| 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 | 53.8 | Low | 46.8 | Very low | 249 Ų | 249 | 154.3 Ų | 154.3 | 100% | 1.227 | 85% | 0.847 | S | S | * | * | 0 | 137.1 | 0 | -73.2 | 160.1 | 173.1 | 0 | 0 | 107.6 | |||||
| 2 | L | 44.3 | Very low | 46.5 | Very low | 172 Ų | 172 | 153.1 Ų | 153.1 | 90% | 0.901 | 84% | 0.838 | S | S | * | * | trans | -83.8 | 150.5 | 177.2 | -73 | 163.2 | 0 | 0 | 0 | 110.2 | ||||
| 3 | G | 47.3 | Very low | 46.4 | Very low | 72 Ų | 72 | 148.2 Ų | 148.2 | 74% | 0.742 | 83% | 0.83 | S | S | * | * | trans | -151.6 | 43.5 | -175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | V5 | G3-V5 PolarHBondContact O-N 3.29Š| ||
| 4 | S | 46.2 | Very low | 45.5 | Very low | 109 Ų | 109 | 148.9 Ų | 148.9 | 76% | 0.762 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 116.4 | 179.3 | -51 | 0 | 0 | 0 | 0 | 110.8 | K6 | S4-K6 PolarHBondContact O-N 3.5Š|
| 5 | V | 55.7 | Low | 44.7 | Very low | 150 Ų | 150 | 155.7 Ų | 155.7 | 91% | 0.909 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 125.7 | 165.7 | 179.5 | 0 | 0 | 0 | 0 | 108.1 | G3 | G3-V5 PolarHBondContact O-N 3.29Š|
| 6 | K | 50.3 | Low | 44.1 | Very low | 187 Ų | 187 | 152.8 Ų | 152.8 | 81% | 0.813 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -96.3 | 157 | -172.3 | -176.8 | 178.8 | 169.9 | -170 | 0 | 111.3 | S4 | S4-K6 PolarHBondContact O-N 3.5Š|
| 7 | M | 48.8 | Very low | 43.4 | Very low | 159 Ų | 159 | 156.1 Ų | 156.1 | 78% | 0.783 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 145.5 | 178.7 | -54 | 179 | -68.3 | 0 | 0 | 114.2 | ||
| 8 | E | 40 | Very low | 43.3 | Very low | 177 Ų | 177 | 158.6 Ų | 158.6 | 83% | 0.827 | 83% | 0.825 | S | S | * | * | trans | -143.2 | 113.7 | 137 | -146.2 | 160.2 | 130.3 | 0 | 0 | 105.3 | ||||
| 9 | A | 39.3 | Very low | 43.8 | Very low | 80 Ų | 80 | 154.8 Ų | 154.8 | 66% | 0.661 | 81% | 0.811 | S | S | * | * | cis | 77.6 | 57.7 | 38.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 10 | H | 45.4 | Very low | 43.4 | Very low | 191 Ų | 191 | 155.5 Ų | 155.5 | 88% | 0.884 | 81% | 0.81 | S | S | * | * | trans | -90.4 | 114.1 | 153.8 | -89.1 | -74.4 | 0 | 0 | 0 | 109.3 | ||||
| 11 | D | 43.8 | Very low | 43.2 | Very low | 151 Ų | 151 | 153 Ų | 153 | 81% | 0.807 | 81% | 0.812 | S | S | * | * | trans | -87.9 | -178.1 | -177.6 | -139.6 | -57.8 | 0 | 0 | 0 | 112.4 | ||||
| 12 | L | 43.5 | Very low | 42.3 | Very low | 140 Ų | 140 | 144.6 Ų | 144.6 | 73% | 0.733 | 79% | 0.789 | S | S | * | * | trans | -67.2 | 153.2 | -164.3 | -67.3 | 161.2 | 0 | 0 | 0 | 115.6 | ||||
| 13 | A | 44.3 | Very low | 42 | Very low | 89 Ų | 89 | 145.1 Ų | 145.1 | 74% | 0.736 | 79% | 0.787 | S | S | * | * | trans | -134.6 | 86.3 | 152.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 14 | E | 34.2 | Very low | 41.7 | Very low | 158 Ų | 158 | 148.2 Ų | 148.2 | 74% | 0.738 | 79% | 0.791 | S | S | * | * | trans | -60.3 | 138.4 | 175.3 | -64.9 | 172.4 | 101.5 | 0 | 0 | 111.2 | ||||
| 15 | W | 33.8 | Very low | 41.3 | Very low | 251 Ų | 251 | 152.2 Ų | 152.2 | 95% | 0.951 | 79% | 0.791 | S | S | * | * | trans | -123.9 | 67.9 | 161.7 | -82.3 | 81.2 | 0 | 0 | 0 | 109.6 | ||||
| 16 | S | 35.1 | Very low | 40.4 | Very low | 109 Ų | 109 | 150.6 Ų | 150.6 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | trans | -129.9 | 89.5 | 168.9 | -72.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 17 | Y | 31.5 | Very low | 40.7 | Very low | 210 Ų | 210 | 145.8 Ų | 145.8 | 82% | 0.824 | 77% | 0.774 | S | S | * | * | trans | -140.5 | 123.9 | 170.3 | -161.4 | -111.1 | 0 | 0 | 0 | 111.9 | P19 | Y17-P19 HydrophobicContact CE1-CG 3.92Š| ||
| 18 | Y | 41.6 | Very low | 40.7 | Very low | 201 Ų | 201 | 144.4 Ų | 144.4 | 79% | 0.788 | 78% | 0.775 | S | S | * | * | trans | -125.8 | 132.3 | 174.7 | -142.9 | -82.3 | 0 | 0 | 0 | 106.3 | E20 | Y18-E20 HydrophobicContact CD1-CB 4.29Š| ||
| 19 | P | 52.7 | Low | 41.1 | Very low | 87 Ų | 87 | 142 Ų | 142 | 57% | 0.565 | 77% | 0.772 | S | S | * | * | -138.4 | 144.1 | 127.9 | 34.9 | -21.9 | 0 | 0 | 0 | 109.8 | Y17 | Y17-P19 HydrophobicContact CE1-CG 3.92Š| |||
| 20 | E | 37.3 | Very low | 41.8 | Very low | 168 Ų | 168 | 143.6 Ų | 143.6 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | cis | 74.5 | 131 | 31.6 | -164.6 | 156.8 | -158.4 | 0 | 0 | 115.7 | Y18 | Y18-E20 HydrophobicContact CD1-CB 4.29Š| ||
| 21 | A | 39 | Very low | 41.8 | Very low | 103 Ų | 103 | 140.6 Ų | 140.6 | 85% | 0.851 | 77% | 0.77 | S | S | * | * | trans | 62.4 | 146.5 | -170.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 22 | G | 33.8 | Very low | 42.4 | Very low | 73 Ų | 73 | 138.8 Ų | 138.8 | 75% | 0.753 | 77% | 0.767 | S | S | * | * | cis | -163.5 | 171.2 | -1.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 23 | E | 39.1 | Very low | 42.7 | Very low | 183 Ų | 183 | 137.4 Ų | 137.4 | 86% | 0.855 | 77% | 0.765 | S | S | * | * | trans | -70.9 | 166.5 | -167.6 | -49.1 | -174.8 | 145.9 | 0 | 0 | 116.1 | ||||
| 24 | V | 40.3 | Very low | 42.4 | Very low | 136 Ų | 136 | 142 Ų | 142 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | -178.4 | 117.1 | 115.7 | 149.5 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 25 | Y | 37.5 | Very low | 43 | Very low | 193 Ų | 193 | 138.6 Ų | 138.6 | 76% | 0.757 | 77% | 0.772 | S | S | * | * | trans | 29.4 | 125.6 | 147.4 | -110.6 | -104.2 | 0 | 0 | 0 | 124.3 | P27 | Y25-P27 HydrophobicContact CD1-CB 4.33Å; Y25-P27 HydrophobicContact CD1-CG 4.44Å; Y25-P27 HydrophobicContact CE1-CB 4.1Å; Y25-P27 HydrophobicContact CE1-CG 4.37Å | ||
| 26 | S | 36.8 | Very low | 44.5 | Very low | 116 Ų | 116 | 132.4 Ų | 132.4 | 81% | 0.811 | 76% | 0.764 | S | S | * | * | -170.4 | 155.3 | 114.7 | -87.4 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 27 | P | 57.6 | Low | 44.8 | Very low | 87 Ų | 87 | 135.6 Ų | 135.6 | 57% | 0.565 | 77% | 0.771 | S | S | * | * | -139.2 | 170.1 | -127.9 | 43.2 | -27.6 | 0 | 0 | 0 | 119 | Y25 | Y25-P27 HydrophobicContact CD1-CB 4.33Å; Y25-P27 HydrophobicContact CD1-CG 4.44Å; Y25-P27 HydrophobicContact CE1-CB 4.1Å; Y25-P27 HydrophobicContact CE1-CG 4.37Å | |||
| 28 | V | 47.5 | Very low | 45.2 | Very low | 130 Ų | 130 | 132.9 Ų | 132.9 | 79% | 0.788 | 77% | 0.771 | S | S | * | * | trans | 70.3 | 140.9 | 147.8 | 160.3 | 0 | 0 | 0 | 0 | 116 | ||||
| 29 | T | 49 | Very low | 44.8 | Very low | 127 Ų | 127 | 128.7 Ų | 128.7 | 78% | 0.779 | 77% | 0.772 | S | S | * | * | cis | -145.1 | -175.1 | 44.5 | -7.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 30 | P | 54 | Low | 44.1 | Very low | 113 Ų | 113 | 133.8 Ų | 133.8 | 73% | 0.734 | 78% | 0.781 | S | S | * | * | trans | -126.3 | -176.3 | -131.1 | 39.7 | -18.4 | 0 | 0 | 0 | 117.1 | ||||
| 31 | V | 46.4 | Very low | 44.1 | Very low | 127 Ų | 127 | 133.1 Ų | 133.1 | 77% | 0.77 | 78% | 0.779 | S | S | * | * | trans | -125.6 | 143.2 | 173.4 | 177 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 32 | P | 55.7 | Low | 44.6 | Very low | 114 Ų | 114 | 133 Ų | 133 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | trans | -124.9 | 127.4 | 139.6 | 33.3 | -22.8 | 0 | 0 | 0 | 110.2 | ||||
| 33 | T | 50.5 | Low | 45.2 | Very low | 111 Ų | 111 | 137 Ų | 137 | 68% | 0.681 | 77% | 0.772 | S | S | * | * | 70.2 | 108.7 | 62.2 | -57.1 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 34 | M | 38.1 | Very low | 45.6 | Very low | 185 Ų | 185 | 135.9 Ų | 135.9 | 91% | 0.911 | 77% | 0.772 | S | S | * | * | trans | -144.8 | 149.6 | 157.1 | -94.5 | -61.8 | 111 | 0 | 0 | 110.3 | ||||
| 35 | A | 45 | Very low | 46.1 | Very low | 86 Ų | 86 | 135 Ų | 135 | 71% | 0.711 | 77% | 0.768 | S | S | * | * | trans | -122.5 | 171 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 36 | P | 66.4 | Low | 46.2 | Very low | 122 Ų | 122 | 134 Ų | 134 | 79% | 0.792 | 78% | 0.776 | S | S | * | * | trans | -90.1 | 156.1 | -156.2 | 35.3 | -36.5 | 0 | 0 | 0 | 115 | ||||
| 37 | L | 41.4 | Very low | 46.3 | Very low | 175 Ų | 175 | 131.8 Ų | 131.8 | 92% | 0.916 | 77% | 0.771 | S | S | * | * | trans | -138.6 | 154.7 | 162.9 | -79.6 | 179.4 | 0 | 0 | 0 | 112.1 | ||||
| 38 | N | 39.3 | Very low | 45.6 | Very low | 153 Ų | 153 | 132.8 Ų | 132.8 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -103.3 | 170.5 | 172.8 | -78.1 | -71.1 | 0 | 0 | 0 | 110.9 | ||||
| 39 | S | 33 | Very low | 45.9 | Very low | 114 Ų | 114 | 131.3 Ų | 131.3 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | trans | 78 | 111.3 | 152.8 | -60 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 40 | Y | 38.8 | Very low | 45.6 | Very low | 193 Ų | 193 | 135.7 Ų | 135.7 | 76% | 0.757 | 78% | 0.777 | S | S | * | * | 78.2 | 167.6 | 129.4 | -151.3 | -101.7 | 0 | 0 | 0 | 119.1 | |||||
| 41 | M | 37.8 | Very low | 45.9 | Very low | 154 Ų | 154 | 135.3 Ų | 135.3 | 76% | 0.759 | 77% | 0.774 | S | S | * | * | trans | 68.3 | 114.7 | -161.8 | -51.8 | -56.6 | 179.4 | 0 | 0 | 112.6 | ||||
| 42 | T | 48.5 | Very low | 46.4 | Very low | 101 Ų | 101 | 134.8 Ų | 134.8 | 62% | 0.62 | 77% | 0.774 | S | S | * | * | cis | 72.9 | 102.5 | 38.2 | -48.2 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 43 | L | 46.8 | Very low | 45.4 | Very low | 157 Ų | 157 | 133.4 Ų | 133.4 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | 179.4 | 130.3 | 126.6 | -96.8 | 170.5 | 0 | 0 | 0 | 111.4 | |||||
| 44 | N | 47 | Very low | 44.7 | Very low | 159 Ų | 159 | 131.8 Ų | 131.8 | 85% | 0.85 | 79% | 0.785 | S | S | * | * | trans | -109.9 | 144.5 | 161.5 | -85 | 5.6 | 0 | 0 | 0 | 109 | ||||
| 45 | P | 50.6 | Low | 45.2 | Very low | 117 Ų | 117 | 131.5 Ų | 131.5 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | trans | -123.1 | 128.2 | 135.4 | 3.1 | 18.8 | 0 | 0 | 0 | 110.3 | ||||
| 46 | L | 40.7 | Very low | 44.9 | Very low | 173 Ų | 173 | 136.1 Ų | 136.1 | 91% | 0.906 | 79% | 0.793 | S | S | * | * | 74.6 | 122.8 | 82.6 | -170.9 | 78.2 | 0 | 0 | 0 | 112.4 | |||||
| 47 | G | 38.3 | Very low | 43.6 | Very low | 69 Ų | 69 | 134.5 Ų | 134.5 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | cis | -149 | -166.6 | -7.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 48 | S | 42.9 | Very low | 43.7 | Very low | 109 Ų | 109 | 131.3 Ų | 131.3 | 76% | 0.762 | 78% | 0.783 | S | S | * | * | cis | -175.2 | -179.6 | 13 | -110.1 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 49 | P | 54.3 | Low | 44.3 | Very low | 99 Ų | 99 | 130 Ų | 130 | 64% | 0.643 | 78% | 0.782 | S | S | * | * | cis | -140 | 126.3 | -33.4 | 34.5 | -14.2 | 0 | 0 | 0 | 115.6 | ||||
| 50 | Y | 43.3 | Very low | 44.8 | Very low | 219 Ų | 219 | 132 Ų | 132 | 86% | 0.859 | 78% | 0.783 | S | S | * | * | trans | 65.6 | 179.4 | 141 | -69.2 | -75.2 | 0 | 0 | 0 | 119.9 | ||||
| 51 | P | 60.1 | Low | 45.8 | Very low | 104 Ų | 104 | 127.8 Ų | 127.8 | 68% | 0.675 | 78% | 0.78 | S | S | * | * | -143 | -140.3 | -88.8 | 47.3 | -25.3 | 0 | 0 | 0 | 112.3 | |||||
| 52 | P | 55.6 | Low | 45.9 | Very low | 117 Ų | 117 | 127.3 Ų | 127.3 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | cis | -131 | 158.5 | -30 | 36.4 | -20 | 0 | 0 | 0 | 116 | ||||
| 53 | G | 35.9 | Very low | 45.6 | Very low | 85 Ų | 85 | 125.7 Ų | 125.7 | 88% | 0.876 | 79% | 0.789 | S | S | * | * | trans | 73.8 | 159.8 | 146.8 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 54 | G | 35.9 | Very low | 46 | Very low | 76 Ų | 76 | 123.9 Ų | 123.9 | 78% | 0.784 | 79% | 0.787 | S | S | * | * | cis | -178.4 | 144.2 | -8.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 55 | L | 47.1 | Very low | 45.5 | Very low | 179 Ų | 179 | 124.6 Ų | 124.6 | 94% | 0.937 | 79% | 0.79 | S | S | * | * | trans | -109.1 | 122.5 | -178.7 | -66.6 | 174 | 0 | 0 | 0 | 111.3 | ||||
| 56 | Q | 39.3 | Very low | 45.3 | Very low | 183 Ų | 183 | 123.6 Ų | 123.6 | 86% | 0.855 | 79% | 0.791 | S | S | * | * | trans | -154.8 | 144.5 | 173.2 | -97.7 | -67.9 | 9.6 | 0 | 0 | 112.1 | ||||
| 57 | A | 38.6 | Very low | 46.5 | Very low | 89 Ų | 89 | 121 Ų | 121 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | 47.2 | 142.2 | 155.4 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 58 | S | 45.1 | Very low | 47.1 | Very low | 108 Ų | 108 | 123.9 Ų | 123.9 | 76% | 0.755 | 79% | 0.791 | S | S | * | * | trans | -76.8 | 169.4 | 162.6 | -44.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 59 | P | 50.4 | Low | 47.1 | Very low | 124 Ų | 124 | 122.8 Ų | 122.8 | 81% | 0.805 | 79% | 0.789 | S | S | * | * | -147.9 | 170.9 | 102.2 | 40.6 | -25.9 | 0 | 0 | 0 | 116.5 | |||||
| 60 | L | 43.7 | Very low | 47.1 | Very low | 157 Ų | 157 | 124.3 Ų | 124.3 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -84.4 | -174.9 | 159.5 | -90.6 | 84.9 | 0 | 0 | 0 | 110.2 | ||||
| 61 | P | 60.3 | Low | 47.4 | Very low | 104 Ų | 104 | 120.6 Ų | 120.6 | 68% | 0.675 | 80% | 0.799 | S | S | * | * | cis | -129.4 | 174.6 | -12 | 35.9 | -19.7 | 0 | 0 | 0 | 114.2 | ||||
| 62 | T | 40.6 | Very low | 46.8 | Very low | 145 Ų | 145 | 120.2 Ų | 120.2 | 89% | 0.89 | 80% | 0.804 | S | S | * | * | -174 | 149.9 | 125.6 | 16.7 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 63 | G | 40.6 | Very low | 46.8 | Very low | 67 Ų | 67 | 120.5 Ų | 120.5 | 69% | 0.691 | 81% | 0.806 | S | S | * | * | trans | -118.2 | -158.1 | 163.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 64 | P | 54.9 | Low | 47.1 | Very low | 119 Ų | 119 | 124.9 Ų | 124.9 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | cis | -138.1 | -160.7 | 12.6 | 38.7 | -17.2 | 0 | 0 | 0 | 114.6 | ||||
| 65 | L | 37.6 | Very low | 47.1 | Very low | 173 Ų | 173 | 124.8 Ų | 124.8 | 91% | 0.906 | 81% | 0.807 | S | S | * | * | trans | 114.4 | 154.3 | 161.9 | -60.2 | 172.1 | 0 | 0 | 0 | 116.7 | ||||
| 66 | A | 46.4 | Very low | 47.5 | Very low | 96 Ų | 96 | 122 Ų | 122 | 79% | 0.793 | 80% | 0.8 | S | S | * | * | trans | -130.9 | 169.6 | -154.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 67 | P | 65.8 | Low | 47.5 | Very low | 119 Ų | 119 | 120 Ų | 120 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | trans | -102.3 | 177.3 | -155.5 | 40.5 | -38.1 | 0 | 0 | 0 | 115.5 | ||||
| 68 | P | 51.6 | Low | 47.7 | Very low | 130 Ų | 130 | 124.8 Ų | 124.8 | 84% | 0.844 | 81% | 0.805 | S | S | * | * | trans | -123.9 | 176.9 | 141.5 | 36.7 | -26.5 | 0 | 0 | 0 | 114.1 | ||||
| 69 | A | 42.5 | Very low | 48 | Very low | 86 Ų | 86 | 125.7 Ų | 125.7 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | trans | -88.4 | 165.3 | -164.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 70 | P | 53.7 | Low | 47.3 | Very low | 130 Ų | 130 | 122.9 Ų | 122.9 | 84% | 0.844 | 80% | 0.802 | S | S | * | * | trans | -76.4 | 149.4 | 176.4 | 31.7 | -36.6 | 0 | 0 | 0 | 113.6 | ||||
| 71 | T | 50.6 | Low | 47.2 | Very low | 142 Ų | 142 | 124.3 Ų | 124.3 | 87% | 0.871 | 81% | 0.81 | S | S | * | * | trans | -115.7 | 154.8 | 175.2 | 49.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 72 | A | 47.1 | Very low | 45.9 | Very low | 96 Ų | 96 | 123 Ų | 123 | 79% | 0.793 | 82% | 0.815 | S | S | * | * | trans | -107.9 | 153.4 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 73 | P | 55.7 | Low | 46 | Very low | 122 Ų | 122 | 121.5 Ų | 121.5 | 79% | 0.792 | 82% | 0.817 | S | S | * | * | trans | -102 | 162.6 | 162.3 | 36.4 | -29.5 | 0 | 0 | 0 | 112.6 | ||||
| 74 | L | 42.5 | Very low | 45.8 | Very low | 178 Ų | 178 | 122.1 Ų | 122.1 | 93% | 0.932 | 82% | 0.824 | S | S | * | * | trans | -101.5 | 163.6 | -178.4 | -63.3 | 163.4 | 0 | 0 | 0 | 111.4 | ||||
| 75 | G | 34.1 | Very low | 45 | Very low | 73 Ų | 73 | 120.3 Ų | 120.3 | 75% | 0.753 | 83% | 0.826 | S | S | * | * | trans | -82.6 | -146.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 76 | P | 57.3 | Low | 45.3 | Very low | 122 Ų | 122 | 120 Ų | 120 | 79% | 0.792 | 83% | 0.825 | S | S | * | * | cis | -135.6 | 179.7 | 1.1 | 43.1 | -27.4 | 0 | 0 | 0 | 115.1 | ||||
| 77 | T | 39 | Very low | 44.9 | Very low | 141 Ų | 141 | 120.6 Ų | 120.6 | 87% | 0.865 | 82% | 0.824 | S | S | * | * | trans | -178.1 | 156.1 | 140.1 | -79 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 78 | F | 42.8 | Very low | 43.5 | Very low | 189 Ų | 189 | 117.9 Ų | 117.9 | 83% | 0.829 | 82% | 0.818 | S | S | * | * | trans | -92 | 178.3 | -171.9 | -88 | -73.7 | 0 | 0 | 0 | 113.2 | ||||
| 79 | P | 50.5 | Low | 42.9 | Very low | 126 Ų | 126 | 118.1 Ų | 118.1 | 82% | 0.818 | 82% | 0.823 | S | S | * | * | cis | -148.8 | 156.3 | 29.4 | 41.8 | -20.2 | 0 | 0 | 0 | 122.1 | ||||
| 80 | G | 36.3 | Very low | 42.6 | Very low | 66 Ų | 66 | 117.9 Ų | 117.9 | 68% | 0.68 | 83% | 0.829 | S | S | * | * | trans | 81.1 | 157.5 | 142.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 81 | L | 40.7 | Very low | 41.9 | Very low | 187 Ų | 187 | 116.8 Ų | 116.8 | 98% | 0.979 | 83% | 0.83 | S | S | * | * | cis | -163 | 144.6 | -21.9 | -161.9 | 77.1 | 0 | 0 | 0 | 108.9 | ||||
| 82 | G | 34.6 | Very low | 41.5 | Very low | 76 Ų | 76 | 115.8 Ų | 115.8 | 78% | 0.784 | 83% | 0.829 | S | S | * | * | trans | 146.6 | 110.9 | 168.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 83 | A | 41.3 | Very low | 41.1 | Very low | 114 Ų | 114 | 114.9 Ų | 114.9 | 94% | 0.942 | 83% | 0.829 | S | S | * | * | trans | -148.1 | 147.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 84 | G | 37.6 | Very low | 40.3 | Very low | 80 Ų | 80 | 120 Ų | 120 | 83% | 0.825 | 83% | 0.834 | S | S | * | * | trans | 169.8 | 143.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 85 | G | 36.4 | Very low | 39.9 | Very low | 80 Ų | 80 | 114.9 Ų | 114.9 | 83% | 0.825 | 82% | 0.824 | S | S | * | * | cis | 159.9 | 80.9 | 0.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 86 | N | 44.3 | Very low | 40.5 | Very low | 166 Ų | 166 | 117.9 Ų | 117.9 | 89% | 0.888 | 83% | 0.828 | S | S | * | * | trans | -95.8 | 113.5 | -171.2 | 175.3 | 95.5 | 0 | 0 | 0 | 112 | ||||
| 87 | S | 39.4 | Very low | 40.1 | Very low | 109 Ų | 109 | 118.2 Ų | 118.2 | 76% | 0.762 | 83% | 0.83 | S | S | * | * | trans | -153.1 | 118.1 | 170.4 | 62.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 88 | G | 35.5 | Very low | 40 | Very low | 63 Ų | 63 | 114.6 Ų | 114.6 | 65% | 0.649 | 82% | 0.821 | S | S | * | * | 79.4 | 117.4 | 118.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 89 | S | 39.1 | Very low | 40.6 | Very low | 135 Ų | 135 | 112.5 Ų | 112.5 | 94% | 0.944 | 83% | 0.826 | S | S | * | * | trans | 74.2 | 155.8 | 144.5 | -53 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 90 | G | 35.8 | Very low | 40 | Very low | 81 Ų | 81 | 110 Ų | 110 | 84% | 0.835 | 82% | 0.823 | S | S | * | * | trans | -139.7 | -176 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 91 | A | 38.8 | Very low | 40.5 | Very low | 106 Ų | 106 | 115.4 Ų | 115.4 | 88% | 0.876 | 84% | 0.836 | S | S | * | * | trans | -146.9 | 157.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 92 | S | 41.6 | Very low | 40.8 | Very low | 122 Ų | 122 | 110.2 Ų | 110.2 | 85% | 0.853 | 82% | 0.82 | S | S | * | * | trans | -80.1 | 147.1 | 173.5 | -62.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 93 | G | 39.7 | Very low | 41.3 | Very low | 76 Ų | 76 | 115.4 Ų | 115.4 | 78% | 0.784 | 82% | 0.823 | S | S | * | * | trans | -144.2 | 128.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 94 | Y | 38.3 | Very low | 41.3 | Very low | 231 Ų | 231 | 113.4 Ų | 113.4 | 91% | 0.906 | 81% | 0.814 | S | S | * | * | trans | -93.5 | 137.9 | -175.5 | -81.1 | -98.7 | 0 | 0 | 0 | 112.5 | ||||
| 95 | G | 35.1 | Very low | 41.7 | Very low | 70 Ų | 70 | 119.2 Ų | 119.2 | 72% | 0.722 | 82% | 0.816 | S | S | * | * | trans | 71.1 | 114.6 | 140.9 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 96 | T | 45.8 | Very low | 42.2 | Very low | 135 Ų | 135 | 121.8 Ų | 121.8 | 83% | 0.828 | 81% | 0.807 | S | S | * | * | -172.9 | 129.8 | 129 | -76 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 97 | P | 48.8 | Very low | 42.6 | Very low | 129 Ų | 129 | 121.7 Ų | 121.7 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | trans | -88.8 | 128.9 | 171 | 33.5 | -30.2 | 0 | 0 | 0 | 111.4 | ||||
| 98 | G | 37.2 | Very low | 42.9 | Very low | 65 Ų | 65 | 121 Ų | 121 | 67% | 0.67 | 80% | 0.804 | S | S | * | * | trans | -136.6 | 130.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111 | G100 | G98-G100 PolarHBondContact O-N 2.82Š| ||
| 99 | P | 55.7 | Low | 43.5 | Very low | 145 Ų | 145 | 126.1 Ų | 126.1 | 94% | 0.942 | 81% | 0.808 | S | S | * | * | trans | -79.9 | 113.9 | -176.8 | 30.7 | -32.9 | 0 | 0 | 0 | 111.3 | ||||
| 100 | G | 38.1 | Very low | 43.8 | Very low | 73 Ų | 73 | 122.6 Ų | 122.6 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | trans | -139.2 | 129.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G98 | G98-G100 PolarHBondContact O-N 2.82Š| ||
| 101 | L | 47.6 | Very low | 44.4 | Very low | 181 Ų | 181 | 129.5 Ų | 129.5 | 95% | 0.948 | 80% | 0.796 | S | S | * | * | trans | -77.3 | 135.2 | 178.6 | -68.7 | 154.6 | 0 | 0 | 0 | 110.9 | ||||
| 102 | A | 45.8 | Very low | 45 | Very low | 78 Ų | 78 | 135.2 Ų | 135.2 | 65% | 0.645 | 79% | 0.794 | S | S | * | * | 156.8 | 168.3 | 126.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 103 | H | 45.8 | Very low | 45.7 | Very low | 184 Ų | 184 | 137.1 Ų | 137.1 | 85% | 0.852 | 78% | 0.783 | S | S | * | * | trans | 59.2 | 84.1 | 167.6 | -61.1 | 99.6 | 0 | 0 | 0 | 117.1 | ||||
| 104 | G | 41.8 | Very low | 46.5 | Very low | 72 Ų | 72 | 137.7 Ų | 137.7 | 74% | 0.742 | 77% | 0.773 | S | S | * | * | trans | -59.1 | 153.1 | 155.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | E106 | G104-E106 PolarHBondContact O-N 3.26Š| ||
| 105 | K | 46 | Very low | 47.5 | Very low | 203 Ų | 203 | 133.7 Ų | 133.7 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | trans | -72.1 | 83.8 | -177.5 | -68.3 | 177.3 | 178 | 175.9 | 0 | 111.6 | M107 | K105-M107 VanDerWaalsContact C-N 3.29Å; K105-M107 PolarHBondContact O-N 2.9Å | ||
| 106 | E | 46.6 | Very low | 49 | Very low | 133 Ų | 133 | 133 Ų | 133 | 62% | 0.621 | 75% | 0.753 | S | S | * | * | trans | -67 | 92.2 | 163 | -173.4 | 173 | 167.2 | 0 | 0 | 109.1 | G104 A108 K109 | G104-E106 PolarHBondContact O-N 3.26Å; E106-A108 PolarHBondContact O-N 3.48Å; E106-K109 WeakPolarHBondContact OE1-CD 3.24Å; E106-K109 WeakPolarHBondContact OE1-CE 3.29Å; E106-K109 IonicContact OE1-NZ 2.63Å; E106-K109 PolarHBondContact OE1-NZ 3.24Å; E106-K109 IonicContact OE2-NZ 3.85Å | ||
| 107 | M | 53.3 | Low | 50.6 | Low | 165 Ų | 165 | 130 Ų | 130 | 81% | 0.813 | 73% | 0.73 | S | S | * | * | trans | -53.8 | 123.8 | 167.4 | -75.5 | -77.7 | -169.3 | 0 | 0 | 108.8 | K105 K109 | K105-M107 VanDerWaalsContact C-N 3.29Å; K105-M107 PolarHBondContact O-N 2.9Å; M107-K109 PolarHBondContact O-N 3.42Å | ||
| 108 | A | 44.8 | Very low | 52.4 | Low | 95 Ų | 95 | 125.8 Ų | 125.8 | 79% | 0.785 | 71% | 0.706 | S | S | * | * | trans | -51.2 | 131.7 | -164.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | E106 G110 | E106-A108 PolarHBondContact O-N 3.48Å; A108-G110 PolarHBondContact O-N 3.04Å | ||
| 109 | K | 48.8 | Very low | 54.8 | Low | 170 Ų | 170 | 128.6 Ų | 128.6 | 74% | 0.739 | 70% | 0.7 | S | S | * | * | trans | -70.2 | 66 | 172.5 | -70.5 | -178.5 | 178.9 | 115.3 | 0 | 111.7 | E106 M107 Y111 | E106-K109 WeakPolarHBondContact OE1-CD 3.24Å; E106-K109 WeakPolarHBondContact OE1-CE 3.29Å; E106-K109 IonicContact OE1-NZ 2.63Å; E106-K109 PolarHBondContact OE1-NZ 3.24Å; E106-K109 IonicContact OE2-NZ 3.85Å; M107-K109 PolarHBondContact O-N 3.42Å; K109-Y111 PolarHBondContact O-N 2.84Å | ||
| 110 | G | 44.7 | Very low | 56.5 | Low | 60 Ų | 60 | 122.3 Ų | 122.3 | 62% | 0.619 | 66% | 0.659 | S | S | * | * | trans | -60.8 | 107 | 172 | 0 | 0 | 0 | 0 | 0 | 111 | A108 R112 | A108-G110 PolarHBondContact O-N 3.04Å; G110-R112 PolarHBondContact O-N 3.22Å | ||
| 111 | Y | 48.4 | Very low | 58.9 | Low | 227 Ų | 227 | 123.4 Ų | 123.4 | 89% | 0.89 | 65% | 0.653 | S | S | * | * | trans | 23.4 | 64.6 | 167.2 | -76.7 | -92.4 | 0 | 0 | 0 | 116.4 | K109 R113 | K109-Y111 PolarHBondContact O-N 2.84Å; Y111-R113 VanDerWaalsContact C-N 3.25Å; Y111-R113 PolarHBondContact O-N 3.18Å | ||
| 112 | R | 51.8 | Low | 61 | Low | 225 Ų | 225 | 118.7 Ų | 118.7 | 85% | 0.849 | 62% | 0.623 | S | S | * | * | trans | -65.3 | 90 | 158.2 | -73 | -73.4 | -174.2 | 139.2 | 2.2 | 108.1 | G110 | G110-R112 PolarHBondContact O-N 3.22Š| ||
| 113 | R | 55.2 | Low | 63.3 | Low | 162 Ų | 162 | 116.7 Ų | 116.7 | 61% | 0.611 | 61% | 0.605 | S | S | * | * | trans | -47.2 | 135.3 | 161 | -69.1 | -164.3 | -61.5 | 131.8 | 6.3 | 107.3 | Y111 L115 H117 | Y111-R113 VanDerWaalsContact C-N 3.25Å; Y111-R113 PolarHBondContact O-N 3.18Å; R113-L115 PolarHBondContact O-N 3.44Å; R113-H117 PolarHBondContact NH1-O 2.89Å; R113-H117 PolarHBondContact NH2-O 3.29Å | ||
| 114 | P | 56.3 | Low | 65.7 | Low | 89 Ų | 89 | 110.9 Ų | 110.9 | 58% | 0.578 | 58% | 0.576 | S | S | * | * | trans | -50.6 | 134.5 | -177.4 | -27.6 | 34.1 | 0 | 0 | 0 | 110.7 | A116 H117 | P114-A116 PolarHBondContact O-N 3.41Å; P114-H117 PolarHBondContact O-N 3.35Å | ||
| 115 | L | 60.9 | Low | 68.2 | Low | 147 Ų | 147 | 109.6 Ų | 109.6 | 77% | 0.77 | 55% | 0.551 | S | S | * | * | G | 310 helix | trans | -57.4 | -22.6 | -168 | -172.4 | 61.2 | 0 | 0 | 0 | 113 | R113 H117 A118 | R113-L115 PolarHBondContact O-N 3.44Å; L115-H117 PolarHBondContact O-N 3.32Å; L115-H117 VanDerWaalsContact O-N 3.17Å; L115-A118 HydrophobicContact CD1-CB 3.96Å; L115-A118 VanDerWaalsContact O-CB 3.31Å; L115-A118 WeakPolarHBondContact O-CB 3.47Å; L115-A118 PolarHBondContact O-N 3.31Å |
| 116 | A | 66.2 | Low | 70.4 | Confident | 54 Ų | 54 | 100 Ų | 100 | 45% | 0.446 | 51% | 0.51 | S | S | . | . | G | 310 helix | trans | -54.8 | -22.5 | 169.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | P114 P154 | P114-A116 PolarHBondContact O-N 3.41Å; A116-P154 HydrophobicContact CB-CG 4.38Å |
| 117 | H | 78.4 | Confident | 72.8 | Confident | 72 Ų | 72 | 93.7 Ų | 93.7 | 33% | 0.333 | 48% | 0.481 | S | S | . | . | G | 310 helix | trans | -102.5 | 9.9 | 176 | -57.5 | -89.7 | 0 | 0 | 0 | 113.5 | R113 P114 L115 | R113-H117 PolarHBondContact NH1-O 2.89Å; R113-H117 PolarHBondContact NH2-O 3.29Å; P114-H117 PolarHBondContact O-N 3.35Å; L115-H117 PolarHBondContact O-N 3.32Å; L115-H117 VanDerWaalsContact O-N 3.17Å |
| 118 | A | 86.2 | Confident | 74.8 | Confident | 42 Ų | 42 | 85.9 Ų | 85.9 | 35% | 0.347 | 44% | 0.442 | S | S | . | . | S | Bend | trans | -81 | 151.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | L115 P120 | L115-A118 HydrophobicContact CD1-CB 3.96Å; L115-A118 VanDerWaalsContact O-CB 3.31Å; L115-A118 WeakPolarHBondContact O-CB 3.47Å; L115-A118 PolarHBondContact O-N 3.31Å; A118-P120 WeakPolarHBondContact O-CD 3.38Å |
| 119 | K | 89.3 | Confident | 77.2 | Confident | 123 Ų | 123 | 81.3 Ų | 81.3 | 54% | 0.535 | 41% | 0.405 | S | S | . | . | P | Polyproline II helix | trans | -65.2 | 124.2 | 173.7 | -178.3 | 174.5 | 177.2 | -179.4 | 0 | 109.6 | Y155 | K119-Y155 HydrophobicContact CB-CD1 4.13Å; K119-Y155 HydrophobicContact CB-CD2 4.32Å; K119-Y155 HydrophobicContact CB-CE1 3.74Å; K119-Y155 HydrophobicContact CB-CE2 3.96Å; K119-Y155 HydrophobicContact CB-CG 4.41Å; K119-Y155 HydrophobicContact CD-CE1 4.1Å; K119-Y155 HydrophobicContact CG-CD1 4.16Å; K119-Y155 HydrophobicContact CG-CE1 3.61Å |
| 120 | P | 90.1 | Very high | 79.4 | Confident | 14 Ų | 14 | 74.4 Ų | 74.4 | 9% | 0.091 | 38% | 0.375 | C | S | . | . | P | Polyproline II helix | trans | -61.3 | 149.3 | 178.5 | -24 | 34.6 | 0 | 0 | 0 | 112.4 | A118 Y122 F153 Y156 | A118-P120 WeakPolarHBondContact O-CD 3.38Å; P120-Y122 HydrophobicContact CB-CD2 3.77Å; P120-Y122 HydrophobicContact CB-CE2 4.45Å; P120-Y122 PolarHBondContact O-N 3.02Å; P120-F153 HydrophobicContact CB-CD1 3.96Å; P120-F153 HydrophobicContact CB-CE1 4.01Å; P120-F153 HydrophobicContact CB-CG 4.42Å; P120-F153 HydrophobicContact CG-CB 3.85Å; P120-F153 HydrophobicContact CG-CD1 3.36Å; P120-F153 HydrophobicContact CG-CD2 4.36Å; P120-F153 HydrophobicContact CG-CE1 3.94Å; P120-F153 HydrophobicContact CG-CG 3.6Å; P120-Y156 HydrophobicContact CG-CE2 3.99Å |
| 121 | P | 89.4 | Confident | 81.8 | Confident | 96 Ų | 96 | 71.6 Ų | 71.6 | 62% | 0.623 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -75 | 22.9 | -180 | 33.2 | -37.2 | 0 | 0 | 0 | 113.9 | L209 | P121-L209 HydrophobicContact CB-CD2 4.43Š|
| 122 | Y | 91.6 | Very high | 84.1 | Confident | 81 Ų | 81 | 60.8 Ų | 60.8 | 32% | 0.318 | 30% | 0.304 | S | S | . | . | trans | -104.2 | 146.4 | -173.9 | -61.5 | -55.8 | 0 | 0 | 0 | 111.9 | P120 L127 M130 F153 | P120-Y122 HydrophobicContact CB-CD2 3.77Å; P120-Y122 HydrophobicContact CB-CE2 4.45Å; P120-Y122 PolarHBondContact O-N 3.02Å; Y122-L127 HydrophobicContact CD2-CD2 4.32Å; Y122-L127 HydrophobicContact CG-CD2 4.49Å; Y122-M130 HydrophobicContact CD1-CE 4.26Å; Y122-M130 HydrophobicContact CD2-CE 4.01Å; Y122-M130 HydrophobicContact CE2-CE 4.35Å; Y122-M130 HydrophobicContact CG-CE 3.98Å; Y122-F153 HydrophobicContact CD2-CE1 4.19Å; Y122-F153 HydrophobicContact CD2-CE2 4.37Å; Y122-F153 AromaticContact CD2-CZ 3.7Å; Y122-F153 HydrophobicContact CD2-CZ 3.7Å; Y122-F153 HydrophobicContact CE2-CE1 4.04Å; Y122-F153 AromaticContact CE2-CZ 3.69Å; Y122-F153 HydrophobicContact CE2-CZ 3.69Å | ||
| 123 | S | 93.8 | Very high | 86 | Confident | 36 Ų | 36 | 52.5 Ų | 52.5 | 25% | 0.252 | 28% | 0.275 | S | S | . | . | trans | -80.4 | 159.7 | 170.2 | 82.7 | 0 | 0 | 0 | 0 | 110.6 | I125 S126 L127 | S123-I125 PolarHBondContact O-N 3.38Å; S123-I125 PolarHBondContact OG-N 3.28Å; S123-S126 PolarHBondContact N-OG 2.67Å; S123-S126 WeakPolarHBondContact O-CA 3.41Å; S123-S126 VanDerWaalsContact O-CB 3.3Å; S123-S126 WeakPolarHBondContact O-CB 3.3Å; S123-S126 PolarHBondContact O-N 2.94Å; S123-S126 PolarHBondContact OG-N 2.92Å; S123-S126 VanDerWaalsContact OG-N 3.12Å; S123-S126 PolarHBondContact OG-OG 2.89Å; S123-L127 WeakPolarHBondContact O-CG 3.46Å; S123-L127 PolarHBondContact O-N 2.74Å | ||
| 124 | Y | 95.9 | Very high | 87.9 | Confident | 63 Ų | 63 | 51.1 Ų | 51.1 | 25% | 0.247 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -58.2 | -34.9 | 174.4 | -64.4 | -57.4 | 0 | 0 | 0 | 112.6 | L127 I128 Y156 W163 I167 S170 | Y124-L127 HydrophobicContact CD1-CD1 4.21Å; Y124-L127 PolarHBondContact O-N 2.82Å; Y124-I128 VanDerWaalsContact O-CD1 3.3Å; Y124-I128 WeakPolarHBondContact O-CD1 3.43Å; Y124-I128 WeakPolarHBondContact O-CG1 3.48Å; Y124-I128 PolarHBondContact O-N 2.72Å; Y124-Y156 HydrophobicContact CE1-CE1 4.17Å; Y124-W163 HydrophobicContact CE1-CB 4.29Å; Y124-I167 HydrophobicContact CD1-CD1 3.8Å; Y124-I167 HydrophobicContact CD1-CG1 4.35Å; Y124-I167 HydrophobicContact CG-CD1 4.33Å; Y124-S170 WeakPolarHBondContact CB-OG 3.4Å |
| 125 | I | 94.3 | Very high | 89.7 | Confident | 44 Ų | 44 | 47.3 Ų | 47.3 | 23% | 0.226 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.1 | -49.8 | 172.5 | -57.2 | 173.8 | 0 | 0 | 0 | 109.3 | S123 L127 I128 T129 N174 F177 F203 | S123-I125 PolarHBondContact O-N 3.38Å; S123-I125 PolarHBondContact OG-N 3.28Å; I125-L127 VanDerWaalsContact C-N 3.35Å; I125-L127 PolarHBondContact O-N 3.19Å; I125-I128 PolarHBondContact O-N 3.39Å; I125-T129 WeakPolarHBondContact O-CB 3.17Å; I125-T129 PolarHBondContact O-N 3.12Å; I125-T129 PolarHBondContact O-OG1 2.73Å; I125-N174 WeakPolarHBondContact CD1-OD1 3.45Å; I125-F177 HydrophobicContact CB-CE2 4.38Å; I125-F177 HydrophobicContact CB-CZ 4.37Å; I125-F177 HydrophobicContact CG1-CE2 4.4Å; I125-F177 HydrophobicContact CG2-CE2 3.98Å; I125-F177 HydrophobicContact CG2-CZ 3.76Å; I125-F203 HydrophobicContact CG2-CE1 4.06Å; I125-F203 HydrophobicContact CG2-CZ 3.85Å |
| 126 | S | 93.1 | Very high | 91.2 | Very high | 3 Ų | 3 | 46.6 Ų | 46.6 | 2% | 0.021 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.3 | -44 | 178.9 | -38.4 | 0 | 0 | 0 | 0 | 112.5 | S123 T129 M130 Y208 | S123-S126 PolarHBondContact N-OG 2.67Å; S123-S126 WeakPolarHBondContact O-CA 3.41Å; S123-S126 VanDerWaalsContact O-CB 3.3Å; S123-S126 WeakPolarHBondContact O-CB 3.3Å; S123-S126 PolarHBondContact O-N 2.94Å; S123-S126 PolarHBondContact OG-N 2.92Å; S123-S126 VanDerWaalsContact OG-N 3.12Å; S123-S126 PolarHBondContact OG-OG 2.89Å; S126-T129 PolarHBondContact O-N 3.14Å; S126-M130 WeakPolarHBondContact O-CE 3.35Å; S126-M130 WeakPolarHBondContact O-CG 3.39Å; S126-M130 PolarHBondContact O-N 3.31Å; S126-Y208 WeakPolarHBondContact CB-O 3.46Å; S126-Y208 PolarHBondContact OG-O 2.97Å |
| 127 | L | 95.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.3 | -47.6 | 178.5 | -68 | 173 | 0 | 0 | 0 | 111.8 | Y122 S123 Y124 I125 M130 A131 W148 I149 F153 Y156 | Y122-L127 HydrophobicContact CD2-CD2 4.32Å; Y122-L127 HydrophobicContact CG-CD2 4.49Å; S123-L127 WeakPolarHBondContact O-CG 3.46Å; S123-L127 PolarHBondContact O-N 2.74Å; Y124-L127 HydrophobicContact CD1-CD1 4.21Å; Y124-L127 PolarHBondContact O-N 2.82Å; I125-L127 VanDerWaalsContact C-N 3.35Å; I125-L127 PolarHBondContact O-N 3.19Å; L127-M130 HydrophobicContact CD2-CE 4.02Å; L127-A131 PolarHBondContact O-N 3.34Å; L127-A131 VanDerWaalsContact O-N 3.16Å; L127-W148 WeakPolarHBondContact O-CZ3 3.39Å; L127-I149 HydrophobicContact CB-CD1 3.93Å; L127-I149 HydrophobicContact CB-CG1 4.24Å; L127-I149 HydrophobicContact CD1-CD1 4.49Å; L127-F153 HydrophobicContact CD2-CD2 3.69Å; L127-F153 HydrophobicContact CD2-CE2 3.34Å; L127-F153 HydrophobicContact CD2-CZ 4.21Å; L127-Y156 HydrophobicContact CD1-CE2 3.89Å |
| 128 | I | 96.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 177 | -64.2 | 159.8 | 0 | 0 | 0 | 110.5 | Y124 I125 A131 I132 I145 I167 L171 F177 | Y124-I128 VanDerWaalsContact O-CD1 3.3Å; Y124-I128 WeakPolarHBondContact O-CD1 3.43Å; Y124-I128 WeakPolarHBondContact O-CG1 3.48Å; Y124-I128 PolarHBondContact O-N 2.72Å; I125-I128 PolarHBondContact O-N 3.39Å; I128-A131 PolarHBondContact O-N 3Å; I128-I132 HydrophobicContact CG2-CD1 3.68Å; I128-I132 HydrophobicContact CG2-CG1 4.38Å; I128-I132 WeakPolarHBondContact O-CG1 3.46Å; I128-I132 PolarHBondContact O-N 3.34Å; I128-I145 HydrophobicContact CG1-CG2 4.1Å; I128-I145 HydrophobicContact CG2-CD1 4.3Å; I128-I167 HydrophobicContact CD1-CD1 4.02Å; I128-I167 HydrophobicContact CD1-CG2 4.25Å; I128-I167 HydrophobicContact CG1-CD1 3.87Å; I128-I167 HydrophobicContact CG1-CG2 4.36Å; I128-L171 HydrophobicContact CD1-CD2 4.05Å; I128-L171 HydrophobicContact CD1-CG 3.99Å; I128-L171 HydrophobicContact CG2-CD2 3.67Å; I128-F177 HydrophobicContact CB-CE1 3.95Å; I128-F177 HydrophobicContact CB-CE2 4.34Å; I128-F177 HydrophobicContact CB-CZ 3.68Å; I128-F177 HydrophobicContact CD1-CE2 4.06Å; I128-F177 HydrophobicContact CD1-CZ 4.26Å; I128-F177 HydrophobicContact CG2-CD1 3.81Å; I128-F177 HydrophobicContact CG2-CE1 3.34Å; I128-F177 HydrophobicContact CG2-CE2 4.19Å; I128-F177 HydrophobicContact CG2-CG 4.42Å; I128-F177 HydrophobicContact CG2-CZ 3.56Å |
| 129 | T | 94.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 50.2 Ų | 50.2 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.4 | -48.2 | 179.3 | -66.8 | 0 | 0 | 0 | 0 | 111.9 | I125 S126 A131 I132 Q133 L195 F203 Y208 | I125-T129 WeakPolarHBondContact O-CB 3.17Å; I125-T129 PolarHBondContact O-N 3.12Å; I125-T129 PolarHBondContact O-OG1 2.73Å; S126-T129 PolarHBondContact O-N 3.14Å; T129-A131 VanDerWaalsContact C-N 3.35Å; T129-A131 PolarHBondContact O-N 3.19Å; T129-I132 PolarHBondContact O-N 3.12Å; T129-Q133 HydrophobicContact CG2-CG 4.29Å; T129-Q133 WeakPolarHBondContact O-CB 3.17Å; T129-Q133 VanDerWaalsContact O-CG 3.3Å; T129-Q133 WeakPolarHBondContact O-CG 3.48Å; T129-Q133 PolarHBondContact O-N 3.49Å; T129-Q133 PolarHBondContact O-OE1 3.31Å; T129-L195 HydrophobicContact CG2-CD1 4Å; T129-L195 HydrophobicContact CG2-CD2 4.16Å; T129-F203 HydrophobicContact CG2-CB 3.74Å; T129-F203 HydrophobicContact CG2-CD1 3.91Å; T129-F203 HydrophobicContact CG2-CD2 3.81Å; T129-F203 HydrophobicContact CG2-CE1 4.42Å; T129-F203 HydrophobicContact CG2-CE2 4.34Å; T129-F203 HydrophobicContact CG2-CG 3.56Å; T129-Y208 HydrophobicContact CG2-CE1 4.3Å |
| 130 | M | 94.7 | Very high | 94.1 | Very high | 25 Ų | 25 | 45.4 Ų | 45.4 | 12% | 0.123 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62 | -41.1 | 178.6 | -70.6 | -177.4 | -64.5 | 0 | 0 | 112 | Y122 S126 L127 Q133 Q134 W148 F153 Y208 | Y122-M130 HydrophobicContact CD1-CE 4.26Å; Y122-M130 HydrophobicContact CD2-CE 4.01Å; Y122-M130 HydrophobicContact CE2-CE 4.35Å; Y122-M130 HydrophobicContact CG-CE 3.98Å; S126-M130 WeakPolarHBondContact O-CE 3.35Å; S126-M130 WeakPolarHBondContact O-CG 3.39Å; S126-M130 PolarHBondContact O-N 3.31Å; L127-M130 HydrophobicContact CD2-CE 4.02Å; M130-Q133 PolarHBondContact O-N 3.45Å; M130-Q134 WeakPolarHBondContact O-CG 3.46Å; M130-Q134 PolarHBondContact O-N 2.87Å; M130-W148 HydrophobicContact CB-CH2 3.4Å; M130-W148 VanDerWaalsContact CB-CH2 3.4Å; M130-W148 HydrophobicContact CB-CZ2 3.93Å; M130-W148 HydrophobicContact CB-CZ3 4.22Å; M130-W148 HydrophobicContact CE-CH2 4.27Å; M130-F153 HydrophobicContact CE-CE2 4.5Å; M130-Y208 HydrophobicContact CG-CD1 3.7Å; M130-Y208 HydrophobicContact CG-CE1 3.64Å; M130-Y208 HydrophobicContact SD-CD1 4.14Å; M130-Y208 HydrophobicContact SD-CG 4.41Å |
| 131 | A | 96.3 | Very high | 94.4 | Very high | 1 Ų | 1 | 45.3 Ų | 45.3 | 1% | 0.008 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.5 | -49.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | L127 I128 T129 Q133 Q134 A135 L140 W148 | L127-A131 PolarHBondContact O-N 3.34Å; L127-A131 VanDerWaalsContact O-N 3.16Å; I128-A131 PolarHBondContact O-N 3Å; T129-A131 VanDerWaalsContact C-N 3.35Å; T129-A131 PolarHBondContact O-N 3.19Å; A131-Q133 VanDerWaalsContact C-N 3.33Å; A131-Q133 PolarHBondContact O-N 3.45Å; A131-Q134 PolarHBondContact O-N 3.45Å; A131-A135 PolarHBondContact O-N 3.36Å; A131-A135 VanDerWaalsContact O-N 3.09Å; A131-L140 HydrophobicContact CB-CD1 3.73Å; A131-L140 WeakPolarHBondContact O-CD1 3.1Å; A131-W148 HydrophobicContact CB-CB 4.31Å; A131-W148 HydrophobicContact CB-CD2 3.54Å; A131-W148 HydrophobicContact CB-CE3 3.53Å; A131-W148 HydrophobicContact CB-CG 3.89Å; A131-W148 HydrophobicContact CB-CZ3 4.09Å |
| 132 | I | 95.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.7 | -35.5 | 179.5 | -66.5 | 173.7 | 0 | 0 | 0 | 111.5 | I128 T129 K138 L140 F177 W193 L195 | I128-I132 HydrophobicContact CG2-CD1 3.68Å; I128-I132 HydrophobicContact CG2-CG1 4.38Å; I128-I132 WeakPolarHBondContact O-CG1 3.46Å; I128-I132 PolarHBondContact O-N 3.34Å; T129-I132 PolarHBondContact O-N 3.12Å; I132-K138 WeakPolarHBondContact CG2-O 3.42Å; I132-K138 WeakPolarHBondContact O-CA 3.22Å; I132-L140 HydrophobicContact CG1-CB 4.44Å; I132-F177 HydrophobicContact CD1-CD1 4.15Å; I132-F177 HydrophobicContact CD1-CE1 4.37Å; I132-W193 HydrophobicContact CD1-CB 4.42Å; I132-L195 HydrophobicContact CB-CD1 4.32Å; I132-L195 HydrophobicContact CB-CG 4.38Å; I132-L195 HydrophobicContact CG2-CD1 3.97Å; I132-L195 HydrophobicContact CG2-CG 3.91Å |
| 133 | Q | 93 | Very high | 95.1 | Very high | 51 Ų | 51 | 42.7 Ų | 42.7 | 24% | 0.238 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -69.1 | -36.5 | 176.5 | -77 | 171.6 | -42.9 | 0 | 0 | 113 | T129 M130 A131 K138 L195 Y208 | T129-Q133 HydrophobicContact CG2-CG 4.29Å; T129-Q133 WeakPolarHBondContact O-CB 3.17Å; T129-Q133 VanDerWaalsContact O-CG 3.3Å; T129-Q133 WeakPolarHBondContact O-CG 3.48Å; T129-Q133 PolarHBondContact O-N 3.49Å; T129-Q133 PolarHBondContact O-OE1 3.31Å; M130-Q133 PolarHBondContact O-N 3.45Å; A131-Q133 VanDerWaalsContact C-N 3.33Å; A131-Q133 PolarHBondContact O-N 3.45Å; Q133-K138 PolarHBondContact O-NZ 2.94Å; Q133-L195 HydrophobicContact CG-CD1 3.85Å; Q133-Y208 PolarHBondContact NE2-OH 3.06Å; Q133-Y208 PolarHBondContact OE1-OH 3.09Å; Q133-Y208 VanDerWaalsContact OE1-OH 3.12Å |
| 134 | Q | 93.6 | Very high | 95.2 | Very high | 133 Ų | 133 | 45 Ų | 45 | 62% | 0.621 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -76.6 | -23.7 | 176.7 | -72.4 | -172.1 | -5.4 | 0 | 0 | 113.3 | M130 A131 | M130-Q134 WeakPolarHBondContact O-CG 3.46Å; M130-Q134 PolarHBondContact O-N 2.87Å; A131-Q134 PolarHBondContact O-N 3.45Å |
| 135 | A | 94.6 | Very high | 95.3 | Very high | 9 Ų | 9 | 42 Ų | 42 | 7% | 0.074 | 23% | 0.233 | C | C | . | . | S | Bend | trans | -62.7 | 133.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | A131 G137 K138 L140 | A131-A135 PolarHBondContact O-N 3.36Å; A131-A135 VanDerWaalsContact O-N 3.09Å; A135-G137 VanDerWaalsContact C-N 3.33Å; A135-G137 PolarHBondContact O-N 3.02Å; A135-K138 PolarHBondContact O-N 3.03Å; A135-K138 VanDerWaalsContact O-N 3.08Å; A135-L140 HydrophobicContact CB-CD1 4.24Å; A135-L140 HydrophobicContact CB-CD2 3.57Å; A135-L140 HydrophobicContact CB-CG 3.69Å |
| 136 | P | 93.3 | Very high | 95.5 | Very high | 131 Ų | 131 | 41.3 Ų | 41.3 | 85% | 0.851 | 23% | 0.228 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -39.6 | -177.1 | 23.2 | -32.8 | 0 | 0 | 0 | 112.2 | K138 | P136-K138 VanDerWaalsContact C-N 3.27Å; P136-K138 PolarHBondContact O-N 3.08Å |
| 137 | G | 93.1 | Very high | 95.7 | Very high | 48 Ų | 48 | 45.7 Ų | 45.7 | 50% | 0.495 | 25% | 0.248 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -80.3 | 6.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | A135 M139 | A135-G137 VanDerWaalsContact C-N 3.33Å; A135-G137 PolarHBondContact O-N 3.02Å; G137-M139 WeakPolarHBondContact O-CE 3.37Å; G137-M139 PolarHBondContact O-N 3.36Å |
| 138 | K | 94.5 | Very high | 95.8 | Very high | 126 Ų | 126 | 47.6 Ų | 47.6 | 55% | 0.548 | 26% | 0.256 | S | S | . | . | S | Bend | trans | 50.9 | 28 | -177.2 | -51.2 | -62.2 | 167.8 | -178.7 | 0 | 114.9 | I132 Q133 A135 P136 | I132-K138 WeakPolarHBondContact CG2-O 3.42Å; I132-K138 WeakPolarHBondContact O-CA 3.22Å; Q133-K138 PolarHBondContact O-NZ 2.94Å; A135-K138 PolarHBondContact O-N 3.03Å; A135-K138 VanDerWaalsContact O-N 3.08Å; P136-K138 VanDerWaalsContact C-N 3.27Å; P136-K138 PolarHBondContact O-N 3.08Å |
| 139 | M | 95.1 | Very high | 95.8 | Very high | 71 Ų | 71 | 47.6 Ų | 47.6 | 35% | 0.35 | 26% | 0.256 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.4 | 149.3 | 175.2 | 70.3 | -175.7 | 78.7 | 0 | 0 | 109.9 | G137 Y192 W193 A194 | G137-M139 WeakPolarHBondContact O-CE 3.37Å; G137-M139 PolarHBondContact O-N 3.36Å; M139-Y192 HydrophobicContact CG-CD1 4.05Å; M139-Y192 HydrophobicContact CG-CG 4.22Å; M139-Y192 HydrophobicContact SD-CD1 4.27Å; M139-Y192 HydrophobicContact SD-CD2 4.26Å; M139-Y192 HydrophobicContact SD-CG 3.91Å; M139-W193 CarbonylContact C-O 3.55Å; M139-W193 VanDerWaalsContact CA-O 3.22Å; M139-W193 WeakPolarHBondContact CA-O 3.36Å; M139-A194 HydrophobicContact CB-CB 3.96Å |
| 140 | L | 97.1 | Very high | 95.9 | Very high | 22 Ų | 22 | 48.3 Ų | 48.3 | 12% | 0.115 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.2 | 150.7 | 176.4 | -72.2 | 179.9 | 0 | 0 | 0 | 111.3 | A131 I132 A135 E144 I145 W193 | A131-L140 HydrophobicContact CB-CD1 3.73Å; A131-L140 WeakPolarHBondContact O-CD1 3.1Å; I132-L140 HydrophobicContact CG1-CB 4.44Å; A135-L140 HydrophobicContact CB-CD1 4.24Å; A135-L140 HydrophobicContact CB-CD2 3.57Å; A135-L140 HydrophobicContact CB-CG 3.69Å; L140-E144 HydrophobicContact CB-CB 4.34Å; L140-E144 HydrophobicContact CD2-CB 3.9Å; L140-E144 HydrophobicContact CG-CB 4.5Å; L140-I145 HydrophobicContact CB-CD1 4.25Å; L140-I145 HydrophobicContact CB-CG1 3.79Å; L140-I145 HydrophobicContact CD1-CG1 4.09Å; L140-W193 PolarHBondContact N-O 3.47Å; L140-W193 PolarHBondContact O-N 2.76Å |
| 141 | T | 97.4 | Very high | 95.9 | Very high | 11 Ų | 11 | 52.2 Ų | 52.2 | 7% | 0.067 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.7 | 162.2 | 166.5 | 70.4 | 0 | 0 | 0 | 0 | 111 | S143 E144 I145 Y192 | T141-S143 PolarHBondContact O-N 3.3Å; T141-S143 VanDerWaalsContact O-N 3.13Å; T141-S143 PolarHBondContact OG1-N 3.05Å; T141-E144 WeakPolarHBondContact CA-OE2 3.22Å; T141-E144 WeakPolarHBondContact CB-OE2 3.49Å; T141-E144 WeakPolarHBondContact CG2-OE2 3.35Å; T141-E144 PolarHBondContact N-OE2 2.58Å; T141-E144 PolarHBondContact O-N 2.9Å; T141-E144 PolarHBondContact OG1-N 2.91Å; T141-E144 PolarHBondContact OG1-OE2 3.29Å; T141-I145 WeakPolarHBondContact O-CG1 3.3Å; T141-I145 PolarHBondContact O-N 3.26Å; T141-I145 VanDerWaalsContact O-N 3.14Å; T141-Y192 HydrophobicContact CG2-CD1 3.71Å; T141-Y192 HydrophobicContact CG2-CE1 3.59Å; T141-Y192 HydrophobicContact CG2-CG 4.48Å |
| 142 | L | 97.3 | Very high | 95.9 | Very high | 50 Ų | 50 | 56.4 Ų | 56.4 | 26% | 0.262 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -54.4 | -30.4 | 172.5 | -179.3 | 62.9 | 0 | 0 | 0 | 113.2 | Y146 I167 R168 L171 | L142-Y146 HydrophobicContact CD1-CD1 4.4Å; L142-Y146 HydrophobicContact CD1-CE1 3.56Å; L142-Y146 HydrophobicContact CG-CE1 4.02Å; L142-Y146 HydrophobicContact CG-CE2 4.13Å; L142-Y146 WeakPolarHBondContact O-CD1 3.48Å; L142-Y146 VanDerWaalsContact O-CG 3.31Å; L142-Y146 PolarHBondContact O-N 3.26Å; L142-I167 HydrophobicContact CD1-CG2 4.15Å; L142-R168 HydrophobicContact CD1-CG 3.95Å; L142-R168 HydrophobicContact CD2-CG 3.92Å; L142-L171 HydrophobicContact CD1-CD1 3.62Å |
| 143 | S | 97.3 | Very high | 95.8 | Very high | 73 Ų | 73 | 58 Ų | 58 | 51% | 0.51 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -75.7 | -42.8 | -178.9 | -162.9 | 0 | 0 | 0 | 0 | 112 | T141 I145 Y146 Q147 | T141-S143 PolarHBondContact O-N 3.3Å; T141-S143 VanDerWaalsContact O-N 3.13Å; T141-S143 PolarHBondContact OG1-N 3.05Å; S143-I145 VanDerWaalsContact C-N 3.34Å; S143-Y146 WeakPolarHBondContact O-CB 3.46Å; S143-Y146 PolarHBondContact O-N 2.72Å; S143-Q147 PolarHBondContact O-N 2.91Å |
| 144 | E | 97.3 | Very high | 95.9 | Very high | 84 Ų | 84 | 56.8 Ų | 56.8 | 39% | 0.393 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -68.1 | -36 | 178.7 | -66.9 | 147.2 | 143.2 | 0 | 0 | 111.1 | L140 T141 Y146 Q147 W148 | L140-E144 HydrophobicContact CB-CB 4.34Å; L140-E144 HydrophobicContact CD2-CB 3.9Å; L140-E144 HydrophobicContact CG-CB 4.5Å; T141-E144 WeakPolarHBondContact CA-OE2 3.22Å; T141-E144 WeakPolarHBondContact CB-OE2 3.49Å; T141-E144 WeakPolarHBondContact CG2-OE2 3.35Å; T141-E144 PolarHBondContact N-OE2 2.58Å; T141-E144 PolarHBondContact O-N 2.9Å; T141-E144 PolarHBondContact OG1-N 2.91Å; T141-E144 PolarHBondContact OG1-OE2 3.29Å; E144-Y146 VanDerWaalsContact C-N 3.28Å; E144-Y146 PolarHBondContact O-N 3.01Å; E144-Q147 PolarHBondContact O-N 2.82Å; E144-W148 WeakPolarHBondContact O-CB 3.42Å; E144-W148 PolarHBondContact O-N 3.05Å |
| 145 | I | 97.8 | Very high | 95.9 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -59.2 | -38.8 | 172.1 | -66.9 | 165.1 | 0 | 0 | 0 | 111.2 | I128 L140 T141 S143 I149 I167 L171 W193 | I128-I145 HydrophobicContact CG1-CG2 4.1Å; I128-I145 HydrophobicContact CG2-CD1 4.3Å; L140-I145 HydrophobicContact CB-CD1 4.25Å; L140-I145 HydrophobicContact CB-CG1 3.79Å; L140-I145 HydrophobicContact CD1-CG1 4.09Å; T141-I145 WeakPolarHBondContact O-CG1 3.3Å; T141-I145 PolarHBondContact O-N 3.26Å; T141-I145 VanDerWaalsContact O-N 3.14Å; S143-I145 VanDerWaalsContact C-N 3.34Å; I145-I149 HydrophobicContact CG2-CD1 4.01Å; I145-I149 WeakPolarHBondContact O-CD1 3.2Å; I145-I149 VanDerWaalsContact O-CG1 3.23Å; I145-I149 WeakPolarHBondContact O-CG1 3.3Å; I145-I149 PolarHBondContact O-N 2.6Å; I145-I167 HydrophobicContact CG2-CG2 3.97Å; I145-L171 HydrophobicContact CD1-CD1 4.32Å; I145-L171 HydrophobicContact CD1-CD2 4.3Å; I145-W193 HydrophobicContact CD1-CB 4.38Å |
| 146 | Y | 97.7 | Very high | 95.9 | Very high | 29 Ų | 29 | 54.5 Ų | 54.5 | 11% | 0.114 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.4 | -45.2 | 175.7 | -61.7 | -22.6 | 0 | 0 | 0 | 111.9 | L142 S143 E144 M150 W163 Q164 I167 R168 | L142-Y146 HydrophobicContact CD1-CD1 4.4Å; L142-Y146 HydrophobicContact CD1-CE1 3.56Å; L142-Y146 HydrophobicContact CG-CE1 4.02Å; L142-Y146 HydrophobicContact CG-CE2 4.13Å; L142-Y146 WeakPolarHBondContact O-CD1 3.48Å; L142-Y146 VanDerWaalsContact O-CG 3.31Å; L142-Y146 PolarHBondContact O-N 3.26Å; S143-Y146 WeakPolarHBondContact O-CB 3.46Å; S143-Y146 PolarHBondContact O-N 2.72Å; E144-Y146 VanDerWaalsContact C-N 3.28Å; E144-Y146 PolarHBondContact O-N 3.01Å; Y146-M150 WeakPolarHBondContact O-CG 3.37Å; Y146-M150 PolarHBondContact O-N 3.39Å; Y146-M150 VanDerWaalsContact O-N 3.14Å; Y146-W163 HydrophobicContact CD1-CH2 4.26Å; Y146-W163 AromaticContact CD1-CZ3 3.94Å; Y146-W163 HydrophobicContact CD1-CZ3 3.94Å; Y146-W163 HydrophobicContact CG-CH2 4.4Å; Y146-Q164 HydrophobicContact CD1-CB 4.35Å; Y146-Q164 HydrophobicContact CD1-CG 3.78Å; Y146-Q164 HydrophobicContact CD2-CG 4.22Å; Y146-Q164 HydrophobicContact CE1-CB 3.72Å; Y146-Q164 HydrophobicContact CE1-CG 3.65Å; Y146-Q164 HydrophobicContact CE2-CB 4.43Å; Y146-Q164 HydrophobicContact CE2-CG 4.11Å; Y146-Q164 HydrophobicContact CG-CG 4.06Å; Y146-I167 HydrophobicContact CD1-CG2 4.3Å; Y146-I167 HydrophobicContact CE1-CB 4.25Å; Y146-I167 HydrophobicContact CE1-CG2 3.95Å; Y146-R168 WeakPolarHBondContact OH-CG 3.4Å; Y146-R168 PolarHBondContact OH-NH1 3.24Å |
| 147 | Q | 97.8 | Very high | 96 | Very high | 96 Ų | 96 | 54.2 Ų | 54.2 | 45% | 0.449 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -64.3 | -52.9 | -178.7 | -59.8 | -59.6 | -5.9 | 0 | 0 | 110.9 | S143 E144 I149 M150 D151 | S143-Q147 PolarHBondContact O-N 2.91Å; E144-Q147 PolarHBondContact O-N 2.82Å; Q147-I149 PolarHBondContact O-N 2.94Å; Q147-I149 VanDerWaalsContact O-N 3.09Å; Q147-M150 CarbonylContact O-C 3.54Å; Q147-M150 WeakPolarHBondContact O-CA 3.37Å; Q147-M150 PolarHBondContact O-N 3.42Å; Q147-D151 PolarHBondContact O-N 3.29Å; Q147-D151 VanDerWaalsContact O-OD2 3.12Å |
| 148 | W | 97.5 | Very high | 96 | Very high | 39 Ų | 39 | 57.4 Ų | 57.4 | 15% | 0.148 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -53 | -39.1 | 179.6 | -176.7 | 95.9 | 0 | 0 | 0 | 113 | L127 M130 A131 E144 L152 F153 | L127-W148 WeakPolarHBondContact O-CZ3 3.39Å; M130-W148 HydrophobicContact CB-CH2 3.4Å; M130-W148 VanDerWaalsContact CB-CH2 3.4Å; M130-W148 HydrophobicContact CB-CZ2 3.93Å; M130-W148 HydrophobicContact CB-CZ3 4.22Å; M130-W148 HydrophobicContact CE-CH2 4.27Å; A131-W148 HydrophobicContact CB-CB 4.31Å; A131-W148 HydrophobicContact CB-CD2 3.54Å; A131-W148 HydrophobicContact CB-CE3 3.53Å; A131-W148 HydrophobicContact CB-CG 3.89Å; A131-W148 HydrophobicContact CB-CZ3 4.09Å; E144-W148 WeakPolarHBondContact O-CB 3.42Å; E144-W148 PolarHBondContact O-N 3.05Å; W148-L152 HydrophobicContact CH2-CD2 3.4Å; W148-L152 VanDerWaalsContact CH2-CD2 3.4Å; W148-L152 HydrophobicContact CZ2-CD2 3.49Å; W148-L152 VanDerWaalsContact CZ2-CD2 3.49Å; W148-L152 HydrophobicContact CZ3-CD2 4.03Å; W148-L152 WeakPolarHBondContact O-CB 3.16Å; W148-L152 PolarHBondContact O-N 3.42Å; W148-L152 VanDerWaalsContact O-N 3.1Å; W148-F153 HydrophobicContact CH2-CE2 4.46Å; W148-F153 HydrophobicContact CZ3-CE2 4.29Å |
| 149 | I | 97.1 | Very high | 95.9 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -68 | -41.7 | 175.6 | -68.1 | 173.8 | 0 | 0 | 0 | 111.6 | L127 I145 Q147 F153 Y156 W163 I167 | L127-I149 HydrophobicContact CB-CD1 3.93Å; L127-I149 HydrophobicContact CB-CG1 4.24Å; L127-I149 HydrophobicContact CD1-CD1 4.49Å; I145-I149 HydrophobicContact CG2-CD1 4.01Å; I145-I149 WeakPolarHBondContact O-CD1 3.2Å; I145-I149 VanDerWaalsContact O-CG1 3.23Å; I145-I149 WeakPolarHBondContact O-CG1 3.3Å; I145-I149 PolarHBondContact O-N 2.6Å; Q147-I149 PolarHBondContact O-N 2.94Å; Q147-I149 VanDerWaalsContact O-N 3.09Å; I149-F153 WeakPolarHBondContact O-CA 3.41Å; I149-F153 WeakPolarHBondContact O-CB 3.21Å; I149-F153 PolarHBondContact O-N 2.99Å; I149-Y156 HydrophobicContact CG2-CD1 4.5Å; I149-Y156 HydrophobicContact CG2-CD2 3.49Å; I149-Y156 VanDerWaalsContact CG2-CD2 3.49Å; I149-Y156 HydrophobicContact CG2-CE2 4.13Å; I149-Y156 HydrophobicContact CG2-CG 3.7Å; I149-W163 HydrophobicContact CG2-CZ3 4.34Å; I149-I167 HydrophobicContact CD1-CD1 3.58Å; I149-I167 HydrophobicContact CD1-CG1 4.27Å |
| 150 | M | 96.2 | Very high | 95.9 | Very high | 16 Ų | 16 | 57.6 Ų | 57.6 | 8% | 0.079 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -72 | -32.9 | 178.3 | -70.4 | -172.4 | -57.7 | 0 | 0 | 112.8 | Y146 Q147 R157 Q160 W163 | Y146-M150 WeakPolarHBondContact O-CG 3.37Å; Y146-M150 PolarHBondContact O-N 3.39Å; Y146-M150 VanDerWaalsContact O-N 3.14Å; Q147-M150 CarbonylContact O-C 3.54Å; Q147-M150 WeakPolarHBondContact O-CA 3.37Å; Q147-M150 PolarHBondContact O-N 3.42Å; M150-R157 HydrophobicContact CB-CG 4.06Å; M150-R157 HydrophobicContact CG-CG 4.42Å; M150-R157 VanDerWaalsContact O-CZ 3.27Å; M150-R157 PolarHBondContact O-NE 3.41Å; M150-R157 PolarHBondContact O-NH2 3.01Å; M150-Q160 HydrophobicContact SD-CG 4.23Å; M150-Q160 PolarHBondContact SD-NE2 3.32Å; M150-W163 HydrophobicContact CG-CH2 3.96Å; M150-W163 HydrophobicContact CG-CZ2 3.69Å; M150-W163 HydrophobicContact SD-CH2 4.31Å; M150-W163 HydrophobicContact SD-CZ2 3.85Å |
| 151 | D | 95.8 | Very high | 95.9 | Very high | 107 Ų | 107 | 64.6 Ų | 64.6 | 57% | 0.572 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -68.5 | -54.5 | 178.1 | -64.6 | -33.7 | 0 | 0 | 0 | 110.2 | Q147 R157 | Q147-D151 PolarHBondContact O-N 3.29Å; Q147-D151 VanDerWaalsContact O-OD2 3.12Å; D151-R157 PolarHBondContact O-NH2 2.71Å |
| 152 | L | 94.6 | Very high | 95.8 | Very high | 88 Ų | 88 | 73.6 Ų | 73.6 | 46% | 0.461 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -73.1 | -31.9 | -177.5 | -173.6 | 61.3 | 0 | 0 | 0 | 113.6 | W148 | W148-L152 HydrophobicContact CH2-CD2 3.4Å; W148-L152 VanDerWaalsContact CH2-CD2 3.4Å; W148-L152 HydrophobicContact CZ2-CD2 3.49Å; W148-L152 VanDerWaalsContact CZ2-CD2 3.49Å; W148-L152 HydrophobicContact CZ3-CD2 4.03Å; W148-L152 WeakPolarHBondContact O-CB 3.16Å; W148-L152 PolarHBondContact O-N 3.42Å; W148-L152 VanDerWaalsContact O-N 3.1Å |
| 153 | F | 94.3 | Very high | 95.8 | Very high | 33 Ų | 33 | 71.8 Ų | 71.8 | 15% | 0.145 | 34% | 0.335 | C | S | . | . | trans | -128.5 | 90.8 | -174.7 | -59.6 | -64.9 | 0 | 0 | 0 | 111.9 | P120 Y122 L127 M130 W148 I149 Y155 Y156 | P120-F153 HydrophobicContact CB-CD1 3.96Å; P120-F153 HydrophobicContact CB-CE1 4.01Å; P120-F153 HydrophobicContact CB-CG 4.42Å; P120-F153 HydrophobicContact CG-CB 3.85Å; P120-F153 HydrophobicContact CG-CD1 3.36Å; P120-F153 HydrophobicContact CG-CD2 4.36Å; P120-F153 HydrophobicContact CG-CE1 3.94Å; P120-F153 HydrophobicContact CG-CG 3.6Å; Y122-F153 HydrophobicContact CD2-CE1 4.19Å; Y122-F153 HydrophobicContact CD2-CE2 4.37Å; Y122-F153 AromaticContact CD2-CZ 3.7Å; Y122-F153 HydrophobicContact CD2-CZ 3.7Å; Y122-F153 HydrophobicContact CE2-CE1 4.04Å; Y122-F153 AromaticContact CE2-CZ 3.69Å; Y122-F153 HydrophobicContact CE2-CZ 3.69Å; L127-F153 HydrophobicContact CD2-CD2 3.69Å; L127-F153 HydrophobicContact CD2-CE2 3.34Å; L127-F153 HydrophobicContact CD2-CZ 4.21Å; M130-F153 HydrophobicContact CE-CE2 4.5Å; W148-F153 HydrophobicContact CH2-CE2 4.46Å; W148-F153 HydrophobicContact CZ3-CE2 4.29Å; I149-F153 WeakPolarHBondContact O-CA 3.41Å; I149-F153 WeakPolarHBondContact O-CB 3.21Å; I149-F153 PolarHBondContact O-N 2.99Å; F153-Y155 PolarHBondContact O-N 3.16Å; F153-Y156 HydrophobicContact CB-CD2 3.8Å; F153-Y156 HydrophobicContact CB-CE2 4.27Å; F153-Y156 PolarHBondContact O-N 3.33Å | ||
| 154 | P | 93.9 | Very high | 95.8 | Very high | 27 Ų | 27 | 69.7 Ų | 69.7 | 18% | 0.175 | 32% | 0.317 | C | S | . | . | G | 310 helix | trans | -51.7 | -29.3 | -176.6 | -29.5 | 35.3 | 0 | 0 | 0 | 115.5 | A116 Y156 R157 | A116-P154 HydrophobicContact CB-CG 4.38Å; P154-Y156 PolarHBondContact O-N 3.09Å; P154-Y156 VanDerWaalsContact O-N 3.09Å; P154-R157 WeakPolarHBondContact O-CB 3.29Å; P154-R157 WeakPolarHBondContact O-CG 3.47Å; P154-R157 PolarHBondContact O-N 3.12Å |
| 155 | Y | 94.4 | Very high | 95.8 | Very high | 89 Ų | 89 | 70.2 Ų | 70.2 | 35% | 0.349 | 32% | 0.323 | S | S | . | . | G | 310 helix | trans | -48 | -31.6 | 172 | 174.6 | -100.6 | 0 | 0 | 0 | 114.6 | K119 F153 | K119-Y155 HydrophobicContact CB-CD1 4.13Å; K119-Y155 HydrophobicContact CB-CD2 4.32Å; K119-Y155 HydrophobicContact CB-CE1 3.74Å; K119-Y155 HydrophobicContact CB-CE2 3.96Å; K119-Y155 HydrophobicContact CB-CG 4.41Å; K119-Y155 HydrophobicContact CD-CE1 4.1Å; K119-Y155 HydrophobicContact CG-CD1 4.16Å; K119-Y155 HydrophobicContact CG-CE1 3.61Å; F153-Y155 PolarHBondContact O-N 3.16Å |
| 156 | Y | 95.8 | Very high | 95.8 | Very high | 4 Ų | 4 | 72 Ų | 72 | 2% | 0.016 | 34% | 0.335 | C | S | . | . | G | 310 helix | trans | -90 | -0.2 | -177.8 | -68.5 | -71.7 | 0 | 0 | 0 | 114.5 | P120 Y124 L127 I149 F153 P154 E158 W163 | P120-Y156 HydrophobicContact CG-CE2 3.99Å; Y124-Y156 HydrophobicContact CE1-CE1 4.17Å; L127-Y156 HydrophobicContact CD1-CE2 3.89Å; I149-Y156 HydrophobicContact CG2-CD1 4.5Å; I149-Y156 HydrophobicContact CG2-CD2 3.49Å; I149-Y156 VanDerWaalsContact CG2-CD2 3.49Å; I149-Y156 HydrophobicContact CG2-CE2 4.13Å; I149-Y156 HydrophobicContact CG2-CG 3.7Å; F153-Y156 HydrophobicContact CB-CD2 3.8Å; F153-Y156 HydrophobicContact CB-CE2 4.27Å; F153-Y156 PolarHBondContact O-N 3.33Å; P154-Y156 PolarHBondContact O-N 3.09Å; P154-Y156 VanDerWaalsContact O-N 3.09Å; Y156-E158 VanDerWaalsContact C-N 3.26Å; Y156-E158 PolarHBondContact O-N 3Å; Y156-W163 HydrophobicContact CD1-CB 4.1Å; Y156-W163 AromaticContact CD1-CD1 3.77Å; Y156-W163 AromaticContact CD1-CD2 3.84Å; Y156-W163 HydrophobicContact CD1-CD2 3.84Å; Y156-W163 HydrophobicContact CD1-CE3 4.44Å; Y156-W163 AromaticContact CD1-CG 3.66Å; Y156-W163 HydrophobicContact CD1-CG 3.66Å; Y156-W163 AromaticContact CD1-NE1 3.98Å; Y156-W163 HydrophobicContact CE1-CB 4.23Å; Y156-W163 HydrophobicContact CE1-CG 4.28Å; Y156-W163 HydrophobicContact CG-CD2 4.47Å; Y156-W163 WeakPolarHBondContact O-CZ2 3.47Å; Y156-W163 PolarHBondContact O-NE1 3.35Å |
| 157 | R | 95.3 | Very high | 95.8 | Very high | 125 Ų | 125 | 70.6 Ų | 70.6 | 47% | 0.472 | 33% | 0.329 | S | S | . | . | S | Bend | trans | -67.4 | -31 | 176.7 | -65.8 | 173.5 | -170.5 | 165.9 | 7.3 | 112.1 | M150 D151 P154 Q160 | M150-R157 HydrophobicContact CB-CG 4.06Å; M150-R157 HydrophobicContact CG-CG 4.42Å; M150-R157 VanDerWaalsContact O-CZ 3.27Å; M150-R157 PolarHBondContact O-NE 3.41Å; M150-R157 PolarHBondContact O-NH2 3.01Å; D151-R157 PolarHBondContact O-NH2 2.71Å; P154-R157 WeakPolarHBondContact O-CB 3.29Å; P154-R157 WeakPolarHBondContact O-CG 3.47Å; P154-R157 PolarHBondContact O-N 3.12Å; R157-Q160 WeakPolarHBondContact O-CG 3.48Å; R157-Q160 PolarHBondContact O-NE2 3.27Å |
| 158 | E | 92.6 | Very high | 95.8 | Very high | 115 Ų | 115 | 70.1 Ų | 70.1 | 54% | 0.537 | 32% | 0.324 | S | S | . | . | S | Bend | trans | -84 | 165.2 | 174.7 | -62.4 | 169.2 | -146.9 | 0 | 0 | 112.3 | Y156 Q160 W163 | Y156-E158 VanDerWaalsContact C-N 3.26Å; Y156-E158 PolarHBondContact O-N 3Å; E158-Q160 PolarHBondContact O-N 2.89Å; E158-W163 PolarHBondContact O-NE1 3.45Å |
| 159 | N | 92.1 | Very high | 95.8 | Very high | 121 Ų | 121 | 73.1 Ų | 73.1 | 65% | 0.647 | 34% | 0.339 | S | S | * | . | S | Bend | trans | 54.4 | 28.8 | 167.5 | -70.8 | -81.4 | 0 | 0 | 0 | 115.3 | Q161 R162 | N159-Q161 PolarHBondContact O-N 3.05Å; N159-R162 PolarHBondContact O-N 2.73Å; N159-R162 VanDerWaalsContact O-N 3.08Å |
| 160 | Q | 94.6 | Very high | 95.8 | Very high | 80 Ų | 80 | 73.6 Ų | 73.6 | 37% | 0.374 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -50.2 | -47.6 | -165.9 | -66.7 | -171 | 24 | 0 | 0 | 114.9 | M150 R157 E158 R162 W163 Q164 | M150-Q160 HydrophobicContact SD-CG 4.23Å; M150-Q160 PolarHBondContact SD-NE2 3.32Å; R157-Q160 WeakPolarHBondContact O-CG 3.48Å; R157-Q160 PolarHBondContact O-NE2 3.27Å; E158-Q160 PolarHBondContact O-N 2.89Å; Q160-R162 PolarHBondContact O-N 2.58Å; Q160-R162 VanDerWaalsContact O-N 3.08Å; Q160-W163 HydrophobicContact CG-CZ2 4.23Å; Q160-W163 PolarHBondContact O-N 2.83Å; Q160-Q164 WeakPolarHBondContact O-CB 3.06Å; Q160-Q164 WeakPolarHBondContact O-CG 2.99Å; Q160-Q164 PolarHBondContact O-N 2.84Å |
| 161 | Q | 96.7 | Very high | 95.8 | Very high | 169 Ų | 169 | 73 Ų | 73 | 79% | 0.79 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -53.2 | -36.2 | -177.5 | -166.5 | -178.4 | 21 | 0 | 0 | 113 | N159 N165 | N159-Q161 PolarHBondContact O-N 3.05Å; Q161-N165 WeakPolarHBondContact O-CB 3.46Å; Q161-N165 PolarHBondContact O-N 3.15Å |
| 162 | R | 95.9 | Very high | 95.8 | Very high | 200 Ų | 200 | 72.3 Ų | 72.3 | 76% | 0.755 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -72.9 | -54.1 | -177.1 | -173.3 | -178.6 | -66.9 | -89 | 2.6 | 111.9 | N159 Q160 N165 S166 | N159-R162 PolarHBondContact O-N 2.73Å; N159-R162 VanDerWaalsContact O-N 3.08Å; Q160-R162 PolarHBondContact O-N 2.58Å; Q160-R162 VanDerWaalsContact O-N 3.08Å; R162-N165 WeakPolarHBondContact O-CB 3.37Å; R162-N165 PolarHBondContact O-N 2.76Å; R162-S166 PolarHBondContact O-N 3.23Å; R162-S166 PolarHBondContact O-OG 2.89Å |
| 163 | W | 96.6 | Very high | 95.7 | Very high | 13 Ų | 13 | 73.2 Ų | 73.2 | 5% | 0.049 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -77.2 | -32.8 | -176.5 | 67.8 | -105.4 | 0 | 0 | 0 | 112.4 | Y124 Y146 I149 M150 Y156 E158 Q160 N165 S166 I167 | Y124-W163 HydrophobicContact CE1-CB 4.29Å; Y146-W163 HydrophobicContact CD1-CH2 4.26Å; Y146-W163 AromaticContact CD1-CZ3 3.94Å; Y146-W163 HydrophobicContact CD1-CZ3 3.94Å; Y146-W163 HydrophobicContact CG-CH2 4.4Å; I149-W163 HydrophobicContact CG2-CZ3 4.34Å; M150-W163 HydrophobicContact CG-CH2 3.96Å; M150-W163 HydrophobicContact CG-CZ2 3.69Å; M150-W163 HydrophobicContact SD-CH2 4.31Å; M150-W163 HydrophobicContact SD-CZ2 3.85Å; Y156-W163 HydrophobicContact CD1-CB 4.1Å; Y156-W163 AromaticContact CD1-CD1 3.77Å; Y156-W163 AromaticContact CD1-CD2 3.84Å; Y156-W163 HydrophobicContact CD1-CD2 3.84Å; Y156-W163 HydrophobicContact CD1-CE3 4.44Å; Y156-W163 AromaticContact CD1-CG 3.66Å; Y156-W163 HydrophobicContact CD1-CG 3.66Å; Y156-W163 AromaticContact CD1-NE1 3.98Å; Y156-W163 HydrophobicContact CE1-CB 4.23Å; Y156-W163 HydrophobicContact CE1-CG 4.28Å; Y156-W163 HydrophobicContact CG-CD2 4.47Å; Y156-W163 WeakPolarHBondContact O-CZ2 3.47Å; Y156-W163 PolarHBondContact O-NE1 3.35Å; E158-W163 PolarHBondContact O-NE1 3.45Å; Q160-W163 HydrophobicContact CG-CZ2 4.23Å; Q160-W163 PolarHBondContact O-N 2.83Å; W163-N165 PolarHBondContact O-N 2.98Å; W163-S166 CarbonylContact O-C 3.57Å; W163-S166 WeakPolarHBondContact O-CA 3.23Å; W163-S166 WeakPolarHBondContact O-CB 3.46Å; W163-S166 PolarHBondContact O-N 3.49Å; W163-I167 HydrophobicContact CE3-CG1 3.81Å; W163-I167 HydrophobicContact CZ3-CG1 4.03Å; W163-I167 PolarHBondContact O-N 3.35Å |
| 164 | Q | 97.9 | Very high | 95.6 | Very high | 29 Ų | 29 | 72.5 Ų | 72.5 | 14% | 0.136 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -61.6 | -31.7 | 172.5 | -70.6 | 179.9 | 1.9 | 0 | 0 | 111.4 | Y146 Q160 I167 R168 | Y146-Q164 HydrophobicContact CD1-CB 4.35Å; Y146-Q164 HydrophobicContact CD1-CG 3.78Å; Y146-Q164 HydrophobicContact CD2-CG 4.22Å; Y146-Q164 HydrophobicContact CE1-CB 3.72Å; Y146-Q164 HydrophobicContact CE1-CG 3.65Å; Y146-Q164 HydrophobicContact CE2-CB 4.43Å; Y146-Q164 HydrophobicContact CE2-CG 4.11Å; Y146-Q164 HydrophobicContact CG-CG 4.06Å; Q160-Q164 WeakPolarHBondContact O-CB 3.06Å; Q160-Q164 WeakPolarHBondContact O-CG 2.99Å; Q160-Q164 PolarHBondContact O-N 2.84Å; Q164-I167 PolarHBondContact O-N 3.31Å; Q164-R168 WeakPolarHBondContact O-CG 3.33Å; Q164-R168 PolarHBondContact O-N 3.39Å; Q164-R168 PolarHBondContact O-NH1 2.86Å |
| 165 | N | 97.9 | Very high | 95.4 | Very high | 95 Ų | 95 | 73.2 Ų | 73.2 | 51% | 0.508 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 171.8 | -154.9 | 43.6 | 0 | 0 | 0 | 112.1 | Q161 R162 W163 I167 R168 H169 | Q161-N165 WeakPolarHBondContact O-CB 3.46Å; Q161-N165 PolarHBondContact O-N 3.15Å; R162-N165 WeakPolarHBondContact O-CB 3.37Å; R162-N165 PolarHBondContact O-N 2.76Å; W163-N165 PolarHBondContact O-N 2.98Å; N165-I167 VanDerWaalsContact C-N 3.33Å; N165-I167 PolarHBondContact O-N 3.31Å; N165-R168 PolarHBondContact O-N 2.93Å; N165-R168 PolarHBondContact OD1-NH2 2.94Å; N165-H169 WeakPolarHBondContact O-CB 3.44Å; N165-H169 PolarHBondContact O-N 3.23Å |
| 166 | S | 97.5 | Very high | 95.3 | Very high | 37 Ų | 37 | 69.4 Ų | 69.4 | 26% | 0.259 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64.5 | -34 | 173 | -50.7 | 0 | 0 | 0 | 0 | 113 | R162 W163 S170 | R162-S166 PolarHBondContact O-N 3.23Å; R162-S166 PolarHBondContact O-OG 2.89Å; W163-S166 CarbonylContact O-C 3.57Å; W163-S166 WeakPolarHBondContact O-CA 3.23Å; W163-S166 WeakPolarHBondContact O-CB 3.46Å; W163-S166 PolarHBondContact O-N 3.49Å; S166-S170 VanDerWaalsContact O-CB 3.29Å; S166-S170 WeakPolarHBondContact O-CB 3.37Å; S166-S170 PolarHBondContact O-N 3.26Å; S166-S170 PolarHBondContact O-OG 3.38Å |
| 167 | I | 97.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 69.7 Ų | 69.7 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.7 | -50.4 | 172.3 | -66.9 | -69.1 | 0 | 0 | 0 | 110.8 | Y124 I128 L142 I145 Y146 I149 W163 Q164 N165 H169 S170 L171 | Y124-I167 HydrophobicContact CD1-CD1 3.8Å; Y124-I167 HydrophobicContact CD1-CG1 4.35Å; Y124-I167 HydrophobicContact CG-CD1 4.33Å; I128-I167 HydrophobicContact CD1-CD1 4.02Å; I128-I167 HydrophobicContact CD1-CG2 4.25Å; I128-I167 HydrophobicContact CG1-CD1 3.87Å; I128-I167 HydrophobicContact CG1-CG2 4.36Å; L142-I167 HydrophobicContact CD1-CG2 4.15Å; I145-I167 HydrophobicContact CG2-CG2 3.97Å; Y146-I167 HydrophobicContact CD1-CG2 4.3Å; Y146-I167 HydrophobicContact CE1-CB 4.25Å; Y146-I167 HydrophobicContact CE1-CG2 3.95Å; I149-I167 HydrophobicContact CD1-CD1 3.58Å; I149-I167 HydrophobicContact CD1-CG1 4.27Å; W163-I167 HydrophobicContact CE3-CG1 3.81Å; W163-I167 HydrophobicContact CZ3-CG1 4.03Å; W163-I167 PolarHBondContact O-N 3.35Å; Q164-I167 PolarHBondContact O-N 3.31Å; N165-I167 VanDerWaalsContact C-N 3.33Å; N165-I167 PolarHBondContact O-N 3.31Å; I167-H169 VanDerWaalsContact C-N 3.33Å; I167-H169 PolarHBondContact O-N 3.28Å; I167-S170 PolarHBondContact O-N 3.42Å; I167-L171 HydrophobicContact CG2-CD1 4.09Å; I167-L171 WeakPolarHBondContact O-CG 3.39Å; I167-L171 PolarHBondContact O-N 3.21Å |
| 168 | R | 97.9 | Very high | 95.3 | Very high | 86 Ų | 86 | 66.1 Ų | 66.1 | 33% | 0.325 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -56.4 | -45.5 | 177 | -72.1 | -175.5 | -59.8 | -94.5 | 10.9 | 112.3 | L142 Y146 Q164 N165 L171 S172 | L142-R168 HydrophobicContact CD1-CG 3.95Å; L142-R168 HydrophobicContact CD2-CG 3.92Å; Y146-R168 WeakPolarHBondContact OH-CG 3.4Å; Y146-R168 PolarHBondContact OH-NH1 3.24Å; Q164-R168 WeakPolarHBondContact O-CG 3.33Å; Q164-R168 PolarHBondContact O-N 3.39Å; Q164-R168 PolarHBondContact O-NH1 2.86Å; N165-R168 PolarHBondContact O-N 2.93Å; N165-R168 PolarHBondContact OD1-NH2 2.94Å; R168-L171 PolarHBondContact O-N 3.14Å; R168-S172 PolarHBondContact O-N 3.25Å; R168-S172 PolarHBondContact O-OG 3.13Å |
| 169 | H | 97.8 | Very high | 95.5 | Very high | 102 Ų | 102 | 67.6 Ų | 67.6 | 47% | 0.472 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -62.6 | -43.3 | 173.6 | 170.4 | 69 | 0 | 0 | 0 | 112 | N165 I167 L171 S172 F173 | N165-H169 WeakPolarHBondContact O-CB 3.44Å; N165-H169 PolarHBondContact O-N 3.23Å; I167-H169 VanDerWaalsContact C-N 3.33Å; I167-H169 PolarHBondContact O-N 3.28Å; H169-L171 VanDerWaalsContact C-N 3.3Å; H169-L171 PolarHBondContact O-N 3.36Å; H169-S172 PolarHBondContact O-N 3.38Å; H169-S172 PolarHBondContact O-OG 2.67Å; H169-F173 AromaticContact CE1-CD1 3.67Å; H169-F173 AromaticContact CE1-CG 3.52Å; H169-F173 AromaticContact NE2-CD1 3.47Å; H169-F173 WeakPolarHBondContact NE2-CD1 3.45Å; H169-F173 AromaticContact NE2-CG 3.81Å; H169-F173 WeakPolarHBondContact O-CB 3.49Å; H169-F173 PolarHBondContact O-N 2.89Å |
| 170 | S | 96.5 | Very high | 95.6 | Very high | 10 Ų | 10 | 64.2 Ų | 64.2 | 7% | 0.07 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.3 | -36.6 | -179.7 | -62.2 | 0 | 0 | 0 | 0 | 112.7 | Y124 S166 I167 N174 | Y124-S170 WeakPolarHBondContact CB-OG 3.4Å; S166-S170 VanDerWaalsContact O-CB 3.29Å; S166-S170 WeakPolarHBondContact O-CB 3.37Å; S166-S170 PolarHBondContact O-N 3.26Å; S166-S170 PolarHBondContact O-OG 3.38Å; I167-S170 PolarHBondContact O-N 3.42Å; S170-N174 PolarHBondContact O-N 3.38Å; S170-N174 PolarHBondContact O-ND2 2.95Å |
| 171 | L | 96.4 | Very high | 95.5 | Very high | 4 Ų | 4 | 64.1 Ų | 64.1 | 2% | 0.021 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -67.4 | -43.1 | 176.3 | -71.8 | 166.9 | 0 | 0 | 0 | 112.8 | I128 L142 I145 I167 R168 H169 F177 W193 | I128-L171 HydrophobicContact CD1-CD2 4.05Å; I128-L171 HydrophobicContact CD1-CG 3.99Å; I128-L171 HydrophobicContact CG2-CD2 3.67Å; L142-L171 HydrophobicContact CD1-CD1 3.62Å; I145-L171 HydrophobicContact CD1-CD1 4.32Å; I145-L171 HydrophobicContact CD1-CD2 4.3Å; I167-L171 HydrophobicContact CG2-CD1 4.09Å; I167-L171 WeakPolarHBondContact O-CG 3.39Å; I167-L171 PolarHBondContact O-N 3.21Å; R168-L171 PolarHBondContact O-N 3.14Å; H169-L171 VanDerWaalsContact C-N 3.3Å; H169-L171 PolarHBondContact O-N 3.36Å; L171-F177 HydrophobicContact CD2-CB 4.11Å; L171-F177 HydrophobicContact CD2-CD1 4.43Å; L171-F177 HydrophobicContact CD2-CD2 4.2Å; L171-F177 HydrophobicContact CD2-CG 3.99Å; L171-W193 HydrophobicContact CB-CD2 4.15Å; L171-W193 HydrophobicContact CB-CE3 4.09Å; L171-W193 HydrophobicContact CB-CH2 3.94Å; L171-W193 HydrophobicContact CB-CZ2 4.02Å; L171-W193 HydrophobicContact CB-CZ3 3.98Å; L171-W193 HydrophobicContact CD1-CD2 4.28Å; L171-W193 HydrophobicContact CD1-CG 4.32Å; L171-W193 HydrophobicContact CD2-CB 4.1Å; L171-W193 HydrophobicContact CD2-CD2 3.85Å; L171-W193 HydrophobicContact CD2-CE3 4Å; L171-W193 HydrophobicContact CD2-CG 3.9Å; L171-W193 HydrophobicContact CG-CD2 4.32Å; L171-W193 WeakPolarHBondContact O-CZ3 3.43Å |
| 172 | S | 95.6 | Very high | 95.2 | Very high | 92 Ų | 92 | 59.3 Ų | 59.3 | 64% | 0.643 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -83.3 | -22.8 | -179 | 60.6 | 0 | 0 | 0 | 0 | 114.5 | R168 H169 | R168-S172 PolarHBondContact O-N 3.25Å; R168-S172 PolarHBondContact O-OG 3.13Å; H169-S172 PolarHBondContact O-N 3.38Å; H169-S172 PolarHBondContact O-OG 2.67Å |
| 173 | F | 92.7 | Very high | 94.9 | Very high | 107 Ų | 107 | 52.5 Ų | 52.5 | 47% | 0.469 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -92 | -19.2 | -173.8 | -176.7 | -126.4 | 0 | 0 | 0 | 114.5 | H169 R214 | H169-F173 AromaticContact CE1-CD1 3.67Å; H169-F173 AromaticContact CE1-CG 3.52Å; H169-F173 AromaticContact NE2-CD1 3.47Å; H169-F173 WeakPolarHBondContact NE2-CD1 3.45Å; H169-F173 AromaticContact NE2-CG 3.81Å; H169-F173 WeakPolarHBondContact O-CB 3.49Å; H169-F173 PolarHBondContact O-N 2.89Å; F173-R214 VanDerWaalsContact CD1-NH2 3.25Å; F173-R214 VanDerWaalsContact CE1-NH2 3.33Å; F173-R214 VanDerWaalsContact CZ-NH1 3.29Å; F173-R214 PolarHBondContact O-NH2 3.49Å |
| 174 | N | 91.9 | Very high | 94.3 | Very high | 17 Ų | 17 | 57.5 Ų | 57.5 | 9% | 0.091 | 32% | 0.316 | C | S | . | . | trans | -113.2 | 119.6 | -175.4 | -62.4 | -79 | 0 | 0 | 0 | 111.8 | I125 S170 C176 F177 R214 | I125-N174 WeakPolarHBondContact CD1-OD1 3.45Å; S170-N174 PolarHBondContact O-N 3.38Å; S170-N174 PolarHBondContact O-ND2 2.95Å; N174-C176 PolarHBondContact O-N 3.33Å; N174-F177 HydrophobicContact CB-CD2 4.21Å; N174-F177 HydrophobicContact CB-CE2 4.45Å; N174-F177 PolarHBondContact O-N 2.91Å; N174-R214 PolarHBondContact OD1-NE 3.38Å; N174-R214 PolarHBondContact OD1-NH2 3.05Å | ||
| 175 | D | 90.3 | Very high | 93.7 | Very high | 42 Ų | 42 | 62.1 Ų | 62.1 | 23% | 0.225 | 34% | 0.342 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.4 | -5.3 | -179.4 | -56.1 | -57.5 | 0 | 0 | 0 | 114.6 | F177 L217 K220 | D175-F177 VanDerWaalsContact C-N 3.31Å; D175-L217 HydrophobicContact CB-CB 4.31Å; D175-L217 HydrophobicContact CB-CD1 3.8Å; D175-L217 HydrophobicContact CB-CG 3.79Å; D175-K220 IonicContact OD1-NZ 2.74Å; D175-K220 PolarHBondContact OD1-NZ 3.37Å |
| 176 | C | 91.8 | Very high | 93 | Very high | 9 Ų | 9 | 64.7 Ų | 64.7 | 6% | 0.061 | 35% | 0.348 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.8 | -15.9 | 172 | 60.3 | 0 | 0 | 0 | 0 | 113.7 | N174 L195 H196 F215 | N174-C176 PolarHBondContact O-N 3.33Å; C176-L195 WeakPolarHBondContact O-CA 3.43Å; C176-H196 PolarHBondContact O-N 3.43Å; C176-F215 HydrophobicContact CB-CD1 4.5Å |
| 177 | F | 94.8 | Very high | 92.2 | Very high | 10 Ų | 10 | 68.8 Ų | 68.8 | 4% | 0.044 | 37% | 0.374 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.5 | 121.2 | 176.7 | -56.3 | -57.6 | 0 | 0 | 0 | 110.4 | I125 I128 I132 L171 N174 D175 W193 A194 L195 | I125-F177 HydrophobicContact CB-CE2 4.38Å; I125-F177 HydrophobicContact CB-CZ 4.37Å; I125-F177 HydrophobicContact CG1-CE2 4.4Å; I125-F177 HydrophobicContact CG2-CE2 3.98Å; I125-F177 HydrophobicContact CG2-CZ 3.76Å; I128-F177 HydrophobicContact CB-CE1 3.95Å; I128-F177 HydrophobicContact CB-CE2 4.34Å; I128-F177 HydrophobicContact CB-CZ 3.68Å; I128-F177 HydrophobicContact CD1-CE2 4.06Å; I128-F177 HydrophobicContact CD1-CZ 4.26Å; I128-F177 HydrophobicContact CG2-CD1 3.81Å; I128-F177 HydrophobicContact CG2-CE1 3.34Å; I128-F177 HydrophobicContact CG2-CE2 4.19Å; I128-F177 HydrophobicContact CG2-CG 4.42Å; I128-F177 HydrophobicContact CG2-CZ 3.56Å; I132-F177 HydrophobicContact CD1-CD1 4.15Å; I132-F177 HydrophobicContact CD1-CE1 4.37Å; L171-F177 HydrophobicContact CD2-CB 4.11Å; L171-F177 HydrophobicContact CD2-CD1 4.43Å; L171-F177 HydrophobicContact CD2-CD2 4.2Å; L171-F177 HydrophobicContact CD2-CG 3.99Å; N174-F177 HydrophobicContact CB-CD2 4.21Å; N174-F177 HydrophobicContact CB-CE2 4.45Å; N174-F177 PolarHBondContact O-N 2.91Å; D175-F177 VanDerWaalsContact C-N 3.31Å; F177-W193 HydrophobicContact CB-CE3 4.11Å; F177-W193 HydrophobicContact CB-CZ3 4.48Å; F177-A194 WeakPolarHBondContact CA-O 3.49Å; F177-L195 HydrophobicContact CD1-CD2 3.99Å; F177-L195 HydrophobicContact CE1-CD2 3.69Å |
| 178 | V | 95.5 | Very high | 91.7 | Very high | 50 Ų | 50 | 70.8 Ų | 70.8 | 30% | 0.303 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.3 | 136.8 | 177.6 | -67.9 | 0 | 0 | 0 | 0 | 110.9 | V180 W193 A194 H196 | V178-V180 HydrophobicContact CG2-CG2 4.32Å; V178-W193 WeakPolarHBondContact O-CA 3.48Å; V178-A194 HydrophobicContact CG2-CB 4.05Å; V178-A194 PolarHBondContact N-O 3.4Å; V178-A194 PolarHBondContact O-N 3.41Å; V178-H196 HydrophobicContact CG1-CB 4.12Å |
| 179 | K | 96.8 | Very high | 91.3 | Very high | 147 Ų | 147 | 76.3 Ų | 76.3 | 64% | 0.639 | 42% | 0.421 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 112.6 | 176.5 | -177.5 | -171.1 | 174.4 | -169.4 | 0 | 109.2 | S191 W193 | K179-S191 WeakPolarHBondContact CE-OG 3.18Å; K179-W193 HydrophobicContact CB-CE3 4.24Å; K179-W193 HydrophobicContact CB-CH2 4.1Å; K179-W193 HydrophobicContact CB-CZ2 4.49Å; K179-W193 HydrophobicContact CB-CZ3 3.96Å |
| 180 | V | 95 | Very high | 91 | Very high | 49 Ų | 49 | 74 Ų | 74 | 30% | 0.297 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 131.2 | -179.3 | -177.4 | 0 | 0 | 0 | 0 | 109.5 | V178 S191 Y192 A194 | V178-V180 HydrophobicContact CG2-CG2 4.32Å; V180-S191 WeakPolarHBondContact O-CB 3.36Å; V180-Y192 PolarHBondContact N-O 3.36Å; V180-Y192 PolarHBondContact O-N 3.48Å; V180-A194 HydrophobicContact CG2-CB 3.93Å |
| 181 | A | 92.9 | Very high | 90.9 | Very high | 79 Ų | 79 | 75 Ų | 75 | 65% | 0.653 | 43% | 0.432 | S | S | * | . | P | Polyproline II helix | trans | -65 | 153.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 182 | R | 90.7 | Very high | 90.9 | Very high | 67 Ų | 67 | 77.8 Ų | 77.8 | 25% | 0.253 | 44% | 0.443 | S | S | . | . | P | Polyproline II helix | trans | -76.4 | 152.7 | 164.7 | -66 | -176.2 | 176.3 | -91.1 | 3.2 | 108.7 | G188 K189 G190 Y192 | R182-G188 WeakPolarHBondContact CD-O 3.39Å; R182-G188 PolarHBondContact NE-O 2.96Å; R182-G188 VanDerWaalsContact NE-O 3.15Å; R182-K189 PolarHBondContact NH2-O 3Å; R182-G190 WeakPolarHBondContact CD-O 3.38Å; R182-G190 PolarHBondContact NE-O 3.01Å; R182-Y192 HydrophobicContact CG-CD2 4.08Å; R182-Y192 HydrophobicContact CG-CE2 3.88Å; R182-Y192 PolarHBondContact NH1-OH 3.2Å |
| 183 | S | 87.7 | Confident | 91 | Very high | 58 Ų | 58 | 75.4 Ų | 75.4 | 41% | 0.406 | 42% | 0.419 | S | S | . | . | P | Polyproline II helix | trans | -67.1 | 149.9 | 165.3 | 84.1 | 0 | 0 | 0 | 0 | 109.6 | D185 K186 | S183-D185 WeakPolarHBondContact CB-OD2 3.43Å; S183-D185 PolarHBondContact O-N 3.1Å; S183-D185 PolarHBondContact OG-OD2 2.8Å; S183-K186 PolarHBondContact O-N 2.97Å |
| 184 | P | 84.3 | Confident | 91.1 | Very high | 118 Ų | 118 | 70.9 Ų | 70.9 | 77% | 0.766 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.6 | -27.3 | -176.7 | 27 | -34.8 | 0 | 0 | 0 | 112.5 | K186 | P184-K186 PolarHBondContact O-N 2.86Š|
| 185 | D | 85.8 | Confident | 91.2 | Very high | 125 Ų | 125 | 71.7 Ų | 71.7 | 67% | 0.668 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.7 | -13.5 | -177.1 | -14.9 | -89.9 | 0 | 0 | 0 | 113.1 | S183 P187 | S183-D185 WeakPolarHBondContact CB-OD2 3.43Å; S183-D185 PolarHBondContact O-N 3.1Å; S183-D185 PolarHBondContact OG-OD2 2.8Å; D185-P187 VanDerWaalsContact C-CD 3.49Å |
| 186 | K | 82.8 | Confident | 91.3 | Very high | 149 Ų | 149 | 72.1 Ų | 72.1 | 65% | 0.648 | 41% | 0.407 | S | S | * | . | S | Bend | trans | -127.3 | 69.7 | -179.5 | -65.6 | -172.7 | -178.9 | 179.1 | 0 | 110.9 | S183 P184 G188 | S183-K186 PolarHBondContact O-N 2.97Å; P184-K186 PolarHBondContact O-N 2.86Å; K186-G188 PolarHBondContact O-N 3.14Å |
| 187 | P | 80.9 | Confident | 91.1 | Very high | 123 Ų | 123 | 77 Ų | 77 | 80% | 0.799 | 44% | 0.438 | S | S | * | . | trans | -57.3 | 125.4 | 176 | 24.9 | -34.2 | 0 | 0 | 0 | 110.2 | D185 | D185-P187 VanDerWaalsContact C-CD 3.49Š| ||
| 188 | G | 88 | Confident | 90.5 | Very high | 42 Ų | 42 | 79.9 Ų | 79.9 | 43% | 0.433 | 46% | 0.46 | S | S | . | . | trans | -165.8 | 158.2 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | R182 K186 G190 | R182-G188 WeakPolarHBondContact CD-O 3.39Å; R182-G188 PolarHBondContact NE-O 2.96Å; R182-G188 VanDerWaalsContact NE-O 3.15Å; K186-G188 PolarHBondContact O-N 3.14Å; G188-G190 PolarHBondContact O-N 3.09Å | ||
| 189 | K | 88.4 | Confident | 89.7 | Confident | 202 Ų | 202 | 77.5 Ų | 77.5 | 88% | 0.878 | 45% | 0.445 | S | S | * | . | S | Bend | trans | -68.2 | 128.2 | -172.2 | -169 | 171.5 | -176 | 172.6 | 0 | 112 | R182 | R182-K189 PolarHBondContact NH2-O 3Š|
| 190 | G | 91.4 | Very high | 88.4 | Confident | 54 Ų | 54 | 71.9 Ų | 71.9 | 56% | 0.557 | 43% | 0.429 | S | S | * | . | S | Bend | trans | 68.2 | -172.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | R182 G188 | R182-G190 WeakPolarHBondContact CD-O 3.38Å; R182-G190 PolarHBondContact NE-O 3.01Å; G188-G190 PolarHBondContact O-N 3.09Å |
| 191 | S | 95.4 | Very high | 87.1 | Confident | 30 Ų | 30 | 74.8 Ų | 74.8 | 21% | 0.21 | 44% | 0.443 | C | S | . | . | trans | -110.9 | 161.2 | -177.9 | -56.2 | 0 | 0 | 0 | 0 | 111.5 | K179 V180 | K179-S191 WeakPolarHBondContact CE-OG 3.18Å; V180-S191 WeakPolarHBondContact O-CB 3.36Å | ||
| 192 | Y | 96.4 | Very high | 85.9 | Confident | 64 Ų | 64 | 73.4 Ų | 73.4 | 25% | 0.251 | 42% | 0.423 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.9 | 154.4 | 167.1 | -69.5 | -73.4 | 0 | 0 | 0 | 110.3 | M139 T141 V180 R182 | M139-Y192 HydrophobicContact CG-CD1 4.05Å; M139-Y192 HydrophobicContact CG-CG 4.22Å; M139-Y192 HydrophobicContact SD-CD1 4.27Å; M139-Y192 HydrophobicContact SD-CD2 4.26Å; M139-Y192 HydrophobicContact SD-CG 3.91Å; T141-Y192 HydrophobicContact CG2-CD1 3.71Å; T141-Y192 HydrophobicContact CG2-CE1 3.59Å; T141-Y192 HydrophobicContact CG2-CG 4.48Å; V180-Y192 PolarHBondContact N-O 3.36Å; V180-Y192 PolarHBondContact O-N 3.48Å; R182-Y192 HydrophobicContact CG-CD2 4.08Å; R182-Y192 HydrophobicContact CG-CE2 3.88Å; R182-Y192 PolarHBondContact NH1-OH 3.2Å |
| 193 | W | 97.3 | Very high | 84.8 | Confident | 41 Ų | 41 | 71.2 Ų | 71.2 | 16% | 0.155 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 127.7 | 172.1 | -67.1 | 92 | 0 | 0 | 0 | 108.5 | I132 M139 L140 I145 L171 F177 V178 K179 | I132-W193 HydrophobicContact CD1-CB 4.42Å; M139-W193 CarbonylContact C-O 3.55Å; M139-W193 VanDerWaalsContact CA-O 3.22Å; M139-W193 WeakPolarHBondContact CA-O 3.36Å; L140-W193 PolarHBondContact N-O 3.47Å; L140-W193 PolarHBondContact O-N 2.76Å; I145-W193 HydrophobicContact CD1-CB 4.38Å; L171-W193 HydrophobicContact CB-CD2 4.15Å; L171-W193 HydrophobicContact CB-CE3 4.09Å; L171-W193 HydrophobicContact CB-CH2 3.94Å; L171-W193 HydrophobicContact CB-CZ2 4.02Å; L171-W193 HydrophobicContact CB-CZ3 3.98Å; L171-W193 HydrophobicContact CD1-CD2 4.28Å; L171-W193 HydrophobicContact CD1-CG 4.32Å; L171-W193 HydrophobicContact CD2-CB 4.1Å; L171-W193 HydrophobicContact CD2-CD2 3.85Å; L171-W193 HydrophobicContact CD2-CE3 4Å; L171-W193 HydrophobicContact CD2-CG 3.9Å; L171-W193 HydrophobicContact CG-CD2 4.32Å; L171-W193 WeakPolarHBondContact O-CZ3 3.43Å; F177-W193 HydrophobicContact CB-CE3 4.11Å; F177-W193 HydrophobicContact CB-CZ3 4.48Å; V178-W193 WeakPolarHBondContact O-CA 3.48Å; K179-W193 HydrophobicContact CB-CE3 4.24Å; K179-W193 HydrophobicContact CB-CH2 4.1Å; K179-W193 HydrophobicContact CB-CZ2 4.49Å; K179-W193 HydrophobicContact CB-CZ3 3.96Å |
| 194 | A | 95.7 | Very high | 83.6 | Confident | 13 Ų | 13 | 74.9 Ų | 74.9 | 11% | 0.107 | 43% | 0.426 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.4 | 164.6 | 177 | 0 | 0 | 0 | 0 | 0 | 110.3 | M139 F177 V178 V180 | M139-A194 HydrophobicContact CB-CB 3.96Å; F177-A194 WeakPolarHBondContact CA-O 3.49Å; V178-A194 HydrophobicContact CG2-CB 4.05Å; V178-A194 PolarHBondContact N-O 3.4Å; V178-A194 PolarHBondContact O-N 3.41Å; V180-A194 HydrophobicContact CG2-CB 3.93Å |
| 195 | L | 94.1 | Very high | 82.4 | Confident | 34 Ų | 34 | 75.6 Ų | 75.6 | 18% | 0.178 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 136.5 | 169.9 | -72.5 | 161.1 | 0 | 0 | 0 | 109.7 | T129 I132 Q133 C176 F177 | T129-L195 HydrophobicContact CG2-CD1 4Å; T129-L195 HydrophobicContact CG2-CD2 4.16Å; I132-L195 HydrophobicContact CB-CD1 4.32Å; I132-L195 HydrophobicContact CB-CG 4.38Å; I132-L195 HydrophobicContact CG2-CD1 3.97Å; I132-L195 HydrophobicContact CG2-CG 3.91Å; Q133-L195 HydrophobicContact CG-CD1 3.85Å; C176-L195 WeakPolarHBondContact O-CA 3.43Å; F177-L195 HydrophobicContact CD1-CD2 3.99Å; F177-L195 HydrophobicContact CE1-CD2 3.69Å |
| 196 | H | 91.9 | Very high | 81.1 | Confident | 51 Ų | 51 | 72.1 Ų | 72.1 | 24% | 0.236 | 42% | 0.417 | C | S | . | . | trans | -64.5 | 133.7 | 173 | -174.3 | -110.3 | 0 | 0 | 0 | 109.9 | C176 V178 S198 S199 | C176-H196 PolarHBondContact O-N 3.43Å; V178-H196 HydrophobicContact CG1-CB 4.12Å; H196-S198 VanDerWaalsContact C-N 3.34Å; H196-S198 PolarHBondContact O-N 3.29Å; H196-S199 WeakPolarHBondContact O-CA 3.47Å; H196-S199 WeakPolarHBondContact O-CB 3.41Å; H196-S199 PolarHBondContact O-N 3.01Å; H196-S199 PolarHBondContact O-OG 2.89Å | ||
| 197 | P | 87.9 | Confident | 80.1 | Confident | 112 Ų | 112 | 67.3 Ų | 67.3 | 73% | 0.727 | 40% | 0.402 | S | S | * | . | G | 310 helix | trans | -53.5 | -45.5 | -173.8 | -30.5 | 36.5 | 0 | 0 | 0 | 114.1 | S199 G200 | P197-S199 PolarHBondContact O-N 2.98Å; P197-G200 PolarHBondContact O-N 2.92Å |
| 198 | S | 81.8 | Confident | 79.3 | Confident | 70 Ų | 70 | 64 Ų | 64 | 49% | 0.49 | 37% | 0.374 | S | S | . | . | G | 310 helix | trans | -66.2 | -5.6 | 177 | 159.7 | 0 | 0 | 0 | 0 | 114.6 | H196 | H196-S198 VanDerWaalsContact C-N 3.34Å; H196-S198 PolarHBondContact O-N 3.29Å |
| 199 | S | 78.6 | Confident | 78 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 38% | 0.382 | C | S | . | . | G | 310 helix | trans | -96 | -9.9 | 175.6 | 74.8 | 0 | 0 | 0 | 0 | 114.5 | H196 P197 N201 M202 F203 | H196-S199 WeakPolarHBondContact O-CA 3.47Å; H196-S199 WeakPolarHBondContact O-CB 3.41Å; H196-S199 PolarHBondContact O-N 3.01Å; H196-S199 PolarHBondContact O-OG 2.89Å; P197-S199 PolarHBondContact O-N 2.98Å; S199-N201 PolarHBondContact O-N 3.36Å; S199-M202 VanDerWaalsContact O-CB 3.29Å; S199-M202 WeakPolarHBondContact O-CB 3.21Å; S199-M202 PolarHBondContact O-N 3.04Å; S199-M202 VanDerWaalsContact O-N 3.14Å; S199-F203 WeakPolarHBondContact O-CD2 3.22Å |
| 200 | G | 68.4 | Low | 76.5 | Confident | 29 Ų | 29 | 68.4 Ų | 68.4 | 30% | 0.299 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.2 | -51.5 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | P197 M202 F203 E204 | P197-G200 PolarHBondContact O-N 2.92Å; G200-M202 PolarHBondContact O-N 2.93Å; G200-F203 PolarHBondContact O-N 3.31Å; G200-F203 VanDerWaalsContact O-N 3.12Å; G200-E204 PolarHBondContact O-N 2.92Å |
| 201 | N | 69.1 | Low | 75.2 | Confident | 109 Ų | 109 | 71 Ų | 71 | 58% | 0.583 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -62.9 | -11.6 | -177.5 | -47 | 102.3 | 0 | 0 | 0 | 113.8 | S199 F203 E204 N205 | S199-N201 PolarHBondContact O-N 3.36Å; N201-F203 VanDerWaalsContact C-N 3.33Å; N201-E204 PolarHBondContact ND2-OE2 3.17Å; N201-N205 PolarHBondContact O-ND2 2.77Å |
| 202 | M | 67.4 | Low | 73.2 | Confident | 50 Ų | 50 | 79.5 Ų | 79.5 | 25% | 0.246 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -77.1 | -18.6 | 178.6 | -57.5 | -143.7 | 173.2 | 0 | 0 | 113.4 | S199 G200 R211 F215 | S199-M202 VanDerWaalsContact O-CB 3.29Å; S199-M202 WeakPolarHBondContact O-CB 3.21Å; S199-M202 PolarHBondContact O-N 3.04Å; S199-M202 VanDerWaalsContact O-N 3.14Å; G200-M202 PolarHBondContact O-N 2.93Å; M202-R211 PolarHBondContact O-NH2 3.02Å; M202-R211 PolarHBondContact SD-NH1 2.74Å; M202-F215 HydrophobicContact CE-CD2 3.29Å; M202-F215 HydrophobicContact CE-CE2 3.47Å; M202-F215 VanDerWaalsContact CE-CE2 3.47Å; M202-F215 HydrophobicContact CE-CG 4.02Å; M202-F215 HydrophobicContact CE-CZ 4.31Å; M202-F215 HydrophobicContact SD-CB 3.97Å; M202-F215 HydrophobicContact SD-CD2 3.76Å; M202-F215 HydrophobicContact SD-CE2 4.36Å; M202-F215 HydrophobicContact SD-CG 3.86Å |
| 203 | F | 66.8 | Low | 71.4 | Confident | 22 Ų | 22 | 85 Ų | 85 | 10% | 0.096 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -120.3 | -28.9 | -174.3 | -58.4 | -78.2 | 0 | 0 | 0 | 112.9 | I125 T129 S199 G200 N201 N205 G206 Y208 | I125-F203 HydrophobicContact CG2-CE1 4.06Å; I125-F203 HydrophobicContact CG2-CZ 3.85Å; T129-F203 HydrophobicContact CG2-CB 3.74Å; T129-F203 HydrophobicContact CG2-CD1 3.91Å; T129-F203 HydrophobicContact CG2-CD2 3.81Å; T129-F203 HydrophobicContact CG2-CE1 4.42Å; T129-F203 HydrophobicContact CG2-CE2 4.34Å; T129-F203 HydrophobicContact CG2-CG 3.56Å; S199-F203 WeakPolarHBondContact O-CD2 3.22Å; G200-F203 PolarHBondContact O-N 3.31Å; G200-F203 VanDerWaalsContact O-N 3.12Å; N201-F203 VanDerWaalsContact C-N 3.33Å; F203-N205 VanDerWaalsContact C-N 3.28Å; F203-N205 PolarHBondContact O-N 2.87Å; F203-G206 PolarHBondContact O-N 3.38Å; F203-Y208 HydrophobicContact CB-CE1 4.05Å; F203-Y208 WeakPolarHBondContact O-CE2 3.45Å; F203-Y208 VanDerWaalsContact O-CZ 3.23Å; F203-Y208 PolarHBondContact O-OH 2.98Å |
| 204 | E | 64.1 | Low | 69.6 | Low | 134 Ų | 134 | 89.5 Ų | 89.5 | 63% | 0.626 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -50.3 | -43.8 | 175.2 | -169.3 | 163.4 | -133.4 | 0 | 0 | 112.9 | G200 N201 G206 | G200-E204 PolarHBondContact O-N 2.92Å; N201-E204 PolarHBondContact ND2-OE2 3.17Å; E204-G206 PolarHBondContact O-N 3Å |
| 205 | N | 57.3 | Low | 68 | Low | 134 Ų | 134 | 91.7 Ų | 91.7 | 72% | 0.717 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | 36.5 | 177.4 | -63.8 | -64.4 | 0 | 0 | 0 | 114.1 | N201 F203 C207 | N201-N205 PolarHBondContact O-ND2 2.77Å; F203-N205 VanDerWaalsContact C-N 3.28Å; F203-N205 PolarHBondContact O-N 2.87Å; N205-C207 PolarHBondContact O-N 2.91Å |
| 206 | G | 59.7 | Low | 66.5 | Low | 51 Ų | 51 | 97.6 Ų | 97.6 | 53% | 0.526 | 48% | 0.483 | S | S | . | . | S | Bend | trans | 67.8 | 4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | F203 E204 Y208 | F203-G206 PolarHBondContact O-N 3.38Å; E204-G206 PolarHBondContact O-N 3Å; G206-Y208 PolarHBondContact O-N 3.41Å |
| 207 | C | 62.1 | Low | 65.1 | Low | 48 Ų | 48 | 96.8 Ų | 96.8 | 32% | 0.324 | 48% | 0.48 | S | S | . | . | trans | -78.1 | 49.9 | -173.8 | -162.9 | 0 | 0 | 0 | 0 | 113.3 | N205 L209 R211 | N205-C207 PolarHBondContact O-N 2.91Å; C207-L209 VanDerWaalsContact C-N 3.35Å; C207-R211 PolarHBondContact SG-NH2 3.41Å; C207-R211 VanDerWaalsContact SG-NH2 3.38Å | ||
| 208 | Y | 62.8 | Low | 63.9 | Low | 53 Ų | 53 | 99.4 Ų | 99.4 | 21% | 0.208 | 48% | 0.483 | C | S | . | . | trans | -81.3 | -12.5 | 176.8 | -59 | -77.9 | 0 | 0 | 0 | 113.3 | S126 T129 M130 Q133 F203 G206 | S126-Y208 WeakPolarHBondContact CB-O 3.46Å; S126-Y208 PolarHBondContact OG-O 2.97Å; T129-Y208 HydrophobicContact CG2-CE1 4.3Å; M130-Y208 HydrophobicContact CG-CD1 3.7Å; M130-Y208 HydrophobicContact CG-CE1 3.64Å; M130-Y208 HydrophobicContact SD-CD1 4.14Å; M130-Y208 HydrophobicContact SD-CG 4.41Å; Q133-Y208 PolarHBondContact NE2-OH 3.06Å; Q133-Y208 PolarHBondContact OE1-OH 3.09Å; Q133-Y208 VanDerWaalsContact OE1-OH 3.12Å; F203-Y208 HydrophobicContact CB-CE1 4.05Å; F203-Y208 WeakPolarHBondContact O-CE2 3.45Å; F203-Y208 VanDerWaalsContact O-CZ 3.23Å; F203-Y208 PolarHBondContact O-OH 2.98Å; G206-Y208 PolarHBondContact O-N 3.41Å | ||
| 209 | L | 61.8 | Low | 62.7 | Low | 114 Ų | 114 | 104.1 Ų | 104.1 | 60% | 0.597 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -73.1 | 159.8 | 170.9 | -67 | 171.3 | 0 | 0 | 0 | 111.3 | P121 C207 R211 | P121-L209 HydrophobicContact CB-CD2 4.43Å; C207-L209 VanDerWaalsContact C-N 3.35Å; L209-R211 PolarHBondContact O-N 3.24Å |
| 210 | R | 56 | Low | 61.4 | Low | 223 Ų | 223 | 111 Ų | 111 | 84% | 0.842 | 53% | 0.527 | S | S | * | . | trans | -63.9 | 97.3 | -175.1 | -179.8 | -175.6 | 168.5 | -166.9 | -4.1 | 112.1 | ||||
| 211 | R | 63.8 | Low | 60.8 | Low | 109 Ų | 109 | 112.2 Ų | 112.2 | 41% | 0.411 | 53% | 0.534 | S | S | . | . | trans | -60 | 139.1 | 172.7 | -168.8 | 179.6 | -65.6 | 172 | 3.2 | 111.6 | M202 C207 L209 K213 | M202-R211 PolarHBondContact O-NH2 3.02Å; M202-R211 PolarHBondContact SD-NH1 2.74Å; C207-R211 PolarHBondContact SG-NH2 3.41Å; C207-R211 VanDerWaalsContact SG-NH2 3.38Å; L209-R211 PolarHBondContact O-N 3.24Å; R211-K213 WeakPolarHBondContact CD-O 3.31Å; R211-K213 WeakPolarHBondContact CG-O 3.2Å | ||
| 212 | Q | 55.2 | Low | 60 | Low | 208 Ų | 208 | 116.7 Ų | 116.7 | 97% | 0.972 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -77.3 | -27.6 | -179.5 | -69.6 | 177.1 | -19.7 | 0 | 0 | 114 | ||
| 213 | K | 58.2 | Low | 59.1 | Low | 179 Ų | 179 | 124 Ų | 124 | 78% | 0.778 | 58% | 0.579 | S | S | * | * | S | Bend | trans | -112.1 | 131.7 | 178.5 | -166.9 | 174.6 | -177.5 | 179.9 | 0 | 110.6 | R211 | R211-K213 WeakPolarHBondContact CD-O 3.31Å; R211-K213 WeakPolarHBondContact CG-O 3.2Å |
| 214 | R | 58.8 | Low | 58.2 | Low | 136 Ų | 136 | 125.8 Ų | 125.8 | 51% | 0.513 | 60% | 0.604 | S | S | . | * | trans | -85.5 | 143 | -174.6 | -161.3 | -175.3 | 179.7 | -153.3 | -5.3 | 111.8 | F173 N174 | F173-R214 VanDerWaalsContact CD1-NH2 3.25Å; F173-R214 VanDerWaalsContact CE1-NH2 3.33Å; F173-R214 VanDerWaalsContact CZ-NH1 3.29Å; F173-R214 PolarHBondContact O-NH2 3.49Å; N174-R214 PolarHBondContact OD1-NE 3.38Å; N174-R214 PolarHBondContact OD1-NH2 3.05Å | ||
| 215 | F | 63 | Low | 57.3 | Low | 59 Ų | 59 | 127 Ų | 127 | 26% | 0.259 | 61% | 0.614 | S | S | . | * | trans | -72 | 151.8 | 167.1 | 179.5 | -122.6 | 0 | 0 | 0 | 111.3 | C176 M202 L217 | C176-F215 HydrophobicContact CB-CD1 4.5Å; M202-F215 HydrophobicContact CE-CD2 3.29Å; M202-F215 HydrophobicContact CE-CE2 3.47Å; M202-F215 VanDerWaalsContact CE-CE2 3.47Å; M202-F215 HydrophobicContact CE-CG 4.02Å; M202-F215 HydrophobicContact CE-CZ 4.31Å; M202-F215 HydrophobicContact SD-CB 3.97Å; M202-F215 HydrophobicContact SD-CD2 3.76Å; M202-F215 HydrophobicContact SD-CE2 4.36Å; M202-F215 HydrophobicContact SD-CG 3.86Å; F215-L217 HydrophobicContact CE1-CD2 3.91Å; F215-L217 HydrophobicContact CE1-CG 4.21Å; F215-L217 HydrophobicContact CZ-CD2 3.59Å; F215-L217 HydrophobicContact CZ-CG 4.29Å | ||
| 216 | K | 61.8 | Low | 56.7 | Low | 158 Ų | 158 | 124.4 Ų | 124.4 | 69% | 0.687 | 62% | 0.62 | S | S | * | * | trans | -153.7 | 129.4 | -180 | -163.1 | 177.9 | -174.8 | -175.1 | 0 | 107.4 | E218 | K216-E218 PolarHBondContact O-N 2.98Š| ||
| 217 | L | 63.5 | Low | 56.2 | Low | 34 Ų | 34 | 126.5 Ų | 126.5 | 18% | 0.178 | 63% | 0.632 | C | S | . | * | trans | -73.2 | 124.3 | 175.2 | -75.4 | 178.2 | 0 | 0 | 0 | 110 | D175 F215 E219 K220 | D175-L217 HydrophobicContact CB-CB 4.31Å; D175-L217 HydrophobicContact CB-CD1 3.8Å; D175-L217 HydrophobicContact CB-CG 3.79Å; F215-L217 HydrophobicContact CE1-CD2 3.91Å; F215-L217 HydrophobicContact CE1-CG 4.21Å; F215-L217 HydrophobicContact CZ-CD2 3.59Å; F215-L217 HydrophobicContact CZ-CG 4.29Å; L217-E219 PolarHBondContact O-N 3.08Å; L217-K220 PolarHBondContact O-N 3.35Å | ||
| 218 | E | 61.2 | Low | 55.2 | Low | 168 Ų | 168 | 129 Ų | 129 | 79% | 0.785 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -72.3 | -16.9 | -174.7 | -58.4 | -158.9 | 153.5 | 0 | 0 | 113.6 | K216 K220 A221 | K216-E218 PolarHBondContact O-N 2.98Å; E218-K220 VanDerWaalsContact C-N 3.26Å; E218-K220 PolarHBondContact O-N 3.08Å; E218-A221 VanDerWaalsContact O-CB 3.24Å; E218-A221 WeakPolarHBondContact O-CB 3.5Å; E218-A221 PolarHBondContact O-N 3.17Å |
| 219 | E | 57 | Low | 54 | Low | 169 Ų | 169 | 132 Ų | 132 | 79% | 0.79 | 69% | 0.685 | S | S | * | * | G | 310 helix | trans | -54.7 | -40.8 | 173.2 | -167 | -174.3 | 166.4 | 0 | 0 | 112.1 | L217 A221 | L217-E219 PolarHBondContact O-N 3.08Å; E219-A221 VanDerWaalsContact C-N 3.27Å; E219-A221 PolarHBondContact O-N 2.94Å |
| 220 | K | 52.3 | Low | 53.4 | Low | 143 Ų | 143 | 131.2 Ų | 131.2 | 62% | 0.622 | 70% | 0.695 | S | S | * | * | G | 310 helix | trans | -70.4 | -17.7 | 174.8 | -81.2 | 177.1 | -176.9 | 163.7 | 0 | 113.7 | D175 L217 E218 | D175-K220 IonicContact OD1-NZ 2.74Å; D175-K220 PolarHBondContact OD1-NZ 3.37Å; L217-K220 PolarHBondContact O-N 3.35Å; E218-K220 VanDerWaalsContact C-N 3.26Å; E218-K220 PolarHBondContact O-N 3.08Å |
| 221 | A | 55.3 | Low | 52.6 | Low | 56 Ų | 56 | 125.7 Ų | 125.7 | 46% | 0.463 | 69% | 0.686 | S | S | . | * | G | 310 helix | trans | -73.7 | -33.3 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | E218 E219 K223 | E218-A221 VanDerWaalsContact O-CB 3.24Å; E218-A221 WeakPolarHBondContact O-CB 3.5Å; E218-A221 PolarHBondContact O-N 3.17Å; E219-A221 VanDerWaalsContact C-N 3.27Å; E219-A221 PolarHBondContact O-N 2.94Å; A221-K223 VanDerWaalsContact C-N 3.28Å; A221-K223 PolarHBondContact O-N 3.37Å |
| 222 | K | 51.9 | Low | 51.6 | Low | 202 Ų | 202 | 130.4 Ų | 130.4 | 88% | 0.878 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | -16.5 | -179.3 | -84.7 | -177.7 | 172.6 | 177 | 0 | 114.9 | ||
| 223 | K | 49.1 | Very low | 51.1 | Low | 203 Ų | 203 | 128.1 Ų | 128.1 | 88% | 0.883 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.6 | 6.8 | -178.4 | -148.1 | 173 | -176.6 | 176 | 0 | 114.4 | A221 | A221-K223 VanDerWaalsContact C-N 3.28Å; A221-K223 PolarHBondContact O-N 3.37Å |
| 224 | G | 47.8 | Very low | 49.9 | Very low | 60 Ų | 60 | 123 Ų | 123 | 62% | 0.619 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.6 | -25.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | G226 | G224-G226 PolarHBondContact O-N 2.95Š|
| 225 | N | 44.7 | Very low | 48.9 | Very low | 159 Ų | 159 | 121.6 Ų | 121.6 | 85% | 0.85 | 71% | 0.714 | S | S | * | * | trans | -95.8 | 77.8 | -174 | -75.9 | 24.7 | 0 | 0 | 0 | 111.7 | ||||
| 226 | G | 45.3 | Very low | 47.7 | Very low | 81 Ų | 81 | 126.1 Ų | 126.1 | 84% | 0.835 | 75% | 0.746 | S | S | * | * | trans | -110.3 | 13.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | G224 | G224-G226 PolarHBondContact O-N 2.95Š| ||
| 227 | A | 47.9 | Very low | 46.5 | Very low | 94 Ų | 94 | 121.5 Ų | 121.5 | 78% | 0.777 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -155.5 | 152.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 228 | A | 42.7 | Very low | 45 | Very low | 102 Ų | 102 | 125.8 Ų | 125.8 | 84% | 0.843 | 78% | 0.776 | S | S | * | * | trans | 49.1 | 88.7 | 160.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 229 | S | 37.4 | Very low | 43.9 | Very low | 114 Ų | 114 | 122.1 Ų | 122.1 | 80% | 0.797 | 78% | 0.775 | S | S | * | * | 170.5 | 117.8 | 100.5 | -172.1 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 230 | A | 47.7 | Very low | 42.9 | Very low | 99 Ų | 99 | 120.2 Ų | 120.2 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -134.9 | 98.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 231 | T | 40.1 | Very low | 42.3 | Very low | 107 Ų | 107 | 118.6 Ų | 118.6 | 66% | 0.656 | 78% | 0.782 | S | S | * | * | trans | -142.1 | 81.6 | -178.3 | -62.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 232 | R | 43.3 | Very low | 41.4 | Very low | 208 Ų | 208 | 120.8 Ų | 120.8 | 79% | 0.785 | 80% | 0.799 | S | S | * | * | trans | 42.3 | 138.8 | 137.4 | 62.6 | 179.1 | 173.5 | -159.2 | -3.5 | 123.1 | ||||
| 233 | N | 43.5 | Very low | 40.6 | Very low | 159 Ų | 159 | 115.4 Ų | 115.4 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | trans | 73.5 | 144.4 | 154.8 | -54.1 | -11.5 | 0 | 0 | 0 | 117.7 | ||||
| 234 | G | 33.7 | Very low | 40 | Very low | 72 Ų | 72 | 110.3 Ų | 110.3 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | cis | -168.4 | 146.4 | -8 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 235 | A | 37.7 | Very low | 39.6 | Very low | 106 Ų | 106 | 113 Ų | 113 | 88% | 0.876 | 80% | 0.798 | S | S | * | * | 100.2 | 88.3 | 55.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 236 | V | 38.2 | Very low | 39.2 | Very low | 154 Ų | 154 | 111.4 Ų | 111.4 | 93% | 0.933 | 79% | 0.794 | S | S | * | * | trans | -176.1 | 146.6 | 150.1 | 69.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 237 | G | 35.6 | Very low | 39.4 | Very low | 61 Ų | 61 | 113.5 Ų | 113.5 | 63% | 0.629 | 79% | 0.793 | S | S | * | * | cis | 171.2 | 168.3 | -9.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 238 | S | 33.4 | Very low | 38.8 | Very low | 124 Ų | 124 | 113.2 Ų | 113.2 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | trans | 68 | 118.2 | -179.8 | -132.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 239 | A | 37.4 | Very low | 38.4 | Very low | 91 Ų | 91 | 113 Ų | 113 | 75% | 0.752 | 79% | 0.789 | S | S | * | * | cis | 100.4 | 106.1 | 7.8 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 240 | T | 36 | Very low | 38.2 | Very low | 129 Ų | 129 | 113.5 Ų | 113.5 | 79% | 0.791 | 79% | 0.787 | S | S | * | * | trans | -169.7 | 109.8 | 152 | 39.9 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 241 | S | 40 | Very low | 37.8 | Very low | 110 Ų | 110 | 115.3 Ų | 115.3 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | 61.3 | 133.9 | 84.4 | 69.3 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 242 | A | 36.4 | Very low | 37.6 | Very low | 101 Ų | 101 | 116.1 Ų | 116.1 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | cis | -168.8 | -172 | -14.5 | 0 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 243 | A | 34.8 | Very low | 37.2 | Very low | 90 Ų | 90 | 112.1 Ų | 112.1 | 74% | 0.744 | 79% | 0.791 | S | S | * | * | cis | -161.2 | 160.8 | -0.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 244 | A | 36.8 | Very low | 37.5 | Very low | 96 Ų | 96 | 110.2 Ų | 110.2 | 79% | 0.793 | 79% | 0.788 | S | S | * | * | trans | 64.3 | 159.8 | 157 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 245 | S | 38.2 | Very low | 37.4 | Very low | 115 Ų | 115 | 115.9 Ų | 115.9 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | cis | -143.6 | 148.3 | 6.1 | -57 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 246 | T | 36.5 | Very low | 37 | Very low | 127 Ų | 127 | 115.6 Ų | 115.6 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | trans | -88.2 | 172.5 | 159.8 | -3.2 | 0 | 0 | 0 | 0 | 110.4 | A248 | T246-A248 HydrophobicContact CG2-CB 4.1Š| ||
| 247 | P | 50.2 | Low | 36.7 | Very low | 124 Ų | 124 | 117.1 Ų | 117.1 | 81% | 0.805 | 79% | 0.789 | S | S | * | * | cis | -125.4 | 165.2 | 46.7 | 20.4 | 3.9 | 0 | 0 | 0 | 114.6 | ||||
| 248 | A | 35.3 | Very low | 37.1 | Very low | 88 Ų | 88 | 119.4 Ų | 119.4 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | cis | 98.9 | 101.5 | 16.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | T246 | T246-A248 HydrophobicContact CG2-CB 4.1Š| ||
| 249 | A | 33.6 | Very low | 37.1 | Very low | 98 Ų | 98 | 121.8 Ų | 121.8 | 81% | 0.81 | 79% | 0.791 | S | S | * | * | trans | -179.5 | 154.4 | 152.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 250 | T | 34.2 | Very low | 37.4 | Very low | 125 Ų | 125 | 123 Ų | 123 | 77% | 0.767 | 79% | 0.791 | S | S | * | * | cis | -177.9 | 137.8 | -29.8 | -98.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 251 | V | 38 | Very low | 37.3 | Very low | 137 Ų | 137 | 122.2 Ų | 122.2 | 83% | 0.83 | 79% | 0.786 | S | S | * | * | trans | 69.6 | 144.4 | 157.5 | 146.9 | 0 | 0 | 0 | 0 | 118 | ||||
| 252 | V | 36.3 | Very low | 37.7 | Very low | 124 Ų | 124 | 122.7 Ų | 122.7 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | cis | -158.1 | 172.4 | -7.2 | 96.4 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 253 | T | 35.2 | Very low | 37.6 | Very low | 123 Ų | 123 | 123.9 Ų | 123.9 | 76% | 0.755 | 79% | 0.788 | S | S | * | * | trans | -124.3 | 149.3 | 172 | -42.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 254 | P | 50.6 | Low | 37.6 | Very low | 120 Ų | 120 | 127.3 Ų | 127.3 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | -143.2 | -179.9 | 124.5 | 33 | -15 | 0 | 0 | 0 | 115.3 | |||||
| 255 | Q | 30.3 | Very low | 38.4 | Very low | 191 Ų | 191 | 127.9 Ų | 127.9 | 89% | 0.893 | 79% | 0.785 | S | S | * | * | trans | -105.6 | 162.4 | -170.7 | -53.7 | 149.6 | -99.5 | 0 | 0 | 113.4 | ||||
| 256 | A | 31 | Very low | 38.2 | Very low | 100 Ų | 100 | 129 Ų | 129 | 83% | 0.826 | 78% | 0.777 | S | S | * | * | trans | -177.7 | 168.7 | 137.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 257 | Q | 31.6 | Very low | 38 | Very low | 185 Ų | 185 | 127.7 Ų | 127.7 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | trans | -121.7 | -163.4 | 175.5 | -62.7 | 177 | -88.8 | 0 | 0 | 109.7 | ||||
| 258 | P | 44.2 | Very low | 37.2 | Very low | 110 Ų | 110 | 129.1 Ų | 129.1 | 71% | 0.714 | 78% | 0.775 | S | S | * | * | -131.5 | 159.6 | -69.5 | 37.3 | -21.8 | 0 | 0 | 0 | 116.1 | |||||
| 259 | Q | 32.4 | Very low | 37 | Very low | 174 Ų | 174 | 130.9 Ų | 130.9 | 81% | 0.813 | 78% | 0.782 | S | S | * | * | trans | 59.5 | 168 | 158.6 | -103.5 | -169.2 | -24.3 | 0 | 0 | 118.6 | ||||
| 260 | P | 44.5 | Very low | 36.9 | Very low | 116 Ų | 116 | 129.4 Ų | 129.4 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | cis | -133.5 | -167.6 | 29.5 | 43.3 | -23.7 | 0 | 0 | 0 | 117.7 | ||||
| 261 | T | 32.3 | Very low | 37 | Very low | 113 Ų | 113 | 132.4 Ų | 132.4 | 69% | 0.693 | 78% | 0.782 | S | S | * | * | trans | -76.7 | -178.9 | 170.4 | 40.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 262 | P | 50.2 | Low | 36.8 | Very low | 119 Ų | 119 | 133.3 Ų | 133.3 | 77% | 0.773 | 78% | 0.777 | S | S | * | * | cis | -147.2 | -171.2 | 23.9 | 46 | -25.1 | 0 | 0 | 0 | 118.3 | ||||
| 263 | S | 34 | Very low | 36.8 | Very low | 126 Ų | 126 | 131.9 Ų | 131.9 | 88% | 0.881 | 77% | 0.768 | S | S | * | * | trans | -170.5 | 142.8 | 141.8 | -92.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 264 | E | 34.3 | Very low | 36.7 | Very low | 163 Ų | 163 | 137.1 Ų | 137.1 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | trans | -115.9 | 179.5 | 172.8 | -149 | -163.2 | 103 | 0 | 0 | 109 | E266 | E264-E266 PolarHBondContact OE1-N 3.33Š| ||
| 265 | P | 53 | Low | 35.8 | Very low | 108 Ų | 108 | 134.5 Ų | 134.5 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | -154.8 | 151.9 | 74.4 | 39.5 | -18.1 | 0 | 0 | 0 | 119.4 | |||||
| 266 | E | 33.8 | Very low | 36.2 | Very low | 137 Ų | 137 | 133.7 Ų | 133.7 | 64% | 0.64 | 77% | 0.77 | S | S | * | * | trans | 52.2 | 126.9 | 133.1 | -62.7 | -164.5 | 86.6 | 0 | 0 | 124.5 | E264 Q268 | E264-E266 PolarHBondContact OE1-N 3.33Å; E266-Q268 PolarHBondContact OE1-NE2 3.41Å | ||
| 267 | A | 32.7 | Very low | 36.2 | Very low | 100 Ų | 100 | 136.4 Ų | 136.4 | 83% | 0.826 | 77% | 0.77 | S | S | * | * | 163 | 148.9 | 113.3 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 268 | Q | 33.8 | Very low | 36.4 | Very low | 155 Ų | 155 | 133.5 Ų | 133.5 | 72% | 0.724 | 77% | 0.769 | S | S | * | * | cis | 164.5 | 163.2 | -34.2 | -99.1 | -155.2 | 40.3 | 0 | 0 | 106.3 | E266 | E266-Q268 PolarHBondContact OE1-NE2 3.41Š| ||
| 269 | S | 30.9 | Very low | 35.8 | Very low | 125 Ų | 125 | 132.7 Ų | 132.7 | 87% | 0.874 | 77% | 0.771 | S | S | * | * | trans | 68.3 | 149.4 | -170 | 83.5 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 270 | G | 32.6 | Very low | 36.1 | Very low | 66 Ų | 66 | 129.7 Ų | 129.7 | 68% | 0.68 | 77% | 0.77 | S | S | * | * | cis | 119.1 | 131.8 | 2.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 271 | E | 34.9 | Very low | 36.8 | Very low | 189 Ų | 189 | 129.6 Ų | 129.6 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | cis | -152 | 176.3 | 8.5 | -68.2 | 177.3 | 82.2 | 0 | 0 | 111.9 | ||||
| 272 | E | 34.3 | Very low | 36.8 | Very low | 155 Ų | 155 | 129.7 Ų | 129.7 | 72% | 0.724 | 78% | 0.775 | S | S | * | * | trans | 13.8 | 160.6 | 154 | -116.6 | -161.6 | 90.7 | 0 | 0 | 122.9 | ||||
| 273 | V | 35.3 | Very low | 36.1 | Very low | 94 Ų | 94 | 129.4 Ų | 129.4 | 57% | 0.57 | 78% | 0.775 | S | S | * | * | cis | -167.3 | 133.2 | 49.6 | -179.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 274 | R | 34.3 | Very low | 36.4 | Very low | 234 Ų | 234 | 129.3 Ų | 129.3 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | trans | 53.1 | 156.8 | 156.9 | -62 | 162.8 | -159.5 | 158.1 | 7.1 | 120.7 | ||||
| 275 | G | 31.3 | Very low | 37.5 | Very low | 64 Ų | 64 | 127 Ų | 127 | 66% | 0.66 | 77% | 0.768 | S | S | * | * | cis | 160.9 | 159.3 | -9.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 276 | L | 39.1 | Very low | 36.7 | Very low | 175 Ų | 175 | 132.6 Ų | 132.6 | 92% | 0.916 | 78% | 0.777 | S | S | * | * | trans | 77.3 | 151.9 | -179.9 | -51.8 | 177.3 | 0 | 0 | 0 | 115.9 | ||||
| 277 | D | 31.2 | Very low | 36.5 | Very low | 156 Ų | 156 | 135.3 Ų | 135.3 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | cis | -136.9 | -157.9 | 0.4 | 32 | -92.8 | 0 | 0 | 0 | 114 | ||||
| 278 | C | 35.2 | Very low | 36.7 | Very low | 125 Ų | 125 | 135.8 Ų | 135.8 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -110.3 | 178 | -153.2 | 61 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 279 | A | 31.1 | Very low | 36.8 | Very low | 92 Ų | 92 | 131.9 Ų | 131.9 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | cis | -156.2 | 178.1 | 21 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 280 | S | 40.2 | Very low | 37.1 | Very low | 112 Ų | 112 | 134.2 Ų | 134.2 | 78% | 0.783 | 78% | 0.783 | S | S | * | * | trans | -89.8 | -166.2 | -170.9 | -28.5 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 281 | P | 57.8 | Low | 37 | Very low | 114 Ų | 114 | 139.6 Ų | 139.6 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | cis | -139.5 | -178.6 | -20.9 | 33.3 | -12 | 0 | 0 | 0 | 117 | ||||
| 282 | S | 33.3 | Very low | 37.2 | Very low | 115 Ų | 115 | 138.1 Ų | 138.1 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | 97.1 | 147.3 | 136.6 | 77.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 283 | S | 34.4 | Very low | 38 | Very low | 113 Ų | 113 | 136.7 Ų | 136.7 | 79% | 0.79 | 79% | 0.792 | S | S | * | * | cis | -157.4 | 158.8 | -23.7 | -176.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 284 | T | 41.3 | Very low | 37.8 | Very low | 123 Ų | 123 | 135.9 Ų | 135.9 | 76% | 0.755 | 80% | 0.803 | S | S | * | * | trans | -98.3 | -168.2 | 170.3 | 58.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 285 | P | 56.5 | Low | 38 | Very low | 114 Ų | 114 | 134.2 Ų | 134.2 | 74% | 0.74 | 81% | 0.805 | S | S | * | * | cis | -142.6 | -164.9 | 4.8 | 39.4 | -15.1 | 0 | 0 | 0 | 117.8 | ||||
| 286 | Y | 35.9 | Very low | 38.8 | Very low | 226 Ų | 226 | 139.6 Ų | 139.6 | 89% | 0.886 | 82% | 0.818 | S | S | * | * | trans | -50.4 | 154.8 | 178.9 | -56 | -98.9 | 0 | 0 | 0 | 119.3 | ||||
| 287 | F | 31.4 | Very low | 38.6 | Very low | 195 Ų | 195 | 139.5 Ų | 139.5 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | -177 | -169.5 | 109.9 | -162.5 | -122.7 | 0 | 0 | 0 | 112.7 | |||||
| 288 | T | 36 | Very low | 39 | Very low | 110 Ų | 110 | 139.9 Ų | 139.9 | 68% | 0.675 | 81% | 0.811 | S | S | * | * | trans | -116.8 | 154.6 | -160.2 | 58.8 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 289 | G | 34.9 | Very low | 39.1 | Very low | 73 Ų | 73 | 140 Ų | 140 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | trans | 159.8 | 110.1 | 152 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 290 | L | 38.2 | Very low | 39.9 | Very low | 173 Ų | 173 | 139.3 Ų | 139.3 | 91% | 0.906 | 80% | 0.797 | S | S | * | * | trans | 35.5 | 133.9 | 147.2 | -59.6 | 175.4 | 0 | 0 | 0 | 125 | ||||
| 291 | E | 29.9 | Very low | 40.3 | Very low | 180 Ų | 180 | 139.2 Ų | 139.2 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | 138.6 | 165.3 | 127 | -153.6 | 145.6 | 139.8 | 0 | 0 | 116 | |||||
| 292 | L | 39.3 | Very low | 39.8 | Very low | 158 Ų | 158 | 143.4 Ų | 143.4 | 83% | 0.827 | 80% | 0.797 | S | S | * | * | trans | -101.8 | -178.1 | -161.3 | -98.4 | 70.3 | 0 | 0 | 0 | 113.1 | ||||
| 293 | P | 50.5 | Low | 40.6 | Very low | 124 Ų | 124 | 144.6 Ų | 144.6 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | cis | -130.4 | -178.3 | -28 | 35.6 | -18.5 | 0 | 0 | 0 | 112.7 | ||||
| 294 | G | 32.6 | Very low | 41.4 | Very low | 78 Ų | 78 | 146.7 Ų | 146.7 | 80% | 0.804 | 79% | 0.789 | S | S | * | * | trans | 171.1 | 149.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 295 | E | 37.1 | Very low | 42.1 | Very low | 199 Ų | 199 | 146.4 Ų | 146.4 | 93% | 0.93 | 78% | 0.783 | S | S | * | * | trans | -52.3 | 160.7 | -170.6 | -69.5 | -164.2 | 96.3 | 0 | 0 | 119.9 | ||||
| 296 | L | 48.5 | Very low | 42.5 | Very low | 176 Ų | 176 | 145.4 Ų | 145.4 | 92% | 0.921 | 77% | 0.768 | S | S | * | * | trans | -68.7 | 124.7 | 163.2 | -71.8 | 162.8 | 0 | 0 | 0 | 111.7 | ||||
| 297 | K | 36.1 | Very low | 43.6 | Very low | 174 Ų | 174 | 139.1 Ų | 139.1 | 76% | 0.757 | 76% | 0.755 | S | S | * | * | trans | -140 | 109.3 | 155.4 | -155.2 | 169.8 | -177.4 | 170.5 | 0 | 112 | D299 | K297-D299 WeakPolarHBondContact CD-OD2 3.37Å; K297-D299 WeakPolarHBondContact CE-OD2 3.42Å; K297-D299 WeakPolarHBondContact CG-OD2 3.38Å; K297-D299 PolarHBondContact O-N 2.96Å | ||
| 298 | L | 39.9 | Very low | 45.1 | Very low | 164 Ų | 164 | 137.9 Ų | 137.9 | 86% | 0.859 | 75% | 0.75 | S | S | * | * | trans | -97.8 | 67.7 | -175.5 | -167 | 77.3 | 0 | 0 | 0 | 110.6 | A300 | L298-A300 PolarHBondContact O-N 3.15Š| ||
| 299 | D | 37.1 | Very low | 47 | Very low | 127 Ų | 127 | 133.8 Ų | 133.8 | 68% | 0.679 | 73% | 0.726 | S | S | * | * | trans | -72.6 | 94.1 | 177.4 | -73 | -51.3 | 0 | 0 | 0 | 110.4 | K297 P301 | K297-D299 WeakPolarHBondContact CD-OD2 3.37Å; K297-D299 WeakPolarHBondContact CE-OD2 3.42Å; K297-D299 WeakPolarHBondContact CG-OD2 3.38Å; K297-D299 PolarHBondContact O-N 2.96Å; D299-P301 WeakPolarHBondContact O-CD 3.47Å | ||
| 300 | A | 46.5 | Very low | 48.4 | Very low | 77 Ų | 77 | 136.1 Ų | 136.1 | 64% | 0.636 | 72% | 0.72 | S | S | * | * | trans | -105.1 | 101.6 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112 | L298 Y302 | L298-A300 PolarHBondContact O-N 3.15Å; A300-Y302 VanDerWaalsContact C-N 3.26Å; A300-Y302 PolarHBondContact O-N 3.23Å | ||
| 301 | P | 50 | Low | 50 | Low | 111 Ų | 111 | 133.1 Ų | 133.1 | 72% | 0.721 | 71% | 0.705 | S | S | * | * | trans | -83.5 | 51.1 | -170.9 | 35.6 | -38.6 | 0 | 0 | 0 | 113.8 | D299 | D299-P301 WeakPolarHBondContact O-CD 3.47Š| ||
| 302 | Y | 46.7 | Very low | 51.8 | Low | 202 Ų | 202 | 127.1 Ų | 127.1 | 79% | 0.792 | 68% | 0.678 | S | S | * | * | trans | -132.7 | 57.1 | -176.1 | -68.6 | -69.3 | 0 | 0 | 0 | 114.3 | A300 F304 | A300-Y302 VanDerWaalsContact C-N 3.26Å; A300-Y302 PolarHBondContact O-N 3.23Å; Y302-F304 PolarHBondContact O-N 2.91Å | ||
| 303 | N | 49.4 | Very low | 53.2 | Low | 139 Ų | 139 | 124.9 Ų | 124.9 | 74% | 0.743 | 67% | 0.667 | S | S | * | * | trans | -76.2 | 84.8 | 167.1 | -175 | 26.4 | 0 | 0 | 0 | 111 | N305 | N303-N305 PolarHBondContact O-N 3Š| ||
| 304 | F | 51 | Low | 53.7 | Low | 158 Ų | 158 | 126.2 Ų | 126.2 | 69% | 0.693 | 66% | 0.664 | S | S | * | * | trans | -78.2 | 85.2 | -176.5 | -161.8 | -103.1 | 0 | 0 | 0 | 111.6 | Y302 H306 | Y302-F304 PolarHBondContact O-N 2.91Å; F304-H306 HydrophobicContact CD1-CB 4.03Å; F304-H306 HydrophobicContact CE1-CB 4.1Å; F304-H306 AromaticContact CE1-CD2 3.5Å; F304-H306 VanDerWaalsContact CE1-CD2 3.5Å; F304-H306 WeakPolarHBondContact CE1-CD2 3.47Å; F304-H306 AromaticContact CE1-CG 3.94Å; F304-H306 PolarHBondContact O-N 2.76Å | ||
| 305 | N | 57.5 | Low | 55.1 | Low | 116 Ų | 116 | 126.7 Ų | 126.7 | 62% | 0.62 | 66% | 0.655 | S | S | * | * | trans | -72.4 | 87.7 | -179.8 | -165.4 | -21.1 | 0 | 0 | 0 | 111.5 | N303 N312 | N303-N305 PolarHBondContact O-N 3Å; N305-N312 PolarHBondContact OD1-ND2 3.41Å | ||
| 306 | H | 63.8 | Low | 56.1 | Low | 93 Ų | 93 | 125.2 Ų | 125.2 | 43% | 0.431 | 65% | 0.648 | S | S | . | * | trans | -103.1 | 146 | 174.1 | -142.9 | -111.4 | 0 | 0 | 0 | 109.8 | F304 F308 S309 N312 | F304-H306 HydrophobicContact CD1-CB 4.03Å; F304-H306 HydrophobicContact CE1-CB 4.1Å; F304-H306 AromaticContact CE1-CD2 3.5Å; F304-H306 VanDerWaalsContact CE1-CD2 3.5Å; F304-H306 WeakPolarHBondContact CE1-CD2 3.47Å; F304-H306 AromaticContact CE1-CG 3.94Å; F304-H306 PolarHBondContact O-N 2.76Å; H306-F308 PolarHBondContact O-N 3.35Å; H306-S309 VanDerWaalsContact O-CB 3.28Å; H306-S309 WeakPolarHBondContact O-CB 3.28Å; H306-S309 PolarHBondContact O-N 2.99Å; H306-S309 PolarHBondContact O-OG 3.01Å; H306-N312 PolarHBondContact O-ND2 3.48Å; H306-N312 VanDerWaalsContact O-ND2 3.11Å | ||
| 307 | P | 60.4 | Low | 56.4 | Low | 94 Ų | 94 | 124.8 Ų | 124.8 | 61% | 0.61 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -12.8 | 179.7 | 24 | -35 | 0 | 0 | 0 | 114.4 | ||
| 308 | F | 61.7 | Low | 57.1 | Low | 169 Ų | 169 | 122.4 Ų | 122.4 | 74% | 0.741 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.7 | 20 | 174.1 | -52.9 | -63.7 | 0 | 0 | 0 | 113 | H306 | H306-F308 PolarHBondContact O-N 3.35Š|
| 309 | S | 76.3 | Confident | 57.3 | Low | 25 Ų | 25 | 120.8 Ų | 120.8 | 18% | 0.175 | 64% | 0.641 | C | S | . | * | trans | -66.8 | 146.7 | 172.8 | 66.8 | 0 | 0 | 0 | 0 | 110.8 | H306 N311 N312 L313 | H306-S309 VanDerWaalsContact O-CB 3.28Å; H306-S309 WeakPolarHBondContact O-CB 3.28Å; H306-S309 PolarHBondContact O-N 2.99Å; H306-S309 PolarHBondContact O-OG 3.01Å; S309-N311 PolarHBondContact O-N 3.11Å; S309-N312 PolarHBondContact O-N 2.89Å; S309-N312 VanDerWaalsContact O-N 3.15Å; S309-N312 PolarHBondContact OG-N 3.36Å; S309-N312 PolarHBondContact OG-ND2 2.91Å; S309-L313 WeakPolarHBondContact O-CB 3.21Å; S309-L313 PolarHBondContact O-N 3.06Å | ||
| 310 | I | 64.1 | Low | 57.5 | Low | 121 Ų | 121 | 119 Ų | 119 | 62% | 0.621 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -60.4 | -33.2 | -178 | -63 | 172.3 | 0 | 0 | 0 | 111.1 | L313 M314 | I310-L313 PolarHBondContact O-N 2.87Å; I310-M314 HydrophobicContact CG2-CE 4.38Å; I310-M314 HydrophobicContact CG2-CG 4.2Å; I310-M314 WeakPolarHBondContact O-CB 3.41Å; I310-M314 WeakPolarHBondContact O-CG 3.48Å; I310-M314 PolarHBondContact O-N 2.88Å |
| 311 | N | 72.9 | Confident | 57.4 | Low | 111 Ų | 111 | 121.3 Ų | 121.3 | 59% | 0.594 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -63.7 | -45.3 | 176.8 | -64.6 | -2.5 | 0 | 0 | 0 | 112 | S309 S315 | S309-N311 PolarHBondContact O-N 3.11Å; N311-S315 PolarHBondContact O-N 3.25Å; N311-S315 PolarHBondContact O-OG 2.78Å |
| 312 | N | 66.5 | Low | 56.8 | Low | 53 Ų | 53 | 121.4 Ų | 121.4 | 28% | 0.283 | 66% | 0.656 | S | S | . | * | H | α-helix | trans | -68.3 | -42.8 | 176.1 | -68.1 | -10.5 | 0 | 0 | 0 | 110.8 | N305 H306 S309 M314 S315 E316 | N305-N312 PolarHBondContact OD1-ND2 3.41Å; H306-N312 PolarHBondContact O-ND2 3.48Å; H306-N312 VanDerWaalsContact O-ND2 3.11Å; S309-N312 PolarHBondContact O-N 2.89Å; S309-N312 VanDerWaalsContact O-N 3.15Å; S309-N312 PolarHBondContact OG-N 3.36Å; S309-N312 PolarHBondContact OG-ND2 2.91Å; N312-M314 VanDerWaalsContact C-N 3.31Å; N312-M314 PolarHBondContact O-N 2.63Å; N312-S315 WeakPolarHBondContact O-CB 3.5Å; N312-S315 PolarHBondContact O-N 3.4Å; N312-E316 PolarHBondContact O-N 2.99Å |
| 313 | L | 68.4 | Low | 56.4 | Low | 112 Ų | 112 | 121.1 Ų | 121.1 | 59% | 0.586 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -62.9 | -33.4 | -179.2 | -164.7 | 72.6 | 0 | 0 | 0 | 113.4 | S309 I310 S315 | S309-L313 WeakPolarHBondContact O-CB 3.21Å; S309-L313 PolarHBondContact O-N 3.06Å; I310-L313 PolarHBondContact O-N 2.87Å; L313-S315 VanDerWaalsContact C-N 3.32Å |
| 314 | M | 61.4 | Low | 56.1 | Low | 152 Ų | 152 | 121.9 Ų | 121.9 | 75% | 0.749 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -73 | -23.3 | 172.4 | -71.7 | -76.2 | -165.3 | 0 | 0 | 113 | I310 N312 | I310-M314 HydrophobicContact CG2-CE 4.38Å; I310-M314 HydrophobicContact CG2-CG 4.2Å; I310-M314 WeakPolarHBondContact O-CB 3.41Å; I310-M314 WeakPolarHBondContact O-CG 3.48Å; I310-M314 PolarHBondContact O-N 2.88Å; N312-M314 VanDerWaalsContact C-N 3.31Å; N312-M314 PolarHBondContact O-N 2.63Å |
| 315 | S | 61.7 | Low | 55.6 | Low | 88 Ų | 88 | 121.2 Ų | 121.2 | 62% | 0.615 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -84.6 | -24.8 | -172.9 | -60.7 | 0 | 0 | 0 | 0 | 113.8 | N311 N312 L313 Q317 | N311-S315 PolarHBondContact O-N 3.25Å; N311-S315 PolarHBondContact O-OG 2.78Å; N312-S315 WeakPolarHBondContact O-CB 3.5Å; N312-S315 PolarHBondContact O-N 3.4Å; L313-S315 VanDerWaalsContact C-N 3.32Å; S315-Q317 VanDerWaalsContact C-N 3.3Å; S315-Q317 PolarHBondContact O-N 3.03Å |
| 316 | E | 59.5 | Low | 54.8 | Low | 168 Ų | 168 | 122 Ų | 122 | 79% | 0.785 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 4.9 | -175.6 | -65.2 | -171.1 | 137.9 | 0 | 0 | 114.7 | N312 | N312-E316 PolarHBondContact O-N 2.99Š|
| 317 | Q | 53.9 | Low | 53.4 | Low | 167 Ų | 167 | 120.4 Ų | 120.4 | 78% | 0.78 | 68% | 0.683 | S | S | * | * | trans | -112.2 | 35.2 | -165.9 | -153.5 | 150.1 | 113 | 0 | 0 | 116 | S315 | S315-Q317 VanDerWaalsContact C-N 3.3Å; S315-Q317 PolarHBondContact O-N 3.03Å | ||
| 318 | T | 50.7 | Low | 52 | Low | 124 Ų | 124 | 126 Ų | 126 | 76% | 0.761 | 70% | 0.698 | S | S | * | * | trans | -133.7 | 100.1 | 165.7 | 55.4 | 0 | 0 | 0 | 0 | 112.5 | A320 | T318-A320 PolarHBondContact O-N 3.3Š| ||
| 319 | P | 43.4 | Very low | 50.6 | Low | 130 Ų | 130 | 121.4 Ų | 121.4 | 84% | 0.844 | 70% | 0.698 | S | S | * | * | trans | -74.6 | 110.2 | 165 | 29.9 | -31.1 | 0 | 0 | 0 | 109.4 | ||||
| 320 | A | 43 | Very low | 48.5 | Very low | 90 Ų | 90 | 123.9 Ų | 123.9 | 74% | 0.744 | 73% | 0.728 | S | S | * | * | trans | -68.2 | 141.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | T318 | T318-A320 PolarHBondContact O-N 3.3Š| ||
| 321 | P | 42.5 | Very low | 47.2 | Very low | 125 Ų | 125 | 129 Ų | 129 | 81% | 0.812 | 74% | 0.741 | S | S | * | * | trans | -66.1 | 139.5 | 175.4 | 28.1 | -34.1 | 0 | 0 | 0 | 110.7 | K323 | P321-K323 PolarHBondContact O-N 3.11Å; P321-K323 VanDerWaalsContact O-N 3.09Å | ||
| 322 | S | 38.7 | Very low | 45.4 | Very low | 113 Ų | 113 | 127.7 Ų | 127.7 | 79% | 0.79 | 75% | 0.753 | S | S | * | * | trans | -63.7 | 109.7 | 179.1 | 53.7 | 0 | 0 | 0 | 0 | 111.1 | L324 | S322-L324 PolarHBondContact O-N 3.38Å; S322-L324 VanDerWaalsContact O-N 3.11Å | ||
| 323 | K | 37.8 | Very low | 44 | Very low | 195 Ų | 195 | 129.8 Ų | 129.8 | 85% | 0.848 | 78% | 0.778 | S | S | * | * | trans | -70.7 | 102.6 | 177.2 | -165.1 | -175 | -174.4 | -167.3 | 0 | 109.8 | P321 D325 | P321-K323 PolarHBondContact O-N 3.11Å; P321-K323 VanDerWaalsContact O-N 3.09Å; K323-D325 PolarHBondContact O-N 3.09Å | ||
| 324 | L | 43.7 | Very low | 42.5 | Very low | 155 Ų | 155 | 133.8 Ų | 133.8 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | -70 | 122.5 | 167.2 | -77.4 | 170.4 | 0 | 0 | 0 | 108.9 | S322 | S322-L324 PolarHBondContact O-N 3.38Å; S322-L324 VanDerWaalsContact O-N 3.11Å | ||
| 325 | D | 39.7 | Very low | 41.3 | Very low | 144 Ų | 144 | 130 Ų | 130 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | trans | -87.1 | 112.3 | 172.4 | -159.6 | -98.4 | 0 | 0 | 0 | 109.1 | K323 | K323-D325 PolarHBondContact O-N 3.09Š| ||
| 326 | V | 41 | Very low | 39.9 | Very low | 133 Ų | 133 | 129.7 Ų | 129.7 | 81% | 0.806 | 80% | 0.804 | S | S | * | * | trans | -132.9 | 97.3 | 171.3 | -179.7 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 327 | G | 33.7 | Very low | 39 | Very low | 60 Ų | 60 | 130.7 Ų | 130.7 | 62% | 0.619 | 81% | 0.809 | S | S | * | * | trans | -78.4 | 161.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 328 | F | 31.4 | Very low | 38.9 | Very low | 210 Ų | 210 | 128 Ų | 128 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | trans | 76.4 | 72.3 | 154.9 | -134.6 | -85.2 | 0 | 0 | 0 | 119.8 | ||||
| 329 | G | 33.5 | Very low | 38.2 | Very low | 73 Ų | 73 | 125.7 Ų | 125.7 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | 46.5 | 113.1 | 112.3 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 330 | G | 31.7 | Very low | 38.2 | Very low | 77 Ų | 77 | 126.1 Ų | 126.1 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | -135.5 | 142.7 | 159.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 331 | Y | 37.3 | Very low | 38 | Very low | 230 Ų | 230 | 132 Ų | 132 | 90% | 0.902 | 81% | 0.811 | S | S | * | * | trans | -104.9 | 155 | -171.5 | 44.9 | -94.4 | 0 | 0 | 0 | 112 | ||||
| 332 | G | 33.8 | Very low | 38 | Very low | 82 Ų | 82 | 136.1 Ų | 136.1 | 85% | 0.845 | 81% | 0.812 | S | S | * | * | trans | 156.4 | 120.9 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 333 | A | 36.7 | Very low | 38 | Very low | 97 Ų | 97 | 138.2 Ų | 138.2 | 80% | 0.802 | 81% | 0.809 | S | S | * | * | trans | -130.9 | 144.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 334 | E | 37.4 | Very low | 37.8 | Very low | 196 Ų | 196 | 134.9 Ų | 134.9 | 92% | 0.916 | 80% | 0.801 | S | S | * | * | trans | -172.4 | 165.5 | 147.9 | -106.5 | -50.1 | 132.2 | 0 | 0 | 110 | ||||
| 335 | G | 35.9 | Very low | 37.7 | Very low | 72 Ų | 72 | 135.1 Ų | 135.1 | 74% | 0.742 | 80% | 0.802 | S | S | * | * | trans | -81.5 | 171.8 | -159.5 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 336 | G | 33.7 | Very low | 37.7 | Very low | 82 Ų | 82 | 139.7 Ų | 139.7 | 85% | 0.845 | 81% | 0.81 | S | S | * | * | trans | -174.5 | 123.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 337 | E | 40.2 | Very low | 37.8 | Very low | 189 Ų | 189 | 138.4 Ų | 138.4 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -78.1 | 165.2 | -176.9 | -92 | -77.8 | 99.4 | 0 | 0 | 113.9 | ||||
| 338 | P | 50.4 | Low | 38.1 | Very low | 112 Ų | 112 | 147 Ų | 147 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | trans | -84.6 | 143.4 | -161.5 | 32.9 | -36.1 | 0 | 0 | 0 | 115.6 | ||||
| 339 | G | 36.5 | Very low | 38.5 | Very low | 75 Ų | 75 | 142.2 Ų | 142.2 | 77% | 0.773 | 81% | 0.813 | S | S | * | * | trans | -115.7 | 123.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 340 | V | 42.9 | Very low | 39 | Very low | 138 Ų | 138 | 146.6 Ų | 146.6 | 84% | 0.836 | 82% | 0.818 | S | S | * | * | trans | -83.8 | 121.8 | -178.3 | -178.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 341 | Y | 40.7 | Very low | 39.9 | Very low | 214 Ų | 214 | 151.1 Ų | 151.1 | 84% | 0.839 | 82% | 0.824 | S | S | * | * | trans | -138.7 | 107 | 166.3 | -104.2 | -88.5 | 0 | 0 | 0 | 114.4 | ||||
| 342 | Y | 41 | Very low | 40 | Very low | 211 Ų | 211 | 147.9 Ų | 147.9 | 83% | 0.827 | 82% | 0.822 | S | S | * | * | trans | 59.4 | 126.1 | 157.4 | -83.3 | -97.2 | 0 | 0 | 0 | 122.3 | ||||
| 343 | Q | 38.9 | Very low | 40.4 | Very low | 158 Ų | 158 | 147.9 Ų | 147.9 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | -110.3 | 156.4 | 171.1 | -155.8 | -160.8 | 30.7 | 0 | 0 | 109.4 | ||||
| 344 | N | 34.6 | Very low | 40.8 | Very low | 125 Ų | 125 | 152.8 Ų | 152.8 | 67% | 0.668 | 84% | 0.843 | S | S | * | * | trans | 45.3 | 107.2 | 154.3 | -67.8 | -22 | 0 | 0 | 0 | 120.2 | ||||
| 345 | L | 40.2 | Very low | 40.9 | Very low | 159 Ų | 159 | 150.7 Ų | 150.7 | 83% | 0.832 | 84% | 0.839 | S | S | * | * | trans | -150 | 90.2 | 136.8 | -84.1 | -168.7 | 0 | 0 | 0 | 111.7 | ||||
| 346 | Y | 40.2 | Very low | 41.2 | Very low | 241 Ų | 241 | 154.8 Ų | 154.8 | 95% | 0.945 | 84% | 0.844 | S | S | * | * | trans | -155.8 | 100.2 | 148.9 | -100.3 | -64.9 | 0 | 0 | 0 | 110.2 | ||||
| 347 | S | 42.5 | Very low | 41.6 | Very low | 106 Ų | 106 | 158.8 Ų | 158.8 | 74% | 0.741 | 84% | 0.844 | S | S | * | * | trans | -74.8 | 133 | -174.4 | -52.3 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 348 | R | 40.1 | Very low | 41.7 | Very low | 241 Ų | 241 | 157.1 Ų | 157.1 | 91% | 0.909 | 84% | 0.842 | S | S | * | * | trans | -90.4 | 101.4 | 162.2 | -87.9 | -174.2 | 167.7 | -117.2 | 0.4 | 109.9 | L350 | R348-L350 PolarHBondContact O-N 3.44Š| ||
| 349 | S | 40.3 | Very low | 41.1 | Very low | 108 Ų | 108 | 159.9 Ų | 159.9 | 76% | 0.755 | 85% | 0.849 | S | S | * | * | trans | -69.7 | 111.8 | 170.5 | -56.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 350 | L | 44.5 | Very low | 41.4 | Very low | 165 Ų | 165 | 165.5 Ų | 165.5 | 86% | 0.864 | 85% | 0.854 | S | S | * | * | trans | -101.5 | 112.9 | 160.5 | -70.8 | 175.3 | 0 | 0 | 0 | 107.8 | R348 | R348-L350 PolarHBondContact O-N 3.44Š| ||
| 351 | L | 49.3 | Very low | 41.3 | Very low | 173 Ų | 173 | 167.5 Ų | 167.5 | 91% | 0.906 | 86% | 0.855 | S | S | * | * | trans | -105.9 | 121 | 165.3 | -81.5 | 167.5 | 0 | 0 | 0 | 108 | ||||
| 352 | N | 41 | Very low | 41.4 | Very low | 161 Ų | 161 | 163.9 Ų | 163.9 | 86% | 0.861 | 86% | 0.856 | S | S | * | * | trans | -127 | 153 | 163.7 | -171 | 27.9 | 0 | 0 | 0 | 107.9 | ||||
| 353 | A | 40.5 | Very low | 41.4 | Very low | 82 Ų | 82 | 160 Ų | 160 | 68% | 0.678 | 86% | 0.859 | S | S | * | * | trans | -84.7 | 149 | -165.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 354 | S | 45 | Very low | 41.7 | Very low | 201 Ų | 201 | 160.2 Ų | 160.2 | 100% | 1.406 | 87% | 0.87 | S | S | * | * | trans | -154.3 | 0 | 138.4 | -71 | 0 | 0 | 0 | 0 | 108 |
Retrieved 354 of 354 residues in 51.2 ms
(Link to these results)