContact CB-CE1 3.89Å; V66-Y68 HydrophobicContact CB-CE2 4.1Å; V66-Y68 HydrophobicContact CB-CG 4.33Å; V66-Y68 HydrophobicContact CG1-CD1 3.63Å; V66-Y68 HydrophobicContact CG1-CE1 3.64Å; V66-Y68 HydrophobicContact CG1-CG 4.19Å; V66-Y68 HydrophobicContact CG2-CE1 4.39Å; V66-Y68 PolarHBondContact O-N 2.88Å; Y68-R73 PolarHBondContact O-NH1 2.88Å; Y68-R73 PolarHBondContact O-NH2 3.22Å; Y68-E104 WeakPolarHBondContact CE2-OE1 3.48Å; Y68-M105 PolarHBondContact OH-O 2.74Å; Y68-V130 HydrophobicContact CD1-CB 4.33Å; Y68-V130 HydrophobicContact CD1-CG1 3.79Å; Y68-V130 HydrophobicContact CD1-CG2 3.93Å; Y68-V130 HydrophobicContact CE1-CG2 4.4Å; Y68-E138 HydrophobicContact CD2-CB 4.41Å; Y68-E138 HydrophobicContact CD2-CG 3.91Å; Y68-E138 HydrophobicContact CE1-CB 4.46Å; Y68-E138 HydrophobicContact CE2-CB 4.17Å; Y68-E138 HydrophobicContact CE2-CG 3.6Å |
| 69 | M | 72.8 | Confident | 75.3 | Confident | 136 Ų | 136 | 76.5 Ų | 76.5 | 67% | 0.67 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.4 | 4 | 176.8 | -70.4 | -64 | 120.4 | 0 | 0 | 113.4 | D67 P71 R73 | D67-M69 PolarHBondContact O-N 2.79Å; D67-M69 VanDerWaalsContact OD1-C 3.31Å; D67-M69 WeakPolarHBondContact OD1-CA 3.39Å; D67-M69 PolarHBondContact OD1-N 2.88Å; M69-P71 WeakPolarHBondContact O-CD 3.04Å; M69-R73 VanDerWaalsContact CA-NH2 3.32Å |
| 70 | D | 76.8 | Confident | 77.6 | Confident | 35 Ų | 35 | 71.2 Ų | 71.2 | 19% | 0.187 | 39% | 0.392 | C | S | . | . | trans | -56.5 | 125.1 | -177.4 | -165.3 | -15.4 | 0 | 0 | 0 | 110.9 | D67 Q72 R73 V161 | D67-D70 HydrophobicContact CB-CB 3.99Å; D67-D70 WeakPolarHBondContact O-CB 3.4Å; D67-D70 PolarHBondContact O-N 3.17Å; D67-D70 PolarHBondContact OD1-N 3.05Å; D70-Q72 PolarHBondContact O-N 3.34Å; D70-Q72 WeakPolarHBondContact OD1-CB 3.39Å; D70-Q72 PolarHBondContact OD1-N 3.26Å; D70-R73 PolarHBondContact O-NE 3.31Å; D70-V161 HydrophobicContact CB-CG1 4.41Å; D70-V161 HydrophobicContact CB-CG2 4.16Å | ||
| 71 | P | 72.2 | Confident | 80 | Confident | 126 Ų | 126 | 71.9 Ų | 71.9 | 82% | 0.818 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -65.6 | -19 | 170.2 | -21.5 | 34.1 | 0 | 0 | 0 | 113.9 | M69 R73 | M69-P71 WeakPolarHBondContact O-CD 3.04Å; P71-R73 VanDerWaalsContact C-N 3.29Å; P71-R73 PolarHBondContact O-N 2.91Å |
| 72 | Q | 80.3 | Confident | 81.8 | Confident | 151 Ų | 151 | 72 Ų | 72 | 71% | 0.706 | 38% | 0.382 | S | S | * | . | trans | -92 | 38.8 | -177.1 | -55.8 | -165.7 | -3.2 | 0 | 0 | 113.1 | D70 | D70-Q72 PolarHBondContact O-N 3.34Å; D70-Q72 WeakPolarHBondContact OD1-CB 3.39Å; D70-Q72 PolarHBondContact OD1-N 3.26Å | ||
| 73 | R | 89.2 | Confident | 83.4 | Confident | 70 Ų | 70 | 76.7 Ų | 76.7 | 26% | 0.264 | 40% | 0.401 | S | S | . | . | P | Polyproline II helix | trans | -70.9 | 136.3 | 173.4 | -87.3 | 176.4 | -102.7 | -153.8 | -11.1 | 112.3 | Y68 M69 D70 P71 V130 T160 V161 | Y68-R73 PolarHBondContact O-NH1 2.88Å; Y68-R73 PolarHBondContact O-NH2 3.22Å; M69-R73 VanDerWaalsContact CA-NH2 3.32Å; D70-R73 PolarHBondContact O-NE 3.31Å; P71-R73 VanDerWaalsContact C-N 3.29Å; P71-R73 PolarHBondContact O-N 2.91Å; R73-V130 VanDerWaalsContact NH1-CG1 3.32Å; R73-T160 VanDerWaalsContact CA-O 3.29Å; R73-T160 WeakPolarHBondContact CA-O 3.5Å; R73-T160 WeakPolarHBondContact CG-O 3.3Å; R73-V161 HydrophobicContact CG-CG2 3.6Å |
| 74 | T | 92.1 | Very high | 84.9 | Confident | 61 Ų | 61 | 75.9 Ų | 75.9 | 37% | 0.374 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 128.1 | 168.5 | -53.3 | 0 | 0 | 0 | 0 | 108.8 | F76 E159 T160 | T74-F76 HydrophobicContact CG2-CD1 4.34Å; T74-F76 HydrophobicContact CG2-CD2 4.36Å; T74-F76 HydrophobicContact CG2-CE1 3.69Å; T74-F76 HydrophobicContact CG2-CE2 3.73Å; T74-F76 HydrophobicContact CG2-CZ 3.37Å; T74-E159 WeakPolarHBondContact O-CA 3.02Å; T74-T160 PolarHBondContact N-O 2.8Å; T74-T160 PolarHBondContact O-N 3.49Å |
| 75 | T | 94.9 | Very high | 86 | Confident | 72 Ų | 72 | 79.5 Ų | 79.5 | 44% | 0.442 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 126.7 | 173.3 | -60.6 | 0 | 0 | 0 | 0 | 109.5 | K157 L158 E159 | T75-K157 HydrophobicContact CG2-CD 4.29Å; T75-K157 HydrophobicContact CG2-CG 4.01Å; T75-L158 CarbonylContact C-O 3.59Å; T75-L158 WeakPolarHBondContact CA-O 3.5Å; T75-E159 HydrophobicContact CG2-CG 4.38Å |
| 76 | F | 95.8 | Very high | 87.2 | Confident | 18 Ų | 18 | 77.7 Ų | 77.7 | 8% | 0.079 | 41% | 0.405 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.2 | 135.7 | 171.6 | -58.1 | -74.5 | 0 | 0 | 0 | 109.7 | T74 L78 A121 G122 L123 K157 L158 T160 | T74-F76 HydrophobicContact CG2-CD1 4.34Å; T74-F76 HydrophobicContact CG2-CD2 4.36Å; T74-F76 HydrophobicContact CG2-CE1 3.69Å; T74-F76 HydrophobicContact CG2-CE2 3.73Å; T74-F76 HydrophobicContact CG2-CZ 3.37Å; F76-L78 HydrophobicContact CB-CD1 3.79Å; F76-A121 VanDerWaalsContact CD1-O 3.27Å; F76-A121 WeakPolarHBondContact CD1-O 3.07Å; F76-G122 VanDerWaalsContact CE1-C 3.4Å; F76-G122 VanDerWaalsContact CE1-O 3.25Å; F76-G122 WeakPolarHBondContact CE1-O 3.39Å; F76-L123 HydrophobicContact CD2-CD1 3.49Å; F76-L123 VanDerWaalsContact CD2-CD1 3.49Å; F76-L123 HydrophobicContact CE2-CD1 3.44Å; F76-L123 VanDerWaalsContact CE2-CD1 3.44Å; F76-L123 HydrophobicContact CG-CD1 4.13Å; F76-L123 HydrophobicContact CZ-CD1 4.07Å; F76-K157 CarbonylContact O-C 3.57Å; F76-K157 WeakPolarHBondContact O-CA 3.3Å; F76-L158 HydrophobicContact CB-CB 4.41Å; F76-L158 PolarHBondContact N-O 3.44Å; F76-L158 PolarHBondContact O-N 2.89Å; F76-T160 HydrophobicContact CD2-CG2 3.98Å; F76-T160 HydrophobicContact CE2-CG2 3.91Å; F76-T160 WeakPolarHBondContact CE2-OG1 3.4Å |
| 77 | V | 96.5 | Very high | 88.3 | Confident | 83 Ų | 83 | 78.1 Ų | 78.1 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 110.3 | 170.1 | -178.7 | 0 | 0 | 0 | 0 | 106.5 | K157 | V77-K157 HydrophobicContact CG2-CG 4.39Å |
| 78 | L | 96.4 | Very high | 89.3 | Confident | 0 Ų | 0 | 76.8 Ų | 76.8 | 0% | 0 | 40% | 0.402 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 114.4 | 177.6 | -64.9 | 84.5 | 0 | 0 | 0 | 107.3 | F76 F86 F88 V117 A118 A121 N155 L156 L158 | F76-L78 HydrophobicContact CB-CD1 3.79Å; L78-F86 HydrophobicContact CB-CD1 3.74Å; L78-F86 HydrophobicContact CB-CE1 4.05Å; L78-F86 HydrophobicContact CD2-CB 3.98Å; L78-F86 HydrophobicContact CD2-CD1 4.22Å; L78-F86 HydrophobicContact CD2-CG 4.36Å; L78-F88 HydrophobicContact CD2-CD1 4Å; L78-F88 HydrophobicContact CD2-CE1 3.87Å; L78-V117 HydrophobicContact CB-CG1 3.89Å; L78-V117 HydrophobicContact CG-CG1 4.44Å; L78-A118 HydrophobicContact CD2-CB 3.83Å; L78-A121 HydrophobicContact CG-CB 4.21Å; L78-N155 WeakPolarHBondContact O-CA 3.34Å; L78-L156 HydrophobicContact CB-CB 4.33Å; L78-L156 PolarHBondContact N-O 2.82Å; L78-L156 PolarHBondContact O-N 3.34Å; L78-L158 HydrophobicContact CD1-CD1 3.95Å; L78-L158 HydrophobicContact CD1-CG 4.14Å |
| 79 | E | 95.6 | Very high | 90.3 | Very high | 149 Ų | 149 | 81.3 Ų | 81.3 | 70% | 0.696 | 42% | 0.423 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 124.9 | 174.7 | -174.7 | 169.4 | -170.2 | 0 | 0 | 108.7 | V117 N154 | E79-V117 WeakPolarHBondContact O-CG1 3.1Å; E79-N154 CarbonylContact C-O 3.59Å; E79-N154 WeakPolarHBondContact CA-O 3.25Å |
| 80 | K | 94.4 | Very high | 91.3 | Very high | 32 Ų | 32 | 75.9 Ų | 75.9 | 14% | 0.139 | 40% | 0.397 | C | S | . | . | trans | -131.3 | 156.8 | -176.6 | 82.4 | 158.9 | -168.5 | -77.5 | 0 | 112.3 | E84 F86 V117 T153 N154 | K80-E84 VanDerWaalsContact CA-OE1 3.27Å; K80-E84 WeakPolarHBondContact CA-OE1 3.01Å; K80-E84 HydrophobicContact CB-CG 3.76Å; K80-E84 WeakPolarHBondContact CB-OE1 3.41Å; K80-E84 HydrophobicContact CD-CG 3.99Å; K80-E84 VanDerWaalsContact CD-O 3.28Å; K80-E84 WeakPolarHBondContact CD-O 3.29Å; K80-E84 WeakPolarHBondContact CE-O 3.38Å; K80-E84 HydrophobicContact CG-CG 4.31Å; K80-F86 HydrophobicContact CB-CD1 4.04Å; K80-F86 HydrophobicContact CB-CE1 4Å; K80-F86 HydrophobicContact CD-CD1 3.9Å; K80-F86 HydrophobicContact CD-CE1 3.9Å; K80-F86 HydrophobicContact CD-CG 4.22Å; K80-F86 HydrophobicContact CD-CZ 4.22Å; K80-F86 HydrophobicContact CG-CD1 3.93Å; K80-F86 HydrophobicContact CG-CE1 3.59Å; K80-F86 HydrophobicContact CG-CZ 4.11Å; K80-F86 VanDerWaalsContact NZ-CE2 3.25Å; K80-F86 VanDerWaalsContact NZ-CZ 3.28Å; K80-V117 HydrophobicContact CB-CG2 3.95Å; K80-T153 WeakPolarHBondContact CE-O 3.34Å; K80-T153 PolarHBondContact NZ-O 3.12Å; K80-N154 PolarHBondContact N-O 3.37Å; K80-N154 VanDerWaalsContact O-CB 3.3Å; K80-N154 WeakPolarHBondContact O-CB 2.98Å | ||
| 81 | Q | 93.9 | Very high | 92.1 | Very high | 134 Ų | 134 | 78.1 Ų | 78.1 | 63% | 0.626 | 41% | 0.406 | S | S | * | . | trans | -75.5 | 159.7 | 170.6 | -54.8 | -62.3 | -6.9 | 0 | 0 | 112 | N83 E84 | Q81-N83 PolarHBondContact O-N 2.95Å; Q81-N83 VanDerWaalsContact O-N 3.07Å; Q81-E84 HydrophobicContact CB-CG 4.33Å; Q81-E84 PolarHBondContact N-OE1 3.2Å; Q81-E84 PolarHBondContact O-N 3.37Å | ||
| 82 | D | 87.9 | Confident | 93 | Very high | 121 Ų | 121 | 73.3 Ų | 73.3 | 65% | 0.647 | 37% | 0.374 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | -27.8 | -177.6 | -62.6 | -51.2 | 0 | 0 | 0 | 114 | N154 | D82-N154 PolarHBondContact OD1-ND2 3.35Š|
| 83 | N | 86.6 | Confident | 93.3 | Very high | 165 Ų | 165 | 69.9 Ų | 69.9 | 88% | 0.882 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.2 | -0.7 | -171.1 | -63.7 | -26.8 | 0 | 0 | 0 | 114.4 | Q81 | Q81-N83 PolarHBondContact O-N 2.95Å; Q81-N83 VanDerWaalsContact O-N 3.07Å |
| 84 | E | 92.1 | Very high | 93.1 | Very high | 86 Ų | 86 | 68.6 Ų | 68.6 | 40% | 0.402 | 36% | 0.364 | S | S | . | . | S | Bend | trans | -114.2 | -180 | -176.7 | 78.5 | -167.3 | 157.7 | 0 | 0 | 112.5 | K80 Q81 | K80-E84 VanDerWaalsContact CA-OE1 3.27Å; K80-E84 WeakPolarHBondContact CA-OE1 3.01Å; K80-E84 HydrophobicContact CB-CG 3.76Å; K80-E84 WeakPolarHBondContact CB-OE1 3.41Å; K80-E84 HydrophobicContact CD-CG 3.99Å; K80-E84 VanDerWaalsContact CD-O 3.28Å; K80-E84 WeakPolarHBondContact CD-O 3.29Å; K80-E84 WeakPolarHBondContact CE-O 3.38Å; K80-E84 HydrophobicContact CG-CG 4.31Å; Q81-E84 HydrophobicContact CB-CG 4.33Å; Q81-E84 PolarHBondContact N-OE1 3.2Å; Q81-E84 PolarHBondContact O-N 3.37Å |
| 85 | T | 94.1 | Very high | 92.4 | Very high | 102 Ų | 102 | 66.1 Ų | 66.1 | 63% | 0.626 | 35% | 0.348 | S | S | * | . | trans | -119.9 | 156.1 | 174.5 | 66.7 | 0 | 0 | 0 | 0 | 109.2 | G87 | T85-G87 PolarHBondContact O-N 2.95Å; T85-G87 VanDerWaalsContact O-N 3.13Å | ||
| 86 | F | 95.8 | Very high | 91.5 | Very high | 15 Ų | 15 | 68.6 Ų | 68.6 | 7% | 0.066 | 36% | 0.355 | C | S | . | . | trans | -62.1 | -20.7 | 175.9 | -61.4 | -63.7 | 0 | 0 | 0 | 112.7 | L78 K80 F88 V117 A118 I149 L156 | L78-F86 HydrophobicContact CB-CD1 3.74Å; L78-F86 HydrophobicContact CB-CE1 4.05Å; L78-F86 HydrophobicContact CD2-CB 3.98Å; L78-F86 HydrophobicContact CD2-CD1 4.22Å; L78-F86 HydrophobicContact CD2-CG 4.36Å; K80-F86 HydrophobicContact CB-CD1 4.04Å; K80-F86 HydrophobicContact CB-CE1 4Å; K80-F86 HydrophobicContact CD-CD1 3.9Å; K80-F86 HydrophobicContact CD-CE1 3.9Å; K80-F86 HydrophobicContact CD-CG 4.22Å; K80-F86 HydrophobicContact CD-CZ 4.22Å; K80-F86 HydrophobicContact CG-CD1 3.93Å; K80-F86 HydrophobicContact CG-CE1 3.59Å; K80-F86 HydrophobicContact CG-CZ 4.11Å; K80-F86 VanDerWaalsContact NZ-CE2 3.25Å; K80-F86 VanDerWaalsContact NZ-CZ 3.28Å; F86-F88 HydrophobicContact CB-CD1 3.6Å; F86-F88 HydrophobicContact CB-CE1 3.43Å; F86-F88 VanDerWaalsContact CB-CE1 3.43Å; F86-F88 HydrophobicContact CD2-CE1 4.28Å; F86-F88 HydrophobicContact CG-CE1 4.1Å; F86-V117 HydrophobicContact CD1-CG1 4.47Å; F86-A118 WeakPolarHBondContact O-CB 3.45Å; F86-A118 PolarHBondContact O-N 3.32Å; F86-I149 HydrophobicContact CD2-CG2 4.4Å; F86-I149 HydrophobicContact CE2-CG2 4.45Å; F86-L156 HydrophobicContact CD1-CB 4.49Å; F86-L156 HydrophobicContact CD1-CD2 4.44Å; F86-L156 HydrophobicContact CD2-CD2 3.81Å; F86-L156 HydrophobicContact CE1-CB 3.78Å; F86-L156 HydrophobicContact CE1-CD2 4.44Å; F86-L156 HydrophobicContact CE2-CB 3.98Å; F86-L156 HydrophobicContact CE2-CD2 3.81Å; F86-L156 HydrophobicContact CG-CD2 4.14Å; F86-L156 HydrophobicContact CZ-CB 3.49Å; F86-L156 VanDerWaalsContact CZ-CB 3.49Å; F86-L156 HydrophobicContact CZ-CD2 4.14Å; F86-L156 HydrophobicContact CZ-CG 4.46Å | ||
| 87 | G | 95.7 | Very high | 90.5 | Very high | 11 Ų | 11 | 69.2 Ų | 69.2 | 11% | 0.113 | 36% | 0.359 | C | S | . | . | trans | 77.1 | 30.7 | 171.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | T85 K113 | T85-G87 PolarHBondContact O-N 2.95Å; T85-G87 VanDerWaalsContact O-N 3.13Å; G87-K113 WeakPolarHBondContact O-CB 3.39Å; G87-K113 PolarHBondContact O-N 3.25Å | ||
| 88 | F | 96.9 | Very high | 89.2 | Confident | 31 Ų | 31 | 72.3 Ų | 72.3 | 14% | 0.136 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.2 | 155.8 | 172.4 | 71 | -85.4 | 0 | 0 | 0 | 111.3 | L78 F86 I90 V109 N111 I112 A118 L123 I149 L156 L158 | L78-F88 HydrophobicContact CD2-CD1 4Å; L78-F88 HydrophobicContact CD2-CE1 3.87Å; F86-F88 HydrophobicContact CB-CD1 3.6Å; F86-F88 HydrophobicContact CB-CE1 3.43Å; F86-F88 VanDerWaalsContact CB-CE1 3.43Å; F86-F88 HydrophobicContact CD2-CE1 4.28Å; F86-F88 HydrophobicContact CG-CE1 4.1Å; F88-I90 HydrophobicContact CD2-CG2 3.8Å; F88-I90 HydrophobicContact CE2-CG2 3.61Å; F88-V109 HydrophobicContact CB-CG1 4.13Å; F88-V109 HydrophobicContact CD2-CG1 4.45Å; F88-V109 HydrophobicContact CD2-CG2 4.47Å; F88-N111 WeakPolarHBondContact CA-O 3.42Å; F88-I112 HydrophobicContact CB-CG1 4.22Å; F88-A118 HydrophobicContact CB-CB 3.91Å; F88-A118 HydrophobicContact CD1-CB 3.95Å; F88-A118 HydrophobicContact CG-CB 4.34Å; F88-L123 HydrophobicContact CB-CD2 4.18Å; F88-L123 HydrophobicContact CD1-CD2 4.28Å; F88-L123 HydrophobicContact CD2-CD2 4.38Å; F88-L123 HydrophobicContact CG-CD2 4.04Å; F88-I149 HydrophobicContact CE2-CD1 4.31Å; F88-I149 HydrophobicContact CZ-CD1 4.27Å; F88-I149 HydrophobicContact CZ-CG2 4.4Å; F88-L156 HydrophobicContact CE1-CD2 3.81Å; F88-L156 HydrophobicContact CZ-CD2 3.81Å; F88-L158 HydrophobicContact CE2-CD1 4.47Å; F88-L158 HydrophobicContact CZ-CD1 4.1Å |
| 89 | E | 96.2 | Very high | 87.7 | Confident | 109 Ų | 109 | 76.4 Ų | 76.4 | 51% | 0.509 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 147 | 173.4 | -62.9 | 168.7 | -137.7 | 0 | 0 | 110.1 | V109 C110 N111 | E89-V109 CarbonylContact O-C 3.54Å; E89-V109 WeakPolarHBondContact O-CA 3.43Å; E89-C110 VanDerWaalsContact C-SG 3.57Å; E89-C110 VanDerWaalsContact CB-SG 3.59Å; E89-C110 PolarHBondContact O-N 3.2Å; E89-C110 PolarHBondContact O-SG 2.7Å; E89-N111 HydrophobicContact CB-CB 4.01Å; E89-N111 HydrophobicContact CG-CB 4.18Å; E89-N111 PolarHBondContact N-O 2.9Å; E89-N111 PolarHBondContact OE1-ND2 2.85Å |
| 90 | I | 95.1 | Very high | 86.5 | Confident | 23 Ų | 23 | 71.3 Ų | 71.3 | 12% | 0.118 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.2 | 146 | 176.9 | 55.5 | 158.1 | 0 | 0 | 0 | 111.7 | F88 T107 F108 I129 I145 L146 I149 | F88-I90 HydrophobicContact CD2-CG2 3.8Å; F88-I90 HydrophobicContact CE2-CG2 3.61Å; I90-T107 HydrophobicContact CB-CG2 4.01Å; I90-T107 HydrophobicContact CD1-CG2 3.92Å; I90-T107 HydrophobicContact CG2-CG2 4.49Å; I90-F108 VanDerWaalsContact CA-O 3.32Å; I90-F108 WeakPolarHBondContact CA-O 3.37Å; I90-I129 HydrophobicContact CG2-CD1 3.58Å; I90-I145 HydrophobicContact CD1-CG2 3.81Å; I90-L146 HydrophobicContact CD1-CD2 3.92Å; I90-L146 HydrophobicContact CD1-CG 4.49Å; I90-L146 HydrophobicContact CG1-CD2 4.12Å; I90-I149 HydrophobicContact CD1-CD1 3.84Å |
| 91 | Q | 92.2 | Very high | 85.6 | Confident | 81 Ų | 81 | 74.7 Ų | 74.7 | 38% | 0.379 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 143.7 | 172.2 | -156.3 | 169.2 | 30.4 | 0 | 0 | 110 | Y93 T107 F108 C110 | Q91-Y93 HydrophobicContact CB-CD2 4.46Å; Q91-Y93 HydrophobicContact CB-CE2 3.92Å; Q91-Y93 VanDerWaalsContact CD-CZ 3.49Å; Q91-Y93 HydrophobicContact CG-CD2 4.12Å; Q91-Y93 HydrophobicContact CG-CE2 3.46Å; Q91-Y93 VanDerWaalsContact CG-CE2 3.46Å; Q91-Y93 PolarHBondContact NE2-OH 3.09Å; Q91-Y93 VanDerWaalsContact OE1-CZ 3.28Å; Q91-Y93 PolarHBondContact OE1-OH 3.26Å; Q91-T107 WeakPolarHBondContact O-CA 3.38Å; Q91-F108 HydrophobicContact CB-CZ 4.46Å; Q91-F108 PolarHBondContact N-O 2.99Å; Q91-F108 PolarHBondContact O-N 3.11Å; Q91-C110 HydrophobicContact CB-CB 4.04Å |
| 92 | T | 91.2 | Very high | 84.9 | Confident | 25 Ų | 25 | 74.4 Ų | 74.4 | 15% | 0.153 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 129.2 | 179.2 | -53 | 0 | 0 | 0 | 0 | 109.7 | M105 C106 T107 H142 | T92-M105 HydrophobicContact CG2-CB 4.25Å; T92-M105 HydrophobicContact CG2-CE 3.98Å; T92-C106 CarbonylContact C-O 3.59Å; T92-C106 VanDerWaalsContact CA-O 3.3Å; T92-C106 WeakPolarHBondContact CA-O 3.47Å; T92-T107 WeakPolarHBondContact CG2-OG1 3.45Å; T92-T107 PolarHBondContact OG1-OG1 3.33Å; T92-H142 PolarHBondContact OG1-ND1 3.29Å |
| 93 | Y | 86 | Confident | 84.7 | Confident | 80 Ų | 80 | 72.7 Ų | 72.7 | 31% | 0.314 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 140.1 | -179.4 | -74.6 | -94.7 | 0 | 0 | 0 | 111.2 | Q91 M105 C106 F108 | Q91-Y93 HydrophobicContact CB-CD2 4.46Å; Q91-Y93 HydrophobicContact CB-CE2 3.92Å; Q91-Y93 VanDerWaalsContact CD-CZ 3.49Å; Q91-Y93 HydrophobicContact CG-CD2 4.12Å; Q91-Y93 HydrophobicContact CG-CE2 3.46Å; Q91-Y93 VanDerWaalsContact CG-CE2 3.46Å; Q91-Y93 PolarHBondContact NE2-OH 3.09Å; Q91-Y93 VanDerWaalsContact OE1-CZ 3.28Å; Q91-Y93 PolarHBondContact OE1-OH 3.26Å; Y93-M105 WeakPolarHBondContact O-CA 3.49Å; Y93-C106 PolarHBondContact N-O 3.36Å; Y93-C106 PolarHBondContact O-N 3.02Å; Y93-F108 HydrophobicContact CD2-CD1 4.2Å; Y93-F108 AromaticContact CD2-CE1 3.29Å; Y93-F108 HydrophobicContact CD2-CE1 3.29Å; Y93-F108 AromaticContact CD2-CZ 3.85Å; Y93-F108 HydrophobicContact CD2-CZ 3.85Å; Y93-F108 AromaticContact CE2-CE1 3.41Å; Y93-F108 HydrophobicContact CE2-CE1 3.41Å; Y93-F108 VanDerWaalsContact CE2-CE1 3.41Å; Y93-F108 AromaticContact CE2-CZ 3.42Å; Y93-F108 HydrophobicContact CE2-CZ 3.42Å; Y93-F108 VanDerWaalsContact CE2-CZ 3.42Å; Y93-F108 HydrophobicContact CG-CE1 4.39Å |
| 94 | G | 85.9 | Confident | 84.5 | Confident | 42 Ų | 42 | 66.4 Ų | 66.4 | 43% | 0.433 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79 | 124.5 | 165.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | E104 M105 | G94-E104 CarbonylContact C-O 3.59Å; G94-E104 WeakPolarHBondContact CA-O 3.41Å; G94-M105 WeakPolarHBondContact CA-SD 3.48Å |
| 95 | L | 78.1 | Confident | 84.3 | Confident | 10 Ų | 10 | 66.2 Ų | 66.2 | 5% | 0.052 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 114 | -177.2 | -52.7 | -179.1 | 0 | 0 | 0 | 108.9 | L65 V103 E104 C106 I169 | L65-L95 HydrophobicContact CD2-CB 3.96Å; L65-L95 HydrophobicContact CD2-CD1 3.91Å; L65-L95 HydrophobicContact CD2-CG 4.47Å; L65-L95 HydrophobicContact CG-CD1 4.41Å; L95-V103 WeakPolarHBondContact O-CA 3.36Å; L95-E104 PolarHBondContact N-O 3.33Å; L95-E104 PolarHBondContact O-N 3.29Å; L95-C106 HydrophobicContact CD1-CB 3.41Å; L95-C106 VanDerWaalsContact CD1-CB 3.41Å; L95-C106 HydrophobicContact CG-CB 4.09Å; L95-I169 HydrophobicContact CD1-CD1 3.46Å; L95-I169 VanDerWaalsContact CD1-CD1 3.46Å; L95-I169 HydrophobicContact CD2-CB 4.44Å; L95-I169 HydrophobicContact CD2-CD1 3.51Å; L95-I169 HydrophobicContact CD2-CG1 4Å; L95-I169 HydrophobicContact CD2-CG2 3.69Å; L95-I169 HydrophobicContact CG-CD1 4.11Å |
| 96 | Q | 76.4 | Confident | 84 | Confident | 124 Ų | 124 | 61.5 Ų | 61.5 | 58% | 0.579 | 33% | 0.33 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 128.5 | 178.3 | -165.7 | 170 | 27.5 | 0 | 0 | 110.1 | E102 V103 | Q96-E102 WeakPolarHBondContact CA-O 3.32Å; Q96-V103 HydrophobicContact CB-CG2 4.49Å |
| 97 | L | 73.9 | Confident | 83.8 | Confident | 30 Ų | 30 | 60.9 Ų | 60.9 | 16% | 0.157 | 33% | 0.327 | C | S | . | . | trans | -70.7 | 149 | 177.8 | -168.2 | 64.4 | 0 | 0 | 0 | 110.8 | N63 S99 T100 E102 | N63-L97 HydrophobicContact CB-CD2 3.65Å; N63-L97 WeakPolarHBondContact O-CD1 3.33Å; N63-L97 WeakPolarHBondContact O-CD2 3.34Å; L97-S99 VanDerWaalsContact C-N 3.31Å; L97-S99 WeakPolarHBondContact CD2-OG 3.41Å; L97-S99 WeakPolarHBondContact CG-OG 3.21Å; L97-S99 PolarHBondContact O-N 3.41Å; L97-T100 CarbonylContact C-O 3.58Å; L97-T100 HydrophobicContact CD2-CG2 4.19Å; L97-T100 WeakPolarHBondContact CD2-OG1 3.46Å; L97-E102 PolarHBondContact N-O 3.12Å; L97-E102 VanDerWaalsContact N-O 3.1Å | ||
| 98 | K | 68.1 | Low | 83.7 | Confident | 149 Ų | 149 | 61.6 Ų | 61.6 | 65% | 0.648 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -79.1 | -13.9 | -180 | -53.4 | -159.1 | -176.9 | -154.5 | 0 | 113.7 | E172 | K98-E172 IonicContact NZ-OE1 3.37Å; K98-E172 PolarHBondContact NZ-OE1 2.97Å; K98-E172 IonicContact NZ-OE2 2.67Å; K98-E172 PolarHBondContact NZ-OE2 3.5Å |
| 99 | S | 66.8 | Low | 83.5 | Confident | 85 Ų | 85 | 60.1 Ų | 60.1 | 59% | 0.594 | 32% | 0.321 | S | S | * | . | S | Bend | trans | -112.2 | -18.8 | -178.1 | 46.8 | 0 | 0 | 0 | 0 | 114.3 | L97 | L97-S99 VanDerWaalsContact C-N 3.31Å; L97-S99 WeakPolarHBondContact CD2-OG 3.41Å; L97-S99 WeakPolarHBondContact CG-OG 3.21Å; L97-S99 PolarHBondContact O-N 3.41Å |
| 100 | T | 70 | Confident | 83.4 | Confident | 42 Ų | 42 | 57.1 Ų | 57.1 | 26% | 0.258 | 31% | 0.311 | S | S | . | . | S | Bend | trans | -133.1 | 152.8 | 174.9 | 67.6 | 0 | 0 | 0 | 0 | 109.7 | L97 E102 | L97-T100 CarbonylContact C-O 3.58Å; L97-T100 HydrophobicContact CD2-CG2 4.19Å; L97-T100 WeakPolarHBondContact CD2-OG1 3.46Å; T100-E102 VanDerWaalsContact CB-OE2 3.25Å; T100-E102 WeakPolarHBondContact CB-OE2 3.32Å; T100-E102 PolarHBondContact O-N 2.74Å; T100-E102 WeakPolarHBondContact OG1-CB 3.34Å; T100-E102 PolarHBondContact OG1-OE2 3.39Å |
| 101 | S | 74.8 | Confident | 83.3 | Confident | 103 Ų | 103 | 59.6 Ų | 59.6 | 72% | 0.72 | 33% | 0.325 | S | S | * | . | S | Bend | trans | -75.7 | 15.4 | 176.2 | -171.3 | 0 | 0 | 0 | 0 | 113.1 | ||
| 102 | E | 79.4 | Confident | 83.5 | Confident | 128 Ų | 128 | 57.1 Ų | 57.1 | 60% | 0.598 | 31% | 0.314 | S | S | * | . | trans | -80.2 | 149.2 | -177.9 | -63.2 | 164.2 | 142.1 | 0 | 0 | 110.2 | Q96 L97 T100 | Q96-E102 WeakPolarHBondContact CA-O 3.32Å; L97-E102 PolarHBondContact N-O 3.12Å; L97-E102 VanDerWaalsContact N-O 3.1Å; T100-E102 VanDerWaalsContact CB-OE2 3.25Å; T100-E102 WeakPolarHBondContact CB-OE2 3.32Å; T100-E102 PolarHBondContact O-N 2.74Å; T100-E102 WeakPolarHBondContact OG1-CB 3.34Å; T100-E102 PolarHBondContact OG1-OE2 3.39Å | ||
| 103 | V | 82.7 | Confident | 83.8 | Confident | 86 Ų | 86 | 62.7 Ų | 62.7 | 52% | 0.521 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 114.2 | 179.7 | 179.2 | 0 | 0 | 0 | 0 | 108.3 | L95 Q96 M105 | L95-V103 WeakPolarHBondContact O-CA 3.36Å; Q96-V103 HydrophobicContact CB-CG2 4.49Å; V103-M105 HydrophobicContact CG1-SD 4.45Å |
| 104 | E | 83.9 | Confident | 84.3 | Confident | 32 Ų | 32 | 66.4 Ų | 66.4 | 15% | 0.15 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.5 | 126.9 | -179.8 | -176.3 | -173.4 | 167.5 | 0 | 0 | 110.2 | S64 L65 Y68 G94 L95 C106 | S64-E104 VanDerWaalsContact CA-OE2 3.29Å; S64-E104 WeakPolarHBondContact CA-OE2 3.14Å; S64-E104 WeakPolarHBondContact CB-OE1 3.37Å; S64-E104 PolarHBondContact OG-OE1 3.37Å; L65-E104 PolarHBondContact N-OE2 2.62Å; Y68-E104 WeakPolarHBondContact CE2-OE1 3.48Å; G94-E104 CarbonylContact C-O 3.59Å; G94-E104 WeakPolarHBondContact CA-O 3.41Å; L95-E104 PolarHBondContact N-O 3.33Å; L95-E104 PolarHBondContact O-N 3.29Å; E104-C106 PolarHBondContact O-N 2.88Å |
| 105 | M | 87.1 | Confident | 84.8 | Confident | 83 Ų | 83 | 72.1 Ų | 72.1 | 41% | 0.409 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.4 | 109.6 | -178.5 | -62.2 | -61.3 | -76.4 | 0 | 0 | 110.6 | Y68 T92 Y93 G94 V103 | Y68-M105 PolarHBondContact OH-O 2.74Å; T92-M105 HydrophobicContact CG2-CB 4.25Å; T92-M105 HydrophobicContact CG2-CE 3.98Å; Y93-M105 WeakPolarHBondContact O-CA 3.49Å; G94-M105 WeakPolarHBondContact CA-SD 3.48Å; V103-M105 HydrophobicContact CG1-SD 4.45Å |
| 106 | C | 88.4 | Confident | 85.6 | Confident | 2 Ų | 2 | 72.1 Ų | 72.1 | 1% | 0.014 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 133.6 | -179.5 | 172.1 | 0 | 0 | 0 | 0 | 111 | V66 T92 Y93 L95 E104 | V66-C106 HydrophobicContact CG2-CB 3.99Å; V66-C106 VanDerWaalsContact CG2-SG 3.57Å; T92-C106 CarbonylContact C-O 3.59Å; T92-C106 VanDerWaalsContact CA-O 3.3Å; T92-C106 WeakPolarHBondContact CA-O 3.47Å; Y93-C106 PolarHBondContact N-O 3.36Å; Y93-C106 PolarHBondContact O-N 3.02Å; L95-C106 HydrophobicContact CD1-CB 3.41Å; L95-C106 VanDerWaalsContact CD1-CB 3.41Å; L95-C106 HydrophobicContact CG-CB 4.09Å; E104-C106 PolarHBondContact O-N 2.88Å |
| 107 | T | 92.1 | Very high | 86.6 | Confident | 3 Ų | 3 | 67.3 Ų | 67.3 | 2% | 0.018 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.2 | 132.1 | 178.8 | -57.4 | 0 | 0 | 0 | 0 | 111 | I90 Q91 T92 I129 I145 | I90-T107 HydrophobicContact CB-CG2 4.01Å; I90-T107 HydrophobicContact CD1-CG2 3.92Å; I90-T107 HydrophobicContact CG2-CG2 4.49Å; Q91-T107 WeakPolarHBondContact O-CA 3.38Å; T92-T107 WeakPolarHBondContact CG2-OG1 3.45Å; T92-T107 PolarHBondContact OG1-OG1 3.33Å; T107-I129 PolarHBondContact O-N 2.99Å; T107-I145 HydrophobicContact CG2-CG2 4.44Å; T107-I145 VanDerWaalsContact OG1-CD1 3.28Å; T107-I145 WeakPolarHBondContact OG1-CD1 3.3Å |
| 108 | F | 91.9 | Very high | 87.7 | Confident | 25 Ų | 25 | 65.9 Ų | 65.9 | 11% | 0.11 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137 | 160.7 | 178.3 | 67.1 | -101.5 | 0 | 0 | 0 | 112.2 | I90 Q91 Y93 C110 D127 V128 V166 | I90-F108 VanDerWaalsContact CA-O 3.32Å; I90-F108 WeakPolarHBondContact CA-O 3.37Å; Q91-F108 HydrophobicContact CB-CZ 4.46Å; Q91-F108 PolarHBondContact N-O 2.99Å; Q91-F108 PolarHBondContact O-N 3.11Å; Y93-F108 HydrophobicContact CD2-CD1 4.2Å; Y93-F108 AromaticContact CD2-CE1 3.29Å; Y93-F108 HydrophobicContact CD2-CE1 3.29Å; Y93-F108 AromaticContact CD2-CZ 3.85Å; Y93-F108 HydrophobicContact CD2-CZ 3.85Å; Y93-F108 AromaticContact CE2-CE1 3.41Å; Y93-F108 HydrophobicContact CE2-CE1 3.41Å; Y93-F108 VanDerWaalsContact CE2-CE1 3.41Å; Y93-F108 AromaticContact CE2-CZ 3.42Å; Y93-F108 HydrophobicContact CE2-CZ 3.42Å; Y93-F108 VanDerWaalsContact CE2-CZ 3.42Å; Y93-F108 HydrophobicContact CG-CE1 4.39Å; F108-C110 HydrophobicContact CD2-CB 4.26Å; F108-C110 HydrophobicContact CE2-CB 3.81Å; F108-C110 PolarHBondContact O-N 3.02Å; F108-D127 CarbonylContact C-O 3.48Å; F108-D127 WeakPolarHBondContact CA-O 3.28Å; F108-D127 WeakPolarHBondContact CB-O 3.4Å; F108-V128 HydrophobicContact CB-CG2 4.33Å; F108-V166 HydrophobicContact CB-CG2 3.79Å; F108-V166 HydrophobicContact CD1-CB 4.26Å; F108-V166 HydrophobicContact CD1-CG1 3.61Å; F108-V166 HydrophobicContact CD1-CG2 3.57Å; F108-V166 HydrophobicContact CD2-CG1 3.93Å; F108-V166 HydrophobicContact CE1-CB 4.44Å; F108-V166 HydrophobicContact CE1-CG1 3.4Å; F108-V166 HydrophobicContact CE1-CG2 4.2Å; F108-V166 HydrophobicContact CE2-CG1 3.79Å; F108-V166 HydrophobicContact CG-CB 4.45Å; F108-V166 HydrophobicContact CG-CG1 3.86Å; F108-V166 HydrophobicContact CG-CG2 3.74Å; F108-V166 HydrophobicContact CZ-CG1 3.5Å |
| 109 | V | 94 | Very high | 89 | Confident | 0 Ų | 0 | 63.1 Ų | 63.1 | 0% | 0 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.7 | 111.5 | 175 | -176.5 | 0 | 0 | 0 | 0 | 109.3 | F88 E89 I112 L123 G126 D127 I129 | F88-V109 HydrophobicContact CB-CG1 4.13Å; F88-V109 HydrophobicContact CD2-CG1 4.45Å; F88-V109 HydrophobicContact CD2-CG2 4.47Å; E89-V109 CarbonylContact O-C 3.54Å; E89-V109 WeakPolarHBondContact O-CA 3.43Å; V109-I112 HydrophobicContact CG1-CD1 3.85Å; V109-I112 HydrophobicContact CG1-CG1 3.57Å; V109-L123 HydrophobicContact CG1-CD2 4.27Å; V109-L123 HydrophobicContact CG1-CG 4.48Å; V109-L123 HydrophobicContact CG2-CD1 4.09Å; V109-L123 HydrophobicContact CG2-CD2 3.91Å; V109-L123 HydrophobicContact CG2-CG 4.11Å; V109-G126 PolarHBondContact O-N 3.07Å; V109-D127 PolarHBondContact N-O 2.8Å; V109-I129 HydrophobicContact CG2-CD1 4.09Å; V109-I129 HydrophobicContact CG2-CG1 4.2Å |
| 110 | C | 92.4 | Very high | 90.4 | Very high | 46 Ų | 46 | 64 Ų | 64 | 31% | 0.311 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.4 | -28.8 | -175.1 | 57.3 | 0 | 0 | 0 | 0 | 113.5 | E89 Q91 F108 | E89-C110 VanDerWaalsContact C-SG 3.57Å; E89-C110 VanDerWaalsContact CB-SG 3.59Å; E89-C110 PolarHBondContact O-N 3.2Å; E89-C110 PolarHBondContact O-SG 2.7Å; Q91-C110 HydrophobicContact CB-CB 4.04Å; F108-C110 HydrophobicContact CD2-CB 4.26Å; F108-C110 HydrophobicContact CE2-CB 3.81Å; F108-C110 PolarHBondContact O-N 3.02Å |
| 111 | N | 94.8 | Very high | 91.6 | Very high | 75 Ų | 75 | 63.7 Ų | 63.7 | 40% | 0.401 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.5 | 149.5 | 179 | -169.8 | 28.1 | 0 | 0 | 0 | 110.1 | F88 E89 | F88-N111 WeakPolarHBondContact CA-O 3.42Å; E89-N111 HydrophobicContact CB-CB 4.01Å; E89-N111 HydrophobicContact CG-CB 4.18Å; E89-N111 PolarHBondContact N-O 2.9Å; E89-N111 PolarHBondContact OE1-ND2 2.85Å |
| 112 | I | 96.6 | Very high | 92.5 | Very high | 29 Ų | 29 | 60.8 Ų | 60.8 | 15% | 0.149 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.2 | 133.3 | 173.2 | -60.4 | -176.3 | 0 | 0 | 0 | 107.2 | F88 V109 A118 E119 L123 T124 | F88-I112 HydrophobicContact CB-CG1 4.22Å; V109-I112 HydrophobicContact CG1-CD1 3.85Å; V109-I112 HydrophobicContact CG1-CG1 3.57Å; I112-A118 HydrophobicContact CG2-CB 4.16Å; I112-E119 HydrophobicContact CG2-CB 3.94Å; I112-L123 HydrophobicContact CD1-CB 3.98Å; I112-L123 HydrophobicContact CD1-CD2 4.35Å; I112-L123 HydrophobicContact CD1-CG 3.9Å; I112-L123 WeakPolarHBondContact CD1-O 3.18Å; I112-T124 VanDerWaalsContact CD1-C 3.48Å; I112-T124 VanDerWaalsContact CD1-CA 3.47Å |
| 113 | K | 97.3 | Very high | 93.2 | Very high | 142 Ų | 142 | 55 Ų | 55 | 62% | 0.617 | 31% | 0.306 | S | S | * | . | trans | -82.3 | 136.8 | 179.3 | -168.8 | -167.2 | 171.9 | -166 | 0 | 109.7 | G87 S116 | G87-K113 WeakPolarHBondContact O-CB 3.39Å; G87-K113 PolarHBondContact O-N 3.25Å; K113-S116 WeakPolarHBondContact O-CB 3.26Å; K113-S116 PolarHBondContact O-N 3.01Å; K113-S116 PolarHBondContact O-OG 3.06Å | ||
| 114 | E | 96 | Very high | 93.7 | Very high | 158 Ų | 158 | 54.4 Ų | 54.4 | 74% | 0.738 | 30% | 0.303 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | 145.8 | 169.4 | -62 | 175.4 | 177 | 0 | 0 | 111 | S116 E119 | E114-S116 VanDerWaalsContact C-N 3.25Å; E114-S116 PolarHBondContact O-N 3.04Å; E114-E119 WeakPolarHBondContact CA-OE2 3.46Å |
| 115 | D | 95.1 | Very high | 94.1 | Very high | 162 Ų | 162 | 55.5 Ų | 55.5 | 87% | 0.866 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.8 | 35 | -177.3 | -63.8 | -45.2 | 0 | 0 | 0 | 113.5 | E119 | D115-E119 PolarHBondContact N-OE2 3.03Š|
| 116 | S | 96.4 | Very high | 94.2 | Very high | 10 Ų | 10 | 52 Ų | 52 | 7% | 0.07 | 30% | 0.302 | C | S | . | . | trans | -102.3 | 164.2 | -179.8 | 69.6 | 0 | 0 | 0 | 0 | 114.7 | K113 E114 A118 E119 S120 | K113-S116 WeakPolarHBondContact O-CB 3.26Å; K113-S116 PolarHBondContact O-N 3.01Å; K113-S116 PolarHBondContact O-OG 3.06Å; E114-S116 VanDerWaalsContact C-N 3.25Å; E114-S116 PolarHBondContact O-N 3.04Å; S116-A118 VanDerWaalsContact C-N 3.28Å; S116-A118 PolarHBondContact O-N 3.44Å; S116-E119 PolarHBondContact O-N 3.22Å; S116-E119 PolarHBondContact OG-N 2.86Å; S116-E119 VanDerWaalsContact OG-N 3.12Å; S116-S120 VanDerWaalsContact O-CB 3.32Å; S116-S120 WeakPolarHBondContact O-CB 3.27Å; S116-S120 PolarHBondContact O-N 2.83Å; S116-S120 PolarHBondContact O-OG 2.87Å | ||
| 117 | V | 96.6 | Very high | 94.3 | Very high | 23 Ų | 23 | 52.7 Ų | 52.7 | 14% | 0.139 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.4 | -39.2 | 170.7 | 179.5 | 0 | 0 | 0 | 0 | 111.3 | L78 E79 K80 F86 S120 A121 | L78-V117 HydrophobicContact CB-CG1 3.89Å; L78-V117 HydrophobicContact CG-CG1 4.44Å; E79-V117 WeakPolarHBondContact O-CG1 3.1Å; K80-V117 HydrophobicContact CB-CG2 3.95Å; F86-V117 HydrophobicContact CD1-CG1 4.47Å; V117-S120 PolarHBondContact O-N 2.65Å; V117-A121 VanDerWaalsContact O-CB 3.32Å; V117-A121 WeakPolarHBondContact O-CB 3.2Å; V117-A121 PolarHBondContact O-N 2.53Å |
| 118 | A | 96.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.7 | -46.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L78 F86 F88 I112 S116 A121 G122 L123 | L78-A118 HydrophobicContact CD2-CB 3.83Å; F86-A118 WeakPolarHBondContact O-CB 3.45Å; F86-A118 PolarHBondContact O-N 3.32Å; F88-A118 HydrophobicContact CB-CB 3.91Å; F88-A118 HydrophobicContact CD1-CB 3.95Å; F88-A118 HydrophobicContact CG-CB 4.34Å; I112-A118 HydrophobicContact CG2-CB 4.16Å; S116-A118 VanDerWaalsContact C-N 3.28Å; S116-A118 PolarHBondContact O-N 3.44Å; A118-A121 PolarHBondContact O-N 3.11Å; A118-G122 PolarHBondContact O-N 2.88Å; A118-L123 HydrophobicContact CB-CB 4.34Å; A118-L123 HydrophobicContact CB-CD2 4.01Å; A118-L123 VanDerWaalsContact O-CB 3.3Å; A118-L123 WeakPolarHBondContact O-CB 3.4Å; A118-L123 PolarHBondContact O-N 2.87Å |
| 119 | E | 96.2 | Very high | 94.4 | Very high | 91 Ų | 91 | 51.5 Ų | 51.5 | 43% | 0.425 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -64 | -43.3 | 175.9 | -175.9 | 174.2 | -128.5 | 0 | 0 | 111.2 | I112 E114 D115 S116 A121 G122 | I112-E119 HydrophobicContact CG2-CB 3.94Å; E114-E119 WeakPolarHBondContact CA-OE2 3.46Å; D115-E119 PolarHBondContact N-OE2 3.03Å; S116-E119 PolarHBondContact O-N 3.22Å; S116-E119 PolarHBondContact OG-N 2.86Å; S116-E119 VanDerWaalsContact OG-N 3.12Å; E119-A121 VanDerWaalsContact C-N 3.27Å; E119-A121 PolarHBondContact O-N 2.84Å; E119-G122 WeakPolarHBondContact O-CA 3.28Å; E119-G122 PolarHBondContact O-N 3.07Å |
| 120 | S | 96.1 | Very high | 94.4 | Very high | 104 Ų | 104 | 51.6 Ų | 51.6 | 73% | 0.727 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -62.9 | -32.3 | 177.1 | -59.7 | 0 | 0 | 0 | 0 | 113 | S116 V117 G122 | S116-S120 VanDerWaalsContact O-CB 3.32Å; S116-S120 WeakPolarHBondContact O-CB 3.27Å; S116-S120 PolarHBondContact O-N 2.83Å; S116-S120 PolarHBondContact O-OG 2.87Å; V117-S120 PolarHBondContact O-N 2.65Å; S120-G122 PolarHBondContact O-N 3.01Å |
| 121 | A | 95.4 | Very high | 94.5 | Very high | 36 Ų | 36 | 49.9 Ų | 49.9 | 30% | 0.298 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.8 | -10.3 | 172 | 0 | 0 | 0 | 0 | 0 | 113.3 | F76 L78 V117 A118 E119 | F76-A121 VanDerWaalsContact CD1-O 3.27Å; F76-A121 WeakPolarHBondContact CD1-O 3.07Å; L78-A121 HydrophobicContact CG-CB 4.21Å; V117-A121 VanDerWaalsContact O-CB 3.32Å; V117-A121 WeakPolarHBondContact O-CB 3.2Å; V117-A121 PolarHBondContact O-N 2.53Å; A118-A121 PolarHBondContact O-N 3.11Å; E119-A121 VanDerWaalsContact C-N 3.27Å; E119-A121 PolarHBondContact O-N 2.84Å |
| 122 | G | 93.4 | Very high | 94.6 | Very high | 42 Ų | 42 | 46.3 Ų | 46.3 | 43% | 0.433 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 81.4 | 17.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | F76 A118 E119 S120 | F76-G122 VanDerWaalsContact CE1-C 3.4Å; F76-G122 VanDerWaalsContact CE1-O 3.25Å; F76-G122 WeakPolarHBondContact CE1-O 3.39Å; A118-G122 PolarHBondContact O-N 2.88Å; E119-G122 WeakPolarHBondContact O-CA 3.28Å; E119-G122 PolarHBondContact O-N 3.07Å; S120-G122 PolarHBondContact O-N 3.01Å |
| 123 | L | 94.9 | Very high | 94.5 | Very high | 6 Ų | 6 | 47.8 Ų | 47.8 | 3% | 0.031 | 28% | 0.278 | C | S | . | . | trans | -64.4 | 144.3 | 171.7 | -170.5 | 64.8 | 0 | 0 | 0 | 109.2 | F76 F88 V109 I112 A118 D127 L158 T160 | F76-L123 HydrophobicContact CD2-CD1 3.49Å; F76-L123 VanDerWaalsContact CD2-CD1 3.49Å; F76-L123 HydrophobicContact CE2-CD1 3.44Å; F76-L123 VanDerWaalsContact CE2-CD1 3.44Å; F76-L123 HydrophobicContact CG-CD1 4.13Å; F76-L123 HydrophobicContact CZ-CD1 4.07Å; F88-L123 HydrophobicContact CB-CD2 4.18Å; F88-L123 HydrophobicContact CD1-CD2 4.28Å; F88-L123 HydrophobicContact CD2-CD2 4.38Å; F88-L123 HydrophobicContact CG-CD2 4.04Å; V109-L123 HydrophobicContact CG1-CD2 4.27Å; V109-L123 HydrophobicContact CG1-CG 4.48Å; V109-L123 HydrophobicContact CG2-CD1 4.09Å; V109-L123 HydrophobicContact CG2-CD2 3.91Å; V109-L123 HydrophobicContact CG2-CG 4.11Å; I112-L123 HydrophobicContact CD1-CB 3.98Å; I112-L123 HydrophobicContact CD1-CD2 4.35Å; I112-L123 HydrophobicContact CD1-CG 3.9Å; I112-L123 WeakPolarHBondContact CD1-O 3.18Å; A118-L123 HydrophobicContact CB-CB 4.34Å; A118-L123 HydrophobicContact CB-CD2 4.01Å; A118-L123 VanDerWaalsContact O-CB 3.3Å; A118-L123 WeakPolarHBondContact O-CB 3.4Å; A118-L123 PolarHBondContact O-N 2.87Å; L123-D127 HydrophobicContact CD1-CB 4.38Å; L123-L158 HydrophobicContact CD2-CD1 4.21Å; L123-T160 HydrophobicContact CD1-CG2 4.17Å | ||
| 124 | T | 92.6 | Very high | 94.2 | Very high | 74 Ų | 74 | 44.6 Ų | 44.6 | 45% | 0.454 | 28% | 0.279 | S | S | . | . | trans | -128.7 | 148.9 | -179.2 | 70.1 | 0 | 0 | 0 | 0 | 113.7 | I112 G126 D127 | I112-T124 VanDerWaalsContact CD1-C 3.48Å; I112-T124 VanDerWaalsContact CD1-CA 3.47Å; T124-G126 PolarHBondContact O-N 3.3Å; T124-D127 WeakPolarHBondContact CA-OD2 3.34Å; T124-D127 PolarHBondContact N-OD2 3.49Å; T124-D127 WeakPolarHBondContact O-CB 3.49Å; T124-D127 PolarHBondContact O-N 2.76Å; T124-D127 VanDerWaalsContact O-N 3.16Å; T124-D127 VanDerWaalsContact OG1-CG 3.26Å; T124-D127 PolarHBondContact OG1-OD1 3.4Å; T124-D127 PolarHBondContact OG1-OD2 2.74Å | ||
| 125 | A | 91.8 | Very high | 94.1 | Very high | 54 Ų | 54 | 40.4 Ų | 40.4 | 45% | 0.446 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.1 | 125.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||
| 126 | G | 88.8 | Confident | 94 | Very high | 9 Ų | 9 | 35.5 Ų | 35.5 | 9% | 0.093 | 24% | 0.242 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 107.9 | -16 | -173.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | V109 T124 V128 G163 | V109-G126 PolarHBondContact O-N 3.07Å; T124-G126 PolarHBondContact O-N 3.3Å; G126-V128 PolarHBondContact O-N 3.1Å; G126-G163 WeakPolarHBondContact O-CA 3.44Å |
| 127 | D | 91.7 | Very high | 93.9 | Very high | 17 Ų | 17 | 35.2 Ų | 35.2 | 9% | 0.091 | 24% | 0.24 | C | C | . | . | P | Polyproline II helix | trans | -61.3 | 128.9 | 179.9 | -74.6 | -34.3 | 0 | 0 | 0 | 112 | F108 V109 L123 T124 T160 | F108-D127 CarbonylContact C-O 3.48Å; F108-D127 WeakPolarHBondContact CA-O 3.28Å; F108-D127 WeakPolarHBondContact CB-O 3.4Å; V109-D127 PolarHBondContact N-O 2.8Å; L123-D127 HydrophobicContact CD1-CB 4.38Å; T124-D127 WeakPolarHBondContact CA-OD2 3.34Å; T124-D127 PolarHBondContact N-OD2 3.49Å; T124-D127 WeakPolarHBondContact O-CB 3.49Å; T124-D127 PolarHBondContact O-N 2.76Å; T124-D127 VanDerWaalsContact O-N 3.16Å; T124-D127 VanDerWaalsContact OG1-CG 3.26Å; T124-D127 PolarHBondContact OG1-OD1 3.4Å; T124-D127 PolarHBondContact OG1-OD2 2.74Å; D127-T160 HydrophobicContact CB-CG2 4.16Å |
| 128 | V | 91.8 | Very high | 93.5 | Very high | 3 Ų | 3 | 39.2 Ų | 39.2 | 2% | 0.018 | 26% | 0.256 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.4 | 119.5 | -179 | 176.5 | 0 | 0 | 0 | 0 | 109 | V66 F108 G126 T160 V161 V166 | V66-V128 HydrophobicContact CG1-CG1 3.77Å; V66-V128 HydrophobicContact CG2-CG1 4.16Å; F108-V128 HydrophobicContact CB-CG2 4.33Å; G126-V128 PolarHBondContact O-N 3.1Å; V128-T160 CarbonylContact O-C 3.56Å; V128-T160 WeakPolarHBondContact O-CA 3.15Å; V128-T160 WeakPolarHBondContact O-CB 3.32Å; V128-V161 PolarHBondContact N-O 3.03Å; V128-V161 PolarHBondContact O-N 2.61Å; V128-V166 HydrophobicContact CG2-CG2 3.44Å; V128-V166 VanDerWaalsContact CG2-CG2 3.44Å |
| 129 | I | 94.1 | Very high | 93 | Very high | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.005 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78 | 131.4 | 178.7 | -55.6 | 175.1 | 0 | 0 | 0 | 108.7 | I90 T107 V109 I132 I137 L158 T160 | I90-I129 HydrophobicContact CG2-CD1 3.58Å; T107-I129 PolarHBondContact O-N 2.99Å; V109-I129 HydrophobicContact CG2-CD1 4.09Å; V109-I129 HydrophobicContact CG2-CG1 4.2Å; I129-I132 HydrophobicContact CG2-CD1 4.18Å; I129-I132 HydrophobicContact CG2-CG1 3.82Å; I129-I137 HydrophobicContact CB-CD1 3.9Å; I129-I137 HydrophobicContact CG2-CD1 3.67Å; I129-I137 HydrophobicContact CG2-CG1 4.39Å; I129-I137 WeakPolarHBondContact O-CD1 3.49Å; I129-L158 HydrophobicContact CG2-CD2 4.24Å; I129-T160 HydrophobicContact CG1-CG2 4.32Å |
| 130 | V | 93.3 | Very high | 92.8 | Very high | 1 Ų | 1 | 40.7 Ų | 40.7 | 1% | 0.006 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.8 | -41.8 | 178.7 | 175.7 | 0 | 0 | 0 | 0 | 111.6 | V66 Y68 R73 I137 E159 V161 | V66-V130 HydrophobicContact CG1-CG2 4.33Å; Y68-V130 HydrophobicContact CD1-CB 4.33Å; Y68-V130 HydrophobicContact CD1-CG1 3.79Å; Y68-V130 HydrophobicContact CD1-CG2 3.93Å; Y68-V130 HydrophobicContact CE1-CG2 4.4Å; R73-V130 VanDerWaalsContact NH1-CG1 3.32Å; V130-I137 WeakPolarHBondContact O-CG1 3.46Å; V130-I137 PolarHBondContact O-N 2.9Å; V130-E159 PolarHBondContact N-O 2.89Å; V130-V161 HydrophobicContact CG2-CB 4.39Å; V130-V161 HydrophobicContact CG2-CG2 3.76Å |
| 131 | T | 94.7 | Very high | 92.6 | Very high | 10 Ų | 10 | 38.5 Ų | 38.5 | 6% | 0.061 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.5 | 151 | 173.9 | 85.9 | 0 | 0 | 0 | 0 | 112.5 | V135 E159 | T131-V135 CarbonylContact C-O 3.54Å; T131-V135 WeakPolarHBondContact CA-O 3.17Å; T131-V135 WeakPolarHBondContact CB-O 3.06Å; T131-E159 HydrophobicContact CG2-CB 4.5Å; T131-E159 WeakPolarHBondContact CG2-OE2 3.45Å; T131-E159 PolarHBondContact N-O 2.82Å; T131-E159 PolarHBondContact O-N 3.04Å; T131-E159 WeakPolarHBondContact OG1-CB 3.42Å; T131-E159 WeakPolarHBondContact OG1-CG 3.32Å; T131-E159 PolarHBondContact OG1-OE2 3.31Å |
| 132 | I | 96.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.3 | 118 | 175.1 | -58.6 | -171.5 | 0 | 0 | 0 | 107.4 | I129 A134 V135 I137 I145 L148 I149 L156 L158 | I129-I132 HydrophobicContact CG2-CD1 4.18Å; I129-I132 HydrophobicContact CG2-CG1 3.82Å; I132-A134 PolarHBondContact O-N 2.75Å; I132-V135 PolarHBondContact N-O 2.85Å; I132-V135 WeakPolarHBondContact O-CB 3.43Å; I132-V135 PolarHBondContact O-N 3.48Å; I132-I137 HydrophobicContact CB-CG2 4.24Å; I132-I137 HydrophobicContact CD1-CG2 3.88Å; I132-I137 HydrophobicContact CG1-CG2 3.75Å; I132-I145 HydrophobicContact CD1-CG2 3.68Å; I132-L148 HydrophobicContact CB-CB 4.49Å; I132-L148 HydrophobicContact CG2-CB 4.01Å; I132-I149 HydrophobicContact CD1-CD1 4.09Å; I132-I149 HydrophobicContact CD1-CG1 3.77Å; I132-I149 HydrophobicContact CG2-CG1 4.49Å; I132-L156 HydrophobicContact CG2-CD1 3.73Å; I132-L158 HydrophobicContact CB-CD2 4.42Å; I132-L158 HydrophobicContact CD1-CD2 4.24Å; I132-L158 HydrophobicContact CG1-CD2 3.77Å; I132-L158 HydrophobicContact CG2-CD2 4.37Å |
| 133 | N | 95.1 | Very high | 92.7 | Very high | 61 Ų | 61 | 43.1 Ų | 43.1 | 33% | 0.326 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 50.9 | 41.1 | -176.4 | -55 | -40.1 | 0 | 0 | 0 | 112.6 | V135 S152 K157 | N133-V135 PolarHBondContact O-N 2.98Å; N133-S152 WeakPolarHBondContact ND2-CB 3.29Å; N133-S152 PolarHBondContact ND2-OG 2.89Å; N133-K157 PolarHBondContact N-O 2.91Å; N133-K157 PolarHBondContact OD1-N 2.77Å |
| 134 | A | 91.6 | Very high | 92.7 | Very high | 75 Ų | 75 | 48.2 Ų | 48.2 | 62% | 0.62 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.1 | 8.5 | -173.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | I132 | I132-A134 PolarHBondContact O-N 2.75Š|
| 135 | V | 94.3 | Very high | 92.9 | Very high | 70 Ų | 70 | 44.8 Ų | 44.8 | 42% | 0.424 | 27% | 0.274 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 124.4 | 168.8 | -175.6 | 0 | 0 | 0 | 0 | 109 | T131 I132 N133 L148 | T131-V135 CarbonylContact C-O 3.54Å; T131-V135 WeakPolarHBondContact CA-O 3.17Å; T131-V135 WeakPolarHBondContact CB-O 3.06Å; I132-V135 PolarHBondContact N-O 2.85Å; I132-V135 WeakPolarHBondContact O-CB 3.43Å; I132-V135 PolarHBondContact O-N 3.48Å; N133-V135 PolarHBondContact O-N 2.98Å; V135-L148 HydrophobicContact CG1-CD1 4.28Å |
| 136 | S | 92.9 | Very high | 93.1 | Very high | 58 Ų | 58 | 44.1 Ų | 44.1 | 41% | 0.406 | 26% | 0.262 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.9 | 137.3 | 171.3 | -175.7 | 0 | 0 | 0 | 0 | 110.4 | E138 | S136-E138 PolarHBondContact OG-N 2.89Å |
| 137 | I | 92.8 | Very high | 93.4 | Very high | 5 Ų | 5 | 46.5 Ų | 46.5 | 3% | 0.026 | 27% | 0.273 | C | S | . | . | trans | -101.4 | 5.9 | 176.7 | 65.8 | 159 | 0 | 0 | 0 | 114.1 | I129 V130 I132 G139 L140 I145 L148 | I129-I137 HydrophobicContact CB-CD1 3.9Å; I129-I137 HydrophobicContact CG2-CD1 3.67Å; I129-I137 HydrophobicContact CG2-CG1 4.39Å; I129-I137 WeakPolarHBondContact O-CD1 3.49Å; V130-I137 WeakPolarHBondContact O-CG1 3.46Å; V130-I137 PolarHBondContact O-N 2.9Å; I132-I137 HydrophobicContact CB-CG2 4.24Å; I132-I137 HydrophobicContact CD1-CG2 3.88Å; I132-I137 HydrophobicContact CG1-CG2 3.75Å; I137-G139 PolarHBondContact O-N 2.76Å; I137-L140 HydrophobicContact CB-CD1 4.17Å; I137-L140 HydrophobicContact CG2-CD1 4.12Å; I137-L140 WeakPolarHBondContact O-CB 3.37Å; I137-L140 PolarHBondContact O-N 2.92Å; I137-L140 VanDerWaalsContact O-N 3.11Å; I137-I145 HydrophobicContact CB-CD1 4.29Å; I137-I145 HydrophobicContact CB-CG1 4.14Å; I137-I145 HydrophobicContact CD1-CD1 4Å; I137-I145 HydrophobicContact CD1-CG1 4.39Å; I137-I145 HydrophobicContact CD1-CG2 4.21Å; I137-I145 HydrophobicContact CG2-CG1 4.32Å; I137-L148 HydrophobicContact CG2-CD1 4.06Å | ||
| 138 | E | 89 | Confident | 93.7 | Very high | 106 Ų | 106 | 47.3 Ų | 47.3 | 50% | 0.495 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.6 | 126.1 | 174.2 | -177.7 | 176 | -172 | 0 | 0 | 111.1 | Y68 S136 L140 | Y68-E138 HydrophobicContact CD2-CB 4.41Å; Y68-E138 HydrophobicContact CD2-CG 3.91Å; Y68-E138 HydrophobicContact CE1-CB 4.46Å; Y68-E138 HydrophobicContact CE2-CB 4.17Å; Y68-E138 HydrophobicContact CE2-CG 3.6Å; S136-E138 PolarHBondContact OG-N 2.89Å; E138-L140 PolarHBondContact O-N 2.95Å |
| 139 | G | 86 | Confident | 93.8 | Very high | 66 Ų | 66 | 48.2 Ų | 48.2 | 68% | 0.68 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.4 | -1.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | I137 | I137-G139 PolarHBondContact O-N 2.76Š|
| 140 | L | 91.3 | Very high | 93.8 | Very high | 56 Ų | 56 | 55.9 Ų | 55.9 | 29% | 0.293 | 31% | 0.311 | S | S | . | . | trans | -73.9 | 146.9 | 177 | -62.1 | -170.8 | 0 | 0 | 0 | 111.9 | I137 E138 H144 I145 L148 | I137-L140 HydrophobicContact CB-CD1 4.17Å; I137-L140 HydrophobicContact CG2-CD1 4.12Å; I137-L140 WeakPolarHBondContact O-CB 3.37Å; I137-L140 PolarHBondContact O-N 2.92Å; I137-L140 VanDerWaalsContact O-N 3.11Å; E138-L140 PolarHBondContact O-N 2.95Å; L140-H144 HydrophobicContact CB-CB 4.47Å; L140-I145 HydrophobicContact CB-CD1 4.25Å; L140-I145 HydrophobicContact CB-CG1 3.9Å; L140-L148 HydrophobicContact CD1-CD1 3.82Å | ||
| 141 | S | 93.1 | Very high | 93.8 | Very high | 59 Ų | 59 | 63.4 Ų | 63.4 | 41% | 0.413 | 34% | 0.343 | S | S | . | . | trans | -74.4 | 150.1 | 171.7 | 79.6 | 0 | 0 | 0 | 0 | 111.2 | Q143 H144 I145 | S141-Q143 PolarHBondContact O-N 2.85Å; S141-Q143 VanDerWaalsContact O-N 3.07Å; S141-H144 PolarHBondContact O-N 2.93Å; S141-H144 PolarHBondContact OG-ND1 3.2Å; S141-I145 PolarHBondContact O-N 3.26Å | ||
| 142 | H | 94.4 | Very high | 93.6 | Very high | 62 Ų | 62 | 63.3 Ų | 63.3 | 29% | 0.287 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -50.6 | -37.5 | -178.4 | -175.7 | 76.6 | 0 | 0 | 0 | 113.5 | T92 I145 L146 | T92-H142 PolarHBondContact OG1-ND1 3.29Å; H142-I145 PolarHBondContact O-N 3.35Å; H142-L146 WeakPolarHBondContact O-CG 3.32Å; H142-L146 PolarHBondContact O-N 3.06Å |
| 143 | Q | 95.9 | Very high | 93.3 | Very high | 112 Ų | 112 | 68.2 Ų | 68.2 | 52% | 0.523 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -65.6 | -42.7 | 177 | -62.5 | -60.5 | -25.6 | 0 | 0 | 112.7 | S141 I145 L146 D147 | S141-Q143 PolarHBondContact O-N 2.85Å; S141-Q143 VanDerWaalsContact O-N 3.07Å; Q143-I145 VanDerWaalsContact C-N 3.25Å; Q143-I145 PolarHBondContact O-N 2.79Å; Q143-L146 PolarHBondContact O-N 2.94Å; Q143-D147 PolarHBondContact O-N 3.44Å |
| 144 | H | 95.8 | Very high | 93.3 | Very high | 114 Ų | 114 | 67.8 Ų | 67.8 | 53% | 0.528 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63 | -34.6 | 175.9 | -73.3 | 90.4 | 0 | 0 | 0 | 112 | L140 S141 D147 L148 | L140-H144 HydrophobicContact CB-CB 4.47Å; S141-H144 PolarHBondContact O-N 2.93Å; S141-H144 PolarHBondContact OG-ND1 3.2Å; H144-D147 PolarHBondContact O-N 3.49Å; H144-L148 WeakPolarHBondContact O-CG 3.25Å; H144-L148 PolarHBondContact O-N 3.13Å |
| 145 | I | 96.2 | Very high | 93.4 | Very high | 1 Ų | 1 | 68.1 Ų | 68.1 | 1% | 0.005 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -67.4 | -45.5 | 176.7 | -60.6 | 169.1 | 0 | 0 | 0 | 110.3 | I90 T107 I132 I137 L140 S141 H142 Q143 D147 L148 I149 | I90-I145 HydrophobicContact CD1-CG2 3.81Å; T107-I145 HydrophobicContact CG2-CG2 4.44Å; T107-I145 VanDerWaalsContact OG1-CD1 3.28Å; T107-I145 WeakPolarHBondContact OG1-CD1 3.3Å; I132-I145 HydrophobicContact CD1-CG2 3.68Å; I137-I145 HydrophobicContact CB-CD1 4.29Å; I137-I145 HydrophobicContact CB-CG1 4.14Å; I137-I145 HydrophobicContact CD1-CD1 4Å; I137-I145 HydrophobicContact CD1-CG1 4.39Å; I137-I145 HydrophobicContact CD1-CG2 4.21Å; I137-I145 HydrophobicContact CG2-CG1 4.32Å; L140-I145 HydrophobicContact CB-CD1 4.25Å; L140-I145 HydrophobicContact CB-CG1 3.9Å; S141-I145 PolarHBondContact O-N 3.26Å; H142-I145 PolarHBondContact O-N 3.35Å; Q143-I145 VanDerWaalsContact C-N 3.25Å; Q143-I145 PolarHBondContact O-N 2.79Å; I145-D147 VanDerWaalsContact C-N 3.29Å; I145-D147 PolarHBondContact O-N 3.41Å; I145-L148 PolarHBondContact O-N 2.76Å; I145-I149 HydrophobicContact CG2-CD1 4.38Å; I145-I149 WeakPolarHBondContact O-CG1 3.42Å; I145-I149 PolarHBondContact O-N 2.9Å; I145-I149 VanDerWaalsContact O-N 3.09Å |
| 146 | L | 95.9 | Very high | 93.6 | Very high | 40 Ų | 40 | 64.8 Ų | 64.8 | 21% | 0.209 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.8 | -39.6 | 172.7 | -69.5 | 173.8 | 0 | 0 | 0 | 112 | I90 H142 Q143 I149 R150 | I90-L146 HydrophobicContact CD1-CD2 3.92Å; I90-L146 HydrophobicContact CD1-CG 4.49Å; I90-L146 HydrophobicContact CG1-CD2 4.12Å; H142-L146 WeakPolarHBondContact O-CG 3.32Å; H142-L146 PolarHBondContact O-N 3.06Å; Q143-L146 PolarHBondContact O-N 2.94Å; L146-I149 PolarHBondContact O-N 3.3Å; L146-R150 WeakPolarHBondContact O-CB 3.21Å; L146-R150 VanDerWaalsContact O-CG 3.26Å; L146-R150 WeakPolarHBondContact O-CG 3.27Å; L146-R150 PolarHBondContact O-N 3.03Å |
| 147 | D | 96.2 | Very high | 93.8 | Very high | 60 Ų | 60 | 65.1 Ų | 65.1 | 32% | 0.321 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -69.4 | -33.5 | 178 | -70.2 | -18.5 | 0 | 0 | 0 | 112.7 | Q143 H144 I145 R150 K151 | Q143-D147 PolarHBondContact O-N 3.44Å; H144-D147 PolarHBondContact O-N 3.49Å; I145-D147 VanDerWaalsContact C-N 3.29Å; I145-D147 PolarHBondContact O-N 3.41Å; D147-R150 PolarHBondContact O-N 3.38Å; D147-R150 IonicContact OD1-NH1 2.59Å; D147-R150 PolarHBondContact OD1-NH1 3.16Å; D147-K151 WeakPolarHBondContact O-CB 3.33Å; D147-K151 WeakPolarHBondContact O-CD 3.27Å; D147-K151 WeakPolarHBondContact O-CG 3.37Å; D147-K151 PolarHBondContact O-N 2.93Å |
| 148 | L | 96.1 | Very high | 93.9 | Very high | 34 Ų | 34 | 64.9 Ų | 64.9 | 18% | 0.178 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 169.7 | -73.1 | 170.8 | 0 | 0 | 0 | 111.1 | I132 V135 I137 L140 H144 I145 K151 S152 | I132-L148 HydrophobicContact CB-CB 4.49Å; I132-L148 HydrophobicContact CG2-CB 4.01Å; V135-L148 HydrophobicContact CG1-CD1 4.28Å; I137-L148 HydrophobicContact CG2-CD1 4.06Å; L140-L148 HydrophobicContact CD1-CD1 3.82Å; H144-L148 WeakPolarHBondContact O-CG 3.25Å; H144-L148 PolarHBondContact O-N 3.13Å; I145-L148 PolarHBondContact O-N 2.76Å; L148-K151 PolarHBondContact O-N 3.29Å; L148-S152 PolarHBondContact O-N 3.46Å; L148-S152 PolarHBondContact O-OG 3.4Å; L148-S152 VanDerWaalsContact O-OG 3.12Å |
| 149 | I | 95.1 | Very high | 94.2 | Very high | 21 Ų | 21 | 61.5 Ų | 61.5 | 11% | 0.108 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -63 | -42.1 | 177.5 | -65.7 | 168.4 | 0 | 0 | 0 | 111.2 | F86 F88 I90 I132 I145 L146 S152 L156 | F86-I149 HydrophobicContact CD2-CG2 4.4Å; F86-I149 HydrophobicContact CE2-CG2 4.45Å; F88-I149 HydrophobicContact CE2-CD1 4.31Å; F88-I149 HydrophobicContact CZ-CD1 4.27Å; F88-I149 HydrophobicContact CZ-CG2 4.4Å; I90-I149 HydrophobicContact CD1-CD1 3.84Å; I132-I149 HydrophobicContact CD1-CD1 4.09Å; I132-I149 HydrophobicContact CD1-CG1 3.77Å; I132-I149 HydrophobicContact CG2-CG1 4.49Å; I145-I149 HydrophobicContact CG2-CD1 4.38Å; I145-I149 WeakPolarHBondContact O-CG1 3.42Å; I145-I149 PolarHBondContact O-N 2.9Å; I145-I149 VanDerWaalsContact O-N 3.09Å; L146-I149 PolarHBondContact O-N 3.3Å; I149-S152 PolarHBondContact O-N 2.94Å; I149-S152 PolarHBondContact O-OG 2.9Å; I149-L156 HydrophobicContact CG2-CD2 4.23Å |
| 150 | R | 93.4 | Very high | 94.5 | Very high | 163 Ų | 163 | 58.3 Ų | 58.3 | 62% | 0.615 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -68.6 | -31.7 | 177.8 | -72.6 | 166.6 | 176.5 | 162.9 | -2.6 | 113.3 | L146 D147 S152 | L146-R150 WeakPolarHBondContact O-CB 3.21Å; L146-R150 VanDerWaalsContact O-CG 3.26Å; L146-R150 WeakPolarHBondContact O-CG 3.27Å; L146-R150 PolarHBondContact O-N 3.03Å; D147-R150 PolarHBondContact O-N 3.38Å; D147-R150 IonicContact OD1-NH1 2.59Å; D147-R150 PolarHBondContact OD1-NH1 3.16Å; R150-S152 VanDerWaalsContact C-N 3.34Å |
| 151 | K | 94.4 | Very high | 94.5 | Very high | 158 Ų | 158 | 56.3 Ų | 56.3 | 69% | 0.687 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -69.5 | -30.1 | 175.5 | -76.8 | 164.7 | -172.9 | 172.2 | 0 | 112.6 | D147 L148 T153 | D147-K151 WeakPolarHBondContact O-CB 3.33Å; D147-K151 WeakPolarHBondContact O-CD 3.27Å; D147-K151 WeakPolarHBondContact O-CG 3.37Å; D147-K151 PolarHBondContact O-N 2.93Å; L148-K151 PolarHBondContact O-N 3.29Å; K151-T153 PolarHBondContact O-N 2.88Å; K151-T153 VanDerWaalsContact O-N 3.1Å |
| 152 | S | 90.4 | Very high | 93.8 | Very high | 8 Ų | 8 | 56.7 Ų | 56.7 | 6% | 0.056 | 28% | 0.278 | C | S | . | . | trans | -73.6 | 89.2 | 164 | 25.7 | 0 | 0 | 0 | 0 | 110.3 | N133 L148 I149 R150 N155 L156 | N133-S152 WeakPolarHBondContact ND2-CB 3.29Å; N133-S152 PolarHBondContact ND2-OG 2.89Å; L148-S152 PolarHBondContact O-N 3.46Å; L148-S152 PolarHBondContact O-OG 3.4Å; L148-S152 VanDerWaalsContact O-OG 3.12Å; I149-S152 PolarHBondContact O-N 2.94Å; I149-S152 PolarHBondContact O-OG 2.9Å; R150-S152 VanDerWaalsContact C-N 3.34Å; S152-N155 WeakPolarHBondContact CB-O 3.41Å; S152-L156 WeakPolarHBondContact OG-CD1 3.46Å | ||
| 153 | T | 89.4 | Confident | 92.7 | Very high | 104 Ų | 104 | 54.1 Ų | 54.1 | 64% | 0.638 | 27% | 0.269 | S | S | * | . | S | Bend | trans | -56.7 | -65.2 | -178.4 | -3.7 | 0 | 0 | 0 | 0 | 111.3 | K80 K151 | K80-T153 WeakPolarHBondContact CE-O 3.34Å; K80-T153 PolarHBondContact NZ-O 3.12Å; K151-T153 PolarHBondContact O-N 2.88Å; K151-T153 VanDerWaalsContact O-N 3.1Å |
| 154 | N | 94.5 | Very high | 91.7 | Very high | 51 Ų | 51 | 54.7 Ų | 54.7 | 27% | 0.273 | 28% | 0.275 | S | S | . | . | S | Bend | trans | -118.6 | -26.5 | -172.5 | -67.8 | 0.1 | 0 | 0 | 0 | 113.1 | E79 K80 D82 | E79-N154 CarbonylContact C-O 3.59Å; E79-N154 WeakPolarHBondContact CA-O 3.25Å; K80-N154 PolarHBondContact N-O 3.37Å; K80-N154 VanDerWaalsContact O-CB 3.3Å; K80-N154 WeakPolarHBondContact O-CB 2.98Å; D82-N154 PolarHBondContact OD1-ND2 3.35Å |
| 155 | N | 95.1 | Very high | 90.5 | Very high | 82 Ų | 82 | 51 Ų | 51 | 44% | 0.439 | 26% | 0.261 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 123.5 | 176.3 | -170.7 | -91.7 | 0 | 0 | 0 | 110.1 | L78 S152 | L78-N155 WeakPolarHBondContact O-CA 3.34Å; S152-N155 WeakPolarHBondContact CB-O 3.41Å |
| 156 | L | 96.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 26% | 0.264 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.8 | 117.6 | 178.7 | 166.3 | 66.2 | 0 | 0 | 0 | 108.8 | L78 F86 F88 I132 I149 S152 L158 | L78-L156 HydrophobicContact CB-CB 4.33Å; L78-L156 PolarHBondContact N-O 2.82Å; L78-L156 PolarHBondContact O-N 3.34Å; F86-L156 HydrophobicContact CD1-CB 4.49Å; F86-L156 HydrophobicContact CD1-CD2 4.44Å; F86-L156 HydrophobicContact CD2-CD2 3.81Å; F86-L156 HydrophobicContact CE1-CB 3.78Å; F86-L156 HydrophobicContact CE1-CD2 4.44Å; F86-L156 HydrophobicContact CE2-CB 3.98Å; F86-L156 HydrophobicContact CE2-CD2 3.81Å; F86-L156 HydrophobicContact CG-CD2 4.14Å; F86-L156 HydrophobicContact CZ-CB 3.49Å; F86-L156 VanDerWaalsContact CZ-CB 3.49Å; F86-L156 HydrophobicContact CZ-CD2 4.14Å; F86-L156 HydrophobicContact CZ-CG 4.46Å; F88-L156 HydrophobicContact CE1-CD2 3.81Å; F88-L156 HydrophobicContact CZ-CD2 3.81Å; I132-L156 HydrophobicContact CG2-CD1 3.73Å; I149-L156 HydrophobicContact CG2-CD2 4.23Å; S152-L156 WeakPolarHBondContact OG-CD1 3.46Å; L156-L158 HydrophobicContact CD1-CD2 3.79Å; L156-L158 HydrophobicContact CD1-CG 4.25Å; L156-L158 HydrophobicContact CD2-CD1 4.32Å; L156-L158 HydrophobicContact CD2-CD2 4.27Å; L156-L158 HydrophobicContact CD2-CG 4.2Å; L156-L158 HydrophobicContact CG-CD2 4.12Å; L156-L158 HydrophobicContact CG-CG 4.04Å |
| 157 | K | 97 | Very high | 88.5 | Confident | 65 Ų | 65 | 55 Ų | 55 | 28% | 0.283 | 28% | 0.278 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 119.8 | 171.1 | -172.9 | -170.5 | 174.6 | -150.7 | 0 | 109.5 | T75 F76 V77 N133 E159 | T75-K157 HydrophobicContact CG2-CD 4.29Å; T75-K157 HydrophobicContact CG2-CG 4.01Å; F76-K157 CarbonylContact O-C 3.57Å; F76-K157 WeakPolarHBondContact O-CA 3.3Å; V77-K157 HydrophobicContact CG2-CG 4.39Å; N133-K157 PolarHBondContact N-O 2.91Å; N133-K157 PolarHBondContact OD1-N 2.77Å; K157-E159 WeakPolarHBondContact CE-OE1 3.38Å; K157-E159 IonicContact NZ-OE1 2.61Å; K157-E159 PolarHBondContact NZ-OE1 2.64Å |
| 158 | L | 96.3 | Very high | 87.6 | Confident | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.9 | 144.6 | 171.9 | -62.2 | 177.9 | 0 | 0 | 0 | 110.1 | T75 F76 L78 F88 L123 I129 I132 L156 | T75-L158 CarbonylContact C-O 3.59Å; T75-L158 WeakPolarHBondContact CA-O 3.5Å; F76-L158 HydrophobicContact CB-CB 4.41Å; F76-L158 PolarHBondContact N-O 3.44Å; F76-L158 PolarHBondContact O-N 2.89Å; L78-L158 HydrophobicContact CD1-CD1 3.95Å; L78-L158 HydrophobicContact CD1-CG 4.14Å; F88-L158 HydrophobicContact CE2-CD1 4.47Å; F88-L158 HydrophobicContact CZ-CD1 4.1Å; L123-L158 HydrophobicContact CD2-CD1 4.21Å; I129-L158 HydrophobicContact CG2-CD2 4.24Å; I132-L158 HydrophobicContact CB-CD2 4.42Å; I132-L158 HydrophobicContact CD1-CD2 4.24Å; I132-L158 HydrophobicContact CG1-CD2 3.77Å; I132-L158 HydrophobicContact CG2-CD2 4.37Å; L156-L158 HydrophobicContact CD1-CD2 3.79Å; L156-L158 HydrophobicContact CD1-CG 4.25Å; L156-L158 HydrophobicContact CD2-CD1 4.32Å; L156-L158 HydrophobicContact CD2-CD2 4.27Å; L156-L158 HydrophobicContact CD2-CG 4.2Å; L156-L158 HydrophobicContact CG-CD2 4.12Å; L156-L158 HydrophobicContact CG-CG 4.04Å |
| 159 | E | 94.9 | Very high | 86.6 | Confident | 35 Ų | 35 | 58.4 Ų | 58.4 | 16% | 0.164 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.7 | 126 | 164.7 | -61.5 | 171.6 | 173.2 | 0 | 0 | 108.8 | T74 T75 V130 T131 K157 | T74-E159 WeakPolarHBondContact O-CA 3.02Å; T75-E159 HydrophobicContact CG2-CG 4.38Å; V130-E159 PolarHBondContact N-O 2.89Å; T131-E159 HydrophobicContact CG2-CB 4.5Å; T131-E159 WeakPolarHBondContact CG2-OE2 3.45Å; T131-E159 PolarHBondContact N-O 2.82Å; T131-E159 PolarHBondContact O-N 3.04Å; T131-E159 WeakPolarHBondContact OG1-CB 3.42Å; T131-E159 WeakPolarHBondContact OG1-CG 3.32Å; T131-E159 PolarHBondContact OG1-OE2 3.31Å; K157-E159 WeakPolarHBondContact CE-OE1 3.38Å; K157-E159 IonicContact NZ-OE1 2.61Å; K157-E159 PolarHBondContact NZ-OE1 2.64Å |
| 160 | T | 93.1 | Very high | 86 | Confident | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 161.6 | -175.7 | 74.9 | 0 | 0 | 0 | 0 | 113.1 | R73 T74 F76 L123 D127 V128 I129 | R73-T160 VanDerWaalsContact CA-O 3.29Å; R73-T160 WeakPolarHBondContact CA-O 3.5Å; R73-T160 WeakPolarHBondContact CG-O 3.3Å; T74-T160 PolarHBondContact N-O 2.8Å; T74-T160 PolarHBondContact O-N 3.49Å; F76-T160 HydrophobicContact CD2-CG2 3.98Å; F76-T160 HydrophobicContact CE2-CG2 3.91Å; F76-T160 WeakPolarHBondContact CE2-OG1 3.4Å; L123-T160 HydrophobicContact CD1-CG2 4.17Å; D127-T160 HydrophobicContact CB-CG2 4.16Å; V128-T160 CarbonylContact O-C 3.56Å; V128-T160 WeakPolarHBondContact O-CA 3.15Å; V128-T160 WeakPolarHBondContact O-CB 3.32Å; I129-T160 HydrophobicContact CG1-CG2 4.32Å |
| 161 | V | 89.9 | Confident | 85.6 | Confident | 13 Ų | 13 | 59.5 Ų | 59.5 | 8% | 0.079 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | 147.6 | 170.4 | 178.1 | 0 | 0 | 0 | 0 | 109.1 | D70 R73 V128 V130 G163 | D70-V161 HydrophobicContact CB-CG1 4.41Å; D70-V161 HydrophobicContact CB-CG2 4.16Å; R73-V161 HydrophobicContact CG-CG2 3.6Å; V128-V161 PolarHBondContact N-O 3.03Å; V128-V161 PolarHBondContact O-N 2.61Å; V130-V161 HydrophobicContact CG2-CB 4.39Å; V130-V161 HydrophobicContact CG2-CG2 3.76Å; V161-G163 PolarHBondContact O-N 3.44Å |
| 162 | C | 80 | Confident | 85 | Confident | 67 Ų | 67 | 55.5 Ų | 55.5 | 45% | 0.453 | 29% | 0.288 | S | S | . | . | trans | -53.8 | 125.8 | -173.4 | -62.1 | 0 | 0 | 0 | 0 | 113.5 | N164 | C162-N164 PolarHBondContact O-N 3.11Š| ||
| 163 | G | 70.6 | Confident | 84.7 | Confident | 9 Ų | 9 | 61.5 Ų | 61.5 | 9% | 0.093 | 31% | 0.313 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.3 | 13.5 | -173.6 | 0 | 0 | 0 | 0 | 0 | 119.6 | G126 V161 V165 V166 K167 | G126-G163 WeakPolarHBondContact O-CA 3.44Å; V161-G163 PolarHBondContact O-N 3.44Å; G163-V165 PolarHBondContact O-N 2.91Å; G163-V166 PolarHBondContact O-N 3.32Å; G163-K167 PolarHBondContact O-N 3.17Å |
| 164 | N | 74.9 | Confident | 84.6 | Confident | 123 Ų | 123 | 61.3 Ų | 61.3 | 66% | 0.658 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -61 | -31.5 | -179.8 | -72.8 | -19.2 | 0 | 0 | 0 | 112.5 | C162 K168 | C162-N164 PolarHBondContact O-N 3.11Å; N164-K168 WeakPolarHBondContact O-CB 3.39Å; N164-K168 PolarHBondContact O-N 3.48Å |
| 165 | V | 70.6 | Confident | 84.6 | Confident | 37 Ų | 37 | 63.2 Ų | 63.2 | 22% | 0.224 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -63.2 | -48.7 | 175.7 | 179.9 | 0 | 0 | 0 | 0 | 110.6 | L65 G163 K167 K168 I169 | L65-V165 HydrophobicContact CD1-CG1 4.26Å; L65-V165 HydrophobicContact CG-CG1 3.86Å; L65-V165 WeakPolarHBondContact O-CG1 3.38Å; G163-V165 PolarHBondContact O-N 2.91Å; V165-K167 PolarHBondContact O-N 3.2Å; V165-K168 WeakPolarHBondContact O-CB 3.45Å; V165-K168 PolarHBondContact O-N 3.25Å; V165-I169 HydrophobicContact CG1-CD1 3.74Å; V165-I169 VanDerWaalsContact O-CD1 3.27Å; V165-I169 WeakPolarHBondContact O-CD1 3.48Å; V165-I169 WeakPolarHBondContact O-CG1 3.44Å; V165-I169 PolarHBondContact O-N 2.96Å |
| 166 | V | 72.4 | Confident | 84.2 | Confident | 11 Ų | 11 | 63.5 Ų | 63.5 | 7% | 0.067 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -59.4 | -49 | 179.8 | 178.3 | 0 | 0 | 0 | 0 | 111.7 | F108 V128 G163 K168 I169 E170 | F108-V166 HydrophobicContact CB-CG2 3.79Å; F108-V166 HydrophobicContact CD1-CB 4.26Å; F108-V166 HydrophobicContact CD1-CG1 3.61Å; F108-V166 HydrophobicContact CD1-CG2 3.57Å; F108-V166 HydrophobicContact CD2-CG1 3.93Å; F108-V166 HydrophobicContact CE1-CB 4.44Å; F108-V166 HydrophobicContact CE1-CG1 3.4Å; F108-V166 HydrophobicContact CE1-CG2 4.2Å; F108-V166 HydrophobicContact CE2-CG1 3.79Å; F108-V166 HydrophobicContact CG-CB 4.45Å; F108-V166 HydrophobicContact CG-CG1 3.86Å; F108-V166 HydrophobicContact CG-CG2 3.74Å; F108-V166 HydrophobicContact CZ-CG1 3.5Å; V128-V166 HydrophobicContact CG2-CG2 3.44Å; V128-V166 VanDerWaalsContact CG2-CG2 3.44Å; G163-V166 PolarHBondContact O-N 3.32Å; V166-K168 VanDerWaalsContact C-N 3.27Å; V166-K168 PolarHBondContact O-N 3.3Å; V166-I169 WeakPolarHBondContact O-CB 3.22Å; V166-I169 PolarHBondContact O-N 2.78Å; V166-I169 VanDerWaalsContact O-N 3.11Å; V166-E170 PolarHBondContact O-N 2.81Å |
| 167 | K | 77 | Confident | 84.1 | Confident | 115 Ų | 115 | 69.7 Ų | 69.7 | 50% | 0.5 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59.6 | -39.2 | 178.5 | -68.4 | 175.5 | -178.5 | 171 | 0 | 111.7 | G163 V165 L171 | G163-K167 PolarHBondContact O-N 3.17Å; V165-K167 PolarHBondContact O-N 3.2Å; K167-L171 WeakPolarHBondContact O-CB 3.13Å; K167-L171 WeakPolarHBondContact O-CG 3.36Å; K167-L171 PolarHBondContact O-N 3.07Å; K167-L171 VanDerWaalsContact O-N 3.07Å |
| 168 | K | 78.1 | Confident | 84.1 | Confident | 121 Ų | 121 | 72.4 Ų | 72.4 | 53% | 0.526 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 175 | 180 | -175.3 | 175.4 | -173.2 | 0 | 112.1 | N164 V165 V166 L171 E172 | N164-K168 WeakPolarHBondContact O-CB 3.39Å; N164-K168 PolarHBondContact O-N 3.48Å; V165-K168 WeakPolarHBondContact O-CB 3.45Å; V165-K168 PolarHBondContact O-N 3.25Å; V166-K168 VanDerWaalsContact C-N 3.27Å; V166-K168 PolarHBondContact O-N 3.3Å; K168-L171 PolarHBondContact O-N 2.9Å; K168-E172 WeakPolarHBondContact O-CB 3.33Å; K168-E172 PolarHBondContact O-N 3.45Å |
| 169 | I | 75.7 | Confident | 84.2 | Confident | 43 Ų | 43 | 76.2 Ų | 76.2 | 22% | 0.221 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.9 | -45.4 | 178 | -66.1 | 149.7 | 0 | 0 | 0 | 111.2 | L65 L95 V165 V166 L171 E172 K173 | L65-I169 HydrophobicContact CD2-CD1 4.19Å; L65-I169 HydrophobicContact CD2-CG1 4.29Å; L95-I169 HydrophobicContact CD1-CD1 3.46Å; L95-I169 VanDerWaalsContact CD1-CD1 3.46Å; L95-I169 HydrophobicContact CD2-CB 4.44Å; L95-I169 HydrophobicContact CD2-CD1 3.51Å; L95-I169 HydrophobicContact CD2-CG1 4Å; L95-I169 HydrophobicContact CD2-CG2 3.69Å; L95-I169 HydrophobicContact CG-CD1 4.11Å; V165-I169 HydrophobicContact CG1-CD1 3.74Å; V165-I169 VanDerWaalsContact O-CD1 3.27Å; V165-I169 WeakPolarHBondContact O-CD1 3.48Å; V165-I169 WeakPolarHBondContact O-CG1 3.44Å; V165-I169 PolarHBondContact O-N 2.96Å; V166-I169 WeakPolarHBondContact O-CB 3.22Å; V166-I169 PolarHBondContact O-N 2.78Å; V166-I169 VanDerWaalsContact O-N 3.11Å; I169-L171 VanDerWaalsContact C-N 3.33Å; I169-L171 PolarHBondContact O-N 3.33Å; I169-E172 PolarHBondContact O-N 2.82Å; I169-K173 PolarHBondContact O-N 2.7Å |
| 170 | E | 80.6 | Confident | 84.2 | Confident | 94 Ų | 94 | 80 Ų | 80 | 44% | 0.439 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -60.9 | -43.6 | 178.3 | -165.3 | -160.2 | 161 | 0 | 0 | 111.4 | V166 K173 K174 | V166-E170 PolarHBondContact O-N 2.81Å; E170-K173 PolarHBondContact O-N 3.25Å; E170-K174 WeakPolarHBondContact O-CG 3.32Å; E170-K174 PolarHBondContact O-N 3.47Å; E170-K174 WeakPolarHBondContact OE1-CE 3.43Å; E170-K174 IonicContact OE1-NZ 2.8Å; E170-K174 PolarHBondContact OE1-NZ 3Å |
| 171 | L | 85.1 | Confident | 84.5 | Confident | 114 Ų | 114 | 82.6 Ų | 82.6 | 60% | 0.597 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -65.4 | -39.8 | 175.6 | -70.4 | 170.8 | 0 | 0 | 0 | 112.3 | K167 K168 I169 K174 L175 | K167-L171 WeakPolarHBondContact O-CB 3.13Å; K167-L171 WeakPolarHBondContact O-CG 3.36Å; K167-L171 PolarHBondContact O-N 3.07Å; K167-L171 VanDerWaalsContact O-N 3.07Å; K168-L171 PolarHBondContact O-N 2.9Å; I169-L171 VanDerWaalsContact C-N 3.33Å; I169-L171 PolarHBondContact O-N 3.33Å; L171-K174 PolarHBondContact O-N 3.39Å; L171-L175 VanDerWaalsContact O-CB 3.32Å; L171-L175 WeakPolarHBondContact O-CB 3.1Å; L171-L175 PolarHBondContact O-N 3.37Å |
| 172 | E | 82.3 | Confident | 84.9 | Confident | 74 Ų | 74 | 87 Ų | 87 | 35% | 0.346 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -65.5 | -39.4 | 176.4 | -169.8 | 159.3 | -175 | 0 | 0 | 111.3 | K98 K168 I169 L175 N176 | K98-E172 IonicContact NZ-OE1 3.37Å; K98-E172 PolarHBondContact NZ-OE1 2.97Å; K98-E172 IonicContact NZ-OE2 2.67Å; K98-E172 PolarHBondContact NZ-OE2 3.5Å; K168-E172 WeakPolarHBondContact O-CB 3.33Å; K168-E172 PolarHBondContact O-N 3.45Å; I169-E172 PolarHBondContact O-N 2.82Å; E172-L175 PolarHBondContact O-N 2.96Å; E172-N176 VanDerWaalsContact O-CG 3.25Å; E172-N176 PolarHBondContact O-N 3.04Å; E172-N176 PolarHBondContact O-ND2 3.37Å |
| 173 | K | 83.8 | Confident | 85.7 | Confident | 133 Ų | 133 | 91.3 Ų | 91.3 | 58% | 0.578 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -62.4 | -47.8 | 171.4 | -177.1 | 179.9 | 177.1 | -178.1 | 0 | 112.2 | I169 E170 L175 N176 Q177 | I169-K173 PolarHBondContact O-N 2.7Å; E170-K173 PolarHBondContact O-N 3.25Å; K173-L175 VanDerWaalsContact C-N 3.34Å; K173-L175 PolarHBondContact O-N 3.33Å; K173-N176 PolarHBondContact O-N 3.49Å; K173-Q177 PolarHBondContact O-N 2.95Å |
| 174 | K | 87.9 | Confident | 87 | Confident | 100 Ų | 100 | 95.5 Ų | 95.5 | 44% | 0.435 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.2 | -40.5 | 177.2 | -74.7 | 178.2 | -175.1 | 171.2 | 0 | 111.9 | E170 L171 Q177 L178 | E170-K174 WeakPolarHBondContact O-CG 3.32Å; E170-K174 PolarHBondContact O-N 3.47Å; E170-K174 WeakPolarHBondContact OE1-CE 3.43Å; E170-K174 IonicContact OE1-NZ 2.8Å; E170-K174 PolarHBondContact OE1-NZ 3Å; L171-K174 PolarHBondContact O-N 3.39Å; K174-Q177 PolarHBondContact O-N 3.41Å; K174-L178 WeakPolarHBondContact O-CB 3.37Å; K174-L178 VanDerWaalsContact O-CG 3.3Å; K174-L178 WeakPolarHBondContact O-CG 3.45Å; K174-L178 PolarHBondContact O-N 2.59Å |
| 175 | L | 93.4 | Very high | 88.1 | Confident | 91 Ų | 91 | 95.2 Ų | 95.2 | 48% | 0.476 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -59.7 | -48.6 | 175.3 | 177.6 | 62.2 | 0 | 0 | 0 | 111.3 | L171 E172 K173 Q177 L178 Q179 | L171-L175 VanDerWaalsContact O-CB 3.32Å; L171-L175 WeakPolarHBondContact O-CB 3.1Å; L171-L175 PolarHBondContact O-N 3.37Å; E172-L175 PolarHBondContact O-N 2.96Å; K173-L175 VanDerWaalsContact C-N 3.34Å; K173-L175 PolarHBondContact O-N 3.33Å; L175-Q177 PolarHBondContact O-N 2.82Å; L175-L178 PolarHBondContact O-N 3.34Å; L175-Q179 HydrophobicContact CD1-CG 4.37Å; L175-Q179 WeakPolarHBondContact O-CG 3.32Å; L175-Q179 PolarHBondContact O-N 2.9Å |
| 176 | N | 88.4 | Confident | 89.4 | Confident | 89 Ų | 89 | 98.2 Ų | 98.2 | 48% | 0.476 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.5 | -42 | 178.9 | -69.8 | -21.4 | 0 | 0 | 0 | 111.9 | E172 K173 Q179 Q180 | E172-N176 VanDerWaalsContact O-CG 3.25Å; E172-N176 PolarHBondContact O-N 3.04Å; E172-N176 PolarHBondContact O-ND2 3.37Å; K173-N176 PolarHBondContact O-N 3.49Å; N176-Q179 PolarHBondContact O-N 3.45Å; N176-Q180 PolarHBondContact O-N 2.85Å |
| 177 | Q | 94.2 | Very high | 90.7 | Very high | 130 Ų | 130 | 105 Ų | 105 | 61% | 0.607 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.9 | -43.9 | 175.3 | -173.9 | 179.9 | 3.9 | 0 | 0 | 112.3 | K173 K174 L175 Q180 S181 | K173-Q177 PolarHBondContact O-N 2.95Å; K174-Q177 PolarHBondContact O-N 3.41Å; L175-Q177 PolarHBondContact O-N 2.82Å; Q177-Q180 PolarHBondContact O-N 2.91Å; Q177-S181 WeakPolarHBondContact O-CB 3.3Å; Q177-S181 PolarHBondContact O-N 2.93Å |
| 178 | L | 97.2 | Very high | 91.7 | Very high | 121 Ų | 121 | 103.9 Ų | 103.9 | 63% | 0.634 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -66.2 | -40.1 | 176.8 | -72.5 | 170.5 | 0 | 0 | 0 | 112 | K174 L175 Q180 S181 L182 | K174-L178 WeakPolarHBondContact O-CB 3.37Å; K174-L178 VanDerWaalsContact O-CG 3.3Å; K174-L178 WeakPolarHBondContact O-CG 3.45Å; K174-L178 PolarHBondContact O-N 2.59Å; L175-L178 PolarHBondContact O-N 3.34Å; L178-Q180 VanDerWaalsContact C-N 3.33Å; L178-Q180 PolarHBondContact O-N 3.29Å; L178-S181 PolarHBondContact O-N 3.49Å; L178-L182 WeakPolarHBondContact O-CB 3.28Å; L178-L182 PolarHBondContact O-N 3.1Å |
| 179 | Q | 97.2 | Very high | 92.6 | Very high | 81 Ų | 81 | 104.5 Ų | 104.5 | 38% | 0.379 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.8 | -39.2 | 174 | -74.3 | -175.9 | 8.9 | 0 | 0 | 112.2 | L175 N176 R183 | L175-Q179 HydrophobicContact CD1-CG 4.37Å; L175-Q179 WeakPolarHBondContact O-CG 3.32Å; L175-Q179 PolarHBondContact O-N 2.9Å; N176-Q179 PolarHBondContact O-N 3.45Å; Q179-R183 VanDerWaalsContact O-CG 3.28Å; Q179-R183 WeakPolarHBondContact O-CG 3.5Å; Q179-R183 PolarHBondContact O-N 3.42Å; Q179-R183 VanDerWaalsContact O-N 3.1Å |
| 180 | Q | 96.8 | Very high | 93.6 | Very high | 113 Ų | 113 | 108.6 Ų | 108.6 | 53% | 0.528 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.2 | -50.9 | 174.7 | 177.2 | 172.8 | -10.1 | 0 | 0 | 111.2 | N176 Q177 L178 L182 R183 E184 | N176-Q180 PolarHBondContact O-N 2.85Å; Q177-Q180 PolarHBondContact O-N 2.91Å; L178-Q180 VanDerWaalsContact C-N 3.33Å; L178-Q180 PolarHBondContact O-N 3.29Å; Q180-L182 VanDerWaalsContact C-N 3.26Å; Q180-L182 PolarHBondContact O-N 2.93Å; Q180-R183 WeakPolarHBondContact O-CB 3.22Å; Q180-R183 PolarHBondContact O-N 3.45Å; Q180-E184 WeakPolarHBondContact CG-OE1 3.42Å; Q180-E184 PolarHBondContact NE2-OE1 3.28Å; Q180-E184 WeakPolarHBondContact O-CG 3.45Å; Q180-E184 PolarHBondContact O-N 2.96Å |
| 181 | S | 98.1 | Very high | 94.4 | Very high | 56 Ų | 56 | 106.9 Ų | 106.9 | 39% | 0.392 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -57.2 | -39.4 | 178.1 | -172.6 | 0 | 0 | 0 | 0 | 112.2 | Q177 L178 E184 K185 | Q177-S181 WeakPolarHBondContact O-CB 3.3Å; Q177-S181 PolarHBondContact O-N 2.93Å; L178-S181 PolarHBondContact O-N 3.49Å; S181-E184 PolarHBondContact O-N 3.12Å; S181-K185 WeakPolarHBondContact O-CB 3.27Å; S181-K185 WeakPolarHBondContact O-CG 3.41Å; S181-K185 PolarHBondContact O-N 3.37Å |
| 182 | L | 98.1 | Very high | 94.9 | Very high | 106 Ų | 106 | 105.8 Ų | 105.8 | 56% | 0.555 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.6 | -44.6 | 173.4 | -179.1 | 64.4 | 0 | 0 | 0 | 112.3 | L178 Q180 E184 K185 L186 | L178-L182 WeakPolarHBondContact O-CB 3.28Å; L178-L182 PolarHBondContact O-N 3.1Å; Q180-L182 VanDerWaalsContact C-N 3.26Å; Q180-L182 PolarHBondContact O-N 2.93Å; L182-E184 VanDerWaalsContact C-N 3.31Å; L182-E184 PolarHBondContact O-N 3.02Å; L182-K185 PolarHBondContact O-N 2.91Å; L182-L186 HydrophobicContact CD1-CD1 4.36Å; L182-L186 HydrophobicContact CD1-CG 4.38Å; L182-L186 HydrophobicContact CG-CD1 4.11Å; L182-L186 WeakPolarHBondContact O-CB 3.45Å; L182-L186 VanDerWaalsContact O-CG 3.27Å; L182-L186 WeakPolarHBondContact O-CG 3.45Å; L182-L186 PolarHBondContact O-N 3.4Å |
| 183 | R | 97.5 | Very high | 95.6 | Very high | 157 Ų | 157 | 103.6 Ų | 103.6 | 59% | 0.592 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.4 | -37.2 | 177 | -70.6 | 168.1 | -171.1 | 176.6 | 6.1 | 112.1 | Q179 Q180 K187 | Q179-R183 VanDerWaalsContact O-CG 3.28Å; Q179-R183 WeakPolarHBondContact O-CG 3.5Å; Q179-R183 PolarHBondContact O-N 3.42Å; Q179-R183 VanDerWaalsContact O-N 3.1Å; Q180-R183 WeakPolarHBondContact O-CB 3.22Å; Q180-R183 PolarHBondContact O-N 3.45Å; R183-K187 WeakPolarHBondContact O-CG 3.39Å; R183-K187 PolarHBondContact O-N 2.92Å |
| 184 | E | 98.2 | Very high | 96.1 | Very high | 97 Ų | 97 | 102 Ų | 102 | 45% | 0.453 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.4 | -49.1 | 176 | -71.2 | 164.6 | -175.5 | 0 | 0 | 110.8 | Q180 S181 L182 L186 K187 E188 | Q180-E184 WeakPolarHBondContact CG-OE1 3.42Å; Q180-E184 PolarHBondContact NE2-OE1 3.28Å; Q180-E184 WeakPolarHBondContact O-CG 3.45Å; Q180-E184 PolarHBondContact O-N 2.96Å; S181-E184 PolarHBondContact O-N 3.12Å; L182-E184 VanDerWaalsContact C-N 3.31Å; L182-E184 PolarHBondContact O-N 3.02Å; E184-L186 VanDerWaalsContact C-N 3.32Å; E184-L186 PolarHBondContact O-N 3.3Å; E184-K187 WeakPolarHBondContact O-CB 3.46Å; E184-K187 PolarHBondContact O-N 3.38Å; E184-K187 VanDerWaalsContact O-N 3.12Å; E184-E188 PolarHBondContact O-N 3.01Å |
| 185 | K | 98.1 | Very high | 96.4 | Very high | 116 Ų | 116 | 102.9 Ų | 102.9 | 50% | 0.504 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.7 | -31.7 | 178 | -73.5 | -71.1 | 168.2 | -160.7 | 0 | 113.8 | S181 L182 E188 F189 | S181-K185 WeakPolarHBondContact O-CB 3.27Å; S181-K185 WeakPolarHBondContact O-CG 3.41Å; S181-K185 PolarHBondContact O-N 3.37Å; L182-K185 PolarHBondContact O-N 2.91Å; K185-E188 WeakPolarHBondContact CD-OE2 3.48Å; K185-E188 WeakPolarHBondContact CE-OE2 3.31Å; K185-E188 IonicContact NZ-OE1 2.99Å; K185-E188 PolarHBondContact NZ-OE1 3.26Å; K185-E188 IonicContact NZ-OE2 2.67Å; K185-E188 PolarHBondContact NZ-OE2 2.98Å; K185-F189 VanDerWaalsContact O-CB 3.31Å; K185-F189 WeakPolarHBondContact O-CB 3.39Å; K185-F189 PolarHBondContact O-N 3.23Å |
| 186 | L | 98.2 | Very high | 96.4 | Very high | 101 Ų | 101 | 103.5 Ų | 103.5 | 53% | 0.529 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.3 | -38.5 | 172.2 | -75.9 | 169.8 | 0 | 0 | 0 | 112.5 | L182 E184 Q190 | L182-L186 HydrophobicContact CD1-CD1 4.36Å; L182-L186 HydrophobicContact CD1-CG 4.38Å; L182-L186 HydrophobicContact CG-CD1 4.11Å; L182-L186 WeakPolarHBondContact O-CB 3.45Å; L182-L186 VanDerWaalsContact O-CG 3.27Å; L182-L186 WeakPolarHBondContact O-CG 3.45Å; L182-L186 PolarHBondContact O-N 3.4Å; E184-L186 VanDerWaalsContact C-N 3.32Å; E184-L186 PolarHBondContact O-N 3.3Å; L186-Q190 WeakPolarHBondContact O-CB 3.39Å; L186-Q190 PolarHBondContact O-N 2.97Å |
| 187 | K | 98.3 | Very high | 96.6 | Very high | 152 Ų | 152 | 106.7 Ų | 106.7 | 66% | 0.661 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67.3 | -43.5 | 174.7 | -70.4 | 172.9 | -178.8 | -178.6 | 0 | 111.8 | R183 E184 Q190 A191 | R183-K187 WeakPolarHBondContact O-CG 3.39Å; R183-K187 PolarHBondContact O-N 2.92Å; E184-K187 WeakPolarHBondContact O-CB 3.46Å; E184-K187 PolarHBondContact O-N 3.38Å; E184-K187 VanDerWaalsContact O-N 3.12Å; K187-Q190 PolarHBondContact O-N 3.46Å; K187-A191 PolarHBondContact O-N 2.67Å |
| 188 | E | 98 | Very high | 96.3 | Very high | 92 Ų | 92 | 101.9 Ų | 101.9 | 43% | 0.43 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.8 | -48.5 | 175.7 | -174.4 | -177.8 | 152.3 | 0 | 0 | 111 | E184 K185 Q190 A191 L192 | E184-E188 PolarHBondContact O-N 3.01Å; K185-E188 WeakPolarHBondContact CD-OE2 3.48Å; K185-E188 WeakPolarHBondContact CE-OE2 3.31Å; K185-E188 IonicContact NZ-OE1 2.99Å; K185-E188 PolarHBondContact NZ-OE1 3.26Å; K185-E188 IonicContact NZ-OE2 2.67Å; K185-E188 PolarHBondContact NZ-OE2 2.98Å; E188-Q190 PolarHBondContact O-N 2.91Å; E188-A191 PolarHBondContact O-N 2.99Å; E188-L192 HydrophobicContact CG-CD1 4.24Å; E188-L192 WeakPolarHBondContact O-CG 3.37Å; E188-L192 PolarHBondContact O-N 3.38Å |
| 189 | F | 97.2 | Very high | 95.9 | Very high | 134 Ų | 134 | 101 Ų | 101 | 59% | 0.588 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -58.1 | -46.8 | 174.5 | 176.5 | -101.6 | 0 | 0 | 0 | 112.2 | K185 A191 L192 S193 | K185-F189 VanDerWaalsContact O-CB 3.31Å; K185-F189 WeakPolarHBondContact O-CB 3.39Å; K185-F189 PolarHBondContact O-N 3.23Å; F189-A191 VanDerWaalsContact C-N 3.32Å; F189-A191 PolarHBondContact O-N 3.33Å; F189-L192 PolarHBondContact O-N 3.34Å; F189-S193 WeakPolarHBondContact CZ-OG 3.36Å; F189-S193 PolarHBondContact O-N 3.29Å; F189-S193 PolarHBondContact O-OG 3.18Å |
| 190 | Q | 97.5 | Very high | 95 | Very high | 129 Ų | 129 | 102.7 Ų | 102.7 | 60% | 0.603 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.3 | -39.1 | 178.6 | -174.8 | 177.9 | 0.3 | 0 | 0 | 112.4 | L186 K187 E188 L194 | L186-Q190 WeakPolarHBondContact O-CB 3.39Å; L186-Q190 PolarHBondContact O-N 2.97Å; K187-Q190 PolarHBondContact O-N 3.46Å; E188-Q190 PolarHBondContact O-N 2.91Å; Q190-L194 WeakPolarHBondContact O-CG 3.48Å; Q190-L194 PolarHBondContact O-N 2.96Å |
| 191 | A | 96.9 | Very high | 93.4 | Very high | 59 Ų | 59 | 105.6 Ų | 105.6 | 49% | 0.488 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.3 | -45.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | K187 E188 F189 L194 Q195 | K187-A191 PolarHBondContact O-N 2.67Å; E188-A191 PolarHBondContact O-N 2.99Å; F189-A191 VanDerWaalsContact C-N 3.32Å; F189-A191 PolarHBondContact O-N 3.33Å; A191-L194 PolarHBondContact O-N 3.23Å; A191-Q195 PolarHBondContact O-N 2.99Å |
| 192 | L | 96.6 | Very high | 91.5 | Very high | 90 Ų | 90 | 108.4 Ų | 108.4 | 47% | 0.471 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63 | -42 | 177.5 | -69.9 | 171.4 | 0 | 0 | 0 | 112.3 | E188 F189 L194 Q195 E196 | E188-L192 HydrophobicContact CG-CD1 4.24Å; E188-L192 WeakPolarHBondContact O-CG 3.37Å; E188-L192 PolarHBondContact O-N 3.38Å; F189-L192 PolarHBondContact O-N 3.34Å; L192-L194 VanDerWaalsContact C-N 3.27Å; L192-L194 PolarHBondContact O-N 3.02Å; L192-Q195 PolarHBondContact O-N 2.81Å; L192-E196 WeakPolarHBondContact O-CB 3.38Å; L192-E196 PolarHBondContact O-N 3.21Å |
| 193 | S | 95.4 | Very high | 89.6 | Confident | 28 Ų | 28 | 110.1 Ų | 110.1 | 20% | 0.196 | 53% | 0.529 | C | S | . | . | H | α-helix | trans | -65 | -27.2 | 175.6 | -62.4 | 0 | 0 | 0 | 0 | 113.7 | F189 R197 | F189-S193 WeakPolarHBondContact CZ-OG 3.36Å; F189-S193 PolarHBondContact O-N 3.29Å; F189-S193 PolarHBondContact O-OG 3.18Å; S193-R197 WeakPolarHBondContact O-CB 3.35Å; S193-R197 PolarHBondContact O-N 2.86Å |
| 194 | L | 95.1 | Very high | 87.7 | Confident | 100 Ų | 100 | 109 Ų | 109 | 52% | 0.524 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -76 | -41.5 | 172.1 | -72.1 | 172.7 | 0 | 0 | 0 | 111.3 | Q190 A191 L192 R197 G198 | Q190-L194 WeakPolarHBondContact O-CG 3.48Å; Q190-L194 PolarHBondContact O-N 2.96Å; A191-L194 PolarHBondContact O-N 3.23Å; L192-L194 VanDerWaalsContact C-N 3.27Å; L192-L194 PolarHBondContact O-N 3.02Å; L194-R197 PolarHBondContact O-N 3.39Å; L194-G198 PolarHBondContact O-N 3.2Å |
| 195 | Q | 94.8 | Very high | 85.7 | Confident | 118 Ų | 118 | 108.8 Ų | 108.8 | 55% | 0.551 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.5 | -47.4 | 175.2 | -177.8 | -179.9 | -9.4 | 0 | 0 | 111.7 | A191 L192 R197 G198 L199 | A191-Q195 PolarHBondContact O-N 2.99Å; L192-Q195 PolarHBondContact O-N 2.81Å; Q195-R197 VanDerWaalsContact C-N 3.32Å; Q195-R197 PolarHBondContact O-N 2.97Å; Q195-G198 PolarHBondContact O-N 3.24Å; Q195-G198 VanDerWaalsContact O-N 3.1Å; Q195-L199 HydrophobicContact CG-CD1 4.15Å; Q195-L199 WeakPolarHBondContact O-CG 3.29Å; Q195-L199 PolarHBondContact O-N 3.41Å |
| 196 | E | 92.6 | Very high | 83.3 | Confident | 105 Ų | 105 | 111.4 Ų | 111.4 | 49% | 0.491 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -55.4 | -47 | 175.1 | -179.3 | -179.8 | -156.1 | 0 | 0 | 111.1 | L192 G198 L199 M200 | L192-E196 WeakPolarHBondContact O-CB 3.38Å; L192-E196 PolarHBondContact O-N 3.21Å; E196-G198 VanDerWaalsContact C-N 3.3Å; E196-G198 PolarHBondContact O-N 3Å; E196-L199 PolarHBondContact O-N 2.87Å; E196-M200 HydrophobicContact CG-CE 3.67Å; E196-M200 HydrophobicContact CG-CG 4.49Å; E196-M200 HydrophobicContact CG-SD 4.11Å; E196-M200 WeakPolarHBondContact O-CB 3.28Å; E196-M200 WeakPolarHBondContact O-CG 3.33Å; E196-M200 PolarHBondContact O-N 3.3Å; E196-M200 VanDerWaalsContact OE1-CE 3.29Å; E196-M200 WeakPolarHBondContact OE1-CE 3.41Å |
| 197 | R | 91.6 | Very high | 81.1 | Confident | 155 Ų | 155 | 110.8 Ų | 110.8 | 59% | 0.585 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.6 | -33.4 | 177.1 | -170.5 | -177.1 | -58.2 | 153.5 | 6 | 113.1 | S193 L194 Q195 R201 | S193-R197 WeakPolarHBondContact O-CB 3.35Å; S193-R197 PolarHBondContact O-N 2.86Å; L194-R197 PolarHBondContact O-N 3.39Å; Q195-R197 VanDerWaalsContact C-N 3.32Å; Q195-R197 PolarHBondContact O-N 2.97Å; R197-R201 VanDerWaalsContact O-CB 3.28Å; R197-R201 WeakPolarHBondContact O-CB 3.41Å; R197-R201 PolarHBondContact O-N 2.94Å; R197-R201 VanDerWaalsContact O-N 3.1Å |
| 198 | G | 89.6 | Confident | 78.8 | Confident | 29 Ų | 29 | 109 Ų | 109 | 30% | 0.299 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.1 | -56.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L194 Q195 E196 M200 R201 D202 | L194-G198 PolarHBondContact O-N 3.2Å; Q195-G198 PolarHBondContact O-N 3.24Å; Q195-G198 VanDerWaalsContact O-N 3.1Å; E196-G198 VanDerWaalsContact C-N 3.3Å; E196-G198 PolarHBondContact O-N 3Å; G198-M200 VanDerWaalsContact C-N 3.27Å; G198-M200 PolarHBondContact O-N 3.37Å; G198-R201 PolarHBondContact O-N 3.1Å; G198-D202 PolarHBondContact O-N 3.1Å |
| 199 | L | 88.9 | Confident | 76.3 | Confident | 103 Ų | 103 | 110.6 Ų | 110.6 | 54% | 0.539 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -59.3 | -34.1 | -179.8 | -64.9 | 172.8 | 0 | 0 | 0 | 113.4 | Q195 E196 N203 | Q195-L199 HydrophobicContact CG-CD1 4.15Å; Q195-L199 WeakPolarHBondContact O-CG 3.29Å; Q195-L199 PolarHBondContact O-N 3.41Å; E196-L199 PolarHBondContact O-N 2.87Å; L199-N203 PolarHBondContact O-ND2 3.2Å |
| 200 | M | 77.7 | Confident | 74 | Confident | 116 Ų | 116 | 112.3 Ų | 112.3 | 57% | 0.571 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -74.3 | -30.1 | 173.5 | -72.6 | -175.9 | 179.3 | 0 | 0 | 113.3 | E196 G198 | E196-M200 HydrophobicContact CG-CE 3.67Å; E196-M200 HydrophobicContact CG-CG 4.49Å; E196-M200 HydrophobicContact CG-SD 4.11Å; E196-M200 WeakPolarHBondContact O-CB 3.28Å; E196-M200 WeakPolarHBondContact O-CG 3.33Å; E196-M200 PolarHBondContact O-N 3.3Å; E196-M200 VanDerWaalsContact OE1-CE 3.29Å; E196-M200 WeakPolarHBondContact OE1-CE 3.41Å; G198-M200 VanDerWaalsContact C-N 3.27Å; G198-M200 PolarHBondContact O-N 3.37Å |
| 201 | R | 63.3 | Low | 71.6 | Confident | 174 Ų | 174 | 114.1 Ų | 114.1 | 66% | 0.657 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -76.1 | -38.5 | 178 | 176.2 | 172.1 | -78.3 | -147.8 | -5.6 | 111.7 | R197 G198 N203 L204 | R197-R201 VanDerWaalsContact O-CB 3.28Å; R197-R201 WeakPolarHBondContact O-CB 3.41Å; R197-R201 PolarHBondContact O-N 2.94Å; R197-R201 VanDerWaalsContact O-N 3.1Å; G198-R201 PolarHBondContact O-N 3.1Å; R201-N203 PolarHBondContact O-N 3.49Å; R201-L204 PolarHBondContact O-N 2.96Å; R201-L204 VanDerWaalsContact O-N 3.12Å |
| 202 | D | 57.8 | Low | 69.4 | Low | 115 Ų | 115 | 119 Ų | 119 | 62% | 0.615 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -67.5 | -22 | -178 | -64.3 | -21.2 | 0 | 0 | 0 | 112.6 | G198 L204 | G198-D202 PolarHBondContact O-N 3.1Å; D202-L204 VanDerWaalsContact C-N 3.33Å; D202-L204 PolarHBondContact O-N 3.12Å |
| 203 | N | 58 | Low | 67 | Low | 142 Ų | 142 | 123 Ų | 123 | 76% | 0.759 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -1.9 | 173.8 | -85.6 | -76.4 | 0 | 0 | 0 | 115.3 | L199 R201 | L199-N203 PolarHBondContact O-ND2 3.2Å; R201-N203 PolarHBondContact O-N 3.49Å |
| 204 | L | 57.2 | Low | 64.1 | Low | 135 Ų | 135 | 129 Ų | 129 | 71% | 0.707 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.4 | 4.1 | -179.2 | -78.8 | 169.2 | 0 | 0 | 0 | 114.2 | R201 D202 | R201-L204 PolarHBondContact O-N 2.96Å; R201-L204 VanDerWaalsContact O-N 3.12Å; D202-L204 VanDerWaalsContact C-N 3.33Å; D202-L204 PolarHBondContact O-N 3.12Å |
| 205 | N | 56.5 | Low | 61.6 | Low | 92 Ų | 92 | 129 Ų | 129 | 49% | 0.492 | 68% | 0.677 | S | S | . | * | trans | -104.6 | -6.3 | -176 | -92.8 | 13 | 0 | 0 | 0 | 115.8 | S207 | N205-S207 PolarHBondContact O-N 3.27Å; N205-S207 VanDerWaalsContact O-N 3.12Å | ||
| 206 | D | 48.3 | Very low | 58.9 | Low | 171 Ų | 171 | 129.2 Ų | 129.2 | 91% | 0.914 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -71.7 | 2.2 | 172.9 | -95.6 | -5.9 | 0 | 0 | 0 | 113.8 | ||
| 207 | S | 52.4 | Low | 56.4 | Low | 88 Ų | 88 | 127.5 Ų | 127.5 | 62% | 0.615 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -141.3 | 124.3 | 161.5 | 55.7 | 0 | 0 | 0 | 0 | 111.4 | N205 | N205-S207 PolarHBondContact O-N 3.27Å; N205-S207 VanDerWaalsContact O-N 3.12Å |
| 208 | S | 49.5 | Very low | 53.6 | Low | 114 Ų | 114 | 128.4 Ų | 128.4 | 80% | 0.797 | 72% | 0.716 | S | S | * | * | S | Bend | trans | 111.4 | 13.7 | 164.5 | -42.8 | 0 | 0 | 0 | 0 | 120 | ||
| 209 | L | 45.9 | Very low | 51.4 | Low | 126 Ų | 126 | 135.3 Ų | 135.3 | 66% | 0.66 | 75% | 0.746 | S | S | * | * | trans | -130.3 | 34.2 | 173.8 | -69.8 | 177.5 | 0 | 0 | 0 | 116.5 | L211 | L209-L211 PolarHBondContact O-N 3.06Š| ||
| 210 | N | 47.2 | Very low | 48.6 | Very low | 169 Ų | 169 | 133.9 Ų | 133.9 | 90% | 0.904 | 76% | 0.756 | S | S | * | * | trans | -84.4 | 44.3 | 165.5 | -86.7 | -18.8 | 0 | 0 | 0 | 113.1 | ||||
| 211 | L | 48.3 | Very low | 46.6 | Very low | 167 Ų | 167 | 134 Ų | 134 | 87% | 0.874 | 77% | 0.768 | S | S | * | * | trans | -148 | 59.7 | 173.3 | -77.5 | -177.4 | 0 | 0 | 0 | 112.4 | L209 | L209-L211 PolarHBondContact O-N 3.06Š| ||
| 212 | L | 50.3 | Low | 45.9 | Very low | 163 Ų | 163 | 130.7 Ų | 130.7 | 85% | 0.853 | 77% | 0.769 | S | S | * | * | trans | -157.6 | 73.1 | 151 | -149.9 | 73.6 | 0 | 0 | 0 | 114 | ||||
| 213 | M | 46.2 | Very low | 44.9 | Very low | 172 Ų | 172 | 134 Ų | 134 | 85% | 0.847 | 78% | 0.783 | S | S | * | * | trans | -138.9 | 92.2 | 157.4 | -99.6 | -69.3 | 109.7 | 0 | 0 | 108.8 | ||||
| 214 | D | 33.9 | Very low | 43.6 | Very low | 155 Ų | 155 | 130.8 Ų | 130.8 | 83% | 0.829 | 78% | 0.783 | S | S | * | * | trans | -152.1 | 112.9 | 152.2 | -147.3 | -8 | 0 | 0 | 0 | 110.1 | ||||
| 215 | P | 44.3 | Very low | 43 | Very low | 101 Ų | 101 | 136 Ų | 136 | 66% | 0.656 | 79% | 0.794 | S | S | * | * | trans | -106 | 87.9 | -178 | 36.7 | -28.6 | 0 | 0 | 0 | 111.9 | ||||
| 216 | S | 36.8 | Very low | 42.1 | Very low | 122 Ų | 122 | 143.5 Ų | 143.5 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | trans | -169.4 | 142.6 | 153.1 | -87.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 217 | G | 40.1 | Very low | 41.6 | Very low | 69 Ų | 69 | 138.9 Ų | 138.9 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -73 | 171.8 | -163.1 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 218 | I | 33.7 | Very low | 41.1 | Very low | 173 Ų | 173 | 145 Ų | 145 | 89% | 0.887 | 82% | 0.817 | S | S | * | * | trans | -170.7 | 145.2 | 131.8 | -95.3 | 152.2 | 0 | 0 | 0 | 109.6 | ||||
| 219 | L | 42.5 | Very low | 40.7 | Very low | 175 Ų | 175 | 150.4 Ų | 150.4 | 92% | 0.916 | 82% | 0.82 | S | S | * | * | trans | -34.1 | 133 | 170 | -170.4 | 74 | 0 | 0 | 0 | 116.5 | ||||
| 220 | G | 31 | Very low | 40.2 | Very low | 73 Ų | 73 | 153.5 Ų | 153.5 | 75% | 0.753 | 83% | 0.828 | S | S | * | * | trans | 144.6 | 114 | 155 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 221 | S | 36.1 | Very low | 39.6 | Very low | 118 Ų | 118 | 150.6 Ų | 150.6 | 83% | 0.825 | 82% | 0.822 | S | S | * | * | trans | -77 | 159.7 | 146.4 | -49.9 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 222 | P | 48.2 | Very low | 39.2 | Very low | 104 Ų | 104 | 149 Ų | 149 | 68% | 0.675 | 82% | 0.824 | S | S | * | * | cis | -154.7 | -171.4 | 44.9 | 41.7 | -18.9 | 0 | 0 | 0 | 117.6 | ||||
| 223 | M | 35.7 | Very low | 38.5 | Very low | 184 Ų | 184 | 148.1 Ų | 148.1 | 91% | 0.906 | 82% | 0.82 | S | S | * | * | trans | 60.8 | 141.5 | 146 | -123.5 | 90.7 | 74.5 | 0 | 0 | 121.2 | ||||
| 224 | G | 31.4 | Very low | 38.1 | Very low | 75 Ų | 75 | 145.4 Ų | 145.4 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | trans | 140.1 | 102 | 143.4 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 225 | R | 44.9 | Very low | 38.7 | Very low | 246 Ų | 246 | 141.9 Ų | 141.9 | 93% | 0.928 | 81% | 0.806 | S | S | * | * | trans | -52.3 | 134.6 | 170.1 | -62.7 | 166.3 | 170.8 | -100.2 | 0.9 | 114 | ||||
| 226 | R | 36.7 | Very low | 38.2 | Very low | 249 Ų | 249 | 148.6 Ų | 148.6 | 94% | 0.94 | 82% | 0.82 | S | S | * | * | trans | -166.8 | 135.5 | 138.8 | -98.2 | 166.8 | -158.1 | -98.6 | 5.4 | 106.6 | ||||
| 227 | G | 38.3 | Very low | 38.2 | Very low | 73 Ų | 73 | 153.4 Ų | 153.4 | 75% | 0.753 | 82% | 0.819 | S | S | * | * | cis | 112.2 | 68.1 | 5.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 228 | R | 41.9 | Very low | 38.1 | Very low | 217 Ų | 217 | 154.8 Ų | 154.8 | 82% | 0.819 | 82% | 0.818 | S | S | * | * | trans | -152.8 | 117 | 159.7 | -112.6 | 173.6 | -172.6 | -81.7 | -0.8 | 111.2 | ||||
| 229 | R | 41.1 | Very low | 38.4 | Very low | 228 Ų | 228 | 150 Ų | 150 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -79.6 | 150.8 | 163.2 | -63.5 | 176.2 | 176.3 | -173.2 | -2.6 | 108.3 | ||||
| 230 | F | 35.6 | Very low | 38.3 | Very low | 190 Ų | 190 | 150.5 Ų | 150.5 | 83% | 0.833 | 81% | 0.811 | S | S | * | * | trans | -109.2 | 122 | 150.1 | -79.6 | -77.1 | 0 | 0 | 0 | 108.2 | ||||
| 231 | S | 34.8 | Very low | 39.4 | Very low | 109 Ų | 109 | 153.8 Ų | 153.8 | 76% | 0.762 | 82% | 0.817 | S | S | * | * | trans | -84.6 | 145.6 | 170.6 | -53.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 232 | S | 39.4 | Very low | 39.6 | Very low | 132 Ų | 132 | 155.2 Ų | 155.2 | 92% | 0.923 | 82% | 0.815 | S | S | * | * | trans | -128.6 | 133 | 153 | -72.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 233 | D | 35.1 | Very low | 39.2 | Very low | 145 Ų | 145 | 157.9 Ų | 157.9 | 78% | 0.775 | 82% | 0.823 | S | S | * | * | trans | -100 | 144.4 | -172.8 | 173.7 | 35.8 | 0 | 0 | 0 | 110.6 | ||||
| 234 | S | 38.9 | Very low | 39.5 | Very low | 115 Ų | 115 | 153.4 Ų | 153.4 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | 179.9 | 105.5 | 142 | 28.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 235 | S | 46.7 | Very low | 40.4 | Very low | 82 Ų | 82 | 157.7 Ų | 157.7 | 57% | 0.573 | 82% | 0.815 | S | S | * | * | trans | -93.8 | 149.3 | 171 | 84.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 236 | Y | 33.4 | Very low | 40 | Very low | 242 Ų | 242 | 155 Ų | 155 | 95% | 0.949 | 81% | 0.813 | S | S | * | * | trans | -130.3 | 124.1 | 139.6 | -81.6 | -77.2 | 0 | 0 | 0 | 110.8 | ||||
| 237 | R | 36.6 | Very low | 40 | Very low | 223 Ų | 223 | 148 Ų | 148 | 84% | 0.842 | 81% | 0.81 | S | S | * | * | trans | -94.5 | 165.3 | 173.2 | -121.6 | -178 | -173.9 | -84.2 | 4.4 | 107.3 | ||||
| 238 | S | 38.2 | Very low | 39.9 | Very low | 98 Ų | 98 | 150.2 Ų | 150.2 | 69% | 0.685 | 81% | 0.813 | S | S | * | * | cis | -144 | -164.3 | -1.3 | -49.3 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 239 | G | 39.7 | Very low | 39.6 | Very low | 71 Ų | 71 | 145.7 Ų | 145.7 | 73% | 0.732 | 81% | 0.81 | S | S | * | * | cis | 169.9 | 151.3 | 6.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 240 | M | 41.2 | Very low | 39.6 | Very low | 186 Ų | 186 | 145 Ų | 145 | 92% | 0.916 | 81% | 0.813 | S | S | * | * | trans | -81.7 | 144.7 | -177.6 | -64 | 148.3 | 58.2 | 0 | 0 | 111.9 | ||||
| 241 | T | 54.4 | Low | 39.6 | Very low | 142 Ų | 142 | 139 Ų | 139 | 87% | 0.871 | 80% | 0.804 | S | S | * | * | trans | -129.3 | 122.4 | 143.8 | 49.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 242 | D | 38.9 | Very low | 39.6 | Very low | 148 Ų | 148 | 141.1 Ų | 141.1 | 79% | 0.791 | 81% | 0.807 | S | S | * | * | trans | -75.1 | 133.2 | 165.5 | 177.7 | 26.8 | 0 | 0 | 0 | 108.2 | ||||
| 243 | D | 39.8 | Very low | 39.3 | Very low | 160 Ų | 160 | 141.9 Ų | 141.9 | 86% | 0.856 | 80% | 0.8 | S | S | * | * | trans | -150.3 | 139.6 | 158.6 | -161.9 | 13.2 | 0 | 0 | 0 | 108.6 | ||||
| 244 | S | 43.5 | Very low | 39.1 | Very low | 90 Ų | 90 | 141.8 Ų | 141.8 | 63% | 0.629 | 80% | 0.8 | S | S | * | * | trans | -133.5 | 116.7 | -159.8 | 169.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 245 | D | 48.9 | Very low | 38.9 | Very low | 165 Ų | 165 | 141.9 Ų | 141.9 | 88% | 0.882 | 80% | 0.8 | S | S | * | * | trans | -140.5 | 142.4 | 167.8 | -111.7 | -29.4 | 0 | 0 | 0 | 113.2 | ||||
| 246 | Q | 37.4 | Very low | 38.6 | Very low | 189 Ų | 189 | 143.9 Ų | 143.9 | 88% | 0.883 | 81% | 0.812 | S | S | * | * | trans | -87.1 | 132.9 | -176.2 | -63.1 | 175.6 | 4.6 | 0 | 0 | 111.8 | ||||
| 247 | A | 36.4 | Very low | 38.3 | Very low | 104 Ų | 104 | 137.8 Ų | 137.8 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | -159 | 113.4 | 147.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 248 | S | 36.4 | Very low | 38.3 | Very low | 119 Ų | 119 | 131.3 Ų | 131.3 | 83% | 0.832 | 79% | 0.791 | S | S | * | * | trans | -99.8 | 122.9 | 178.8 | 56.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 249 | V | 35.6 | Very low | 37.8 | Very low | 122 Ų | 122 | 136.7 Ų | 136.7 | 74% | 0.739 | 80% | 0.798 | S | S | * | * | trans | -149.4 | 98.6 | 166.9 | -178.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 250 | F | 40.8 | Very low | 37.4 | Very low | 213 Ų | 213 | 138.2 Ų | 138.2 | 93% | 0.934 | 80% | 0.797 | S | S | * | * | trans | 49.1 | 143.3 | 166.6 | -51.2 | -69.6 | 0 | 0 | 0 | 119.4 | ||||
| 251 | G | 36.4 | Very low | 36.8 | Very low | 63 Ų | 63 | 135.8 Ų | 135.8 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | cis | 167.4 | 126.4 | -4.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 252 | D | 32.9 | Very low | 35.7 | Very low | 154 Ų | 154 | 135 Ų | 135 | 82% | 0.824 | 79% | 0.789 | S | S | * | * | trans | 53.9 | 102 | 141.6 | -73.1 | 2.7 | 0 | 0 | 0 | 122 | ||||
| 253 | L | 34.1 | Very low | 35.3 | Very low | 149 Ų | 149 | 133.7 Ų | 133.7 | 78% | 0.78 | 79% | 0.79 | S | S | * | * | 156.4 | 114.4 | 107.4 | -82.9 | 158.9 | 0 | 0 | 0 | 115.7 | |||||
| 254 | N | 31.2 | Very low | 34.8 | Very low | 142 Ų | 142 | 132.4 Ų | 132.4 | 76% | 0.759 | 79% | 0.789 | S | S | * | * | trans | 53.4 | 107.4 | 140 | -59.7 | -13.8 | 0 | 0 | 0 | 121.8 | ||||
| 255 | S | 33.6 | Very low | 34.5 | Very low | 117 Ų | 117 | 135 Ų | 135 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | 168.4 | 177.4 | 93.7 | 68.3 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 256 | P | 41.9 | Very low | 33.8 | Very low | 125 Ų | 125 | 134.9 Ų | 134.9 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | -111.8 | 158.4 | -108.2 | 32 | -14.4 | 0 | 0 | 0 | 115.2 | |||||
| 257 | S | 26.4 | Very low | 33.7 | Very low | 113 Ų | 113 | 133.7 Ų | 133.7 | 79% | 0.79 | 80% | 0.8 | S | S | * | * | trans | -115.1 | 161.9 | 164.9 | 64.4 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 258 | P | 37 | Very low | 33.4 | Very low | 88 Ų | 88 | 132.1 Ų | 132.1 | 57% | 0.571 | 79% | 0.794 | S | S | * | * | trans | -106.3 | -178 | -170.5 | 12 | 11.6 | 0 | 0 | 0 | 113.8 | ||||
| 259 | Y | 27.2 | Very low | 33.5 | Very low | 211 Ų | 211 | 132.2 Ų | 132.2 | 83% | 0.827 | 79% | 0.793 | S | S | * | * | trans | 80.4 | 144 | 168.3 | -46.3 | -64.7 | 0 | 0 | 0 | 116.1 | ||||
| 260 | S | 30.6 | Very low | 33.1 | Very low | 102 Ų | 102 | 135.5 Ų | 135.5 | 71% | 0.713 | 80% | 0.798 | S | S | * | * | cis | -169 | 144.6 | -13 | -99.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 261 | T | 28.8 | Very low | 32.7 | Very low | 135 Ų | 135 | 134.9 Ų | 134.9 | 83% | 0.828 | 80% | 0.795 | S | S | * | * | trans | -160.6 | 143.3 | 155.6 | 42.5 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 262 | T | 32.3 | Very low | 32.6 | Very low | 127 Ų | 127 | 136.4 Ų | 136.4 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | cis | -150.8 | 162.9 | -9.5 | 14.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 263 | S | 29.6 | Very low | 32.5 | Very low | 119 Ų | 119 | 138.8 Ų | 138.8 | 83% | 0.832 | 80% | 0.799 | S | S | * | * | trans | -28.8 | 134 | 179.2 | 50.9 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 264 | T | 28.8 | Very low | 32.2 | Very low | 134 Ų | 134 | 138.6 Ų | 138.6 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | trans | -95 | 142.1 | 166.7 | 46.7 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 265 | T | 38.7 | Very low | 32.2 | Very low | 144 Ų | 144 | 141.8 Ų | 141.8 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | trans | -146.2 | 105.8 | 157.3 | 52.9 | 0 | 0 | 0 | 0 | 110 | ||||
| 266 | D | 34 | Very low | 32.9 | Very low | 163 Ų | 163 | 142 Ų | 142 | 87% | 0.872 | 81% | 0.805 | S | S | * | * | -171.2 | 148 | 122.8 | -160.1 | 14.3 | 0 | 0 | 0 | 109.6 | |||||
| 267 | D | 34 | Very low | 32.3 | Very low | 164 Ų | 164 | 144 Ų | 144 | 88% | 0.877 | 81% | 0.808 | S | S | * | * | trans | -117.5 | 148.8 | -176.6 | -111.3 | -43.6 | 0 | 0 | 0 | 109.7 | ||||
| 268 | G | 30.8 | Very low | 32.6 | Very low | 71 Ų | 71 | 146.1 Ų | 146.1 | 73% | 0.732 | 81% | 0.805 | S | S | * | * | trans | 125.8 | 82.5 | 159.7 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 269 | C | 39.3 | Very low | 32.2 | Very low | 120 Ų | 120 | 149.2 Ų | 149.2 | 81% | 0.811 | 82% | 0.817 | S | S | * | * | trans | -10.8 | 136.3 | 145.6 | -55.4 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 270 | F | 27.3 | Very low | 32.1 | Very low | 192 Ų | 192 | 142.3 Ų | 142.3 | 84% | 0.842 | 81% | 0.81 | S | S | * | * | trans | -142.4 | 124.9 | 147.1 | -143 | -94.5 | 0 | 0 | 0 | 112.6 | ||||
| 271 | F | 31.5 | Very low | 32.7 | Very low | 200 Ų | 200 | 142.9 Ų | 142.9 | 88% | 0.877 | 81% | 0.811 | S | S | * | * | trans | -89.5 | 125.8 | 169.4 | -84.3 | -92.1 | 0 | 0 | 0 | 109.8 | ||||
| 272 | S | 34.3 | Very low | 32.7 | Very low | 95 Ų | 95 | 146.8 Ų | 146.8 | 66% | 0.664 | 81% | 0.811 | S | S | * | * | trans | -129.5 | 119.6 | 159.9 | -61.2 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 273 | K | 32.1 | Very low | 32.5 | Very low | 203 Ų | 203 | 151 Ų | 151 | 88% | 0.883 | 81% | 0.812 | S | S | * | * | cis | 73.7 | 77.9 | 46 | -161.2 | 172.2 | -176.4 | 176.1 | 0 | 112.2 | ||||
| 274 | D | 27.8 | Very low | 32.3 | Very low | 145 Ų | 145 | 151.1 Ų | 151.1 | 78% | 0.775 | 81% | 0.808 | S | S | * | * | trans | -81.9 | 140.8 | 170.1 | -58.9 | -61.1 | 0 | 0 | 0 | 112.1 | ||||
| 275 | F | 30.5 | Very low | 32.2 | Very low | 209 Ų | 209 | 149.8 Ų | 149.8 | 92% | 0.917 | 81% | 0.805 | S | S | * | * | trans | -161.1 | 146.7 | 132.8 | -88 | -62.1 | 0 | 0 | 0 | 109 | ||||
| 276 | P | 47.7 | Very low | 31.7 | Very low | 122 Ų | 122 | 148.5 Ų | 148.5 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | trans | -106.2 | 166.7 | -162.9 | 39.9 | -35.8 | 0 | 0 | 0 | 115.5 | ||||
| 277 | L | 29.1 | Very low | 31.5 | Very low | 167 Ų | 167 | 146.6 Ų | 146.6 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | -145.2 | 157.3 | 156.3 | -167.2 | 56.9 | 0 | 0 | 0 | 111.6 | ||||
| 278 | Q | 33.2 | Very low | 31.4 | Very low | 158 Ų | 158 | 144 Ų | 144 | 74% | 0.738 | 80% | 0.796 | S | S | * | * | trans | -71.4 | 151.4 | -168.2 | -56.2 | -177.5 | 93 | 0 | 0 | 115.4 | ||||
| 279 | D | 28.1 | Very low | 31.5 | Very low | 152 Ų | 152 | 148.3 Ų | 148.3 | 81% | 0.813 | 80% | 0.801 | S | S | * | * | 177 | 161.8 | 94.4 | -99.4 | -43.2 | 0 | 0 | 0 | 112.2 | |||||
| 280 | G | 26.8 | Very low | 31.1 | Very low | 67 Ų | 67 | 151.1 Ų | 151.1 | 69% | 0.691 | 80% | 0.802 | S | S | * | * | trans | -95.2 | -161.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 281 | P | 41.3 | Very low | 31.2 | Very low | 113 Ų | 113 | 151.1 Ų | 151.1 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | cis | -141.2 | 177.3 | -6.1 | 44.8 | -28.1 | 0 | 0 | 0 | 116.2 | ||||
| 282 | R | 29.7 | Very low | 31.1 | Very low | 217 Ų | 217 | 150.6 Ų | 150.6 | 82% | 0.819 | 81% | 0.805 | S | S | * | * | trans | 60.2 | 110.5 | 155.1 | -67.9 | -178.9 | -162.5 | -116.9 | 5.7 | 121.2 | ||||
| 283 | R | 27.2 | Very low | 30.9 | Very low | 215 Ų | 215 | 150.3 Ų | 150.3 | 81% | 0.811 | 81% | 0.808 | S | S | * | * | 161.8 | 122.9 | 107.5 | -92.9 | 166.7 | -159.5 | -102.8 | 7 | 115.5 | |||||
| 284 | T | 25.8 | Very low | 30.9 | Very low | 122 Ų | 122 | 148.4 Ų | 148.4 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | trans | 47.1 | 147.2 | 136.5 | 59.5 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 285 | S | 26.8 | Very low | 30.9 | Very low | 106 Ų | 106 | 147 Ų | 147 | 74% | 0.741 | 81% | 0.807 | S | S | * | * | trans | 85.5 | 99.1 | 161.6 | -50.7 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 286 | S | 28.9 | Very low | 31 | Very low | 117 Ų | 117 | 149 Ų | 149 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | 82.6 | 96.1 | 62 | 75.5 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 287 | S | 30 | Very low | 30.1 | Very low | 124 Ų | 124 | 148.6 Ų | 148.6 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | trans | -146.1 | 117.8 | 153.3 | 53.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 288 | S | 30.8 | Very low | 30.3 | Very low | 110 Ų | 110 | 146.6 Ų | 146.6 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -76.1 | 146.1 | 173 | 50.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 289 | L | 33 | Very low | 30.3 | Very low | 161 Ų | 161 | 145 Ų | 145 | 84% | 0.843 | 82% | 0.815 | S | S | * | * | trans | -158.1 | 107.2 | 150.1 | -105.5 | 146.1 | 0 | 0 | 0 | 112.6 | ||||
| 290 | H | 30.4 | Very low | 30.8 | Very low | 179 Ų | 179 | 143.5 Ų | 143.5 | 83% | 0.829 | 82% | 0.817 | S | S | * | * | trans | 37.5 | 120.4 | 149.5 | -75.1 | -86.2 | 0 | 0 | 0 | 122.7 | ||||
| 291 | H | 29.3 | Very low | 31.2 | Very low | 191 Ų | 191 | 146 Ų | 146 | 88% | 0.884 | 82% | 0.823 | S | S | * | * | trans | -61.8 | 145.9 | 155 | -71.8 | -96.5 | 0 | 0 | 0 | 112.4 | ||||
| 292 | Q | 31.1 | Very low | 31 | Very low | 189 Ų | 189 | 149.1 Ų | 149.1 | 88% | 0.883 | 83% | 0.833 | S | S | * | * | trans | -142.1 | 122.5 | 144.7 | -146.9 | 170.6 | 25.3 | 0 | 0 | 110.3 | ||||
| 293 | A | 29.2 | Very low | 31.2 | Very low | 89 Ų | 89 | 143.6 Ų | 143.6 | 74% | 0.736 | 83% | 0.834 | S | S | * | * | trans | -104.9 | 138.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 294 | L | 32.5 | Very low | 31.4 | Very low | 163 Ų | 163 | 137.2 Ų | 137.2 | 85% | 0.853 | 84% | 0.835 | S | S | * | * | trans | -125.9 | 104.5 | 173.1 | -85.5 | 166.1 | 0 | 0 | 0 | 110 | ||||
| 295 | C | 27 | Very low | 31.8 | Very low | 117 Ų | 117 | 137.4 Ų | 137.4 | 79% | 0.791 | 84% | 0.841 | S | S | * | * | trans | -68.7 | 139.9 | 167.3 | -56 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 296 | R | 33.9 | Very low | 32.2 | Very low | 249 Ų | 249 | 137.4 Ų | 137.4 | 94% | 0.94 | 84% | 0.841 | S | S | * | * | trans | -130.6 | 116 | 158.9 | -86.1 | -169.5 | 157.4 | -154.3 | -6.4 | 110 | ||||
| 297 | S | 28.5 | Very low | 32.4 | Very low | 115 Ų | 115 | 138.3 Ų | 138.3 | 80% | 0.804 | 84% | 0.842 | S | S | * | * | trans | -77.9 | 144.2 | 175.6 | -44.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 298 | S | 33.8 | Very low | 32.6 | Very low | 125 Ų | 125 | 138.3 Ų | 138.3 | 87% | 0.874 | 84% | 0.842 | S | S | * | * | trans | -142 | 115.9 | 156.3 | 43 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 299 | S | 33 | Very low | 32.8 | Very low | 123 Ų | 123 | 141.4 Ų | 141.4 | 86% | 0.86 | 85% | 0.849 | S | S | * | * | trans | -91.1 | 136.8 | 177.8 | -45.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 300 | S | 37.1 | Very low | 32.7 | Very low | 122 Ų | 122 | 139.2 Ų | 139.2 | 85% | 0.853 | 85% | 0.847 | S | S | * | * | trans | -124.8 | 123.2 | 161.2 | 50.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 301 | S | 36.5 | Very low | 33.1 | Very low | 119 Ų | 119 | 136.3 Ų | 136.3 | 83% | 0.832 | 84% | 0.844 | S | S | * | * | trans | -86.8 | 139.1 | -173.8 | 49 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 302 | L | 35.4 | Very low | 33.1 | Very low | 178 Ų | 178 | 132.2 Ų | 132.2 | 93% | 0.932 | 84% | 0.837 | S | S | * | * | trans | -67.5 | 138.1 | 169 | -65.7 | 159.4 | 0 | 0 | 0 | 110.8 | ||||
| 303 | A | 35.8 | Very low | 33.5 | Very low | 102 Ų | 102 | 134.2 Ų | 134.2 | 84% | 0.843 | 84% | 0.836 | S | S | * | * | trans | -137.3 | 107.8 | 158.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 304 | G | 30.9 | Very low | 33.5 | Very low | 80 Ų | 80 | 138.4 Ų | 138.4 | 83% | 0.825 | 84% | 0.841 | S | S | * | * | trans | -88.5 | 154.4 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 305 | S | 34.4 | Very low | 33.5 | Very low | 127 Ų | 127 | 138.5 Ų | 138.5 | 89% | 0.888 | 84% | 0.837 | S | S | * | * | trans | -150.5 | 101.5 | 170.2 | 57.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 306 | S | 34.1 | Very low | 33.8 | Very low | 105 Ų | 105 | 139 Ų | 139 | 73% | 0.734 | 84% | 0.837 | S | S | * | * | trans | -94 | 137.2 | 170.2 | 51.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 307 | T | 34.1 | Very low | 34 | Very low | 137 Ų | 137 | 136.9 Ų | 136.9 | 84% | 0.84 | 83% | 0.829 | S | S | * | * | trans | 52 | 114.6 | 150.3 | 59.6 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 308 | S | 34.6 | Very low | 34.4 | Very low | 124 Ų | 124 | 138.4 Ų | 138.4 | 87% | 0.867 | 83% | 0.826 | S | S | * | * | trans | -145.7 | 143.9 | 146.9 | 61.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 309 | L | 34.1 | Very low | 34.6 | Very low | 175 Ų | 175 | 137 Ų | 137 | 92% | 0.916 | 82% | 0.817 | S | S | * | * | trans | -84.4 | 162.3 | -166.7 | -66.6 | 152.8 | 0 | 0 | 0 | 113.6 | ||||
| 310 | S | 30.5 | Very low | 34.9 | Very low | 114 Ų | 114 | 136.1 Ų | 136.1 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -69.9 | 154.5 | 175.3 | -41.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 311 | P | 38.8 | Very low | 35.1 | Very low | 119 Ų | 119 | 137.7 Ų | 137.7 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | trans | -109.9 | 127.8 | 137.5 | -0.6 | 21.2 | 0 | 0 | 0 | 109.1 | ||||
| 312 | S | 30.3 | Very low | 35.2 | Very low | 104 Ų | 104 | 142.2 Ų | 142.2 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | 72.1 | 104.2 | 83.3 | -165.1 | 0 | 0 | 0 | 0 | 112 | |||||
| 313 | W | 39 | Very low | 35.6 | Very low | 231 Ų | 231 | 136.7 Ų | 136.7 | 88% | 0.875 | 80% | 0.799 | S | S | * | * | trans | -88.1 | 131.7 | 170.1 | 47.8 | -88.9 | 0 | 0 | 0 | 108.6 | ||||
| 314 | E | 30.1 | Very low | 36 | Very low | 178 Ų | 178 | 138 Ų | 138 | 83% | 0.832 | 80% | 0.797 | S | S | * | * | trans | -147.5 | 140.4 | 168.4 | -162 | 73.8 | -112.5 | 0 | 0 | 107.3 | ||||
| 315 | E | 32.3 | Very low | 36.6 | Very low | 164 Ų | 164 | 142 Ų | 142 | 77% | 0.766 | 80% | 0.798 | S | S | * | * | trans | -114.7 | 133.1 | -167.7 | 178.3 | 172.5 | 178.1 | 0 | 0 | 110.8 | ||||
| 316 | T | 32.5 | Very low | 37.4 | Very low | 129 Ų | 129 | 141.5 Ų | 141.5 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | trans | -175.7 | 103.3 | 148 | -76.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 317 | R | 38.2 | Very low | 38.3 | Very low | 204 Ų | 204 | 148.3 Ų | 148.3 | 77% | 0.77 | 80% | 0.802 | S | S | * | * | trans | 46.5 | 125.7 | 132.5 | -64.3 | -70.8 | -162.7 | 157.4 | 6.8 | 123.7 | ||||
| 318 | I | 37.8 | Very low | 38.7 | Very low | 146 Ų | 146 | 151.7 Ų | 151.7 | 75% | 0.749 | 81% | 0.805 | S | S | * | * | trans | 74.8 | 133.7 | 141 | -54.4 | 159.6 | 0 | 0 | 0 | 115.4 | ||||
| 319 | S | 37.7 | Very low | 39.4 | Very low | 97 Ų | 97 | 151 Ų | 151 | 68% | 0.678 | 80% | 0.8 | S | S | * | * | cis | -156 | 160.6 | 22.1 | 21.6 | 0 | 0 | 0 | 0 | 114 | ||||
| 320 | S | 37.7 | Very low | 40.4 | Very low | 103 Ų | 103 | 154.3 Ų | 154.3 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | trans | 8.9 | 155.3 | 146.1 | 61.3 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 321 | L | 41.7 | Very low | 41.4 | Very low | 155 Ų | 155 | 160.7 Ų | 160.7 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | cis | -168 | 134.6 | 18.3 | -117.4 | 146.3 | 0 | 0 | 0 | 108.5 | ||||
| 322 | F | 39.4 | Very low | 41.9 | Very low | 214 Ų | 214 | 159.2 Ų | 159.2 | 94% | 0.939 | 81% | 0.805 | S | S | * | * | trans | 169.6 | 146.5 | 140.2 | -114.5 | -98 | 0 | 0 | 0 | 111.9 | ||||
| 323 | G | 42.9 | Very low | 43 | Very low | 62 Ų | 62 | 157.8 Ų | 157.8 | 64% | 0.639 | 80% | 0.795 | S | S | * | * | trans | -89 | -173.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 324 | T | 45.6 | Very low | 43.7 | Very low | 131 Ų | 131 | 152.2 Ų | 152.2 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | cis | -159.3 | 176.9 | 18.6 | 53.7 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 325 | L | 43.7 | Very low | 44.9 | Very low | 162 Ų | 162 | 153.1 Ų | 153.1 | 85% | 0.848 | 78% | 0.782 | S | S | * | * | trans | 85.3 | 140.1 | 160.1 | -66.5 | 169.1 | 0 | 0 | 0 | 120.6 | ||||
| 326 | P | 50.2 | Low | 46.1 | Very low | 118 Ų | 118 | 153.5 Ų | 153.5 | 77% | 0.766 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 143.9 | -163.8 | 34.7 | -36.4 | 0 | 0 | 0 | 114.6 | K328 | P326-K328 PolarHBondContact O-N 2.99Š|
| 327 | R | 53.9 | Low | 47.2 | Very low | 247 Ų | 247 | 154.1 Ų | 154.1 | 93% | 0.932 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 122.8 | 170.6 | -74.8 | -179 | 168.2 | 129.5 | -2.1 | 110.9 | S329 | R327-S329 PolarHBondContact O-N 3.05Š|
| 328 | K | 42.5 | Very low | 48.1 | Very low | 208 Ų | 208 | 149.1 Ų | 149.1 | 90% | 0.904 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 125.3 | 175.7 | -166.3 | 162.7 | -176.3 | 167.5 | 0 | 110.9 | P326 | P326-K328 PolarHBondContact O-N 2.99Š|
| 329 | S | 48.3 | Very low | 48.9 | Very low | 109 Ų | 109 | 149 Ų | 149 | 76% | 0.762 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 141.8 | -179.8 | 49.8 | 0 | 0 | 0 | 0 | 111.6 | R327 R331 | R327-S329 PolarHBondContact O-N 3.05Å; S329-R331 PolarHBondContact O-N 3.01Å |
| 330 | R | 54.4 | Low | 49.9 | Very low | 245 Ų | 245 | 153.3 Ų | 153.3 | 93% | 0.925 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 133.8 | 175.2 | -69.5 | -174.5 | 176.2 | -157.5 | -0.3 | 109.3 | A332 | R330-A332 PolarHBondContact O-N 3.23Š|
| 331 | R | 52.3 | Low | 50.9 | Low | 249 Ų | 249 | 155 Ų | 155 | 94% | 0.94 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 126.2 | 172.4 | -72.5 | 178.3 | 174.4 | 165.3 | -3.2 | 109.3 | S329 | S329-R331 PolarHBondContact O-N 3.01Š|
| 332 | A | 48.8 | Very low | 51.7 | Low | 87 Ų | 87 | 152.1 Ų | 152.1 | 72% | 0.719 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 139.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | R330 | R330-A332 PolarHBondContact O-N 3.23Š|
| 333 | S | 53.2 | Low | 52.3 | Low | 75 Ų | 75 | 148 Ų | 148 | 52% | 0.524 | 74% | 0.743 | S | S | . | * | P | Polyproline II helix | trans | -63.7 | 136 | 179.3 | 179.8 | 0 | 0 | 0 | 0 | 111.7 | R335 K336 | S333-R335 PolarHBondContact O-N 3.47Å; S333-R335 PolarHBondContact OG-N 3.17Å; S333-K336 PolarHBondContact O-N 3Å |
| 334 | V | 53.8 | Low | 53.2 | Low | 114 Ų | 114 | 148.5 Ų | 148.5 | 69% | 0.691 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -55 | -18.9 | 176.7 | -178.8 | 0 | 0 | 0 | 0 | 112.5 | K336 Q337 | V334-K336 PolarHBondContact O-N 3.12Å; V334-Q337 PolarHBondContact O-N 3.04Å |
| 335 | R | 56.7 | Low | 53.6 | Low | 196 Ų | 196 | 147.5 Ų | 147.5 | 74% | 0.74 | 74% | 0.737 | S | S | * | * | G | 310 helix | trans | -56.7 | -16.7 | 175 | -68.7 | -172.8 | 176.8 | -170.7 | -1.9 | 115.1 | S333 | S333-R335 PolarHBondContact O-N 3.47Å; S333-R335 PolarHBondContact OG-N 3.17Å |
| 336 | K | 56.6 | Low | 54.1 | Low | 172 Ų | 172 | 149 Ų | 149 | 75% | 0.748 | 74% | 0.74 | S | S | * | * | G | 310 helix | trans | -81.6 | -6.9 | 175.3 | -69.8 | -163 | 174.5 | -168.3 | 0 | 115 | S333 V334 | S333-K336 PolarHBondContact O-N 3Å; V334-K336 PolarHBondContact O-N 3.12Å |
| 337 | Q | 55.7 | Low | 54.1 | Low | 142 Ų | 142 | 154.7 Ų | 154.7 | 66% | 0.664 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -96.2 | -17.9 | -175.4 | -150 | 158.1 | -12.8 | 0 | 0 | 113.5 | V334 | V334-Q337 PolarHBondContact O-N 3.04Š|
| 338 | I | 57.5 | Low | 53.9 | Low | 100 Ų | 100 | 147.7 Ų | 147.7 | 51% | 0.513 | 74% | 0.735 | S | S | . | * | G | 310 helix | trans | -75.6 | -38 | -178.1 | -50.2 | 176.4 | 0 | 0 | 0 | 111.5 | K340 L341 | I338-K340 PolarHBondContact O-N 3.43Å; I338-L341 PolarHBondContact O-N 3.48Å |
| 339 | F | 54.8 | Low | 54.2 | Low | 144 Ų | 144 | 144.8 Ų | 144.8 | 63% | 0.632 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -65.4 | -7.7 | 178 | -66 | -76.2 | 0 | 0 | 0 | 114.6 | L345 | F339-L345 HydrophobicContact CD1-CD2 3.95Å; F339-L345 HydrophobicContact CE1-CD2 3.82Å |
| 340 | K | 58.8 | Low | 54.2 | Low | 187 Ų | 187 | 147.7 Ų | 147.7 | 81% | 0.813 | 74% | 0.735 | S | S | * | * | G | 310 helix | trans | -88.9 | -7.5 | 172.3 | -68 | -170.1 | 174.4 | -170 | 0 | 113.8 | I338 | I338-K340 PolarHBondContact O-N 3.43Š|
| 341 | L | 58.3 | Low | 54.2 | Low | 139 Ų | 139 | 145.1 Ų | 145.1 | 73% | 0.728 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -104.7 | 0.6 | -174.4 | -70.2 | 164.4 | 0 | 0 | 0 | 113.5 | I338 | I338-L341 PolarHBondContact O-N 3.48Š|
| 342 | I | 59.2 | Low | 54.1 | Low | 93 Ų | 93 | 142.8 Ų | 142.8 | 48% | 0.477 | 73% | 0.734 | S | S | . | * | S | Bend | trans | -129.6 | 96.6 | 179.8 | -52.2 | 178.4 | 0 | 0 | 0 | 109.2 | G344 L345 | I342-G344 PolarHBondContact O-N 3.38Å; I342-L345 HydrophobicContact CG2-CB 4.47Å |
| 343 | P | 51.7 | Low | 54.3 | Low | 129 Ų | 129 | 147.1 Ų | 147.1 | 84% | 0.838 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.8 | 131.6 | 169.2 | -20.2 | 32.8 | 0 | 0 | 0 | 110.3 | ||
| 344 | G | 61.5 | Low | 54.1 | Low | 71 Ų | 71 | 152.1 Ų | 152.1 | 73% | 0.732 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 108.5 | -14.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | I342 Q346 | I342-G344 PolarHBondContact O-N 3.38Å; G344-Q346 PolarHBondContact O-N 3.26Å |
| 345 | L | 54.1 | Low | 53.7 | Low | 110 Ų | 110 | 150 Ų | 150 | 58% | 0.576 | 76% | 0.758 | S | S | * | * | trans | -81.5 | 31.4 | -177.8 | -141.6 | 88 | 0 | 0 | 0 | 114.7 | F339 I342 | F339-L345 HydrophobicContact CD1-CD2 3.95Å; F339-L345 HydrophobicContact CE1-CD2 3.82Å; I342-L345 HydrophobicContact CG2-CB 4.47Å | ||
| 346 | Q | 53.2 | Low | 53.5 | Low | 195 Ų | 195 | 147.8 Ų | 147.8 | 91% | 0.911 | 77% | 0.766 | S | S | * | * | trans | -135.2 | 48.9 | 175.7 | -69.2 | -152.6 | -64.8 | 0 | 0 | 112.2 | G344 | G344-Q346 PolarHBondContact O-N 3.26Š| ||
| 347 | R | 51.5 | Low | 53 | Low | 237 Ų | 237 | 148.2 Ų | 148.2 | 89% | 0.894 | 80% | 0.801 | S | S | * | * | trans | -108.6 | 106.5 | 154.1 | -81 | -168.3 | 176.7 | -131 | 1.5 | 109 | ||||
| 348 | S | 49.4 | Very low | 52.9 | Low | 100 Ų | 100 | 148.5 Ų | 148.5 | 70% | 0.699 | 81% | 0.808 | S | S | * | * | trans | -55.9 | 135 | 153.6 | -47.5 | 0 | 0 | 0 | 0 | 107.7 | E350 | S348-E350 PolarHBondContact O-N 3.42Š| ||
| 349 | V | 48 | Very low | 52.6 | Low | 146 Ų | 146 | 151.1 Ų | 151.1 | 89% | 0.885 | 82% | 0.824 | S | S | * | * | trans | -77 | 98 | 160.8 | 175.4 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 350 | E | 49.1 | Very low | 52.5 | Low | 170 Ų | 170 | 151.4 Ų | 151.4 | 79% | 0.794 | 84% | 0.835 | S | S | * | * | trans | -95.1 | 150.8 | 160.8 | -71.6 | -167 | 177.1 | 0 | 0 | 109 | S348 | S348-E350 PolarHBondContact O-N 3.42Š| ||
| 351 | E | 54.9 | Low | 52.1 | Low | 192 Ų | 192 | 149.4 Ų | 149.4 | 90% | 0.897 | 84% | 0.836 | S | S | * | * | trans | -73.6 | 146.8 | -162.5 | -61.8 | 153.7 | 152.1 | 0 | 0 | 111.6 | ||||
| 352 | E | 49.6 | Very low | 51.7 | Low | 200 Ų | 200 | 150 Ų | 150 | 94% | 0.935 | 84% | 0.843 | S | S | * | * | trans | -136.1 | 81.7 | 164.1 | -153.6 | 170.2 | -149.6 | 0 | 0 | 109.2 | ||||
| 353 | E | 53.2 | Low | 51.2 | Low | 177 Ų | 177 | 153.8 Ų | 153.8 | 83% | 0.827 | 87% | 0.867 | S | S | * | * | trans | -117.4 | 149.8 | 159.4 | -171.4 | 176.2 | 177.8 | 0 | 0 | 108 | ||||
| 354 | M | 47.9 | Very low | 51.2 | Low | 181 Ų | 181 | 155.6 Ų | 155.6 | 89% | 0.892 | 87% | 0.869 | S | S | * | * | trans | 77.6 | 127.4 | -165 | -49.3 | -174.2 | -70.5 | 0 | 0 | 114.2 | ||||
| 355 | G | 45.4 | Very low | 50.4 | Low | 70 Ų | 70 | 162.1 Ų | 162.1 | 72% | 0.722 | 88% | 0.88 | S | S | * | * | cis | -179.1 | 159.7 | -3.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 356 | T | 52.5 | Low | 50.1 | Low | 148 Ų | 148 | 166.4 Ų | 166.4 | 91% | 0.908 | 91% | 0.905 | S | S | * | * | trans | -7.7 | 129.5 | 166.3 | 53 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 357 | A | 46.4 | Very low | 49.8 | Very low | 181 Ų | 181 | 163.8 Ų | 163.8 | 100% | 1.496 | 90% | 0.904 | S | S | * | * | trans | -150.3 | 0 | 130.3 | 0 | 0 | 0 | 0 | 0 | 109.7 |
Retrieved 357 of 357 residues in 464.1 ms
(Link to these results)