| 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 | I | 40.2 | Very low | 43 | Very low | 234 Ų | 234 | 129.4 Ų | 129.4 | 100% | 1.2 | 83% | 0.828 | S | S | * | * | 0 | 113.4 | 0 | -46 | 170.3 | 0 | 0 | 0 | 106.5 | |||||
| 2 | G | 42.7 | Very low | 43 | Very low | 63 Ų | 63 | 132.8 Ų | 132.8 | 65% | 0.649 | 83% | 0.826 | S | S | * | * | cis | -108.3 | -177.7 | -36.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 3 | L | 43.6 | Very low | 42.4 | Very low | 173 Ų | 173 | 133 Ų | 133 | 91% | 0.906 | 82% | 0.818 | S | S | * | * | cis | 50.9 | 122.9 | 46.8 | -59 | 174.3 | 0 | 0 | 0 | 110.6 | ||||
| 4 | T | 44.7 | Very low | 42.6 | Very low | 138 Ų | 138 | 139 Ų | 139 | 85% | 0.847 | 82% | 0.818 | S | S | * | * | cis | -150.8 | -178.6 | 28 | 48.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 5 | A | 41.4 | Very low | 42.1 | Very low | 95 Ų | 95 | 142.5 Ų | 142.5 | 79% | 0.785 | 82% | 0.823 | S | S | * | * | cis | -167.5 | -174.6 | -30.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 6 | A | 41.8 | Very low | 41.9 | Very low | 92 Ų | 92 | 143.3 Ų | 143.3 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | trans | -107.6 | -166.6 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 7 | P | 56 | Low | 43 | Very low | 129 Ų | 129 | 142.1 Ų | 142.1 | 84% | 0.838 | 82% | 0.82 | S | S | * | * | cis | -146.7 | -168.9 | 6.1 | 44.9 | -24 | 0 | 0 | 0 | 117.4 | ||||
| 8 | G | 37.2 | Very low | 42.6 | Very low | 75 Ų | 75 | 139.8 Ų | 139.8 | 77% | 0.773 | 82% | 0.822 | S | S | * | * | trans | 113.8 | 150.4 | 153.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 9 | S | 42.1 | Very low | 42.2 | Very low | 120 Ų | 120 | 140.6 Ų | 140.6 | 84% | 0.839 | 82% | 0.822 | S | S | * | * | cis | -162.1 | 133.5 | -13.6 | -161.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 10 | A | 41.3 | Very low | 42.3 | Very low | 82 Ų | 82 | 142.2 Ų | 142.2 | 68% | 0.678 | 83% | 0.825 | S | S | * | * | trans | 43.2 | 131.8 | 142.5 | 0 | 0 | 0 | 0 | 0 | 125.9 | ||||
| 11 | R | 42.6 | Very low | 42 | Very low | 222 Ų | 222 | 139.7 Ų | 139.7 | 84% | 0.838 | 82% | 0.816 | S | S | * | * | trans | 72.9 | 127.6 | 139.7 | -71.1 | 177.2 | 167.8 | -158.5 | -5.2 | 119.4 | ||||
| 12 | Q | 42.8 | Very low | 41.9 | Very low | 170 Ų | 170 | 137.2 Ų | 137.2 | 79% | 0.794 | 80% | 0.799 | S | S | * | * | 58.2 | 131.8 | 70.6 | -66.5 | 177.6 | -10.8 | 0 | 0 | 112.4 | |||||
| 13 | N | 34.8 | Very low | 41.7 | Very low | 136 Ų | 136 | 141.2 Ų | 141.2 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | cis | -161 | -177.8 | 36.7 | -156.6 | -4.8 | 0 | 0 | 0 | 113.2 | ||||
| 14 | R | 45.2 | Very low | 41.6 | Very low | 217 Ų | 217 | 137.8 Ų | 137.8 | 82% | 0.819 | 81% | 0.807 | S | S | * | * | trans | -71.6 | 148 | -173.6 | -63.2 | 169.4 | -94.3 | -168.6 | -8.7 | 116.5 | ||||
| 15 | H | 35.4 | Very low | 41.6 | Very low | 191 Ų | 191 | 140.1 Ų | 140.1 | 88% | 0.884 | 81% | 0.808 | S | S | * | * | trans | -158.2 | 150.6 | 139.4 | -119.1 | 60.1 | 0 | 0 | 0 | 114.7 | ||||
| 16 | L | 39.5 | Very low | 42.2 | Very low | 155 Ų | 155 | 142.9 Ų | 142.9 | 81% | 0.812 | 81% | 0.809 | S | S | * | * | trans | -128.2 | -176.8 | 167.2 | -76.3 | 172.1 | 0 | 0 | 0 | 106.2 | ||||
| 17 | P | 59.4 | Low | 42.3 | Very low | 123 Ų | 123 | 146.9 Ų | 146.9 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | -125.2 | 176.6 | -50.3 | 37 | -22.6 | 0 | 0 | 0 | 111.7 | |||||
| 18 | A | 36.3 | Very low | 41.8 | Very low | 102 Ų | 102 | 148.3 Ų | 148.3 | 84% | 0.843 | 81% | 0.811 | S | S | * | * | trans | -164.1 | 148.3 | 160 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 19 | D | 35.5 | Very low | 42.4 | Very low | 155 Ų | 155 | 154.2 Ų | 154.2 | 83% | 0.829 | 82% | 0.815 | S | S | * | * | trans | -76.7 | 152.8 | 178.7 | -64.9 | -69.7 | 0 | 0 | 0 | 115.1 | ||||
| 20 | I | 42.8 | Very low | 42.9 | Very low | 172 Ų | 172 | 157.3 Ų | 157.3 | 88% | 0.882 | 81% | 0.814 | S | S | * | * | trans | -142.3 | 132.1 | 147.5 | -59 | -175.2 | 0 | 0 | 0 | 109.7 | ||||
| 21 | S | 37.3 | Very low | 43.1 | Very low | 90 Ų | 90 | 160.5 Ų | 160.5 | 63% | 0.629 | 82% | 0.819 | S | S | * | * | trans | -93.2 | 165.9 | -176.6 | -54.3 | 0 | 0 | 0 | 0 | 115 | ||||
| 22 | H | 37.8 | Very low | 43.4 | Very low | 181 Ų | 181 | 158.4 Ų | 158.4 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | trans | 61.9 | 113.2 | 157.4 | -68.4 | -70 | 0 | 0 | 0 | 120.2 | ||||
| 23 | T | 37.7 | Very low | 43.2 | Very low | 148 Ų | 148 | 157.2 Ų | 157.2 | 91% | 0.908 | 82% | 0.822 | S | S | * | * | trans | -152.1 | 152.4 | 138.4 | 33.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 24 | A | 42.2 | Very low | 43.3 | Very low | 100 Ų | 100 | 158.1 Ų | 158.1 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | trans | 64.3 | 76.2 | 159.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 25 | E | 45.5 | Very low | 43 | Very low | 187 Ų | 187 | 152.9 Ų | 152.9 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | trans | -62.6 | 127.3 | 139.3 | 174.7 | -178.6 | -151.2 | 0 | 0 | 109.5 | ||||
| 26 | I | 52.5 | Low | 43.2 | Very low | 154 Ų | 154 | 151.2 Ų | 151.2 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | trans | 170.5 | 154.7 | 157.9 | -91.8 | 151.5 | 0 | 0 | 0 | 109 | ||||
| 27 | M | 43.7 | Very low | 43.2 | Very low | 175 Ų | 175 | 149.7 Ų | 149.7 | 86% | 0.862 | 81% | 0.812 | S | S | * | * | trans | 72.2 | 126.9 | -178.7 | -31 | -169.5 | 84.8 | 0 | 0 | 115 | ||||
| 28 | M | 46.4 | Very low | 42.4 | Very low | 160 Ų | 160 | 151.2 Ų | 151.2 | 79% | 0.788 | 81% | 0.813 | S | S | * | * | cis | -139.1 | 122.9 | 14.3 | -68.3 | -177.8 | -99.5 | 0 | 0 | 112 | ||||
| 29 | K | 50.5 | Low | 42.3 | Very low | 199 Ų | 199 | 154.3 Ų | 154.3 | 87% | 0.865 | 82% | 0.816 | S | S | * | * | trans | -84.8 | 119.1 | 154.2 | -76.9 | 169.6 | 176.7 | 169.8 | 0 | 107 | ||||
| 30 | K | 52 | Low | 42.9 | Very low | 185 Ų | 185 | 151.4 Ų | 151.4 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | -97 | 98.5 | 175.8 | -106.6 | -178.1 | 175.2 | 177.7 | 0 | 109.1 | ||||
| 31 | D | 44.8 | Very low | 42.8 | Very low | 149 Ų | 149 | 150.5 Ų | 150.5 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -73.7 | 133 | 168.4 | -66.9 | -57.5 | 0 | 0 | 0 | 110.1 | N33 | D31-N33 PolarHBondContact O-N 3.32Š| ||
| 32 | I | 48.7 | Very low | 43.1 | Very low | 177 Ų | 177 | 154 Ų | 154 | 91% | 0.908 | 82% | 0.821 | S | S | * | * | trans | -88.6 | 80.5 | -177.3 | 46.6 | 162.2 | 0 | 0 | 0 | 111 | ||||
| 33 | N | 40.3 | Very low | 43.3 | Very low | 145 Ų | 145 | 154.1 Ų | 154.1 | 78% | 0.775 | 82% | 0.819 | S | S | * | * | trans | -88.1 | 124 | 168.1 | -156.8 | -69.7 | 0 | 0 | 0 | 109.9 | D31 T35 | D31-N33 PolarHBondContact O-N 3.32Å; N33-T35 PolarHBondContact O-N 3.03Å | ||
| 34 | L | 35.8 | Very low | 43.7 | Very low | 156 Ų | 156 | 153 Ų | 153 | 82% | 0.817 | 81% | 0.814 | S | S | * | * | trans | -97.9 | 86.6 | -175.8 | -174.5 | 72.8 | 0 | 0 | 0 | 110.2 | L36 | L34-L36 PolarHBondContact O-N 2.95Š| ||
| 35 | T | 38.1 | Very low | 43.7 | Very low | 106 Ų | 106 | 155.9 Ų | 155.9 | 65% | 0.65 | 81% | 0.81 | S | S | * | * | trans | -81.5 | 112.6 | 170.4 | -42.9 | 0 | 0 | 0 | 0 | 109.5 | N33 V37 | N33-T35 PolarHBondContact O-N 3.03Å; T35-V37 HydrophobicContact CG2-CG2 4.17Å | ||
| 36 | L | 40.6 | Very low | 43.8 | Very low | 157 Ų | 157 | 154.7 Ų | 154.7 | 82% | 0.822 | 81% | 0.809 | S | S | * | * | trans | -71.1 | 126.1 | 165.5 | -79.2 | 154.1 | 0 | 0 | 0 | 108.6 | L34 | L34-L36 PolarHBondContact O-N 2.95Š| ||
| 37 | V | 39.8 | Very low | 43.7 | Very low | 122 Ų | 122 | 157.6 Ų | 157.6 | 74% | 0.739 | 81% | 0.81 | S | S | * | * | trans | -132.3 | 113 | 167.7 | -153.8 | 0 | 0 | 0 | 0 | 106.2 | T35 | T35-V37 HydrophobicContact CG2-CG2 4.17Š| ||
| 38 | D | 42.4 | Very low | 43.6 | Very low | 155 Ų | 155 | 155.1 Ų | 155.1 | 83% | 0.829 | 80% | 0.8 | S | S | * | * | trans | -68.8 | 132.8 | 167.9 | -72.3 | -70.2 | 0 | 0 | 0 | 108.8 | ||||
| 39 | D | 34.8 | Very low | 43.5 | Very low | 167 Ų | 167 | 151 Ų | 151 | 89% | 0.893 | 79% | 0.791 | S | S | * | * | trans | -152.2 | 139 | 152.1 | -113.4 | -39.4 | 0 | 0 | 0 | 110.5 | ||||
| 40 | A | 46.5 | Very low | 43.4 | Very low | 95 Ų | 95 | 149.6 Ų | 149.6 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | -106.2 | 118.2 | -169.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 41 | D | 42.3 | Very low | 43.1 | Very low | 152 Ų | 152 | 145.7 Ų | 145.7 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -168.9 | 136 | 139.9 | -137.6 | -24.5 | 0 | 0 | 0 | 111.1 | ||||
| 42 | L | 43.3 | Very low | 43.1 | Very low | 163 Ų | 163 | 145.8 Ų | 145.8 | 85% | 0.853 | 78% | 0.784 | S | S | * | * | trans | 171.8 | 99.1 | 152.6 | -96.8 | 158.3 | 0 | 0 | 0 | 113.8 | ||||
| 43 | K | 42.1 | Very low | 42.6 | Very low | 185 Ų | 185 | 144.5 Ų | 144.5 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | 61.7 | 131.9 | 144.1 | -119.5 | 71.8 | 177.4 | -176.5 | 0 | 121.2 | ||||
| 44 | P | 46 | Very low | 43.1 | Very low | 123 Ų | 123 | 144.9 Ų | 144.9 | 80% | 0.799 | 78% | 0.78 | S | S | * | * | trans | -96.3 | 102 | -179.1 | 36.1 | -31.5 | 0 | 0 | 0 | 113.6 | ||||
| 45 | H | 42.7 | Very low | 43.2 | Very low | 161 Ų | 161 | 143 Ų | 143 | 75% | 0.745 | 78% | 0.78 | S | S | * | * | trans | -142.1 | 26.8 | 172.3 | -161.6 | 53.2 | 0 | 0 | 0 | 114.1 | ||||
| 46 | L | 47.2 | Very low | 43.9 | Very low | 162 Ų | 162 | 143.6 Ų | 143.6 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | trans | -126.2 | 56.6 | 177.6 | -69.2 | 175.8 | 0 | 0 | 0 | 110.9 | ||||
| 47 | R | 48.8 | Very low | 44 | Very low | 216 Ų | 216 | 142.5 Ų | 142.5 | 82% | 0.815 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -119.3 | -16.4 | 176.1 | -80.1 | -79.4 | 150.7 | 150.2 | -9.6 | 113.9 | ||
| 48 | D | 42.5 | Very low | 44.6 | Very low | 123 Ų | 123 | 145.2 Ų | 145.2 | 66% | 0.658 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -89 | -6 | -175.6 | -54.6 | -55 | 0 | 0 | 0 | 114.2 | ||
| 49 | A | 45 | Very low | 45.3 | Very low | 72 Ų | 72 | 140.4 Ų | 140.4 | 60% | 0.595 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -80.3 | -21.4 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 50 | E | 47.3 | Very low | 46.2 | Very low | 170 Ų | 170 | 140.3 Ų | 140.3 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | G | 310 helix | trans | -87.3 | -9.3 | -175.2 | -61.2 | -160.3 | 130.9 | 0 | 0 | 113.8 | ||
| 51 | S | 46.2 | Very low | 46.3 | Very low | 103 Ų | 103 | 144.6 Ų | 144.6 | 72% | 0.72 | 78% | 0.784 | S | S | * | * | G | 310 helix | trans | -84.7 | -5.5 | 178.4 | -168.1 | 0 | 0 | 0 | 0 | 114.4 | ||
| 52 | L | 45.3 | Very low | 46.8 | Very low | 151 Ų | 151 | 146.1 Ų | 146.1 | 79% | 0.791 | 78% | 0.783 | S | S | * | * | G | 310 helix | trans | -97.7 | -1.4 | -174.8 | -69.4 | 176.1 | 0 | 0 | 0 | 114.6 | ||
| 53 | L | 38.3 | Very low | 47 | Very low | 151 Ų | 151 | 146.1 Ų | 146.1 | 79% | 0.791 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -94.1 | -0.8 | -179.2 | -63.7 | -177.9 | 0 | 0 | 0 | 114.4 | ||
| 54 | N | 50.3 | Low | 47.6 | Very low | 153 Ų | 153 | 142 Ų | 142 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -114.8 | 89 | 177.2 | -72.4 | -16.3 | 0 | 0 | 0 | 110.9 | ||||
| 55 | S | 37.8 | Very low | 47.7 | Very low | 116 Ų | 116 | 140.3 Ų | 140.3 | 81% | 0.811 | 78% | 0.775 | S | S | * | * | trans | -146 | 137 | 159.4 | -165.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 56 | P | 53.1 | Low | 48.5 | Very low | 118 Ų | 118 | 136.5 Ų | 136.5 | 77% | 0.766 | 77% | 0.765 | S | S | * | * | trans | -108.2 | 131.4 | -167.3 | 37.1 | -27.8 | 0 | 0 | 0 | 113.7 | ||||
| 57 | D | 41.8 | Very low | 48.9 | Very low | 135 Ų | 135 | 135.6 Ų | 135.6 | 72% | 0.722 | 76% | 0.756 | S | S | * | * | trans | -155.2 | 127.7 | 150.2 | -161.4 | -8.9 | 0 | 0 | 0 | 111.5 | G59 | D57-G59 WeakPolarHBondContact OD1-CA 3.5Å; D57-G59 PolarHBondContact OD1-N 3.31Å | ||
| 58 | L | 52.1 | Low | 49.5 | Very low | 179 Ų | 179 | 130.9 Ų | 130.9 | 94% | 0.937 | 75% | 0.746 | S | S | * | * | trans | -115.2 | 29.2 | 174.5 | -90.2 | 82.4 | 0 | 0 | 0 | 111.1 | ||||
| 59 | G | 56.9 | Low | 50.2 | Low | 53 Ų | 53 | 131.4 Ų | 131.4 | 55% | 0.546 | 75% | 0.745 | S | S | . | * | trans | -81.7 | -21.9 | -163.5 | 0 | 0 | 0 | 0 | 0 | 119 | D57 | D57-G59 WeakPolarHBondContact OD1-CA 3.5Å; D57-G59 PolarHBondContact OD1-N 3.31Å | ||
| 60 | L | 54.2 | Low | 51.1 | Low | 166 Ų | 166 | 135.4 Ų | 135.4 | 87% | 0.869 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -122.4 | -6.2 | -158.3 | -68.3 | 176.3 | 0 | 0 | 0 | 118.1 | K62 | L60-K62 PolarHBondContact O-N 3.25Å; L60-K62 VanDerWaalsContact O-N 3.17Å |
| 61 | L | 49.1 | Very low | 51.9 | Low | 184 Ų | 184 | 132.8 Ų | 132.8 | 96% | 0.963 | 74% | 0.735 | S | S | * | * | trans | -93.4 | 60.4 | -178.5 | -149.8 | 74.9 | 0 | 0 | 0 | 112.9 | ||||
| 62 | K | 53.2 | Low | 52.7 | Low | 184 Ų | 184 | 132.4 Ų | 132.4 | 80% | 0.8 | 72% | 0.724 | S | S | * | * | trans | -124.4 | 53.8 | -178.4 | -159 | 159 | 179.3 | 172 | 0 | 113.4 | L60 | L60-K62 PolarHBondContact O-N 3.25Å; L60-K62 VanDerWaalsContact O-N 3.17Å | ||
| 63 | L | 47.9 | Very low | 53.5 | Low | 164 Ų | 164 | 130.7 Ų | 130.7 | 86% | 0.859 | 72% | 0.715 | S | S | * | * | trans | -107.5 | 35.6 | 161.2 | -65.6 | -177.1 | 0 | 0 | 0 | 112.2 | S65 | L63-S65 PolarHBondContact O-N 3.41Š| ||
| 64 | A | 54.3 | Low | 54.5 | Low | 98 Ų | 98 | 131 Ų | 131 | 81% | 0.81 | 71% | 0.712 | S | S | * | * | trans | -83.7 | 82.6 | 155.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 65 | S | 47.7 | Very low | 54.7 | Low | 87 Ų | 87 | 127.1 Ų | 127.1 | 61% | 0.608 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -160.6 | 155.2 | 175.6 | -153.7 | 0 | 0 | 0 | 0 | 111.4 | L63 E67 | L63-S65 PolarHBondContact O-N 3.41Å; S65-E67 PolarHBondContact O-N 3.48Å |
| 66 | P | 59.1 | Low | 55.7 | Low | 82 Ų | 82 | 128.4 Ų | 128.4 | 53% | 0.532 | 69% | 0.694 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.8 | 40.8 | -165.4 | -22.3 | 36.2 | 0 | 0 | 0 | 118.4 | R70 | P66-R70 VanDerWaalsContact O-CZ 3.31Å; P66-R70 PolarHBondContact O-NE 2.87Å; P66-R70 PolarHBondContact O-NH2 3.4Å |
| 67 | E | 57 | Low | 55.7 | Low | 143 Ų | 143 | 125.9 Ų | 125.9 | 67% | 0.668 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.8 | -46.9 | 175.9 | -105.7 | -88 | 117.7 | 0 | 0 | 111.2 | S65 E69 R70 L71 | S65-E67 PolarHBondContact O-N 3.48Å; E67-E69 VanDerWaalsContact C-N 3.32Å; E67-E69 PolarHBondContact O-N 3.2Å; E67-R70 PolarHBondContact O-N 2.94Å; E67-R70 VanDerWaalsContact O-N 3.14Å; E67-L71 PolarHBondContact O-N 3.29Å |
| 68 | L | 59.4 | Low | 56.3 | Low | 117 Ų | 117 | 126.8 Ų | 126.8 | 61% | 0.613 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -61.3 | -38.2 | -174.5 | -158.8 | 91.2 | 0 | 0 | 0 | 113 | R70 L71 I72 | L68-R70 VanDerWaalsContact C-N 3.35Å; L68-R70 PolarHBondContact O-N 2.88Å; L68-L71 WeakPolarHBondContact O-CB 3.42Å; L68-L71 PolarHBondContact O-N 2.94Å; L68-I72 HydrophobicContact CD2-CD1 4.36Å; L68-I72 WeakPolarHBondContact O-CG1 3.41Å; L68-I72 PolarHBondContact O-N 3.34Å; L68-I72 VanDerWaalsContact O-N 3.13Å |
| 69 | E | 58.6 | Low | 55.9 | Low | 133 Ų | 133 | 124.1 Ų | 124.1 | 62% | 0.621 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -64.5 | -38.7 | 178.6 | -173.3 | 177.1 | -170.2 | 0 | 0 | 111.9 | E67 I72 I73 | E67-E69 VanDerWaalsContact C-N 3.32Å; E67-E69 PolarHBondContact O-N 3.2Å; E69-I72 PolarHBondContact O-N 3.24Å; E69-I73 HydrophobicContact CG-CD1 4.04Å; E69-I73 WeakPolarHBondContact O-CG1 3.36Å; E69-I73 PolarHBondContact O-N 2.95Å |
| 70 | R | 62.8 | Low | 55.3 | Low | 157 Ų | 157 | 127.7 Ų | 127.7 | 59% | 0.592 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -67.6 | -36.3 | 176.6 | -78.2 | -175.7 | -84.2 | 175.8 | -2.6 | 112 | P66 E67 L68 Q74 | P66-R70 VanDerWaalsContact O-CZ 3.31Å; P66-R70 PolarHBondContact O-NE 2.87Å; P66-R70 PolarHBondContact O-NH2 3.4Å; E67-R70 PolarHBondContact O-N 2.94Å; E67-R70 VanDerWaalsContact O-N 3.14Å; L68-R70 VanDerWaalsContact C-N 3.35Å; L68-R70 PolarHBondContact O-N 2.88Å; R70-Q74 VanDerWaalsContact O-CB 3.31Å; R70-Q74 WeakPolarHBondContact O-CB 3.48Å; R70-Q74 PolarHBondContact O-N 3.25Å |
| 71 | L | 64.9 | Low | 54.8 | Low | 114 Ų | 114 | 125.6 Ų | 125.6 | 60% | 0.597 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -63.6 | -43.6 | 174.3 | -170.9 | 71.8 | 0 | 0 | 0 | 111.8 | E67 L68 Q74 S75 | E67-L71 PolarHBondContact O-N 3.29Å; L68-L71 WeakPolarHBondContact O-CB 3.42Å; L68-L71 PolarHBondContact O-N 2.94Å; L71-Q74 PolarHBondContact O-N 2.86Å; L71-S75 PolarHBondContact O-N 3.45Å; L71-S75 VanDerWaalsContact O-N 3.07Å |
| 72 | I | 62.6 | Low | 54.2 | Low | 95 Ų | 95 | 122.5 Ų | 122.5 | 49% | 0.487 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -65.4 | -47.8 | 179 | -67 | 168.3 | 0 | 0 | 0 | 110.6 | L68 E69 Q74 S75 | L68-I72 HydrophobicContact CD2-CD1 4.36Å; L68-I72 WeakPolarHBondContact O-CG1 3.41Å; L68-I72 PolarHBondContact O-N 3.34Å; L68-I72 VanDerWaalsContact O-N 3.13Å; E69-I72 PolarHBondContact O-N 3.24Å; I72-Q74 VanDerWaalsContact C-N 3.3Å; I72-Q74 PolarHBondContact O-N 3.17Å; I72-S75 PolarHBondContact O-N 2.93Å; I72-S75 VanDerWaalsContact O-N 3.08Å; I72-S75 PolarHBondContact O-OG 2.93Å |
| 73 | I | 61.8 | Low | 53.6 | Low | 116 Ų | 116 | 120.1 Ų | 120.1 | 60% | 0.595 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -60.9 | -39.5 | 178.2 | -66.7 | 167.2 | 0 | 0 | 0 | 111.4 | E69 S75 | E69-I73 HydrophobicContact CG-CD1 4.04Å; E69-I73 WeakPolarHBondContact O-CG1 3.36Å; E69-I73 PolarHBondContact O-N 2.95Å; I73-S75 VanDerWaalsContact C-N 3.3Å; I73-S75 PolarHBondContact O-N 3.22Å |
| 74 | Q | 59.8 | Low | 53.1 | Low | 158 Ų | 158 | 118.4 Ų | 118.4 | 74% | 0.738 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -67.9 | -28.1 | 176.7 | -170.9 | 168.4 | 51.3 | 0 | 0 | 113 | R70 L71 I72 N76 | R70-Q74 VanDerWaalsContact O-CB 3.31Å; R70-Q74 WeakPolarHBondContact O-CB 3.48Å; R70-Q74 PolarHBondContact O-N 3.25Å; L71-Q74 PolarHBondContact O-N 2.86Å; I72-Q74 VanDerWaalsContact C-N 3.3Å; I72-Q74 PolarHBondContact O-N 3.17Å; Q74-N76 PolarHBondContact O-N 3.32Å |
| 75 | S | 55.7 | Low | 52.4 | Low | 70 Ų | 70 | 118.7 Ų | 118.7 | 49% | 0.49 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -74.3 | -20.8 | -178.4 | 74.4 | 0 | 0 | 0 | 0 | 114.7 | L71 I72 I73 G77 | L71-S75 PolarHBondContact O-N 3.45Å; L71-S75 VanDerWaalsContact O-N 3.07Å; I72-S75 PolarHBondContact O-N 2.93Å; I72-S75 VanDerWaalsContact O-N 3.08Å; I72-S75 PolarHBondContact O-OG 2.93Å; I73-S75 VanDerWaalsContact C-N 3.3Å; I73-S75 PolarHBondContact O-N 3.22Å; S75-G77 PolarHBondContact O-N 2.95Å; S75-G77 VanDerWaalsContact O-N 3.07Å |
| 76 | N | 57.3 | Low | 51.9 | Low | 143 Ų | 143 | 119.8 Ų | 119.8 | 77% | 0.765 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | 8.9 | -178.2 | -77.9 | 2 | 0 | 0 | 0 | 114.8 | Q74 | Q74-N76 PolarHBondContact O-N 3.32Š|
| 77 | G | 54.6 | Low | 51.6 | Low | 66 Ų | 66 | 123.4 Ų | 123.4 | 68% | 0.68 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.6 | -9.9 | -174 | 0 | 0 | 0 | 0 | 0 | 117.3 | S75 | S75-G77 PolarHBondContact O-N 2.95Å; S75-G77 VanDerWaalsContact O-N 3.07Å |
| 78 | L | 52.8 | Low | 50.7 | Low | 153 Ų | 153 | 125.5 Ų | 125.5 | 80% | 0.801 | 70% | 0.7 | S | S | * | * | trans | -152.6 | 52.9 | -167.6 | -162.5 | 60.4 | 0 | 0 | 0 | 115.9 | ||||
| 79 | V | 43.4 | Very low | 50.1 | Low | 123 Ų | 123 | 128 Ų | 128 | 75% | 0.745 | 71% | 0.713 | S | S | * | * | trans | -126.1 | 92.3 | 162.8 | -178.3 | 0 | 0 | 0 | 0 | 110.9 | T81 | V79-T81 HydrophobicContact CG1-CG2 4.08Å; V79-T81 PolarHBondContact O-N 3.47Å | ||
| 80 | T | 44.6 | Very low | 49.3 | Very low | 129 Ų | 129 | 131.2 Ų | 131.2 | 79% | 0.791 | 72% | 0.721 | S | S | * | * | trans | -76.7 | 101.5 | 168.2 | 49.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 81 | T | 44.2 | Very low | 48.5 | Very low | 122 Ų | 122 | 129.6 Ų | 129.6 | 75% | 0.748 | 73% | 0.731 | S | S | * | * | trans | -103.5 | 105.4 | 162.6 | 53.3 | 0 | 0 | 0 | 0 | 110.2 | V79 | V79-T81 HydrophobicContact CG1-CG2 4.08Å; V79-T81 PolarHBondContact O-N 3.47Å | ||
| 82 | T | 36 | Very low | 47.7 | Very low | 119 Ų | 119 | 133.2 Ų | 133.2 | 73% | 0.73 | 74% | 0.741 | S | S | * | * | trans | -51.6 | 135.6 | -178.9 | 44.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 83 | P | 40.5 | Very low | 47.1 | Very low | 133 Ų | 133 | 134.4 Ų | 134.4 | 86% | 0.864 | 75% | 0.754 | S | S | * | * | trans | -87.4 | 110.3 | 168.7 | 33.4 | -29.8 | 0 | 0 | 0 | 110.9 | ||||
| 84 | T | 38.2 | Very low | 46.6 | Very low | 129 Ų | 129 | 133 Ų | 133 | 79% | 0.791 | 75% | 0.75 | S | S | * | * | trans | -118 | 120.6 | 169.9 | -59.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 85 | S | 38.6 | Very low | 46.4 | Very low | 103 Ų | 103 | 130.2 Ų | 130.2 | 72% | 0.72 | 74% | 0.744 | S | S | * | * | trans | -50.7 | 135.2 | -176.6 | -177.1 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 86 | S | 38.9 | Very low | 46.6 | Very low | 110 Ų | 110 | 132.5 Ų | 132.5 | 77% | 0.769 | 75% | 0.751 | S | S | * | * | trans | -150.5 | 92.2 | 144.9 | -159.1 | 0 | 0 | 0 | 0 | 112.3 | F88 | S86-F88 PolarHBondContact O-N 3.37Š| ||
| 87 | Q | 51.8 | Low | 46.9 | Very low | 159 Ų | 159 | 132.7 Ų | 132.7 | 74% | 0.743 | 75% | 0.747 | S | S | * | * | trans | 3.4 | 102.2 | 153.7 | -60 | 172.3 | -6.2 | 0 | 0 | 118.6 | ||||
| 88 | F | 38.3 | Very low | 47.2 | Very low | 186 Ų | 186 | 135.2 Ų | 135.2 | 82% | 0.816 | 74% | 0.741 | S | S | * | * | trans | -137.2 | 119 | 141.5 | -85.8 | -81.1 | 0 | 0 | 0 | 109.3 | S86 Y90 | S86-F88 PolarHBondContact O-N 3.37Å; F88-Y90 PolarHBondContact O-N 3.46Å | ||
| 89 | L | 47 | Very low | 47.6 | Very low | 169 Ų | 169 | 135.2 Ų | 135.2 | 89% | 0.885 | 74% | 0.737 | S | S | * | * | trans | -75.7 | 111.4 | 178.7 | -91.1 | 63.7 | 0 | 0 | 0 | 110.1 | ||||
| 90 | Y | 41.7 | Very low | 48.8 | Very low | 202 Ų | 202 | 136.7 Ų | 136.7 | 79% | 0.792 | 73% | 0.734 | S | S | * | * | trans | -121.5 | 127.4 | 160.6 | -81.6 | -84.8 | 0 | 0 | 0 | 108.9 | F88 K92 | F88-Y90 PolarHBondContact O-N 3.46Å; Y90-K92 PolarHBondContact O-N 3.38Å | ||
| 91 | P | 45.8 | Very low | 50.3 | Low | 122 Ų | 122 | 132.9 Ų | 132.9 | 79% | 0.792 | 72% | 0.716 | S | S | * | * | trans | -65.9 | 127.4 | 174.3 | -17.8 | 31.2 | 0 | 0 | 0 | 110.4 | T93 | P91-T93 PolarHBondContact O-N 3.04Š| ||
| 92 | K | 47.8 | Very low | 51.8 | Low | 190 Ų | 190 | 133.1 Ų | 133.1 | 83% | 0.826 | 71% | 0.708 | S | S | * | * | trans | -72.3 | 120.6 | 168.9 | -83.8 | -177.6 | 169.3 | -175.3 | 0 | 110.1 | Y90 V94 | Y90-K92 PolarHBondContact O-N 3.38Å; K92-V94 HydrophobicContact CB-CG2 4.41Å; K92-V94 HydrophobicContact CG-CG2 4.27Å | ||
| 93 | T | 49.5 | Very low | 54.1 | Low | 121 Ų | 121 | 129.6 Ų | 129.6 | 74% | 0.742 | 70% | 0.695 | S | S | * | * | trans | -122.2 | 75.2 | 148.9 | 53.1 | 0 | 0 | 0 | 0 | 107.1 | P91 | P91-T93 PolarHBondContact O-N 3.04Š| ||
| 94 | V | 52.4 | Low | 56 | Low | 86 Ų | 86 | 130 Ų | 130 | 52% | 0.521 | 68% | 0.684 | S | S | . | * | trans | -120.1 | 54.2 | -176.6 | -165.4 | 0 | 0 | 0 | 0 | 108.9 | K92 | K92-V94 HydrophobicContact CB-CG2 4.41Å; K92-V94 HydrophobicContact CG-CG2 4.27Å | ||
| 95 | T | 56.3 | Low | 58.4 | Low | 99 Ų | 99 | 128.8 Ų | 128.8 | 61% | 0.607 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -116.6 | -47.7 | 173.9 | 34.5 | 0 | 0 | 0 | 0 | 109.8 | E97 Q98 E99 | T95-E97 PolarHBondContact O-N 2.89Å; T95-Q98 PolarHBondContact O-N 3.39Å; T95-E99 PolarHBondContact O-N 3.39Å |
| 96 | D | 60 | Low | 60.7 | Low | 119 Ų | 119 | 130.4 Ų | 130.4 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -71 | -31.6 | -170.3 | -52.2 | 18.5 | 0 | 0 | 0 | 112.7 | Q98 F100 | D96-Q98 VanDerWaalsContact C-N 3.34Å; D96-F100 WeakPolarHBondContact O-CB 3.23Å; D96-F100 PolarHBondContact O-N 3.2Å |
| 97 | E | 62.4 | Low | 63.1 | Low | 146 Ų | 146 | 128 Ų | 128 | 68% | 0.682 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -71 | -29.5 | 177.6 | -169.3 | 172.9 | -173 | 0 | 0 | 112.3 | T95 A101 | T95-E97 PolarHBondContact O-N 2.89Å; E97-A101 PolarHBondContact O-N 2.92Å; E97-A101 VanDerWaalsContact O-N 3.12Å |
| 98 | Q | 60.6 | Low | 65 | Low | 119 Ų | 119 | 125.7 Ų | 125.7 | 56% | 0.556 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -72 | -46.7 | 178.4 | -145 | 78 | 33.2 | 0 | 0 | 110.6 | T95 D96 F100 A101 E102 | T95-Q98 PolarHBondContact O-N 3.39Å; D96-Q98 VanDerWaalsContact C-N 3.34Å; Q98-F100 VanDerWaalsContact C-N 3.34Å; Q98-F100 PolarHBondContact O-N 3.19Å; Q98-A101 PolarHBondContact O-N 3.47Å; Q98-E102 WeakPolarHBondContact O-CG 3.38Å; Q98-E102 PolarHBondContact O-N 2.98Å |
| 99 | E | 61.4 | Low | 67.3 | Low | 153 Ų | 153 | 122.1 Ų | 122.1 | 72% | 0.715 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -64 | -37.9 | 175.4 | -116.9 | -178.9 | 179.5 | 0 | 0 | 112 | T95 A101 E102 G103 | T95-E99 PolarHBondContact O-N 3.39Å; E99-A101 PolarHBondContact O-N 2.75Å; E99-E102 PolarHBondContact O-N 3.5Å; E99-G103 PolarHBondContact O-N 3.32Å |
| 100 | F | 68.3 | Low | 69.3 | Low | 154 Ų | 154 | 117.7 Ų | 117.7 | 68% | 0.675 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -61.8 | -41 | 174.5 | -178.3 | -98.4 | 0 | 0 | 0 | 112.4 | D96 Q98 | D96-F100 WeakPolarHBondContact O-CB 3.23Å; D96-F100 PolarHBondContact O-N 3.2Å; Q98-F100 VanDerWaalsContact C-N 3.34Å; Q98-F100 PolarHBondContact O-N 3.19Å |
| 101 | A | 76.1 | Confident | 71.6 | Confident | 50 Ų | 50 | 112.3 Ų | 112.3 | 41% | 0.413 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -69.3 | -41.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | E97 Q98 E99 G103 F104 V105 | E97-A101 PolarHBondContact O-N 2.92Å; E97-A101 VanDerWaalsContact O-N 3.12Å; Q98-A101 PolarHBondContact O-N 3.47Å; E99-A101 PolarHBondContact O-N 2.75Å; A101-G103 VanDerWaalsContact C-N 3.32Å; A101-G103 PolarHBondContact O-N 3.13Å; A101-F104 PolarHBondContact O-N 3.23Å; A101-V105 PolarHBondContact O-N 3.36Å; A101-V105 VanDerWaalsContact O-N 3.16Å |
| 102 | E | 76.1 | Confident | 73.3 | Confident | 127 Ų | 127 | 112.9 Ų | 112.9 | 59% | 0.593 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -61.7 | -38 | 177.7 | -76.3 | -176.5 | -165.8 | 0 | 0 | 112.6 | Q98 E99 F104 V105 K106 | Q98-E102 WeakPolarHBondContact O-CG 3.38Å; Q98-E102 PolarHBondContact O-N 2.98Å; E99-E102 PolarHBondContact O-N 3.5Å; E102-F104 VanDerWaalsContact C-N 3.29Å; E102-F104 PolarHBondContact O-N 3.14Å; E102-V105 PolarHBondContact O-N 3.29Å; E102-K106 VanDerWaalsContact O-CB 3.29Å; E102-K106 WeakPolarHBondContact O-CB 3.41Å; E102-K106 PolarHBondContact O-N 3.43Å |
| 103 | G | 85.3 | Confident | 74.9 | Confident | 44 Ų | 44 | 108.2 Ų | 108.2 | 45% | 0.454 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -57.7 | -39.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | E99 A101 A107 | E99-G103 PolarHBondContact O-N 3.32Å; A101-G103 VanDerWaalsContact C-N 3.32Å; A101-G103 PolarHBondContact O-N 3.13Å; G103-A107 WeakPolarHBondContact O-CB 3.39Å; G103-A107 PolarHBondContact O-N 3.03Å |
| 104 | F | 79.3 | Confident | 76.3 | Confident | 143 Ų | 143 | 108.4 Ų | 108.4 | 63% | 0.627 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -70.7 | -42.7 | 177.3 | -118.6 | -85 | 0 | 0 | 0 | 112.5 | A101 E102 A107 L108 | A101-F104 PolarHBondContact O-N 3.23Å; E102-F104 VanDerWaalsContact C-N 3.29Å; E102-F104 PolarHBondContact O-N 3.14Å; F104-A107 PolarHBondContact O-N 3.02Å; F104-L108 WeakPolarHBondContact O-CG 3.37Å; F104-L108 PolarHBondContact O-N 3.36Å; F104-L108 VanDerWaalsContact O-N 3.12Å |
| 105 | V | 88.3 | Confident | 77.2 | Confident | 102 Ų | 102 | 109.7 Ų | 109.7 | 62% | 0.618 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.6 | -43.5 | 177.1 | 174.8 | 0 | 0 | 0 | 0 | 110.8 | A101 E102 L108 E109 | A101-V105 PolarHBondContact O-N 3.36Å; A101-V105 VanDerWaalsContact O-N 3.16Å; E102-V105 PolarHBondContact O-N 3.29Å; V105-L108 PolarHBondContact O-N 3.07Å; V105-E109 PolarHBondContact O-N 3.49Å |
| 106 | K | 87.1 | Confident | 77.7 | Confident | 138 Ų | 138 | 112 Ų | 112 | 60% | 0.6 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -65 | -43.3 | 178.3 | -172.1 | 177 | -179.5 | -179.4 | 0 | 112.5 | E102 L108 E109 D110 | E102-K106 VanDerWaalsContact O-CB 3.29Å; E102-K106 WeakPolarHBondContact O-CB 3.41Å; E102-K106 PolarHBondContact O-N 3.43Å; K106-L108 VanDerWaalsContact C-N 3.3Å; K106-L108 PolarHBondContact O-N 3.43Å; K106-E109 PolarHBondContact O-N 2.88Å; K106-D110 PolarHBondContact O-N 3.13Å |
| 107 | A | 89.7 | Confident | 77.6 | Confident | 60 Ų | 60 | 113.3 Ų | 113.3 | 50% | 0.496 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.8 | -35.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G103 F104 L111 | G103-A107 WeakPolarHBondContact O-CB 3.39Å; G103-A107 PolarHBondContact O-N 3.03Å; F104-A107 PolarHBondContact O-N 3.02Å; A107-L111 WeakPolarHBondContact O-CB 3.29Å; A107-L111 PolarHBondContact O-N 2.88Å |
| 108 | L | 92.4 | Very high | 77.3 | Confident | 109 Ų | 109 | 112.3 Ų | 112.3 | 57% | 0.571 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67.8 | -40.8 | 172.9 | -75.4 | 168.7 | 0 | 0 | 0 | 112.1 | F104 V105 K106 L111 H112 | F104-L108 WeakPolarHBondContact O-CG 3.37Å; F104-L108 PolarHBondContact O-N 3.36Å; F104-L108 VanDerWaalsContact O-N 3.12Å; V105-L108 PolarHBondContact O-N 3.07Å; K106-L108 VanDerWaalsContact C-N 3.3Å; K106-L108 PolarHBondContact O-N 3.43Å; L108-L111 PolarHBondContact O-N 3.42Å; L108-H112 WeakPolarHBondContact O-CB 3.37Å; L108-H112 PolarHBondContact O-N 3.41Å |
| 109 | E | 86.8 | Confident | 76.6 | Confident | 111 Ų | 111 | 109.8 Ų | 109.8 | 52% | 0.519 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.2 | -42.9 | 175.7 | -169 | -178.8 | -102.5 | 0 | 0 | 112 | V105 K106 H112 K113 | V105-E109 PolarHBondContact O-N 3.49Å; K106-E109 PolarHBondContact O-N 2.88Å; E109-H112 WeakPolarHBondContact O-CB 3.47Å; E109-H112 PolarHBondContact O-N 2.85Å; E109-H112 VanDerWaalsContact O-N 3.14Å; E109-K113 HydrophobicContact CG-CD 4.48Å; E109-K113 WeakPolarHBondContact O-CG 3.48Å; E109-K113 PolarHBondContact O-N 3.45Å; E109-K113 WeakPolarHBondContact OE2-CE 3.43Å; E109-K113 IonicContact OE2-NZ 2.63Å; E109-K113 PolarHBondContact OE2-NZ 2.91Å |
| 110 | D | 89.1 | Confident | 75.5 | Confident | 77 Ų | 77 | 108.7 Ų | 108.7 | 41% | 0.412 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -65.7 | -37.8 | 177.1 | -75.4 | -17.7 | 0 | 0 | 0 | 111.8 | K106 H112 K113 Q114 | K106-D110 PolarHBondContact O-N 3.13Å; D110-H112 VanDerWaalsContact C-N 3.32Å; D110-H112 PolarHBondContact O-N 3.34Å; D110-K113 PolarHBondContact O-N 2.96Å; D110-K113 IonicContact OD1-NZ 3.7Å; D110-Q114 WeakPolarHBondContact O-CB 3.48Å; D110-Q114 PolarHBondContact O-N 3.43Å |
| 111 | L | 88.6 | Confident | 74.5 | Confident | 88 Ų | 88 | 106 Ų | 106 | 46% | 0.461 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.1 | -39.5 | 170.2 | -177.6 | 66 | 0 | 0 | 0 | 111.9 | A107 L108 Q114 N115 | A107-L111 WeakPolarHBondContact O-CB 3.29Å; A107-L111 PolarHBondContact O-N 2.88Å; L108-L111 PolarHBondContact O-N 3.42Å; L111-Q114 PolarHBondContact O-N 2.92Å; L111-N115 PolarHBondContact O-N 3.08Å |
| 112 | H | 81.4 | Confident | 73.1 | Confident | 134 Ų | 134 | 109.6 Ų | 109.6 | 62% | 0.62 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -69.2 | -34 | 178.8 | -133.2 | 176.9 | 0 | 0 | 0 | 112.1 | L108 E109 D110 Q116 | L108-H112 WeakPolarHBondContact O-CB 3.37Å; L108-H112 PolarHBondContact O-N 3.41Å; E109-H112 WeakPolarHBondContact O-CB 3.47Å; E109-H112 PolarHBondContact O-N 2.85Å; E109-H112 VanDerWaalsContact O-N 3.14Å; D110-H112 VanDerWaalsContact C-N 3.32Å; D110-H112 PolarHBondContact O-N 3.34Å; H112-Q116 WeakPolarHBondContact O-CG 3.31Å; H112-Q116 PolarHBondContact O-N 2.7Å; H112-Q116 PolarHBondContact O-NE2 3.34Å |
| 113 | K | 82.1 | Confident | 71.6 | Confident | 92 Ų | 92 | 107.2 Ų | 107.2 | 40% | 0.4 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69.2 | -42.9 | 170.2 | -71.4 | 166.1 | -173.7 | 158.1 | 0 | 111.5 | E109 D110 N115 Q116 L117 | E109-K113 HydrophobicContact CG-CD 4.48Å; E109-K113 WeakPolarHBondContact O-CG 3.48Å; E109-K113 PolarHBondContact O-N 3.45Å; E109-K113 WeakPolarHBondContact OE2-CE 3.43Å; E109-K113 IonicContact OE2-NZ 2.63Å; E109-K113 PolarHBondContact OE2-NZ 2.91Å; D110-K113 PolarHBondContact O-N 2.96Å; D110-K113 IonicContact OD1-NZ 3.7Å; K113-N115 PolarHBondContact O-N 3.22Å; K113-Q116 PolarHBondContact O-N 3.07Å; K113-L117 WeakPolarHBondContact O-CG 3.33Å; K113-L117 PolarHBondContact O-N 3.11Å |
| 114 | Q | 79.1 | Confident | 69.5 | Low | 126 Ų | 126 | 113.2 Ų | 113.2 | 59% | 0.589 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -61.6 | -43.7 | 178.4 | -172.7 | 175.1 | -48.8 | 0 | 0 | 111.7 | D110 L111 Q116 L117 N118 | D110-Q114 WeakPolarHBondContact O-CB 3.48Å; D110-Q114 PolarHBondContact O-N 3.43Å; L111-Q114 PolarHBondContact O-N 2.92Å; Q114-Q116 PolarHBondContact O-N 3.36Å; Q114-L117 PolarHBondContact O-N 2.96Å; Q114-N118 WeakPolarHBondContact O-CB 3.45Å; Q114-N118 PolarHBondContact O-N 3.31Å; Q114-N118 VanDerWaalsContact O-N 3.12Å |
| 115 | N | 70.8 | Confident | 67.6 | Low | 113 Ų | 113 | 110.5 Ų | 110.5 | 60% | 0.604 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -67.2 | -33 | 175 | -95.6 | -23.4 | 0 | 0 | 0 | 113.3 | L111 K113 | L111-N115 PolarHBondContact O-N 3.08Å; K113-N115 PolarHBondContact O-N 3.22Å |
| 116 | Q | 66.6 | Low | 65.2 | Low | 146 Ų | 146 | 111.4 Ų | 111.4 | 68% | 0.682 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -71.6 | -31.3 | 175.7 | -79.6 | 173.3 | 93.3 | 0 | 0 | 113.1 | H112 K113 Q114 | H112-Q116 WeakPolarHBondContact O-CG 3.31Å; H112-Q116 PolarHBondContact O-N 2.7Å; H112-Q116 PolarHBondContact O-NE2 3.34Å; K113-Q116 PolarHBondContact O-N 3.07Å; Q114-Q116 PolarHBondContact O-N 3.36Å |
| 117 | L | 58.7 | Low | 62.9 | Low | 148 Ų | 148 | 113.1 Ų | 113.1 | 78% | 0.775 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -85.7 | -17.9 | 179 | -65.9 | 175.1 | 0 | 0 | 0 | 113.8 | K113 Q114 | K113-L117 WeakPolarHBondContact O-CG 3.33Å; K113-L117 PolarHBondContact O-N 3.11Å; Q114-L117 PolarHBondContact O-N 2.96Å |
| 118 | N | 56 | Low | 60.3 | Low | 124 Ų | 124 | 117.3 Ų | 117.3 | 66% | 0.663 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.9 | 23 | 177.2 | -88.9 | 60.3 | 0 | 0 | 0 | 114.2 | Q114 T120 | Q114-N118 WeakPolarHBondContact O-CB 3.45Å; Q114-N118 PolarHBondContact O-N 3.31Å; Q114-N118 VanDerWaalsContact O-N 3.12Å; N118-T120 VanDerWaalsContact C-N 3.27Å; N118-T120 PolarHBondContact O-N 3.36Å |
| 119 | G | 45.1 | Very low | 57.8 | Low | 67 Ų | 67 | 120.4 Ų | 120.4 | 69% | 0.691 | 70% | 0.701 | S | S | * | * | trans | -70.9 | 58.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 120 | T | 39.9 | Very low | 55.3 | Low | 129 Ų | 129 | 118 Ų | 118 | 79% | 0.791 | 71% | 0.706 | S | S | * | * | trans | -120.7 | 105 | 160.4 | 53.8 | 0 | 0 | 0 | 0 | 110.2 | N118 | N118-T120 VanDerWaalsContact C-N 3.27Å; N118-T120 PolarHBondContact O-N 3.36Å | ||
| 121 | A | 46.4 | Very low | 52.8 | Low | 97 Ų | 97 | 119.2 Ų | 119.2 | 80% | 0.802 | 73% | 0.727 | S | S | * | * | trans | -63.9 | 163.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 122 | P | 46.2 | Very low | 50.6 | Low | 127 Ų | 127 | 122.6 Ų | 122.6 | 83% | 0.825 | 75% | 0.745 | S | S | * | * | -127.3 | 153.4 | 103.8 | 36.2 | -32.3 | 0 | 0 | 0 | 113.8 | |||||
| 123 | A | 45.9 | Very low | 48.8 | Very low | 77 Ų | 77 | 123.7 Ų | 123.7 | 64% | 0.636 | 75% | 0.754 | S | S | * | * | trans | -72.8 | 152.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 124 | N | 40.4 | Very low | 46.9 | Very low | 169 Ų | 169 | 124.2 Ų | 124.2 | 90% | 0.904 | 77% | 0.767 | S | S | * | * | 157.1 | 127.2 | 123.1 | -78.8 | -37.3 | 0 | 0 | 0 | 110.6 | |||||
| 125 | G | 39.3 | Very low | 44.9 | Very low | 86 Ų | 86 | 124.6 Ų | 124.6 | 89% | 0.887 | 78% | 0.78 | S | S | * | * | trans | 158.5 | 50 | 178.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 126 | S | 37.2 | Very low | 43.3 | Very low | 122 Ų | 122 | 125.1 Ų | 125.1 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | trans | -137.4 | 134.5 | 162.4 | -165 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 127 | L | 38.6 | Very low | 42 | Very low | 173 Ų | 173 | 124.3 Ų | 124.3 | 91% | 0.906 | 79% | 0.793 | S | S | * | * | trans | -86.8 | 135.9 | -172.4 | -70.3 | 161.7 | 0 | 0 | 0 | 110.5 | ||||
| 128 | D | 35.1 | Very low | 40.9 | Very low | 148 Ų | 148 | 125 Ų | 125 | 79% | 0.791 | 80% | 0.795 | S | S | * | * | trans | -76.6 | 128.5 | 172.7 | 173.7 | 25.2 | 0 | 0 | 0 | 110.8 | G130 | D128-G130 PolarHBondContact OD1-N 3.49Š| ||
| 129 | L | 40 | Very low | 40 | Very low | 175 Ų | 175 | 126.6 Ų | 126.6 | 92% | 0.916 | 80% | 0.799 | S | S | * | * | trans | -151.7 | 87.6 | 152.1 | -159.4 | 74 | 0 | 0 | 0 | 112.1 | ||||
| 130 | G | 34.7 | Very low | 39.8 | Very low | 60 Ų | 60 | 128.5 Ų | 128.5 | 62% | 0.619 | 80% | 0.799 | S | S | * | * | trans | 90.8 | 88.4 | 134.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | D128 | D128-G130 PolarHBondContact OD1-N 3.49Š| ||
| 131 | A | 36.7 | Very low | 39.4 | Very low | 102 Ų | 102 | 129.3 Ų | 129.3 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | 66.8 | 115.4 | 134.7 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 132 | N | 41.7 | Very low | 39.5 | Very low | 160 Ų | 160 | 131.2 Ų | 131.2 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | 91.4 | 75.3 | 133.6 | -153 | 41.1 | 0 | 0 | 0 | 120.2 | ||||
| 133 | I | 43.6 | Very low | 39.8 | Very low | 156 Ų | 156 | 130.5 Ų | 130.5 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | trans | -137.8 | 137.8 | 159.4 | -53.8 | -179.6 | 0 | 0 | 0 | 108.2 | ||||
| 134 | P | 42.3 | Very low | 40.2 | Very low | 103 Ų | 103 | 132.6 Ų | 132.6 | 67% | 0.669 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 158.5 | 176.4 | 28.1 | -35.8 | 0 | 0 | 0 | 112.8 | V136 | P134-V136 PolarHBondContact O-N 3.3Š|
| 135 | P | 37.6 | Very low | 40 | Very low | 134 Ų | 134 | 134.8 Ų | 134.8 | 87% | 0.87 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 118 | -167.1 | 28.9 | -35.1 | 0 | 0 | 0 | 112.7 | ||
| 136 | V | 37.6 | Very low | 40.1 | Very low | 125 Ų | 125 | 137.1 Ų | 137.1 | 76% | 0.758 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -97.9 | 129.3 | 165.7 | 173.7 | 0 | 0 | 0 | 0 | 108.8 | P134 I138 | P134-V136 PolarHBondContact O-N 3.3Å; V136-I138 PolarHBondContact O-N 3.37Å |
| 137 | T | 39.4 | Very low | 40.6 | Very low | 129 Ų | 129 | 137.4 Ų | 137.4 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 116.6 | 176.2 | -58.4 | 0 | 0 | 0 | 0 | 110.9 | Q139 | T137-Q139 PolarHBondContact O-N 2.77Š|
| 138 | I | 35.2 | Very low | 41.1 | Very low | 161 Ų | 161 | 136.9 Ų | 136.9 | 83% | 0.826 | 78% | 0.778 | S | S | * | * | trans | -83 | 106.7 | 175 | -60.4 | 172.3 | 0 | 0 | 0 | 109 | V136 | V136-I138 PolarHBondContact O-N 3.37Š| ||
| 139 | Q | 37.7 | Very low | 41.8 | Very low | 158 Ų | 158 | 136.5 Ų | 136.5 | 74% | 0.738 | 78% | 0.776 | S | S | * | * | trans | -84.4 | 142.6 | 155.6 | -83.7 | -84.6 | -5.3 | 0 | 0 | 108.6 | T137 D141 | T137-Q139 PolarHBondContact O-N 2.77Å; Q139-D141 PolarHBondContact O-N 3.04Å; Q139-D141 VanDerWaalsContact O-N 3.11Å | ||
| 140 | P | 39.6 | Very low | 42.1 | Very low | 107 Ų | 107 | 133.5 Ų | 133.5 | 70% | 0.695 | 77% | 0.769 | S | S | * | * | trans | -77.3 | 96.2 | 176.9 | 31.2 | -32.7 | 0 | 0 | 0 | 110.2 | ||||
| 141 | D | 33.2 | Very low | 42.7 | Very low | 146 Ų | 146 | 141.7 Ų | 141.7 | 78% | 0.781 | 78% | 0.783 | S | S | * | * | trans | -78.4 | 139.7 | -179.1 | -154.5 | 6.5 | 0 | 0 | 0 | 112.1 | Q139 | Q139-D141 PolarHBondContact O-N 3.04Å; Q139-D141 VanDerWaalsContact O-N 3.11Å | ||
| 142 | L | 47.5 | Very low | 43.1 | Very low | 137 Ų | 137 | 140.1 Ų | 140.1 | 72% | 0.717 | 78% | 0.777 | S | S | * | * | trans | -80.2 | 156.3 | 178.3 | -92.4 | 69.4 | 0 | 0 | 0 | 110.4 | V144 | L142-V144 PolarHBondContact O-N 2.96Š| ||
| 143 | P | 52.1 | Low | 43.3 | Very low | 113 Ų | 113 | 138.7 Ų | 138.7 | 73% | 0.734 | 78% | 0.779 | S | S | * | * | trans | -64.4 | 112.9 | -179.6 | 25.4 | -33.8 | 0 | 0 | 0 | 112.1 | Y145 | P143-Y145 PolarHBondContact O-N 3.2Š| ||
| 144 | V | 54 | Low | 43.3 | Very low | 121 Ų | 121 | 134.4 Ų | 134.4 | 73% | 0.733 | 77% | 0.774 | S | S | * | * | trans | -66.4 | 114.2 | 178.5 | 177.6 | 0 | 0 | 0 | 0 | 111 | L142 | L142-V144 PolarHBondContact O-N 2.96Š| ||
| 145 | Y | 36.9 | Very low | 43.6 | Very low | 215 Ų | 215 | 136 Ų | 136 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | trans | -77.5 | 127.9 | 169.4 | -87.6 | -96 | 0 | 0 | 0 | 111.3 | P143 N147 | P143-Y145 PolarHBondContact O-N 3.2Å; Y145-N147 PolarHBondContact O-N 3.42Å; Y145-N147 VanDerWaalsContact O-N 3.14Å | ||
| 146 | T | 40.7 | Very low | 43.8 | Very low | 134 Ų | 134 | 137 Ų | 137 | 82% | 0.822 | 78% | 0.781 | S | S | * | * | trans | -74.5 | 99.5 | 178.1 | 45.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 147 | N | 48 | Very low | 44.4 | Very low | 128 Ų | 128 | 134.7 Ų | 134.7 | 68% | 0.684 | 78% | 0.784 | S | S | * | * | trans | -81.8 | 127 | 171.6 | -167.1 | -61.9 | 0 | 0 | 0 | 111.1 | Y145 N149 | Y145-N147 PolarHBondContact O-N 3.42Å; Y145-N147 VanDerWaalsContact O-N 3.14Å; N147-N149 WeakPolarHBondContact OD1-CB 3.49Å; N147-N149 PolarHBondContact OD1-N 2.89Å; N147-N149 VanDerWaalsContact OD1-N 3.12Å | ||
| 148 | L | 50.5 | Low | 44.5 | Very low | 162 Ų | 162 | 134 Ų | 134 | 85% | 0.848 | 78% | 0.779 | S | S | * | * | trans | -98.8 | 20.3 | -170.8 | -148.4 | 74 | 0 | 0 | 0 | 114.5 | S150 | L148-S150 PolarHBondContact O-N 3.27Š| ||
| 149 | N | 48.3 | Very low | 44.7 | Very low | 141 Ų | 141 | 133 Ų | 133 | 75% | 0.754 | 78% | 0.781 | S | S | * | * | trans | -83.4 | -0.1 | -176.1 | -83.4 | 19.5 | 0 | 0 | 0 | 115.9 | N147 Y151 | N147-N149 WeakPolarHBondContact OD1-CB 3.49Å; N147-N149 PolarHBondContact OD1-N 2.89Å; N147-N149 VanDerWaalsContact OD1-N 3.12Å; N149-Y151 VanDerWaalsContact C-N 3.32Å; N149-Y151 PolarHBondContact O-N 3.37Å; N149-Y151 VanDerWaalsContact O-N 3.13Å | ||
| 150 | S | 46.4 | Very low | 45 | Very low | 111 Ų | 111 | 130.7 Ų | 130.7 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | trans | -82.2 | 15.5 | -164.6 | -160.5 | 0 | 0 | 0 | 0 | 117.3 | L148 | L148-S150 PolarHBondContact O-N 3.27Š| ||
| 151 | Y | 46.9 | Very low | 44.8 | Very low | 233 Ų | 233 | 132.6 Ų | 132.6 | 91% | 0.914 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -123.4 | 73.2 | 176.8 | -70.4 | -77.1 | 0 | 0 | 0 | 111.5 | N149 | N149-Y151 VanDerWaalsContact C-N 3.32Å; N149-Y151 PolarHBondContact O-N 3.37Å; N149-Y151 VanDerWaalsContact O-N 3.13Å |
| 152 | G | 45 | Very low | 44.8 | Very low | 69 Ų | 69 | 135.2 Ų | 135.2 | 71% | 0.711 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -161.6 | 6.4 | -174.1 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||
| 153 | S | 46.2 | Very low | 44.1 | Very low | 129 Ų | 129 | 134 Ų | 134 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | trans | -147.2 | 83.9 | 179 | -70.8 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 154 | G | 44.3 | Very low | 43.3 | Very low | 67 Ų | 67 | 134.4 Ų | 134.4 | 69% | 0.691 | 79% | 0.785 | S | S | * | * | trans | -108.7 | 138 | 164.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | L156 | G154-L156 PolarHBondContact O-N 3.39Š| ||
| 155 | P | 48 | Very low | 42.4 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 89% | 0.89 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -83.7 | 83.3 | -172.3 | 33.7 | -35.3 | 0 | 0 | 0 | 111.9 | ||
| 156 | L | 42.9 | Very low | 42.7 | Very low | 153 Ų | 153 | 130.5 Ų | 130.5 | 80% | 0.801 | 78% | 0.779 | S | S | * | * | trans | -148.7 | 119.8 | 157.3 | -161.6 | 61.5 | 0 | 0 | 0 | 111.1 | G154 T158 | G154-L156 PolarHBondContact O-N 3.39Å; L156-T158 PolarHBondContact O-N 2.9Å | ||
| 157 | G | 49.3 | Very low | 42.7 | Very low | 78 Ų | 78 | 129.8 Ų | 129.8 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -71.8 | 108.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 158 | T | 41.4 | Very low | 42.3 | Very low | 113 Ų | 113 | 129.7 Ų | 129.7 | 69% | 0.693 | 78% | 0.781 | S | S | * | * | trans | -124.6 | 97.1 | 159.9 | 47.4 | 0 | 0 | 0 | 0 | 109.6 | L156 V160 | L156-T158 PolarHBondContact O-N 2.9Å; T158-V160 PolarHBondContact O-N 2.91Å | ||
| 159 | T | 40.8 | Very low | 41.7 | Very low | 142 Ų | 142 | 131.3 Ų | 131.3 | 87% | 0.871 | 78% | 0.782 | S | S | * | * | trans | -73 | 91.4 | 175.1 | 57.2 | 0 | 0 | 0 | 0 | 109.7 | N161 | T159-N161 PolarHBondContact O-N 3.14Å; T159-N161 VanDerWaalsContact O-N 3.16Å | ||
| 160 | V | 42.6 | Very low | 42 | Very low | 108 Ų | 108 | 129.1 Ų | 129.1 | 66% | 0.655 | 78% | 0.775 | S | S | * | * | trans | -82.2 | 94.3 | 174.7 | -161 | 0 | 0 | 0 | 0 | 108.4 | T158 Y162 | T158-V160 PolarHBondContact O-N 2.91Å; V160-Y162 WeakPolarHBondContact O-CD1 3.45Å; V160-Y162 VanDerWaalsContact O-CE1 3.23Å; V160-Y162 WeakPolarHBondContact O-CE1 3.35Å; V160-Y162 PolarHBondContact O-N 3.41Å; V160-Y162 VanDerWaalsContact O-N 3.17Å | ||
| 161 | N | 35.4 | Very low | 42.4 | Very low | 148 Ų | 148 | 129.4 Ų | 129.4 | 79% | 0.791 | 77% | 0.774 | S | S | * | * | trans | -69.4 | 109 | 178.5 | -169.9 | 21.5 | 0 | 0 | 0 | 110.2 | T159 | T159-N161 PolarHBondContact O-N 3.14Å; T159-N161 VanDerWaalsContact O-N 3.16Å | ||
| 162 | Y | 34.3 | Very low | 42.5 | Very low | 201 Ų | 201 | 123.8 Ų | 123.8 | 79% | 0.788 | 77% | 0.766 | S | S | * | * | trans | -96.5 | 105.3 | 173.4 | 21.9 | -98.8 | 0 | 0 | 0 | 110.2 | V160 T164 | V160-Y162 WeakPolarHBondContact O-CD1 3.45Å; V160-Y162 VanDerWaalsContact O-CE1 3.23Å; V160-Y162 WeakPolarHBondContact O-CE1 3.35Å; V160-Y162 PolarHBondContact O-N 3.41Å; V160-Y162 VanDerWaalsContact O-N 3.17Å; Y162-T164 PolarHBondContact O-N 3.47Å; Y162-T164 VanDerWaalsContact O-N 3.13Å | ||
| 163 | S | 32.4 | Very low | 42.5 | Very low | 111 Ų | 111 | 126.1 Ų | 126.1 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | trans | -60.5 | 114.2 | 166.3 | -59.4 | 0 | 0 | 0 | 0 | 109.7 | D165 | S163-D165 PolarHBondContact O-N 3.41Š| ||
| 164 | T | 35.9 | Very low | 42.3 | Very low | 121 Ų | 121 | 125.1 Ų | 125.1 | 74% | 0.742 | 76% | 0.762 | S | S | * | * | trans | -79.5 | 92 | 171.1 | 175.7 | 0 | 0 | 0 | 0 | 109.5 | Y162 T166 | Y162-T164 PolarHBondContact O-N 3.47Å; Y162-T164 VanDerWaalsContact O-N 3.13Å; T164-T166 PolarHBondContact O-N 2.92Å; T164-T166 VanDerWaalsContact O-N 3.12Å | ||
| 165 | D | 35.2 | Very low | 41.9 | Very low | 139 Ų | 139 | 131.3 Ų | 131.3 | 74% | 0.743 | 77% | 0.772 | S | S | * | * | trans | -78.6 | 94.7 | 176.5 | -154.1 | -23.1 | 0 | 0 | 0 | 109.9 | S163 V167 | S163-D165 PolarHBondContact O-N 3.41Å; D165-V167 PolarHBondContact O-N 3.25Å | ||
| 166 | T | 41.3 | Very low | 41.5 | Very low | 115 Ų | 115 | 133.1 Ų | 133.1 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | -78.2 | 81.5 | -179.5 | 50.8 | 0 | 0 | 0 | 0 | 110.6 | T164 P168 | T164-T166 PolarHBondContact O-N 2.92Å; T164-T166 VanDerWaalsContact O-N 3.12Å; T166-P168 VanDerWaalsContact O-CD 3.27Å; T166-P168 WeakPolarHBondContact O-CD 3.32Å | ||
| 167 | V | 42.2 | Very low | 41.4 | Very low | 120 Ų | 120 | 134.5 Ų | 134.5 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 118.2 | 169.6 | -80 | 0 | 0 | 0 | 0 | 111.2 | D165 F169 | D165-V167 PolarHBondContact O-N 3.25Å; V167-F169 PolarHBondContact O-N 2.87Å |
| 168 | P | 38.8 | Very low | 40.6 | Very low | 126 Ų | 126 | 134.6 Ų | 134.6 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 128.1 | 174.4 | -18.8 | 33.8 | 0 | 0 | 0 | 110.8 | T166 | T166-P168 VanDerWaalsContact O-CD 3.27Å; T166-P168 WeakPolarHBondContact O-CD 3.32Å |
| 169 | F | 37.3 | Very low | 40.3 | Very low | 196 Ų | 196 | 134 Ų | 134 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 127.5 | 178.4 | -158.1 | -89.2 | 0 | 0 | 0 | 109.9 | V167 | V167-F169 PolarHBondContact O-N 2.87Š|
| 170 | P | 55.3 | Low | 40.1 | Very low | 95 Ų | 95 | 131.8 Ų | 131.8 | 62% | 0.617 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -74.7 | 144.7 | 176.6 | 30.7 | -33.7 | 0 | 0 | 0 | 111 | ||
| 171 | P | 54.9 | Low | 40.4 | Very low | 117 Ų | 117 | 131.9 Ų | 131.9 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 155.2 | 177.9 | 29.7 | -34.9 | 0 | 0 | 0 | 112.1 | ||
| 172 | P | 49.1 | Very low | 40.4 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 149.9 | 178.6 | 30 | -35.4 | 0 | 0 | 0 | 112 | ||
| 173 | P | 45.9 | Very low | 40.7 | Very low | 117 Ų | 117 | 130.4 Ų | 130.4 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 136.9 | -177.1 | 30.6 | -34.7 | 0 | 0 | 0 | 112.6 | ||
| 174 | S | 41.5 | Very low | 41.4 | Very low | 108 Ų | 108 | 129.5 Ų | 129.5 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -71 | 125.4 | 171.4 | -53.8 | 0 | 0 | 0 | 0 | 111.2 | H176 | S174-H176 PolarHBondContact O-N 3.45Š|
| 175 | H | 36.6 | Very low | 41.2 | Very low | 198 Ų | 198 | 131.3 Ų | 131.3 | 92% | 0.917 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 119.2 | 169.4 | -70 | -87.8 | 0 | 0 | 0 | 109.8 | ||
| 176 | H | 38.6 | Very low | 41.2 | Very low | 174 Ų | 174 | 131 Ų | 131 | 81% | 0.806 | 77% | 0.771 | S | S | * | * | trans | -116.3 | 143.6 | 172.1 | 62.3 | -77.7 | 0 | 0 | 0 | 109.8 | S174 | S174-H176 PolarHBondContact O-N 3.45Š| ||
| 177 | L | 40.1 | Very low | 40.9 | Very low | 183 Ų | 183 | 130.6 Ų | 130.6 | 96% | 0.958 | 77% | 0.773 | S | S | * | * | trans | -79.9 | 138.8 | -177.8 | -68 | 154.9 | 0 | 0 | 0 | 110.4 | ||||
| 178 | G | 32.5 | Very low | 40.5 | Very low | 80 Ų | 80 | 135.9 Ų | 135.9 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -169.8 | 142.3 | 176 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 179 | A | 35 | Very low | 40.4 | Very low | 101 Ų | 101 | 135.8 Ų | 135.8 | 84% | 0.835 | 78% | 0.777 | S | S | * | * | trans | -116.1 | 143.8 | -158.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 180 | A | 37.3 | Very low | 40.5 | Very low | 95 Ų | 95 | 135 Ų | 135 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | trans | 57.3 | 166.5 | 147 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 181 | P | 49.6 | Very low | 40.1 | Very low | 110 Ų | 110 | 136 Ų | 136 | 71% | 0.714 | 78% | 0.782 | S | S | * | * | cis | -133.4 | 157.9 | 4.6 | 17.9 | 8.6 | 0 | 0 | 0 | 118.8 | ||||
| 182 | L | 34.1 | Very low | 40.3 | Very low | 155 Ų | 155 | 135.7 Ų | 135.7 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | trans | 66.1 | 168.9 | 150.9 | -61.9 | 168.6 | 0 | 0 | 0 | 117.4 | ||||
| 183 | Q | 40.9 | Very low | 39.5 | Very low | 162 Ų | 162 | 138.5 Ų | 138.5 | 76% | 0.757 | 78% | 0.781 | S | S | * | * | cis | -168.4 | 171.8 | -21 | -97.5 | -116.2 | -29 | 0 | 0 | 107.2 | ||||
| 184 | P | 47.3 | Very low | 39.2 | Very low | 93 Ų | 93 | 139.5 Ų | 139.5 | 60% | 0.604 | 78% | 0.776 | S | S | * | * | cis | -133.9 | -170.3 | -40.9 | 38.3 | -19.4 | 0 | 0 | 0 | 115 | ||||
| 185 | E | 32.2 | Very low | 39.1 | Very low | 159 Ų | 159 | 142.7 Ų | 142.7 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | trans | 75.6 | 130.8 | 167.3 | -58.7 | -80.8 | 105.5 | 0 | 0 | 118.6 | ||||
| 186 | L | 35.3 | Very low | 39.8 | Very low | 132 Ų | 132 | 138.5 Ų | 138.5 | 69% | 0.691 | 77% | 0.769 | S | S | * | * | cis | -161 | 162.9 | -9.7 | -128.7 | -172.2 | 0 | 0 | 0 | 112.2 | ||||
| 187 | S | 35.4 | Very low | 40.3 | Very low | 107 Ų | 107 | 138.9 Ų | 138.9 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | trans | 74.8 | 135.7 | 166.4 | -58.6 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 188 | R | 33.2 | Very low | 40.3 | Very low | 230 Ų | 230 | 136.3 Ų | 136.3 | 87% | 0.868 | 76% | 0.763 | S | S | * | * | cis | -157.8 | 122.1 | 13.2 | -175.1 | 171.5 | 176.2 | 119.3 | -1.8 | 114.1 | ||||
| 189 | V | 36.6 | Very low | 41.2 | Very low | 125 Ų | 125 | 138.9 Ų | 138.9 | 76% | 0.758 | 76% | 0.762 | S | S | * | * | trans | 52.7 | 116 | 146.9 | -174.6 | 0 | 0 | 0 | 0 | 122 | ||||
| 190 | Q | 40.2 | Very low | 42 | Very low | 179 Ų | 179 | 140 Ų | 140 | 84% | 0.836 | 76% | 0.761 | S | S | * | * | trans | -117.9 | 172 | 133.8 | -63.5 | -174.3 | 5.4 | 0 | 0 | 108 | ||||
| 191 | P | 45.6 | Very low | 42.3 | Very low | 116 Ų | 116 | 142.2 Ų | 142.2 | 75% | 0.753 | 76% | 0.759 | S | S | * | * | -155.6 | -157.1 | 93.1 | 46.6 | -24.7 | 0 | 0 | 0 | 113.6 | |||||
| 192 | P | 58.9 | Low | 42.5 | Very low | 111 Ų | 111 | 142.4 Ų | 142.4 | 72% | 0.721 | 76% | 0.758 | S | S | * | * | -140 | -179.4 | -102.7 | 41.8 | -20.2 | 0 | 0 | 0 | 117.8 | |||||
| 193 | K | 33.7 | Very low | 43.3 | Very low | 174 Ų | 174 | 143.7 Ų | 143.7 | 76% | 0.757 | 76% | 0.76 | S | S | * | * | trans | 150.1 | 122.2 | 142.4 | -87.4 | -166.4 | 170.6 | -116.3 | 0 | 111.9 | ||||
| 194 | E | 39 | Very low | 43.6 | Very low | 138 Ų | 138 | 142 Ų | 142 | 65% | 0.645 | 77% | 0.766 | S | S | * | * | 89 | 84.3 | 66.2 | -169.7 | -179.2 | -164.8 | 0 | 0 | 111.2 | |||||
| 195 | E | 39.4 | Very low | 43.9 | Very low | 175 Ų | 175 | 146.8 Ų | 146.8 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | 95.6 | 148.6 | 102.1 | -168.4 | 176.1 | 155.7 | 0 | 0 | 111.8 | |||||
| 196 | P | 49.9 | Very low | 44.7 | Very low | 109 Ų | 109 | 142.5 Ų | 142.5 | 71% | 0.708 | 78% | 0.776 | S | S | * | * | cis | -122.7 | 171.7 | 6.3 | 18 | 8 | 0 | 0 | 0 | 118.7 | ||||
| 197 | Q | 49.2 | Very low | 45.2 | Very low | 183 Ų | 183 | 145.1 Ų | 145.1 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | -27.1 | 125.3 | 160.7 | -178.7 | 175.4 | -0.9 | 0 | 0 | 117.7 | ||||
| 198 | T | 40.8 | Very low | 45.8 | Very low | 129 Ų | 129 | 144.4 Ų | 144.4 | 79% | 0.791 | 78% | 0.78 | S | S | * | * | trans | -148.4 | 132.6 | 147.5 | -58.8 | 0 | 0 | 0 | 0 | 107.7 | P200 | T198-P200 VanDerWaalsContact O-CD 3.3Å; T198-P200 WeakPolarHBondContact O-CD 3.35Å | ||
| 199 | V | 50.9 | Low | 47 | Very low | 133 Ų | 133 | 138.4 Ų | 138.4 | 81% | 0.806 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 122.1 | 177.4 | -97.9 | 0 | 0 | 0 | 0 | 110.7 | ||
| 200 | P | 51.5 | Low | 47.4 | Very low | 124 Ų | 124 | 137.6 Ų | 137.6 | 81% | 0.805 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 134 | 162.7 | -6.7 | 27.9 | 0 | 0 | 0 | 109.8 | T198 | T198-P200 VanDerWaalsContact O-CD 3.3Å; T198-P200 WeakPolarHBondContact O-CD 3.35Å |
| 201 | D | 43.9 | Very low | 48.1 | Very low | 142 Ų | 142 | 136.5 Ų | 136.5 | 76% | 0.759 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 173.1 | -167.5 | -158.5 | 4.1 | 0 | 0 | 0 | 115.4 | Q203 | D201-Q203 PolarHBondContact O-N 2.96Š|
| 202 | V | 53.4 | Low | 48.7 | Very low | 114 Ų | 114 | 135 Ų | 135 | 69% | 0.691 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -65.1 | 82.9 | -175.8 | -175.8 | 0 | 0 | 0 | 0 | 112.3 | ||
| 203 | Q | 52.3 | Low | 49 | Very low | 183 Ų | 183 | 136 Ų | 136 | 86% | 0.855 | 77% | 0.766 | S | S | * | * | trans | -137.3 | 66.7 | 169 | -65.3 | -169 | 4.8 | 0 | 0 | 112.3 | D201 | D201-Q203 PolarHBondContact O-N 2.96Š| ||
| 204 | S | 47.7 | Very low | 50.4 | Low | 125 Ų | 125 | 130.6 Ų | 130.6 | 87% | 0.874 | 75% | 0.747 | S | S | * | * | trans | -134.5 | 37.8 | 160.9 | -149.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 205 | F | 52.7 | Low | 52.2 | Low | 194 Ų | 194 | 128.4 Ų | 128.4 | 85% | 0.851 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -97.5 | 124.7 | 157 | -83.3 | -89.3 | 0 | 0 | 0 | 108 | ||
| 206 | G | 49.1 | Very low | 54.1 | Low | 69 Ų | 69 | 125.9 Ų | 125.9 | 71% | 0.711 | 73% | 0.73 | S | S | * | * | S | Bend | trans | 114.5 | -9.9 | 157.5 | 0 | 0 | 0 | 0 | 0 | 118.3 | S208 | G206-S208 PolarHBondContact O-N 3.03Š|
| 207 | E | 46.6 | Very low | 55.5 | Low | 188 Ų | 188 | 124.7 Ų | 124.7 | 88% | 0.879 | 72% | 0.718 | S | S | * | * | trans | -99.6 | 47.8 | 179.4 | -129.1 | 166.1 | -171.1 | 0 | 0 | 113.8 | ||||
| 208 | S | 47.1 | Very low | 57.3 | Low | 92 Ų | 92 | 118 Ų | 118 | 64% | 0.643 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -55.6 | 129.9 | 134.8 | 51.2 | 0 | 0 | 0 | 0 | 107.1 | G206 | G206-S208 PolarHBondContact O-N 3.03Š|
| 209 | P | 57.5 | Low | 59.5 | Low | 104 Ų | 104 | 115.3 Ų | 115.3 | 68% | 0.675 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -48.3 | 136.6 | 175.1 | -27.6 | 34.5 | 0 | 0 | 0 | 109.4 | L211 | P209-L211 PolarHBondContact O-N 3.03Š|
| 210 | P | 46.4 | Very low | 61.3 | Low | 108 Ų | 108 | 115.4 Ų | 115.4 | 70% | 0.701 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 136.5 | 178.2 | 23.1 | -33.6 | 0 | 0 | 0 | 107.6 | S212 | P210-S212 PolarHBondContact O-N 3.16Š|
| 211 | L | 54.6 | Low | 63.3 | Low | 156 Ų | 156 | 117.8 Ų | 117.8 | 82% | 0.817 | 65% | 0.654 | S | S | * | * | trans | -68.9 | 73.3 | 175.6 | -63.5 | 177.1 | 0 | 0 | 0 | 108.5 | P209 | P209-L211 PolarHBondContact O-N 3.03Š| ||
| 212 | S | 57.2 | Low | 65.5 | Low | 85 Ų | 85 | 116.3 Ų | 116.3 | 59% | 0.594 | 65% | 0.645 | S | S | * | * | trans | -43.5 | 129.2 | 153.8 | 44.3 | 0 | 0 | 0 | 0 | 106.1 | P210 V214 | P210-S212 PolarHBondContact O-N 3.16Å; S212-V214 PolarHBondContact O-N 3.24Å | ||
| 213 | P | 65 | Low | 67.5 | Low | 131 Ų | 131 | 116.7 Ų | 116.7 | 85% | 0.851 | 64% | 0.637 | S | S | * | * | trans | -50.2 | 101.5 | -171.8 | -31.6 | 36.5 | 0 | 0 | 0 | 110.3 | D215 | P213-D215 PolarHBondContact O-N 3.11Š| ||
| 214 | V | 64.9 | Low | 69.5 | Low | 60 Ų | 60 | 109.8 Ų | 109.8 | 36% | 0.364 | 61% | 0.611 | S | S | . | * | trans | -65.6 | 111.9 | -179.1 | 167.1 | 0 | 0 | 0 | 0 | 103.9 | S212 M216 Q219 | S212-V214 PolarHBondContact O-N 3.24Å; V214-M216 WeakPolarHBondContact O-CE 3.25Å; V214-M216 PolarHBondContact O-N 2.91Å; V214-Q219 HydrophobicContact CG1-CB 3.82Å; V214-Q219 HydrophobicContact CG1-CG 3.99Å | ||
| 215 | D | 75.6 | Confident | 71.9 | Confident | 92 Ų | 92 | 110.2 Ų | 110.2 | 49% | 0.492 | 60% | 0.599 | S | S | . | * | trans | -46.9 | 115.6 | 176.8 | 165.5 | 41.3 | 0 | 0 | 0 | 108.2 | P213 D217 S218 Q219 | P213-D215 PolarHBondContact O-N 3.11Å; D215-D217 PolarHBondContact O-N 2.92Å; D215-D217 PolarHBondContact OD1-N 3.35Å; D215-S218 WeakPolarHBondContact O-CA 3.5Å; D215-S218 WeakPolarHBondContact O-CB 3.48Å; D215-S218 PolarHBondContact O-N 2.95Å; D215-S218 PolarHBondContact O-OG 3.13Å; D215-S218 VanDerWaalsContact OD2-CB 3.31Å; D215-S218 WeakPolarHBondContact OD2-CB 3.38Å; D215-S218 PolarHBondContact OD2-N 2.93Å; D215-Q219 PolarHBondContact O-N 3.21Å | ||
| 216 | M | 78.9 | Confident | 74 | Confident | 122 Ų | 122 | 108.9 Ų | 108.9 | 60% | 0.601 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -60.9 | -35.3 | -170.6 | -72.4 | -73.3 | 99.8 | 0 | 0 | 110.1 | V214 Q219 E220 | V214-M216 WeakPolarHBondContact O-CE 3.25Å; V214-M216 PolarHBondContact O-N 2.91Å; M216-Q219 PolarHBondContact O-N 2.93Å; M216-E220 WeakPolarHBondContact O-CB 3.35Å; M216-E220 PolarHBondContact O-N 3.48Å |
| 217 | D | 80.3 | Confident | 76.3 | Confident | 85 Ų | 85 | 112.9 Ų | 112.9 | 46% | 0.455 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -61.6 | -46.1 | 173.3 | -72.6 | 11.9 | 0 | 0 | 0 | 111.5 | D215 Q219 E220 R221 | D215-D217 PolarHBondContact O-N 2.92Å; D215-D217 PolarHBondContact OD1-N 3.35Å; D217-Q219 VanDerWaalsContact C-N 3.33Å; D217-Q219 PolarHBondContact O-N 3.48Å; D217-E220 PolarHBondContact O-N 3.12Å; D217-R221 WeakPolarHBondContact O-CB 3.21Å; D217-R221 WeakPolarHBondContact O-CG 3.49Å; D217-R221 PolarHBondContact O-N 3.17Å; D217-R221 IonicContact OD2-NH2 3.96Å |
| 218 | S | 86.8 | Confident | 78.7 | Confident | 41 Ų | 41 | 112.9 Ų | 112.9 | 29% | 0.287 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -59 | -43 | 174.9 | 79.5 | 0 | 0 | 0 | 0 | 112 | D215 R221 I222 | D215-S218 WeakPolarHBondContact O-CA 3.5Å; D215-S218 WeakPolarHBondContact O-CB 3.48Å; D215-S218 PolarHBondContact O-N 2.95Å; D215-S218 PolarHBondContact O-OG 3.13Å; D215-S218 VanDerWaalsContact OD2-CB 3.31Å; D215-S218 WeakPolarHBondContact OD2-CB 3.38Å; D215-S218 PolarHBondContact OD2-N 2.93Å; S218-R221 PolarHBondContact O-N 3.13Å; S218-I222 WeakPolarHBondContact O-CD1 3.31Å; S218-I222 VanDerWaalsContact O-CG1 3.26Å; S218-I222 WeakPolarHBondContact O-CG1 3.37Å; S218-I222 PolarHBondContact O-N 3.13Å |
| 219 | Q | 87 | Confident | 81.2 | Confident | 74 Ų | 74 | 112.7 Ų | 112.7 | 35% | 0.346 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -69.6 | -39.3 | -179.2 | -148.6 | -167.4 | 52.7 | 0 | 0 | 111.6 | V214 D215 M216 D217 K223 | V214-Q219 HydrophobicContact CG1-CB 3.82Å; V214-Q219 HydrophobicContact CG1-CG 3.99Å; D215-Q219 PolarHBondContact O-N 3.21Å; M216-Q219 PolarHBondContact O-N 2.93Å; D217-Q219 VanDerWaalsContact C-N 3.33Å; D217-Q219 PolarHBondContact O-N 3.48Å; Q219-K223 WeakPolarHBondContact O-CB 3.36Å; Q219-K223 WeakPolarHBondContact O-CD 3.42Å; Q219-K223 VanDerWaalsContact O-CG 3.25Å; Q219-K223 WeakPolarHBondContact O-CG 3.39Å; Q219-K223 PolarHBondContact O-N 2.97Å |
| 220 | E | 88.6 | Confident | 83.1 | Confident | 135 Ų | 135 | 114.3 Ų | 114.3 | 63% | 0.631 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -64.3 | -47.1 | 174.7 | -172.7 | 175.9 | -174 | 0 | 0 | 111.1 | M216 D217 I222 K223 A224 | M216-E220 WeakPolarHBondContact O-CB 3.35Å; M216-E220 PolarHBondContact O-N 3.48Å; D217-E220 PolarHBondContact O-N 3.12Å; E220-I222 VanDerWaalsContact C-N 3.35Å; E220-I222 PolarHBondContact O-N 2.78Å; E220-K223 PolarHBondContact O-N 3.25Å; E220-A224 VanDerWaalsContact O-CB 3.29Å; E220-A224 WeakPolarHBondContact O-CB 3.36Å; E220-A224 PolarHBondContact O-N 3.3Å |
| 221 | R | 93.3 | Very high | 85.5 | Confident | 174 Ų | 174 | 114.7 Ų | 114.7 | 66% | 0.657 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -56.3 | -46.7 | 176.5 | -72.4 | 169 | -165.3 | -163.5 | 9.5 | 111.5 | D217 S218 A224 E225 | D217-R221 WeakPolarHBondContact O-CB 3.21Å; D217-R221 WeakPolarHBondContact O-CG 3.49Å; D217-R221 PolarHBondContact O-N 3.17Å; D217-R221 IonicContact OD2-NH2 3.96Å; S218-R221 PolarHBondContact O-N 3.13Å; R221-A224 PolarHBondContact O-N 3.05Å; R221-E225 WeakPolarHBondContact O-CB 3.34Å; R221-E225 PolarHBondContact O-N 3.41Å |
| 222 | I | 89.6 | Confident | 87.6 | Confident | 110 Ų | 110 | 115.5 Ų | 115.5 | 56% | 0.564 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.8 | -42.7 | 177.7 | -67.3 | 164.7 | 0 | 0 | 0 | 111.5 | S218 E220 E225 R226 | S218-I222 WeakPolarHBondContact O-CD1 3.31Å; S218-I222 VanDerWaalsContact O-CG1 3.26Å; S218-I222 WeakPolarHBondContact O-CG1 3.37Å; S218-I222 PolarHBondContact O-N 3.13Å; E220-I222 VanDerWaalsContact C-N 3.35Å; E220-I222 PolarHBondContact O-N 2.78Å; I222-E225 PolarHBondContact O-N 3.48Å; I222-R226 WeakPolarHBondContact O-CB 3.29Å; I222-R226 PolarHBondContact O-N 2.88Å |
| 223 | K | 95.4 | Very high | 89.6 | Confident | 123 Ų | 123 | 116.4 Ų | 116.4 | 54% | 0.535 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.2 | -43.5 | 175.3 | -76.6 | 166 | 176.1 | 168.6 | 0 | 111.5 | Q219 E220 R226 K227 | Q219-K223 WeakPolarHBondContact O-CB 3.36Å; Q219-K223 WeakPolarHBondContact O-CD 3.42Å; Q219-K223 VanDerWaalsContact O-CG 3.25Å; Q219-K223 WeakPolarHBondContact O-CG 3.39Å; Q219-K223 PolarHBondContact O-N 2.97Å; E220-K223 PolarHBondContact O-N 3.25Å; K223-R226 PolarHBondContact O-N 3.5Å; K223-K227 WeakPolarHBondContact O-CB 3.23Å; K223-K227 PolarHBondContact O-N 3.28Å |
| 224 | A | 95.6 | Very high | 91.2 | Very high | 37 Ų | 37 | 112.9 Ų | 112.9 | 31% | 0.306 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.7 | -43.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | E220 R221 K227 R228 | E220-A224 VanDerWaalsContact O-CB 3.29Å; E220-A224 WeakPolarHBondContact O-CB 3.36Å; E220-A224 PolarHBondContact O-N 3.3Å; R221-A224 PolarHBondContact O-N 3.05Å; A224-K227 WeakPolarHBondContact O-CB 3.28Å; A224-K227 PolarHBondContact O-N 3.23Å; A224-R228 WeakPolarHBondContact O-CG 3.11Å; A224-R228 PolarHBondContact O-N 2.94Å |
| 225 | E | 96.9 | Very high | 92.8 | Very high | 135 Ų | 135 | 111.8 Ų | 111.8 | 63% | 0.631 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.6 | -46.5 | 174.8 | -176.9 | 169.1 | -153.2 | 0 | 0 | 111.6 | R221 I222 K227 R228 L229 | R221-E225 WeakPolarHBondContact O-CB 3.34Å; R221-E225 PolarHBondContact O-N 3.41Å; I222-E225 PolarHBondContact O-N 3.48Å; E225-K227 PolarHBondContact O-N 2.86Å; E225-R228 CarbonylContact O-C 3.59Å; E225-R228 WeakPolarHBondContact O-CB 3.23Å; E225-R228 PolarHBondContact O-N 3.28Å; E225-R228 VanDerWaalsContact O-N 3.08Å; E225-L229 PolarHBondContact O-N 3.14Å |
| 226 | R | 97.1 | Very high | 93.9 | Very high | 166 Ų | 166 | 110.4 Ų | 110.4 | 63% | 0.626 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.7 | -33.6 | 175 | -165.3 | 178.2 | -179.5 | -170.9 | 1.8 | 112 | I222 K223 R230 | I222-R226 WeakPolarHBondContact O-CB 3.29Å; I222-R226 PolarHBondContact O-N 2.88Å; K223-R226 PolarHBondContact O-N 3.5Å; R226-R230 WeakPolarHBondContact O-CG 3.37Å; R226-R230 PolarHBondContact O-N 3.32Å; R226-R230 VanDerWaalsContact O-N 3.16Å; R226-R230 PolarHBondContact O-NE 3.02Å; R226-R230 VanDerWaalsContact O-NE 3.14Å |
| 227 | K | 97.8 | Very high | 94.8 | Very high | 153 Ų | 153 | 110.2 Ų | 110.2 | 67% | 0.665 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67.7 | -46.1 | 172 | -168.9 | 178.4 | -179.2 | -179.9 | 0 | 111.4 | K223 A224 E225 R230 N231 | K223-K227 WeakPolarHBondContact O-CB 3.23Å; K223-K227 PolarHBondContact O-N 3.28Å; A224-K227 WeakPolarHBondContact O-CB 3.28Å; A224-K227 PolarHBondContact O-N 3.23Å; E225-K227 PolarHBondContact O-N 2.86Å; K227-R230 PolarHBondContact O-N 3.27Å; K227-N231 WeakPolarHBondContact O-CB 3.34Å; K227-N231 PolarHBondContact O-N 2.79Å |
| 228 | R | 98.1 | Very high | 95.7 | Very high | 187 Ų | 187 | 110.3 Ų | 110.3 | 71% | 0.706 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.9 | -43.9 | 175.2 | -72.7 | 173.5 | 178.5 | 166 | 0.5 | 112.1 | A224 E225 N231 R232 | A224-R228 WeakPolarHBondContact O-CG 3.11Å; A224-R228 PolarHBondContact O-N 2.94Å; E225-R228 CarbonylContact O-C 3.59Å; E225-R228 WeakPolarHBondContact O-CB 3.23Å; E225-R228 PolarHBondContact O-N 3.28Å; E225-R228 VanDerWaalsContact O-N 3.08Å; R228-N231 PolarHBondContact O-N 3.27Å; R228-R232 WeakPolarHBondContact O-CB 3.39Å; R228-R232 PolarHBondContact O-N 3.5Å |
| 229 | L | 97.6 | Very high | 96.3 | Very high | 89 Ų | 89 | 117.1 Ų | 117.1 | 47% | 0.466 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.4 | -47.1 | 177.9 | -179 | 59.7 | 0 | 0 | 0 | 111.9 | E225 N231 R232 I233 | E225-L229 PolarHBondContact O-N 3.14Å; L229-N231 VanDerWaalsContact C-N 3.33Å; L229-N231 PolarHBondContact O-N 2.9Å; L229-R232 PolarHBondContact O-N 3.22Å; L229-I233 HydrophobicContact CD1-CD1 4.13Å; L229-I233 HydrophobicContact CD1-CG1 4.44Å; L229-I233 HydrophobicContact CG-CD1 4.07Å; L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 2.94Å |
| 230 | R | 98 | Very high | 96.8 | Very high | 138 Ų | 138 | 121.1 Ų | 121.1 | 52% | 0.521 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -59.2 | -43.3 | 174.8 | -76 | 179 | -66 | -145.7 | 0.3 | 112 | R226 K227 I233 A234 | R226-R230 WeakPolarHBondContact O-CG 3.37Å; R226-R230 PolarHBondContact O-N 3.32Å; R226-R230 VanDerWaalsContact O-N 3.16Å; R226-R230 PolarHBondContact O-NE 3.02Å; R226-R230 VanDerWaalsContact O-NE 3.14Å; K227-R230 PolarHBondContact O-N 3.27Å; R230-I233 PolarHBondContact O-N 2.91Å; R230-A234 WeakPolarHBondContact O-CB 3.44Å; R230-A234 PolarHBondContact O-N 2.94Å |
| 231 | N | 98.3 | Very high | 97.3 | Very high | 116 Ų | 116 | 122 Ų | 122 | 62% | 0.62 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.3 | -43.2 | 176.7 | -178.4 | -90.2 | 0 | 0 | 0 | 112.1 | K227 R228 L229 I233 A234 A235 | K227-N231 WeakPolarHBondContact O-CB 3.34Å; K227-N231 PolarHBondContact O-N 2.79Å; R228-N231 PolarHBondContact O-N 3.27Å; L229-N231 VanDerWaalsContact C-N 3.33Å; L229-N231 PolarHBondContact O-N 2.9Å; N231-I233 VanDerWaalsContact C-N 3.35Å; N231-I233 PolarHBondContact O-N 3Å; N231-A234 PolarHBondContact O-N 3.39Å; N231-A235 WeakPolarHBondContact O-CB 3.29Å; N231-A235 PolarHBondContact O-N 3.2Å |
| 232 | R | 98.3 | Very high | 97.6 | Very high | 173 Ų | 173 | 120.6 Ų | 120.6 | 65% | 0.653 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -57 | -45.9 | 174.8 | -172.3 | -175.6 | -67.3 | 168 | -1.5 | 111.7 | R228 L229 S236 | R228-R232 WeakPolarHBondContact O-CB 3.39Å; R228-R232 PolarHBondContact O-N 3.5Å; L229-R232 PolarHBondContact O-N 3.22Å; R232-S236 PolarHBondContact O-N 3.45Å; R232-S236 VanDerWaalsContact O-N 3.07Å; R232-S236 PolarHBondContact O-OG 3.48Å |
| 233 | I | 98.1 | Very high | 98 | Very high | 104 Ų | 104 | 121 Ų | 121 | 53% | 0.533 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.5 | -44.5 | 176.6 | -66.1 | 165.6 | 0 | 0 | 0 | 111 | L229 R230 N231 S236 K237 | L229-I233 HydrophobicContact CD1-CD1 4.13Å; L229-I233 HydrophobicContact CD1-CG1 4.44Å; L229-I233 HydrophobicContact CG-CD1 4.07Å; L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 2.94Å; R230-I233 PolarHBondContact O-N 2.91Å; N231-I233 VanDerWaalsContact C-N 3.35Å; N231-I233 PolarHBondContact O-N 3Å; I233-S236 PolarHBondContact O-N 3.24Å; I233-K237 WeakPolarHBondContact O-CB 3.39Å; I233-K237 PolarHBondContact O-N 2.84Å |
| 234 | A | 98.6 | Very high | 98.2 | Very high | 56 Ų | 56 | 118.7 Ų | 118.7 | 46% | 0.463 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.8 | -43.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R230 N231 K237 C238 | R230-A234 WeakPolarHBondContact O-CB 3.44Å; R230-A234 PolarHBondContact O-N 2.94Å; N231-A234 PolarHBondContact O-N 3.39Å; A234-K237 PolarHBondContact O-N 3.34Å; A234-C238 WeakPolarHBondContact O-CB 3.44Å; A234-C238 PolarHBondContact O-N 2.9Å |
| 235 | A | 98.6 | Very high | 98.3 | Very high | 38 Ų | 38 | 125.2 Ų | 125.2 | 31% | 0.314 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.4 | -45.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | N231 K237 C238 R239 | N231-A235 WeakPolarHBondContact O-CB 3.29Å; N231-A235 PolarHBondContact O-N 3.2Å; A235-K237 PolarHBondContact O-N 2.63Å; A235-C238 PolarHBondContact O-N 3.18Å; A235-R239 WeakPolarHBondContact O-CG 3.26Å; A235-R239 PolarHBondContact O-N 3.12Å |
| 236 | S | 98.5 | Very high | 98.4 | Very high | 63 Ų | 63 | 122 Ų | 122 | 44% | 0.441 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.8 | -41 | 174.3 | -67.1 | 0 | 0 | 0 | 0 | 112.6 | R232 I233 R239 R240 | R232-S236 PolarHBondContact O-N 3.45Å; R232-S236 VanDerWaalsContact O-N 3.07Å; R232-S236 PolarHBondContact O-OG 3.48Å; I233-S236 PolarHBondContact O-N 3.24Å; S236-R239 PolarHBondContact O-N 2.9Å; S236-R240 WeakPolarHBondContact O-CB 3.4Å; S236-R240 PolarHBondContact O-N 2.97Å |
| 237 | K | 98.8 | Very high | 98.5 | Very high | 118 Ų | 118 | 116.7 Ų | 116.7 | 51% | 0.513 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.5 | -38.4 | 175.8 | -167.9 | 173.6 | -174.1 | 175.2 | 0 | 112 | I233 A234 A235 R241 | I233-K237 WeakPolarHBondContact O-CB 3.39Å; I233-K237 PolarHBondContact O-N 2.84Å; A234-K237 PolarHBondContact O-N 3.34Å; A235-K237 PolarHBondContact O-N 2.63Å; K237-R241 WeakPolarHBondContact O-CG 3.48Å; K237-R241 PolarHBondContact O-N 3.48Å |
| 238 | C | 98.8 | Very high | 98.5 | Very high | 87 Ų | 87 | 117.9 Ų | 117.9 | 59% | 0.588 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -64.2 | -49.4 | 174.9 | -175.6 | 0 | 0 | 0 | 0 | 111.5 | A234 A235 R240 R241 K242 | A234-C238 WeakPolarHBondContact O-CB 3.44Å; A234-C238 PolarHBondContact O-N 2.9Å; A235-C238 PolarHBondContact O-N 3.18Å; C238-R240 VanDerWaalsContact C-N 3.34Å; C238-R240 PolarHBondContact O-N 2.86Å; C238-R241 PolarHBondContact O-N 2.95Å; C238-K242 PolarHBondContact O-N 3.31Å |
| 239 | R | 98.8 | Very high | 98.6 | Very high | 183 Ų | 183 | 113 Ų | 113 | 69% | 0.691 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -56.9 | -46 | 174.5 | -71.8 | 174.3 | -178.2 | -175.7 | -0.3 | 111.6 | A235 S236 K242 L243 | A235-R239 WeakPolarHBondContact O-CG 3.26Å; A235-R239 PolarHBondContact O-N 3.12Å; S236-R239 PolarHBondContact O-N 2.9Å; R239-K242 PolarHBondContact O-N 3.15Å; R239-L243 WeakPolarHBondContact O-CG 3.48Å; R239-L243 PolarHBondContact O-N 3.12Å |
| 240 | R | 98.6 | Very high | 98.6 | Very high | 159 Ų | 159 | 114.6 Ų | 114.6 | 60% | 0.6 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -59.3 | -52.4 | 176.6 | -168.7 | -171.2 | -65.2 | 157.4 | -0.4 | 111.9 | S236 C238 K242 L243 E244 | S236-R240 WeakPolarHBondContact O-CB 3.4Å; S236-R240 PolarHBondContact O-N 2.97Å; C238-R240 VanDerWaalsContact C-N 3.34Å; C238-R240 PolarHBondContact O-N 2.86Å; R240-K242 VanDerWaalsContact C-N 3.26Å; R240-K242 PolarHBondContact O-N 3.18Å; R240-L243 PolarHBondContact O-N 3.22Å; R240-L243 VanDerWaalsContact O-N 3.12Å; R240-E244 WeakPolarHBondContact CD-OE1 3.46Å; R240-E244 HydrophobicContact CG-CG 4.39Å; R240-E244 VanDerWaalsContact CG-OE1 3.29Å; R240-E244 WeakPolarHBondContact CG-OE1 3.43Å; R240-E244 WeakPolarHBondContact O-CG 3.37Å; R240-E244 PolarHBondContact O-N 3.1Å |
| 241 | R | 98.8 | Very high | 98.7 | Very high | 154 Ų | 154 | 112.1 Ų | 112.1 | 58% | 0.581 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -58.4 | -35.9 | 176.9 | -74.1 | -174 | -175.1 | -79.1 | 18.6 | 112.8 | K237 C238 R245 | K237-R241 WeakPolarHBondContact O-CG 3.48Å; K237-R241 PolarHBondContact O-N 3.48Å; C238-R241 PolarHBondContact O-N 2.95Å; R241-R245 WeakPolarHBondContact O-CB 3.48Å; R241-R245 PolarHBondContact O-N 3.14Å |
| 242 | K | 98.8 | Very high | 98.7 | Very high | 144 Ų | 144 | 113 Ų | 113 | 63% | 0.626 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.8 | -46.8 | 175.2 | -174.8 | 178.5 | 178.5 | -179.5 | 0 | 111.1 | C238 R239 R240 R245 I246 | C238-K242 PolarHBondContact O-N 3.31Å; R239-K242 PolarHBondContact O-N 3.15Å; R240-K242 VanDerWaalsContact C-N 3.26Å; R240-K242 PolarHBondContact O-N 3.18Å; K242-R245 PolarHBondContact O-N 3.27Å; K242-I246 HydrophobicContact CG-CD1 4.08Å; K242-I246 WeakPolarHBondContact O-CG1 3.46Å; K242-I246 PolarHBondContact O-N 2.94Å |
| 243 | L | 98.8 | Very high | 98.7 | Very high | 117 Ų | 117 | 108.3 Ų | 108.3 | 61% | 0.613 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.6 | -43.5 | 177.2 | -67.1 | 171.3 | 0 | 0 | 0 | 112.2 | R239 R240 R245 I246 S247 | R239-L243 WeakPolarHBondContact O-CG 3.48Å; R239-L243 PolarHBondContact O-N 3.12Å; R240-L243 PolarHBondContact O-N 3.22Å; R240-L243 VanDerWaalsContact O-N 3.12Å; L243-R245 VanDerWaalsContact C-N 3.28Å; L243-R245 PolarHBondContact O-N 3.06Å; L243-I246 PolarHBondContact O-N 2.84Å; L243-I246 VanDerWaalsContact O-N 3.15Å; L243-S247 PolarHBondContact O-N 3Å |
| 244 | E | 98.8 | Very high | 98.7 | Very high | 76 Ų | 76 | 110.1 Ų | 110.1 | 36% | 0.355 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -56.3 | -41.3 | 172.2 | -71.6 | 166.5 | -171.3 | 0 | 0 | 111.7 | R240 R248 | R240-E244 WeakPolarHBondContact CD-OE1 3.46Å; R240-E244 HydrophobicContact CG-CG 4.39Å; R240-E244 VanDerWaalsContact CG-OE1 3.29Å; R240-E244 WeakPolarHBondContact CG-OE1 3.43Å; R240-E244 WeakPolarHBondContact O-CG 3.37Å; R240-E244 PolarHBondContact O-N 3.1Å; E244-R248 VanDerWaalsContact O-CG 3.26Å; E244-R248 WeakPolarHBondContact O-CG 3.5Å; E244-R248 PolarHBondContact O-N 3Å |
| 245 | R | 98.8 | Very high | 98.8 | Very high | 174 Ų | 174 | 111.1 Ų | 111.1 | 66% | 0.657 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -70.2 | -35.8 | 177.2 | -171.8 | 173.9 | -175.1 | -89.5 | 4.3 | 112.5 | R241 K242 L243 L249 | R241-R245 WeakPolarHBondContact O-CB 3.48Å; R241-R245 PolarHBondContact O-N 3.14Å; K242-R245 PolarHBondContact O-N 3.27Å; L243-R245 VanDerWaalsContact C-N 3.28Å; L243-R245 PolarHBondContact O-N 3.06Å; R245-L249 HydrophobicContact CG-CD1 4.31Å; R245-L249 VanDerWaalsContact O-CG 3.26Å; R245-L249 WeakPolarHBondContact O-CG 3.5Å; R245-L249 PolarHBondContact O-N 2.9Å |
| 246 | I | 98.7 | Very high | 98.8 | Very high | 68 Ų | 68 | 113.6 Ų | 113.6 | 35% | 0.349 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.1 | -53.7 | 174.5 | -71.1 | 163.7 | 0 | 0 | 0 | 109.6 | K242 L243 R248 L249 E250 | K242-I246 HydrophobicContact CG-CD1 4.08Å; K242-I246 WeakPolarHBondContact O-CG1 3.46Å; K242-I246 PolarHBondContact O-N 2.94Å; L243-I246 PolarHBondContact O-N 2.84Å; L243-I246 VanDerWaalsContact O-N 3.15Å; I246-R248 VanDerWaalsContact C-N 3.35Å; I246-R248 PolarHBondContact O-N 3.33Å; I246-L249 WeakPolarHBondContact O-CA 3.37Å; I246-L249 WeakPolarHBondContact O-CB 3.45Å; I246-L249 PolarHBondContact O-N 3.46Å; I246-E250 HydrophobicContact CG2-CG 4.25Å; I246-E250 WeakPolarHBondContact CG2-OE1 3.46Å; I246-E250 WeakPolarHBondContact O-CG 3.32Å; I246-E250 PolarHBondContact O-N 3.14Å |
| 247 | S | 98.8 | Very high | 98.8 | Very high | 54 Ų | 54 | 117.4 Ų | 117.4 | 38% | 0.378 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -54.5 | -46.2 | 177.7 | 150 | 0 | 0 | 0 | 0 | 112.5 | L243 L249 E250 D251 | L243-S247 PolarHBondContact O-N 3Å; S247-L249 VanDerWaalsContact C-N 3.27Å; S247-L249 PolarHBondContact O-N 3.46Å; S247-E250 WeakPolarHBondContact CA-OE2 3.37Å; S247-E250 PolarHBondContact O-N 3.02Å; S247-D251 WeakPolarHBondContact O-CB 3.43Å; S247-D251 PolarHBondContact O-N 3.32Å |
| 248 | R | 98.8 | Very high | 98.8 | Very high | 178 Ų | 178 | 115.1 Ų | 115.1 | 67% | 0.672 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -60.9 | -32.7 | 175.9 | -72.3 | 173.3 | -170.9 | -170.5 | 3 | 113.8 | E244 I246 K252 | E244-R248 VanDerWaalsContact O-CG 3.26Å; E244-R248 WeakPolarHBondContact O-CG 3.5Å; E244-R248 PolarHBondContact O-N 3Å; I246-R248 VanDerWaalsContact C-N 3.35Å; I246-R248 PolarHBondContact O-N 3.33Å; R248-K252 WeakPolarHBondContact O-CB 3.34Å; R248-K252 PolarHBondContact O-N 3.12Å; R248-K252 VanDerWaalsContact O-N 3.1Å |
| 249 | L | 98.9 | Very high | 98.8 | Very high | 85 Ų | 85 | 115.9 Ų | 115.9 | 45% | 0.445 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -76.6 | -38.5 | 176.6 | -71.1 | 169.7 | 0 | 0 | 0 | 111.1 | R245 I246 S247 K252 V253 | R245-L249 HydrophobicContact CG-CD1 4.31Å; R245-L249 VanDerWaalsContact O-CG 3.26Å; R245-L249 WeakPolarHBondContact O-CG 3.5Å; R245-L249 PolarHBondContact O-N 2.9Å; I246-L249 WeakPolarHBondContact O-CA 3.37Å; I246-L249 WeakPolarHBondContact O-CB 3.45Å; I246-L249 PolarHBondContact O-N 3.46Å; S247-L249 VanDerWaalsContact C-N 3.27Å; S247-L249 PolarHBondContact O-N 3.46Å; L249-K252 PolarHBondContact O-N 3.2Å; L249-V253 WeakPolarHBondContact O-CG2 3.4Å; L249-V253 PolarHBondContact O-N 3.49Å |
| 250 | E | 98.8 | Very high | 98.8 | Very high | 121 Ų | 121 | 112.6 Ų | 112.6 | 57% | 0.565 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.9 | -45.6 | 173.6 | -68.5 | 167.9 | 157.2 | 0 | 0 | 111.2 | I246 S247 K252 V253 K254 | I246-E250 HydrophobicContact CG2-CG 4.25Å; I246-E250 WeakPolarHBondContact CG2-OE1 3.46Å; I246-E250 WeakPolarHBondContact O-CG 3.32Å; I246-E250 PolarHBondContact O-N 3.14Å; S247-E250 WeakPolarHBondContact CA-OE2 3.37Å; S247-E250 PolarHBondContact O-N 3.02Å; E250-K252 PolarHBondContact O-N 3.41Å; E250-V253 PolarHBondContact O-N 3.06Å; E250-K254 WeakPolarHBondContact O-CB 3.48Å; E250-K254 PolarHBondContact O-N 3.29Å |
| 251 | D | 98.9 | Very high | 98.8 | Very high | 87 Ų | 87 | 109 Ų | 109 | 47% | 0.465 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61 | -42.5 | 173.5 | -72.5 | -36.2 | 0 | 0 | 0 | 111.8 | S247 V253 K254 T255 | S247-D251 WeakPolarHBondContact O-CB 3.43Å; S247-D251 PolarHBondContact O-N 3.32Å; D251-V253 PolarHBondContact O-N 2.88Å; D251-K254 WeakPolarHBondContact O-CB 3.44Å; D251-K254 PolarHBondContact O-N 3.35Å; D251-T255 PolarHBondContact O-N 3.04Å; D251-T255 PolarHBondContact O-OG1 3.37Å |
| 252 | K | 98.8 | Very high | 98.8 | Very high | 133 Ų | 133 | 105.6 Ų | 105.6 | 58% | 0.578 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.2 | -40.6 | 175.7 | -173.4 | 171.1 | -178.1 | 175.1 | 0 | 111.9 | R248 L249 E250 L256 | R248-K252 WeakPolarHBondContact O-CB 3.34Å; R248-K252 PolarHBondContact O-N 3.12Å; R248-K252 VanDerWaalsContact O-N 3.1Å; L249-K252 PolarHBondContact O-N 3.2Å; E250-K252 PolarHBondContact O-N 3.41Å; K252-L256 HydrophobicContact CG-CD1 4Å; K252-L256 HydrophobicContact CG-CG 4.41Å; K252-L256 WeakPolarHBondContact O-CB 3.29Å; K252-L256 VanDerWaalsContact O-CG 3.28Å; K252-L256 WeakPolarHBondContact O-CG 3.27Å; K252-L256 PolarHBondContact O-N 2.99Å |
| 253 | V | 98.9 | Very high | 98.8 | Very high | 75 Ų | 75 | 104.4 Ų | 104.4 | 46% | 0.455 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.4 | -41 | 174.7 | 167.7 | 0 | 0 | 0 | 0 | 110.9 | L249 E250 D251 K257 | L249-V253 WeakPolarHBondContact O-CG2 3.4Å; L249-V253 PolarHBondContact O-N 3.49Å; E250-V253 PolarHBondContact O-N 3.06Å; D251-V253 PolarHBondContact O-N 2.88Å; V253-K257 HydrophobicContact CG1-CD 4.11Å; V253-K257 HydrophobicContact CG1-CG 4.5Å; V253-K257 WeakPolarHBondContact O-CB 3.44Å; V253-K257 VanDerWaalsContact O-CG 3.29Å; V253-K257 WeakPolarHBondContact O-CG 3.37Å; V253-K257 PolarHBondContact O-N 3.48Å |
| 254 | K | 98.8 | Very high | 98.8 | Very high | 142 Ų | 142 | 101.4 Ų | 101.4 | 62% | 0.617 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.4 | -51.9 | 175.4 | -177.4 | -178.8 | 175.8 | -175.1 | 0 | 111.2 | E250 D251 L256 K257 T258 | E250-K254 WeakPolarHBondContact O-CB 3.48Å; E250-K254 PolarHBondContact O-N 3.29Å; D251-K254 WeakPolarHBondContact O-CB 3.44Å; D251-K254 PolarHBondContact O-N 3.35Å; K254-L256 PolarHBondContact O-N 3.16Å; K254-K257 PolarHBondContact O-N 3.42Å; K254-T258 PolarHBondContact O-N 3.2Å; K254-T258 PolarHBondContact O-OG1 3.42Å |
| 255 | T | 98.8 | Very high | 98.8 | Very high | 77 Ų | 77 | 101.1 Ų | 101.1 | 47% | 0.472 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.4 | -46.5 | 177.7 | -61.7 | 0 | 0 | 0 | 0 | 112.2 | D251 K257 T258 Q259 | D251-T255 PolarHBondContact O-N 3.04Å; D251-T255 PolarHBondContact O-OG1 3.37Å; T255-K257 VanDerWaalsContact C-N 3.32Å; T255-K257 PolarHBondContact O-N 3.48Å; T255-T258 PolarHBondContact O-N 3.25Å; T255-Q259 HydrophobicContact CG2-CG 4.5Å; T255-Q259 WeakPolarHBondContact O-CG 3.26Å; T255-Q259 PolarHBondContact O-N 3.34Å |
| 256 | L | 98.8 | Very high | 98.7 | Very high | 90 Ų | 90 | 96.4 Ų | 96.4 | 47% | 0.471 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.5 | -34.6 | 178.1 | -73.4 | 172.2 | 0 | 0 | 0 | 112.6 | K252 K254 N260 | K252-L256 HydrophobicContact CG-CD1 4Å; K252-L256 HydrophobicContact CG-CG 4.41Å; K252-L256 WeakPolarHBondContact O-CB 3.29Å; K252-L256 VanDerWaalsContact O-CG 3.28Å; K252-L256 WeakPolarHBondContact O-CG 3.27Å; K252-L256 PolarHBondContact O-N 2.99Å; K254-L256 PolarHBondContact O-N 3.16Å; L256-N260 VanDerWaalsContact O-CB 3.29Å; L256-N260 WeakPolarHBondContact O-CB 3.37Å; L256-N260 PolarHBondContact O-N 3.04Å |
| 257 | K | 98.8 | Very high | 98.7 | Very high | 143 Ų | 143 | 94.7 Ų | 94.7 | 62% | 0.622 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.8 | -46.9 | 173.2 | -79.3 | 176.8 | 176.2 | -176.6 | 0 | 111.6 | V253 K254 T255 N260 T261 | V253-K257 HydrophobicContact CG1-CD 4.11Å; V253-K257 HydrophobicContact CG1-CG 4.5Å; V253-K257 WeakPolarHBondContact O-CB 3.44Å; V253-K257 VanDerWaalsContact O-CG 3.29Å; V253-K257 WeakPolarHBondContact O-CG 3.37Å; V253-K257 PolarHBondContact O-N 3.48Å; K254-K257 PolarHBondContact O-N 3.42Å; T255-K257 VanDerWaalsContact C-N 3.32Å; T255-K257 PolarHBondContact O-N 3.48Å; K257-N260 WeakPolarHBondContact O-CB 3.33Å; K257-N260 PolarHBondContact O-N 3.27Å; K257-T261 PolarHBondContact O-N 3.12Å; K257-T261 PolarHBondContact O-OG1 3.12Å |
| 258 | T | 98.8 | Very high | 98.7 | Very high | 71 Ų | 71 | 95.6 Ų | 95.6 | 44% | 0.436 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.3 | -48 | 175.7 | -60.4 | 0 | 0 | 0 | 0 | 111.3 | K254 T255 N260 T261 D262 | K254-T258 PolarHBondContact O-N 3.2Å; K254-T258 PolarHBondContact O-OG1 3.42Å; T255-T258 PolarHBondContact O-N 3.25Å; T258-N260 VanDerWaalsContact C-N 3.26Å; T258-N260 PolarHBondContact O-N 3.41Å; T258-T261 WeakPolarHBondContact CA-OG1 3.4Å; T258-T261 PolarHBondContact O-N 3.3Å; T258-T261 VanDerWaalsContact O-N 3.13Å; T258-T261 PolarHBondContact O-OG1 3.39Å; T258-D262 PolarHBondContact O-N 3.27Å |
| 259 | Q | 98.7 | Very high | 98.7 | Very high | 102 Ų | 102 | 91.9 Ų | 91.9 | 48% | 0.477 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.1 | -37.5 | 175.2 | -71.9 | 178.2 | -35 | 0 | 0 | 112.5 | T255 D262 L263 | T255-Q259 HydrophobicContact CG2-CG 4.5Å; T255-Q259 WeakPolarHBondContact O-CG 3.26Å; T255-Q259 PolarHBondContact O-N 3.34Å; Q259-D262 PolarHBondContact O-N 2.91Å; Q259-L263 WeakPolarHBondContact O-CB 3.39Å; Q259-L263 VanDerWaalsContact O-CG 3.23Å; Q259-L263 WeakPolarHBondContact O-CG 3.37Å; Q259-L263 PolarHBondContact O-N 3.03Å |
| 260 | N | 98.7 | Very high | 98.7 | Very high | 114 Ų | 114 | 92.5 Ų | 92.5 | 61% | 0.61 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.7 | -42.2 | 176 | -168 | -90.3 | 0 | 0 | 0 | 112.1 | L256 K257 T258 A264 | L256-N260 VanDerWaalsContact O-CB 3.29Å; L256-N260 WeakPolarHBondContact O-CB 3.37Å; L256-N260 PolarHBondContact O-N 3.04Å; K257-N260 WeakPolarHBondContact O-CB 3.33Å; K257-N260 PolarHBondContact O-N 3.27Å; T258-N260 VanDerWaalsContact C-N 3.26Å; T258-N260 PolarHBondContact O-N 3.41Å; N260-A264 WeakPolarHBondContact O-CB 3.47Å; N260-A264 PolarHBondContact O-N 2.97Å |
| 261 | T | 98.8 | Very high | 98.7 | Very high | 84 Ų | 84 | 94.9 Ų | 94.9 | 52% | 0.515 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.1 | -38.2 | 175.4 | 50.7 | 0 | 0 | 0 | 0 | 112.4 | K257 T258 A264 S265 | K257-T261 PolarHBondContact O-N 3.12Å; K257-T261 PolarHBondContact O-OG1 3.12Å; T258-T261 WeakPolarHBondContact CA-OG1 3.4Å; T258-T261 PolarHBondContact O-N 3.3Å; T258-T261 VanDerWaalsContact O-N 3.13Å; T258-T261 PolarHBondContact O-OG1 3.39Å; T261-A264 PolarHBondContact O-N 2.85Å; T261-S265 PolarHBondContact O-N 2.97Å |
| 262 | D | 98.6 | Very high | 98.7 | Very high | 82 Ų | 82 | 95.4 Ų | 95.4 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -70.9 | -40.9 | -179.6 | -59.9 | -14.6 | 0 | 0 | 0 | 111.6 | T258 Q259 S265 T266 | T258-D262 PolarHBondContact O-N 3.27Å; Q259-D262 PolarHBondContact O-N 2.91Å; D262-S265 PolarHBondContact O-OG 3.43Å; D262-T266 WeakPolarHBondContact O-CB 3.35Å; D262-T266 PolarHBondContact O-N 3.42Å; D262-T266 PolarHBondContact O-OG1 3.35Å |
| 263 | L | 98.7 | Very high | 98.7 | Very high | 120 Ų | 120 | 93.9 Ų | 93.9 | 63% | 0.628 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -67.4 | -38.3 | 172.7 | -70.5 | 171.8 | 0 | 0 | 0 | 111.6 | Q259 T266 A267 | Q259-L263 WeakPolarHBondContact O-CB 3.39Å; Q259-L263 VanDerWaalsContact O-CG 3.23Å; Q259-L263 WeakPolarHBondContact O-CG 3.37Å; Q259-L263 PolarHBondContact O-N 3.03Å; L263-T266 PolarHBondContact O-N 2.93Å; L263-A267 VanDerWaalsContact O-CB 3.31Å; L263-A267 WeakPolarHBondContact O-CB 3.39Å; L263-A267 PolarHBondContact O-N 3.32Å |
| 264 | A | 98.7 | Very high | 98.6 | Very high | 54 Ų | 54 | 93.9 Ų | 93.9 | 45% | 0.446 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.9 | -41.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | N260 T261 A267 S268 | N260-A264 WeakPolarHBondContact O-CB 3.47Å; N260-A264 PolarHBondContact O-N 2.97Å; T261-A264 PolarHBondContact O-N 2.85Å; A264-A267 PolarHBondContact O-N 3.28Å; A264-S268 PolarHBondContact O-N 3.07Å |
| 265 | S | 98.7 | Very high | 98.6 | Very high | 70 Ų | 70 | 89.4 Ų | 89.4 | 49% | 0.49 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.7 | -42.9 | 176 | 73.4 | 0 | 0 | 0 | 0 | 111.4 | T261 D262 A267 S268 L269 | T261-S265 PolarHBondContact O-N 2.97Å; D262-S265 PolarHBondContact O-OG 3.43Å; S265-A267 PolarHBondContact O-N 3.06Å; S265-S268 WeakPolarHBondContact O-CB 3.38Å; S265-S268 PolarHBondContact O-N 3.38Å; S265-S268 VanDerWaalsContact O-N 3.14Å; S265-L269 PolarHBondContact O-N 3.43Å |
| 266 | T | 98.6 | Very high | 98.6 | Very high | 74 Ų | 74 | 90.2 Ų | 90.2 | 45% | 0.454 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.8 | -45.9 | 174.1 | -55.7 | 0 | 0 | 0 | 0 | 111.4 | D262 L263 S268 L269 L270 | D262-T266 WeakPolarHBondContact O-CB 3.35Å; D262-T266 PolarHBondContact O-N 3.42Å; D262-T266 PolarHBondContact O-OG1 3.35Å; L263-T266 PolarHBondContact O-N 2.93Å; T266-S268 VanDerWaalsContact C-N 3.3Å; T266-S268 PolarHBondContact O-N 3.3Å; T266-L269 PolarHBondContact O-N 2.93Å; T266-L270 HydrophobicContact CG2-CD1 4.27Å; T266-L270 WeakPolarHBondContact O-CG 3.32Å; T266-L270 PolarHBondContact O-N 2.83Å |
| 267 | A | 98.6 | Very high | 98.5 | Very high | 32 Ų | 32 | 91.2 Ų | 91.2 | 26% | 0.264 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.9 | -30.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L263 A264 S265 R271 | L263-A267 VanDerWaalsContact O-CB 3.31Å; L263-A267 WeakPolarHBondContact O-CB 3.39Å; L263-A267 PolarHBondContact O-N 3.32Å; A264-A267 PolarHBondContact O-N 3.28Å; S265-A267 PolarHBondContact O-N 3.06Å; A267-R271 WeakPolarHBondContact O-CB 3.29Å; A267-R271 VanDerWaalsContact O-CG 3.25Å; A267-R271 WeakPolarHBondContact O-CG 3.4Å; A267-R271 PolarHBondContact O-N 3.21Å; A267-R271 VanDerWaalsContact O-N 3.11Å; A267-R271 PolarHBondContact O-NH1 3.5Å |
| 268 | S | 98.5 | Very high | 98.4 | Very high | 73 Ų | 73 | 91.5 Ų | 91.5 | 51% | 0.51 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.3 | -45.1 | 171.9 | -161.9 | 0 | 0 | 0 | 0 | 111.4 | A264 S265 T266 L270 R271 E272 | A264-S268 PolarHBondContact O-N 3.07Å; S265-S268 WeakPolarHBondContact O-CB 3.38Å; S265-S268 PolarHBondContact O-N 3.38Å; S265-S268 VanDerWaalsContact O-N 3.14Å; T266-S268 VanDerWaalsContact C-N 3.3Å; T266-S268 PolarHBondContact O-N 3.3Å; S268-L270 PolarHBondContact O-N 3.49Å; S268-R271 PolarHBondContact O-N 2.9Å; S268-E272 WeakPolarHBondContact O-CB 3.47Å; S268-E272 PolarHBondContact O-N 2.85Å |
| 269 | L | 98.6 | Very high | 98.3 | Very high | 101 Ų | 101 | 93.1 Ų | 93.1 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.2 | -43.5 | 176.9 | 179.6 | 62.6 | 0 | 0 | 0 | 112 | S265 T266 E272 Q273 | S265-L269 PolarHBondContact O-N 3.43Å; T266-L269 PolarHBondContact O-N 2.93Å; L269-E272 PolarHBondContact O-N 3.27Å; L269-Q273 WeakPolarHBondContact O-CG 3.48Å; L269-Q273 PolarHBondContact O-N 2.93Å |
| 270 | L | 98.7 | Very high | 98.2 | Very high | 98 Ų | 98 | 94.9 Ų | 94.9 | 51% | 0.513 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.9 | -40 | 176.9 | -69.6 | 171 | 0 | 0 | 0 | 112.1 | T266 S268 E272 Q273 V274 | T266-L270 HydrophobicContact CG2-CD1 4.27Å; T266-L270 WeakPolarHBondContact O-CG 3.32Å; T266-L270 PolarHBondContact O-N 2.83Å; S268-L270 PolarHBondContact O-N 3.49Å; L270-E272 VanDerWaalsContact C-N 3.35Å; L270-Q273 PolarHBondContact O-N 2.86Å; L270-V274 WeakPolarHBondContact O-CG2 3.43Å; L270-V274 PolarHBondContact O-N 3.22Å |
| 271 | R | 98.4 | Very high | 98 | Very high | 171 Ų | 171 | 92.3 Ų | 92.3 | 65% | 0.645 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.5 | -42.1 | 174 | -74.8 | 176.7 | -167.5 | 109.4 | -3.6 | 111.7 | A267 S268 V274 A275 | A267-R271 WeakPolarHBondContact O-CB 3.29Å; A267-R271 VanDerWaalsContact O-CG 3.25Å; A267-R271 WeakPolarHBondContact O-CG 3.4Å; A267-R271 PolarHBondContact O-N 3.21Å; A267-R271 VanDerWaalsContact O-N 3.11Å; A267-R271 PolarHBondContact O-NH1 3.5Å; S268-R271 PolarHBondContact O-N 2.9Å; R271-V274 PolarHBondContact O-N 3.42Å; R271-A275 WeakPolarHBondContact O-CB 3.39Å; R271-A275 PolarHBondContact O-N 2.87Å |
| 272 | E | 98.5 | Very high | 97.8 | Very high | 98 Ų | 98 | 92.6 Ų | 92.6 | 46% | 0.458 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.5 | -46.3 | 176 | 179.1 | 55.3 | -150.5 | 0 | 0 | 111.4 | S268 L269 L270 V274 A275 Q276 | S268-E272 WeakPolarHBondContact O-CB 3.47Å; S268-E272 PolarHBondContact O-N 2.85Å; L269-E272 PolarHBondContact O-N 3.27Å; L270-E272 VanDerWaalsContact C-N 3.35Å; E272-V274 VanDerWaalsContact C-N 3.32Å; E272-V274 PolarHBondContact O-N 2.93Å; E272-A275 WeakPolarHBondContact O-CB 3.48Å; E272-A275 PolarHBondContact O-N 3.27Å; E272-A275 VanDerWaalsContact O-N 3.13Å; E272-Q276 WeakPolarHBondContact O-CG 3.29Å; E272-Q276 PolarHBondContact O-N 3.08Å; E272-Q276 WeakPolarHBondContact OE1-CG 3.41Å; E272-Q276 PolarHBondContact OE1-NE2 2.98Å |
| 273 | Q | 98.4 | Very high | 97.6 | Very high | 100 Ų | 100 | 92.3 Ų | 92.3 | 47% | 0.467 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.6 | -41.8 | 174.4 | -73.6 | 175.2 | -9.4 | 0 | 0 | 112.4 | L269 L270 L277 | L269-Q273 WeakPolarHBondContact O-CG 3.48Å; L269-Q273 PolarHBondContact O-N 2.93Å; L270-Q273 PolarHBondContact O-N 2.86Å; Q273-L277 WeakPolarHBondContact O-CB 3.44Å; Q273-L277 PolarHBondContact O-N 3.42Å |
| 274 | V | 98.4 | Very high | 97.3 | Very high | 75 Ų | 75 | 90.9 Ų | 90.9 | 46% | 0.455 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.5 | -40.3 | 174.8 | 169 | 0 | 0 | 0 | 0 | 111.4 | L270 R271 E272 L277 K278 | L270-V274 WeakPolarHBondContact O-CG2 3.43Å; L270-V274 PolarHBondContact O-N 3.22Å; R271-V274 PolarHBondContact O-N 3.42Å; E272-V274 VanDerWaalsContact C-N 3.32Å; E272-V274 PolarHBondContact O-N 2.93Å; V274-L277 PolarHBondContact O-N 3.27Å; V274-K278 HydrophobicContact CG1-CD 4.12Å; V274-K278 HydrophobicContact CG1-CG 4.47Å; V274-K278 WeakPolarHBondContact O-CB 3.47Å; V274-K278 VanDerWaalsContact O-CG 3.29Å; V274-K278 WeakPolarHBondContact O-CG 3.25Å; V274-K278 PolarHBondContact O-N 2.97Å |
| 275 | A | 98.1 | Very high | 97.1 | Very high | 49 Ų | 49 | 91.6 Ų | 91.6 | 41% | 0.405 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.1 | -46.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | R271 E272 L277 K278 Q279 | R271-A275 WeakPolarHBondContact O-CB 3.39Å; R271-A275 PolarHBondContact O-N 2.87Å; E272-A275 WeakPolarHBondContact O-CB 3.48Å; E272-A275 PolarHBondContact O-N 3.27Å; E272-A275 VanDerWaalsContact O-N 3.13Å; A275-L277 PolarHBondContact O-N 3.35Å; A275-K278 PolarHBondContact O-N 3.22Å; A275-Q279 WeakPolarHBondContact O-CB 3.38Å; A275-Q279 PolarHBondContact O-N 3.43Å |
| 276 | Q | 98.1 | Very high | 96.8 | Very high | 93 Ų | 93 | 94 Ų | 94 | 44% | 0.435 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61 | -41.5 | 175 | -69.9 | 178.6 | 16.1 | 0 | 0 | 112.3 | E272 Q279 K280 | E272-Q276 WeakPolarHBondContact O-CG 3.29Å; E272-Q276 PolarHBondContact O-N 3.08Å; E272-Q276 WeakPolarHBondContact OE1-CG 3.41Å; E272-Q276 PolarHBondContact OE1-NE2 2.98Å; Q276-Q279 PolarHBondContact O-N 3.41Å; Q276-K280 WeakPolarHBondContact O-CG 3.36Å; Q276-K280 PolarHBondContact O-N 2.87Å |
| 277 | L | 97.7 | Very high | 96.5 | Very high | 112 Ų | 112 | 94.9 Ų | 94.9 | 59% | 0.586 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.7 | -44.6 | 177.4 | -174.4 | 61.5 | 0 | 0 | 0 | 111.3 | Q273 V274 A275 Q279 K280 V281 | Q273-L277 WeakPolarHBondContact O-CB 3.44Å; Q273-L277 PolarHBondContact O-N 3.42Å; V274-L277 PolarHBondContact O-N 3.27Å; A275-L277 PolarHBondContact O-N 3.35Å; L277-Q279 VanDerWaalsContact C-N 3.32Å; L277-Q279 PolarHBondContact O-N 2.99Å; L277-K280 PolarHBondContact O-N 3.45Å; L277-V281 WeakPolarHBondContact O-CG2 3.31Å; L277-V281 PolarHBondContact O-N 3.47Å |
| 278 | K | 96.1 | Very high | 96 | Very high | 148 Ų | 148 | 96.7 Ų | 96.7 | 64% | 0.643 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -57.7 | -43.4 | 173.2 | -76.6 | 176.9 | 177.2 | -174.5 | 0 | 111.8 | V274 A275 V281 L282 | V274-K278 HydrophobicContact CG1-CD 4.12Å; V274-K278 HydrophobicContact CG1-CG 4.47Å; V274-K278 WeakPolarHBondContact O-CB 3.47Å; V274-K278 VanDerWaalsContact O-CG 3.29Å; V274-K278 WeakPolarHBondContact O-CG 3.25Å; V274-K278 PolarHBondContact O-N 2.97Å; A275-K278 PolarHBondContact O-N 3.22Å; K278-V281 PolarHBondContact O-N 3.14Å; K278-L282 WeakPolarHBondContact O-CB 3.15Å; K278-L282 PolarHBondContact O-N 3.16Å |
| 279 | Q | 97.1 | Very high | 95.5 | Very high | 106 Ų | 106 | 95.5 Ų | 95.5 | 50% | 0.495 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 176.9 | -176.5 | 57.5 | 72.7 | 0 | 0 | 112 | A275 Q276 L277 L282 T283 | A275-Q279 WeakPolarHBondContact O-CB 3.38Å; A275-Q279 PolarHBondContact O-N 3.43Å; Q276-Q279 PolarHBondContact O-N 3.41Å; L277-Q279 VanDerWaalsContact C-N 3.32Å; L277-Q279 PolarHBondContact O-N 2.99Å; Q279-L282 PolarHBondContact O-N 2.82Å; Q279-T283 PolarHBondContact NE2-OG1 3.48Å; Q279-T283 PolarHBondContact O-N 2.97Å; Q279-T283 PolarHBondContact O-OG1 3.46Å; Q279-T283 VanDerWaalsContact O-OG1 3.04Å |
| 280 | K | 95.6 | Very high | 94.5 | Very high | 139 Ų | 139 | 99.4 Ų | 99.4 | 60% | 0.604 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.9 | -43.9 | 175.3 | -74.3 | 173.5 | -178.1 | 177 | 0 | 112.1 | Q276 L277 T283 H284 | Q276-K280 WeakPolarHBondContact O-CG 3.36Å; Q276-K280 PolarHBondContact O-N 2.87Å; L277-K280 PolarHBondContact O-N 3.45Å; K280-T283 PolarHBondContact O-N 2.8Å; K280-H284 WeakPolarHBondContact O-CB 3.39Å; K280-H284 PolarHBondContact O-N 2.85Å |
| 281 | V | 94.9 | Very high | 93.2 | Very high | 60 Ų | 60 | 99.6 Ų | 99.6 | 36% | 0.364 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.3 | -44.1 | 175.6 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | L277 K278 T283 H284 V285 | L277-V281 WeakPolarHBondContact O-CG2 3.31Å; L277-V281 PolarHBondContact O-N 3.47Å; K278-V281 PolarHBondContact O-N 3.14Å; V281-T283 PolarHBondContact O-N 3.48Å; V281-H284 WeakPolarHBondContact O-CB 3.4Å; V281-H284 PolarHBondContact O-N 3.34Å; V281-V285 HydrophobicContact CG1-CG2 4.5Å; V281-V285 WeakPolarHBondContact O-CG2 3.48Å; V281-V285 PolarHBondContact O-N 2.96Å |
| 282 | L | 94 | Very high | 91.7 | Very high | 90 Ų | 90 | 98.9 Ų | 98.9 | 47% | 0.471 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.1 | -43.6 | 176.8 | -177.6 | 61 | 0 | 0 | 0 | 111.8 | K278 Q279 H284 V285 N286 | K278-L282 WeakPolarHBondContact O-CB 3.15Å; K278-L282 PolarHBondContact O-N 3.16Å; Q279-L282 PolarHBondContact O-N 2.82Å; L282-H284 VanDerWaalsContact C-N 3.35Å; L282-H284 PolarHBondContact O-N 3.27Å; L282-V285 PolarHBondContact O-N 2.88Å; L282-N286 WeakPolarHBondContact O-CB 3.06Å; L282-N286 PolarHBondContact O-N 3.23Å; L282-N286 PolarHBondContact O-ND2 3.44Å; L282-N286 PolarHBondContact O-OD1 3.39Å |
| 283 | T | 94.8 | Very high | 90.2 | Very high | 75 Ų | 75 | 98.9 Ų | 98.9 | 46% | 0.46 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 174.3 | -58.1 | 0 | 0 | 0 | 0 | 111.8 | Q279 K280 V281 N286 S287 | Q279-T283 PolarHBondContact NE2-OG1 3.48Å; Q279-T283 PolarHBondContact O-N 2.97Å; Q279-T283 PolarHBondContact O-OG1 3.46Å; Q279-T283 VanDerWaalsContact O-OG1 3.04Å; K280-T283 PolarHBondContact O-N 2.8Å; V281-T283 PolarHBondContact O-N 3.48Å; T283-N286 PolarHBondContact O-N 2.92Å; T283-S287 PolarHBondContact O-N 3.24Å; T283-S287 PolarHBondContact O-OG 3.19Å |
| 284 | H | 93.5 | Very high | 88.4 | Confident | 91 Ų | 91 | 102.3 Ų | 102.3 | 42% | 0.421 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.8 | -42.3 | 177.8 | -173.7 | -113.5 | 0 | 0 | 0 | 112.6 | K280 V281 L282 S287 C289 | K280-H284 WeakPolarHBondContact O-CB 3.39Å; K280-H284 PolarHBondContact O-N 2.85Å; V281-H284 WeakPolarHBondContact O-CB 3.4Å; V281-H284 PolarHBondContact O-N 3.34Å; L282-H284 VanDerWaalsContact C-N 3.35Å; L282-H284 PolarHBondContact O-N 3.27Å; H284-S287 WeakPolarHBondContact O-CB 3.35Å; H284-S287 PolarHBondContact O-N 2.97Å; H284-C289 WeakPolarHBondContact CE1-CB 3.26Å; H284-C289 WeakPolarHBondContact ND1-CB 3.45Å; H284-C289 PolarHBondContact NE2-SG 3.02Å; H284-C289 WeakPolarHBondContact O-CB 3.41Å; H284-C289 PolarHBondContact O-N 2.65Å |
| 285 | V | 93.4 | Very high | 86.3 | Confident | 68 Ų | 68 | 105.8 Ų | 105.8 | 41% | 0.412 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63 | -43.7 | 173.5 | 172 | 0 | 0 | 0 | 0 | 110.9 | V281 L282 S287 G288 M291 | V281-V285 HydrophobicContact CG1-CG2 4.5Å; V281-V285 WeakPolarHBondContact O-CG2 3.48Å; V281-V285 PolarHBondContact O-N 2.96Å; L282-V285 PolarHBondContact O-N 2.88Å; V285-S287 PolarHBondContact O-N 3.03Å; V285-G288 PolarHBondContact O-N 3.39Å; V285-M291 HydrophobicContact CG2-CB 4.33Å; V285-M291 HydrophobicContact CG2-CG 3.6Å |
| 286 | N | 91.9 | Very high | 84.2 | Confident | 122 Ų | 122 | 108.8 Ų | 108.8 | 65% | 0.652 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.7 | -26.7 | 176.7 | -68.1 | -9.2 | 0 | 0 | 0 | 113 | L282 T283 G288 | L282-N286 WeakPolarHBondContact O-CB 3.06Å; L282-N286 PolarHBondContact O-N 3.23Å; L282-N286 PolarHBondContact O-ND2 3.44Å; L282-N286 PolarHBondContact O-OD1 3.39Å; T283-N286 PolarHBondContact O-N 2.92Å; N286-G288 PolarHBondContact O-N 3.44Å |
| 287 | S | 93.4 | Very high | 81.6 | Confident | 92 Ų | 92 | 111.9 Ų | 111.9 | 64% | 0.643 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | 4.1 | 170.4 | -66.5 | 0 | 0 | 0 | 0 | 114.1 | T283 H284 V285 | T283-S287 PolarHBondContact O-N 3.24Å; T283-S287 PolarHBondContact O-OG 3.19Å; H284-S287 WeakPolarHBondContact O-CB 3.35Å; H284-S287 PolarHBondContact O-N 2.97Å; V285-S287 PolarHBondContact O-N 3.03Å |
| 288 | G | 87.9 | Confident | 79.2 | Confident | 69 Ų | 69 | 113 Ų | 113 | 71% | 0.711 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 92.3 | 8.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115 | V285 N286 | V285-G288 PolarHBondContact O-N 3.39Å; N286-G288 PolarHBondContact O-N 3.44Å |
| 289 | C | 87.8 | Confident | 76.8 | Confident | 49 Ų | 49 | 117.2 Ų | 117.2 | 33% | 0.331 | 63% | 0.628 | S | S | . | * | trans | -83.3 | 119.3 | 179.8 | -60.9 | 0 | 0 | 0 | 0 | 111.7 | H284 M291 | H284-C289 WeakPolarHBondContact CE1-CB 3.26Å; H284-C289 WeakPolarHBondContact ND1-CB 3.45Å; H284-C289 PolarHBondContact NE2-SG 3.02Å; H284-C289 WeakPolarHBondContact O-CB 3.41Å; H284-C289 PolarHBondContact O-N 2.65Å; C289-M291 PolarHBondContact O-N 2.98Å | ||
| 290 | Q | 78.9 | Confident | 75.8 | Confident | 183 Ų | 183 | 117.8 Ų | 117.8 | 86% | 0.855 | 64% | 0.635 | S | S | * | * | trans | -80.2 | 101.6 | -176.5 | -167.8 | 161.6 | 17.3 | 0 | 0 | 111.8 | L292 | Q290-L292 PolarHBondContact O-N 3.28Š| ||
| 291 | M | 71.4 | Confident | 74.8 | Confident | 102 Ų | 102 | 116.6 Ų | 116.6 | 50% | 0.502 | 64% | 0.636 | S | S | . | * | trans | -82.3 | 104.9 | 174.1 | -59 | -66.4 | -70.2 | 0 | 0 | 109.5 | V285 C289 P293 | V285-M291 HydrophobicContact CG2-CB 4.33Å; V285-M291 HydrophobicContact CG2-CG 3.6Å; C289-M291 PolarHBondContact O-N 2.98Å; M291-P293 WeakPolarHBondContact O-CD 3.3Å | ||
| 292 | L | 66.4 | Low | 73.6 | Confident | 155 Ų | 155 | 119.8 Ų | 119.8 | 81% | 0.812 | 65% | 0.652 | S | S | * | * | trans | -72.2 | 122.6 | 168.6 | -82.1 | 163.7 | 0 | 0 | 0 | 109.4 | Q290 H294 | Q290-L292 PolarHBondContact O-N 3.28Å; L292-H294 PolarHBondContact O-N 2.7Å | ||
| 293 | P | 67 | Low | 72.4 | Confident | 99 Ų | 99 | 121.5 Ų | 121.5 | 64% | 0.643 | 66% | 0.662 | S | S | * | * | trans | -69.2 | 116.4 | 173.7 | 28.2 | -32 | 0 | 0 | 0 | 109.1 | M291 E295 | M291-P293 WeakPolarHBondContact O-CD 3.3Å; P293-E295 PolarHBondContact O-N 2.96Å | ||
| 294 | H | 59.8 | Low | 71 | Confident | 171 Ų | 171 | 124.4 Ų | 124.4 | 79% | 0.792 | 68% | 0.675 | S | S | * | * | trans | -86.8 | 92.9 | 168.4 | -162 | 66.6 | 0 | 0 | 0 | 107.8 | L292 V296 | L292-H294 PolarHBondContact O-N 2.7Å; H294-V296 PolarHBondContact O-N 2.67Å | ||
| 295 | E | 54.9 | Low | 69.5 | Low | 149 Ų | 149 | 126.7 Ų | 126.7 | 70% | 0.696 | 69% | 0.692 | S | S | * | * | trans | -63.1 | 96 | 175.6 | -66.8 | -64 | 122.4 | 0 | 0 | 109.5 | P293 Q297 | P293-E295 PolarHBondContact O-N 2.96Å; E295-Q297 PolarHBondContact O-N 3.25Å | ||
| 296 | V | 54.3 | Low | 67.8 | Low | 111 Ų | 111 | 130.9 Ų | 130.9 | 67% | 0.673 | 71% | 0.712 | S | S | * | * | trans | -75.4 | 96 | 173.2 | -178 | 0 | 0 | 0 | 0 | 107.8 | H294 V298 | H294-V296 PolarHBondContact O-N 2.67Å; V296-V298 PolarHBondContact O-N 3.38Å | ||
| 297 | Q | 44 | Very low | 66 | Low | 158 Ų | 158 | 131.5 Ų | 131.5 | 74% | 0.738 | 72% | 0.716 | S | S | * | * | trans | -67.2 | 92.2 | 178.8 | -144.6 | 108.7 | 45.1 | 0 | 0 | 110.3 | E295 H299 | E295-Q297 PolarHBondContact O-N 3.25Å; Q297-H299 PolarHBondContact O-N 2.87Å | ||
| 298 | V | 47.2 | Very low | 63.7 | Low | 135 Ų | 135 | 134.8 Ų | 134.8 | 82% | 0.818 | 72% | 0.722 | S | S | * | * | trans | -70.3 | 114.5 | 173.1 | -175.9 | 0 | 0 | 0 | 0 | 108.6 | V296 | V296-V298 PolarHBondContact O-N 3.38Š| ||
| 299 | H | 45.1 | Very low | 61.5 | Low | 237 Ų | 237 | 140.8 Ų | 140.8 | 100% | 1.097 | 72% | 0.723 | S | S | * | * | trans | -93.5 | 0 | 164.4 | -79.3 | 70.7 | 0 | 0 | 0 | 109.7 | Q297 | Q297-H299 PolarHBondContact O-N 2.87Š|
Retrieved 299 of 299 residues in 177 ms
(Link to these results)