| 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 | 49.3 | Very low | 58.5 | Low | 244 Ų | 244 | 126.8 Ų | 126.8 | 100% | 1.202 | 85% | 0.85 | S | S | * | * | 0 | 101.2 | 0 | -57.7 | 91.8 | 136.9 | 0 | 0 | 106.8 | |||||
| 2 | G | 42.8 | Very low | 58.7 | Low | 71 Ų | 71 | 123.9 Ų | 123.9 | 73% | 0.732 | 84% | 0.843 | S | S | * | * | cis | 86.8 | 78.3 | 19.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 3 | D | 48.6 | Very low | 59.4 | Low | 173 Ų | 173 | 123.1 Ų | 123.1 | 93% | 0.925 | 83% | 0.834 | S | S | * | * | trans | -152.2 | 113.4 | 143.3 | -107.7 | -51.6 | 0 | 0 | 0 | 109.9 | ||||
| 4 | A | 50.4 | Low | 59.3 | Low | 96 Ų | 96 | 123.5 Ų | 123.5 | 79% | 0.793 | 84% | 0.835 | S | S | * | * | trans | -107.7 | 122.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 5 | A | 58.3 | Low | 58.4 | Low | 109 Ų | 109 | 123.6 Ų | 123.6 | 90% | 0.901 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 117.3 | 168.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||
| 6 | A | 59 | Low | 57.7 | Low | 99 Ų | 99 | 127.5 Ų | 127.5 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 139.6 | -170.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 7 | D | 64 | Low | 56.8 | Low | 159 Ų | 159 | 132.2 Ų | 132.2 | 85% | 0.85 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 141.5 | 162.1 | -99.3 | -43.5 | 0 | 0 | 0 | 111 | ||
| 8 | P | 73.6 | Confident | 56.3 | Low | 112 Ų | 112 | 132.7 Ų | 132.7 | 73% | 0.727 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 143.2 | 172.8 | 30.4 | -32.6 | 0 | 0 | 0 | 112.3 | ||
| 9 | P | 64.7 | Low | 56.4 | Low | 128 Ų | 128 | 131.3 Ų | 131.3 | 83% | 0.831 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 134.2 | -174.5 | 29.5 | -34.3 | 0 | 0 | 0 | 112.8 | ||
| 10 | G | 63.7 | Low | 56 | Low | 65 Ų | 65 | 131.4 Ų | 131.4 | 67% | 0.67 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -68 | 159.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 11 | P | 68.6 | Low | 55 | Low | 139 Ų | 139 | 128.8 Ų | 128.8 | 90% | 0.903 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 137.3 | 179.2 | 27.4 | -32.8 | 0 | 0 | 0 | 112.6 | ||
| 12 | A | 61.8 | Low | 54.1 | Low | 92 Ų | 92 | 121.3 Ų | 121.3 | 76% | 0.76 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 153.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 13 | P | 67.3 | Low | 53.7 | Low | 113 Ų | 113 | 121.4 Ų | 121.4 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 148.1 | 175.9 | 33.7 | -34.2 | 0 | 0 | 0 | 112.6 | C15 | P13-C15 PolarHBondContact O-N 3.29Š|
| 14 | P | 57.7 | Low | 53.1 | Low | 129 Ų | 129 | 118.5 Ų | 118.5 | 84% | 0.838 | 82% | 0.815 | S | S | * | * | trans | -82.3 | 104 | 167.2 | 29.4 | -28.5 | 0 | 0 | 0 | 111.8 | ||||
| 15 | C | 46.2 | Very low | 52.4 | Low | 125 Ų | 125 | 117.2 Ų | 117.2 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | trans | 27.7 | 108.4 | 137.2 | -56.7 | 0 | 0 | 0 | 0 | 119.9 | P13 | P13-C15 PolarHBondContact O-N 3.29Š| ||
| 16 | E | 47.6 | Very low | 51.4 | Low | 186 Ų | 186 | 120.5 Ų | 120.5 | 87% | 0.869 | 81% | 0.812 | S | S | * | * | trans | -91.8 | 123.7 | 148.5 | -79.4 | -92.7 | 141 | 0 | 0 | 108.7 | ||||
| 17 | F | 42 | Very low | 50.6 | Low | 207 Ų | 207 | 121.4 Ų | 121.4 | 91% | 0.908 | 81% | 0.812 | S | S | * | * | trans | -151.2 | 134.1 | 155.3 | -158.6 | -102.2 | 0 | 0 | 0 | 112.2 | ||||
| 18 | L | 48.1 | Very low | 49.8 | Very low | 142 Ų | 142 | 120 Ų | 120 | 74% | 0.743 | 81% | 0.812 | S | S | * | * | trans | -76.6 | 177.6 | -168.1 | -96.2 | 143.4 | 0 | 0 | 0 | 114.6 | ||||
| 19 | P | 57.9 | Low | 47.9 | Very low | 106 Ų | 106 | 118.2 Ų | 118.2 | 69% | 0.688 | 81% | 0.814 | S | S | * | * | trans | -91.9 | 174.6 | -154.6 | 39.6 | -38.5 | 0 | 0 | 0 | 114.6 | ||||
| 20 | P | 47.8 | Very low | 46.5 | Very low | 133 Ų | 133 | 117.5 Ų | 117.5 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | -138.7 | 154.1 | 122.8 | 34.7 | -20.2 | 0 | 0 | 0 | 110 | |||||
| 21 | G | 34.7 | Very low | 45.1 | Very low | 77 Ų | 77 | 122.7 Ų | 122.7 | 79% | 0.794 | 83% | 0.826 | S | S | * | * | cis | 137.3 | 132.2 | 26 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 22 | G | 31.9 | Very low | 43.4 | Very low | 87 Ų | 87 | 123.4 Ų | 123.4 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | trans | 100.1 | 124.7 | 146.1 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 23 | G | 34.7 | Very low | 41.9 | Very low | 72 Ų | 72 | 122.4 Ų | 122.4 | 74% | 0.742 | 82% | 0.819 | S | S | * | * | trans | 113.4 | 91.2 | 150.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 24 | A | 36.3 | Very low | 40.2 | Very low | 113 Ų | 113 | 129.6 Ų | 129.6 | 93% | 0.934 | 83% | 0.832 | S | S | * | * | 60.6 | 127.6 | 88.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 25 | G | 34.2 | Very low | 39 | Very low | 69 Ų | 69 | 127.1 Ų | 127.1 | 71% | 0.711 | 83% | 0.83 | S | S | * | * | cis | 175 | -166.3 | 7.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 26 | L | 37.7 | Very low | 38.5 | Very low | 178 Ų | 178 | 125.7 Ų | 125.7 | 93% | 0.932 | 83% | 0.827 | S | S | * | * | trans | 92.4 | 90 | 161.7 | -50.7 | 172.4 | 0 | 0 | 0 | 118.5 | ||||
| 27 | S | 42.1 | Very low | 38.7 | Very low | 117 Ų | 117 | 122.9 Ų | 122.9 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | -78.2 | 155.9 | 128.8 | -90.7 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 28 | P | 47.7 | Very low | 38.2 | Very low | 131 Ų | 131 | 117 Ų | 117 | 85% | 0.851 | 82% | 0.815 | S | S | * | * | -141.5 | 174.4 | 64.5 | 29.3 | -5.7 | 0 | 0 | 0 | 111.8 | |||||
| 29 | G | 34 | Very low | 37.5 | Very low | 74 Ų | 74 | 115.9 Ų | 115.9 | 76% | 0.763 | 82% | 0.819 | S | S | * | * | cis | 135.7 | 129.4 | 23.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 30 | A | 34.5 | Very low | 36.4 | Very low | 112 Ų | 112 | 115.8 Ų | 115.8 | 93% | 0.926 | 83% | 0.827 | S | S | * | * | trans | -158.2 | 130.2 | 162.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 31 | Q | 34.3 | Very low | 35.7 | Very low | 175 Ų | 175 | 119 Ų | 119 | 82% | 0.818 | 83% | 0.827 | S | S | * | * | trans | -95.4 | 162.8 | -170.2 | -83.9 | -158.5 | 101 | 0 | 0 | 114.1 | ||||
| 32 | L | 32.3 | Very low | 36.4 | Very low | 154 Ų | 154 | 121 Ų | 121 | 81% | 0.806 | 83% | 0.827 | S | S | * | * | trans | 44.3 | 131.2 | 142.5 | -86.8 | 98.2 | 0 | 0 | 0 | 121.6 | ||||
| 33 | G | 31.3 | Very low | 36.6 | Very low | 70 Ų | 70 | 121 Ų | 121 | 72% | 0.722 | 82% | 0.818 | S | S | * | * | 144.1 | 114.7 | 117.9 | 0 | 0 | 0 | 0 | 0 | 118.3 | |||||
| 34 | R | 32.3 | Very low | 37.2 | Very low | 264 Ų | 264 | 123.2 Ų | 123.2 | 100% | 0.996 | 82% | 0.82 | S | S | * | * | 84.3 | 122.1 | 127.4 | -142.8 | 172.7 | -166.8 | -115.3 | 2.4 | 119.1 | |||||
| 35 | G | 32 | Very low | 36.9 | Very low | 78 Ų | 78 | 122.3 Ų | 122.3 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | 145.6 | 83.6 | 148.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 36 | A | 36.2 | Very low | 36.8 | Very low | 95 Ų | 95 | 123.5 Ų | 123.5 | 79% | 0.785 | 82% | 0.815 | S | S | * | * | trans | -98.6 | 168.3 | 142.5 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 37 | P | 50.1 | Low | 36.3 | Very low | 126 Ų | 126 | 123.8 Ų | 123.8 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | cis | -152.8 | -163.5 | 38 | 41.4 | -17.4 | 0 | 0 | 0 | 116.8 | ||||
| 38 | A | 33.1 | Very low | 35.8 | Very low | 85 Ų | 85 | 122.4 Ų | 122.4 | 70% | 0.702 | 81% | 0.808 | S | S | * | * | trans | 96.3 | 112 | 163 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 39 | S | 33.4 | Very low | 35.3 | Very low | 117 Ų | 117 | 124.8 Ų | 124.8 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | 66.5 | 101.5 | 52.4 | 82.2 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 40 | A | 34.6 | Very low | 35.9 | Very low | 104 Ų | 104 | 127.1 Ų | 127.1 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | 180 | 106.1 | 142.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 41 | F | 32.3 | Very low | 35.8 | Very low | 200 Ų | 200 | 126 Ų | 126 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | trans | -69.3 | 156.6 | 144 | -92.2 | -79.3 | 0 | 0 | 0 | 108.1 | ||||
| 42 | P | 49.2 | Very low | 35.7 | Very low | 120 Ų | 120 | 122.2 Ų | 122.2 | 78% | 0.779 | 80% | 0.798 | S | S | * | * | -151.8 | 171.1 | 64.4 | 37.7 | -15.4 | 0 | 0 | 0 | 117.8 | |||||
| 43 | A | 37.4 | Very low | 35.8 | Very low | 87 Ų | 87 | 123.8 Ų | 123.8 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | trans | -86.5 | 156.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 44 | P | 47.1 | Very low | 35.9 | Very low | 119 Ų | 119 | 130.7 Ų | 130.7 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | -145.7 | 140.8 | 110.2 | 28.2 | -7.8 | 0 | 0 | 0 | 112.7 | |||||
| 45 | A | 29.5 | Very low | 35.8 | Very low | 93 Ų | 93 | 121.9 Ų | 121.9 | 77% | 0.769 | 79% | 0.789 | S | S | * | * | 77.1 | 134.3 | 83.4 | 0 | 0 | 0 | 0 | 0 | 116 | |||||
| 46 | A | 31.7 | Very low | 36 | Very low | 94 Ų | 94 | 125.7 Ų | 125.7 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | trans | 70.2 | 145 | 157.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 47 | E | 27.4 | Very low | 36.5 | Very low | 184 Ų | 184 | 126.9 Ų | 126.9 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | cis | 178.2 | 167.3 | 1.8 | 175.4 | 175.8 | 125.7 | 0 | 0 | 106.6 | ||||
| 48 | A | 31.4 | Very low | 35.8 | Very low | 89 Ų | 89 | 125.6 Ų | 125.6 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | trans | 91 | 109.6 | 154.6 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 49 | Q | 37.8 | Very low | 36.3 | Very low | 180 Ų | 180 | 126.5 Ų | 126.5 | 84% | 0.841 | 78% | 0.782 | S | S | * | * | trans | -65.6 | 176.5 | 153.7 | -60.7 | 178.7 | -37.8 | 0 | 0 | 111.4 | ||||
| 50 | P | 45.4 | Very low | 36.2 | Very low | 124 Ų | 124 | 130 Ų | 130 | 81% | 0.805 | 79% | 0.786 | S | S | * | * | -145.7 | 143.8 | 108.1 | 33.4 | -15.9 | 0 | 0 | 0 | 117.2 | |||||
| 51 | A | 32.5 | Very low | 36.2 | Very low | 88 Ų | 88 | 130.6 Ų | 130.6 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | 75.8 | 131.9 | 124.8 | 0 | 0 | 0 | 0 | 0 | 124.1 | |||||
| 52 | A | 32.3 | Very low | 36.9 | Very low | 95 Ų | 95 | 126.5 Ų | 126.5 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | trans | 81.5 | 137 | 145.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 53 | R | 34.8 | Very low | 36.2 | Very low | 188 Ų | 188 | 126.9 Ų | 126.9 | 71% | 0.709 | 78% | 0.783 | S | S | * | * | cis | -170.1 | 140.9 | -0.8 | -120.9 | -170.4 | -172.6 | -85.8 | 5.4 | 107.1 | ||||
| 54 | R | 32.8 | Very low | 35.9 | Very low | 215 Ų | 215 | 126.5 Ų | 126.5 | 81% | 0.811 | 79% | 0.787 | S | S | * | * | trans | 70.6 | 116.4 | 136 | -136.9 | -177.7 | -130.5 | 150.9 | -4.1 | 120.1 | ||||
| 55 | G | 31.5 | Very low | 35.2 | Very low | 78 Ų | 78 | 125.2 Ų | 125.2 | 80% | 0.804 | 79% | 0.787 | S | S | * | * | trans | 141.9 | 99.6 | 146.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 56 | L | 36.3 | Very low | 35.4 | Very low | 159 Ų | 159 | 128.5 Ų | 128.5 | 83% | 0.832 | 79% | 0.788 | S | S | * | * | trans | -105.3 | 155.7 | 153.1 | -137 | 85.2 | 0 | 0 | 0 | 106.2 | ||||
| 57 | P | 45.9 | Very low | 35.5 | Very low | 119 Ų | 119 | 130 Ų | 130 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | -141.2 | 160.1 | 56.3 | 30.7 | -7.9 | 0 | 0 | 0 | 116.2 | |||||
| 58 | S | 35.3 | Very low | 36.1 | Very low | 100 Ų | 100 | 128.4 Ų | 128.4 | 70% | 0.699 | 79% | 0.785 | S | S | * | * | trans | -69.1 | 156.7 | 161 | -46.4 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 59 | P | 42.9 | Very low | 36.1 | Very low | 104 Ų | 104 | 132.5 Ų | 132.5 | 68% | 0.675 | 80% | 0.795 | S | S | * | * | -157.1 | 157.1 | 85.4 | 36.2 | -14.3 | 0 | 0 | 0 | 118 | |||||
| 60 | Q | 31.1 | Very low | 35.9 | Very low | 190 Ų | 190 | 127.6 Ų | 127.6 | 89% | 0.888 | 79% | 0.793 | S | S | * | * | trans | 61.9 | 135.9 | 140.8 | -61.5 | 175.7 | 58.6 | 0 | 0 | 123.4 | ||||
| 61 | S | 35.2 | Very low | 35.3 | Very low | 116 Ų | 116 | 126.4 Ų | 126.4 | 81% | 0.811 | 79% | 0.794 | S | S | * | * | trans | -69.1 | 172.6 | 170.8 | -128.6 | 0 | 0 | 0 | 0 | 113 | ||||
| 62 | P | 48.3 | Very low | 35.9 | Very low | 114 Ų | 114 | 128.6 Ų | 128.6 | 74% | 0.74 | 80% | 0.8 | S | S | * | * | cis | -150.8 | -178.6 | 36.7 | 39.5 | -15.6 | 0 | 0 | 0 | 119.1 | ||||
| 63 | S | 33 | Very low | 36 | Very low | 129 Ų | 129 | 127.5 Ų | 127.5 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | trans | 72.7 | 128.6 | 150.6 | -96.5 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 64 | G | 32.4 | Very low | 35.9 | Very low | 79 Ų | 79 | 127.7 Ų | 127.7 | 81% | 0.814 | 81% | 0.809 | S | S | * | * | trans | 168.2 | 85.6 | 162.3 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 65 | A | 31.3 | Very low | 36.2 | Very low | 92 Ų | 92 | 126 Ų | 126 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | trans | 24.7 | 130.6 | 149.3 | 0 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 66 | M | 33.6 | Very low | 36.7 | Very low | 161 Ų | 161 | 129.8 Ų | 129.8 | 79% | 0.793 | 81% | 0.807 | S | S | * | * | trans | 58.2 | 112.6 | 131 | -67.4 | 168 | 68.5 | 0 | 0 | 121.2 | ||||
| 67 | S | 35.2 | Very low | 36.8 | Very low | 126 Ų | 126 | 131.2 Ų | 131.2 | 88% | 0.881 | 81% | 0.81 | S | S | * | * | trans | -143.3 | 113.6 | 136.9 | -155.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 68 | Q | 38.4 | Very low | 37.1 | Very low | 150 Ų | 150 | 130.2 Ų | 130.2 | 70% | 0.701 | 81% | 0.806 | S | S | * | * | trans | -86.5 | 139.4 | 173 | -61.2 | 172.9 | 19.2 | 0 | 0 | 108.4 | ||||
| 69 | N | 32.3 | Very low | 37.5 | Very low | 175 Ų | 175 | 133.7 Ų | 133.7 | 94% | 0.936 | 82% | 0.816 | S | S | * | * | trans | -173.4 | 124 | 139.7 | -96.4 | -28.5 | 0 | 0 | 0 | 111.6 | ||||
| 70 | G | 32.4 | Very low | 37.8 | Very low | 78 Ų | 78 | 136 Ų | 136 | 80% | 0.804 | 82% | 0.817 | S | S | * | * | trans | 154.2 | 81.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 71 | A | 34.1 | Very low | 38.7 | Very low | 99 Ų | 99 | 129.9 Ų | 129.9 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -62.7 | 159.1 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 72 | P | 44.8 | Very low | 39.7 | Very low | 134 Ų | 134 | 128.7 Ų | 128.7 | 87% | 0.87 | 80% | 0.797 | S | S | * | * | trans | -97 | 154.7 | -176.7 | 38.2 | -30.8 | 0 | 0 | 0 | 112.1 | ||||
| 73 | G | 33.5 | Very low | 39.9 | Very low | 72 Ų | 72 | 135.2 Ų | 135.2 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | trans | 154.1 | 84.7 | 162.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 74 | M | 33.2 | Very low | 40.8 | Very low | 191 Ų | 191 | 134.7 Ų | 134.7 | 94% | 0.941 | 80% | 0.798 | S | S | * | * | -149.9 | 93.3 | 127.1 | -66.5 | -157.9 | 88.2 | 0 | 0 | 106.3 | |||||
| 75 | Q | 38.4 | Very low | 41.7 | Very low | 180 Ų | 180 | 136.1 Ų | 136.1 | 84% | 0.841 | 78% | 0.784 | S | S | * | * | trans | -63.6 | 125.2 | 157.2 | -83 | 176.1 | 10.1 | 0 | 0 | 106.5 | ||||
| 76 | E | 42.8 | Very low | 42.9 | Very low | 157 Ų | 157 | 137.6 Ų | 137.6 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | 95 | 101.8 | 107.1 | -174.1 | -164 | -173.8 | 0 | 0 | 110.1 | |||||
| 77 | E | 38.4 | Very low | 43.6 | Very low | 190 Ų | 190 | 136.7 Ų | 136.7 | 89% | 0.888 | 77% | 0.772 | S | S | * | * | trans | -147.8 | 76.8 | 152.1 | -101.3 | 146.3 | -175.2 | 0 | 0 | 107.1 | L79 | E77-L79 PolarHBondContact O-N 2.85Š| ||
| 78 | S | 52.6 | Low | 43.9 | Very low | 97 Ų | 97 | 139.4 Ų | 139.4 | 68% | 0.678 | 77% | 0.768 | S | S | * | * | trans | 25.4 | 84 | 136.2 | -163.3 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 79 | L | 44.3 | Very low | 44.1 | Very low | 174 Ų | 174 | 137.5 Ų | 137.5 | 91% | 0.911 | 77% | 0.771 | S | S | * | * | trans | -125.3 | 34 | 148.3 | -71.6 | 175.3 | 0 | 0 | 0 | 110.5 | E77 G81 | E77-L79 PolarHBondContact O-N 2.85Å; L79-G81 PolarHBondContact O-N 2.91Å | ||
| 80 | Q | 49.1 | Very low | 45.2 | Very low | 151 Ų | 151 | 136.7 Ų | 136.7 | 71% | 0.706 | 77% | 0.767 | S | S | * | * | trans | -77.6 | 44.8 | 164 | -75.9 | 171.3 | -21.2 | 0 | 0 | 110.6 | ||||
| 81 | G | 49.3 | Very low | 45.9 | Very low | 62 Ų | 62 | 140.4 Ų | 140.4 | 64% | 0.639 | 77% | 0.768 | S | S | * | * | trans | -102.8 | 62.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | L79 | L79-G81 PolarHBondContact O-N 2.91Š| ||
| 82 | S | 55.9 | Low | 46.4 | Very low | 91 Ų | 91 | 138.9 Ų | 138.9 | 64% | 0.636 | 76% | 0.762 | S | S | * | * | trans | 26.5 | 98.3 | 150.2 | -170.2 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 83 | W | 52.4 | Low | 46.7 | Very low | 252 Ų | 252 | 140.7 Ų | 140.7 | 96% | 0.955 | 76% | 0.764 | S | S | * | * | S | Bend | -134.2 | 74 | 129.6 | -68.2 | 99.8 | 0 | 0 | 0 | 107.5 | |||
| 84 | V | 52.7 | Low | 47.3 | Very low | 118 Ų | 118 | 140.1 Ų | 140.1 | 72% | 0.715 | 76% | 0.759 | S | S | * | * | trans | 67.9 | 94.1 | -177.8 | -164.5 | 0 | 0 | 0 | 0 | 114.6 | L86 | V84-L86 HydrophobicContact CG1-CD1 4.27Å; V84-L86 HydrophobicContact CG1-CG 4.23Å; V84-L86 PolarHBondContact O-N 2.75Å | ||
| 85 | E | 51.5 | Low | 48.2 | Very low | 109 Ų | 109 | 136.8 Ų | 136.8 | 51% | 0.509 | 75% | 0.754 | S | S | . | * | trans | -77.8 | 104.7 | 166.9 | -174.1 | 148.8 | -160.9 | 0 | 0 | 109.8 | H87 | E85-H87 WeakPolarHBondContact CG-NE2 3.29Å; E85-H87 IonicContact OE1-CE1 3.85Å; E85-H87 IonicContact OE1-NE2 2.77Å; E85-H87 PolarHBondContact OE1-NE2 2.99Å | ||
| 86 | L | 56.5 | Low | 48.7 | Very low | 123 Ų | 123 | 133.6 Ų | 133.6 | 64% | 0.644 | 75% | 0.752 | S | S | * | * | trans | -97.8 | 96.5 | 175.6 | -99.4 | 157.3 | 0 | 0 | 0 | 109.7 | V84 F88 | V84-L86 HydrophobicContact CG1-CD1 4.27Å; V84-L86 HydrophobicContact CG1-CG 4.23Å; V84-L86 PolarHBondContact O-N 2.75Å; L86-F88 HydrophobicContact CB-CD2 4.49Å; L86-F88 HydrophobicContact CB-CE2 4.21Å; L86-F88 HydrophobicContact CD2-CE2 3.76Å; L86-F88 HydrophobicContact CD2-CZ 3.91Å; L86-F88 HydrophobicContact CG-CE2 4.39Å; L86-F88 PolarHBondContact O-N 2.9Å | ||
| 87 | H | 47.1 | Very low | 49.1 | Very low | 142 Ų | 142 | 130.5 Ų | 130.5 | 66% | 0.657 | 74% | 0.744 | S | S | * | * | trans | -79.6 | 103.6 | 168.7 | -72.4 | -78.9 | 0 | 0 | 0 | 110.6 | E85 S89 | E85-H87 WeakPolarHBondContact CG-NE2 3.29Å; E85-H87 IonicContact OE1-CE1 3.85Å; E85-H87 IonicContact OE1-NE2 2.77Å; E85-H87 PolarHBondContact OE1-NE2 2.99Å; H87-S89 PolarHBondContact O-N 3.34Å | ||
| 88 | F | 42.7 | Very low | 49.6 | Very low | 183 Ų | 183 | 126.1 Ų | 126.1 | 80% | 0.803 | 73% | 0.732 | S | S | * | * | trans | -91.5 | 77.8 | 162.9 | -72.8 | -79.3 | 0 | 0 | 0 | 110.1 | L86 N90 | L86-F88 HydrophobicContact CB-CD2 4.49Å; L86-F88 HydrophobicContact CB-CE2 4.21Å; L86-F88 HydrophobicContact CD2-CE2 3.76Å; L86-F88 HydrophobicContact CD2-CZ 3.91Å; L86-F88 HydrophobicContact CG-CE2 4.39Å; L86-F88 PolarHBondContact O-N 2.9Å; F88-N90 PolarHBondContact O-N 3.04Å | ||
| 89 | S | 41.9 | Very low | 49.6 | Very low | 110 Ų | 110 | 126.5 Ų | 126.5 | 77% | 0.769 | 74% | 0.74 | S | S | * | * | trans | -89.5 | 90.8 | 163.2 | -68.6 | 0 | 0 | 0 | 0 | 108.7 | H87 N91 | H87-S89 PolarHBondContact O-N 3.34Å; S89-N91 PolarHBondContact O-N 3.04Å; S89-N91 VanDerWaalsContact O-N 3.09Å | ||
| 90 | N | 56.4 | Low | 49.9 | Very low | 158 Ų | 158 | 122.3 Ų | 122.3 | 85% | 0.845 | 73% | 0.726 | S | S | * | * | trans | -70.6 | 93.4 | 169.6 | 175.1 | 60.1 | 0 | 0 | 0 | 109.6 | F88 | F88-N90 PolarHBondContact O-N 3.04Š| ||
| 91 | N | 47 | Very low | 50.1 | Low | 155 Ų | 155 | 120.3 Ų | 120.3 | 83% | 0.829 | 72% | 0.724 | S | S | * | * | trans | -160.7 | 114.6 | 149.8 | -150.8 | 49 | 0 | 0 | 0 | 112.4 | S89 | S89-N91 PolarHBondContact O-N 3.04Å; S89-N91 VanDerWaalsContact O-N 3.09Å | ||
| 92 | G | 44.8 | Very low | 50.2 | Low | 67 Ų | 67 | 121.1 Ų | 121.1 | 69% | 0.691 | 72% | 0.72 | S | S | * | * | S | Bend | trans | 82.7 | 101.7 | 147.8 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||
| 93 | N | 49.5 | Very low | 50 | Low | 172 Ų | 172 | 122.3 Ų | 122.3 | 92% | 0.92 | 72% | 0.717 | S | S | * | * | trans | 56.9 | 98.2 | 141.2 | -162.1 | 87.1 | 0 | 0 | 0 | 118.9 | ||||
| 94 | G | 46.3 | Very low | 50.1 | Low | 61 Ų | 61 | 121.1 Ų | 121.1 | 63% | 0.629 | 71% | 0.714 | S | S | * | * | trans | 153.6 | 105.1 | 158 | 0 | 0 | 0 | 0 | 0 | 113.3 | S96 | G94-S96 PolarHBondContact O-N 3.15Å; G94-S96 VanDerWaalsContact O-N 3.09Å | ||
| 95 | S | 53 | Low | 50.4 | Low | 120 Ų | 120 | 121.4 Ų | 121.4 | 84% | 0.839 | 71% | 0.712 | S | S | * | * | trans | 14.8 | 81.3 | 155.2 | 179.3 | 0 | 0 | 0 | 0 | 117 | ||||
| 96 | S | 49.2 | Very low | 51 | Low | 113 Ų | 113 | 117.9 Ų | 117.9 | 79% | 0.79 | 70% | 0.704 | S | S | * | * | trans | -113 | 91.6 | 160.7 | 47 | 0 | 0 | 0 | 0 | 108.8 | G94 | G94-S96 PolarHBondContact O-N 3.15Å; G94-S96 VanDerWaalsContact O-N 3.09Å | ||
| 97 | V | 50.6 | Low | 51.7 | Low | 93 Ų | 93 | 115.7 Ų | 115.7 | 56% | 0.564 | 69% | 0.693 | S | S | * | * | trans | -52.6 | 133.6 | 165.1 | -176.1 | 0 | 0 | 0 | 0 | 107.6 | V101 | V97-V101 HydrophobicContact CG1-CB 4.28Å; V97-V101 HydrophobicContact CG1-CG2 3.59Å | ||
| 98 | P | 49.2 | Very low | 53.1 | Low | 98 Ų | 98 | 114 Ų | 114 | 64% | 0.636 | 69% | 0.687 | S | S | * | * | trans | -56.2 | 145.5 | 174.8 | 24.3 | -32.7 | 0 | 0 | 0 | 109.3 | S100 | P98-S100 PolarHBondContact O-N 2.72Š| ||
| 99 | A | 52.2 | Low | 54.6 | Low | 104 Ų | 104 | 111.4 Ų | 111.4 | 86% | 0.86 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.6 | 61.8 | 180 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 100 | S | 51.1 | Low | 56.3 | Low | 86 Ų | 86 | 111.2 Ų | 111.2 | 60% | 0.601 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -132.1 | -1.6 | 177.4 | -49.5 | 0 | 0 | 0 | 0 | 111.7 | P98 | P98-S100 PolarHBondContact O-N 2.72Š|
| 101 | V | 51.9 | Low | 57.5 | Low | 110 Ų | 110 | 108.3 Ų | 108.3 | 67% | 0.667 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -104 | -9 | -178.7 | -173.9 | 0 | 0 | 0 | 0 | 113.4 | V97 | V97-V101 HydrophobicContact CG1-CB 4.28Å; V97-V101 HydrophobicContact CG1-CG2 3.59Å |
| 102 | S | 51.3 | Low | 59.3 | Low | 79 Ų | 79 | 106.3 Ų | 106.3 | 55% | 0.552 | 64% | 0.635 | S | S | * | * | G | 310 helix | trans | -95 | 5.2 | 177.6 | 81.7 | 0 | 0 | 0 | 0 | 115.3 | Y104 N105 | S102-Y104 PolarHBondContact O-N 3.15Å; S102-N105 PolarHBondContact O-N 2.76Å |
| 103 | I | 53.7 | Low | 61.1 | Low | 115 Ų | 115 | 107.9 Ų | 107.9 | 59% | 0.59 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -58.9 | -18.4 | 171.6 | -62.5 | -177.8 | 0 | 0 | 0 | 111.1 | M108 | I103-M108 HydrophobicContact CG2-CE 3.58Š|
| 104 | Y | 53.6 | Low | 62.4 | Low | 228 Ų | 228 | 103.6 Ų | 103.6 | 89% | 0.894 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -105.8 | 15.6 | 177.8 | -130.9 | -89.6 | 0 | 0 | 0 | 114.2 | S102 | S102-Y104 PolarHBondContact O-N 3.15Š|
| 105 | N | 58 | Low | 63.8 | Low | 124 Ų | 124 | 103.3 Ų | 103.3 | 66% | 0.663 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -110 | 68.4 | 179.3 | -172.5 | 50.2 | 0 | 0 | 0 | 110.9 | S102 D107 | S102-N105 PolarHBondContact O-N 2.76Å; N105-D107 PolarHBondContact O-N 3.05Å |
| 106 | G | 64.8 | Low | 64.8 | Low | 34 Ų | 34 | 104.6 Ų | 104.6 | 35% | 0.351 | 59% | 0.588 | S | S | . | * | S | Bend | trans | 56.8 | 0.8 | 164.1 | 0 | 0 | 0 | 0 | 0 | 118.6 | E109 | G106-E109 VanDerWaalsContact CA-CD 3.5Å; G106-E109 WeakPolarHBondContact CA-OE1 3.13Å; G106-E109 WeakPolarHBondContact O-CG 3.49Å |
| 107 | D | 71.3 | Confident | 65.5 | Low | 77 Ų | 77 | 105.8 Ų | 105.8 | 41% | 0.412 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -91.8 | -23.4 | -176.1 | -156.8 | 35 | 0 | 0 | 0 | 111 | N105 K110 I111 | N105-D107 PolarHBondContact O-N 3.05Å; D107-K110 PolarHBondContact O-N 3.16Å; D107-K110 IonicContact OD1-NZ 2.75Å; D107-K110 PolarHBondContact OD1-NZ 3.04Å; D107-I111 WeakPolarHBondContact O-CB 3.37Å; D107-I111 VanDerWaalsContact O-CD1 3.3Å; D107-I111 WeakPolarHBondContact O-CD1 3.46Å; D107-I111 WeakPolarHBondContact O-CG1 3.18Å; D107-I111 PolarHBondContact O-N 3.36Å |
| 108 | M | 76.4 | Confident | 65.9 | Low | 107 Ų | 107 | 108.4 Ų | 108.4 | 53% | 0.527 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65.8 | -48.2 | 172.6 | -174.9 | -177.9 | -66 | 0 | 0 | 111.3 | I103 K110 I111 L112 | I103-M108 HydrophobicContact CG2-CE 3.58Å; M108-K110 VanDerWaalsContact C-N 3.28Å; M108-K110 PolarHBondContact O-N 2.94Å; M108-I111 PolarHBondContact O-N 3.48Å; M108-L112 HydrophobicContact CG-CD1 4.05Å; M108-L112 HydrophobicContact CG-CG 4.45Å; M108-L112 WeakPolarHBondContact O-CB 3.39Å; M108-L112 VanDerWaalsContact O-CG 3.24Å; M108-L112 WeakPolarHBondContact O-CG 3.45Å; M108-L112 PolarHBondContact O-N 3.4Å |
| 109 | E | 73.9 | Confident | 66.3 | Low | 129 Ų | 129 | 108.5 Ų | 108.5 | 60% | 0.603 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -62.2 | -36 | 177.1 | 63.5 | -143.6 | -150.2 | 0 | 0 | 111.9 | G106 L112 L113 | G106-E109 VanDerWaalsContact CA-CD 3.5Å; G106-E109 WeakPolarHBondContact CA-OE1 3.13Å; G106-E109 WeakPolarHBondContact O-CG 3.49Å; E109-L112 PolarHBondContact O-N 2.88Å; E109-L113 WeakPolarHBondContact O-CB 3.45Å; E109-L113 WeakPolarHBondContact O-CG 3.14Å; E109-L113 PolarHBondContact O-N 3.42Å |
| 110 | K | 78.8 | Confident | 66.6 | Low | 105 Ų | 105 | 106.3 Ų | 106.3 | 46% | 0.457 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.2 | -47.7 | 172.9 | 172.4 | 169.5 | 145.7 | -74.3 | 0 | 112.2 | D107 M108 L112 L113 D114 | D107-K110 PolarHBondContact O-N 3.16Å; D107-K110 IonicContact OD1-NZ 2.75Å; D107-K110 PolarHBondContact OD1-NZ 3.04Å; M108-K110 VanDerWaalsContact C-N 3.28Å; M108-K110 PolarHBondContact O-N 2.94Å; K110-L112 VanDerWaalsContact C-N 3.29Å; K110-L112 PolarHBondContact O-N 3.47Å; K110-L113 PolarHBondContact O-N 3.21Å; K110-D114 WeakPolarHBondContact O-CB 3.44Å; K110-D114 VanDerWaalsContact O-CG 3.25Å; K110-D114 PolarHBondContact O-N 3.19Å |
| 111 | I | 81.4 | Confident | 66.9 | Low | 97 Ų | 97 | 112.9 Ų | 112.9 | 50% | 0.497 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.6 | -38.4 | 177.8 | -66.1 | 160.3 | 0 | 0 | 0 | 111.1 | D107 M108 D114 A115 | D107-I111 WeakPolarHBondContact O-CB 3.37Å; D107-I111 VanDerWaalsContact O-CD1 3.3Å; D107-I111 WeakPolarHBondContact O-CD1 3.46Å; D107-I111 WeakPolarHBondContact O-CG1 3.18Å; D107-I111 PolarHBondContact O-N 3.36Å; M108-I111 PolarHBondContact O-N 3.48Å; I111-D114 PolarHBondContact O-N 3.06Å; I111-A115 PolarHBondContact O-N 3.37Å; I111-A115 VanDerWaalsContact O-N 3.08Å |
| 112 | L | 84.6 | Confident | 66.7 | Low | 114 Ų | 114 | 111.8 Ų | 111.8 | 60% | 0.597 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -66.3 | -40 | 175.9 | -69.3 | 171.7 | 0 | 0 | 0 | 112.1 | M108 E109 K110 Q116 | M108-L112 HydrophobicContact CG-CD1 4.05Å; M108-L112 HydrophobicContact CG-CG 4.45Å; M108-L112 WeakPolarHBondContact O-CB 3.39Å; M108-L112 VanDerWaalsContact O-CG 3.24Å; M108-L112 WeakPolarHBondContact O-CG 3.45Å; M108-L112 PolarHBondContact O-N 3.4Å; E109-L112 PolarHBondContact O-N 2.88Å; K110-L112 VanDerWaalsContact C-N 3.29Å; K110-L112 PolarHBondContact O-N 3.47Å; L112-Q116 PolarHBondContact O-N 3.28Å |
| 113 | L | 81.6 | Confident | 66.9 | Low | 99 Ų | 99 | 113.1 Ų | 113.1 | 52% | 0.518 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.4 | -39 | 175.2 | -71.1 | 171.2 | 0 | 0 | 0 | 112.2 | E109 K110 Q116 H117 | E109-L113 WeakPolarHBondContact O-CB 3.45Å; E109-L113 WeakPolarHBondContact O-CG 3.14Å; E109-L113 PolarHBondContact O-N 3.42Å; K110-L113 PolarHBondContact O-N 3.21Å; L113-Q116 PolarHBondContact O-N 2.94Å; L113-H117 PolarHBondContact O-N 3.26Å |
| 114 | D | 77.4 | Confident | 66.8 | Low | 82 Ų | 82 | 112.7 Ų | 112.7 | 44% | 0.439 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -65 | -43.3 | 178.8 | -73.2 | -19.5 | 0 | 0 | 0 | 111.8 | K110 I111 Q116 H117 E118 | K110-D114 WeakPolarHBondContact O-CB 3.44Å; K110-D114 VanDerWaalsContact O-CG 3.25Å; K110-D114 PolarHBondContact O-N 3.19Å; I111-D114 PolarHBondContact O-N 3.06Å; D114-Q116 PolarHBondContact O-N 3.29Å; D114-H117 PolarHBondContact O-N 3.11Å; D114-E118 PolarHBondContact O-N 3.02Å |
| 115 | A | 76.4 | Confident | 66.9 | Low | 55 Ų | 55 | 111.7 Ų | 111.7 | 46% | 0.455 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -61.2 | -33.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | I111 S119 | I111-A115 PolarHBondContact O-N 3.37Å; I111-A115 VanDerWaalsContact O-N 3.08Å; A115-S119 PolarHBondContact O-N 2.96Å; A115-S119 PolarHBondContact O-OG 3.08Å |
| 116 | Q | 72.5 | Confident | 66.7 | Low | 147 Ų | 147 | 110.5 Ų | 110.5 | 69% | 0.687 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -75.7 | -38.4 | 177.2 | -163.2 | 170.1 | -22.4 | 0 | 0 | 111.8 | L112 L113 D114 E118 S119 | L112-Q116 PolarHBondContact O-N 3.28Å; L113-Q116 PolarHBondContact O-N 2.94Å; D114-Q116 PolarHBondContact O-N 3.29Å; Q116-E118 VanDerWaalsContact C-N 3.35Å; Q116-S119 PolarHBondContact O-N 3.06Å |
| 117 | H | 64.2 | Low | 66.1 | Low | 138 Ų | 138 | 114.4 Ų | 114.4 | 64% | 0.639 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -66.4 | -33.4 | 174.5 | -75.7 | 167.6 | 0 | 0 | 0 | 113.1 | L113 D114 G120 | L113-H117 PolarHBondContact O-N 3.26Å; D114-H117 PolarHBondContact O-N 3.11Å; H117-G120 PolarHBondContact O-N 2.88Å |
| 118 | E | 59.5 | Low | 65.1 | Low | 148 Ų | 148 | 119 Ų | 119 | 69% | 0.692 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -69.6 | -33.3 | 175.4 | -167.7 | 173.4 | 178.4 | 0 | 0 | 112.2 | D114 Q116 G120 | D114-E118 PolarHBondContact O-N 3.02Å; Q116-E118 VanDerWaalsContact C-N 3.35Å; E118-G120 VanDerWaalsContact C-N 3.27Å; E118-G120 PolarHBondContact O-N 2.91Å |
| 119 | S | 57.6 | Low | 63.6 | Low | 100 Ų | 100 | 118.5 Ų | 118.5 | 70% | 0.699 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -67.6 | -23.3 | 177.6 | -73.5 | 0 | 0 | 0 | 0 | 114 | A115 Q116 | A115-S119 PolarHBondContact O-N 2.96Å; A115-S119 PolarHBondContact O-OG 3.08Å; Q116-S119 PolarHBondContact O-N 3.06Å |
| 120 | G | 58.4 | Low | 62.4 | Low | 58 Ų | 58 | 119.2 Ų | 119.2 | 60% | 0.598 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -14.7 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115.8 | H117 E118 | H117-G120 PolarHBondContact O-N 2.88Å; E118-G120 VanDerWaalsContact C-N 3.27Å; E118-G120 PolarHBondContact O-N 2.91Å |
| 121 | R | 57.7 | Low | 60.8 | Low | 225 Ų | 225 | 118.3 Ų | 118.3 | 85% | 0.849 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -102.7 | -6.3 | -173.6 | -66.7 | -179.8 | 70.2 | -166.8 | 1.6 | 114.7 | S123 | R121-S123 PolarHBondContact O-N 3.04Š|
| 122 | S | 48.1 | Very low | 59.2 | Low | 86 Ų | 86 | 118.9 Ų | 118.9 | 60% | 0.601 | 68% | 0.676 | S | S | * | * | trans | -88.1 | 9.2 | -173.5 | -66.9 | 0 | 0 | 0 | 0 | 115.2 | S124 | S122-S124 PolarHBondContact O-N 3.09Š| ||
| 123 | S | 54.2 | Low | 57.4 | Low | 108 Ų | 108 | 119.4 Ų | 119.4 | 76% | 0.755 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -80.8 | 4 | -170.8 | 57.5 | 0 | 0 | 0 | 0 | 117 | R121 | R121-S123 PolarHBondContact O-N 3.04Š|
| 124 | S | 53.4 | Low | 55.8 | Low | 105 Ų | 105 | 126.2 Ų | 126.2 | 73% | 0.734 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -129.8 | -0.9 | -169 | -60.3 | 0 | 0 | 0 | 0 | 118.7 | S122 | S122-S124 PolarHBondContact O-N 3.09Š|
| 125 | K | 55.5 | Low | 54.3 | Low | 208 Ų | 208 | 127.6 Ų | 127.6 | 90% | 0.904 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -161.9 | 32.6 | -178.4 | -133.8 | 168.8 | 168 | 177.3 | 0 | 119.8 | ||
| 126 | S | 54 | Low | 52.8 | Low | 99 Ų | 99 | 133.8 Ų | 133.8 | 69% | 0.692 | 74% | 0.741 | S | S | * | * | trans | -150.7 | 33.4 | 168.7 | 67.9 | 0 | 0 | 0 | 0 | 115.1 | H128 | S126-H128 PolarHBondContact O-N 3.08Š| ||
| 127 | S | 52 | Low | 51.2 | Low | 115 Ų | 115 | 132.3 Ų | 132.3 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | trans | -90.1 | 71.5 | 172.3 | 64.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 128 | H | 49.8 | Very low | 50 | Low | 175 Ų | 175 | 132 Ų | 132 | 81% | 0.81 | 75% | 0.752 | S | S | * | * | trans | -107.4 | 63.3 | 148.2 | -161 | 67.4 | 0 | 0 | 0 | 107.7 | S126 | S126-H128 PolarHBondContact O-N 3.08Š| ||
| 129 | C | 44.6 | Very low | 49.1 | Very low | 95 Ų | 95 | 133 Ų | 133 | 64% | 0.642 | 76% | 0.757 | S | S | * | * | trans | -97 | 109.4 | 167.1 | -66 | 0 | 0 | 0 | 0 | 106.1 | S131 | C129-S131 PolarHBondContact O-N 3.47Š| ||
| 130 | D | 47.6 | Very low | 48.2 | Very low | 144 Ų | 144 | 135.9 Ų | 135.9 | 77% | 0.77 | 76% | 0.764 | S | S | * | * | trans | -74.8 | 56.9 | 170.9 | -143.1 | -10.5 | 0 | 0 | 0 | 109.4 | ||||
| 131 | S | 45.8 | Very low | 47.4 | Very low | 87 Ų | 87 | 139.9 Ų | 139.9 | 61% | 0.608 | 78% | 0.777 | S | S | * | * | trans | -106.3 | 130.2 | 179 | -65.3 | 0 | 0 | 0 | 0 | 108.3 | C129 | C129-S131 PolarHBondContact O-N 3.47Š| ||
| 132 | P | 47.7 | Very low | 46.5 | Very low | 109 Ų | 109 | 136.8 Ų | 136.8 | 71% | 0.708 | 78% | 0.778 | S | S | * | * | trans | -59.9 | 144.9 | 176.5 | 10.8 | -12.8 | 0 | 0 | 0 | 110.5 | R134 | P132-R134 PolarHBondContact O-N 3.27Š| ||
| 133 | P | 47.2 | Very low | 46.1 | Very low | 124 Ų | 124 | 144.3 Ų | 144.3 | 81% | 0.805 | 79% | 0.793 | S | S | * | * | trans | -54.7 | 129.6 | -177.5 | -21.2 | 30.2 | 0 | 0 | 0 | 110.9 | S135 | P133-S135 PolarHBondContact O-N 2.82Å; P133-S135 VanDerWaalsContact O-N 3.07Å | ||
| 134 | R | 48.9 | Very low | 45.2 | Very low | 242 Ų | 242 | 143.6 Ų | 143.6 | 91% | 0.913 | 79% | 0.794 | S | S | * | * | trans | -60.8 | 111.9 | 176.2 | -165 | 177.9 | -178.4 | 119.2 | -2.5 | 108.5 | P132 Q136 | P132-R134 PolarHBondContact O-N 3.27Å; R134-Q136 PolarHBondContact O-N 2.75Å | ||
| 135 | S | 46 | Very low | 44.4 | Very low | 112 Ų | 112 | 144.1 Ų | 144.1 | 78% | 0.783 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 125.5 | 171.9 | -61.8 | 0 | 0 | 0 | 0 | 109.4 | P133 T137 | P133-S135 PolarHBondContact O-N 2.82Å; P133-S135 VanDerWaalsContact O-N 3.07Å; S135-T137 PolarHBondContact O-N 3.31Å |
| 136 | Q | 44.2 | Very low | 43.6 | Very low | 185 Ų | 185 | 142.3 Ų | 142.3 | 86% | 0.864 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 127.6 | -178.6 | -68.2 | 170.9 | -5.1 | 0 | 0 | 110.7 | R134 | R134-Q136 PolarHBondContact O-N 2.75Š|
| 137 | T | 39 | Very low | 43.2 | Very low | 115 Ų | 115 | 143.2 Ų | 143.2 | 71% | 0.706 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 127.5 | 158.8 | 37.5 | 0 | 0 | 0 | 0 | 108.4 | S135 Q139 | S135-T137 PolarHBondContact O-N 3.31Å; T137-Q139 PolarHBondContact O-N 3.08Å; T137-Q139 VanDerWaalsContact O-N 3.16Å |
| 138 | P | 38.3 | Very low | 42.6 | Very low | 131 Ų | 131 | 144 Ų | 144 | 85% | 0.851 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 120.7 | 170.7 | -23.4 | 33.7 | 0 | 0 | 0 | 109.7 | ||
| 139 | Q | 40.4 | Very low | 42.1 | Very low | 170 Ų | 170 | 140.6 Ų | 140.6 | 79% | 0.794 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 142.7 | -179.5 | -74.4 | -102.2 | -17.4 | 0 | 0 | 111 | T137 T141 | T137-Q139 PolarHBondContact O-N 3.08Å; T137-Q139 VanDerWaalsContact O-N 3.16Å; Q139-T141 PolarHBondContact O-N 3.33Å |
| 140 | D | 38.6 | Very low | 41.9 | Very low | 160 Ų | 160 | 144.5 Ų | 144.5 | 86% | 0.856 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 120.7 | 171.3 | -68.8 | -64.6 | 0 | 0 | 0 | 113.3 | ||
| 141 | T | 42.7 | Very low | 41.3 | Very low | 142 Ų | 142 | 142.8 Ų | 142.8 | 87% | 0.871 | 79% | 0.79 | S | S | * | * | trans | -113.3 | 79.7 | 160.2 | 35 | 0 | 0 | 0 | 0 | 110 | Q139 | Q139-T141 PolarHBondContact O-N 3.33Š| ||
| 142 | N | 39.1 | Very low | 41.4 | Very low | 160 Ų | 160 | 146.6 Ų | 146.6 | 86% | 0.856 | 80% | 0.802 | S | S | * | * | trans | -143 | 78 | 153.8 | -155.9 | -80.3 | 0 | 0 | 0 | 110.1 | ||||
| 143 | R | 38.4 | Very low | 40.9 | Very low | 244 Ų | 244 | 144 Ų | 144 | 92% | 0.921 | 80% | 0.795 | S | S | * | * | trans | -133.5 | 99.1 | 165.7 | -163.6 | 177.4 | -146.9 | 141 | 5.7 | 109.1 | ||||
| 144 | A | 36.9 | Very low | 40.8 | Very low | 94 Ų | 94 | 146.2 Ų | 146.2 | 78% | 0.777 | 80% | 0.795 | S | S | * | * | trans | 35.8 | 111.5 | 149.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 145 | S | 34.8 | Very low | 40.7 | Very low | 115 Ų | 115 | 143.8 Ų | 143.8 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | -160.1 | 119.8 | 138.8 | 59.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 146 | E | 40.6 | Very low | 40.7 | Very low | 170 Ų | 170 | 144.3 Ų | 144.3 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | trans | -49.6 | 145.5 | 159 | -81 | -111.8 | 136.5 | 0 | 0 | 111.4 | ||||
| 147 | P | 45.6 | Very low | 41 | Very low | 118 Ų | 118 | 140.6 Ų | 140.6 | 77% | 0.766 | 78% | 0.78 | S | S | * | * | -149.2 | 154 | 94.3 | 35.5 | -16.6 | 0 | 0 | 0 | 116.3 | |||||
| 148 | D | 38.2 | Very low | 41.3 | Very low | 131 Ų | 131 | 138.4 Ų | 138.4 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | trans | -51 | 165.6 | 161.1 | -79.7 | -55.4 | 0 | 0 | 0 | 114.3 | ||||
| 149 | T | 40.4 | Very low | 41.9 | Very low | 104 Ų | 104 | 138.6 Ų | 138.6 | 64% | 0.638 | 76% | 0.758 | S | S | * | * | trans | 104.7 | 88.7 | 146.6 | -45 | 0 | 0 | 0 | 0 | 118 | ||||
| 150 | H | 39.3 | Very low | 42.8 | Very low | 178 Ų | 178 | 134.7 Ų | 134.7 | 82% | 0.824 | 75% | 0.75 | S | S | * | * | trans | 70.4 | 147.5 | 137.5 | -43.1 | -40 | 0 | 0 | 0 | 123.3 | ||||
| 151 | S | 35.3 | Very low | 43.6 | Very low | 108 Ų | 108 | 132.1 Ų | 132.1 | 76% | 0.755 | 73% | 0.733 | S | S | * | * | trans | 97.8 | 96.9 | 164.8 | -157.3 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 152 | I | 48.4 | Very low | 44.6 | Very low | 167 Ų | 167 | 130.7 Ų | 130.7 | 86% | 0.856 | 72% | 0.716 | S | S | * | * | 41.1 | 118.3 | 86.7 | -69.3 | 172.5 | 0 | 0 | 0 | 112.5 | |||||
| 153 | G | 37 | Very low | 46 | Very low | 55 Ų | 55 | 126.8 Ų | 126.8 | 57% | 0.567 | 70% | 0.695 | S | S | * | * | trans | 139.3 | 78.3 | 154.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 154 | E | 45.2 | Very low | 47.6 | Very low | 170 Ų | 170 | 117.8 Ų | 117.8 | 79% | 0.794 | 67% | 0.666 | S | S | * | * | trans | 58.4 | 135.8 | 135.7 | -53.4 | 173.9 | 131.4 | 0 | 0 | 119.9 | ||||
| 155 | K | 45.7 | Very low | 49.7 | Very low | 190 Ų | 190 | 117.3 Ų | 117.3 | 83% | 0.826 | 65% | 0.649 | S | S | * | * | trans | 81 | 87.8 | 167.5 | 66.3 | -108.7 | 161.4 | 174 | 0 | 119.5 | ||||
| 156 | N | 46.8 | Very low | 51.8 | Low | 123 Ų | 123 | 118 Ų | 118 | 66% | 0.658 | 64% | 0.639 | S | S | * | * | trans | -122.6 | 67.2 | 151.7 | 178.6 | -3.7 | 0 | 0 | 0 | 109.5 | ||||
| 157 | S | 49.4 | Very low | 53.8 | Low | 108 Ų | 108 | 116.1 Ų | 116.1 | 76% | 0.755 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -126.5 | 3.8 | 168.2 | -167.2 | 0 | 0 | 0 | 0 | 112.9 | ||
| 158 | S | 47.2 | Very low | 55.5 | Low | 69 Ų | 69 | 118.1 Ų | 118.1 | 48% | 0.483 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -104.1 | -20.1 | 174.7 | -61.8 | 0 | 0 | 0 | 0 | 112.5 | S160 E161 | S158-S160 PolarHBondContact O-N 2.93Å; S158-E161 WeakPolarHBondContact O-CG 3.24Å; S158-E161 PolarHBondContact O-N 3.22Å |
| 159 | Q | 49.9 | Very low | 57.8 | Low | 134 Ų | 134 | 118.1 Ų | 118.1 | 63% | 0.626 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -64 | -16.9 | -174.8 | -165.7 | 169.8 | -4.5 | 0 | 0 | 114.5 | ||
| 160 | S | 58.7 | Low | 59.8 | Low | 88 Ų | 88 | 118.3 Ų | 118.3 | 62% | 0.615 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -86.4 | -20.5 | -178.8 | 77 | 0 | 0 | 0 | 0 | 114.3 | S158 D164 | S158-S160 PolarHBondContact O-N 2.93Å; S160-D164 PolarHBondContact O-N 2.84Å; S160-D164 VanDerWaalsContact O-N 3.17Å |
| 161 | E | 57.1 | Low | 61.9 | Low | 106 Ų | 106 | 114 Ų | 114 | 50% | 0.495 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -78.5 | -39.4 | -178.8 | 74.8 | -172.2 | 105.5 | 0 | 0 | 111.1 | S158 I165 | S158-E161 WeakPolarHBondContact O-CG 3.24Å; S158-E161 PolarHBondContact O-N 3.22Å; E161-I165 VanDerWaalsContact O-CD1 3.28Å; E161-I165 WeakPolarHBondContact O-CD1 3.42Å; E161-I165 WeakPolarHBondContact O-CG1 3.36Å; E161-I165 PolarHBondContact O-N 3.5Å; E161-I165 VanDerWaalsContact O-N 3.17Å |
| 162 | E | 63 | Low | 64.2 | Low | 112 Ų | 112 | 115.3 Ų | 115.3 | 52% | 0.523 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.8 | -38.8 | 172.5 | -67.9 | 91.1 | -166.5 | 0 | 0 | 112 | I165 E166 | E162-I165 PolarHBondContact O-N 2.84Å; E162-E166 VanDerWaalsContact O-CB 3.24Å; E162-E166 WeakPolarHBondContact O-CB 3.47Å; E162-E166 PolarHBondContact O-N 3.35Å |
| 163 | D | 69.1 | Low | 65.9 | Low | 78 Ų | 78 | 109.6 Ų | 109.6 | 42% | 0.417 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -68.1 | -37.8 | -179.6 | -155.3 | 87.8 | 0 | 0 | 0 | 112.4 | R167 | D163-R167 WeakPolarHBondContact O-CB 3.08Å; D163-R167 PolarHBondContact O-N 3.36Å; D163-R167 IonicContact OD2-CZ 2.88Å; D163-R167 IonicContact OD2-NH2 2.83Å; D163-R167 PolarHBondContact OD2-NH2 3.35Å |
| 164 | D | 72 | Confident | 68.2 | Low | 56 Ų | 56 | 110.1 Ų | 110.1 | 30% | 0.299 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -70 | -38.1 | 175.3 | -166 | -106.9 | 0 | 0 | 0 | 111.6 | S160 R168 | S160-D164 PolarHBondContact O-N 2.84Å; S160-D164 VanDerWaalsContact O-N 3.17Å; D164-R168 WeakPolarHBondContact O-CB 3.36Å; D164-R168 VanDerWaalsContact O-CG 3.23Å; D164-R168 WeakPolarHBondContact O-CG 3.08Å; D164-R168 PolarHBondContact O-N 3.15Å; D164-R168 IonicContact OD1-CZ 3.09Å; D164-R168 IonicContact OD1-NE 3.51Å; D164-R168 PolarHBondContact OD1-NE 2.86Å; D164-R168 IonicContact OD1-NH2 3.26Å; D164-R168 PolarHBondContact OD1-NH2 3.27Å |
| 165 | I | 79.4 | Confident | 69.9 | Low | 83 Ų | 83 | 107.9 Ų | 107.9 | 43% | 0.426 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.7 | -40.7 | 175.6 | -64.8 | 164.4 | 0 | 0 | 0 | 110.5 | E161 E162 K169 | E161-I165 VanDerWaalsContact O-CD1 3.28Å; E161-I165 WeakPolarHBondContact O-CD1 3.42Å; E161-I165 WeakPolarHBondContact O-CG1 3.36Å; E161-I165 PolarHBondContact O-N 3.5Å; E161-I165 VanDerWaalsContact O-N 3.17Å; E162-I165 PolarHBondContact O-N 2.84Å; I165-K169 HydrophobicContact CG2-CD 4.15Å; I165-K169 WeakPolarHBondContact O-CB 3.02Å; I165-K169 VanDerWaalsContact O-CG 3.27Å; I165-K169 WeakPolarHBondContact O-CG 3.15Å; I165-K169 PolarHBondContact O-N 3.07Å |
| 166 | E | 79.9 | Confident | 71.5 | Confident | 130 Ų | 130 | 105.7 Ų | 105.7 | 61% | 0.607 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -66.4 | -44.8 | 176.1 | -176.6 | 164.1 | -157.6 | 0 | 0 | 111.1 | E162 R168 K169 E170 | E162-E166 VanDerWaalsContact O-CB 3.24Å; E162-E166 WeakPolarHBondContact O-CB 3.47Å; E162-E166 PolarHBondContact O-N 3.35Å; E166-R168 VanDerWaalsContact C-N 3.35Å; E166-R168 PolarHBondContact O-N 3.4Å; E166-K169 CarbonylContact O-C 3.52Å; E166-K169 PolarHBondContact O-N 3.28Å; E166-E170 WeakPolarHBondContact O-CB 3.48Å; E166-E170 PolarHBondContact O-N 2.76Å |
| 167 | R | 81.4 | Confident | 72.9 | Confident | 131 Ų | 131 | 105 Ų | 105 | 49% | 0.494 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.7 | -40 | 176.1 | -167.1 | -171.3 | -57.3 | 144.8 | 5.5 | 112 | D163 E170 V171 | D163-R167 WeakPolarHBondContact O-CB 3.08Å; D163-R167 PolarHBondContact O-N 3.36Å; D163-R167 IonicContact OD2-CZ 2.88Å; D163-R167 IonicContact OD2-NH2 2.83Å; D163-R167 PolarHBondContact OD2-NH2 3.35Å; R167-E170 PolarHBondContact O-N 2.97Å; R167-V171 VanDerWaalsContact O-CG2 3.27Å; R167-V171 WeakPolarHBondContact O-CG2 3.38Å; R167-V171 PolarHBondContact O-N 2.69Å |
| 168 | R | 81.9 | Confident | 74.5 | Confident | 159 Ų | 159 | 102.3 Ų | 102.3 | 60% | 0.6 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.9 | -44.2 | 173.7 | -74.6 | 178.5 | -162.1 | -158.2 | 7.4 | 111.7 | D164 E166 E170 V171 E172 | D164-R168 WeakPolarHBondContact O-CB 3.36Å; D164-R168 VanDerWaalsContact O-CG 3.23Å; D164-R168 WeakPolarHBondContact O-CG 3.08Å; D164-R168 PolarHBondContact O-N 3.15Å; D164-R168 IonicContact OD1-CZ 3.09Å; D164-R168 IonicContact OD1-NE 3.51Å; D164-R168 PolarHBondContact OD1-NE 2.86Å; D164-R168 IonicContact OD1-NH2 3.26Å; D164-R168 PolarHBondContact OD1-NH2 3.27Å; E166-R168 VanDerWaalsContact C-N 3.35Å; E166-R168 PolarHBondContact O-N 3.4Å; R168-E170 VanDerWaalsContact C-N 3.29Å; R168-E170 PolarHBondContact O-N 3.35Å; R168-V171 PolarHBondContact O-N 3.43Å; R168-E172 WeakPolarHBondContact O-CB 3.17Å; R168-E172 WeakPolarHBondContact O-CG 3.27Å; R168-E172 PolarHBondContact O-N 3.2Å |
| 169 | K | 85.8 | Confident | 75.9 | Confident | 132 Ų | 132 | 101.2 Ų | 101.2 | 57% | 0.574 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.9 | -34.7 | 174 | -75.5 | 174.1 | -179.7 | 176.8 | 0 | 112 | I165 E166 S173 | I165-K169 HydrophobicContact CG2-CD 4.15Å; I165-K169 WeakPolarHBondContact O-CB 3.02Å; I165-K169 VanDerWaalsContact O-CG 3.27Å; I165-K169 WeakPolarHBondContact O-CG 3.15Å; I165-K169 PolarHBondContact O-N 3.07Å; E166-K169 CarbonylContact O-C 3.52Å; E166-K169 PolarHBondContact O-N 3.28Å; K169-S173 WeakPolarHBondContact O-CA 3.39Å; K169-S173 WeakPolarHBondContact O-CB 3.32Å; K169-S173 PolarHBondContact O-N 2.74Å |
| 170 | E | 83 | Confident | 77.3 | Confident | 107 Ų | 107 | 99.1 Ų | 99.1 | 50% | 0.5 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66.5 | -48.1 | 175.7 | -168.6 | -169.1 | 175.6 | 0 | 0 | 109.9 | E166 R167 R168 E172 S173 I174 | E166-E170 WeakPolarHBondContact O-CB 3.48Å; E166-E170 PolarHBondContact O-N 2.76Å; R167-E170 PolarHBondContact O-N 2.97Å; R168-E170 VanDerWaalsContact C-N 3.29Å; R168-E170 PolarHBondContact O-N 3.35Å; E170-E172 PolarHBondContact O-N 2.75Å; E170-S173 CarbonylContact O-C 3.52Å; E170-S173 WeakPolarHBondContact O-CB 3.17Å; E170-S173 PolarHBondContact O-N 3.43Å; E170-S173 VanDerWaalsContact O-N 3.17Å; E170-S173 PolarHBondContact O-OG 3.2Å; E170-I174 HydrophobicContact CG-CD1 3.84Å; E170-I174 HydrophobicContact CG-CG1 4.41Å; E170-I174 WeakPolarHBondContact O-CB 3.47Å; E170-I174 WeakPolarHBondContact O-CG1 3.1Å; E170-I174 PolarHBondContact O-N 3.45Å |
| 171 | V | 83.8 | Confident | 78.2 | Confident | 89 Ų | 89 | 100.1 Ų | 100.1 | 54% | 0.539 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.6 | -45.3 | 176.2 | 171.2 | 0 | 0 | 0 | 0 | 111.3 | R167 R168 S173 I174 L175 | R167-V171 VanDerWaalsContact O-CG2 3.27Å; R167-V171 WeakPolarHBondContact O-CG2 3.38Å; R167-V171 PolarHBondContact O-N 2.69Å; R168-V171 PolarHBondContact O-N 3.43Å; V171-S173 VanDerWaalsContact C-N 3.35Å; V171-I174 PolarHBondContact O-N 2.87Å; V171-L175 WeakPolarHBondContact O-CB 3.07Å; V171-L175 PolarHBondContact O-N 3.23Å |
| 172 | E | 83.9 | Confident | 79.3 | Confident | 134 Ų | 134 | 98.8 Ų | 98.8 | 63% | 0.626 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -63.6 | -41.1 | 174.5 | -74.8 | 179.9 | -175.6 | 0 | 0 | 111.5 | R168 E170 I174 L175 K176 | R168-E172 WeakPolarHBondContact O-CB 3.17Å; R168-E172 WeakPolarHBondContact O-CG 3.27Å; R168-E172 PolarHBondContact O-N 3.2Å; E170-E172 PolarHBondContact O-N 2.75Å; E172-I174 VanDerWaalsContact C-N 3.29Å; E172-I174 PolarHBondContact O-N 3.34Å; E172-L175 PolarHBondContact O-N 3.17Å; E172-K176 WeakPolarHBondContact O-CB 3.4Å; E172-K176 PolarHBondContact O-N 3.19Å |
| 173 | S | 84.3 | Confident | 79.8 | Confident | 47 Ų | 47 | 101.5 Ų | 101.5 | 33% | 0.329 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.3 | -39.5 | 174.1 | 86.6 | 0 | 0 | 0 | 0 | 110.5 | K169 E170 V171 K177 | K169-S173 WeakPolarHBondContact O-CA 3.39Å; K169-S173 WeakPolarHBondContact O-CB 3.32Å; K169-S173 PolarHBondContact O-N 2.74Å; E170-S173 CarbonylContact O-C 3.52Å; E170-S173 WeakPolarHBondContact O-CB 3.17Å; E170-S173 PolarHBondContact O-N 3.43Å; E170-S173 VanDerWaalsContact O-N 3.17Å; E170-S173 PolarHBondContact O-OG 3.2Å; V171-S173 VanDerWaalsContact C-N 3.35Å; S173-K177 WeakPolarHBondContact O-CA 3.07Å; S173-K177 WeakPolarHBondContact O-CB 3.37Å; S173-K177 WeakPolarHBondContact O-CE 3.17Å; S173-K177 WeakPolarHBondContact O-CG 3.43Å; S173-K177 PolarHBondContact O-N 2.88Å; S173-K177 VanDerWaalsContact OG-CE 3.32Å; S173-K177 WeakPolarHBondContact OG-CE 3.46Å; S173-K177 PolarHBondContact OG-NZ 2.95Å |
| 174 | I | 84.4 | Confident | 80.1 | Confident | 66 Ų | 66 | 102.6 Ų | 102.6 | 34% | 0.338 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.6 | -40.9 | -179.4 | -71.3 | 164.5 | 0 | 0 | 0 | 109.7 | E170 V171 E172 K177 N178 | E170-I174 HydrophobicContact CG-CD1 3.84Å; E170-I174 HydrophobicContact CG-CG1 4.41Å; E170-I174 WeakPolarHBondContact O-CB 3.47Å; E170-I174 WeakPolarHBondContact O-CG1 3.1Å; E170-I174 PolarHBondContact O-N 3.45Å; V171-I174 PolarHBondContact O-N 2.87Å; E172-I174 VanDerWaalsContact C-N 3.29Å; E172-I174 PolarHBondContact O-N 3.34Å; I174-K177 HydrophobicContact CG1-CD 4.38Å; I174-K177 WeakPolarHBondContact O-CG 3.4Å; I174-N178 WeakPolarHBondContact CG2-ND2 3.49Å; I174-N178 WeakPolarHBondContact O-CA 3.41Å; I174-N178 WeakPolarHBondContact O-CB 3.49Å; I174-N178 PolarHBondContact O-N 2.91Å; I174-N178 PolarHBondContact O-ND2 3.48Å |
| 175 | L | 82.3 | Confident | 80 | Confident | 124 Ų | 124 | 108.9 Ų | 108.9 | 65% | 0.649 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -71 | -42.6 | 178 | -173.7 | 64.3 | 0 | 0 | 0 | 111.9 | V171 E172 N178 S179 | V171-L175 WeakPolarHBondContact O-CB 3.07Å; V171-L175 PolarHBondContact O-N 3.23Å; E172-L175 PolarHBondContact O-N 3.17Å; L175-N178 WeakPolarHBondContact O-CB 3.11Å; L175-N178 PolarHBondContact O-N 2.8Å; L175-S179 PolarHBondContact O-N 3.28Å; L175-S179 VanDerWaalsContact O-N 3.08Å; L175-S179 PolarHBondContact O-OG 3.17Å |
| 176 | K | 77.9 | Confident | 79.3 | Confident | 144 Ų | 144 | 108.4 Ų | 108.4 | 63% | 0.626 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.5 | -52.3 | 176.7 | -171.2 | 75.6 | 176.7 | -75 | 0 | 110.8 | E172 N178 S179 D180 | E172-K176 WeakPolarHBondContact O-CB 3.4Å; E172-K176 PolarHBondContact O-N 3.19Å; K176-N178 PolarHBondContact O-N 3.03Å; K176-S179 WeakPolarHBondContact O-CB 3.33Å; K176-S179 PolarHBondContact O-N 3.49Å; K176-S179 VanDerWaalsContact O-N 3.09Å; K176-D180 PolarHBondContact O-N 2.89Å |
| 177 | K | 77.1 | Confident | 78.2 | Confident | 108 Ų | 108 | 106 Ų | 106 | 47% | 0.47 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.2 | -33.5 | 174.1 | 84.7 | -172.7 | 64.7 | 163.6 | 0 | 110.6 | S173 I174 S179 D180 W181 | S173-K177 WeakPolarHBondContact O-CA 3.07Å; S173-K177 WeakPolarHBondContact O-CB 3.37Å; S173-K177 WeakPolarHBondContact O-CE 3.17Å; S173-K177 WeakPolarHBondContact O-CG 3.43Å; S173-K177 PolarHBondContact O-N 2.88Å; S173-K177 VanDerWaalsContact OG-CE 3.32Å; S173-K177 WeakPolarHBondContact OG-CE 3.46Å; S173-K177 PolarHBondContact OG-NZ 2.95Å; I174-K177 HydrophobicContact CG1-CD 4.38Å; I174-K177 WeakPolarHBondContact O-CG 3.4Å; K177-S179 VanDerWaalsContact C-N 3.31Å; K177-S179 PolarHBondContact O-N 2.96Å; K177-D180 PolarHBondContact O-N 2.92Å; K177-W181 PolarHBondContact O-N 2.96Å |
| 178 | N | 81.7 | Confident | 77.7 | Confident | 52 Ų | 52 | 108.2 Ų | 108.2 | 28% | 0.278 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.3 | -44.7 | 176.3 | -102.6 | -85.4 | 0 | 0 | 0 | 111.9 | I174 L175 K176 W181 I182 | I174-N178 WeakPolarHBondContact CG2-ND2 3.49Å; I174-N178 WeakPolarHBondContact O-CA 3.41Å; I174-N178 WeakPolarHBondContact O-CB 3.49Å; I174-N178 PolarHBondContact O-N 2.91Å; I174-N178 PolarHBondContact O-ND2 3.48Å; L175-N178 WeakPolarHBondContact O-CB 3.11Å; L175-N178 PolarHBondContact O-N 2.8Å; K176-N178 PolarHBondContact O-N 3.03Å; N178-W181 VanDerWaalsContact CA-NE1 3.26Å; N178-W181 VanDerWaalsContact CG-NE1 3.35Å; N178-W181 VanDerWaalsContact O-CD1 3.27Å; N178-W181 PolarHBondContact O-NE1 2.72Å; N178-W181 WeakPolarHBondContact OD1-CZ2 3.24Å; N178-W181 PolarHBondContact OD1-NE1 2.91Å; N178-I182 HydrophobicContact CB-CD1 4.4Å; N178-I182 WeakPolarHBondContact O-CB 3.48Å; N178-I182 VanDerWaalsContact O-CD1 3.24Å; N178-I182 WeakPolarHBondContact O-CD1 3.16Å; N178-I182 WeakPolarHBondContact O-CG1 3.37Å; N178-I182 PolarHBondContact O-N 3.4Å; N178-I182 VanDerWaalsContact O-N 3.08Å |
| 179 | S | 78.3 | Confident | 76.5 | Confident | 45 Ų | 45 | 106.2 Ų | 106.2 | 32% | 0.315 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.7 | -50.2 | 179.6 | -57.2 | 0 | 0 | 0 | 0 | 110.5 | L175 K176 K177 W181 I182 W183 | L175-S179 PolarHBondContact O-N 3.28Å; L175-S179 VanDerWaalsContact O-N 3.08Å; L175-S179 PolarHBondContact O-OG 3.17Å; K176-S179 WeakPolarHBondContact O-CB 3.33Å; K176-S179 PolarHBondContact O-N 3.49Å; K176-S179 VanDerWaalsContact O-N 3.09Å; K177-S179 VanDerWaalsContact C-N 3.31Å; K177-S179 PolarHBondContact O-N 2.96Å; S179-W181 PolarHBondContact O-N 3.43Å; S179-I182 PolarHBondContact O-N 3.08Å; S179-W183 WeakPolarHBondContact O-CB 3.4Å; S179-W183 VanDerWaalsContact O-CG 3.25Å; S179-W183 PolarHBondContact O-N 3.38Å |
| 180 | D | 79 | Confident | 75.2 | Confident | 91 Ų | 91 | 108.2 Ų | 108.2 | 49% | 0.487 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.9 | -41.6 | -174.6 | -62 | -26.1 | 0 | 0 | 0 | 112.6 | K176 K177 W183 D184 | K176-D180 PolarHBondContact O-N 2.89Å; K177-D180 PolarHBondContact O-N 2.92Å; D180-W183 PolarHBondContact O-N 3.41Å; D180-D184 PolarHBondContact O-N 2.82Å |
| 181 | W | 77.8 | Confident | 73.9 | Confident | 109 Ų | 109 | 110.1 Ų | 110.1 | 41% | 0.413 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -71.8 | -36.7 | 176 | 78.9 | -104.5 | 0 | 0 | 0 | 112.8 | K177 N178 S179 W183 D184 W185 | K177-W181 PolarHBondContact O-N 2.96Å; N178-W181 VanDerWaalsContact CA-NE1 3.26Å; N178-W181 VanDerWaalsContact CG-NE1 3.35Å; N178-W181 VanDerWaalsContact O-CD1 3.27Å; N178-W181 PolarHBondContact O-NE1 2.72Å; N178-W181 WeakPolarHBondContact OD1-CZ2 3.24Å; N178-W181 PolarHBondContact OD1-NE1 2.91Å; S179-W181 PolarHBondContact O-N 3.43Å; W181-W183 VanDerWaalsContact C-N 3.3Å; W181-W183 PolarHBondContact O-N 3.24Å; W181-D184 PolarHBondContact O-N 3.4Å; W181-W185 AromaticContact CE3-CD2 3.94Å; W181-W185 HydrophobicContact CE3-CD2 3.94Å; W181-W185 AromaticContact CE3-CE2 3.81Å; W181-W185 HydrophobicContact CE3-CG 4.09Å; W181-W185 HydrophobicContact CE3-CZ2 4.32Å; W181-W185 AromaticContact CE3-NE1 3.86Å; W181-W185 AromaticContact CZ3-CD2 3.99Å; W181-W185 HydrophobicContact CZ3-CD2 3.99Å; W181-W185 HydrophobicContact CZ3-CE3 4.14Å; W181-W185 HydrophobicContact CZ3-CG 4.44Å; W181-W185 HydrophobicContact CZ3-CZ2 4.38Å; W181-W185 HydrophobicContact CZ3-CZ3 4.41Å; W181-W185 PolarHBondContact O-N 3.26Å; W181-W185 VanDerWaalsContact O-N 3.11Å |
| 182 | I | 79.6 | Confident | 72.7 | Confident | 78 Ų | 78 | 112.1 Ų | 112.1 | 40% | 0.4 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.1 | -40.3 | 176.6 | -68.8 | 165.9 | 0 | 0 | 0 | 110 | N178 S179 W185 S186 | N178-I182 HydrophobicContact CB-CD1 4.4Å; N178-I182 WeakPolarHBondContact O-CB 3.48Å; N178-I182 VanDerWaalsContact O-CD1 3.24Å; N178-I182 WeakPolarHBondContact O-CD1 3.16Å; N178-I182 WeakPolarHBondContact O-CG1 3.37Å; N178-I182 PolarHBondContact O-N 3.4Å; N178-I182 VanDerWaalsContact O-N 3.08Å; S179-I182 PolarHBondContact O-N 3.08Å; I182-W185 PolarHBondContact O-N 3.33Å; I182-S186 WeakPolarHBondContact O-CB 3.48Å; I182-S186 PolarHBondContact O-N 3.37Å; I182-S186 PolarHBondContact O-OG 3.43Å |
| 183 | W | 73.8 | Confident | 71.5 | Confident | 168 Ų | 168 | 109.5 Ų | 109.5 | 64% | 0.636 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.5 | -41.8 | 177.7 | -67.8 | 126 | 0 | 0 | 0 | 112.1 | S179 D180 W181 W185 S186 S187 | S179-W183 WeakPolarHBondContact O-CB 3.4Å; S179-W183 VanDerWaalsContact O-CG 3.25Å; S179-W183 PolarHBondContact O-N 3.38Å; D180-W183 PolarHBondContact O-N 3.41Å; W181-W183 VanDerWaalsContact C-N 3.3Å; W181-W183 PolarHBondContact O-N 3.24Å; W183-W185 PolarHBondContact O-N 3.35Å; W183-S186 PolarHBondContact O-N 3.17Å; W183-S186 PolarHBondContact O-OG 2.95Å; W183-S186 VanDerWaalsContact O-OG 3.04Å; W183-S187 WeakPolarHBondContact O-CB 3.28Å; W183-S187 PolarHBondContact O-N 2.83Å; W183-S187 PolarHBondContact O-OG 2.71Å |
| 184 | D | 75.5 | Confident | 70.6 | Confident | 102 Ų | 102 | 112.5 Ų | 112.5 | 55% | 0.545 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.6 | -26.2 | 174 | -75.5 | -16.9 | 0 | 0 | 0 | 113.5 | D180 W181 | D180-D184 PolarHBondContact O-N 2.82Å; W181-D184 PolarHBondContact O-N 3.4Å |
| 185 | W | 69.1 | Low | 69.4 | Low | 187 Ų | 187 | 118.6 Ų | 118.6 | 71% | 0.708 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -82.7 | -38.2 | 176.4 | -74.4 | 40.7 | 0 | 0 | 0 | 112 | W181 I182 W183 | W181-W185 AromaticContact CE3-CD2 3.94Å; W181-W185 HydrophobicContact CE3-CD2 3.94Å; W181-W185 AromaticContact CE3-CE2 3.81Å; W181-W185 HydrophobicContact CE3-CG 4.09Å; W181-W185 HydrophobicContact CE3-CZ2 4.32Å; W181-W185 AromaticContact CE3-NE1 3.86Å; W181-W185 AromaticContact CZ3-CD2 3.99Å; W181-W185 HydrophobicContact CZ3-CD2 3.99Å; W181-W185 HydrophobicContact CZ3-CE3 4.14Å; W181-W185 HydrophobicContact CZ3-CG 4.44Å; W181-W185 HydrophobicContact CZ3-CZ2 4.38Å; W181-W185 HydrophobicContact CZ3-CZ3 4.41Å; W181-W185 PolarHBondContact O-N 3.26Å; W181-W185 VanDerWaalsContact O-N 3.11Å; I182-W185 PolarHBondContact O-N 3.33Å; W183-W185 PolarHBondContact O-N 3.35Å |
| 186 | S | 65.6 | Low | 68.3 | Low | 73 Ų | 73 | 120.6 Ų | 120.6 | 51% | 0.51 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -77.4 | -23.6 | 179.6 | 72.1 | 0 | 0 | 0 | 0 | 114 | I182 W183 | I182-S186 WeakPolarHBondContact O-CB 3.48Å; I182-S186 PolarHBondContact O-N 3.37Å; I182-S186 PolarHBondContact O-OG 3.43Å; W183-S186 PolarHBondContact O-N 3.17Å; W183-S186 PolarHBondContact O-OG 2.95Å; W183-S186 VanDerWaalsContact O-OG 3.04Å |
| 187 | S | 56 | Low | 67.1 | Low | 79 Ų | 79 | 121.1 Ų | 121.1 | 55% | 0.552 | 60% | 0.598 | S | S | * | * | trans | -89.7 | -6.2 | -172.9 | 58.9 | 0 | 0 | 0 | 0 | 114.1 | W183 P189 | W183-S187 WeakPolarHBondContact O-CB 3.28Å; W183-S187 PolarHBondContact O-N 2.83Å; W183-S187 PolarHBondContact O-OG 2.71Å; S187-P189 WeakPolarHBondContact O-CD 3.17Å; S187-P189 VanDerWaalsContact O-N 3.17Å | ||
| 188 | R | 70.6 | Confident | 66.2 | Low | 178 Ų | 178 | 123.4 Ų | 123.4 | 67% | 0.672 | 61% | 0.614 | S | S | * | * | S | Bend | trans | -62 | 119.7 | 170.6 | -64.4 | -168.4 | -179.2 | -130.5 | -1.8 | 107.7 | E190 | R188-E190 PolarHBondContact O-N 2.79Š|
| 189 | P | 57.4 | Low | 64.8 | Low | 118 Ų | 118 | 128.3 Ų | 128.3 | 77% | 0.766 | 63% | 0.633 | S | S | * | * | trans | -57.5 | 122.1 | 177.6 | 23 | -31.2 | 0 | 0 | 0 | 107.8 | S187 N191 | S187-P189 WeakPolarHBondContact O-CD 3.17Å; S187-P189 VanDerWaalsContact O-N 3.17Å; P189-N191 PolarHBondContact O-N 3.39Å; P189-N191 VanDerWaalsContact O-N 3.16Å | ||
| 190 | E | 58.6 | Low | 63.7 | Low | 174 Ų | 174 | 135.8 Ų | 135.8 | 81% | 0.813 | 66% | 0.66 | S | S | * | * | trans | -30.4 | 119 | 171 | -174.6 | 174.8 | -176.4 | 0 | 0 | 109.2 | R188 I192 | R188-E190 PolarHBondContact O-N 2.79Å; E190-I192 VanDerWaalsContact C-N 3.27Å; E190-I192 WeakPolarHBondContact O-CG1 3.16Å; E190-I192 PolarHBondContact O-N 3.33Å | ||
| 191 | N | 56.2 | Low | 62.4 | Low | 146 Ų | 146 | 139.7 Ų | 139.7 | 78% | 0.781 | 68% | 0.675 | S | S | * | * | trans | -59.6 | 94.3 | -179.7 | -176 | -71 | 0 | 0 | 0 | 107.9 | P189 P193 | P189-N191 PolarHBondContact O-N 3.39Å; P189-N191 VanDerWaalsContact O-N 3.16Å; N191-P193 WeakPolarHBondContact O-CD 3.37Å | ||
| 192 | I | 57.6 | Low | 61 | Low | 131 Ų | 131 | 140.4 Ų | 140.4 | 67% | 0.672 | 69% | 0.694 | S | S | * | * | trans | -69.9 | 110 | 173.3 | -64.5 | 151.9 | 0 | 0 | 0 | 104.7 | E190 | E190-I192 VanDerWaalsContact C-N 3.27Å; E190-I192 WeakPolarHBondContact O-CG1 3.16Å; E190-I192 PolarHBondContact O-N 3.33Å | ||
| 193 | P | 59.6 | Low | 59.6 | Low | 79 Ų | 79 | 146.1 Ų | 146.1 | 51% | 0.513 | 72% | 0.716 | S | S | . | * | trans | -57.5 | 137.5 | 172.1 | 24.5 | -32.2 | 0 | 0 | 0 | 107.8 | N191 K195 | N191-P193 WeakPolarHBondContact O-CD 3.37Å; P193-K195 PolarHBondContact O-N 3.4Å; P193-K195 VanDerWaalsContact O-N 3.15Å | ||
| 194 | P | 63.9 | Low | 58.7 | Low | 110 Ų | 110 | 148.6 Ų | 148.6 | 71% | 0.714 | 73% | 0.725 | S | S | * | * | trans | -46.4 | 127.2 | 177.9 | -28.9 | 34.4 | 0 | 0 | 0 | 110.7 | E196 | P194-E196 VanDerWaalsContact C-N 3.26Å; P194-E196 PolarHBondContact O-N 2.75Å | ||
| 195 | K | 59.8 | Low | 57.5 | Low | 195 Ų | 195 | 150.2 Ų | 150.2 | 85% | 0.848 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -78.4 | 65 | -159.3 | -159.5 | 174.5 | -171 | 171.5 | 0 | 111.4 | P193 | P193-K195 PolarHBondContact O-N 3.4Å; P193-K195 VanDerWaalsContact O-N 3.15Å |
| 196 | E | 58.7 | Low | 56.6 | Low | 166 Ų | 166 | 145.6 Ų | 145.6 | 78% | 0.776 | 74% | 0.74 | S | S | * | * | trans | -168.8 | 44.7 | 167.8 | 38.8 | -157.9 | 136.1 | 0 | 0 | 115.4 | P194 L198 | P194-E196 VanDerWaalsContact C-N 3.26Å; P194-E196 PolarHBondContact O-N 2.75Å; E196-L198 PolarHBondContact O-N 3.41Å | ||
| 197 | F | 53.9 | Low | 56.2 | Low | 155 Ų | 155 | 149.2 Ų | 149.2 | 68% | 0.68 | 76% | 0.759 | S | S | * | * | trans | -73 | 82.4 | 149.2 | -69.9 | -69.2 | 0 | 0 | 0 | 108.8 | F199 | F197-F199 HydrophobicContact CB-CD2 3.64Å; F197-F199 HydrophobicContact CB-CE2 3.62Å; F197-F199 AromaticContact CD1-CE2 3.91Å; F197-F199 HydrophobicContact CD1-CE2 3.91Å; F197-F199 HydrophobicContact CD1-CZ 4.35Å; F197-F199 HydrophobicContact CG-CD2 4.46Å; F197-F199 AromaticContact CG-CE2 3.95Å; F197-F199 HydrophobicContact CG-CE2 3.95Å; F197-F199 PolarHBondContact O-N 2.77Å | ||
| 198 | L | 57 | Low | 55.9 | Low | 156 Ų | 156 | 152.4 Ų | 152.4 | 82% | 0.817 | 77% | 0.769 | S | S | * | * | trans | -63.4 | 63 | 167.3 | -77.3 | 167.4 | 0 | 0 | 0 | 110.2 | E196 K200 | E196-L198 PolarHBondContact O-N 3.41Å; L198-K200 PolarHBondContact O-N 2.86Å | ||
| 199 | F | 53.8 | Low | 55.1 | Low | 154 Ų | 154 | 148.4 Ų | 148.4 | 68% | 0.675 | 77% | 0.769 | S | S | * | * | trans | -72.3 | 97.8 | 166.3 | -75.1 | -67 | 0 | 0 | 0 | 107.7 | F197 H201 | F197-F199 HydrophobicContact CB-CD2 3.64Å; F197-F199 HydrophobicContact CB-CE2 3.62Å; F197-F199 AromaticContact CD1-CE2 3.91Å; F197-F199 HydrophobicContact CD1-CE2 3.91Å; F197-F199 HydrophobicContact CD1-CZ 4.35Å; F197-F199 HydrophobicContact CG-CD2 4.46Å; F197-F199 AromaticContact CG-CE2 3.95Å; F197-F199 HydrophobicContact CG-CE2 3.95Å; F197-F199 PolarHBondContact O-N 2.77Å; F199-H201 PolarHBondContact O-N 2.86Å | ||
| 200 | K | 54.8 | Low | 54.5 | Low | 203 Ų | 203 | 149.3 Ų | 149.3 | 88% | 0.883 | 76% | 0.764 | S | S | * | * | trans | -46.2 | 102.5 | 158.5 | -80.7 | -93.1 | 178.6 | 179.1 | 0 | 108.6 | L198 P202 | L198-K200 PolarHBondContact O-N 2.86Å; K200-P202 VanDerWaalsContact O-CD 3.29Å; K200-P202 WeakPolarHBondContact O-CD 3.23Å | ||
| 201 | H | 50.9 | Low | 54.6 | Low | 172 Ų | 172 | 151.7 Ų | 151.7 | 80% | 0.796 | 77% | 0.766 | S | S | * | * | trans | -64.5 | 124.9 | 176.1 | -68.3 | -75.9 | 0 | 0 | 0 | 111 | F199 K203 | F199-H201 PolarHBondContact O-N 2.86Å; H201-K203 PolarHBondContact O-N 3.23Å | ||
| 202 | P | 48 | Very low | 54.6 | Low | 125 Ų | 125 | 151.4 Ų | 151.4 | 81% | 0.812 | 77% | 0.765 | S | S | * | * | trans | -60.5 | 125.6 | 157.2 | -22 | 34.7 | 0 | 0 | 0 | 109.2 | K200 R204 | K200-P202 VanDerWaalsContact O-CD 3.29Å; K200-P202 WeakPolarHBondContact O-CD 3.23Å; P202-R204 PolarHBondContact O-N 2.9Å | ||
| 203 | K | 51.9 | Low | 54.1 | Low | 198 Ų | 198 | 150.3 Ų | 150.3 | 86% | 0.861 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -59.5 | 107.7 | 176.7 | -71.9 | 176.4 | 171.4 | 175.9 | 0 | 110 | H201 | H201-K203 PolarHBondContact O-N 3.23Š|
| 204 | R | 54.2 | Low | 53.8 | Low | 220 Ų | 220 | 151.5 Ų | 151.5 | 83% | 0.83 | 77% | 0.774 | S | S | * | * | 164.5 | 141.4 | 123.3 | -93.7 | -179.6 | 170.2 | 115.8 | -2.6 | 112.9 | P202 | P202-R204 PolarHBondContact O-N 2.9Š| |||
| 205 | T | 50.7 | Low | 53.5 | Low | 135 Ų | 135 | 152.6 Ų | 152.6 | 83% | 0.828 | 78% | 0.779 | S | S | * | * | trans | 79.7 | 136.5 | 144.9 | 51.4 | 0 | 0 | 0 | 0 | 121 | ||||
| 206 | A | 49.4 | Very low | 53.1 | Low | 90 Ų | 90 | 150.7 Ų | 150.7 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | trans | 82 | 78.5 | 164.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | L208 | A206-L208 VanDerWaalsContact C-N 3.28Å; A206-L208 PolarHBondContact O-N 3.43Å | ||
| 207 | T | 57 | Low | 53.2 | Low | 149 Ų | 149 | 150.5 Ų | 150.5 | 91% | 0.914 | 77% | 0.771 | S | S | * | * | trans | -56.7 | 98.6 | 137.4 | -70.8 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 208 | L | 49.7 | Very low | 53.7 | Low | 146 Ų | 146 | 152.8 Ų | 152.8 | 76% | 0.764 | 78% | 0.781 | S | S | * | * | trans | -149.6 | 105.5 | 155.5 | -110.2 | 170 | 0 | 0 | 0 | 107.9 | A206 M210 | A206-L208 VanDerWaalsContact C-N 3.28Å; A206-L208 PolarHBondContact O-N 3.43Å; L208-M210 PolarHBondContact O-N 2.98Å; L208-M210 VanDerWaalsContact O-N 3.15Å | ||
| 209 | S | 53.5 | Low | 53.4 | Low | 94 Ų | 94 | 148.9 Ų | 148.9 | 66% | 0.657 | 78% | 0.778 | S | S | * | * | trans | -60.5 | 111.2 | 174.1 | -175.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 210 | M | 46.4 | Very low | 54 | Low | 137 Ų | 137 | 144.7 Ų | 144.7 | 68% | 0.675 | 78% | 0.778 | S | S | * | * | trans | -116.1 | 32.6 | 166.7 | -73 | -161.3 | -64 | 0 | 0 | 111.2 | L208 K217 | L208-M210 PolarHBondContact O-N 2.98Å; L208-M210 VanDerWaalsContact O-N 3.15Å; M210-K217 VanDerWaalsContact CE-NZ 3.26Å; M210-K217 HydrophobicContact SD-CD 4.43Å | ||
| 211 | R | 60.5 | Low | 54.3 | Low | 224 Ų | 224 | 140.9 Ų | 140.9 | 85% | 0.845 | 77% | 0.766 | S | S | * | * | trans | -89.7 | 115.1 | 160.6 | -62.7 | -176.9 | -174.9 | 94.2 | -3.4 | 104.6 | ||||
| 212 | N | 54.4 | Low | 54.6 | Low | 141 Ų | 141 | 139.2 Ų | 139.2 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | S | Bend | cis | -171.3 | 80.5 | 19.5 | -170.8 | -22 | 0 | 0 | 0 | 108.5 | ||
| 213 | T | 48.1 | Very low | 55.3 | Low | 107 Ų | 107 | 136.8 Ų | 136.8 | 66% | 0.656 | 74% | 0.743 | S | S | * | * | trans | -127.1 | 79.7 | 167.1 | 71 | 0 | 0 | 0 | 0 | 109.8 | V215 | T213-V215 PolarHBondContact O-N 3.5Š| ||
| 214 | S | 53.9 | Low | 56.2 | Low | 105 Ų | 105 | 130.9 Ų | 130.9 | 73% | 0.734 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | 66.7 | 179 | 171.8 | 0 | 0 | 0 | 0 | 111.9 | ||
| 215 | V | 56 | Low | 57.2 | Low | 132 Ų | 132 | 126.7 Ų | 126.7 | 80% | 0.8 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.6 | -5.6 | 163 | -86.9 | 0 | 0 | 0 | 0 | 113.5 | T213 | T213-V215 PolarHBondContact O-N 3.5Š|
| 216 | M | 52.8 | Low | 58.2 | Low | 156 Ų | 156 | 124.6 Ų | 124.6 | 77% | 0.768 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -105.3 | -7.2 | -177.2 | -49.7 | 178.5 | 79.4 | 0 | 0 | 114.1 | ||
| 217 | K | 60 | Low | 59.8 | Low | 162 Ų | 162 | 123.7 Ų | 123.7 | 70% | 0.704 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -96.9 | 2.2 | -172.2 | -63.9 | -174.2 | 82.6 | -176.6 | 0 | 114.8 | M210 | M210-K217 VanDerWaalsContact CE-NZ 3.26Å; M210-K217 HydrophobicContact SD-CD 4.43Å |
| 218 | K | 63.8 | Low | 61 | Low | 203 Ų | 203 | 123.9 Ų | 123.9 | 88% | 0.883 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -127.8 | 80.9 | 172.7 | -161.5 | 151.5 | -176.1 | 178.6 | 0 | 110.4 | ||
| 219 | G | 52.4 | Low | 62.7 | Low | 73 Ų | 73 | 121.9 Ų | 121.9 | 75% | 0.753 | 67% | 0.665 | S | S | * | * | trans | 82.4 | 96.3 | 167.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 220 | G | 65.6 | Low | 64.3 | Low | 66 Ų | 66 | 121.4 Ų | 121.4 | 68% | 0.68 | 65% | 0.651 | S | S | * | * | trans | -70 | 146.3 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 221 | I | 61.3 | Low | 66.4 | Low | 123 Ų | 123 | 119.3 Ų | 119.3 | 63% | 0.631 | 64% | 0.642 | S | S | * | * | trans | -139.8 | 14.4 | 149.4 | 58.4 | 153.2 | 0 | 0 | 0 | 113 | S223 F226 | I221-S223 VanDerWaalsContact C-N 3.29Å; I221-S223 PolarHBondContact O-N 3.37Å; I221-F226 HydrophobicContact CD1-CE1 3.98Å | ||
| 222 | F | 57.2 | Low | 67.9 | Low | 137 Ų | 137 | 112 Ų | 112 | 60% | 0.601 | 62% | 0.623 | S | S | * | * | trans | -84.6 | 74.8 | 178.6 | -60.2 | -68.6 | 0 | 0 | 0 | 110.7 | L227 | F222-L227 HydrophobicContact CD1-CB 4.43Å; F222-L227 HydrophobicContact CD1-CD1 3.9Å; F222-L227 HydrophobicContact CE1-CD1 4.1Å | ||
| 223 | S | 61.9 | Low | 69.8 | Low | 75 Ų | 75 | 107.9 Ų | 107.9 | 52% | 0.524 | 61% | 0.606 | S | S | . | * | trans | -59.8 | 135.5 | 150.5 | -172.5 | 0 | 0 | 0 | 0 | 107.4 | I221 E225 F226 L227 | I221-S223 VanDerWaalsContact C-N 3.29Å; I221-S223 PolarHBondContact O-N 3.37Å; S223-E225 PolarHBondContact O-N 3.43Å; S223-E225 VanDerWaalsContact O-N 3.08Å; S223-F226 PolarHBondContact O-N 3.46Å; S223-L227 PolarHBondContact O-N 3.46Å | ||
| 224 | A | 71.8 | Confident | 71.9 | Confident | 74 Ų | 74 | 106.3 Ų | 106.3 | 61% | 0.612 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -53.9 | -30.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | K228 | A224-K228 WeakPolarHBondContact O-CB 3.27Å; A224-K228 PolarHBondContact O-N 3.29Å |
| 225 | E | 75.9 | Confident | 73.9 | Confident | 131 Ų | 131 | 106.3 Ų | 106.3 | 61% | 0.612 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -70.8 | -36.1 | 175 | -60.1 | -55.5 | 119.8 | 0 | 0 | 113.1 | S223 K228 V229 | S223-E225 PolarHBondContact O-N 3.43Å; S223-E225 VanDerWaalsContact O-N 3.08Å; E225-K228 PolarHBondContact O-N 3.32Å; E225-V229 PolarHBondContact O-N 3.16Å |
| 226 | F | 71.6 | Confident | 75.8 | Confident | 91 Ų | 91 | 105 Ų | 105 | 40% | 0.399 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -71.3 | -41.7 | 175.8 | -173.5 | -103.2 | 0 | 0 | 0 | 110.6 | I221 S223 K228 V229 F230 | I221-F226 HydrophobicContact CD1-CE1 3.98Å; S223-F226 PolarHBondContact O-N 3.46Å; F226-K228 VanDerWaalsContact C-N 3.25Å; F226-K228 PolarHBondContact O-N 3.29Å; F226-V229 PolarHBondContact O-N 3.17Å; F226-V229 VanDerWaalsContact O-N 3.15Å; F226-F230 HydrophobicContact CD1-CB 4.19Å; F226-F230 HydrophobicContact CD1-CG 4.48Å; F226-F230 HydrophobicContact CE1-CB 4.06Å; F226-F230 AromaticContact CE1-CD2 3.69Å; F226-F230 HydrophobicContact CE1-CD2 3.69Å; F226-F230 HydrophobicContact CE1-CE2 4.3Å; F226-F230 AromaticContact CE1-CG 3.91Å; F226-F230 HydrophobicContact CE1-CG 3.91Å; F226-F230 AromaticContact CZ-CD2 3.73Å; F226-F230 HydrophobicContact CZ-CD2 3.73Å; F226-F230 HydrophobicContact CZ-CE2 4.28Å; F226-F230 HydrophobicContact CZ-CG 4.37Å; F226-F230 WeakPolarHBondContact O-CB 3.22Å; F226-F230 PolarHBondContact O-N 2.88Å |
| 227 | L | 81.7 | Confident | 77.9 | Confident | 72 Ų | 72 | 100.3 Ų | 100.3 | 38% | 0.377 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.1 | -34.9 | 175 | -170.6 | 64.4 | 0 | 0 | 0 | 111.6 | F222 S223 V229 F230 L231 | F222-L227 HydrophobicContact CD1-CB 4.43Å; F222-L227 HydrophobicContact CD1-CD1 3.9Å; F222-L227 HydrophobicContact CE1-CD1 4.1Å; S223-L227 PolarHBondContact O-N 3.46Å; L227-V229 VanDerWaalsContact C-N 3.27Å; L227-V229 PolarHBondContact O-N 3.23Å; L227-F230 PolarHBondContact O-N 3.09Å; L227-L231 HydrophobicContact CD1-CD1 4.47Å; L227-L231 WeakPolarHBondContact O-CB 3.45Å; L227-L231 PolarHBondContact O-N 3.35Å |
| 228 | K | 82.4 | Confident | 79.6 | Confident | 153 Ų | 153 | 98 Ų | 98 | 67% | 0.665 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63.6 | -30.1 | 176 | -177.4 | 167.9 | 175.6 | 169.9 | 0 | 113.6 | A224 E225 F226 P232 | A224-K228 WeakPolarHBondContact O-CB 3.27Å; A224-K228 PolarHBondContact O-N 3.29Å; E225-K228 PolarHBondContact O-N 3.32Å; F226-K228 VanDerWaalsContact C-N 3.25Å; F226-K228 PolarHBondContact O-N 3.29Å; K228-P232 WeakPolarHBondContact O-CD 3.31Å; K228-P232 WeakPolarHBondContact O-CG 3.35Å |
| 229 | V | 86.6 | Confident | 81.2 | Confident | 103 Ų | 103 | 93.9 Ų | 93.9 | 62% | 0.624 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -93.4 | -30.2 | 176.1 | -175 | 0 | 0 | 0 | 0 | 111.2 | E225 F226 L227 P232 S233 | E225-V229 PolarHBondContact O-N 3.16Å; F226-V229 PolarHBondContact O-N 3.17Å; F226-V229 VanDerWaalsContact O-N 3.15Å; L227-V229 VanDerWaalsContact C-N 3.27Å; L227-V229 PolarHBondContact O-N 3.23Å; V229-P232 WeakPolarHBondContact O-CG 3.49Å; V229-S233 WeakPolarHBondContact O-CB 3.48Å; V229-S233 PolarHBondContact O-N 2.86Å; V229-S233 PolarHBondContact O-OG 2.83Å |
| 230 | F | 86.8 | Confident | 83.3 | Confident | 84 Ų | 84 | 95.9 Ų | 95.9 | 37% | 0.368 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -78.1 | -38.7 | -177.2 | -162.5 | -102.3 | 0 | 0 | 0 | 112.6 | F226 L227 S233 L234 | F226-F230 HydrophobicContact CD1-CB 4.19Å; F226-F230 HydrophobicContact CD1-CG 4.48Å; F226-F230 HydrophobicContact CE1-CB 4.06Å; F226-F230 AromaticContact CE1-CD2 3.69Å; F226-F230 HydrophobicContact CE1-CD2 3.69Å; F226-F230 HydrophobicContact CE1-CE2 4.3Å; F226-F230 AromaticContact CE1-CG 3.91Å; F226-F230 HydrophobicContact CE1-CG 3.91Å; F226-F230 AromaticContact CZ-CD2 3.73Å; F226-F230 HydrophobicContact CZ-CD2 3.73Å; F226-F230 HydrophobicContact CZ-CE2 4.28Å; F226-F230 HydrophobicContact CZ-CG 4.37Å; F226-F230 WeakPolarHBondContact O-CB 3.22Å; F226-F230 PolarHBondContact O-N 2.88Å; L227-F230 PolarHBondContact O-N 3.09Å; F230-S233 VanDerWaalsContact CA-OG 3.24Å; F230-S233 WeakPolarHBondContact CA-OG 3.24Å; F230-S233 PolarHBondContact O-N 3.09Å; F230-S233 PolarHBondContact O-OG 3.25Å; F230-L234 HydrophobicContact CE1-CD1 3.95Å; F230-L234 HydrophobicContact CZ-CD1 4.37Å; F230-L234 WeakPolarHBondContact O-CB 3.44Å; F230-L234 PolarHBondContact O-N 3.42Å |
| 231 | L | 89.9 | Confident | 84.9 | Confident | 94 Ų | 94 | 95.6 Ų | 95.6 | 49% | 0.492 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.7 | -48.7 | 178.6 | -157.7 | 72.2 | 0 | 0 | 0 | 113.2 | L227 L234 L235 | L227-L231 HydrophobicContact CD1-CD1 4.47Å; L227-L231 WeakPolarHBondContact O-CB 3.45Å; L227-L231 PolarHBondContact O-N 3.35Å; L231-L234 PolarHBondContact O-N 2.9Å; L231-L235 WeakPolarHBondContact O-CG 3.29Å; L231-L235 PolarHBondContact O-N 3.47Å; L231-L235 VanDerWaalsContact O-N 3.08Å |
| 232 | P | 92.8 | Very high | 86.6 | Confident | 69 Ų | 69 | 94.6 Ų | 94.6 | 45% | 0.448 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.9 | -35.1 | 175.3 | 25.6 | -33.6 | 0 | 0 | 0 | 112.7 | K228 V229 L235 L236 | K228-P232 WeakPolarHBondContact O-CD 3.31Å; K228-P232 WeakPolarHBondContact O-CG 3.35Å; V229-P232 WeakPolarHBondContact O-CG 3.49Å; P232-L235 PolarHBondContact O-N 3.34Å; P232-L236 WeakPolarHBondContact O-CB 3.22Å; P232-L236 PolarHBondContact O-N 3.19Å |
| 233 | S | 93.6 | Very high | 88.4 | Confident | 56 Ų | 56 | 89.9 Ų | 89.9 | 39% | 0.392 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -70.7 | -34.9 | 177.8 | 53.9 | 0 | 0 | 0 | 0 | 112.7 | V229 F230 L236 S237 | V229-S233 WeakPolarHBondContact O-CB 3.48Å; V229-S233 PolarHBondContact O-N 2.86Å; V229-S233 PolarHBondContact O-OG 2.83Å; F230-S233 VanDerWaalsContact CA-OG 3.24Å; F230-S233 WeakPolarHBondContact CA-OG 3.24Å; F230-S233 PolarHBondContact O-N 3.09Å; F230-S233 PolarHBondContact O-OG 3.25Å; S233-L236 PolarHBondContact O-N 3.41Å; S233-S237 WeakPolarHBondContact O-CB 2.93Å; S233-S237 PolarHBondContact O-N 2.86Å; S233-S237 PolarHBondContact O-OG 3.29Å |
| 234 | L | 92.5 | Very high | 90.1 | Very high | 73 Ų | 73 | 91.3 Ų | 91.3 | 38% | 0.382 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.3 | -42.1 | 172.1 | -171.3 | 99.3 | 0 | 0 | 0 | 111.9 | F230 L231 S237 H238 | F230-L234 HydrophobicContact CE1-CD1 3.95Å; F230-L234 HydrophobicContact CZ-CD1 4.37Å; F230-L234 WeakPolarHBondContact O-CB 3.44Å; F230-L234 PolarHBondContact O-N 3.42Å; L231-L234 PolarHBondContact O-N 2.9Å; L234-S237 PolarHBondContact O-OG 2.84Å; L234-H238 PolarHBondContact O-N 2.78Å; L234-H238 VanDerWaalsContact O-N 3.17Å; L234-H238 PolarHBondContact O-ND1 3.38Å |
| 235 | L | 95.3 | Very high | 91.2 | Very high | 106 Ų | 106 | 90 Ų | 90 | 56% | 0.555 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.1 | -43.9 | 174.7 | -74.4 | 169.3 | 0 | 0 | 0 | 111 | L231 P232 S237 H238 L239 | L231-L235 WeakPolarHBondContact O-CG 3.29Å; L231-L235 PolarHBondContact O-N 3.47Å; L231-L235 VanDerWaalsContact O-N 3.08Å; P232-L235 PolarHBondContact O-N 3.34Å; L235-S237 PolarHBondContact O-N 3.35Å; L235-H238 PolarHBondContact O-N 2.97Å; L235-L239 WeakPolarHBondContact O-CG 3.25Å; L235-L239 PolarHBondContact O-N 3.02Å |
| 236 | L | 95.9 | Very high | 92.2 | Very high | 103 Ų | 103 | 89 Ų | 89 | 54% | 0.539 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.5 | -40.4 | 179.4 | -168.7 | 64.9 | 0 | 0 | 0 | 111.9 | P232 S233 H238 L239 L240 | P232-L236 WeakPolarHBondContact O-CB 3.22Å; P232-L236 PolarHBondContact O-N 3.19Å; S233-L236 PolarHBondContact O-N 3.41Å; L236-H238 VanDerWaalsContact C-N 3.32Å; L236-H238 PolarHBondContact O-N 3.29Å; L236-L239 PolarHBondContact O-N 3.08Å; L236-L240 HydrophobicContact CG-CD1 4.37Å; L236-L240 WeakPolarHBondContact O-CB 3.08Å; L236-L240 VanDerWaalsContact O-CG 3.31Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 3.39Å |
| 237 | S | 97.1 | Very high | 93.3 | Very high | 59 Ų | 59 | 90.9 Ų | 90.9 | 41% | 0.413 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.7 | -38.3 | 176.4 | 69.9 | 0 | 0 | 0 | 0 | 112.1 | S233 L234 L235 L240 A241 | S233-S237 WeakPolarHBondContact O-CB 2.93Å; S233-S237 PolarHBondContact O-N 2.86Å; S233-S237 PolarHBondContact O-OG 3.29Å; L234-S237 PolarHBondContact O-OG 2.84Å; L235-S237 PolarHBondContact O-N 3.35Å; S237-L240 PolarHBondContact O-N 3.45Å; S237-A241 WeakPolarHBondContact O-CB 3.15Å; S237-A241 PolarHBondContact O-N 3.46Å |
| 238 | H | 96.8 | Very high | 93.9 | Very high | 113 Ų | 113 | 91 Ų | 91 | 52% | 0.523 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.8 | -42.4 | 175.4 | -82.8 | 68.9 | 0 | 0 | 0 | 112.7 | L234 L235 L236 L240 A241 I242 | L234-H238 PolarHBondContact O-N 2.78Å; L234-H238 VanDerWaalsContact O-N 3.17Å; L234-H238 PolarHBondContact O-ND1 3.38Å; L235-H238 PolarHBondContact O-N 2.97Å; L236-H238 VanDerWaalsContact C-N 3.32Å; L236-H238 PolarHBondContact O-N 3.29Å; H238-L240 VanDerWaalsContact C-N 3.3Å; H238-L240 PolarHBondContact O-N 2.92Å; H238-A241 PolarHBondContact O-N 2.99Å; H238-I242 WeakPolarHBondContact O-CB 3.5Å; H238-I242 WeakPolarHBondContact O-CD1 3.43Å; H238-I242 VanDerWaalsContact O-CG1 3.22Å; H238-I242 WeakPolarHBondContact O-CG1 3.3Å; H238-I242 PolarHBondContact O-N 2.66Å |
| 239 | L | 97 | Very high | 94.3 | Very high | 116 Ų | 116 | 85.2 Ų | 85.2 | 61% | 0.607 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.1 | -41.3 | 176 | -72.8 | 169.6 | 0 | 0 | 0 | 111.5 | L235 L236 G243 | L235-L239 WeakPolarHBondContact O-CG 3.25Å; L235-L239 PolarHBondContact O-N 3.02Å; L236-L239 PolarHBondContact O-N 3.08Å; L239-G243 PolarHBondContact O-N 3.29Å |
| 240 | L | 96.9 | Very high | 94.3 | Very high | 115 Ų | 115 | 89.1 Ų | 89.1 | 60% | 0.602 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.5 | -42.7 | 174.7 | -71 | 172.4 | 0 | 0 | 0 | 111.7 | L236 S237 H238 G243 L244 | L236-L240 HydrophobicContact CG-CD1 4.37Å; L236-L240 WeakPolarHBondContact O-CB 3.08Å; L236-L240 VanDerWaalsContact O-CG 3.31Å; L236-L240 WeakPolarHBondContact O-CG 3.44Å; L236-L240 PolarHBondContact O-N 3.39Å; S237-L240 PolarHBondContact O-N 3.45Å; H238-L240 VanDerWaalsContact C-N 3.3Å; H238-L240 PolarHBondContact O-N 2.92Å; L240-G243 PolarHBondContact O-N 2.83Å; L240-L244 WeakPolarHBondContact O-CB 3.27Å; L240-L244 PolarHBondContact O-N 3.34Å |
| 241 | A | 97.4 | Very high | 94.3 | Very high | 60 Ų | 60 | 92 Ų | 92 | 50% | 0.496 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.3 | -43.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | S237 H238 G245 | S237-A241 WeakPolarHBondContact O-CB 3.15Å; S237-A241 PolarHBondContact O-N 3.46Å; H238-A241 PolarHBondContact O-N 2.99Å; A241-G245 PolarHBondContact O-N 3.31Å |
| 242 | I | 97.3 | Very high | 94.1 | Very high | 102 Ų | 102 | 93.1 Ų | 93.1 | 52% | 0.523 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66 | -48.1 | 176.2 | -65.9 | 163.4 | 0 | 0 | 0 | 110.2 | H238 L244 G245 I246 | H238-I242 WeakPolarHBondContact O-CB 3.5Å; H238-I242 WeakPolarHBondContact O-CD1 3.43Å; H238-I242 VanDerWaalsContact O-CG1 3.22Å; H238-I242 WeakPolarHBondContact O-CG1 3.3Å; H238-I242 PolarHBondContact O-N 2.66Å; I242-L244 VanDerWaalsContact C-N 3.32Å; I242-L244 PolarHBondContact O-N 3.09Å; I242-G245 PolarHBondContact O-N 3.12Å; I242-I246 HydrophobicContact CG2-CD1 3.79Å; I242-I246 VanDerWaalsContact O-CG1 3.29Å; I242-I246 WeakPolarHBondContact O-CG1 3.31Å; I242-I246 PolarHBondContact O-N 2.82Å |
| 243 | G | 96.3 | Very high | 93.4 | Very high | 39 Ų | 39 | 94.3 Ų | 94.3 | 40% | 0.402 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.8 | -39.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | L239 L240 Y247 | L239-G243 PolarHBondContact O-N 3.29Å; L240-G243 PolarHBondContact O-N 2.83Å; G243-Y247 VanDerWaalsContact O-CB 3.25Å; G243-Y247 WeakPolarHBondContact O-CB 3.27Å; G243-Y247 PolarHBondContact O-N 2.66Å |
| 244 | L | 96.3 | Very high | 92.1 | Very high | 104 Ų | 104 | 95.7 Ų | 95.7 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.7 | -46 | 174.9 | -169.7 | 62.9 | 0 | 0 | 0 | 110.4 | L240 I242 I246 Y247 I248 | L240-L244 WeakPolarHBondContact O-CB 3.27Å; L240-L244 PolarHBondContact O-N 3.34Å; I242-L244 VanDerWaalsContact C-N 3.32Å; I242-L244 PolarHBondContact O-N 3.09Å; L244-I246 VanDerWaalsContact C-N 3.31Å; L244-I246 PolarHBondContact O-N 3.13Å; L244-Y247 PolarHBondContact O-N 2.89Å; L244-Y247 VanDerWaalsContact O-N 3.09Å; L244-I248 HydrophobicContact CB-CD1 4.39Å; L244-I248 HydrophobicContact CD1-CD1 3.33Å; L244-I248 HydrophobicContact CD2-CD1 4.5Å; L244-I248 HydrophobicContact CG-CD1 3.43Å; L244-I248 VanDerWaalsContact CG-CD1 3.43Å; L244-I248 WeakPolarHBondContact O-CD1 3.5Å; L244-I248 PolarHBondContact O-N 2.97Å |
| 245 | G | 96.4 | Very high | 90.5 | Very high | 48 Ų | 48 | 96.1 Ų | 96.1 | 50% | 0.495 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -56.2 | -43.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | A241 I242 G249 | A241-G245 PolarHBondContact O-N 3.31Å; I242-G245 PolarHBondContact O-N 3.12Å; G245-G249 PolarHBondContact O-N 3.43Å |
| 246 | I | 95.4 | Very high | 88.7 | Confident | 110 Ų | 110 | 96.6 Ų | 96.6 | 56% | 0.564 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -68.5 | -40.1 | 175.1 | -64.4 | 165.7 | 0 | 0 | 0 | 111.1 | I242 L244 G249 R250 | I242-I246 HydrophobicContact CG2-CD1 3.79Å; I242-I246 VanDerWaalsContact O-CG1 3.29Å; I242-I246 WeakPolarHBondContact O-CG1 3.31Å; I242-I246 PolarHBondContact O-N 2.82Å; L244-I246 VanDerWaalsContact C-N 3.31Å; L244-I246 PolarHBondContact O-N 3.13Å; I246-G249 PolarHBondContact O-N 2.95Å; I246-R250 VanDerWaalsContact O-CB 3.22Å; I246-R250 WeakPolarHBondContact O-CB 3.29Å; I246-R250 PolarHBondContact O-N 3.47Å |
| 247 | Y | 94.8 | Very high | 86.7 | Confident | 130 Ų | 130 | 96.2 Ų | 96.2 | 51% | 0.51 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.3 | -47 | 178.8 | 177.4 | -104.7 | 0 | 0 | 0 | 112 | G243 L244 R251 | G243-Y247 VanDerWaalsContact O-CB 3.25Å; G243-Y247 WeakPolarHBondContact O-CB 3.27Å; G243-Y247 PolarHBondContact O-N 2.66Å; L244-Y247 PolarHBondContact O-N 2.89Å; L244-Y247 VanDerWaalsContact O-N 3.09Å; Y247-R251 HydrophobicContact CE1-CG 4.12Å; Y247-R251 HydrophobicContact CE2-CG 4.13Å; Y247-R251 VanDerWaalsContact O-CB 3.31Å; Y247-R251 WeakPolarHBondContact O-CB 3.31Å; Y247-R251 VanDerWaalsContact O-CG 3.31Å; Y247-R251 WeakPolarHBondContact O-CG 3.2Å; Y247-R251 PolarHBondContact O-N 2.83Å; Y247-R251 PolarHBondContact OH-NE 3.28Å; Y247-R251 VanDerWaalsContact OH-NE 3.11Å; Y247-R251 PolarHBondContact OH-NH2 3.11Å |
| 248 | I | 93.7 | Very high | 84.6 | Confident | 74 Ų | 74 | 98.9 Ų | 98.9 | 38% | 0.379 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.5 | -46.1 | 174.1 | -74.9 | 86.2 | 0 | 0 | 0 | 109.8 | L244 R250 R251 L252 | L244-I248 HydrophobicContact CB-CD1 4.39Å; L244-I248 HydrophobicContact CD1-CD1 3.33Å; L244-I248 HydrophobicContact CD2-CD1 4.5Å; L244-I248 HydrophobicContact CG-CD1 3.43Å; L244-I248 VanDerWaalsContact CG-CD1 3.43Å; L244-I248 WeakPolarHBondContact O-CD1 3.5Å; L244-I248 PolarHBondContact O-N 2.97Å; I248-R250 VanDerWaalsContact C-N 3.32Å; I248-R250 PolarHBondContact O-N 3.39Å; I248-R251 PolarHBondContact O-N 2.86Å; I248-R251 VanDerWaalsContact O-N 3.13Å; I248-L252 HydrophobicContact CG2-CD1 3.63Å; I248-L252 HydrophobicContact CG2-CG 3.97Å; I248-L252 WeakPolarHBondContact O-CB 3.42Å; I248-L252 VanDerWaalsContact O-CG 3.27Å; I248-L252 WeakPolarHBondContact O-CG 3.24Å; I248-L252 PolarHBondContact O-N 3.21Å |
| 249 | G | 91.6 | Very high | 82.2 | Confident | 32 Ų | 32 | 106.7 Ų | 106.7 | 33% | 0.33 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -54 | -49 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | G245 I246 L252 T253 | G245-G249 PolarHBondContact O-N 3.43Å; I246-G249 PolarHBondContact O-N 2.95Å; G249-L252 PolarHBondContact O-N 2.95Å; G249-T253 VanDerWaalsContact O-CG2 3.27Å; G249-T253 WeakPolarHBondContact O-CG2 3.4Å; G249-T253 PolarHBondContact O-N 3.25Å; G249-T253 PolarHBondContact O-OG1 2.69Å |
| 250 | R | 87.5 | Confident | 81.4 | Confident | 185 Ų | 185 | 106.2 Ų | 106.2 | 70% | 0.698 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -68.6 | -35 | 178.2 | -168.2 | 170.4 | 170.8 | 174.6 | -3 | 112.9 | I246 I248 T253 T254 | I246-R250 VanDerWaalsContact O-CB 3.22Å; I246-R250 WeakPolarHBondContact O-CB 3.29Å; I246-R250 PolarHBondContact O-N 3.47Å; I248-R250 VanDerWaalsContact C-N 3.32Å; I248-R250 PolarHBondContact O-N 3.39Å; R250-T253 WeakPolarHBondContact CA-OG1 3.25Å; R250-T253 PolarHBondContact O-OG1 3.05Å; R250-T253 VanDerWaalsContact O-OG1 3.12Å; R250-T254 VanDerWaalsContact O-CB 3.29Å; R250-T254 WeakPolarHBondContact O-CB 3.48Å; R250-T254 PolarHBondContact O-N 3.01Å; R250-T254 PolarHBondContact O-OG1 3.42Å |
| 251 | R | 87.1 | Confident | 80.6 | Confident | 145 Ų | 145 | 105.7 Ų | 105.7 | 55% | 0.547 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -64.5 | -43.3 | 172.3 | -82.6 | -71.4 | -168.2 | -179.4 | 1.8 | 111.5 | Y247 I248 T254 S255 | Y247-R251 HydrophobicContact CE1-CG 4.12Å; Y247-R251 HydrophobicContact CE2-CG 4.13Å; Y247-R251 VanDerWaalsContact O-CB 3.31Å; Y247-R251 WeakPolarHBondContact O-CB 3.31Å; Y247-R251 VanDerWaalsContact O-CG 3.31Å; Y247-R251 WeakPolarHBondContact O-CG 3.2Å; Y247-R251 PolarHBondContact O-N 2.83Å; Y247-R251 PolarHBondContact OH-NE 3.28Å; Y247-R251 VanDerWaalsContact OH-NE 3.11Å; Y247-R251 PolarHBondContact OH-NH2 3.11Å; I248-R251 PolarHBondContact O-N 2.86Å; I248-R251 VanDerWaalsContact O-N 3.13Å; R251-T254 PolarHBondContact O-N 3.37Å; R251-S255 VanDerWaalsContact O-CB 3.25Å; R251-S255 WeakPolarHBondContact O-CB 3.21Å; R251-S255 PolarHBondContact O-N 3.11Å; R251-S255 PolarHBondContact O-OG 3.43Å |
| 252 | L | 84.4 | Confident | 79.7 | Confident | 117 Ų | 117 | 108.3 Ų | 108.3 | 61% | 0.613 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65.8 | -43.5 | 177.8 | -66.3 | 173.7 | 0 | 0 | 0 | 111.6 | I248 G249 T254 T256 | I248-L252 HydrophobicContact CG2-CD1 3.63Å; I248-L252 HydrophobicContact CG2-CG 3.97Å; I248-L252 WeakPolarHBondContact O-CB 3.42Å; I248-L252 VanDerWaalsContact O-CG 3.27Å; I248-L252 WeakPolarHBondContact O-CG 3.24Å; I248-L252 PolarHBondContact O-N 3.21Å; G249-L252 PolarHBondContact O-N 2.95Å; L252-T254 VanDerWaalsContact C-N 3.34Å; L252-T254 PolarHBondContact O-N 3.18Å; L252-T256 PolarHBondContact O-N 2.98Å; L252-T256 VanDerWaalsContact O-N 3.11Å |
| 253 | T | 79.1 | Confident | 78.6 | Confident | 93 Ų | 93 | 108.6 Ų | 108.6 | 57% | 0.571 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -70.8 | -27.2 | 178.3 | 63.3 | 0 | 0 | 0 | 0 | 113.2 | G249 R250 | G249-T253 VanDerWaalsContact O-CG2 3.27Å; G249-T253 WeakPolarHBondContact O-CG2 3.4Å; G249-T253 PolarHBondContact O-N 3.25Å; G249-T253 PolarHBondContact O-OG1 2.69Å; R250-T253 WeakPolarHBondContact CA-OG1 3.25Å; R250-T253 PolarHBondContact O-OG1 3.05Å; R250-T253 VanDerWaalsContact O-OG1 3.12Å |
| 254 | T | 66.3 | Low | 77.5 | Confident | 85 Ų | 85 | 113 Ų | 113 | 52% | 0.521 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -83.8 | -39.5 | 176.3 | -49.3 | 0 | 0 | 0 | 0 | 111.4 | R250 R251 L252 T256 S257 | R250-T254 VanDerWaalsContact O-CB 3.29Å; R250-T254 WeakPolarHBondContact O-CB 3.48Å; R250-T254 PolarHBondContact O-N 3.01Å; R250-T254 PolarHBondContact O-OG1 3.42Å; R251-T254 PolarHBondContact O-N 3.37Å; L252-T254 VanDerWaalsContact C-N 3.34Å; L252-T254 PolarHBondContact O-N 3.18Å; T254-T256 VanDerWaalsContact C-N 3.29Å; T254-T256 PolarHBondContact O-N 3.46Å; T254-S257 WeakPolarHBondContact O-CB 3.43Å; T254-S257 PolarHBondContact O-N 2.87Å |
| 255 | S | 58.9 | Low | 76.3 | Confident | 83 Ų | 83 | 113.6 Ų | 113.6 | 58% | 0.58 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -66.8 | -29.5 | 177.4 | -65.2 | 0 | 0 | 0 | 0 | 112.7 | R251 S257 | R251-S255 VanDerWaalsContact O-CB 3.25Å; R251-S255 WeakPolarHBondContact O-CB 3.21Å; R251-S255 PolarHBondContact O-N 3.11Å; R251-S255 PolarHBondContact O-OG 3.43Å; S255-S257 PolarHBondContact O-N 2.96Å |
| 256 | T | 57.7 | Low | 74.8 | Confident | 116 Ų | 116 | 118.3 Ų | 118.3 | 71% | 0.712 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -6.8 | 175.4 | -153.9 | 0 | 0 | 0 | 0 | 114.1 | L252 T254 T258 | L252-T256 PolarHBondContact O-N 2.98Å; L252-T256 VanDerWaalsContact O-N 3.11Å; T254-T256 VanDerWaalsContact C-N 3.29Å; T254-T256 PolarHBondContact O-N 3.46Å; T256-T258 VanDerWaalsContact C-N 3.3Å |
| 257 | S | 52.1 | Low | 73.2 | Confident | 95 Ų | 95 | 118.9 Ų | 118.9 | 66% | 0.664 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | 4.5 | 177.2 | -177.2 | 0 | 0 | 0 | 0 | 113.3 | T254 S255 | T254-S257 WeakPolarHBondContact O-CB 3.43Å; T254-S257 PolarHBondContact O-N 2.87Å; S255-S257 PolarHBondContact O-N 2.96Å |
| 258 | T | 53.1 | Low | 71.5 | Confident | 114 Ų | 114 | 118 Ų | 118 | 70% | 0.699 | 63% | 0.627 | S | S | * | * | trans | -109 | 62.7 | 175.8 | -34.2 | 0 | 0 | 0 | 0 | 109.5 | T256 | T256-T258 VanDerWaalsContact C-N 3.3Š| ||
| 259 | F | 46.1 | Very low | 69.4 | Low | 277 Ų | 277 | 122 Ų | 122 | 100% | 1.215 | 65% | 0.65 | S | S | * | * | trans | -148.3 | 0 | 161.3 | -105.5 | -78.4 | 0 | 0 | 0 | 108.9 |
Retrieved 259 of 259 residues in 157.2 ms
(Link to these results)