| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.5 | Very low | 29.1 | Very low | 238 Ų | 238 | 138.9 Ų | 138.9 | 100% | 1.172 | 83% | 0.83 | S | S | * | * | 0 | 133.8 | 0 | -70.6 | 169 | -176.5 | 0 | 0 | 108.2 | |||||
| 2 | V | 39.9 | Very low | 29.1 | Very low | 151 Ų | 151 | 135 Ų | 135 | 92% | 0.915 | 82% | 0.824 | S | S | * | * | trans | 51.6 | 95.6 | 174.1 | -153.8 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 3 | G | 24.6 | Very low | 29 | Very low | 64 Ų | 64 | 133.5 Ų | 133.5 | 66% | 0.66 | 82% | 0.818 | S | S | * | * | trans | -105 | -162.3 | 154.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 4 | M | 25.7 | Very low | 28.8 | Very low | 188 Ų | 188 | 135.4 Ų | 135.4 | 93% | 0.926 | 82% | 0.82 | S | S | * | * | trans | 83.4 | 151.4 | -177.6 | -62.4 | -157.1 | 134.6 | 0 | 0 | 116.8 | ||||
| 5 | P | 29.4 | Very low | 28.9 | Very low | 87 Ų | 87 | 137.1 Ų | 137.1 | 57% | 0.565 | 82% | 0.822 | S | S | * | * | -137.2 | 174 | -52.1 | 37.7 | -21.7 | 0 | 0 | 0 | 113.2 | Y7 | P5-Y7 HydrophobicContact CG-CD2 3.91Å; P5-Y7 HydrophobicContact CG-CE2 3.78Å | |||
| 6 | I | 26.7 | Very low | 28.8 | Very low | 161 Ų | 161 | 139.1 Ų | 139.1 | 83% | 0.826 | 82% | 0.817 | S | S | * | * | trans | -69.8 | 125.2 | 162 | -64.4 | 163.7 | 0 | 0 | 0 | 107.9 | ||||
| 7 | Y | 29.8 | Very low | 29 | Very low | 195 Ų | 195 | 142 Ų | 142 | 77% | 0.765 | 82% | 0.821 | S | S | * | * | trans | -103.4 | 105.4 | 168.2 | -101.7 | -82 | 0 | 0 | 0 | 110.9 | P5 A9 | P5-Y7 HydrophobicContact CG-CD2 3.91Å; P5-Y7 HydrophobicContact CG-CE2 3.78Å; Y7-A9 HydrophobicContact CD1-CB 4.16Å | ||
| 8 | L | 25.5 | Very low | 28.8 | Very low | 172 Ų | 172 | 141.7 Ų | 141.7 | 90% | 0.901 | 81% | 0.814 | S | S | * | * | trans | -81.2 | 107.7 | 149.9 | -94.2 | 149.5 | 0 | 0 | 0 | 106.8 | ||||
| 9 | A | 29.3 | Very low | 28.8 | Very low | 86 Ų | 86 | 142.9 Ų | 142.9 | 71% | 0.711 | 81% | 0.814 | S | S | * | * | trans | -152.4 | 135.2 | 169.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | Y7 | Y7-A9 HydrophobicContact CD1-CB 4.16Š| ||
| 10 | G | 27.1 | Very low | 28.9 | Very low | 74 Ų | 74 | 140.8 Ų | 140.8 | 76% | 0.763 | 81% | 0.808 | S | S | * | * | cis | -164.4 | 147.7 | -10.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | A12 | G10-A12 PolarHBondContact O-N 3.35Š| ||
| 11 | A | 27.2 | Very low | 28.7 | Very low | 112 Ų | 112 | 138.3 Ų | 138.3 | 93% | 0.926 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 119.3 | 165.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||
| 12 | A | 29.2 | Very low | 28.6 | Very low | 92 Ų | 92 | 132 Ų | 132 | 76% | 0.76 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -92 | 148.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | G10 | G10-A12 PolarHBondContact O-N 3.35Š|
| 13 | P | 28.2 | Very low | 28 | Very low | 115 Ų | 115 | 134.4 Ų | 134.4 | 75% | 0.747 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -86 | 152.2 | -143.4 | 31.2 | -36.8 | 0 | 0 | 0 | 115.5 | N15 | P13-N15 PolarHBondContact O-N 3.43Š|
| 14 | L | 26.3 | Very low | 28.2 | Very low | 160 Ų | 160 | 135.5 Ų | 135.5 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | trans | -59.9 | 109.2 | 160.6 | -154.6 | 94.7 | 0 | 0 | 0 | 109 | ||||
| 15 | N | 30.5 | Very low | 28.5 | Very low | 161 Ų | 161 | 132.6 Ų | 132.6 | 86% | 0.861 | 78% | 0.778 | S | S | * | * | trans | -90.2 | 131.1 | 170.1 | -130.7 | 10.5 | 0 | 0 | 0 | 109.5 | P13 | P13-N15 PolarHBondContact O-N 3.43Š| ||
| 16 | K | 27.6 | Very low | 28.4 | Very low | 169 Ų | 169 | 134.7 Ų | 134.7 | 74% | 0.735 | 79% | 0.79 | S | S | * | * | trans | -96.4 | 115.6 | -172.5 | -68.3 | 173.9 | 176.2 | 176.4 | 0 | 111.1 | ||||
| 17 | E | 30.7 | Very low | 28.6 | Very low | 189 Ų | 189 | 135.8 Ų | 135.8 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | trans | -128 | 107.8 | 144.3 | -67.8 | -170 | 143.6 | 0 | 0 | 106.1 | ||||
| 18 | I | 26.7 | Very low | 28.3 | Very low | 136 Ų | 136 | 131.4 Ų | 131.4 | 70% | 0.697 | 79% | 0.789 | S | S | * | * | 73.4 | 78.9 | 67.2 | -60.8 | 163.2 | 0 | 0 | 0 | 110.7 | |||||
| 19 | M | 28.1 | Very low | 28.6 | Very low | 166 Ų | 166 | 132.9 Ų | 132.9 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | 163.6 | 133.8 | 115.2 | -92.5 | 157.2 | 70.9 | 0 | 0 | 112.8 | |||||
| 20 | S | 30.5 | Very low | 28.5 | Very low | 99 Ų | 99 | 136.7 Ų | 136.7 | 69% | 0.692 | 79% | 0.791 | S | S | * | * | trans | 24.2 | 115.8 | 155.8 | 46.8 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 21 | A | 25.9 | Very low | 28.7 | Very low | 90 Ų | 90 | 138 Ų | 138 | 74% | 0.744 | 79% | 0.785 | S | S | * | * | 62.8 | 150.7 | 59.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 22 | P | 30.9 | Very low | 28.6 | Very low | 104 Ų | 104 | 139.6 Ų | 139.6 | 68% | 0.675 | 78% | 0.777 | S | S | * | * | cis | -148.5 | -174.1 | -16.3 | 35.8 | -13.5 | 0 | 0 | 0 | 116.9 | ||||
| 23 | F | 28.9 | Very low | 28.6 | Very low | 202 Ų | 202 | 145.1 Ų | 145.1 | 89% | 0.886 | 78% | 0.784 | S | S | * | * | trans | 65.1 | 133.7 | 150.6 | -69.4 | -59.7 | 0 | 0 | 0 | 122.6 | ||||
| 24 | A | 28.4 | Very low | 28.4 | Very low | 88 Ų | 88 | 146.5 Ų | 146.5 | 73% | 0.727 | 79% | 0.785 | S | S | * | * | trans | -80.6 | 172.4 | 160.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 25 | P | 30.6 | Very low | 28.6 | Very low | 127 Ų | 127 | 147 Ų | 147 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | -145.5 | 172.5 | 97.1 | 38.3 | -22.9 | 0 | 0 | 0 | 116 | |||||
| 26 | T | 27.3 | Very low | 28.4 | Very low | 131 Ų | 131 | 146.7 Ų | 146.7 | 80% | 0.804 | 78% | 0.78 | S | S | * | * | trans | -72.3 | 141.5 | 171.3 | 48 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 27 | E | 31.6 | Very low | 28.5 | Very low | 183 Ų | 183 | 146.8 Ų | 146.8 | 86% | 0.855 | 79% | 0.788 | S | S | * | * | trans | -142 | 145.6 | 143.4 | -79.2 | -152.4 | 156.2 | 0 | 0 | 111.3 | ||||
| 28 | S | 24.1 | Very low | 28.2 | Very low | 103 Ų | 103 | 143 Ų | 143 | 72% | 0.72 | 78% | 0.778 | S | S | * | * | trans | -104.9 | 133.2 | -179.7 | 53.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 29 | F | 30.9 | Very low | 28.5 | Very low | 204 Ų | 204 | 143.8 Ų | 143.8 | 90% | 0.895 | 78% | 0.784 | S | S | * | * | trans | -130.6 | 152.5 | 159.6 | -97.3 | -83.5 | 0 | 0 | 0 | 112.5 | ||||
| 30 | H | 28.1 | Very low | 28.6 | Very low | 165 Ų | 165 | 145 Ų | 145 | 76% | 0.764 | 79% | 0.785 | S | S | * | * | trans | -111.7 | 169.3 | -150.6 | -134 | -81.4 | 0 | 0 | 0 | 112.5 | ||||
| 31 | T | 30.2 | Very low | 28.8 | Very low | 102 Ų | 102 | 150.3 Ų | 150.3 | 63% | 0.626 | 80% | 0.798 | S | S | * | * | trans | 71.1 | 110.1 | 153.8 | 51.9 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 32 | N | 25.2 | Very low | 28.8 | Very low | 145 Ų | 145 | 154.2 Ų | 154.2 | 78% | 0.775 | 80% | 0.801 | S | S | * | * | 53.9 | 118 | 117.4 | -56.4 | -23.5 | 0 | 0 | 0 | 121 | |||||
| 33 | K | 30.9 | Very low | 28.8 | Very low | 208 Ų | 208 | 156.1 Ų | 156.1 | 90% | 0.904 | 81% | 0.811 | S | S | * | * | -156.7 | 134.8 | 108.1 | -121.3 | 174 | -179.8 | 178.8 | 0 | 113.3 | |||||
| 34 | L | 23.9 | Very low | 28.7 | Very low | 145 Ų | 145 | 151 Ų | 151 | 76% | 0.759 | 80% | 0.796 | S | S | * | * | trans | -63.2 | 152.8 | 163.8 | -85.1 | 69 | 0 | 0 | 0 | 110.3 | ||||
| 35 | L | 29.7 | Very low | 28.7 | Very low | 169 Ų | 169 | 155 Ų | 155 | 89% | 0.885 | 80% | 0.799 | S | S | * | * | trans | -148.1 | 115.8 | 134.1 | -107.3 | 166.4 | 0 | 0 | 0 | 109.7 | ||||
| 36 | H | 25.7 | Very low | 28.6 | Very low | 155 Ų | 155 | 153.7 Ų | 153.7 | 72% | 0.718 | 79% | 0.794 | S | S | * | * | trans | -71.8 | 136 | 164.6 | -99.8 | -52.9 | 0 | 0 | 0 | 109 | ||||
| 37 | L | 29.4 | Very low | 28.4 | Very low | 172 Ų | 172 | 153.1 Ų | 153.1 | 90% | 0.901 | 79% | 0.79 | S | S | * | * | trans | -133.8 | 123.3 | 148.9 | -81.9 | 172 | 0 | 0 | 0 | 108.5 | ||||
| 38 | T | 26.3 | Very low | 28.3 | Very low | 110 Ų | 110 | 153.6 Ų | 153.6 | 68% | 0.675 | 79% | 0.792 | S | S | * | * | trans | -106.6 | 132.7 | 176.1 | 48.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 39 | D | 32.6 | Very low | 28.3 | Very low | 151 Ų | 151 | 154.5 Ų | 154.5 | 81% | 0.807 | 79% | 0.793 | S | S | * | * | trans | -160.8 | 114.5 | 149.5 | -83.3 | -43.4 | 0 | 0 | 0 | 105.4 | ||||
| 40 | K | 29.1 | Very low | 28.1 | Very low | 193 Ų | 193 | 151.4 Ų | 151.4 | 84% | 0.839 | 79% | 0.791 | S | S | * | * | 60.5 | 102.5 | 75.6 | -75.1 | -169 | 173.4 | -174 | 0 | 113.7 | |||||
| 41 | E | 34.9 | Very low | 27.9 | Very low | 209 Ų | 209 | 148.8 Ų | 148.8 | 98% | 0.977 | 79% | 0.791 | S | S | * | * | -157.8 | 155 | 126.1 | -114.3 | 173.3 | -179.7 | 0 | 0 | 111.2 | |||||
| 42 | E | 25.4 | Very low | 27.9 | Very low | 172 Ų | 172 | 152.1 Ų | 152.1 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -138 | 124 | -158.5 | 170 | -175.1 | -168.1 | 0 | 0 | 109 | ||||
| 43 | V | 31.1 | Very low | 27.9 | Very low | 145 Ų | 145 | 149.4 Ų | 149.4 | 88% | 0.879 | 80% | 0.796 | S | S | * | * | trans | -140.3 | 109.9 | 167.4 | -178.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 44 | T | 26.5 | Very low | 27.7 | Very low | 94 Ų | 94 | 147.1 Ų | 147.1 | 58% | 0.577 | 79% | 0.789 | S | S | * | * | trans | -52.6 | 152.5 | 163.2 | 58.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 45 | Q | 28.8 | Very low | 28 | Very low | 171 Ų | 171 | 148.4 Ų | 148.4 | 80% | 0.799 | 79% | 0.791 | S | S | * | * | 172.9 | 171.3 | 64.3 | -135.4 | 162.3 | 105.8 | 0 | 0 | 105.8 | |||||
| 46 | S | 28.4 | Very low | 27.8 | Very low | 101 Ų | 101 | 145.3 Ų | 145.3 | 71% | 0.706 | 78% | 0.784 | S | S | * | * | cis | -144.7 | 176.2 | 12.3 | -61.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 47 | T | 24.6 | Very low | 28 | Very low | 119 Ų | 119 | 144.8 Ų | 144.8 | 73% | 0.73 | 79% | 0.792 | S | S | * | * | trans | -102.1 | 149.4 | 174.8 | -47.1 | 0 | 0 | 0 | 0 | 111 | V49 | T47-V49 HydrophobicContact CG2-CG1 4.45Å; T47-V49 HydrophobicContact CG2-CG2 4.32Å | ||
| 48 | E | 28.3 | Very low | 28.2 | Very low | 193 Ų | 193 | 141 Ų | 141 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | trans | -147.8 | 137.5 | 140.8 | -130 | 174 | -168.7 | 0 | 0 | 112.1 | ||||
| 49 | V | 23.9 | Very low | 28.4 | Very low | 122 Ų | 122 | 144.1 Ų | 144.1 | 74% | 0.739 | 79% | 0.791 | S | S | * | * | trans | -134.2 | 126.1 | -174.9 | -85.6 | 0 | 0 | 0 | 0 | 109.2 | T47 | T47-V49 HydrophobicContact CG2-CG1 4.45Å; T47-V49 HydrophobicContact CG2-CG2 4.32Å | ||
| 50 | V | 28 | Very low | 28.4 | Very low | 138 Ų | 138 | 143.2 Ų | 143.2 | 84% | 0.836 | 79% | 0.792 | S | S | * | * | trans | -136.5 | 104.8 | 163.5 | -176.5 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 51 | S | 23.7 | Very low | 28.6 | Very low | 111 Ų | 111 | 139.6 Ų | 139.6 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | trans | -89.4 | 135 | 161.1 | 52.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 52 | L | 28.9 | Very low | 28.5 | Very low | 172 Ų | 172 | 135.4 Ų | 135.4 | 90% | 0.901 | 78% | 0.777 | S | S | * | * | trans | -136.7 | 151 | 158.7 | -138.2 | 77.9 | 0 | 0 | 0 | 110.5 | ||||
| 53 | S | 26 | Very low | 29.1 | Very low | 87 Ų | 87 | 133.6 Ų | 133.6 | 61% | 0.608 | 78% | 0.78 | S | S | * | * | trans | -139.6 | 152.4 | -155.1 | 62.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 54 | Q | 27 | Very low | 29 | Very low | 161 Ų | 161 | 137.2 Ų | 137.2 | 75% | 0.752 | 78% | 0.778 | S | S | * | * | trans | 71.7 | 157 | 164.4 | -55.6 | 169.8 | 32 | 0 | 0 | 113.7 | ||||
| 55 | Q | 29.9 | Very low | 29.5 | Very low | 171 Ų | 171 | 140.9 Ų | 140.9 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | cis | -154.2 | -177.2 | 18 | -139 | 157.3 | 62.2 | 0 | 0 | 111.9 | ||||
| 56 | S | 26.2 | Very low | 29.8 | Very low | 105 Ų | 105 | 139.2 Ų | 139.2 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | trans | -95 | -178.6 | -158.5 | -53.9 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 57 | T | 28.9 | Very low | 29.9 | Very low | 144 Ų | 144 | 140.5 Ų | 140.5 | 88% | 0.883 | 78% | 0.783 | S | S | * | * | trans | 90.3 | 145.6 | 162.2 | 77.9 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 58 | A | 33.9 | Very low | 30.4 | Very low | 91 Ų | 91 | 143 Ų | 143 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | cis | -146.2 | -177.3 | 10.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 59 | H | 29.9 | Very low | 30.7 | Very low | 177 Ų | 177 | 143 Ų | 143 | 82% | 0.819 | 78% | 0.782 | S | S | * | * | trans | -70.3 | 171.2 | -173 | -56.3 | -84.1 | 0 | 0 | 0 | 114.6 | ||||
| 60 | T | 32 | Very low | 30.9 | Very low | 132 Ų | 132 | 143.7 Ų | 143.7 | 81% | 0.81 | 78% | 0.781 | S | S | * | * | -169.5 | -170.9 | 59.2 | -21.6 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 61 | P | 34.4 | Very low | 31.3 | Very low | 117 Ų | 117 | 143.4 Ų | 143.4 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | -124.8 | -178.9 | -117.9 | 43.5 | -25 | 0 | 0 | 0 | 119.3 | |||||
| 62 | T | 33.6 | Very low | 31.7 | Very low | 121 Ų | 121 | 148.7 Ų | 148.7 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | trans | -63.8 | 175.4 | -175.5 | 59.7 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 63 | P | 36.2 | Very low | 31.8 | Very low | 134 Ų | 134 | 146.2 Ų | 146.2 | 87% | 0.87 | 78% | 0.779 | S | S | * | * | -128 | 176 | 113.3 | 37.8 | -31.3 | 0 | 0 | 0 | 116.5 | |||||
| 64 | R | 29.7 | Very low | 31.9 | Very low | 221 Ų | 221 | 146.9 Ų | 146.9 | 83% | 0.834 | 78% | 0.782 | S | S | * | * | trans | -95.8 | 159 | -155.1 | -57 | 167.9 | 175.8 | 173.1 | -1.9 | 116.4 | ||||
| 65 | I | 37.4 | Very low | 32.5 | Very low | 170 Ų | 170 | 147.6 Ų | 147.6 | 87% | 0.872 | 79% | 0.789 | S | S | * | * | trans | -129.6 | 147.5 | 144.4 | -64.7 | -175.4 | 0 | 0 | 0 | 109.9 | ||||
| 66 | N | 34.3 | Very low | 32.6 | Very low | 136 Ų | 136 | 146.6 Ų | 146.6 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | trans | -77.9 | 148.7 | -164.4 | -60.1 | -48.1 | 0 | 0 | 0 | 113.7 | ||||
| 67 | H | 30.7 | Very low | 32.8 | Very low | 129 Ų | 129 | 146.5 Ų | 146.5 | 60% | 0.597 | 80% | 0.795 | S | S | * | * | cis | 97.8 | 86.2 | 33.4 | -161.5 | 17.9 | 0 | 0 | 0 | 115.4 | R69 | H67-R69 PolarHBondContact CE1-NE 2.73Š| ||
| 68 | I | 36.6 | Very low | 32.7 | Very low | 170 Ų | 170 | 143.7 Ų | 143.7 | 87% | 0.872 | 80% | 0.795 | S | S | * | * | trans | -144.4 | 90.4 | 153.5 | -56.7 | -177.4 | 0 | 0 | 0 | 107.1 | ||||
| 69 | R | 33 | Very low | 32.5 | Very low | 194 Ų | 194 | 143.1 Ų | 143.1 | 73% | 0.732 | 80% | 0.798 | S | S | * | * | 62.1 | 91.7 | 87.9 | -74.2 | -167.9 | -176.8 | -177.8 | 0.2 | 116.7 | H67 | H67-R69 PolarHBondContact CE1-NE 2.73Š| |||
| 70 | N | 29.6 | Very low | 32.4 | Very low | 136 Ų | 136 | 142.8 Ų | 142.8 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -31 | 135.4 | 142.9 | 173.6 | 15.3 | 0 | 0 | 0 | 114.6 | R72 | N70-R72 PolarHBondContact OD1-N 2.85Š| ||
| 71 | T | 35 | Very low | 32.5 | Very low | 133 Ų | 133 | 143.2 Ų | 143.2 | 82% | 0.816 | 80% | 0.803 | S | S | * | * | trans | -135.2 | 84.5 | 153.4 | 36.2 | 0 | 0 | 0 | 0 | 111.7 | C73 | T71-C73 PolarHBondContact O-N 2.69Š| ||
| 72 | R | 33.4 | Very low | 32.1 | Very low | 222 Ų | 222 | 144.8 Ų | 144.8 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | trans | -54.3 | 123.3 | 147 | 179.1 | -173.9 | -70.7 | 171.9 | -4.5 | 107.7 | N70 | N70-R72 PolarHBondContact OD1-N 2.85Š| ||
| 73 | C | 30.1 | Very low | 32.1 | Very low | 120 Ų | 120 | 145.3 Ų | 145.3 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | trans | -136.6 | 135.5 | 170.4 | -157.1 | 0 | 0 | 0 | 0 | 110.7 | T71 | T71-C73 PolarHBondContact O-N 2.69Š| ||
| 74 | C | 27.7 | Very low | 32 | Very low | 100 Ų | 100 | 148.2 Ų | 148.2 | 68% | 0.676 | 79% | 0.792 | S | S | * | * | trans | -94 | 146.4 | -169.1 | -34.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 75 | I | 39.3 | Very low | 32 | Very low | 176 Ų | 176 | 145.8 Ų | 145.8 | 90% | 0.903 | 80% | 0.796 | S | S | * | * | trans | -133.4 | 139.4 | 152.7 | -58.9 | -175.1 | 0 | 0 | 0 | 108.8 | ||||
| 76 | N | 32.4 | Very low | 31.8 | Very low | 150 Ų | 150 | 143.2 Ų | 143.2 | 80% | 0.802 | 79% | 0.793 | S | S | * | * | trans | -79.3 | 169.3 | -162.5 | -71.8 | -28.1 | 0 | 0 | 0 | 115.5 | ||||
| 77 | A | 29.9 | Very low | 32.1 | Very low | 104 Ų | 104 | 143.4 Ų | 143.4 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -59.5 | 163.8 | 168 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 78 | G | 27.2 | Very low | 33 | Very low | 84 Ų | 84 | 142.4 Ų | 142.4 | 87% | 0.866 | 80% | 0.798 | S | S | * | * | trans | 121.4 | 114.7 | 157.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 79 | G | 29.3 | Very low | 34 | Very low | 79 Ų | 79 | 140.3 Ų | 140.3 | 81% | 0.814 | 79% | 0.788 | S | S | * | * | trans | 140.1 | 71.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | T81 | G79-T81 PolarHBondContact O-N 3.3Š| ||
| 80 | I | 29.3 | Very low | 36.2 | Very low | 171 Ų | 171 | 133 Ų | 133 | 88% | 0.877 | 76% | 0.764 | S | S | * | * | trans | -71.8 | 115.6 | 166.8 | -60.6 | 167.5 | 0 | 0 | 0 | 108 | ||||
| 81 | T | 33.3 | Very low | 39 | Very low | 141 Ų | 141 | 132.2 Ų | 132.2 | 87% | 0.865 | 76% | 0.757 | S | S | * | * | trans | -158.3 | 134.9 | 141.2 | 18.9 | 0 | 0 | 0 | 0 | 111 | G79 | G79-T81 PolarHBondContact O-N 3.3Š| ||
| 82 | N | 26.9 | Very low | 41.9 | Very low | 149 Ų | 149 | 126 Ų | 126 | 80% | 0.797 | 72% | 0.719 | S | S | * | * | trans | -54.1 | 141.7 | 177.7 | -166.7 | 8.9 | 0 | 0 | 0 | 113.3 | ||||
| 83 | E | 32.1 | Very low | 44.8 | Very low | 133 Ų | 133 | 117.3 Ų | 117.3 | 62% | 0.621 | 69% | 0.694 | S | S | * | * | trans | 168.2 | 96.6 | 145 | -88.7 | -84.6 | 101.9 | 0 | 0 | 112.1 | ||||
| 84 | R | 34.1 | Very low | 48 | Very low | 194 Ų | 194 | 111.6 Ų | 111.6 | 73% | 0.732 | 66% | 0.656 | S | S | * | * | trans | 60.3 | 92.5 | 147.3 | -51.3 | 177.2 | -149 | -179.6 | 13.3 | 120.5 | S86 | R84-S86 PolarHBondContact O-N 3.39Š| ||
| 85 | N | 29.6 | Very low | 51.3 | Low | 170 Ų | 170 | 107.1 Ų | 107.1 | 91% | 0.909 | 63% | 0.626 | S | S | * | * | trans | 39.4 | 72 | 142.5 | -65.9 | 3.4 | 0 | 0 | 0 | 118.9 | L87 | N85-L87 PolarHBondContact O-N 3.41Š| ||
| 86 | S | 34.8 | Very low | 53.9 | Low | 117 Ų | 117 | 100.6 Ų | 100.6 | 82% | 0.818 | 60% | 0.602 | S | S | * | * | trans | -89.9 | 92.9 | 170.9 | 45.3 | 0 | 0 | 0 | 0 | 113.1 | R84 | R84-S86 PolarHBondContact O-N 3.39Š| ||
| 87 | L | 39.8 | Very low | 56.9 | Low | 140 Ų | 140 | 94.5 Ų | 94.5 | 73% | 0.733 | 57% | 0.569 | S | S | * | * | trans | -56 | 145.4 | 161 | -88 | 152.8 | 0 | 0 | 0 | 110.4 | N85 L89 | N85-L87 PolarHBondContact O-N 3.41Å; L87-L89 PolarHBondContact O-N 2.97Å | ||
| 88 | P | 49.3 | Very low | 59.7 | Low | 107 Ų | 107 | 92 Ų | 92 | 70% | 0.695 | 55% | 0.548 | S | S | * | . | trans | -60 | 102.3 | 175.8 | -23.1 | 34 | 0 | 0 | 0 | 111.3 | L90 | P88-L90 PolarHBondContact O-N 3.08Š| ||
| 89 | L | 57.8 | Low | 62.6 | Low | 126 Ų | 126 | 88.5 Ų | 88.5 | 66% | 0.66 | 51% | 0.511 | S | S | * | . | trans | -60 | 102.2 | -179.2 | -75.6 | 156.2 | 0 | 0 | 0 | 110.1 | L87 M91 | L87-L89 PolarHBondContact O-N 2.97Å; L89-M91 WeakPolarHBondContact O-CG 3.12Å; L89-M91 PolarHBondContact O-N 2.92Å | ||
| 90 | L | 78.3 | Confident | 65 | Low | 41 Ų | 41 | 86.7 Ų | 86.7 | 22% | 0.215 | 49% | 0.486 | C | S | . | . | trans | -56.3 | 117.8 | 171.3 | -88 | 179.7 | 0 | 0 | 0 | 108.8 | P88 S99 L107 M169 | P88-L90 PolarHBondContact O-N 3.08Å; L90-S99 WeakPolarHBondContact O-CA 3.07Å; L90-S99 WeakPolarHBondContact O-CB 3.39Å; L90-S99 PolarHBondContact O-N 3.46Å; L90-L107 HydrophobicContact CD1-CD2 4.06Å; L90-L107 HydrophobicContact CD2-CD1 3.88Å; L90-L107 HydrophobicContact CD2-CD2 4.35Å; L90-M169 HydrophobicContact CB-CE 3.84Å; L90-M169 HydrophobicContact CB-SD 4.04Å; L90-M169 HydrophobicContact CD1-CE 3.85Å; L90-M169 HydrophobicContact CD1-CG 3.76Å; L90-M169 HydrophobicContact CD1-SD 3.51Å; L90-M169 VanDerWaalsContact CD1-SD 3.51Å; L90-M169 HydrophobicContact CG-CE 4.16Å; L90-M169 HydrophobicContact CG-SD 3.75Å | ||
| 91 | M | 90.5 | Very high | 67.3 | Low | 119 Ų | 119 | 78.5 Ų | 78.5 | 59% | 0.586 | 44% | 0.444 | S | S | * | . | B | Isolated β-bridge | trans | -93.7 | 143.8 | -174.8 | -69.6 | -165.8 | 173.6 | 0 | 0 | 112.2 | L89 A93 | L89-M91 WeakPolarHBondContact O-CG 3.12Å; L89-M91 PolarHBondContact O-N 2.92Å; M91-A93 PolarHBondContact O-N 2.71Å |
| 92 | C | 95.6 | Very high | 69.6 | Low | 3 Ų | 3 | 76.1 Ų | 76.1 | 2% | 0.02 | 42% | 0.421 | C | S | . | . | trans | -65.9 | 115.1 | 173.1 | 174.4 | 0 | 0 | 0 | 0 | 110.4 | V94 C95 G96 D97 C109 | C92-V94 PolarHBondContact O-N 2.77Å; C92-C95 PolarHBondContact O-N 2.85Å; C92-C95 VanDerWaalsContact SG-SG 3.64Å; C92-G96 PolarHBondContact O-N 3.26Å; C92-D97 WeakPolarHBondContact CB-O 3.15Å; C92-D97 PolarHBondContact N-O 3.27Å; C92-C109 HydrophobicContact CB-CB 3.9Å; C92-C109 PolarHBondContact SG-N 3.05Å; C92-C109 VanDerWaalsContact SG-N 3.41Å; C92-C109 VanDerWaalsContact SG-SG 3.61Å | ||
| 93 | A | 94.2 | Very high | 72.4 | Confident | 39 Ų | 39 | 69.3 Ų | 69.3 | 32% | 0.322 | 39% | 0.385 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.5 | -24.1 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | M91 I106 L107 M156 | M91-A93 PolarHBondContact O-N 2.71Å; A93-I106 HydrophobicContact CB-CD1 4.34Å; A93-L107 PolarHBondContact N-O 2.89Å; A93-M156 HydrophobicContact CB-CB 4.45Å; A93-M156 HydrophobicContact CB-CE 3.96Å; A93-M156 HydrophobicContact CB-CG 4.48Å |
| 94 | V | 96.7 | Very high | 75.1 | Confident | 0 Ų | 0 | 64.4 Ų | 64.4 | 0% | 0 | 36% | 0.361 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | -37.6 | 177.5 | -174.9 | 0 | 0 | 0 | 0 | 113.2 | C92 I106 C112 V137 R149 K152 M158 | C92-V94 PolarHBondContact O-N 2.77Å; V94-I106 HydrophobicContact CG2-CD1 3.91Å; V94-C112 HydrophobicContact CB-CB 4.32Å; V94-V137 HydrophobicContact CG1-CG1 4.12Å; V94-V137 WeakPolarHBondContact O-CG1 3.3Å; V94-R149 HydrophobicContact CG1-CG 4.46Å; V94-K152 HydrophobicContact CG1-CB 4.36Å; V94-K152 HydrophobicContact CG1-CD 4.41Å; V94-K152 HydrophobicContact CG1-CG 4.31Å; V94-K152 WeakPolarHBondContact O-CD 3.25Å; V94-K152 WeakPolarHBondContact O-CE 3.08Å; V94-K152 PolarHBondContact O-NZ 2.97Å; V94-M158 HydrophobicContact CG2-CE 4.36Å |
| 95 | C | 97.4 | Very high | 77.4 | Confident | 6 Ų | 6 | 57.2 Ų | 57.2 | 4% | 0.041 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -143 | 2.2 | -169 | 70.2 | 0 | 0 | 0 | 0 | 116.7 | C92 D97 C112 V137 D138 K139 R142 | C92-C95 PolarHBondContact O-N 2.85Å; C92-C95 VanDerWaalsContact SG-SG 3.64Å; C95-D97 PolarHBondContact O-N 2.91Å; C95-D97 VanDerWaalsContact O-N 3.11Å; C95-C112 VanDerWaalsContact SG-SG 3.64Å; C95-V137 HydrophobicContact CB-CG1 4.09Å; C95-D138 CarbonylContact O-C 3.17Å; C95-D138 VanDerWaalsContact O-CA 3.26Å; C95-D138 WeakPolarHBondContact O-CA 3.29Å; C95-K139 PolarHBondContact O-N 2.99Å; C95-R142 HydrophobicContact CB-CB 4.17Å; C95-R142 PolarHBondContact SG-NH1 2.88Å; C95-R142 VanDerWaalsContact SG-NH1 3.43Å |
| 96 | G | 94.5 | Very high | 80.2 | Confident | 39 Ų | 39 | 50 Ų | 50 | 40% | 0.402 | 31% | 0.308 | S | S | . | . | S | Bend | trans | 72.9 | -8.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | C92 | C92-G96 PolarHBondContact O-N 3.26Š|
| 97 | D | 95 | Very high | 82.7 | Confident | 22 Ų | 22 | 46.9 Ų | 46.9 | 12% | 0.118 | 28% | 0.282 | C | S | . | . | S | Bend | trans | -65.6 | 158.4 | 171.9 | -165.8 | 19.3 | 0 | 0 | 0 | 111.7 | C92 C95 S99 C109 K139 R142 | C92-D97 WeakPolarHBondContact CB-O 3.15Å; C92-D97 PolarHBondContact N-O 3.27Å; C95-D97 PolarHBondContact O-N 2.91Å; C95-D97 VanDerWaalsContact O-N 3.11Å; D97-S99 PolarHBondContact O-N 3.39Å; D97-C109 HydrophobicContact CB-CB 4.15Å; D97-K139 HydrophobicContact CB-CB 4.09Å; D97-K139 HydrophobicContact CB-CD 4.12Å; D97-K139 HydrophobicContact CB-CG 3.92Å; D97-K139 VanDerWaalsContact OD1-CD 3.25Å; D97-K139 WeakPolarHBondContact OD1-CD 3.44Å; D97-K139 WeakPolarHBondContact OD1-CE 3.4Å; D97-K139 IonicContact OD1-NZ 2.73Å; D97-K139 PolarHBondContact OD1-NZ 2.94Å; D97-R142 IonicContact OD2-CZ 3.17Å; D97-R142 IonicContact OD2-NH1 2.7Å; D97-R142 PolarHBondContact OD2-NH1 2.75Å; D97-R142 IonicContact OD2-NH2 2.85Å; D97-R142 PolarHBondContact OD2-NH2 3.02Å |
| 98 | A | 89.1 | Confident | 85.2 | Confident | 51 Ų | 51 | 40.2 Ų | 40.2 | 42% | 0.421 | 25% | 0.247 | S | C | . | . | B | Isolated β-bridge | trans | -55.7 | 126.8 | -178.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | C109 | A98-C109 WeakPolarHBondContact O-CA 3.32Å; A98-C109 WeakPolarHBondContact O-CB 3.5Å |
| 99 | S | 87.1 | Confident | 87.3 | Confident | 12 Ų | 12 | 35.1 Ų | 35.1 | 8% | 0.084 | 21% | 0.214 | C | C | . | . | P | Polyproline II helix | trans | -84 | 140.4 | 177.8 | -168.4 | 0 | 0 | 0 | 0 | 110.5 | L90 D97 G101 A108 | L90-S99 WeakPolarHBondContact O-CA 3.07Å; L90-S99 WeakPolarHBondContact O-CB 3.39Å; L90-S99 PolarHBondContact O-N 3.46Å; D97-S99 PolarHBondContact O-N 3.39Å; S99-G101 PolarHBondContact OG-N 3.29Å; S99-G101 PolarHBondContact OG-O 2.77Å; S99-G101 VanDerWaalsContact OG-O 3.12Å; S99-A108 PolarHBondContact OG-N 3.45Å; S99-A108 PolarHBondContact OG-O 3.47Å; S99-A108 VanDerWaalsContact OG-O 3.13Å |
| 100 | S | 78.7 | Confident | 89 | Confident | 40 Ų | 40 | 34.7 Ų | 34.7 | 28% | 0.28 | 21% | 0.212 | S | C | . | . | trans | -99.9 | 2 | 172 | 52.2 | 0 | 0 | 0 | 0 | 113 | H103 A108 N110 | S100-H103 PolarHBondContact OG-NE2 2.88Å; S100-A108 PolarHBondContact N-O 3.11Å; S100-N110 WeakPolarHBondContact CB-OD1 3.28Å; S100-N110 PolarHBondContact OG-OD1 3.01Å | ||
| 101 | G | 78.2 | Confident | 89.9 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 22% | 0.216 | C | C | . | . | S | Bend | trans | 141.8 | -158.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | S99 H103 L107 A108 | S99-G101 PolarHBondContact OG-N 3.29Å; S99-G101 PolarHBondContact OG-O 2.77Å; S99-G101 VanDerWaalsContact OG-O 3.12Å; G101-H103 PolarHBondContact O-CD2 2.63Å; G101-L107 WeakPolarHBondContact O-CA 3.03Å; G101-A108 PolarHBondContact O-N 2.8Å; G101-A108 VanDerWaalsContact O-N 3.08Å |
| 102 | K | 81.6 | Confident | 90.2 | Very high | 90 Ų | 90 | 28.4 Ų | 28.4 | 39% | 0.391 | 19% | 0.188 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -85.8 | 117.3 | 173.1 | -93 | 174.2 | -177.7 | 178.2 | 0 | 110.2 | I106 L165 L167 | K102-I106 CarbonylContact C-O 3.45Å; K102-I106 VanDerWaalsContact CA-O 3.32Å; K102-I106 WeakPolarHBondContact CA-O 3.25Å; K102-L165 CarbonylContact C-O 3.52Å; K102-L165 WeakPolarHBondContact CA-O 3.46Å; K102-L165 HydrophobicContact CB-CB 4.22Å; K102-L165 WeakPolarHBondContact CB-O 3.35Å; K102-L165 PolarHBondContact N-O 3.41Å; K102-L165 CarbonylContact O-C 3.57Å; K102-L165 PolarHBondContact O-N 3.25Å; K102-L167 HydrophobicContact CB-CD1 4.11Å; K102-L167 HydrophobicContact CB-CG 4.06Å; K102-L167 HydrophobicContact CD-CD1 3.79Å; K102-L167 HydrophobicContact CD-CD2 4.4Å; K102-L167 HydrophobicContact CD-CG 4.22Å; K102-L167 HydrophobicContact CG-CD1 3.59Å; K102-L167 HydrophobicContact CG-CG 4.07Å |
| 103 | H | 85.6 | Confident | 90.1 | Very high | 6 Ų | 6 | 28.8 Ų | 28.8 | 3% | 0.028 | 19% | 0.191 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 126.7 | 170.7 | -57.8 | -100.9 | 0 | 0 | 0 | 108.6 | S100 G101 G105 I106 A108 S113 | S100-H103 PolarHBondContact OG-NE2 2.88Å; G101-H103 PolarHBondContact O-CD2 2.63Å; H103-G105 PolarHBondContact O-N 3.14Å; H103-I106 PolarHBondContact N-O 3.38Å; H103-I106 PolarHBondContact O-N 3.43Å; H103-A108 HydrophobicContact CB-CB 4.1Å; H103-A108 PolarHBondContact CD2-O 2.8Å; H103-S113 WeakPolarHBondContact CB-OG 3.47Å; H103-S113 VanDerWaalsContact CG-CB 3.43Å; H103-S113 VanDerWaalsContact CG-OG 3.29Å; H103-S113 WeakPolarHBondContact ND1-CB 3.42Å; H103-S113 PolarHBondContact ND1-OG 3.12Å |
| 104 | Y | 88.3 | Confident | 90.2 | Very high | 31 Ų | 31 | 27.8 Ų | 27.8 | 12% | 0.122 | 19% | 0.185 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 58.8 | 31 | 177.7 | -56.7 | -68.8 | 0 | 0 | 0 | 113.6 | F116 K117 M158 N159 G162 | Y104-F116 AromaticContact CD1-CD1 3.92Å; Y104-F116 HydrophobicContact CD1-CD1 3.92Å; Y104-F116 AromaticContact CD1-CE1 3.86Å; Y104-F116 HydrophobicContact CD1-CE1 3.86Å; Y104-F116 HydrophobicContact CD2-CB 4.4Å; Y104-F116 AromaticContact CD2-CD1 3.49Å; Y104-F116 HydrophobicContact CD2-CD1 3.49Å; Y104-F116 VanDerWaalsContact CD2-CD1 3.49Å; Y104-F116 HydrophobicContact CD2-CE1 4.19Å; Y104-F116 HydrophobicContact CD2-CG 4.32Å; Y104-F116 HydrophobicContact CE1-CD1 4.4Å; Y104-F116 HydrophobicContact CE2-CD1 4.02Å; Y104-F116 AromaticContact CG-CD1 3.44Å; Y104-F116 HydrophobicContact CG-CD1 3.44Å; Y104-F116 VanDerWaalsContact CG-CD1 3.44Å; Y104-F116 AromaticContact CG-CE1 3.65Å; Y104-F116 HydrophobicContact CG-CE1 3.65Å; Y104-K117 HydrophobicContact CE2-CB 4.17Å; Y104-K117 WeakPolarHBondContact OH-CB 3.26Å; Y104-K117 WeakPolarHBondContact OH-CD 3.42Å; Y104-K117 VanDerWaalsContact OH-CG 3.3Å; Y104-K117 WeakPolarHBondContact OH-CG 3.44Å; Y104-M158 CarbonylContact O-C 3.55Å; Y104-M158 VanDerWaalsContact O-CA 3.29Å; Y104-M158 WeakPolarHBondContact O-CA 3.18Å; Y104-N159 WeakPolarHBondContact CB-O 3.47Å; Y104-N159 WeakPolarHBondContact CD1-O 3.32Å; Y104-N159 PolarHBondContact O-N 2.89Å; Y104-G162 WeakPolarHBondContact CA-O 3.36Å; Y104-G162 WeakPolarHBondContact CD1-O 3.29Å |
| 105 | G | 84 | Confident | 90.2 | Very high | 43 Ų | 43 | 28.2 Ų | 28.2 | 44% | 0.443 | 19% | 0.186 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 99.7 | -16.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | H103 | H103-G105 PolarHBondContact O-N 3.14Š|
| 106 | I | 87 | Confident | 90.1 | Very high | 18 Ų | 18 | 28.1 Ų | 28.1 | 9% | 0.092 | 19% | 0.185 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 159.2 | -170.7 | 79.1 | 170.1 | 0 | 0 | 0 | 113.5 | A93 V94 K102 H103 A108 M156 G157 M158 | A93-I106 HydrophobicContact CB-CD1 4.34Å; V94-I106 HydrophobicContact CG2-CD1 3.91Å; K102-I106 CarbonylContact C-O 3.45Å; K102-I106 VanDerWaalsContact CA-O 3.32Å; K102-I106 WeakPolarHBondContact CA-O 3.25Å; H103-I106 PolarHBondContact N-O 3.38Å; H103-I106 PolarHBondContact O-N 3.43Å; I106-A108 PolarHBondContact O-N 2.97Å; I106-M156 HydrophobicContact CD1-CB 3.58Å; I106-M156 WeakPolarHBondContact CG2-O 3.33Å; I106-G157 VanDerWaalsContact CG2-C 3.45Å; I106-M158 HydrophobicContact CD1-CE 4.04Å; I106-M158 HydrophobicContact CD1-CG 3.52Å; I106-M158 HydrophobicContact CD1-SD 4.42Å; I106-M158 HydrophobicContact CG1-CE 3.85Å; I106-M158 HydrophobicContact CG1-CG 3.62Å |
| 107 | L | 88.5 | Confident | 90 | Very high | 51 Ų | 51 | 32.1 Ų | 32.1 | 27% | 0.267 | 19% | 0.192 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -62.3 | 116.2 | 172.6 | -72 | 170 | 0 | 0 | 0 | 111.4 | L90 A93 G101 L167 | L90-L107 HydrophobicContact CD1-CD2 4.06Å; L90-L107 HydrophobicContact CD2-CD1 3.88Å; L90-L107 HydrophobicContact CD2-CD2 4.35Å; A93-L107 PolarHBondContact N-O 2.89Å; G101-L107 WeakPolarHBondContact O-CA 3.03Å; L107-L167 HydrophobicContact CD2-CD1 3.98Å |
| 108 | A | 90.8 | Very high | 90 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 21% | 0.21 | C | C | . | . | trans | -144 | 146 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | S99 S100 G101 H103 I106 M158 | S99-A108 PolarHBondContact OG-N 3.45Å; S99-A108 PolarHBondContact OG-O 3.47Å; S99-A108 VanDerWaalsContact OG-O 3.13Å; S100-A108 PolarHBondContact N-O 3.11Å; G101-A108 PolarHBondContact O-N 2.8Å; G101-A108 VanDerWaalsContact O-N 3.08Å; H103-A108 HydrophobicContact CB-CB 4.1Å; H103-A108 PolarHBondContact CD2-O 2.8Å; I106-A108 PolarHBondContact O-N 2.97Å; A108-M158 HydrophobicContact CB-CE 3.35Å | ||
| 109 | C | 95.3 | Very high | 90.2 | Very high | 1 Ų | 1 | 35.1 Ų | 35.1 | 1% | 0.007 | 19% | 0.191 | C | C | . | . | trans | -72.4 | 155.6 | 166.7 | 64.3 | 0 | 0 | 0 | 0 | 110.8 | C92 D97 A98 G111 C112 S113 R142 | C92-C109 HydrophobicContact CB-CB 3.9Å; C92-C109 PolarHBondContact SG-N 3.05Å; C92-C109 VanDerWaalsContact SG-N 3.41Å; C92-C109 VanDerWaalsContact SG-SG 3.61Å; D97-C109 HydrophobicContact CB-CB 4.15Å; A98-C109 WeakPolarHBondContact O-CA 3.32Å; A98-C109 WeakPolarHBondContact O-CB 3.5Å; C109-G111 PolarHBondContact O-N 3.42Å; C109-G111 VanDerWaalsContact O-N 3.08Å; C109-C112 PolarHBondContact O-N 2.99Å; C109-C112 PolarHBondContact SG-N 3.08Å; C109-C112 VanDerWaalsContact SG-N 3.38Å; C109-C112 VanDerWaalsContact SG-SG 3.68Å; C109-S113 PolarHBondContact O-N 3.18Å; C109-R142 PolarHBondContact SG-NH1 2.94Å | ||
| 110 | N | 93.2 | Very high | 90.3 | Very high | 116 Ų | 116 | 37.2 Ų | 37.2 | 62% | 0.62 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -48.8 | -38 | 174.1 | -67.4 | -17 | 0 | 0 | 0 | 112.6 | S100 G114 | S100-N110 WeakPolarHBondContact CB-OD1 3.28Å; S100-N110 PolarHBondContact OG-OD1 3.01Å; N110-G114 PolarHBondContact O-N 2.94Å |
| 111 | G | 95.9 | Very high | 90.7 | Very high | 28 Ų | 28 | 45.7 Ų | 45.7 | 29% | 0.289 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63.9 | -41.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114 | C109 F115 R149 | C109-G111 PolarHBondContact O-N 3.42Å; C109-G111 VanDerWaalsContact O-N 3.08Å; G111-F115 VanDerWaalsContact O-CB 3.25Å; G111-F115 WeakPolarHBondContact O-CB 3.48Å; G111-F115 PolarHBondContact O-N 3.08Å; G111-R149 VanDerWaalsContact C-NH2 3.27Å; G111-R149 PolarHBondContact O-NH2 3.2Å; G111-R149 VanDerWaalsContact O-NH2 3.08Å |
| 112 | C | 97.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -79.4 | -38.3 | 178 | -72.5 | 0 | 0 | 0 | 0 | 112.2 | V94 C95 C109 F115 F116 R149 | V94-C112 HydrophobicContact CB-CB 4.32Å; C95-C112 VanDerWaalsContact SG-SG 3.64Å; C109-C112 PolarHBondContact O-N 2.99Å; C109-C112 PolarHBondContact SG-N 3.08Å; C109-C112 VanDerWaalsContact SG-N 3.38Å; C109-C112 VanDerWaalsContact SG-SG 3.68Å; C112-F115 PolarHBondContact O-N 3.34Å; C112-F116 WeakPolarHBondContact O-CB 3.45Å; C112-F116 PolarHBondContact O-N 3.01Å; C112-R149 PolarHBondContact SG-NH2 3.01Å; C112-R149 VanDerWaalsContact SG-NH2 3.42Å |
| 113 | S | 94 | Very high | 91.4 | Very high | 11 Ų | 11 | 58.8 Ų | 58.8 | 8% | 0.077 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -55.5 | -54.7 | 171.6 | 176.7 | 0 | 0 | 0 | 0 | 111.6 | H103 C109 F115 F116 K117 | H103-S113 WeakPolarHBondContact CB-OG 3.47Å; H103-S113 VanDerWaalsContact CG-CB 3.43Å; H103-S113 VanDerWaalsContact CG-OG 3.29Å; H103-S113 WeakPolarHBondContact ND1-CB 3.42Å; H103-S113 PolarHBondContact ND1-OG 3.12Å; C109-S113 PolarHBondContact O-N 3.18Å; S113-F115 VanDerWaalsContact C-N 3.31Å; S113-F115 PolarHBondContact O-N 2.96Å; S113-F116 PolarHBondContact O-N 3.5Å; S113-K117 WeakPolarHBondContact O-CB 3.44Å; S113-K117 PolarHBondContact O-N 3.39Å |
| 114 | G | 94.9 | Very high | 91.6 | Very high | 19 Ų | 19 | 61.6 Ų | 61.6 | 20% | 0.196 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.6 | -33.7 | 178 | 0 | 0 | 0 | 0 | 0 | 113.7 | N110 R118 | N110-G114 PolarHBondContact O-N 2.94Å; G114-R118 WeakPolarHBondContact O-CB 3.38Å; G114-R118 WeakPolarHBondContact O-CG 3.26Å; G114-R118 VanDerWaalsContact O-CZ 3.28Å; G114-R118 PolarHBondContact O-N 3.29Å; G114-R118 VanDerWaalsContact O-N 3.12Å; G114-R118 PolarHBondContact O-NH1 3.31Å |
| 115 | F | 97.4 | Very high | 91.7 | Very high | 8 Ų | 8 | 67.5 Ų | 67.5 | 4% | 0.035 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65.5 | -48.1 | 174.3 | 170.8 | -96.3 | 0 | 0 | 0 | 111.8 | G111 C112 S113 R118 S119 Y126 Q146 R149 L150 | G111-F115 VanDerWaalsContact O-CB 3.25Å; G111-F115 WeakPolarHBondContact O-CB 3.48Å; G111-F115 PolarHBondContact O-N 3.08Å; C112-F115 PolarHBondContact O-N 3.34Å; S113-F115 VanDerWaalsContact C-N 3.31Å; S113-F115 PolarHBondContact O-N 2.96Å; F115-R118 PolarHBondContact O-N 3.46Å; F115-S119 WeakPolarHBondContact O-CB 3.49Å; F115-S119 PolarHBondContact O-N 3.37Å; F115-S119 PolarHBondContact O-OG 3.27Å; F115-Y126 AromaticContact CE2-CE2 3.98Å; F115-Y126 HydrophobicContact CE2-CE2 3.98Å; F115-Y126 HydrophobicContact CZ-CD2 4.35Å; F115-Y126 AromaticContact CZ-CE2 3.71Å; F115-Y126 HydrophobicContact CZ-CE2 3.71Å; F115-Q146 HydrophobicContact CE2-CB 4.1Å; F115-Q146 HydrophobicContact CE2-CG 4.15Å; F115-Q146 HydrophobicContact CZ-CB 4.23Å; F115-Q146 WeakPolarHBondContact CZ-O 3.43Å; F115-R149 VanDerWaalsContact CD1-CD 3.47Å; F115-R149 HydrophobicContact CD1-CG 3.93Å; F115-R149 HydrophobicContact CE1-CB 3.99Å; F115-R149 HydrophobicContact CE1-CG 3.78Å; F115-R149 HydrophobicContact CZ-CB 4.16Å; F115-R149 HydrophobicContact CZ-CG 4.33Å; F115-L150 HydrophobicContact CE1-CB 3.81Å; F115-L150 HydrophobicContact CE1-CD1 4.13Å; F115-L150 HydrophobicContact CZ-CB 4Å |
| 116 | F | 95.8 | Very high | 92.2 | Very high | 5 Ų | 5 | 67.9 Ų | 67.9 | 2% | 0.022 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.5 | -49.3 | 177.7 | -175.1 | -98.9 | 0 | 0 | 0 | 111.1 | Y104 C112 S113 R118 S119 V120 L150 C153 I154 M158 | Y104-F116 AromaticContact CD1-CD1 3.92Å; Y104-F116 HydrophobicContact CD1-CD1 3.92Å; Y104-F116 AromaticContact CD1-CE1 3.86Å; Y104-F116 HydrophobicContact CD1-CE1 3.86Å; Y104-F116 HydrophobicContact CD2-CB 4.4Å; Y104-F116 AromaticContact CD2-CD1 3.49Å; Y104-F116 HydrophobicContact CD2-CD1 3.49Å; Y104-F116 VanDerWaalsContact CD2-CD1 3.49Å; Y104-F116 HydrophobicContact CD2-CE1 4.19Å; Y104-F116 HydrophobicContact CD2-CG 4.32Å; Y104-F116 HydrophobicContact CE1-CD1 4.4Å; Y104-F116 HydrophobicContact CE2-CD1 4.02Å; Y104-F116 AromaticContact CG-CD1 3.44Å; Y104-F116 HydrophobicContact CG-CD1 3.44Å; Y104-F116 VanDerWaalsContact CG-CD1 3.44Å; Y104-F116 AromaticContact CG-CE1 3.65Å; Y104-F116 HydrophobicContact CG-CE1 3.65Å; C112-F116 WeakPolarHBondContact O-CB 3.45Å; C112-F116 PolarHBondContact O-N 3.01Å; S113-F116 PolarHBondContact O-N 3.5Å; F116-R118 VanDerWaalsContact C-N 3.32Å; F116-R118 PolarHBondContact O-N 3.38Å; F116-S119 PolarHBondContact O-N 3.14Å; F116-S119 VanDerWaalsContact O-N 3.08Å; F116-V120 HydrophobicContact CD1-CG2 4.1Å; F116-V120 HydrophobicContact CD2-CG2 4.29Å; F116-V120 HydrophobicContact CE1-CG2 3.76Å; F116-V120 HydrophobicContact CE2-CG2 3.96Å; F116-V120 HydrophobicContact CG-CG2 4.36Å; F116-V120 HydrophobicContact CZ-CG2 3.68Å; F116-V120 WeakPolarHBondContact O-CG2 3.37Å; F116-V120 PolarHBondContact O-N 3.46Å; F116-L150 HydrophobicContact CD2-CD1 3.99Å; F116-L150 HydrophobicContact CE2-CD1 4.43Å; F116-C153 HydrophobicContact CD2-CB 3.86Å; F116-C153 HydrophobicContact CE2-CB 4.48Å; F116-I154 HydrophobicContact CE2-CG1 4.18Å; F116-M158 HydrophobicContact CB-SD 3.65Å; F116-M158 HydrophobicContact CD1-CB 4.27Å; F116-M158 HydrophobicContact CD1-SD 4.27Å; F116-M158 HydrophobicContact CD2-CB 3.74Å; F116-M158 HydrophobicContact CD2-CG 4.4Å; F116-M158 HydrophobicContact CD2-SD 3.82Å; F116-M158 HydrophobicContact CE1-CB 4.03Å; F116-M158 HydrophobicContact CE2-CB 3.49Å; F116-M158 VanDerWaalsContact CE2-CB 3.49Å; F116-M158 HydrophobicContact CG-CB 4.13Å; F116-M158 HydrophobicContact CG-CG 4.49Å; F116-M158 HydrophobicContact CG-SD 3.66Å; F116-M158 HydrophobicContact CZ-CB 3.64Å; F116-M158 VanDerWaalsContact CZ-O 3.26Å; F116-M158 WeakPolarHBondContact CZ-O 3.48Å |
| 117 | K | 93.1 | Very high | 92.5 | Very high | 123 Ų | 123 | 77.6 Ų | 77.6 | 54% | 0.535 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -50.6 | -48.2 | 175.4 | -171.6 | 174.5 | -173.1 | 170.8 | 0 | 112.6 | Y104 S113 R121 | Y104-K117 HydrophobicContact CE2-CB 4.17Å; Y104-K117 WeakPolarHBondContact OH-CB 3.26Å; Y104-K117 WeakPolarHBondContact OH-CD 3.42Å; Y104-K117 VanDerWaalsContact OH-CG 3.3Å; Y104-K117 WeakPolarHBondContact OH-CG 3.44Å; S113-K117 WeakPolarHBondContact O-CB 3.44Å; S113-K117 PolarHBondContact O-N 3.39Å; K117-R121 WeakPolarHBondContact O-CB 3.04Å; K117-R121 PolarHBondContact O-N 3.4Å |
| 118 | R | 94.1 | Very high | 92.9 | Very high | 131 Ų | 131 | 75.9 Ų | 75.9 | 49% | 0.494 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -66.7 | -42.7 | 178.4 | -73.7 | -174.2 | -59.1 | -92.8 | 4 | 112.3 | G114 F115 F116 R122 | G114-R118 WeakPolarHBondContact O-CB 3.38Å; G114-R118 WeakPolarHBondContact O-CG 3.26Å; G114-R118 VanDerWaalsContact O-CZ 3.28Å; G114-R118 PolarHBondContact O-N 3.29Å; G114-R118 VanDerWaalsContact O-N 3.12Å; G114-R118 PolarHBondContact O-NH1 3.31Å; F115-R118 PolarHBondContact O-N 3.46Å; F116-R118 VanDerWaalsContact C-N 3.32Å; F116-R118 PolarHBondContact O-N 3.38Å; R118-R122 WeakPolarHBondContact O-CB 3.36Å; R118-R122 PolarHBondContact O-N 3.49Å; R118-R122 VanDerWaalsContact O-N 3.14Å |
| 119 | S | 93.3 | Very high | 93 | Very high | 4 Ų | 4 | 84.6 Ų | 84.6 | 3% | 0.028 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63 | -47.9 | -178.2 | -54.1 | 0 | 0 | 0 | 0 | 111.3 | F115 F116 K123 L124 Y126 | F115-S119 WeakPolarHBondContact O-CB 3.49Å; F115-S119 PolarHBondContact O-N 3.37Å; F115-S119 PolarHBondContact O-OG 3.27Å; F116-S119 PolarHBondContact O-N 3.14Å; F116-S119 VanDerWaalsContact O-N 3.08Å; S119-K123 PolarHBondContact O-N 2.98Å; S119-K123 VanDerWaalsContact O-N 3.15Å; S119-L124 PolarHBondContact O-N 3.08Å; S119-Y126 WeakPolarHBondContact OG-CE2 3.07Å; S119-Y126 PolarHBondContact OG-OH 3.27Å |
| 120 | V | 89.1 | Confident | 92.9 | Very high | 56 Ų | 56 | 87.6 Ų | 87.6 | 34% | 0.339 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -67.5 | -53.5 | 177.9 | 174.6 | 0 | 0 | 0 | 0 | 111.4 | F116 R122 K123 K160 | F116-V120 HydrophobicContact CD1-CG2 4.1Å; F116-V120 HydrophobicContact CD2-CG2 4.29Å; F116-V120 HydrophobicContact CE1-CG2 3.76Å; F116-V120 HydrophobicContact CE2-CG2 3.96Å; F116-V120 HydrophobicContact CG-CG2 4.36Å; F116-V120 HydrophobicContact CZ-CG2 3.68Å; F116-V120 WeakPolarHBondContact O-CG2 3.37Å; F116-V120 PolarHBondContact O-N 3.46Å; V120-R122 PolarHBondContact O-N 3.33Å; V120-K123 PolarHBondContact O-N 3.38Å; V120-K160 HydrophobicContact CG1-CB 3.68Å |
| 121 | R | 86.3 | Confident | 92.8 | Very high | 218 Ų | 218 | 89 Ų | 89 | 82% | 0.823 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -59 | -35.3 | -175.7 | 178.5 | 175.3 | 169.2 | 84.6 | -1.5 | 112.9 | K117 | K117-R121 WeakPolarHBondContact O-CB 3.04Å; K117-R121 PolarHBondContact O-N 3.4Å |
| 122 | R | 89.5 | Confident | 92.6 | Very high | 181 Ų | 181 | 91.7 Ų | 91.7 | 68% | 0.683 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | 6 | 179.4 | -66.9 | 179.8 | 177.9 | 178.7 | -1.6 | 113.5 | R118 V120 L124 | R118-R122 WeakPolarHBondContact O-CB 3.36Å; R118-R122 PolarHBondContact O-N 3.49Å; R118-R122 VanDerWaalsContact O-N 3.14Å; V120-R122 PolarHBondContact O-N 3.33Å; R122-L124 HydrophobicContact CB-CD1 4.11Å; R122-L124 HydrophobicContact CB-CD2 3.94Å; R122-L124 HydrophobicContact CB-CG 3.69Å; R122-L124 PolarHBondContact O-N 2.71Å |
| 123 | K | 86.6 | Confident | 92.3 | Very high | 185 Ų | 185 | 92.7 Ų | 92.7 | 80% | 0.804 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.4 | 41.9 | -177.1 | -59 | 179.6 | 179.9 | 179.1 | 0 | 112.9 | S119 V120 | S119-K123 PolarHBondContact O-N 2.98Å; S119-K123 VanDerWaalsContact O-N 3.15Å; V120-K123 PolarHBondContact O-N 3.38Å |
| 124 | L | 89.3 | Confident | 92.3 | Very high | 65 Ų | 65 | 98.2 Ų | 98.2 | 34% | 0.34 | 47% | 0.467 | S | S | . | . | trans | -74.6 | 129.1 | -172.9 | -62.5 | 175.6 | 0 | 0 | 0 | 111.7 | S119 R122 Y126 | S119-L124 PolarHBondContact O-N 3.08Å; R122-L124 HydrophobicContact CB-CD1 4.11Å; R122-L124 HydrophobicContact CB-CD2 3.94Å; R122-L124 HydrophobicContact CB-CG 3.69Å; R122-L124 PolarHBondContact O-N 2.71Å; L124-Y126 HydrophobicContact CB-CE1 4.2Å; L124-Y126 HydrophobicContact CB-CE2 4.19Å; L124-Y126 HydrophobicContact CD1-CE1 4.35Å; L124-Y126 VanDerWaalsContact CD1-OH 3.26Å; L124-Y126 WeakPolarHBondContact CD1-OH 3.22Å | ||
| 125 | I | 90 | Very high | 92.3 | Very high | 155 Ų | 155 | 98.9 Ų | 98.9 | 80% | 0.795 | 47% | 0.468 | S | S | * | . | trans | -104.4 | 119.6 | 173.2 | -60.3 | 166 | 0 | 0 | 0 | 107.8 | ||||
| 126 | Y | 95.1 | Very high | 92.2 | Very high | 51 Ų | 51 | 105.3 Ų | 105.3 | 20% | 0.2 | 50% | 0.496 | C | S | . | . | trans | -106.7 | 144.6 | 178.1 | -56.1 | -67.4 | 0 | 0 | 0 | 110.7 | F115 S119 L124 Q146 L150 | F115-Y126 AromaticContact CE2-CE2 3.98Å; F115-Y126 HydrophobicContact CE2-CE2 3.98Å; F115-Y126 HydrophobicContact CZ-CD2 4.35Å; F115-Y126 AromaticContact CZ-CE2 3.71Å; F115-Y126 HydrophobicContact CZ-CE2 3.71Å; S119-Y126 WeakPolarHBondContact OG-CE2 3.07Å; S119-Y126 PolarHBondContact OG-OH 3.27Å; L124-Y126 HydrophobicContact CB-CE1 4.2Å; L124-Y126 HydrophobicContact CB-CE2 4.19Å; L124-Y126 HydrophobicContact CD1-CE1 4.35Å; L124-Y126 VanDerWaalsContact CD1-OH 3.26Å; L124-Y126 WeakPolarHBondContact CD1-OH 3.22Å; Y126-Q146 HydrophobicContact CD1-CB 3.62Å; Y126-Q146 HydrophobicContact CD1-CG 4.42Å; Y126-Q146 HydrophobicContact CD2-CB 3.99Å; Y126-Q146 HydrophobicContact CE1-CB 3.85Å; Y126-Q146 HydrophobicContact CE1-CG 4.3Å; Y126-Q146 HydrophobicContact CE2-CB 4.19Å; Y126-Q146 HydrophobicContact CG-CB 3.69Å; Y126-L150 HydrophobicContact CD2-CB 4.26Å; Y126-L150 HydrophobicContact CD2-CD2 3.87Å; Y126-L150 HydrophobicContact CE2-CD2 4.03Å | ||
| 127 | R | 93.9 | Very high | 92.3 | Very high | 221 Ų | 221 | 105.7 Ų | 105.7 | 83% | 0.834 | 50% | 0.499 | S | S | * | . | trans | -108.8 | 146.1 | 170.2 | -63.1 | -178.1 | -175.5 | -98.5 | 1.5 | 110 | ||||
| 128 | C | 96.3 | Very high | 92.4 | Very high | 16 Ų | 16 | 101.2 Ų | 101.2 | 11% | 0.108 | 48% | 0.481 | C | S | . | . | trans | -85.4 | 112.9 | 176.7 | 179.2 | 0 | 0 | 0 | 0 | 109 | A130 N131 C135 C145 A147 | C128-A130 PolarHBondContact O-N 3.21Å; C128-N131 WeakPolarHBondContact O-CA 3.36Å; C128-N131 PolarHBondContact O-N 3.21Å; C128-N131 PolarHBondContact O-OD1 2.91Å; C128-C135 PolarHBondContact SG-SG 3.48Å; C128-C145 VanDerWaalsContact SG-SG 3.65Å; C128-A147 HydrophobicContact CB-CB 4.15Å | ||
| 129 | Q | 93.5 | Very high | 92.4 | Very high | 182 Ų | 182 | 100.9 Ų | 100.9 | 85% | 0.85 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -32.2 | -177.8 | -71.4 | 173.4 | -36.1 | 0 | 0 | 113.2 | N131 | Q129-N131 PolarHBondContact O-N 2.8Š|
| 130 | A | 92.2 | Very high | 92.5 | Very high | 64 Ų | 64 | 105.6 Ų | 105.6 | 53% | 0.529 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.3 | -4.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | C128 T132 | C128-A130 PolarHBondContact O-N 3.21Å; A130-T132 HydrophobicContact CB-CG2 4.37Å; A130-T132 WeakPolarHBondContact O-CG2 3.39Å; A130-T132 PolarHBondContact O-N 3.3Å |
| 131 | N | 90.6 | Very high | 92.7 | Very high | 147 Ų | 147 | 106 Ų | 106 | 79% | 0.786 | 51% | 0.51 | S | S | * | . | S | Bend | trans | 54 | -2.2 | -174.3 | -66 | -46.9 | 0 | 0 | 0 | 117.1 | C128 Q129 G133 | C128-N131 WeakPolarHBondContact O-CA 3.36Å; C128-N131 PolarHBondContact O-N 3.21Å; C128-N131 PolarHBondContact O-OD1 2.91Å; Q129-N131 PolarHBondContact O-N 2.8Å; N131-G133 VanDerWaalsContact C-N 3.31Å; N131-G133 PolarHBondContact O-N 3.06Å |
| 132 | T | 92.4 | Very high | 93.2 | Very high | 84 Ų | 84 | 97.7 Ų | 97.7 | 52% | 0.515 | 48% | 0.478 | S | S | . | . | S | Bend | trans | -71 | -21.9 | 178.6 | 63.6 | 0 | 0 | 0 | 0 | 114.3 | A130 N134 | A130-T132 HydrophobicContact CB-CG2 4.37Å; A130-T132 WeakPolarHBondContact O-CG2 3.39Å; A130-T132 PolarHBondContact O-N 3.3Å; T132-N134 PolarHBondContact O-N 3.19Å; T132-N134 PolarHBondContact O-ND2 3.24Å; T132-N134 PolarHBondContact OG1-N 2.93Å |
| 133 | G | 91.3 | Very high | 93.5 | Very high | 20 Ų | 20 | 94.9 Ų | 94.9 | 21% | 0.206 | 48% | 0.477 | C | S | . | . | S | Bend | trans | 61.2 | 9.5 | -173.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | N131 C148 K151 | N131-G133 VanDerWaalsContact C-N 3.31Å; N131-G133 PolarHBondContact O-N 3.06Å; G133-C148 PolarHBondContact O-SG 3.42Å; G133-K151 PolarHBondContact O-NZ 3.22Å |
| 134 | N | 93.4 | Very high | 93.9 | Very high | 128 Ų | 128 | 92.3 Ų | 92.3 | 68% | 0.684 | 47% | 0.468 | S | S | * | . | trans | -132.5 | 21.5 | -168 | -69 | -22.6 | 0 | 0 | 0 | 113.6 | T132 K136 C148 | T132-N134 PolarHBondContact O-N 3.19Å; T132-N134 PolarHBondContact O-ND2 3.24Å; T132-N134 PolarHBondContact OG1-N 2.93Å; N134-K136 PolarHBondContact O-N 3.12Å; N134-C148 PolarHBondContact N-SG 3.01Å | ||
| 135 | C | 95.9 | Very high | 94.3 | Very high | 32 Ų | 32 | 90 Ų | 90 | 22% | 0.216 | 46% | 0.457 | C | S | . | . | trans | -54.3 | 140.1 | 177 | -56.1 | 0 | 0 | 0 | 0 | 111.9 | C128 C145 C148 | C128-C135 PolarHBondContact SG-SG 3.48Å; C135-C145 HydrophobicContact CB-CB 3.65Å; C135-C148 HydrophobicContact CB-CB 3.84Å; C135-C148 PolarHBondContact N-SG 3.13Å | ||
| 136 | K | 95 | Very high | 94.7 | Very high | 143 Ų | 143 | 87.4 Ų | 87.4 | 62% | 0.622 | 44% | 0.441 | S | S | * | . | trans | -60.6 | 136.8 | 179.7 | -163.1 | -174.5 | -175.5 | -149 | 0 | 110.8 | N134 D138 | N134-K136 PolarHBondContact O-N 3.12Å; K136-D138 VanDerWaalsContact CD-OD2 3.29Å; K136-D138 WeakPolarHBondContact CD-OD2 3.38Å; K136-D138 WeakPolarHBondContact CE-OD2 3.32Å; K136-D138 IonicContact NZ-OD2 2.72Å; K136-D138 PolarHBondContact NZ-OD2 3.2Å | ||
| 137 | V | 96.5 | Very high | 94.7 | Very high | 14 Ų | 14 | 85.8 Ų | 85.8 | 9% | 0.085 | 44% | 0.438 | C | S | . | . | trans | -127.2 | 95.7 | 176.9 | -175.1 | 0 | 0 | 0 | 0 | 108.6 | V94 C95 R142 C148 R149 K152 | V94-V137 HydrophobicContact CG1-CG1 4.12Å; V94-V137 WeakPolarHBondContact O-CG1 3.3Å; C95-V137 HydrophobicContact CB-CG1 4.09Å; V137-R142 HydrophobicContact CG1-CB 4.02Å; V137-C148 HydrophobicContact CG2-CB 4.46Å; V137-R149 HydrophobicContact CG1-CG 4.23Å; V137-K152 HydrophobicContact CB-CD 3.8Å; V137-K152 HydrophobicContact CG1-CD 4.21Å; V137-K152 HydrophobicContact CG2-CD 4.23Å; V137-K152 PolarHBondContact O-NZ 3.08Å | ||
| 138 | D | 96 | Very high | 94.9 | Very high | 29 Ų | 29 | 75.6 Ų | 75.6 | 16% | 0.155 | 40% | 0.401 | C | S | . | . | S | Bend | trans | -126.6 | -179.1 | 174.8 | 60.5 | 26.3 | 0 | 0 | 0 | 110 | C95 K136 T140 H141 R142 | C95-D138 CarbonylContact O-C 3.17Å; C95-D138 VanDerWaalsContact O-CA 3.26Å; C95-D138 WeakPolarHBondContact O-CA 3.29Å; K136-D138 VanDerWaalsContact CD-OD2 3.29Å; K136-D138 WeakPolarHBondContact CD-OD2 3.38Å; K136-D138 WeakPolarHBondContact CE-OD2 3.32Å; K136-D138 IonicContact NZ-OD2 2.72Å; K136-D138 PolarHBondContact NZ-OD2 3.2Å; D138-T140 VanDerWaalsContact C-N 3.31Å; D138-T140 PolarHBondContact O-N 2.78Å; D138-T140 PolarHBondContact OD1-N 2.84Å; D138-T140 PolarHBondContact OD1-OG1 2.95Å; D138-T140 VanDerWaalsContact OD1-OG1 3.08Å; D138-H141 VanDerWaalsContact CG-ND1 3.33Å; D138-H141 PolarHBondContact O-N 3.38Å; D138-H141 WeakPolarHBondContact OD1-CA 3.44Å; D138-H141 WeakPolarHBondContact OD1-CB 3.49Å; D138-H141 IonicContact OD1-CG 3.76Å; D138-H141 VanDerWaalsContact OD1-CG 3.29Å; D138-H141 PolarHBondContact OD1-N 3.41Å; D138-H141 IonicContact OD1-ND1 2.97Å; D138-H141 PolarHBondContact OD1-ND1 3.11Å; D138-H141 IonicContact OD2-CE1 3.58Å; D138-H141 IonicContact OD2-CG 2.95Å; D138-H141 IonicContact OD2-ND1 2.69Å; D138-H141 PolarHBondContact OD2-ND1 3.09Å; D138-R142 WeakPolarHBondContact O-CB 3.36Å; D138-R142 PolarHBondContact O-N 3.03Å |
| 139 | K | 94.7 | Very high | 95 | Very high | 124 Ų | 124 | 75.3 Ų | 75.3 | 54% | 0.539 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.5 | -42.3 | -174.2 | 175.7 | 171.2 | 178.5 | 144.1 | 0 | 113 | C95 D97 R142 | C95-K139 PolarHBondContact O-N 2.99Å; D97-K139 HydrophobicContact CB-CB 4.09Å; D97-K139 HydrophobicContact CB-CD 4.12Å; D97-K139 HydrophobicContact CB-CG 3.92Å; D97-K139 VanDerWaalsContact OD1-CD 3.25Å; D97-K139 WeakPolarHBondContact OD1-CD 3.44Å; D97-K139 WeakPolarHBondContact OD1-CE 3.4Å; D97-K139 IonicContact OD1-NZ 2.73Å; D97-K139 PolarHBondContact OD1-NZ 2.94Å; K139-R142 PolarHBondContact O-NE 3Å |
| 140 | T | 95.2 | Very high | 95.2 | Very high | 102 Ų | 102 | 67.9 Ų | 67.9 | 63% | 0.626 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | -40 | -176.2 | 47 | 0 | 0 | 0 | 0 | 112.2 | D138 | D138-T140 VanDerWaalsContact C-N 3.31Å; D138-T140 PolarHBondContact O-N 2.78Å; D138-T140 PolarHBondContact OD1-N 2.84Å; D138-T140 PolarHBondContact OD1-OG1 2.95Å; D138-T140 VanDerWaalsContact OD1-OG1 3.08Å |
| 141 | H | 93.6 | Very high | 95.3 | Very high | 66 Ų | 66 | 70.4 Ų | 70.4 | 31% | 0.306 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.5 | -2.1 | -168.6 | -50.9 | 115.8 | 0 | 0 | 0 | 114.5 | D138 N143 Q144 | D138-H141 VanDerWaalsContact CG-ND1 3.33Å; D138-H141 PolarHBondContact O-N 3.38Å; D138-H141 WeakPolarHBondContact OD1-CA 3.44Å; D138-H141 WeakPolarHBondContact OD1-CB 3.49Å; D138-H141 IonicContact OD1-CG 3.76Å; D138-H141 VanDerWaalsContact OD1-CG 3.29Å; D138-H141 PolarHBondContact OD1-N 3.41Å; D138-H141 IonicContact OD1-ND1 2.97Å; D138-H141 PolarHBondContact OD1-ND1 3.11Å; D138-H141 IonicContact OD2-CE1 3.58Å; D138-H141 IonicContact OD2-CG 2.95Å; D138-H141 IonicContact OD2-ND1 2.69Å; D138-H141 PolarHBondContact OD2-ND1 3.09Å; H141-N143 PolarHBondContact O-N 3.31Å; H141-Q144 HydrophobicContact CB-CG 4.25Å; H141-Q144 PolarHBondContact CD2-NE2 2.9Å; H141-Q144 VanDerWaalsContact CD2-NE2 3.26Å; H141-Q144 WeakPolarHBondContact O-CB 3.19Å; H141-Q144 PolarHBondContact O-N 3.26Å |
| 142 | R | 96 | Very high | 95.6 | Very high | 43 Ų | 43 | 66.5 Ų | 66.5 | 16% | 0.162 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -52.6 | -14 | 177 | 61.1 | -173.4 | -177.2 | -170.5 | -9.4 | 116.2 | C95 D97 C109 V137 D138 K139 R149 | C95-R142 HydrophobicContact CB-CB 4.17Å; C95-R142 PolarHBondContact SG-NH1 2.88Å; C95-R142 VanDerWaalsContact SG-NH1 3.43Å; D97-R142 IonicContact OD2-CZ 3.17Å; D97-R142 IonicContact OD2-NH1 2.7Å; D97-R142 PolarHBondContact OD2-NH1 2.75Å; D97-R142 IonicContact OD2-NH2 2.85Å; D97-R142 PolarHBondContact OD2-NH2 3.02Å; C109-R142 PolarHBondContact SG-NH1 2.94Å; V137-R142 HydrophobicContact CG1-CB 4.02Å; D138-R142 WeakPolarHBondContact O-CB 3.36Å; D138-R142 PolarHBondContact O-N 3.03Å; K139-R142 PolarHBondContact O-NE 3Å; R142-R149 VanDerWaalsContact O-CD 3.28Å; R142-R149 WeakPolarHBondContact O-CD 3.33Å; R142-R149 PolarHBondContact O-NH1 3.37Å |
| 143 | N | 96.5 | Very high | 95.8 | Very high | 122 Ų | 122 | 62.5 Ų | 62.5 | 65% | 0.652 | 31% | 0.314 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.8 | -12.6 | 177.2 | -67.3 | -13.8 | 0 | 0 | 0 | 113.7 | H141 C145 R149 | H141-N143 PolarHBondContact O-N 3.31Å; N143-C145 PolarHBondContact O-N 3.35Å; N143-R149 PolarHBondContact OD1-NH1 2.92Å |
| 144 | Q | 95.2 | Very high | 95.9 | Very high | 130 Ų | 130 | 66.6 Ų | 66.6 | 61% | 0.607 | 33% | 0.33 | S | S | * | . | S | Bend | trans | -66.5 | -35.3 | -175.7 | -69.8 | 179.3 | -13.8 | 0 | 0 | 113.9 | H141 | H141-Q144 HydrophobicContact CB-CG 4.25Å; H141-Q144 PolarHBondContact CD2-NE2 2.9Å; H141-Q144 VanDerWaalsContact CD2-NE2 3.26Å; H141-Q144 WeakPolarHBondContact O-CB 3.19Å; H141-Q144 PolarHBondContact O-N 3.26Å |
| 145 | C | 97.5 | Very high | 95.9 | Very high | 16 Ų | 16 | 68.9 Ų | 68.9 | 11% | 0.108 | 33% | 0.334 | C | S | . | . | trans | -140.1 | 101 | -178.9 | -176.3 | 0 | 0 | 0 | 0 | 111.4 | C128 C135 N143 A147 C148 R149 | C128-C145 VanDerWaalsContact SG-SG 3.65Å; C135-C145 HydrophobicContact CB-CB 3.65Å; N143-C145 PolarHBondContact O-N 3.35Å; C145-A147 VanDerWaalsContact C-N 3.29Å; C145-A147 PolarHBondContact O-N 3.27Å; C145-C148 HydrophobicContact CB-CB 4.14Å; C145-C148 PolarHBondContact O-N 2.92Å; C145-C148 PolarHBondContact SG-N 3.47Å; C145-R149 WeakPolarHBondContact O-CB 3.47Å; C145-R149 PolarHBondContact O-N 2.87Å | ||
| 146 | Q | 97.2 | Very high | 95.9 | Very high | 101 Ų | 101 | 71.4 Ų | 71.4 | 47% | 0.472 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -60.9 | -37.4 | 179 | -65.4 | 175.6 | -28.8 | 0 | 0 | 112 | F115 Y126 R149 L150 | F115-Q146 HydrophobicContact CE2-CB 4.1Å; F115-Q146 HydrophobicContact CE2-CG 4.15Å; F115-Q146 HydrophobicContact CZ-CB 4.23Å; F115-Q146 WeakPolarHBondContact CZ-O 3.43Å; Y126-Q146 HydrophobicContact CD1-CB 3.62Å; Y126-Q146 HydrophobicContact CD1-CG 4.42Å; Y126-Q146 HydrophobicContact CD2-CB 3.99Å; Y126-Q146 HydrophobicContact CE1-CB 3.85Å; Y126-Q146 HydrophobicContact CE1-CG 4.3Å; Y126-Q146 HydrophobicContact CE2-CB 4.19Å; Y126-Q146 HydrophobicContact CG-CB 3.69Å; Q146-R149 PolarHBondContact O-N 3.43Å; Q146-L150 PolarHBondContact O-N 2.92Å |
| 147 | A | 96.8 | Very high | 95.6 | Very high | 17 Ų | 17 | 66.7 Ų | 66.7 | 14% | 0.14 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.3 | -51.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | C128 C145 R149 L150 K151 | C128-A147 HydrophobicContact CB-CB 4.15Å; C145-A147 VanDerWaalsContact C-N 3.29Å; C145-A147 PolarHBondContact O-N 3.27Å; A147-R149 VanDerWaalsContact C-N 3.33Å; A147-R149 PolarHBondContact O-N 3.01Å; A147-L150 PolarHBondContact O-N 3.15Å; A147-K151 VanDerWaalsContact O-CB 3.32Å; A147-K151 WeakPolarHBondContact O-CB 3.18Å; A147-K151 PolarHBondContact O-N 3.39Å |
| 148 | C | 97.6 | Very high | 95.4 | Very high | 7 Ų | 7 | 66.4 Ų | 66.4 | 5% | 0.047 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -66.6 | -34.8 | 177.9 | -67.9 | 0 | 0 | 0 | 0 | 112.2 | G133 N134 C135 V137 C145 K152 | G133-C148 PolarHBondContact O-SG 3.42Å; N134-C148 PolarHBondContact N-SG 3.01Å; C135-C148 HydrophobicContact CB-CB 3.84Å; C135-C148 PolarHBondContact N-SG 3.13Å; V137-C148 HydrophobicContact CG2-CB 4.46Å; C145-C148 HydrophobicContact CB-CB 4.14Å; C145-C148 PolarHBondContact O-N 2.92Å; C145-C148 PolarHBondContact SG-N 3.47Å; C148-K152 WeakPolarHBondContact O-CB 3.09Å; C148-K152 PolarHBondContact O-N 2.92Å |
| 149 | R | 98.2 | Very high | 94.8 | Very high | 10 Ų | 10 | 69 Ų | 69 | 4% | 0.038 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -62.9 | -47.4 | 173.4 | -168.9 | -169.6 | -168.3 | 151.8 | -6.7 | 112 | V94 G111 C112 F115 V137 R142 N143 C145 Q146 A147 K152 C153 | V94-R149 HydrophobicContact CG1-CG 4.46Å; G111-R149 VanDerWaalsContact C-NH2 3.27Å; G111-R149 PolarHBondContact O-NH2 3.2Å; G111-R149 VanDerWaalsContact O-NH2 3.08Å; C112-R149 PolarHBondContact SG-NH2 3.01Å; C112-R149 VanDerWaalsContact SG-NH2 3.42Å; F115-R149 VanDerWaalsContact CD1-CD 3.47Å; F115-R149 HydrophobicContact CD1-CG 3.93Å; F115-R149 HydrophobicContact CE1-CB 3.99Å; F115-R149 HydrophobicContact CE1-CG 3.78Å; F115-R149 HydrophobicContact CZ-CB 4.16Å; F115-R149 HydrophobicContact CZ-CG 4.33Å; V137-R149 HydrophobicContact CG1-CG 4.23Å; R142-R149 VanDerWaalsContact O-CD 3.28Å; R142-R149 WeakPolarHBondContact O-CD 3.33Å; R142-R149 PolarHBondContact O-NH1 3.37Å; N143-R149 PolarHBondContact OD1-NH1 2.92Å; C145-R149 WeakPolarHBondContact O-CB 3.47Å; C145-R149 PolarHBondContact O-N 2.87Å; Q146-R149 PolarHBondContact O-N 3.43Å; A147-R149 VanDerWaalsContact C-N 3.33Å; A147-R149 PolarHBondContact O-N 3.01Å; R149-K152 PolarHBondContact O-N 2.92Å; R149-C153 PolarHBondContact O-N 2.89Å; R149-C153 PolarHBondContact O-SG 3.34Å |
| 150 | L | 96.5 | Very high | 93.8 | Very high | 27 Ų | 27 | 69.5 Ų | 69.5 | 14% | 0.141 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -66.3 | -44.4 | 179.2 | -173.7 | 61.8 | 0 | 0 | 0 | 111.5 | F115 F116 Y126 Q146 A147 K152 C153 I154 | F115-L150 HydrophobicContact CE1-CB 3.81Å; F115-L150 HydrophobicContact CE1-CD1 4.13Å; F115-L150 HydrophobicContact CZ-CB 4Å; F116-L150 HydrophobicContact CD2-CD1 3.99Å; F116-L150 HydrophobicContact CE2-CD1 4.43Å; Y126-L150 HydrophobicContact CD2-CB 4.26Å; Y126-L150 HydrophobicContact CD2-CD2 3.87Å; Y126-L150 HydrophobicContact CE2-CD2 4.03Å; Q146-L150 PolarHBondContact O-N 2.92Å; A147-L150 PolarHBondContact O-N 3.15Å; L150-K152 VanDerWaalsContact C-N 3.26Å; L150-K152 PolarHBondContact O-N 3.22Å; L150-C153 WeakPolarHBondContact O-CB 3.4Å; L150-C153 PolarHBondContact O-N 2.94Å; L150-C153 VanDerWaalsContact O-N 3.09Å; L150-I154 HydrophobicContact CD1-CD1 4.47Å; L150-I154 HydrophobicContact CG-CD1 4.2Å; L150-I154 PolarHBondContact O-N 3.43Å |
| 151 | K | 95.6 | Very high | 92.5 | Very high | 116 Ų | 116 | 69.8 Ų | 69.8 | 50% | 0.504 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -53.6 | -42.9 | 171.7 | -177.7 | -178.9 | 173.8 | -170.9 | 0 | 111.3 | G133 A147 K155 | G133-K151 PolarHBondContact O-NZ 3.22Å; A147-K151 VanDerWaalsContact O-CB 3.32Å; A147-K151 WeakPolarHBondContact O-CB 3.18Å; A147-K151 PolarHBondContact O-N 3.39Å; K151-K155 VanDerWaalsContact O-CB 3.22Å; K151-K155 WeakPolarHBondContact O-CB 3.49Å; K151-K155 PolarHBondContact O-N 3.21Å |
| 152 | K | 97.1 | Very high | 90.6 | Very high | 66 Ų | 66 | 67.6 Ų | 67.6 | 29% | 0.287 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -70.4 | -37.8 | 175.9 | -165.3 | 175 | 179 | -169.3 | 0 | 112.8 | V94 V137 C148 R149 L150 I154 K155 M156 | V94-K152 HydrophobicContact CG1-CB 4.36Å; V94-K152 HydrophobicContact CG1-CD 4.41Å; V94-K152 HydrophobicContact CG1-CG 4.31Å; V94-K152 WeakPolarHBondContact O-CD 3.25Å; V94-K152 WeakPolarHBondContact O-CE 3.08Å; V94-K152 PolarHBondContact O-NZ 2.97Å; V137-K152 HydrophobicContact CB-CD 3.8Å; V137-K152 HydrophobicContact CG1-CD 4.21Å; V137-K152 HydrophobicContact CG2-CD 4.23Å; V137-K152 PolarHBondContact O-NZ 3.08Å; C148-K152 WeakPolarHBondContact O-CB 3.09Å; C148-K152 PolarHBondContact O-N 2.92Å; R149-K152 PolarHBondContact O-N 2.92Å; L150-K152 VanDerWaalsContact C-N 3.26Å; L150-K152 PolarHBondContact O-N 3.22Å; K152-I154 PolarHBondContact O-N 2.63Å; K152-K155 PolarHBondContact O-N 3.01Å; K152-M156 HydrophobicContact CG-CG 4.16Å; K152-M156 WeakPolarHBondContact O-CB 3.47Å; K152-M156 VanDerWaalsContact O-CG 3.25Å; K152-M156 WeakPolarHBondContact O-CG 3.28Å; K152-M156 PolarHBondContact O-N 3.48Å |
| 153 | C | 96 | Very high | 88.4 | Confident | 0 Ų | 0 | 70.8 Ų | 70.8 | 0% | 0 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -56.2 | -51.1 | 173.8 | -65.8 | 0 | 0 | 0 | 0 | 111.3 | F116 R149 L150 M156 G157 M158 | F116-C153 HydrophobicContact CD2-CB 3.86Å; F116-C153 HydrophobicContact CE2-CB 4.48Å; R149-C153 PolarHBondContact O-N 2.89Å; R149-C153 PolarHBondContact O-SG 3.34Å; L150-C153 WeakPolarHBondContact O-CB 3.4Å; L150-C153 PolarHBondContact O-N 2.94Å; L150-C153 VanDerWaalsContact O-N 3.09Å; C153-M156 PolarHBondContact O-N 3.28Å; C153-G157 PolarHBondContact O-N 3.2Å; C153-M158 HydrophobicContact CB-CB 4.28Å; C153-M158 HydrophobicContact CB-CG 4.22Å; C153-M158 HydrophobicContact CB-SD 3.61Å; C153-M158 WeakPolarHBondContact O-CB 3.46Å; C153-M158 PolarHBondContact O-N 2.85Å |
| 154 | I | 93.2 | Very high | 85.8 | Confident | 105 Ų | 105 | 70.5 Ų | 70.5 | 54% | 0.538 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -65.6 | -46.7 | 179 | -61.5 | 167.2 | 0 | 0 | 0 | 110.4 | F116 L150 K152 M156 G157 | F116-I154 HydrophobicContact CE2-CG1 4.18Å; L150-I154 HydrophobicContact CD1-CD1 4.47Å; L150-I154 HydrophobicContact CG-CD1 4.2Å; L150-I154 PolarHBondContact O-N 3.43Å; K152-I154 PolarHBondContact O-N 2.63Å; I154-M156 VanDerWaalsContact C-N 3.27Å; I154-M156 PolarHBondContact O-N 3.26Å; I154-G157 PolarHBondContact O-N 2.94Å |
| 155 | K | 94.5 | Very high | 83 | Confident | 177 Ų | 177 | 67.4 Ų | 67.4 | 77% | 0.77 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -57.4 | -36.2 | 178.2 | 179.8 | 176.9 | 177.6 | 179.2 | 0 | 113.3 | K151 K152 G157 | K151-K155 VanDerWaalsContact O-CB 3.22Å; K151-K155 WeakPolarHBondContact O-CB 3.49Å; K151-K155 PolarHBondContact O-N 3.21Å; K152-K155 PolarHBondContact O-N 3.01Å; K155-G157 VanDerWaalsContact C-N 3.28Å |
| 156 | M | 93.9 | Very high | 80 | Confident | 85 Ų | 85 | 72.3 Ų | 72.3 | 42% | 0.419 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | -9 | 177.8 | -63.1 | -49.6 | -66.1 | 0 | 0 | 113.3 | A93 I106 K152 C153 I154 | A93-M156 HydrophobicContact CB-CB 4.45Å; A93-M156 HydrophobicContact CB-CE 3.96Å; A93-M156 HydrophobicContact CB-CG 4.48Å; I106-M156 HydrophobicContact CD1-CB 3.58Å; I106-M156 WeakPolarHBondContact CG2-O 3.33Å; K152-M156 HydrophobicContact CG-CG 4.16Å; K152-M156 WeakPolarHBondContact O-CB 3.47Å; K152-M156 VanDerWaalsContact O-CG 3.25Å; K152-M156 WeakPolarHBondContact O-CG 3.28Å; K152-M156 PolarHBondContact O-N 3.48Å; C153-M156 PolarHBondContact O-N 3.28Å; I154-M156 VanDerWaalsContact C-N 3.27Å; I154-M156 PolarHBondContact O-N 3.26Å |
| 157 | G | 90.4 | Very high | 77.1 | Confident | 43 Ų | 43 | 70.3 Ų | 70.3 | 44% | 0.443 | 36% | 0.357 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 113.6 | 13.4 | 175 | 0 | 0 | 0 | 0 | 0 | 116.5 | I106 C153 I154 K155 N159 | I106-G157 VanDerWaalsContact CG2-C 3.45Å; C153-G157 PolarHBondContact O-N 3.2Å; I154-G157 PolarHBondContact O-N 2.94Å; K155-G157 VanDerWaalsContact C-N 3.28Å; G157-N159 PolarHBondContact O-N 3.01Å |
| 158 | M | 92.2 | Very high | 74 | Confident | 9 Ų | 9 | 74.5 Ų | 74.5 | 4% | 0.044 | 38% | 0.381 | C | S | . | . | trans | -67.9 | 117.5 | 176.7 | -73.5 | -170.8 | 161.1 | 0 | 0 | 112 | V94 Y104 I106 A108 F116 C153 | V94-M158 HydrophobicContact CG2-CE 4.36Å; Y104-M158 CarbonylContact O-C 3.55Å; Y104-M158 VanDerWaalsContact O-CA 3.29Å; Y104-M158 WeakPolarHBondContact O-CA 3.18Å; I106-M158 HydrophobicContact CD1-CE 4.04Å; I106-M158 HydrophobicContact CD1-CG 3.52Å; I106-M158 HydrophobicContact CD1-SD 4.42Å; I106-M158 HydrophobicContact CG1-CE 3.85Å; I106-M158 HydrophobicContact CG1-CG 3.62Å; A108-M158 HydrophobicContact CB-CE 3.35Å; F116-M158 HydrophobicContact CB-SD 3.65Å; F116-M158 HydrophobicContact CD1-CB 4.27Å; F116-M158 HydrophobicContact CD1-SD 4.27Å; F116-M158 HydrophobicContact CD2-CB 3.74Å; F116-M158 HydrophobicContact CD2-CG 4.4Å; F116-M158 HydrophobicContact CD2-SD 3.82Å; F116-M158 HydrophobicContact CE1-CB 4.03Å; F116-M158 HydrophobicContact CE2-CB 3.49Å; F116-M158 VanDerWaalsContact CE2-CB 3.49Å; F116-M158 HydrophobicContact CG-CB 4.13Å; F116-M158 HydrophobicContact CG-CG 4.49Å; F116-M158 HydrophobicContact CG-SD 3.66Å; F116-M158 HydrophobicContact CZ-CB 3.64Å; F116-M158 VanDerWaalsContact CZ-O 3.26Å; F116-M158 WeakPolarHBondContact CZ-O 3.48Å; C153-M158 HydrophobicContact CB-CB 4.28Å; C153-M158 HydrophobicContact CB-CG 4.22Å; C153-M158 HydrophobicContact CB-SD 3.61Å; C153-M158 WeakPolarHBondContact O-CB 3.46Å; C153-M158 PolarHBondContact O-N 2.85Å | ||
| 159 | N | 82 | Confident | 70.9 | Confident | 82 Ų | 82 | 78.4 Ų | 78.4 | 44% | 0.439 | 40% | 0.4 | S | S | . | . | trans | -111.3 | 140.7 | 174 | -170.1 | 11.8 | 0 | 0 | 0 | 112.1 | Y104 G157 D161 G162 | Y104-N159 WeakPolarHBondContact CB-O 3.47Å; Y104-N159 WeakPolarHBondContact CD1-O 3.32Å; Y104-N159 PolarHBondContact O-N 2.89Å; G157-N159 PolarHBondContact O-N 3.01Å; N159-D161 PolarHBondContact ND2-OD2 3.03Å; N159-D161 PolarHBondContact O-N 3.36Å; N159-D161 PolarHBondContact OD1-N 3.23Å; N159-D161 PolarHBondContact OD1-OD2 3.23Å; N159-G162 PolarHBondContact O-N 3.27Å; N159-G162 VanDerWaalsContact O-N 3.14Å | ||
| 160 | K | 74.7 | Confident | 67.9 | Low | 135 Ų | 135 | 81.8 Ų | 81.8 | 59% | 0.587 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -30.9 | 174.9 | 63 | 173.3 | -173.1 | 171.7 | 0 | 112.8 | V120 | V120-K160 HydrophobicContact CG1-CB 3.68Š|
| 161 | D | 66.9 | Low | 64.7 | Low | 109 Ų | 109 | 84.5 Ų | 84.5 | 58% | 0.583 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.5 | -9.3 | -177.7 | -45 | -59.6 | 0 | 0 | 0 | 111.9 | N159 K163 | N159-D161 PolarHBondContact ND2-OD2 3.03Å; N159-D161 PolarHBondContact O-N 3.36Å; N159-D161 PolarHBondContact OD1-N 3.23Å; N159-D161 PolarHBondContact OD1-OD2 3.23Å; D161-K163 PolarHBondContact O-N 2.9Å; D161-K163 VanDerWaalsContact O-N 3.15Å |
| 162 | G | 55.1 | Low | 61.6 | Low | 19 Ų | 19 | 84.3 Ų | 84.3 | 20% | 0.196 | 44% | 0.435 | C | S | . | . | trans | -69.5 | 107.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y104 N159 | Y104-G162 WeakPolarHBondContact CA-O 3.36Å; Y104-G162 WeakPolarHBondContact CD1-O 3.29Å; N159-G162 PolarHBondContact O-N 3.27Å; N159-G162 VanDerWaalsContact O-N 3.14Å | ||
| 163 | K | 49.6 | Very low | 58.4 | Low | 111 Ų | 111 | 86.7 Ų | 86.7 | 48% | 0.483 | 46% | 0.455 | S | S | . | . | trans | -56.9 | 143.2 | 174.2 | -65.1 | 175.1 | -176.1 | 169.7 | 0 | 110 | D161 L165 D336 | D161-K163 PolarHBondContact O-N 2.9Å; D161-K163 VanDerWaalsContact O-N 3.15Å; K163-L165 PolarHBondContact O-N 3.44Å; K163-D336 IonicContact NZ-OD2 2.92Å; K163-D336 PolarHBondContact NZ-OD2 2.95Å | ||
| 164 | M | 40.9 | Very low | 55.3 | Low | 115 Ų | 115 | 93.3 Ų | 93.3 | 57% | 0.567 | 50% | 0.495 | S | S | * | . | trans | -75.6 | 109.9 | 178.8 | -178.9 | 178.3 | 75.2 | 0 | 0 | 109 | ||||
| 165 | L | 36.5 | Very low | 52.2 | Low | 65 Ų | 65 | 91.9 Ų | 91.9 | 34% | 0.34 | 51% | 0.507 | S | S | . | . | B | Isolated β-bridge | trans | -104.9 | 106.4 | 176.5 | -81.1 | 166.1 | 0 | 0 | 0 | 108.6 | K102 K163 L167 V342 | K102-L165 CarbonylContact C-O 3.52Å; K102-L165 WeakPolarHBondContact CA-O 3.46Å; K102-L165 HydrophobicContact CB-CB 4.22Å; K102-L165 WeakPolarHBondContact CB-O 3.35Å; K102-L165 PolarHBondContact N-O 3.41Å; K102-L165 CarbonylContact O-C 3.57Å; K102-L165 PolarHBondContact O-N 3.25Å; K163-L165 PolarHBondContact O-N 3.44Å; L165-L167 PolarHBondContact O-N 3.49Å; L165-V342 HydrophobicContact CD1-CG1 4.4Å |
| 166 | L | 34.4 | Very low | 49.3 | Very low | 119 Ų | 119 | 88.1 Ų | 88.1 | 62% | 0.623 | 51% | 0.508 | S | S | * | . | trans | -60.7 | 106.5 | 167.9 | -127.8 | 81.9 | 0 | 0 | 0 | 107.4 | T168 | L166-T168 PolarHBondContact O-N 3.14Š| ||
| 167 | L | 36.1 | Very low | 46.2 | Very low | 60 Ų | 60 | 89.6 Ų | 89.6 | 31% | 0.314 | 53% | 0.527 | S | S | . | . | trans | -85.9 | 87.6 | 167 | -64.3 | -178.3 | 0 | 0 | 0 | 106.9 | K102 L107 L165 M169 | K102-L167 HydrophobicContact CB-CD1 4.11Å; K102-L167 HydrophobicContact CB-CG 4.06Å; K102-L167 HydrophobicContact CD-CD1 3.79Å; K102-L167 HydrophobicContact CD-CD2 4.4Å; K102-L167 HydrophobicContact CD-CG 4.22Å; K102-L167 HydrophobicContact CG-CD1 3.59Å; K102-L167 HydrophobicContact CG-CG 4.07Å; L107-L167 HydrophobicContact CD2-CD1 3.98Å; L165-L167 PolarHBondContact O-N 3.49Å; L167-M169 PolarHBondContact O-N 3.28Å | ||
| 168 | T | 31.9 | Very low | 43.5 | Very low | 104 Ų | 104 | 92.2 Ų | 92.2 | 64% | 0.638 | 54% | 0.537 | S | S | * | . | trans | -56 | 131.1 | 144.8 | 29.6 | 0 | 0 | 0 | 0 | 107.2 | L166 | L166-T168 PolarHBondContact O-N 3.14Š| ||
| 169 | M | 32.6 | Very low | 40.9 | Very low | 90 Ų | 90 | 97.1 Ų | 97.1 | 44% | 0.443 | 57% | 0.569 | S | S | . | * | trans | -76.9 | 152 | -168.6 | -46.3 | -172 | -170.2 | 0 | 0 | 108.1 | L90 L167 | L90-M169 HydrophobicContact CB-CE 3.84Å; L90-M169 HydrophobicContact CB-SD 4.04Å; L90-M169 HydrophobicContact CD1-CE 3.85Å; L90-M169 HydrophobicContact CD1-CG 3.76Å; L90-M169 HydrophobicContact CD1-SD 3.51Å; L90-M169 VanDerWaalsContact CD1-SD 3.51Å; L90-M169 HydrophobicContact CG-CE 4.16Å; L90-M169 HydrophobicContact CG-SD 3.75Å; L167-M169 PolarHBondContact O-N 3.28Å | ||
| 170 | N | 35.2 | Very low | 38.7 | Very low | 81 Ų | 81 | 100.9 Ų | 100.9 | 43% | 0.433 | 59% | 0.588 | S | S | . | * | -159.1 | 133 | 73.5 | -166.4 | 19.1 | 0 | 0 | 0 | 112.4 | Y172 Y349 | N170-Y172 PolarHBondContact O-N 2.98Å; N170-Y349 PolarHBondContact O-OH 3.18Å | |||
| 171 | P | 30.5 | Very low | 36.9 | Very low | 83 Ų | 83 | 99.9 Ų | 99.9 | 54% | 0.539 | 59% | 0.589 | S | S | . | * | trans | -78.7 | 113.3 | 168.6 | 30.3 | -33.8 | 0 | 0 | 0 | 112 | T173 | P171-T173 PolarHBondContact O-N 2.92Š| ||
| 172 | Y | 29.9 | Very low | 35.4 | Very low | 112 Ų | 112 | 99.4 Ų | 99.4 | 44% | 0.439 | 59% | 0.59 | S | S | . | * | trans | -71.4 | 92 | 161.3 | -80.3 | -81.1 | 0 | 0 | 0 | 110.8 | N170 | N170-Y172 PolarHBondContact O-N 2.98Š| ||
| 173 | T | 29.5 | Very low | 34.3 | Very low | 117 Ų | 117 | 102 Ų | 102 | 72% | 0.718 | 61% | 0.606 | S | S | * | * | trans | -108.1 | 106.1 | 138.7 | 46.6 | 0 | 0 | 0 | 0 | 108.7 | P171 | P171-T173 PolarHBondContact O-N 2.92Š| ||
| 174 | T | 32.2 | Very low | 33.6 | Very low | 138 Ų | 138 | 102.7 Ų | 102.7 | 85% | 0.847 | 61% | 0.612 | S | S | * | * | S | Bend | trans | 61.2 | 105.2 | 154.3 | 61 | 0 | 0 | 0 | 0 | 119.4 | ||
| 175 | G | 28.3 | Very low | 33.2 | Very low | 75 Ų | 75 | 98.9 Ų | 98.9 | 77% | 0.773 | 60% | 0.602 | S | S | * | * | trans | 112.9 | 121.6 | 139.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 176 | A | 31.7 | Very low | 33 | Very low | 98 Ų | 98 | 99 Ų | 99 | 81% | 0.81 | 60% | 0.602 | S | S | * | * | trans | 65.3 | 86.2 | 160.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 177 | S | 30.1 | Very low | 33 | Very low | 116 Ų | 116 | 97.5 Ų | 97.5 | 81% | 0.811 | 60% | 0.595 | S | S | * | * | trans | 59.7 | 133.5 | 135.3 | -52.8 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 178 | P | 33.6 | Very low | 33 | Very low | 99 Ų | 99 | 97.7 Ų | 97.7 | 64% | 0.643 | 61% | 0.605 | S | S | * | * | trans | -88.2 | 169.3 | -170.9 | 40.2 | -39.7 | 0 | 0 | 0 | 113.3 | ||||
| 179 | P | 38.5 | Very low | 33.2 | Very low | 111 Ų | 111 | 93.6 Ų | 93.6 | 72% | 0.721 | 58% | 0.583 | S | S | * | * | -152.8 | 173.5 | 96.9 | 42.5 | -25.2 | 0 | 0 | 0 | 117.5 | |||||
| 180 | L | 34.8 | Very low | 33.4 | Very low | 161 Ų | 161 | 93.3 Ų | 93.3 | 84% | 0.843 | 58% | 0.581 | S | S | * | * | S | Bend | trans | 90.3 | -36.2 | 157.3 | -60.6 | 172.8 | 0 | 0 | 0 | 123.6 | ||
| 181 | D | 36.8 | Very low | 33.7 | Very low | 114 Ų | 114 | 97.4 Ų | 97.4 | 61% | 0.61 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | 1.7 | -172 | -159.3 | 26.4 | 0 | 0 | 0 | 115.9 | S183 | D181-S183 PolarHBondContact O-N 2.98Š|
| 182 | V | 34.8 | Very low | 34.1 | Very low | 99 Ų | 99 | 95.2 Ų | 95.2 | 60% | 0.6 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -61.7 | -29.4 | 178.4 | 174.5 | 0 | 0 | 0 | 0 | 111.8 | M184 G185 L186 | V182-M184 PolarHBondContact O-N 3.47Å; V182-G185 PolarHBondContact O-N 3.42Å; V182-L186 HydrophobicContact CG1-CD1 4.01Å; V182-L186 WeakPolarHBondContact O-CB 3.25Å; V182-L186 PolarHBondContact O-N 2.68Å |
| 183 | S | 31.9 | Very low | 34.6 | Very low | 75 Ų | 75 | 91.6 Ų | 91.6 | 52% | 0.524 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.8 | -27 | -173.7 | -58.5 | 0 | 0 | 0 | 0 | 115.4 | D181 L186 L187 | D181-S183 PolarHBondContact O-N 2.98Å; S183-L186 WeakPolarHBondContact O-CB 3.48Å; S183-L187 WeakPolarHBondContact O-CG 3.26Å; S183-L187 PolarHBondContact O-N 2.69Å |
| 184 | M | 35.4 | Very low | 35.3 | Very low | 125 Ų | 125 | 94.1 Ų | 94.1 | 62% | 0.616 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -84.6 | -33 | 177.7 | -83.6 | -66.8 | -68.3 | 0 | 0 | 112.9 | V182 L186 L187 A188 | V182-M184 PolarHBondContact O-N 3.47Å; M184-L186 VanDerWaalsContact C-N 3.34Å; M184-L187 PolarHBondContact O-N 3.33Å; M184-L187 HydrophobicContact SD-CD1 4Å; M184-A188 PolarHBondContact O-N 3.39Å |
| 185 | G | 32.7 | Very low | 35.8 | Very low | 35 Ų | 35 | 93.7 Ų | 93.7 | 36% | 0.361 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.4 | -38.9 | 167.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | V182 G189 | V182-G185 PolarHBondContact O-N 3.42Å; G185-G189 PolarHBondContact O-N 3.25Å |
| 186 | L | 32.6 | Very low | 36.4 | Very low | 66 Ų | 66 | 91.7 Ų | 91.7 | 35% | 0.346 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -54.6 | -61.4 | 164.7 | -116.4 | 61.2 | 0 | 0 | 0 | 109.8 | V182 S183 M184 A188 G189 E190 M350 | V182-L186 HydrophobicContact CG1-CD1 4.01Å; V182-L186 WeakPolarHBondContact O-CB 3.25Å; V182-L186 PolarHBondContact O-N 2.68Å; S183-L186 WeakPolarHBondContact O-CB 3.48Å; M184-L186 VanDerWaalsContact C-N 3.34Å; L186-A188 PolarHBondContact O-N 3.25Å; L186-G189 CarbonylContact O-C 3.49Å; L186-G189 PolarHBondContact O-N 3.09Å; L186-E190 HydrophobicContact CB-CG 4.2Å; L186-E190 HydrophobicContact CG-CG 4.06Å; L186-E190 WeakPolarHBondContact O-CA 3.5Å; L186-E190 WeakPolarHBondContact O-CB 3.46Å; L186-E190 WeakPolarHBondContact O-CG 3.37Å; L186-E190 PolarHBondContact O-N 2.77Å; L186-M350 HydrophobicContact CD1-CE 4.37Å |
| 187 | L | 33.4 | Very low | 36.9 | Very low | 88 Ų | 88 | 88.9 Ų | 88.9 | 46% | 0.461 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.1 | -26.8 | -174.8 | -78 | 165.7 | 0 | 0 | 0 | 116.3 | S183 M184 E190 R191 | S183-L187 WeakPolarHBondContact O-CG 3.26Å; S183-L187 PolarHBondContact O-N 2.69Å; M184-L187 PolarHBondContact O-N 3.33Å; M184-L187 HydrophobicContact SD-CD1 4Å; L187-E190 PolarHBondContact N-OE2 3.16Å; L187-R191 WeakPolarHBondContact O-CB 3.35Å; L187-R191 VanDerWaalsContact O-CG 3.28Å; L187-R191 WeakPolarHBondContact O-CG 2.96Å; L187-R191 PolarHBondContact O-N 3.19Å |
| 188 | A | 36.5 | Very low | 37.6 | Very low | 65 Ų | 65 | 87.7 Ų | 87.7 | 54% | 0.537 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -83.1 | -44.4 | 173 | 0 | 0 | 0 | 0 | 0 | 112.4 | M184 L186 R191 A192 | M184-A188 PolarHBondContact O-N 3.39Å; L186-A188 PolarHBondContact O-N 3.25Å; A188-R191 PolarHBondContact O-N 3.44Å; A188-R191 VanDerWaalsContact O-N 3.17Å; A188-A192 PolarHBondContact O-N 3.17Å; A188-A192 VanDerWaalsContact O-N 3.16Å |
| 189 | G | 35.5 | Very low | 38.1 | Very low | 17 Ų | 17 | 85 Ų | 85 | 18% | 0.175 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -61.1 | -52.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | G185 L186 R191 A192 L193 | G185-G189 PolarHBondContact O-N 3.25Å; L186-G189 CarbonylContact O-C 3.49Å; L186-G189 PolarHBondContact O-N 3.09Å; G189-R191 PolarHBondContact O-N 2.75Å; G189-A192 PolarHBondContact O-N 3.19Å; G189-L193 WeakPolarHBondContact O-CA 3.34Å; G189-L193 WeakPolarHBondContact O-CB 3.22Å; G189-L193 WeakPolarHBondContact O-CD1 3.1Å; G189-L193 WeakPolarHBondContact O-CG 3.4Å; G189-L193 PolarHBondContact O-N 3.23Å |
| 190 | E | 37.6 | Very low | 38.5 | Very low | 85 Ų | 85 | 80.3 Ų | 80.3 | 40% | 0.397 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -56.7 | -17.4 | 168.8 | -66.8 | 175 | 147.4 | 0 | 0 | 114.3 | L186 L187 R194 | L186-E190 HydrophobicContact CB-CG 4.2Å; L186-E190 HydrophobicContact CG-CG 4.06Å; L186-E190 WeakPolarHBondContact O-CA 3.5Å; L186-E190 WeakPolarHBondContact O-CB 3.46Å; L186-E190 WeakPolarHBondContact O-CG 3.37Å; L186-E190 PolarHBondContact O-N 2.77Å; L187-E190 PolarHBondContact N-OE2 3.16Å; E190-R194 WeakPolarHBondContact O-CA 2.95Å; E190-R194 WeakPolarHBondContact O-CB 3.35Å; E190-R194 WeakPolarHBondContact O-CG 3.12Å; E190-R194 PolarHBondContact O-N 3.38Å |
| 191 | R | 41.7 | Very low | 39 | Very low | 167 Ų | 167 | 74.7 Ų | 74.7 | 63% | 0.63 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -81.1 | -52 | 167.8 | -89.9 | -179.2 | -162.1 | 175.4 | 7.1 | 111.4 | L187 A188 G189 L193 R194 E195 | L187-R191 WeakPolarHBondContact O-CB 3.35Å; L187-R191 VanDerWaalsContact O-CG 3.28Å; L187-R191 WeakPolarHBondContact O-CG 2.96Å; L187-R191 PolarHBondContact O-N 3.19Å; A188-R191 PolarHBondContact O-N 3.44Å; A188-R191 VanDerWaalsContact O-N 3.17Å; G189-R191 PolarHBondContact O-N 2.75Å; R191-L193 PolarHBondContact O-N 2.94Å; R191-R194 CarbonylContact O-C 3.54Å; R191-R194 PolarHBondContact O-N 3.49Å; R191-R194 VanDerWaalsContact O-N 3.09Å; R191-E195 WeakPolarHBondContact O-CB 3.45Å; R191-E195 WeakPolarHBondContact O-CG 3.33Å; R191-E195 PolarHBondContact O-N 3.32Å |
| 192 | A | 39.1 | Very low | 39.4 | Very low | 37 Ų | 37 | 74.2 Ų | 74.2 | 31% | 0.306 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60 | -38.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | A188 G189 E195 C196 | A188-A192 PolarHBondContact O-N 3.17Å; A188-A192 VanDerWaalsContact O-N 3.16Å; G189-A192 PolarHBondContact O-N 3.19Å; A192-E195 PolarHBondContact O-N 3.28Å; A192-C196 VanDerWaalsContact O-CB 3.26Å; A192-C196 WeakPolarHBondContact O-CB 3.4Å; A192-C196 PolarHBondContact O-N 3.5Å; A192-C196 PolarHBondContact O-SG 2.99Å; A192-C196 VanDerWaalsContact O-SG 3.4Å |
| 193 | L | 40.4 | Very low | 39.6 | Very low | 35 Ų | 35 | 70.9 Ų | 70.9 | 18% | 0.183 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -79 | -23 | 175 | -62.8 | 164.8 | 0 | 0 | 0 | 112.3 | G189 R191 A197 I319 A323 | G189-L193 WeakPolarHBondContact O-CA 3.34Å; G189-L193 WeakPolarHBondContact O-CB 3.22Å; G189-L193 WeakPolarHBondContact O-CD1 3.1Å; G189-L193 WeakPolarHBondContact O-CG 3.4Å; G189-L193 PolarHBondContact O-N 3.23Å; R191-L193 PolarHBondContact O-N 2.94Å; L193-A197 VanDerWaalsContact O-CA 3.25Å; L193-A197 WeakPolarHBondContact O-CA 3.46Å; L193-A197 WeakPolarHBondContact O-CB 3.47Å; L193-A197 PolarHBondContact O-N 3.24Å; L193-I319 HydrophobicContact CB-CG2 3.94Å; L193-I319 HydrophobicContact CD1-CG2 3.61Å; L193-I319 HydrophobicContact CD2-CG2 3.63Å; L193-I319 HydrophobicContact CG-CG2 3.9Å; L193-A323 HydrophobicContact CD2-CB 3.72Å |
| 194 | R | 43.7 | Very low | 40.2 | Very low | 170 Ų | 170 | 67.6 Ų | 67.6 | 64% | 0.642 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -75.9 | -34.7 | 164.1 | -92.5 | 173.7 | 150.5 | -110 | -1.1 | 111.4 | E190 R191 N198 | E190-R194 WeakPolarHBondContact O-CA 2.95Å; E190-R194 WeakPolarHBondContact O-CB 3.35Å; E190-R194 WeakPolarHBondContact O-CG 3.12Å; E190-R194 PolarHBondContact O-N 3.38Å; R191-R194 CarbonylContact O-C 3.54Å; R191-R194 PolarHBondContact O-N 3.49Å; R191-R194 VanDerWaalsContact O-N 3.09Å; R194-N198 WeakPolarHBondContact O-CA 3.45Å; R194-N198 WeakPolarHBondContact O-CB 3.13Å; R194-N198 PolarHBondContact O-N 2.69Å; R194-N198 PolarHBondContact O-ND2 3.15Å; R194-N198 PolarHBondContact O-OD1 3.3Å |
| 195 | E | 42.1 | Very low | 40.6 | Very low | 130 Ų | 130 | 64.2 Ų | 64.2 | 61% | 0.607 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -70.1 | -50.1 | 177.9 | -73.3 | 163.1 | -165.4 | 0 | 0 | 109 | R191 A192 N198 V199 | R191-E195 WeakPolarHBondContact O-CB 3.45Å; R191-E195 WeakPolarHBondContact O-CG 3.33Å; R191-E195 PolarHBondContact O-N 3.32Å; A192-E195 PolarHBondContact O-N 3.28Å; E195-N198 PolarHBondContact O-N 3.26Å; E195-V199 WeakPolarHBondContact O-CG2 3.49Å; E195-V199 PolarHBondContact O-N 2.98Å |
| 196 | C | 42.5 | Very low | 40.8 | Very low | 32 Ų | 32 | 65 Ų | 65 | 22% | 0.216 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -69.8 | -36.3 | 173.7 | -67.3 | 0 | 0 | 0 | 0 | 113.5 | A192 V199 V200 L326 | A192-C196 VanDerWaalsContact O-CB 3.26Å; A192-C196 WeakPolarHBondContact O-CB 3.4Å; A192-C196 PolarHBondContact O-N 3.5Å; A192-C196 PolarHBondContact O-SG 2.99Å; A192-C196 VanDerWaalsContact O-SG 3.4Å; C196-V199 WeakPolarHBondContact O-CB 3.35Å; C196-V199 PolarHBondContact O-N 3.03Å; C196-V200 WeakPolarHBondContact O-CB 3.24Å; C196-V200 VanDerWaalsContact O-CG2 3.23Å; C196-V200 WeakPolarHBondContact O-CG2 3.23Å; C196-V200 PolarHBondContact O-N 3.31Å; C196-L326 HydrophobicContact CB-CD2 4.12Å |
| 197 | A | 42.3 | Very low | 41.3 | Very low | 40 Ų | 40 | 63.8 Ų | 63.8 | 33% | 0.331 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -81.5 | -14.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L193 S201 | L193-A197 VanDerWaalsContact O-CA 3.25Å; L193-A197 WeakPolarHBondContact O-CA 3.46Å; L193-A197 WeakPolarHBondContact O-CB 3.47Å; L193-A197 PolarHBondContact O-N 3.24Å; A197-S201 VanDerWaalsContact O-CA 3.24Å; A197-S201 WeakPolarHBondContact O-CA 3.46Å; A197-S201 WeakPolarHBondContact O-CB 3.38Å; A197-S201 PolarHBondContact O-N 3.19Å |
| 198 | N | 44 | Very low | 41.5 | Very low | 90 Ų | 90 | 61.9 Ų | 61.9 | 48% | 0.481 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -73.2 | -45.2 | 163.3 | -76.5 | -11.1 | 0 | 0 | 0 | 108.6 | R194 E195 S201 V202 | R194-N198 WeakPolarHBondContact O-CA 3.45Å; R194-N198 WeakPolarHBondContact O-CB 3.13Å; R194-N198 PolarHBondContact O-N 2.69Å; R194-N198 PolarHBondContact O-ND2 3.15Å; R194-N198 PolarHBondContact O-OD1 3.3Å; E195-N198 PolarHBondContact O-N 3.26Å; N198-S201 PolarHBondContact O-N 3.4Å; N198-V202 WeakPolarHBondContact O-CA 3.42Å; N198-V202 WeakPolarHBondContact O-CB 3.23Å; N198-V202 WeakPolarHBondContact O-CG2 3.12Å; N198-V202 PolarHBondContact O-N 2.85Å |
| 199 | V | 44.5 | Very low | 41.5 | Very low | 44 Ų | 44 | 62 Ų | 62 | 27% | 0.267 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -55.1 | -55.6 | 171.6 | 155.2 | 0 | 0 | 0 | 0 | 111.3 | E195 C196 V202 A203 L251 Y406 | E195-V199 WeakPolarHBondContact O-CG2 3.49Å; E195-V199 PolarHBondContact O-N 2.98Å; C196-V199 WeakPolarHBondContact O-CB 3.35Å; C196-V199 PolarHBondContact O-N 3.03Å; V199-V202 PolarHBondContact O-N 3.26Å; V199-A203 PolarHBondContact O-N 2.9Å; V199-A203 VanDerWaalsContact O-N 3.16Å; V199-L251 HydrophobicContact CG1-CD1 3.94Å; V199-L251 HydrophobicContact CG1-CD2 3.79Å; V199-L251 HydrophobicContact CG1-CG 4.44Å; V199-Y406 WeakPolarHBondContact CG1-OH 3.3Å; V199-Y406 WeakPolarHBondContact CG2-OH 2.8Å |
| 200 | V | 45.5 | Very low | 41.5 | Very low | 12 Ų | 12 | 64.4 Ų | 64.4 | 7% | 0.073 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -68.3 | -41.3 | -179.1 | 174.1 | 0 | 0 | 0 | 0 | 110.8 | C196 V204 L258 K322 | C196-V200 WeakPolarHBondContact O-CB 3.24Å; C196-V200 VanDerWaalsContact O-CG2 3.23Å; C196-V200 WeakPolarHBondContact O-CG2 3.23Å; C196-V200 PolarHBondContact O-N 3.31Å; V200-V204 HydrophobicContact CG1-CG2 4.21Å; V200-V204 WeakPolarHBondContact O-CB 2.82Å; V200-V204 WeakPolarHBondContact O-CG2 3.25Å; V200-V204 PolarHBondContact O-N 3.46Å; V200-L258 HydrophobicContact CG1-CB 4.43Å; V200-L258 HydrophobicContact CG1-CD2 4.45Å; V200-L258 HydrophobicContact CG2-CD1 4.03Å; V200-L258 HydrophobicContact CG2-CD2 4.09Å; V200-K322 HydrophobicContact CG1-CD 4.39Å |
| 201 | S | 46.2 | Very low | 41.4 | Very low | 43 Ų | 43 | 62.3 Ų | 62.3 | 30% | 0.301 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -74.7 | -25.3 | 178.5 | -162 | 0 | 0 | 0 | 0 | 113.5 | A197 N198 S205 | A197-S201 VanDerWaalsContact O-CA 3.24Å; A197-S201 WeakPolarHBondContact O-CA 3.46Å; A197-S201 WeakPolarHBondContact O-CB 3.38Å; A197-S201 PolarHBondContact O-N 3.19Å; N198-S201 PolarHBondContact O-N 3.4Å; S201-S205 WeakPolarHBondContact O-CA 3.14Å; S201-S205 WeakPolarHBondContact O-CB 3.48Å; S201-S205 PolarHBondContact O-N 3.44Å; S201-S205 PolarHBondContact O-OG 2.86Å |
| 202 | V | 44.4 | Very low | 41 | Very low | 104 Ų | 104 | 58.4 Ų | 58.4 | 63% | 0.63 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -70.7 | -48.8 | 172.5 | 164.7 | 0 | 0 | 0 | 0 | 109 | N198 V199 V204 S205 A206 | N198-V202 WeakPolarHBondContact O-CA 3.42Å; N198-V202 WeakPolarHBondContact O-CB 3.23Å; N198-V202 WeakPolarHBondContact O-CG2 3.12Å; N198-V202 PolarHBondContact O-N 2.85Å; V199-V202 PolarHBondContact O-N 3.26Å; V202-V204 PolarHBondContact O-N 3.38Å; V202-S205 PolarHBondContact O-N 2.97Å; V202-A206 WeakPolarHBondContact O-CB 3.31Å; V202-A206 PolarHBondContact O-N 2.88Å |
| 203 | A | 39.9 | Very low | 40.6 | Very low | 28 Ų | 28 | 62.4 Ų | 62.4 | 23% | 0.231 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -56.3 | -52.2 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111 | V199 S205 A206 F207 | V199-A203 PolarHBondContact O-N 2.9Å; V199-A203 VanDerWaalsContact O-N 3.16Å; A203-S205 PolarHBondContact O-N 3.25Å; A203-A206 WeakPolarHBondContact O-CB 3.38Å; A203-A206 PolarHBondContact O-N 3.21Å; A203-F207 HydrophobicContact CB-CE2 4.08Å; A203-F207 WeakPolarHBondContact O-CD2 3.26Å; A203-F207 WeakPolarHBondContact O-CE2 3.47Å; A203-F207 WeakPolarHBondContact O-CG 3.23Å; A203-F207 PolarHBondContact O-N 3.17Å |
| 204 | V | 44.5 | Very low | 40.1 | Very low | 7 Ų | 7 | 67 Ų | 67 | 4% | 0.042 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -60.1 | -41.6 | 176.9 | 143.8 | 0 | 0 | 0 | 0 | 114.4 | V200 V202 F207 S208 K262 | V200-V204 HydrophobicContact CG1-CG2 4.21Å; V200-V204 WeakPolarHBondContact O-CB 2.82Å; V200-V204 WeakPolarHBondContact O-CG2 3.25Å; V200-V204 PolarHBondContact O-N 3.46Å; V202-V204 PolarHBondContact O-N 3.38Å; V204-F207 CarbonylContact O-C 3.54Å; V204-F207 PolarHBondContact O-N 2.93Å; V204-S208 WeakPolarHBondContact O-CB 3.38Å; V204-S208 PolarHBondContact O-N 3.42Å; V204-S208 PolarHBondContact O-OG 3.5Å; V204-K262 HydrophobicContact CB-CD 4.47Å; V204-K262 HydrophobicContact CB-CG 4.06Å; V204-K262 HydrophobicContact CG1-CB 4.39Å; V204-K262 HydrophobicContact CG1-CD 3.5Å; V204-K262 HydrophobicContact CG1-CG 3.38Å; V204-K262 HydrophobicContact CG2-CB 3.6Å; V204-K262 HydrophobicContact CG2-CD 4.27Å; V204-K262 HydrophobicContact CG2-CG 3.54Å |
| 205 | S | 43.4 | Very low | 39.6 | Very low | 54 Ų | 54 | 66 Ų | 66 | 38% | 0.378 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -75.5 | -33 | -176.6 | -75.1 | 0 | 0 | 0 | 0 | 110 | S201 V202 A203 F207 S208 S209 | S201-S205 WeakPolarHBondContact O-CA 3.14Å; S201-S205 WeakPolarHBondContact O-CB 3.48Å; S201-S205 PolarHBondContact O-N 3.44Å; S201-S205 PolarHBondContact O-OG 2.86Å; V202-S205 PolarHBondContact O-N 2.97Å; A203-S205 PolarHBondContact O-N 3.25Å; S205-F207 VanDerWaalsContact C-N 3.34Å; S205-S208 PolarHBondContact O-N 3.33Å; S205-S209 WeakPolarHBondContact O-CB 3.43Å; S205-S209 PolarHBondContact O-N 2.89Å; S205-S209 PolarHBondContact O-OG 3.36Å |
| 206 | A | 36.4 | Very low | 39 | Very low | 52 Ų | 52 | 64 Ų | 64 | 43% | 0.43 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -56.3 | -50 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | V202 A203 S208 S209 I210 | V202-A206 WeakPolarHBondContact O-CB 3.31Å; V202-A206 PolarHBondContact O-N 2.88Å; A203-A206 WeakPolarHBondContact O-CB 3.38Å; A203-A206 PolarHBondContact O-N 3.21Å; A206-S208 PolarHBondContact O-N 3.24Å; A206-S209 PolarHBondContact O-N 3.47Å; A206-I210 VanDerWaalsContact O-CD1 3.25Å; A206-I210 WeakPolarHBondContact O-CD1 3.47Å; A206-I210 VanDerWaalsContact O-CG1 3.23Å; A206-I210 WeakPolarHBondContact O-CG1 3.33Å; A206-I210 PolarHBondContact O-N 2.72Å |
| 207 | F | 42.9 | Very low | 38.3 | Very low | 40 Ų | 40 | 68 Ų | 68 | 18% | 0.175 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -65.2 | -33.9 | 178.3 | -55.7 | -38.8 | 0 | 0 | 0 | 114.2 | A203 V204 S205 F259 F389 M398 | A203-F207 HydrophobicContact CB-CE2 4.08Å; A203-F207 WeakPolarHBondContact O-CD2 3.26Å; A203-F207 WeakPolarHBondContact O-CE2 3.47Å; A203-F207 WeakPolarHBondContact O-CG 3.23Å; A203-F207 PolarHBondContact O-N 3.17Å; V204-F207 CarbonylContact O-C 3.54Å; V204-F207 PolarHBondContact O-N 2.93Å; S205-F207 VanDerWaalsContact C-N 3.34Å; F207-F259 HydrophobicContact CD2-CD2 4.3Å; F207-F389 HydrophobicContact CB-CE1 3.93Å; F207-F389 HydrophobicContact CB-CZ 4.13Å; F207-F389 HydrophobicContact CD1-CD1 4.22Å; F207-F389 AromaticContact CD1-CE1 3.33Å; F207-F389 HydrophobicContact CD1-CE1 3.33Å; F207-F389 AromaticContact CD1-CZ 3.87Å; F207-F389 HydrophobicContact CD1-CZ 3.87Å; F207-F389 HydrophobicContact CD2-CE1 4.31Å; F207-F389 HydrophobicContact CD2-CZ 4.02Å; F207-F389 HydrophobicContact CE1-CD1 4.48Å; F207-F389 AromaticContact CE1-CE1 3.85Å; F207-F389 HydrophobicContact CE1-CE1 3.85Å; F207-F389 HydrophobicContact CE1-CZ 4.26Å; F207-F389 HydrophobicContact CE2-CZ 4.41Å; F207-F389 AromaticContact CG-CE1 3.6Å; F207-F389 HydrophobicContact CG-CE1 3.6Å; F207-F389 AromaticContact CG-CZ 3.74Å; F207-F389 HydrophobicContact CG-CZ 3.74Å; F207-M398 HydrophobicContact CE1-CE 3.95Å; F207-M398 HydrophobicContact CE1-SD 4.13Å; F207-M398 HydrophobicContact CZ-CE 3.95Å; F207-M398 HydrophobicContact CZ-SD 3.77Å |
| 208 | S | 38.1 | Very low | 37.5 | Very low | 48 Ų | 48 | 70.9 Ų | 70.9 | 34% | 0.336 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -74.7 | -35.9 | -179.2 | -54.3 | 0 | 0 | 0 | 0 | 112.3 | V204 S205 A206 G211 T212 | V204-S208 WeakPolarHBondContact O-CB 3.38Å; V204-S208 PolarHBondContact O-N 3.42Å; V204-S208 PolarHBondContact O-OG 3.5Å; S205-S208 PolarHBondContact O-N 3.33Å; A206-S208 PolarHBondContact O-N 3.24Å; S208-G211 PolarHBondContact O-N 3.05Å; S208-T212 PolarHBondContact O-OG1 3.33Å |
| 209 | S | 36.7 | Very low | 36.8 | Very low | 67 Ų | 67 | 73.2 Ų | 73.2 | 47% | 0.469 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -68.2 | -38.4 | 176.8 | -61.8 | 0 | 0 | 0 | 0 | 112.4 | S205 A206 G211 T212 | S205-S209 WeakPolarHBondContact O-CB 3.43Å; S205-S209 PolarHBondContact O-N 2.89Å; S205-S209 PolarHBondContact O-OG 3.36Å; A206-S209 PolarHBondContact O-N 3.47Å; S209-G211 PolarHBondContact O-N 2.91Å; S209-T212 PolarHBondContact O-N 2.74Å |
| 210 | I | 36.1 | Very low | 36.1 | Very low | 67 Ų | 67 | 77 Ų | 77 | 34% | 0.344 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.2 | -27.9 | 178 | -64.7 | 161.5 | 0 | 0 | 0 | 111.8 | A206 V392 | A206-I210 VanDerWaalsContact O-CD1 3.25Å; A206-I210 WeakPolarHBondContact O-CD1 3.47Å; A206-I210 VanDerWaalsContact O-CG1 3.23Å; A206-I210 WeakPolarHBondContact O-CG1 3.33Å; A206-I210 PolarHBondContact O-N 2.72Å; I210-V392 HydrophobicContact CD1-CG1 4.13Å; I210-V392 HydrophobicContact CG2-CG2 3.68Å |
| 211 | G | 34.1 | Very low | 35.4 | Very low | 42 Ų | 42 | 82.2 Ų | 82.2 | 43% | 0.433 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | 0.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | S208 S209 | S208-G211 PolarHBondContact O-N 3.05Å; S209-G211 PolarHBondContact O-N 2.91Å |
| 212 | T | 33.6 | Very low | 34.6 | Very low | 85 Ų | 85 | 89.3 Ų | 89.3 | 52% | 0.521 | 56% | 0.555 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -137.7 | -19 | -169.8 | 46.5 | 0 | 0 | 0 | 0 | 117.8 | S208 S209 M275 | S208-T212 PolarHBondContact O-OG1 3.33Å; S209-T212 PolarHBondContact O-N 2.74Å; T212-M275 HydrophobicContact CG2-CE 4.12Å |
| 213 | N | 30.4 | Very low | 34 | Very low | 120 Ų | 120 | 91.6 Ų | 91.6 | 64% | 0.642 | 56% | 0.564 | S | S | * | * | S | Bend | trans | -119.8 | -8.6 | -167.5 | -71.4 | -32.5 | 0 | 0 | 0 | 117.5 | ||
| 214 | D | 31.6 | Very low | 33.4 | Very low | 133 Ų | 133 | 98.4 Ų | 98.4 | 71% | 0.711 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -104.8 | 11.7 | -170.4 | -69.7 | -41.3 | 0 | 0 | 0 | 116.1 | ||
| 215 | I | 31.4 | Very low | 32.5 | Very low | 147 Ų | 147 | 106.6 Ų | 106.6 | 75% | 0.754 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -97.8 | 3 | 178.9 | -54 | -178.5 | 0 | 0 | 0 | 112.1 | ||
| 216 | A | 29.6 | Very low | 31.9 | Very low | 88 Ų | 88 | 111.8 Ų | 111.8 | 73% | 0.727 | 64% | 0.644 | S | S | * | * | S | Bend | trans | -122.9 | 35.9 | -175 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||
| 217 | S | 28.2 | Very low | 31.6 | Very low | 117 Ų | 117 | 114.2 Ų | 114.2 | 82% | 0.818 | 66% | 0.658 | S | S | * | * | trans | -161.4 | 75.6 | 161 | -82.2 | 0 | 0 | 0 | 0 | 111.5 | D219 | S217-D219 PolarHBondContact O-N 2.86Š| ||
| 218 | A | 26.4 | Very low | 31.1 | Very low | 100 Ų | 100 | 117.4 Ų | 117.4 | 83% | 0.826 | 68% | 0.683 | S | S | * | * | trans | -79.5 | 95.9 | 157.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 219 | D | 28.8 | Very low | 30.7 | Very low | 140 Ų | 140 | 121.1 Ų | 121.1 | 75% | 0.749 | 70% | 0.699 | S | S | * | * | trans | -162.2 | 121.3 | 141.2 | -119.3 | -36.6 | 0 | 0 | 0 | 115.2 | S217 | S217-D219 PolarHBondContact O-N 2.86Š| ||
| 220 | T | 29.8 | Very low | 30.4 | Very low | 123 Ų | 123 | 126.6 Ų | 126.6 | 76% | 0.755 | 72% | 0.717 | S | S | * | * | trans | 32 | 99.4 | 133.1 | -48.1 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 221 | S | 31.5 | Very low | 30.2 | Very low | 121 Ų | 121 | 129.8 Ų | 129.8 | 85% | 0.846 | 74% | 0.74 | S | S | * | * | -161 | 134.5 | 125.5 | 6.1 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 222 | K | 28.5 | Very low | 29.9 | Very low | 193 Ų | 193 | 134.9 Ų | 134.9 | 84% | 0.839 | 76% | 0.757 | S | S | * | * | trans | -82.3 | 142.9 | 161.5 | -61.7 | 167.6 | -179.9 | 171.2 | 0 | 108.1 | ||||
| 223 | N | 31.1 | Very low | 29.8 | Very low | 151 Ų | 151 | 139.7 Ų | 139.7 | 81% | 0.807 | 77% | 0.773 | S | S | * | * | trans | 171.8 | 119.6 | 145.6 | -83.2 | -18.1 | 0 | 0 | 0 | 105.9 | ||||
| 224 | Q | 28.4 | Very low | 30 | Very low | 171 Ų | 171 | 142.9 Ų | 142.9 | 80% | 0.799 | 78% | 0.784 | S | S | * | * | cis | 98.4 | 123.6 | 47.5 | -176.4 | 167.1 | 18.7 | 0 | 0 | 111.5 | ||||
| 225 | F | 26 | Very low | 30 | Very low | 179 Ų | 179 | 146.1 Ų | 146.1 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | 70.4 | 149.7 | 177.8 | -124.9 | -136 | 0 | 0 | 0 | 114.4 | ||||
| 226 | E | 30 | Very low | 30 | Very low | 163 Ų | 163 | 145.2 Ų | 145.2 | 76% | 0.762 | 79% | 0.793 | S | S | * | * | cis | -152.8 | 159.5 | 29.9 | -171.1 | 156.3 | -120.7 | 0 | 0 | 111.2 | ||||
| 227 | S | 29.7 | Very low | 30 | Very low | 103 Ų | 103 | 151.5 Ų | 151.5 | 72% | 0.72 | 80% | 0.798 | S | S | * | * | trans | -140.9 | 126.1 | 180 | 161.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 228 | P | 32.8 | Very low | 30.1 | Very low | 107 Ų | 107 | 153.8 Ų | 153.8 | 70% | 0.695 | 80% | 0.801 | S | S | * | * | trans | -128.4 | 114.1 | 162.1 | 21.1 | 0.3 | 0 | 0 | 0 | 114.2 | ||||
| 229 | D | 30.7 | Very low | 30.2 | Very low | 127 Ų | 127 | 153.1 Ų | 153.1 | 68% | 0.679 | 80% | 0.795 | S | S | * | * | 56.2 | 118.4 | 123.9 | -59.3 | -49.7 | 0 | 0 | 0 | 123.9 | |||||
| 230 | Q | 29.4 | Very low | 30.3 | Very low | 182 Ų | 182 | 152.8 Ų | 152.8 | 85% | 0.85 | 79% | 0.794 | S | S | * | * | 49.5 | 90.9 | 129.4 | -55.8 | -162.4 | 34.6 | 0 | 0 | 119.9 | |||||
| 231 | V | 33 | Very low | 30.2 | Very low | 134 Ų | 134 | 155 Ų | 155 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -132.2 | 89.3 | 153 | -174.6 | 0 | 0 | 0 | 0 | 111.3 | E233 | V231-E233 PolarHBondContact O-N 3.04Š| ||
| 232 | N | 27.9 | Very low | 30.3 | Very low | 149 Ų | 149 | 154.5 Ų | 154.5 | 80% | 0.797 | 78% | 0.776 | S | S | * | * | trans | 31.3 | 81.8 | 156.7 | -72.9 | -33.6 | 0 | 0 | 0 | 118.7 | H234 | N232-H234 PolarHBondContact O-N 3.09Š| ||
| 233 | E | 31.3 | Very low | 30.9 | Very low | 185 Ų | 185 | 149.9 Ų | 149.9 | 86% | 0.864 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65 | -1.2 | 177.1 | -71.9 | 179.6 | 104.3 | 0 | 0 | 116.4 | V231 | V231-E233 PolarHBondContact O-N 3.04Š|
| 234 | H | 34.7 | Very low | 32 | Very low | 188 Ų | 188 | 147.4 Ų | 147.4 | 87% | 0.87 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | 13.7 | -163.7 | -96.2 | -79.3 | 0 | 0 | 0 | 117.2 | N232 | N232-H234 PolarHBondContact O-N 3.09Š|
| 235 | K | 30.8 | Very low | 33.5 | Very low | 200 Ų | 200 | 141 Ų | 141 | 87% | 0.87 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -138.1 | 11.2 | -175.1 | -144.5 | 167.8 | -177.9 | 173.5 | 0 | 118.2 | ||
| 236 | V | 32.1 | Very low | 35.4 | Very low | 129 Ų | 129 | 133.8 Ų | 133.8 | 78% | 0.782 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -116.5 | 11.7 | -173.2 | -164.8 | 0 | 0 | 0 | 0 | 113.3 | ||
| 237 | R | 29.9 | Very low | 37.3 | Very low | 219 Ų | 219 | 130.6 Ų | 130.6 | 83% | 0.826 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -91.7 | -14.6 | -169.9 | -66.1 | -174.9 | 72.5 | 174.1 | 1.9 | 116.5 | ||
| 238 | D | 30.1 | Very low | 39.6 | Very low | 165 Ų | 165 | 126.5 Ų | 126.5 | 88% | 0.882 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -115.4 | 9.4 | -162.1 | -59.2 | -42.2 | 0 | 0 | 0 | 116.1 | ||
| 239 | A | 28.2 | Very low | 42 | Very low | 86 Ų | 86 | 122.9 Ų | 122.9 | 71% | 0.711 | 62% | 0.62 | S | S | * | * | S | Bend | trans | -138.2 | 141.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | W241 | A239-W241 PolarHBondContact O-N 3.31Š|
| 240 | D | 29.8 | Very low | 44.4 | Very low | 134 Ų | 134 | 117.5 Ų | 117.5 | 72% | 0.717 | 59% | 0.591 | S | S | * | * | S | Bend | trans | 66.6 | 5.5 | 169.6 | -96.6 | -12.8 | 0 | 0 | 0 | 122 | N242 | D240-N242 PolarHBondContact O-N 3.39Š|
| 241 | W | 28.7 | Very low | 47 | Very low | 168 Ų | 168 | 109.5 Ų | 109.5 | 64% | 0.636 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | 12.1 | 172 | -157.2 | -100.7 | 0 | 0 | 0 | 115.5 | A239 K407 | A239-W241 PolarHBondContact O-N 3.31Å; W241-K407 HydrophobicContact CH2-CG 4.34Å; W241-K407 HydrophobicContact CZ2-CG 4.21Å |
| 242 | N | 33.8 | Very low | 49.4 | Very low | 112 Ų | 112 | 105.8 Ų | 105.8 | 60% | 0.599 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104 | -10.1 | -164.1 | -86.9 | -53.8 | 0 | 0 | 0 | 116.2 | D240 K335 | D240-N242 PolarHBondContact O-N 3.39Å; N242-K335 PolarHBondContact O-NZ 3.18Å; N242-K335 PolarHBondContact OD1-NZ 3.21Å |
| 243 | V | 40 | Very low | 52.2 | Low | 95 Ų | 95 | 103 Ų | 103 | 58% | 0.576 | 51% | 0.511 | S | S | * | . | S | Bend | trans | -91.8 | -37.4 | -179.3 | -176.3 | 0 | 0 | 0 | 0 | 112.6 | P245 | V243-P245 VanDerWaalsContact C-CD 3.44Š|
| 244 | F | 53.8 | Low | 54.9 | Low | 100 Ų | 100 | 94.2 Ų | 94.2 | 44% | 0.439 | 47% | 0.47 | S | S | . | . | S | Bend | trans | -64.5 | -34.3 | -175.4 | -61.5 | -78.3 | 0 | 0 | 0 | 117.5 | S246 Q247 I248 | F244-S246 VanDerWaalsContact C-N 3.31Å; F244-S246 PolarHBondContact O-N 3.46Å; F244-S246 VanDerWaalsContact O-N 3.17Å; F244-Q247 PolarHBondContact O-N 2.95Å; F244-I248 PolarHBondContact O-N 3.14Å |
| 245 | P | 61.2 | Low | 57.4 | Low | 37 Ų | 37 | 86 Ų | 86 | 24% | 0.24 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -55.5 | -41.7 | -171 | -29.7 | 36.1 | 0 | 0 | 0 | 114.3 | V243 Q247 I248 I249 | V243-P245 VanDerWaalsContact C-CD 3.44Å; P245-Q247 VanDerWaalsContact C-N 3.3Å; P245-Q247 PolarHBondContact O-N 2.83Å; P245-I248 PolarHBondContact O-N 3.2Å; P245-I249 WeakPolarHBondContact O-CB 3.5Å; P245-I249 WeakPolarHBondContact O-CD1 3.31Å; P245-I249 VanDerWaalsContact O-CG1 3.23Å; P245-I249 WeakPolarHBondContact O-CG1 3.48Å; P245-I249 PolarHBondContact O-N 2.79Å |
| 246 | S | 64.7 | Low | 60.2 | Low | 26 Ų | 26 | 77.2 Ų | 77.2 | 18% | 0.182 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.3 | -32.2 | -179.5 | -55.6 | 0 | 0 | 0 | 0 | 113.1 | F244 L250 | F244-S246 VanDerWaalsContact C-N 3.31Å; F244-S246 PolarHBondContact O-N 3.46Å; F244-S246 VanDerWaalsContact O-N 3.17Å; S246-L250 VanDerWaalsContact O-CG 3.26Å; S246-L250 WeakPolarHBondContact O-CG 3.2Å; S246-L250 PolarHBondContact O-N 3.06Å |
| 247 | Q | 70.5 | Confident | 63 | Low | 97 Ų | 97 | 71.1 Ų | 71.1 | 45% | 0.453 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -73.2 | -43.2 | -179.9 | -67.8 | -179.3 | -13.7 | 0 | 0 | 111.4 | F244 P245 L250 L251 | F244-Q247 PolarHBondContact O-N 2.95Å; P245-Q247 VanDerWaalsContact C-N 3.3Å; P245-Q247 PolarHBondContact O-N 2.83Å; Q247-L250 PolarHBondContact O-N 3.4Å; Q247-L251 WeakPolarHBondContact O-CG 3.26Å; Q247-L251 PolarHBondContact O-N 3.32Å; Q247-L251 VanDerWaalsContact O-N 3.13Å |
| 248 | I | 77.6 | Confident | 65.7 | Low | 17 Ų | 17 | 61 Ų | 61 | 9% | 0.087 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.2 | -47.2 | 177.2 | -60.3 | 175.4 | 0 | 0 | 0 | 109.8 | F244 P245 L250 L251 E252 Y406 | F244-I248 PolarHBondContact O-N 3.14Å; P245-I248 PolarHBondContact O-N 3.2Å; I248-L250 PolarHBondContact O-N 3.48Å; I248-L251 PolarHBondContact O-N 3.45Å; I248-L251 VanDerWaalsContact O-N 3.09Å; I248-E252 HydrophobicContact CG2-CG 4.04Å; I248-E252 WeakPolarHBondContact CG2-OE1 3.34Å; I248-E252 WeakPolarHBondContact O-CG 3.33Å; I248-E252 PolarHBondContact O-N 3.33Å; I248-Y406 HydrophobicContact CG1-CD1 4.41Å; I248-Y406 HydrophobicContact CG1-CG 4.1Å |
| 249 | I | 83.4 | Confident | 68.3 | Low | 30 Ų | 30 | 54.4 Ų | 54.4 | 15% | 0.154 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -54.6 | -47.5 | 176.6 | -71.8 | 164 | 0 | 0 | 0 | 111.8 | P245 L251 E252 E253 A331 R332 L334 | P245-I249 WeakPolarHBondContact O-CB 3.5Å; P245-I249 WeakPolarHBondContact O-CD1 3.31Å; P245-I249 VanDerWaalsContact O-CG1 3.23Å; P245-I249 WeakPolarHBondContact O-CG1 3.48Å; P245-I249 PolarHBondContact O-N 2.79Å; I249-L251 VanDerWaalsContact C-N 3.3Å; I249-L251 PolarHBondContact O-N 2.94Å; I249-E252 PolarHBondContact O-N 2.76Å; I249-E253 WeakPolarHBondContact O-CB 3.17Å; I249-E253 VanDerWaalsContact O-CG 3.31Å; I249-E253 WeakPolarHBondContact O-CG 3.38Å; I249-E253 PolarHBondContact O-N 3.5Å; I249-A331 HydrophobicContact CG2-CB 3.87Å; I249-R332 WeakPolarHBondContact CG2-O 3.35Å; I249-L334 HydrophobicContact CG2-CD2 4.18Å; I249-L334 HydrophobicContact CG2-CG 4.46Å |
| 250 | L | 82 | Confident | 71.2 | Confident | 14 Ų | 14 | 50.3 Ų | 50.3 | 7% | 0.073 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.2 | -33.9 | 179.8 | -67.8 | 173.1 | 0 | 0 | 0 | 112.3 | S246 Q247 I248 S254 L326 F327 R328 A331 L334 V340 | S246-L250 VanDerWaalsContact O-CG 3.26Å; S246-L250 WeakPolarHBondContact O-CG 3.2Å; S246-L250 PolarHBondContact O-N 3.06Å; Q247-L250 PolarHBondContact O-N 3.4Å; I248-L250 PolarHBondContact O-N 3.48Å; L250-S254 WeakPolarHBondContact O-CB 3.21Å; L250-S254 PolarHBondContact O-N 3.03Å; L250-S254 PolarHBondContact O-OG 3.47Å; L250-L326 HydrophobicContact CB-CD1 3.86Å; L250-L326 WeakPolarHBondContact CD2-O 3.41Å; L250-F327 HydrophobicContact CD1-CD1 4.47Å; L250-R328 HydrophobicContact CD2-CB 4.37Å; L250-A331 HydrophobicContact CD2-CB 4.12Å; L250-L334 HydrophobicContact CD1-CD2 4.48Å; L250-L334 HydrophobicContact CD2-CD1 4.19Å; L250-L334 HydrophobicContact CD2-CD2 4.02Å; L250-L334 HydrophobicContact CG-CD2 4.01Å; L250-V340 HydrophobicContact CD1-CG1 4.24Å; L250-V340 HydrophobicContact CD1-CG2 4.15Å; L250-V340 HydrophobicContact CD2-CG1 4.03Å |
| 251 | L | 83.1 | Confident | 74 | Confident | 14 Ų | 14 | 44 Ų | 44 | 7% | 0.073 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -73.2 | -47.1 | 176.1 | -70.9 | 168.2 | 0 | 0 | 0 | 111.8 | V199 Q247 I248 I249 E253 S254 W255 L258 L326 Y406 | V199-L251 HydrophobicContact CG1-CD1 3.94Å; V199-L251 HydrophobicContact CG1-CD2 3.79Å; V199-L251 HydrophobicContact CG1-CG 4.44Å; Q247-L251 WeakPolarHBondContact O-CG 3.26Å; Q247-L251 PolarHBondContact O-N 3.32Å; Q247-L251 VanDerWaalsContact O-N 3.13Å; I248-L251 PolarHBondContact O-N 3.45Å; I248-L251 VanDerWaalsContact O-N 3.09Å; I249-L251 VanDerWaalsContact C-N 3.3Å; I249-L251 PolarHBondContact O-N 2.94Å; L251-E253 VanDerWaalsContact C-N 3.25Å; L251-E253 PolarHBondContact O-N 3.15Å; L251-S254 PolarHBondContact O-N 3.4Å; L251-S254 VanDerWaalsContact O-N 3.1Å; L251-W255 WeakPolarHBondContact O-CB 3.44Å; L251-W255 PolarHBondContact O-N 3.39Å; L251-L258 HydrophobicContact CD2-CD1 4.26Å; L251-L326 HydrophobicContact CD2-CD1 3.96Å; L251-L326 HydrophobicContact CG-CD1 4.37Å; L251-Y406 HydrophobicContact CD1-CD2 4.28Å; L251-Y406 HydrophobicContact CD1-CE1 4.17Å; L251-Y406 HydrophobicContact CD1-CE2 3.55Å; L251-Y406 VanDerWaalsContact CD1-CZ 3.5Å |
| 252 | E | 83.8 | Confident | 76.5 | Confident | 56 Ų | 56 | 38 Ų | 38 | 26% | 0.262 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -56.6 | -39.2 | 175.8 | -71.3 | 174.6 | 164.5 | 0 | 0 | 111.2 | I248 I249 S254 E399 C403 | I248-E252 HydrophobicContact CG2-CG 4.04Å; I248-E252 WeakPolarHBondContact CG2-OE1 3.34Å; I248-E252 WeakPolarHBondContact O-CG 3.33Å; I248-E252 PolarHBondContact O-N 3.33Å; I249-E252 PolarHBondContact O-N 2.76Å; E252-S254 PolarHBondContact O-N 2.73Å; E252-E399 HydrophobicContact CB-CB 4.45Å; E252-E399 HydrophobicContact CB-CG 4.22Å; E252-E399 HydrophobicContact CG-CB 4.05Å; E252-E399 HydrophobicContact CG-CG 4.36Å; E252-C403 PolarHBondContact OE1-SG 2.8Å |
| 253 | E | 86.9 | Confident | 78.6 | Confident | 92 Ų | 92 | 33.2 Ų | 33.2 | 43% | 0.43 | 17% | 0.167 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | -1.8 | 178.7 | -70.2 | -81.7 | 169.4 | 0 | 0 | 115.2 | I249 L251 R328 A331 | I249-E253 WeakPolarHBondContact O-CB 3.17Å; I249-E253 VanDerWaalsContact O-CG 3.31Å; I249-E253 WeakPolarHBondContact O-CG 3.38Å; I249-E253 PolarHBondContact O-N 3.5Å; L251-E253 VanDerWaalsContact C-N 3.25Å; L251-E253 PolarHBondContact O-N 3.15Å; E253-R328 VanDerWaalsContact O-CZ 3.32Å; E253-R328 PolarHBondContact O-NH1 2.85Å; E253-A331 HydrophobicContact CG-CB 4.25Å |
| 254 | S | 88.3 | Confident | 80.8 | Confident | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 14% | 0.14 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -144.8 | 0.3 | -175.2 | 70.8 | 0 | 0 | 0 | 0 | 116.9 | L250 L251 E252 N256 D257 L258 A325 | L250-S254 WeakPolarHBondContact O-CB 3.21Å; L250-S254 PolarHBondContact O-N 3.03Å; L250-S254 PolarHBondContact O-OG 3.47Å; L251-S254 PolarHBondContact O-N 3.4Å; L251-S254 VanDerWaalsContact O-N 3.1Å; E252-S254 PolarHBondContact O-N 2.73Å; S254-N256 VanDerWaalsContact C-N 3.26Å; S254-N256 PolarHBondContact O-N 2.84Å; S254-D257 PolarHBondContact O-N 2.7Å; S254-D257 VanDerWaalsContact O-N 3.16Å; S254-L258 VanDerWaalsContact O-CG 3.29Å; S254-L258 WeakPolarHBondContact O-CG 3.22Å; S254-L258 PolarHBondContact O-N 2.72Å; S254-L258 VanDerWaalsContact OG-CD1 3.3Å; S254-L258 WeakPolarHBondContact OG-CD1 3.31Å; S254-A325 WeakPolarHBondContact CB-O 3.2Å |
| 255 | W | 86.4 | Confident | 82.2 | Confident | 14 Ų | 14 | 25 Ų | 25 | 5% | 0.053 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -58 | -36.8 | -174.3 | 74.7 | -96 | 0 | 0 | 0 | 113.3 | L251 L258 F259 P381 I384 E385 F389 M398 E399 L402 | L251-W255 WeakPolarHBondContact O-CB 3.44Å; L251-W255 PolarHBondContact O-N 3.39Å; W255-L258 PolarHBondContact O-N 2.67Å; W255-F259 VanDerWaalsContact O-CB 3.28Å; W255-F259 WeakPolarHBondContact O-CB 3.49Å; W255-F259 PolarHBondContact O-N 3.49Å; W255-P381 HydrophobicContact CH2-CB 4.31Å; W255-P381 HydrophobicContact CZ2-CB 3.44Å; W255-P381 VanDerWaalsContact CZ2-CB 3.44Å; W255-I384 HydrophobicContact CH2-CB 4.09Å; W255-I384 HydrophobicContact CH2-CG2 3.88Å; W255-I384 HydrophobicContact CZ3-CB 4.3Å; W255-I384 HydrophobicContact CZ3-CG2 3.64Å; W255-E385 HydrophobicContact CH2-CB 4.44Å; W255-F389 HydrophobicContact CZ3-CD2 4.32Å; W255-F389 HydrophobicContact CZ3-CE2 4.01Å; W255-M398 HydrophobicContact CD2-CB 4.19Å; W255-M398 HydrophobicContact CD2-CG 3.57Å; W255-M398 HydrophobicContact CE3-CB 4.5Å; W255-M398 HydrophobicContact CE3-CG 3.72Å; W255-M398 HydrophobicContact CG-CG 4.17Å; W255-M398 HydrophobicContact CH2-CB 3.88Å; W255-M398 HydrophobicContact CH2-CG 3.95Å; W255-M398 HydrophobicContact CZ2-CB 3.49Å; W255-M398 VanDerWaalsContact CZ2-CB 3.49Å; W255-M398 HydrophobicContact CZ2-CG 3.8Å; W255-M398 HydrophobicContact CZ3-CB 4.37Å; W255-M398 HydrophobicContact CZ3-CE 4.33Å; W255-M398 HydrophobicContact CZ3-CG 3.91Å; W255-E399 PolarHBondContact NE1-OE1 2.97Å; W255-L402 HydrophobicContact CB-CD1 3.63Å; W255-L402 HydrophobicContact CG-CD1 3.88Å |
| 256 | N | 90.1 | Very high | 82.6 | Confident | 16 Ų | 16 | 26.1 Ų | 26.1 | 9% | 0.086 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.2 | -47 | 179.5 | 72.4 | -53.9 | 0 | 0 | 0 | 110.6 | S254 L258 F259 L260 V379 P381 | S254-N256 VanDerWaalsContact C-N 3.26Å; S254-N256 PolarHBondContact O-N 2.84Å; N256-L258 VanDerWaalsContact C-N 3.34Å; N256-L258 PolarHBondContact O-N 3.15Å; N256-F259 PolarHBondContact O-N 3.42Å; N256-L260 WeakPolarHBondContact O-CB 3.4Å; N256-L260 WeakPolarHBondContact O-CG 3Å; N256-L260 PolarHBondContact O-N 2.89Å; N256-V379 PolarHBondContact ND2-O 3.03Å; N256-P381 HydrophobicContact CB-CB 4.28Å |
| 257 | D | 91.8 | Very high | 82.9 | Confident | 2 Ų | 2 | 24.9 Ų | 24.9 | 1% | 0.011 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -67.2 | -38.3 | 179.5 | -67.6 | -13.5 | 0 | 0 | 0 | 110.3 | S254 L261 A325 R328 L376 R377 | S254-D257 PolarHBondContact O-N 2.7Å; S254-D257 VanDerWaalsContact O-N 3.16Å; D257-L261 VanDerWaalsContact O-CB 3.3Å; D257-L261 WeakPolarHBondContact O-CB 3.4Å; D257-L261 VanDerWaalsContact O-CG 3.23Å; D257-L261 WeakPolarHBondContact O-CG 3.09Å; D257-L261 PolarHBondContact O-N 3.11Å; D257-A325 HydrophobicContact CB-CB 4.33Å; D257-R328 IonicContact OD2-CZ 2.65Å; D257-R328 IonicContact OD2-NH1 2.74Å; D257-R328 IonicContact OD2-NH2 3.98Å; D257-R328 PolarHBondContact OD2-NH2 2.95Å; D257-L376 HydrophobicContact CB-CB 4.29Å; D257-L376 HydrophobicContact CB-CD1 4.16Å; D257-L376 WeakPolarHBondContact OD1-CB 3.28Å; D257-R377 IonicContact OD2-NE 3.71Å |
| 258 | L | 86.3 | Confident | 82.8 | Confident | 7 Ų | 7 | 22.4 Ų | 22.4 | 4% | 0.037 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -68 | -40.1 | 176.4 | -68.4 | 168.5 | 0 | 0 | 0 | 112.6 | V200 L251 S254 W255 N256 K262 K322 L326 | V200-L258 HydrophobicContact CG1-CB 4.43Å; V200-L258 HydrophobicContact CG1-CD2 4.45Å; V200-L258 HydrophobicContact CG2-CD1 4.03Å; V200-L258 HydrophobicContact CG2-CD2 4.09Å; L251-L258 HydrophobicContact CD2-CD1 4.26Å; S254-L258 VanDerWaalsContact O-CG 3.29Å; S254-L258 WeakPolarHBondContact O-CG 3.22Å; S254-L258 PolarHBondContact O-N 2.72Å; S254-L258 VanDerWaalsContact OG-CD1 3.3Å; S254-L258 WeakPolarHBondContact OG-CD1 3.31Å; W255-L258 PolarHBondContact O-N 2.67Å; N256-L258 VanDerWaalsContact C-N 3.34Å; N256-L258 PolarHBondContact O-N 3.15Å; L258-K262 PolarHBondContact O-N 2.99Å; L258-K322 HydrophobicContact CD2-CB 3.76Å; L258-K322 HydrophobicContact CD2-CG 3.98Å; L258-K322 WeakPolarHBondContact CD2-O 3.34Å; L258-L326 HydrophobicContact CD1-CB 4.44Å; L258-L326 HydrophobicContact CD1-CD1 4.13Å; L258-L326 HydrophobicContact CD2-CB 4.41Å |
| 259 | F | 84.6 | Confident | 81.8 | Confident | 26 Ų | 26 | 26.7 Ų | 26.7 | 11% | 0.114 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -62.2 | -50.9 | 173 | 173.3 | -98.7 | 0 | 0 | 0 | 110.7 | F207 W255 N256 L261 K262 M263 I384 F388 F389 | F207-F259 HydrophobicContact CD2-CD2 4.3Å; W255-F259 VanDerWaalsContact O-CB 3.28Å; W255-F259 WeakPolarHBondContact O-CB 3.49Å; W255-F259 PolarHBondContact O-N 3.49Å; N256-F259 PolarHBondContact O-N 3.42Å; F259-L261 PolarHBondContact O-N 3.29Å; F259-K262 PolarHBondContact O-N 3.11Å; F259-M263 HydrophobicContact CE1-CE 4.43Å; F259-M263 HydrophobicContact CE1-SD 4.24Å; F259-M263 HydrophobicContact CZ-SD 4.45Å; F259-M263 WeakPolarHBondContact O-CB 3.5Å; F259-M263 PolarHBondContact O-N 3.05Å; F259-I384 HydrophobicContact CD1-CG2 3.52Å; F259-I384 HydrophobicContact CE1-CG2 3.69Å; F259-I384 HydrophobicContact CG-CG2 4.33Å; F259-F388 AromaticContact CE1-CD2 3.74Å; F259-F388 HydrophobicContact CE1-CD2 3.74Å; F259-F388 HydrophobicContact CE1-CE2 4Å; F259-F388 HydrophobicContact CE1-CG 4.02Å; F259-F388 HydrophobicContact CE1-CZ 4.49Å; F259-F388 HydrophobicContact CZ-CB 4.1Å; F259-F388 HydrophobicContact CZ-CD1 4.04Å; F259-F388 HydrophobicContact CZ-CD2 4.01Å; F259-F388 HydrophobicContact CZ-CE1 4.49Å; F259-F388 HydrophobicContact CZ-CE2 4.46Å; F259-F388 AromaticContact CZ-CG 3.78Å; F259-F388 HydrophobicContact CZ-CG 3.78Å; F259-F389 HydrophobicContact CD2-CE2 4.05Å; F259-F389 AromaticContact CD2-CZ 3.71Å; F259-F389 HydrophobicContact CD2-CZ 3.71Å; F259-F389 HydrophobicContact CE1-CE2 4.41Å; F259-F389 HydrophobicContact CE2-CE1 4.49Å; F259-F389 AromaticContact CE2-CE2 3.91Å; F259-F389 HydrophobicContact CE2-CE2 3.91Å; F259-F389 AromaticContact CE2-CZ 3.45Å; F259-F389 HydrophobicContact CE2-CZ 3.45Å; F259-F389 VanDerWaalsContact CE2-CZ 3.45Å; F259-F389 HydrophobicContact CG-CE2 4.37Å; F259-F389 HydrophobicContact CG-CZ 4.46Å; F259-F389 HydrophobicContact CZ-CE2 4.09Å; F259-F389 HydrophobicContact CZ-CZ 4.01Å |
| 260 | L | 89.2 | Confident | 80.2 | Confident | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -59.3 | -48.1 | 177.2 | -72.7 | 179.5 | 0 | 0 | 0 | 112 | N256 K262 M263 Y264 L301 L376 V379 I384 | N256-L260 WeakPolarHBondContact O-CB 3.4Å; N256-L260 WeakPolarHBondContact O-CG 3Å; N256-L260 PolarHBondContact O-N 2.89Å; L260-K262 PolarHBondContact O-N 3.32Å; L260-M263 HydrophobicContact CD2-CE 3.41Å; L260-M263 VanDerWaalsContact CD2-CE 3.41Å; L260-M263 PolarHBondContact O-N 2.78Å; L260-M263 VanDerWaalsContact O-N 3.14Å; L260-Y264 HydrophobicContact CB-CE2 4.04Å; L260-Y264 VanDerWaalsContact O-CD2 3.26Å; L260-Y264 WeakPolarHBondContact O-CD2 3.42Å; L260-Y264 VanDerWaalsContact O-CG 3.26Å; L260-Y264 PolarHBondContact O-N 3.18Å; L260-L301 HydrophobicContact CD2-CD2 3.85Å; L260-L376 HydrophobicContact CB-CD2 3.92Å; L260-L376 HydrophobicContact CD1-CB 4.36Å; L260-L376 HydrophobicContact CD1-CD2 4.1Å; L260-V379 HydrophobicContact CD1-CB 4.06Å; L260-V379 HydrophobicContact CD1-CG2 4.17Å; L260-I384 HydrophobicContact CD2-CD1 3.73Å; L260-I384 HydrophobicContact CG-CD1 4.31Å |
| 261 | L | 88.1 | Confident | 78.4 | Confident | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -58.6 | -36.4 | 176.6 | -78.8 | 167 | 0 | 0 | 0 | 112.3 | D257 F259 Q265 F308 F318 L321 K322 A325 L373 L376 | D257-L261 VanDerWaalsContact O-CB 3.3Å; D257-L261 WeakPolarHBondContact O-CB 3.4Å; D257-L261 VanDerWaalsContact O-CG 3.23Å; D257-L261 WeakPolarHBondContact O-CG 3.09Å; D257-L261 PolarHBondContact O-N 3.11Å; F259-L261 PolarHBondContact O-N 3.29Å; L261-Q265 VanDerWaalsContact O-CB 3.26Å; L261-Q265 WeakPolarHBondContact O-CB 3.28Å; L261-Q265 PolarHBondContact O-N 2.97Å; L261-Q265 VanDerWaalsContact O-N 3.09Å; L261-F308 HydrophobicContact CD2-CE1 3.65Å; L261-F308 HydrophobicContact CD2-CZ 3.89Å; L261-F318 HydrophobicContact CD2-CD1 4.13Å; L261-F318 HydrophobicContact CD2-CE1 4.28Å; L261-F318 WeakPolarHBondContact O-CD1 3.2Å; L261-F318 WeakPolarHBondContact O-CE1 3.36Å; L261-L321 HydrophobicContact CD1-CB 4.39Å; L261-L321 HydrophobicContact CD2-CB 4.09Å; L261-L321 HydrophobicContact CD2-CD1 4.45Å; L261-K322 HydrophobicContact CB-CD 4.47Å; L261-K322 HydrophobicContact CB-CG 3.81Å; L261-K322 HydrophobicContact CD1-CB 4.43Å; L261-K322 HydrophobicContact CD1-CG 3.75Å; L261-K322 HydrophobicContact CG-CG 4.38Å; L261-A325 HydrophobicContact CD1-CB 3.98Å; L261-L373 HydrophobicContact CD1-CD2 4.24Å; L261-L376 HydrophobicContact CD1-CD1 3.9Å; L261-L376 HydrophobicContact CD2-CD1 3.89Å; L261-L376 HydrophobicContact CG-CD1 3.57Å |
| 262 | K | 80.5 | Confident | 76.6 | Confident | 44 Ų | 44 | 40.6 Ų | 40.6 | 19% | 0.191 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -71.7 | -46.9 | 173 | 174.9 | 70.4 | -177.8 | -150.6 | 0 | 112 | V204 L258 F259 L260 Y264 Q265 S266 | V204-K262 HydrophobicContact CB-CD 4.47Å; V204-K262 HydrophobicContact CB-CG 4.06Å; V204-K262 HydrophobicContact CG1-CB 4.39Å; V204-K262 HydrophobicContact CG1-CD 3.5Å; V204-K262 HydrophobicContact CG1-CG 3.38Å; V204-K262 HydrophobicContact CG2-CB 3.6Å; V204-K262 HydrophobicContact CG2-CD 4.27Å; V204-K262 HydrophobicContact CG2-CG 3.54Å; L258-K262 PolarHBondContact O-N 2.99Å; F259-K262 PolarHBondContact O-N 3.11Å; L260-K262 PolarHBondContact O-N 3.32Å; K262-Y264 VanDerWaalsContact C-N 3.26Å; K262-Y264 PolarHBondContact O-N 3.34Å; K262-Q265 CarbonylContact O-C 3.6Å; K262-Q265 WeakPolarHBondContact O-CB 3.39Å; K262-Q265 PolarHBondContact O-N 3.46Å; K262-S266 WeakPolarHBondContact CE-OG 3.34Å; K262-S266 PolarHBondContact O-N 2.95Å; K262-S266 PolarHBondContact O-OG 3.4Å |
| 263 | M | 79.1 | Confident | 75 | Confident | 11 Ų | 11 | 39.2 Ų | 39.2 | 5% | 0.054 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -55.6 | -46.9 | -179.1 | -179.2 | 175.6 | 58.5 | 0 | 0 | 109.9 | F259 L260 S266 S267 L276 L301 F388 | F259-M263 HydrophobicContact CE1-CE 4.43Å; F259-M263 HydrophobicContact CE1-SD 4.24Å; F259-M263 HydrophobicContact CZ-SD 4.45Å; F259-M263 WeakPolarHBondContact O-CB 3.5Å; F259-M263 PolarHBondContact O-N 3.05Å; L260-M263 HydrophobicContact CD2-CE 3.41Å; L260-M263 VanDerWaalsContact CD2-CE 3.41Å; L260-M263 PolarHBondContact O-N 2.78Å; L260-M263 VanDerWaalsContact O-N 3.14Å; M263-S266 PolarHBondContact O-N 2.96Å; M263-S267 PolarHBondContact O-N 2.95Å; M263-S267 VanDerWaalsContact O-N 3.16Å; M263-S267 PolarHBondContact O-OG 3.36Å; M263-L276 HydrophobicContact CE-CD1 4Å; M263-L276 HydrophobicContact CE-CD2 4.18Å; M263-L276 HydrophobicContact CE-CG 4.46Å; M263-L276 HydrophobicContact CG-CD1 4.08Å; M263-L276 HydrophobicContact CG-CG 4.24Å; M263-L276 HydrophobicContact SD-CD1 4.03Å; M263-L276 HydrophobicContact SD-CD2 3.78Å; M263-L276 HydrophobicContact SD-CG 3.94Å; M263-L301 HydrophobicContact CE-CD1 4.45Å; M263-F388 HydrophobicContact CE-CZ 4.29Å; M263-F388 HydrophobicContact SD-CE1 3.98Å; M263-F388 HydrophobicContact SD-CE2 4.38Å; M263-F388 HydrophobicContact SD-CZ 3.65Å |
| 264 | Y | 86.7 | Confident | 73.3 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -66.2 | -36.7 | 175.3 | -56 | -31.3 | 0 | 0 | 0 | 113.1 | L260 K262 S267 M268 L276 L304 L305 F308 L376 | L260-Y264 HydrophobicContact CB-CE2 4.04Å; L260-Y264 VanDerWaalsContact O-CD2 3.26Å; L260-Y264 WeakPolarHBondContact O-CD2 3.42Å; L260-Y264 VanDerWaalsContact O-CG 3.26Å; L260-Y264 PolarHBondContact O-N 3.18Å; K262-Y264 VanDerWaalsContact C-N 3.26Å; K262-Y264 PolarHBondContact O-N 3.34Å; Y264-S267 WeakPolarHBondContact O-CB 3.29Å; Y264-S267 PolarHBondContact O-N 3.38Å; Y264-M268 WeakPolarHBondContact O-CG 3.42Å; Y264-L276 HydrophobicContact CD1-CD1 3.92Å; Y264-L276 HydrophobicContact CE1-CD1 3.81Å; Y264-L304 HydrophobicContact CE2-CB 4.27Å; Y264-L304 VanDerWaalsContact OH-CB 3.31Å; Y264-L304 WeakPolarHBondContact OH-CB 3.38Å; Y264-L305 HydrophobicContact CD1-CB 3.87Å; Y264-L305 HydrophobicContact CD1-CD1 3.85Å; Y264-L305 HydrophobicContact CD1-CG 4.44Å; Y264-L305 HydrophobicContact CE1-CB 3.95Å; Y264-L305 HydrophobicContact CG-CD1 4.32Å; Y264-F308 HydrophobicContact CD2-CD1 4.4Å; Y264-F308 AromaticContact CD2-CD2 3.6Å; Y264-F308 HydrophobicContact CD2-CD2 3.6Å; Y264-F308 HydrophobicContact CD2-CE1 4.42Å; Y264-F308 AromaticContact CD2-CE2 3.62Å; Y264-F308 HydrophobicContact CD2-CE2 3.62Å; Y264-F308 HydrophobicContact CD2-CG 4.02Å; Y264-F308 HydrophobicContact CD2-CZ 4.05Å; Y264-F308 AromaticContact CE2-CD2 3.99Å; Y264-F308 HydrophobicContact CE2-CD2 3.99Å; Y264-F308 AromaticContact CE2-CE2 3.81Å; Y264-F308 HydrophobicContact CE2-CE2 3.81Å; Y264-F308 HydrophobicContact CE2-CZ 4.49Å; Y264-F308 HydrophobicContact CG-CD2 4.33Å; Y264-F308 HydrophobicContact CG-CG 4.43Å; Y264-L376 HydrophobicContact CD2-CD2 4.3Å; Y264-L376 HydrophobicContact CE2-CD2 3.71Å |
| 265 | Q | 82.1 | Confident | 71.6 | Confident | 23 Ų | 23 | 40.7 Ų | 40.7 | 11% | 0.107 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63 | -44.4 | 173.1 | -178 | -174.1 | 26.1 | 0 | 0 | 112.2 | L261 K262 S267 M268 Q315 F318 | L261-Q265 VanDerWaalsContact O-CB 3.26Å; L261-Q265 WeakPolarHBondContact O-CB 3.28Å; L261-Q265 PolarHBondContact O-N 2.97Å; L261-Q265 VanDerWaalsContact O-N 3.09Å; K262-Q265 CarbonylContact O-C 3.6Å; K262-Q265 WeakPolarHBondContact O-CB 3.39Å; K262-Q265 PolarHBondContact O-N 3.46Å; Q265-S267 PolarHBondContact O-N 3.01Å; Q265-M268 PolarHBondContact O-N 3.45Å; Q265-M268 VanDerWaalsContact O-N 3.11Å; Q265-Q315 VanDerWaalsContact NE2-CD 3.26Å; Q265-F318 HydrophobicContact CB-CB 4.46Å; Q265-F318 HydrophobicContact CB-CD1 3.88Å; Q265-F318 HydrophobicContact CB-CD2 3.9Å; Q265-F318 HydrophobicContact CB-CE1 4Å; Q265-F318 HydrophobicContact CB-CE2 4.03Å; Q265-F318 HydrophobicContact CB-CG 3.83Å; Q265-F318 HydrophobicContact CB-CZ 4.08Å; Q265-F318 HydrophobicContact CG-CB 4.22Å; Q265-F318 HydrophobicContact CG-CD2 3.85Å; Q265-F318 HydrophobicContact CG-CE2 4.32Å; Q265-F318 HydrophobicContact CG-CG 3.96Å |
| 266 | S | 70.2 | Confident | 70.3 | Confident | 59 Ų | 59 | 40.3 Ų | 40.3 | 41% | 0.413 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -65 | -17 | 175.2 | -63.9 | 0 | 0 | 0 | 0 | 113 | K262 M263 M268 | K262-S266 WeakPolarHBondContact CE-OG 3.34Å; K262-S266 PolarHBondContact O-N 2.95Å; K262-S266 PolarHBondContact O-OG 3.4Å; M263-S266 PolarHBondContact O-N 2.96Å; S266-M268 VanDerWaalsContact C-N 3.33Å |
| 267 | S | 71.4 | Confident | 68.8 | Low | 1 Ų | 1 | 41.2 Ų | 41.2 | 1% | 0.007 | 24% | 0.239 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.3 | 4.7 | 174.4 | -59.5 | 0 | 0 | 0 | 0 | 114 | M263 Y264 Q265 C273 L305 | M263-S267 PolarHBondContact O-N 2.95Å; M263-S267 VanDerWaalsContact O-N 3.16Å; M263-S267 PolarHBondContact O-OG 3.36Å; Y264-S267 WeakPolarHBondContact O-CB 3.29Å; Y264-S267 PolarHBondContact O-N 3.38Å; Q265-S267 PolarHBondContact O-N 3.01Å; S267-C273 WeakPolarHBondContact CB-SG 3.12Å; S267-C273 PolarHBondContact OG-SG 3.47Å; S267-L305 VanDerWaalsContact CB-CD1 3.5Å |
| 268 | M | 66.9 | Low | 67.4 | Low | 44 Ų | 44 | 47 Ų | 47 | 22% | 0.217 | 27% | 0.266 | C | S | . | . | trans | -114.3 | 139 | 177.1 | -52.5 | -64.2 | 167 | 0 | 0 | 111 | Y264 Q265 S266 L270 L305 F308 Q309 F318 | Y264-M268 WeakPolarHBondContact O-CG 3.42Å; Q265-M268 PolarHBondContact O-N 3.45Å; Q265-M268 VanDerWaalsContact O-N 3.11Å; S266-M268 VanDerWaalsContact C-N 3.33Å; M268-L270 HydrophobicContact SD-CD1 4.42Å; M268-L305 HydrophobicContact CE-CD1 3.91Å; M268-F308 HydrophobicContact CE-CB 3.89Å; M268-Q309 HydrophobicContact CE-CB 4.31Å; M268-Q309 HydrophobicContact CE-CG 3.52Å; M268-Q309 HydrophobicContact SD-CG 3.76Å; M268-F318 HydrophobicContact CE-CZ 4.37Å; M268-F318 HydrophobicContact CG-CE2 4.08Å; M268-F318 HydrophobicContact CG-CZ 4.45Å | ||
| 269 | P | 57.1 | Low | 66.2 | Low | 107 Ų | 107 | 50.2 Ų | 50.2 | 70% | 0.695 | 29% | 0.289 | S | S | * | . | S | Bend | cis | -77.5 | 163.4 | -8.3 | -12.2 | 30.3 | 0 | 0 | 0 | 112.9 | T271 | P269-T271 PolarHBondContact O-N 2.73Š|
| 270 | L | 50.9 | Low | 65.2 | Low | 111 Ų | 111 | 50.4 Ų | 50.4 | 58% | 0.581 | 29% | 0.291 | S | S | * | . | G | 310 helix | trans | -63.4 | -3.2 | -168 | -81.4 | 83.1 | 0 | 0 | 0 | 117.4 | M268 T272 Q309 | M268-L270 HydrophobicContact SD-CD1 4.42Å; L270-T272 VanDerWaalsContact C-N 3.29Å; L270-T272 PolarHBondContact O-N 3.48Å; L270-Q309 HydrophobicContact CD1-CB 4.23Å; L270-Q309 HydrophobicContact CD1-CG 3.85Å; L270-Q309 HydrophobicContact CD2-CG 4.49Å; L270-Q309 HydrophobicContact CG-CG 4.33Å |
| 271 | T | 42.8 | Very low | 63.9 | Low | 131 Ų | 131 | 51.2 Ų | 51.2 | 80% | 0.804 | 29% | 0.294 | S | S | * | . | G | 310 helix | trans | -64.7 | -28.7 | -175.1 | 25.6 | 0 | 0 | 0 | 0 | 114.3 | P269 | P269-T271 PolarHBondContact O-N 2.73Š|
| 272 | T | 46.1 | Very low | 62.6 | Low | 109 Ų | 109 | 53.4 Ų | 53.4 | 67% | 0.669 | 31% | 0.309 | S | S | * | . | G | 310 helix | trans | -149.7 | 45.2 | -176.9 | -31.1 | 0 | 0 | 0 | 0 | 112.4 | L270 T274 | L270-T272 VanDerWaalsContact C-N 3.29Å; L270-T272 PolarHBondContact O-N 3.48Å; T272-T274 HydrophobicContact CG2-CG2 4.45Å; T272-T274 PolarHBondContact O-N 2.72Å |
| 273 | C | 48.9 | Very low | 61.8 | Low | 27 Ų | 27 | 56.2 Ų | 56.2 | 18% | 0.182 | 32% | 0.323 | C | S | . | . | trans | -60.5 | 115.2 | 169 | 179.1 | 0 | 0 | 0 | 0 | 108.5 | S267 T277 | S267-C273 WeakPolarHBondContact CB-SG 3.12Å; S267-C273 PolarHBondContact OG-SG 3.47Å; C273-T277 WeakPolarHBondContact O-CG2 3.17Å | ||
| 274 | T | 51.5 | Low | 60.9 | Low | 73 Ų | 73 | 57.2 Ų | 57.2 | 45% | 0.448 | 33% | 0.329 | S | S | . | . | trans | -98.6 | -47.5 | 176.2 | 49.1 | 0 | 0 | 0 | 0 | 111.4 | T272 L276 T277 M280 | T272-T274 HydrophobicContact CG2-CG2 4.45Å; T272-T274 PolarHBondContact O-N 2.72Å; T274-L276 VanDerWaalsContact C-N 3.28Å; T274-L276 PolarHBondContact O-N 2.86Å; T274-L276 VanDerWaalsContact O-N 3.08Å; T274-T277 WeakPolarHBondContact O-CB 3.44Å; T274-T277 VanDerWaalsContact O-CG2 3.29Å; T274-T277 WeakPolarHBondContact O-CG2 3.44Å; T274-T277 PolarHBondContact O-N 3.1Å; T274-T277 VanDerWaalsContact O-N 3.13Å; T274-T277 PolarHBondContact O-OG1 3.28Å; T274-M280 VanDerWaalsContact O-CG 3.24Å; T274-M280 WeakPolarHBondContact O-CG 3.41Å | ||
| 275 | M | 52.6 | Low | 59.7 | Low | 49 Ų | 49 | 63.5 Ų | 63.5 | 24% | 0.241 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -25.7 | -167.1 | -62.2 | -67.9 | 98.9 | 0 | 0 | 116.1 | T212 M280 W298 | T212-M275 HydrophobicContact CG2-CE 4.12Å; M275-M280 HydrophobicContact CE-CE 4.49Å; M275-M280 HydrophobicContact CE-SD 3.48Å; M275-M280 WeakPolarHBondContact CE-SD 3.41Å; M275-M280 HydrophobicContact SD-SD 4.39Å; M275-W298 WeakPolarHBondContact O-CH2 3.39Å |
| 276 | L | 58.8 | Low | 58.5 | Low | 6 Ų | 6 | 67.8 Ų | 67.8 | 3% | 0.031 | 38% | 0.377 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -121.1 | 21.8 | -179.9 | -72.2 | 172.8 | 0 | 0 | 0 | 113.5 | M263 Y264 T274 W298 L301 Q302 L305 | M263-L276 HydrophobicContact CE-CD1 4Å; M263-L276 HydrophobicContact CE-CD2 4.18Å; M263-L276 HydrophobicContact CE-CG 4.46Å; M263-L276 HydrophobicContact CG-CD1 4.08Å; M263-L276 HydrophobicContact CG-CG 4.24Å; M263-L276 HydrophobicContact SD-CD1 4.03Å; M263-L276 HydrophobicContact SD-CD2 3.78Å; M263-L276 HydrophobicContact SD-CG 3.94Å; Y264-L276 HydrophobicContact CD1-CD1 3.92Å; Y264-L276 HydrophobicContact CE1-CD1 3.81Å; T274-L276 VanDerWaalsContact C-N 3.28Å; T274-L276 PolarHBondContact O-N 2.86Å; T274-L276 VanDerWaalsContact O-N 3.08Å; L276-W298 HydrophobicContact CB-CZ2 4.37Å; L276-W298 HydrophobicContact CD2-CE3 4.35Å; L276-W298 HydrophobicContact CD2-CH2 3.66Å; L276-W298 HydrophobicContact CD2-CZ2 3.88Å; L276-W298 HydrophobicContact CD2-CZ3 3.89Å; L276-L301 HydrophobicContact CD2-CB 4.43Å; L276-Q302 PolarHBondContact O-NE2 2.99Å; L276-L305 HydrophobicContact CB-CD2 4.07Å; L276-L305 HydrophobicContact CD1-CB 4.04Å; L276-L305 HydrophobicContact CD1-CD2 3.82Å; L276-L305 HydrophobicContact CD1-CG 4.36Å |
| 277 | T | 60.3 | Low | 57.7 | Low | 35 Ų | 35 | 71.7 Ų | 71.7 | 22% | 0.215 | 39% | 0.388 | C | S | . | . | S | Bend | trans | -68.7 | 157.7 | 175.9 | 51.1 | 0 | 0 | 0 | 0 | 113 | C273 T274 S279 M280 F281 W298 | C273-T277 WeakPolarHBondContact O-CG2 3.17Å; T274-T277 WeakPolarHBondContact O-CB 3.44Å; T274-T277 VanDerWaalsContact O-CG2 3.29Å; T274-T277 WeakPolarHBondContact O-CG2 3.44Å; T274-T277 PolarHBondContact O-N 3.1Å; T274-T277 VanDerWaalsContact O-N 3.13Å; T274-T277 PolarHBondContact O-OG1 3.28Å; T277-S279 VanDerWaalsContact CB-OG 3.29Å; T277-S279 WeakPolarHBondContact CB-OG 3.26Å; T277-S279 PolarHBondContact O-N 3.41Å; T277-S279 PolarHBondContact OG1-OG 3.47Å; T277-M280 PolarHBondContact O-N 2.88Å; T277-M280 WeakPolarHBondContact OG1-CB 3.38Å; T277-M280 WeakPolarHBondContact OG1-CG 3.41Å; T277-M280 PolarHBondContact OG1-N 2.91Å; T277-F281 PolarHBondContact O-N 3.16Å; T277-W298 WeakPolarHBondContact O-CZ2 3.44Å |
| 278 | Q | 62 | Low | 56.7 | Low | 124 Ų | 124 | 72.9 Ų | 72.9 | 58% | 0.579 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -60.5 | -28.3 | 166.5 | -170.3 | 60.8 | 32.3 | 0 | 0 | 112.2 | S282 | Q278-S282 WeakPolarHBondContact O-CB 3.42Å; Q278-S282 PolarHBondContact O-N 3.44Å |
| 279 | S | 60.7 | Low | 55.9 | Low | 74 Ų | 74 | 80 Ų | 80 | 52% | 0.517 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -70 | -44 | 173.5 | 39.4 | 0 | 0 | 0 | 0 | 112.2 | T277 S282 Q283 | T277-S279 VanDerWaalsContact CB-OG 3.29Å; T277-S279 WeakPolarHBondContact CB-OG 3.26Å; T277-S279 PolarHBondContact O-N 3.41Å; T277-S279 PolarHBondContact OG1-OG 3.47Å; S279-S282 CarbonylContact O-C 3.58Å; S279-S282 PolarHBondContact O-N 2.9Å; S279-Q283 WeakPolarHBondContact O-CG 3.37Å; S279-Q283 PolarHBondContact O-N 3.13Å |
| 280 | M | 63 | Low | 55.8 | Low | 31 Ų | 31 | 77 Ų | 77 | 15% | 0.153 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -70.4 | -33.4 | 173 | -73.5 | -141.6 | 84.5 | 0 | 0 | 112.9 | T274 M275 T277 S282 Q283 L284 | T274-M280 VanDerWaalsContact O-CG 3.24Å; T274-M280 WeakPolarHBondContact O-CG 3.41Å; M275-M280 HydrophobicContact CE-CE 4.49Å; M275-M280 HydrophobicContact CE-SD 3.48Å; M275-M280 WeakPolarHBondContact CE-SD 3.41Å; M275-M280 HydrophobicContact SD-SD 4.39Å; T277-M280 PolarHBondContact O-N 2.88Å; T277-M280 WeakPolarHBondContact OG1-CB 3.38Å; T277-M280 WeakPolarHBondContact OG1-CG 3.41Å; T277-M280 PolarHBondContact OG1-N 2.91Å; M280-S282 VanDerWaalsContact C-N 3.29Å; M280-S282 PolarHBondContact O-N 3.38Å; M280-Q283 PolarHBondContact O-N 3.38Å; M280-L284 WeakPolarHBondContact O-CB 3.47Å; M280-L284 VanDerWaalsContact O-CG 3.28Å; M280-L284 WeakPolarHBondContact O-CG 3.49Å; M280-L284 PolarHBondContact O-N 3.16Å |
| 281 | F | 63.2 | Low | 56 | Low | 17 Ų | 17 | 77.6 Ų | 77.6 | 8% | 0.075 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -55.4 | -47.9 | 166 | 177.6 | -97 | 0 | 0 | 0 | 110.9 | T277 L284 Y285 F293 V295 W298 | T277-F281 PolarHBondContact O-N 3.16Å; F281-L284 PolarHBondContact O-N 2.79Å; F281-Y285 HydrophobicContact CE1-CG 4.45Å; F281-Y285 HydrophobicContact CZ-CD2 4.41Å; F281-Y285 WeakPolarHBondContact O-CB 3.23Å; F281-Y285 PolarHBondContact O-N 2.91Å; F281-F293 AromaticContact CD2-CE1 3.75Å; F281-F293 HydrophobicContact CD2-CE1 3.75Å; F281-F293 AromaticContact CD2-CZ 3.84Å; F281-F293 HydrophobicContact CD2-CZ 3.84Å; F281-F293 HydrophobicContact CE2-CD1 4.3Å; F281-F293 AromaticContact CE2-CE1 3.25Å; F281-F293 HydrophobicContact CE2-CE1 3.25Å; F281-F293 AromaticContact CE2-CZ 3.74Å; F281-F293 HydrophobicContact CE2-CZ 3.74Å; F281-F293 AromaticContact CZ-CE1 3.89Å; F281-F293 HydrophobicContact CZ-CE1 3.89Å; F281-V295 HydrophobicContact CZ-CB 4.3Å; F281-V295 HydrophobicContact CZ-CG1 4.03Å; F281-V295 HydrophobicContact CZ-CG2 4.1Å; F281-W298 HydrophobicContact CB-CD2 4.26Å; F281-W298 HydrophobicContact CB-CZ2 3.8Å; F281-W298 HydrophobicContact CD2-CB 3.65Å; F281-W298 AromaticContact CD2-CD1 3.38Å; F281-W298 AromaticContact CD2-CD2 3.54Å; F281-W298 HydrophobicContact CD2-CD2 3.54Å; F281-W298 AromaticContact CD2-CE2 3.8Å; F281-W298 HydrophobicContact CD2-CE3 4.24Å; F281-W298 AromaticContact CD2-CG 3.23Å; F281-W298 HydrophobicContact CD2-CG 3.23Å; F281-W298 AromaticContact CD2-NE1 3.72Å; F281-W298 HydrophobicContact CE2-CB 3.59Å; F281-W298 AromaticContact CE2-CD1 4Å; F281-W298 HydrophobicContact CE2-CD2 4.39Å; F281-W298 AromaticContact CE2-CG 3.72Å; F281-W298 HydrophobicContact CE2-CG 3.72Å; F281-W298 HydrophobicContact CG-CD2 4.37Å; F281-W298 HydrophobicContact CG-CG 4.23Å; F281-W298 AromaticContact CG-NE1 3.99Å |
| 282 | S | 60.8 | Low | 56.7 | Low | 45 Ų | 45 | 77.7 Ų | 77.7 | 32% | 0.315 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -68.8 | -36.6 | -179.7 | -166.9 | 0 | 0 | 0 | 0 | 112.2 | Q278 S279 M280 N286 | Q278-S282 WeakPolarHBondContact O-CB 3.42Å; Q278-S282 PolarHBondContact O-N 3.44Å; S279-S282 CarbonylContact O-C 3.58Å; S279-S282 PolarHBondContact O-N 2.9Å; M280-S282 VanDerWaalsContact C-N 3.29Å; M280-S282 PolarHBondContact O-N 3.38Å; S282-N286 WeakPolarHBondContact O-CB 3.5Å; S282-N286 PolarHBondContact O-N 2.84Å; S282-N286 PolarHBondContact O-ND2 3.16Å; S282-N286 PolarHBondContact OG-ND2 2.87Å; S282-N286 VanDerWaalsContact OG-ND2 3.16Å |
| 283 | Q | 63.4 | Low | 57.5 | Low | 104 Ų | 104 | 73.6 Ų | 73.6 | 49% | 0.486 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -64.5 | -48.7 | 173.5 | -75 | 173.3 | -29.6 | 0 | 0 | 111.3 | S279 M280 N286 H287 | S279-Q283 WeakPolarHBondContact O-CG 3.37Å; S279-Q283 PolarHBondContact O-N 3.13Å; M280-Q283 PolarHBondContact O-N 3.38Å; Q283-N286 PolarHBondContact O-N 2.86Å; Q283-H287 VanDerWaalsContact O-CB 3.3Å; Q283-H287 WeakPolarHBondContact O-CB 3.41Å; Q283-H287 PolarHBondContact O-N 3.35Å |
| 284 | L | 60.3 | Low | 58.6 | Low | 32 Ų | 32 | 80.8 Ų | 80.8 | 17% | 0.168 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -59.6 | -52.4 | 174.7 | -70.4 | 169.3 | 0 | 0 | 0 | 110.1 | M280 F281 N286 S288 W298 F388 | M280-L284 WeakPolarHBondContact O-CB 3.47Å; M280-L284 VanDerWaalsContact O-CG 3.28Å; M280-L284 WeakPolarHBondContact O-CG 3.49Å; M280-L284 PolarHBondContact O-N 3.16Å; F281-L284 PolarHBondContact O-N 2.79Å; L284-N286 VanDerWaalsContact C-N 3.33Å; L284-N286 PolarHBondContact O-N 3.38Å; L284-S288 WeakPolarHBondContact O-CA 3.36Å; L284-S288 WeakPolarHBondContact O-CB 3.24Å; L284-S288 PolarHBondContact O-N 3.44Å; L284-S288 PolarHBondContact O-OG 3Å; L284-W298 HydrophobicContact CD1-CH2 3.9Å; L284-W298 HydrophobicContact CD1-CZ3 3.6Å; L284-F388 HydrophobicContact CD1-CE1 4.37Å |
| 285 | Y | 60.1 | Low | 59.8 | Low | 132 Ų | 132 | 80.3 Ų | 80.3 | 52% | 0.518 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -60.2 | -37.8 | -179.6 | -173.1 | -100.3 | 0 | 0 | 0 | 113.7 | F281 F293 | F281-Y285 HydrophobicContact CE1-CG 4.45Å; F281-Y285 HydrophobicContact CZ-CD2 4.41Å; F281-Y285 WeakPolarHBondContact O-CB 3.23Å; F281-Y285 PolarHBondContact O-N 2.91Å; Y285-F293 AromaticContact CD2-CD1 3.93Å; Y285-F293 HydrophobicContact CD2-CD1 3.93Å; Y285-F293 HydrophobicContact CD2-CE1 4.21Å |
| 286 | N | 57.3 | Low | 61.4 | Low | 113 Ų | 113 | 81.1 Ų | 81.1 | 60% | 0.604 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -84.4 | -35.4 | -177.6 | -65.2 | -15.7 | 0 | 0 | 0 | 113.2 | S282 Q283 L284 | S282-N286 WeakPolarHBondContact O-CB 3.5Å; S282-N286 PolarHBondContact O-N 2.84Å; S282-N286 PolarHBondContact O-ND2 3.16Å; S282-N286 PolarHBondContact OG-ND2 2.87Å; S282-N286 VanDerWaalsContact OG-ND2 3.16Å; Q283-N286 PolarHBondContact O-N 2.86Å; L284-N286 VanDerWaalsContact C-N 3.33Å; L284-N286 PolarHBondContact O-N 3.38Å |
| 287 | H | 53.2 | Low | 62.6 | Low | 141 Ų | 141 | 82.4 Ų | 82.4 | 65% | 0.653 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -88 | -35.6 | 179.2 | -81.4 | -76.6 | 0 | 0 | 0 | 113.3 | Q283 Q289 | Q283-H287 VanDerWaalsContact O-CB 3.3Å; Q283-H287 WeakPolarHBondContact O-CB 3.41Å; Q283-H287 PolarHBondContact O-N 3.35Å; H287-Q289 PolarHBondContact O-N 3.42Å |
| 288 | S | 50.7 | Low | 63.5 | Low | 26 Ų | 26 | 80.8 Ų | 80.8 | 18% | 0.182 | 42% | 0.418 | C | S | . | . | trans | -89.1 | 109.9 | 179.3 | 80.1 | 0 | 0 | 0 | 0 | 108.8 | L284 L290 | L284-S288 WeakPolarHBondContact O-CA 3.36Å; L284-S288 WeakPolarHBondContact O-CB 3.24Å; L284-S288 PolarHBondContact O-N 3.44Å; L284-S288 PolarHBondContact O-OG 3Å; S288-L290 PolarHBondContact O-N 3.03Å; S288-L290 WeakPolarHBondContact OG-CD1 3.41Å; S288-L290 VanDerWaalsContact OG-CG 3.23Å; S288-L290 WeakPolarHBondContact OG-CG 3.34Å | ||
| 289 | Q | 51.4 | Low | 64.7 | Low | 192 Ų | 192 | 82.5 Ų | 82.5 | 90% | 0.897 | 42% | 0.419 | S | S | * | . | trans | -68.1 | 68.4 | 163.9 | -62.4 | 179.7 | 18.4 | 0 | 0 | 108.6 | H287 P291 | H287-Q289 PolarHBondContact O-N 3.42Å; Q289-P291 WeakPolarHBondContact O-CD 3.48Å | ||
| 290 | L | 53.8 | Low | 66.1 | Low | 45 Ų | 45 | 83 Ų | 83 | 24% | 0.236 | 41% | 0.41 | C | S | . | . | trans | -95 | 91.2 | 176.4 | -70.1 | 175.9 | 0 | 0 | 0 | 108.6 | S288 N292 F293 A386 | S288-L290 PolarHBondContact O-N 3.03Å; S288-L290 WeakPolarHBondContact OG-CD1 3.41Å; S288-L290 VanDerWaalsContact OG-CG 3.23Å; S288-L290 WeakPolarHBondContact OG-CG 3.34Å; L290-N292 PolarHBondContact O-N 3.17Å; L290-F293 HydrophobicContact CB-CB 3.51Å; L290-F293 HydrophobicContact CB-CG 4.48Å; L290-F293 HydrophobicContact CD1-CB 4Å; L290-F293 HydrophobicContact CD1-CD2 3.84Å; L290-F293 HydrophobicContact CD1-CG 4.2Å; L290-F293 HydrophobicContact CG-CB 4.43Å; L290-F293 PolarHBondContact O-N 3.35Å; L290-A386 WeakPolarHBondContact CD1-O 3.17Å; L290-A386 WeakPolarHBondContact CD2-O 3.39Å | ||
| 291 | P | 54.5 | Low | 67.3 | Low | 123 Ų | 123 | 81.6 Ų | 81.6 | 80% | 0.799 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | -13.9 | -179.6 | 25.5 | -36.6 | 0 | 0 | 0 | 113.6 | Q289 | Q289-P291 WeakPolarHBondContact O-CD 3.48Š|
| 292 | N | 57.8 | Low | 68.4 | Low | 134 Ų | 134 | 83.2 Ų | 83.2 | 72% | 0.717 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.9 | -1.3 | -178.1 | -63.2 | -24.4 | 0 | 0 | 0 | 114.1 | L290 R294 | L290-N292 PolarHBondContact O-N 3.17Å; N292-R294 PolarHBondContact O-N 3.06Å |
| 293 | F | 63.9 | Low | 69.7 | Low | 22 Ų | 22 | 85.6 Ų | 85.6 | 10% | 0.096 | 42% | 0.42 | C | S | . | . | trans | -78.1 | 104.6 | -176.4 | -176.9 | -94.1 | 0 | 0 | 0 | 111.2 | F281 Y285 L290 W298 M387 | F281-F293 AromaticContact CD2-CE1 3.75Å; F281-F293 HydrophobicContact CD2-CE1 3.75Å; F281-F293 AromaticContact CD2-CZ 3.84Å; F281-F293 HydrophobicContact CD2-CZ 3.84Å; F281-F293 HydrophobicContact CE2-CD1 4.3Å; F281-F293 AromaticContact CE2-CE1 3.25Å; F281-F293 HydrophobicContact CE2-CE1 3.25Å; F281-F293 AromaticContact CE2-CZ 3.74Å; F281-F293 HydrophobicContact CE2-CZ 3.74Å; F281-F293 AromaticContact CZ-CE1 3.89Å; F281-F293 HydrophobicContact CZ-CE1 3.89Å; Y285-F293 AromaticContact CD2-CD1 3.93Å; Y285-F293 HydrophobicContact CD2-CD1 3.93Å; Y285-F293 HydrophobicContact CD2-CE1 4.21Å; L290-F293 HydrophobicContact CB-CB 3.51Å; L290-F293 HydrophobicContact CB-CG 4.48Å; L290-F293 HydrophobicContact CD1-CB 4Å; L290-F293 HydrophobicContact CD1-CD2 3.84Å; L290-F293 HydrophobicContact CD1-CG 4.2Å; L290-F293 HydrophobicContact CG-CB 4.43Å; L290-F293 PolarHBondContact O-N 3.35Å; F293-W298 HydrophobicContact CE2-CE3 4.45Å; F293-W298 HydrophobicContact CZ-CB 4.3Å; F293-W298 HydrophobicContact CZ-CE3 4.03Å; F293-M387 HydrophobicContact CD2-CB 4.24Å; F293-M387 HydrophobicContact CD2-CE 4.27Å; F293-M387 HydrophobicContact CD2-CG 3.68Å; F293-M387 HydrophobicContact CE2-CB 4.07Å; F293-M387 HydrophobicContact CE2-CE 3.58Å; F293-M387 HydrophobicContact CE2-CG 3.74Å; F293-M387 HydrophobicContact CZ-CE 4.26Å | ||
| 294 | R | 72.3 | Confident | 71.1 | Confident | 178 Ų | 178 | 80.7 Ų | 80.7 | 67% | 0.672 | 40% | 0.397 | S | S | * | . | trans | -91.1 | 134.7 | 179.4 | -57.3 | 179.8 | 176.4 | -168.5 | -1.9 | 110.4 | N292 A296 D297 | N292-R294 PolarHBondContact O-N 3.06Å; R294-A296 HydrophobicContact CB-CB 4.49Å; R294-A296 PolarHBondContact O-N 3.3Å; R294-D297 WeakPolarHBondContact CB-OD2 3.41Å; R294-D297 PolarHBondContact O-N 2.93Å | ||
| 295 | V | 76.9 | Confident | 72.4 | Confident | 64 Ų | 64 | 79.7 Ų | 79.7 | 39% | 0.388 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -49.3 | -33.9 | 170.5 | -169 | 0 | 0 | 0 | 0 | 111.8 | F281 W298 R299 | F281-V295 HydrophobicContact CZ-CB 4.3Å; F281-V295 HydrophobicContact CZ-CG1 4.03Å; F281-V295 HydrophobicContact CZ-CG2 4.1Å; V295-W298 PolarHBondContact O-N 3.05Å; V295-R299 HydrophobicContact CG1-CG 4.49Å; V295-R299 WeakPolarHBondContact O-CG 3.26Å; V295-R299 PolarHBondContact O-N 3.44Å |
| 296 | A | 84.3 | Confident | 73.8 | Confident | 65 Ų | 65 | 76.4 Ų | 76.4 | 54% | 0.537 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -64 | -38.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | R294 R299 Y300 | R294-A296 HydrophobicContact CB-CB 4.49Å; R294-A296 PolarHBondContact O-N 3.3Å; A296-R299 PolarHBondContact O-N 3.43Å; A296-Y300 WeakPolarHBondContact O-CB 3.28Å; A296-Y300 PolarHBondContact O-N 2.92Å |
| 297 | D | 83.9 | Confident | 75.4 | Confident | 34 Ų | 34 | 77.4 Ų | 77.4 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -69.3 | -38.7 | 179 | -69 | -61 | 0 | 0 | 0 | 110.8 | R294 Y300 L301 K383 M387 | R294-D297 WeakPolarHBondContact CB-OD2 3.41Å; R294-D297 PolarHBondContact O-N 2.93Å; D297-Y300 WeakPolarHBondContact O-CB 3.39Å; D297-Y300 PolarHBondContact O-N 3.22Å; D297-L301 PolarHBondContact O-N 3.16Å; D297-L301 VanDerWaalsContact O-N 3.12Å; D297-K383 WeakPolarHBondContact OD1-CE 3.37Å; D297-K383 IonicContact OD1-NZ 3.95Å; D297-K383 PolarHBondContact OD1-NZ 3.19Å; D297-M387 HydrophobicContact CB-CE 4.29Å; D297-M387 HydrophobicContact CB-SD 4.16Å |
| 298 | W | 81.2 | Confident | 77.2 | Confident | 1 Ų | 1 | 70.7 Ų | 70.7 | 0% | 0.004 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -66.1 | -45.5 | 173.1 | -177.2 | -93.5 | 0 | 0 | 0 | 113 | M275 L276 T277 F281 L284 F293 V295 Y300 L301 Q302 M387 F388 | M275-W298 WeakPolarHBondContact O-CH2 3.39Å; L276-W298 HydrophobicContact CB-CZ2 4.37Å; L276-W298 HydrophobicContact CD2-CE3 4.35Å; L276-W298 HydrophobicContact CD2-CH2 3.66Å; L276-W298 HydrophobicContact CD2-CZ2 3.88Å; L276-W298 HydrophobicContact CD2-CZ3 3.89Å; T277-W298 WeakPolarHBondContact O-CZ2 3.44Å; F281-W298 HydrophobicContact CB-CD2 4.26Å; F281-W298 HydrophobicContact CB-CZ2 3.8Å; F281-W298 HydrophobicContact CD2-CB 3.65Å; F281-W298 AromaticContact CD2-CD1 3.38Å; F281-W298 AromaticContact CD2-CD2 3.54Å; F281-W298 HydrophobicContact CD2-CD2 3.54Å; F281-W298 AromaticContact CD2-CE2 3.8Å; F281-W298 HydrophobicContact CD2-CE3 4.24Å; F281-W298 AromaticContact CD2-CG 3.23Å; F281-W298 HydrophobicContact CD2-CG 3.23Å; F281-W298 AromaticContact CD2-NE1 3.72Å; F281-W298 HydrophobicContact CE2-CB 3.59Å; F281-W298 AromaticContact CE2-CD1 4Å; F281-W298 HydrophobicContact CE2-CD2 4.39Å; F281-W298 AromaticContact CE2-CG 3.72Å; F281-W298 HydrophobicContact CE2-CG 3.72Å; F281-W298 HydrophobicContact CG-CD2 4.37Å; F281-W298 HydrophobicContact CG-CG 4.23Å; F281-W298 AromaticContact CG-NE1 3.99Å; L284-W298 HydrophobicContact CD1-CH2 3.9Å; L284-W298 HydrophobicContact CD1-CZ3 3.6Å; F293-W298 HydrophobicContact CE2-CE3 4.45Å; F293-W298 HydrophobicContact CZ-CB 4.3Å; F293-W298 HydrophobicContact CZ-CE3 4.03Å; V295-W298 PolarHBondContact O-N 3.05Å; W298-Y300 PolarHBondContact O-N 2.93Å; W298-L301 WeakPolarHBondContact O-CB 3.34Å; W298-L301 PolarHBondContact O-N 3.11Å; W298-Q302 VanDerWaalsContact CD1-CD 3.4Å; W298-Q302 PolarHBondContact O-N 2.82Å; W298-M387 HydrophobicContact CB-CE 4.2Å; W298-M387 HydrophobicContact CE3-CE 3.93Å; W298-F388 HydrophobicContact CZ3-CE1 4.14Å; W298-F388 HydrophobicContact CZ3-CZ 4.01Å |
| 299 | R | 85.4 | Confident | 78.9 | Confident | 159 Ų | 159 | 71.4 Ų | 71.4 | 60% | 0.6 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -56.6 | -38.5 | 174.2 | -76.3 | 177.5 | 177.6 | 174.9 | -0.4 | 111.3 | V295 A296 Q302 D303 | V295-R299 HydrophobicContact CG1-CG 4.49Å; V295-R299 WeakPolarHBondContact O-CG 3.26Å; V295-R299 PolarHBondContact O-N 3.44Å; A296-R299 PolarHBondContact O-N 3.43Å; R299-Q302 WeakPolarHBondContact O-CB 3.3Å; R299-Q302 PolarHBondContact O-N 3.34Å; R299-D303 PolarHBondContact O-N 3.49Å |
| 300 | Y | 90.6 | Very high | 80.6 | Confident | 86 Ų | 86 | 67.9 Ų | 67.9 | 34% | 0.337 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -63.6 | -41.3 | 174.8 | -170.1 | -107.5 | 0 | 0 | 0 | 112.9 | A296 D297 W298 Q302 D303 L304 T378 V379 | A296-Y300 WeakPolarHBondContact O-CB 3.28Å; A296-Y300 PolarHBondContact O-N 2.92Å; D297-Y300 WeakPolarHBondContact O-CB 3.39Å; D297-Y300 PolarHBondContact O-N 3.22Å; W298-Y300 PolarHBondContact O-N 2.93Å; Y300-Q302 VanDerWaalsContact C-N 3.32Å; Y300-Q302 PolarHBondContact O-N 3.07Å; Y300-D303 PolarHBondContact O-N 3.48Å; Y300-L304 HydrophobicContact CD1-CD1 4.13Å; Y300-L304 HydrophobicContact CD1-CG 4.38Å; Y300-L304 HydrophobicContact CE1-CD1 3.74Å; Y300-L304 HydrophobicContact CE1-CD2 4.46Å; Y300-L304 HydrophobicContact CE1-CG 4.09Å; Y300-L304 WeakPolarHBondContact O-CG 3.38Å; Y300-L304 PolarHBondContact O-N 3.25Å; Y300-T378 WeakPolarHBondContact CE1-OG1 3.39Å; Y300-T378 WeakPolarHBondContact OH-CB 3.23Å; Y300-T378 PolarHBondContact OH-OG1 2.91Å; Y300-V379 HydrophobicContact CD1-CG2 4.02Å; Y300-V379 HydrophobicContact CE1-CG2 3.79Å |
| 301 | L | 87.9 | Confident | 82.2 | Confident | 1 Ų | 1 | 66.3 Ų | 66.3 | 1% | 0.005 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.4 | -36.2 | 172.3 | -65.3 | -178.1 | 0 | 0 | 0 | 112.5 | L260 M263 L276 D297 W298 L304 L305 V379 I384 M387 F388 | L260-L301 HydrophobicContact CD2-CD2 3.85Å; M263-L301 HydrophobicContact CE-CD1 4.45Å; L276-L301 HydrophobicContact CD2-CB 4.43Å; D297-L301 PolarHBondContact O-N 3.16Å; D297-L301 VanDerWaalsContact O-N 3.12Å; W298-L301 WeakPolarHBondContact O-CB 3.34Å; W298-L301 PolarHBondContact O-N 3.11Å; L301-L304 PolarHBondContact O-N 3.23Å; L301-L305 PolarHBondContact O-N 3.2Å; L301-V379 HydrophobicContact CD2-CG1 4.13Å; L301-V379 HydrophobicContact CD2-CG2 4.01Å; L301-I384 HydrophobicContact CD1-CD1 4.42Å; L301-I384 HydrophobicContact CD2-CD1 4.36Å; L301-M387 HydrophobicContact CD1-CE 3.57Å; L301-M387 HydrophobicContact CD1-SD 4.05Å; L301-M387 HydrophobicContact CG-CE 4.44Å; L301-F388 HydrophobicContact CD1-CE2 3.8Å; L301-F388 HydrophobicContact CD1-CZ 3.98Å |
| 302 | Q | 85.9 | Confident | 83.7 | Confident | 51 Ų | 51 | 63.6 Ų | 63.6 | 24% | 0.238 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -67.1 | -43.3 | 173.7 | -68.4 | 179.8 | -46.4 | 0 | 0 | 111.7 | L276 W298 R299 Y300 L304 L305 V306 | L276-Q302 PolarHBondContact O-NE2 2.99Å; W298-Q302 VanDerWaalsContact CD1-CD 3.4Å; W298-Q302 PolarHBondContact O-N 2.82Å; R299-Q302 WeakPolarHBondContact O-CB 3.3Å; R299-Q302 PolarHBondContact O-N 3.34Å; Y300-Q302 VanDerWaalsContact C-N 3.32Å; Y300-Q302 PolarHBondContact O-N 3.07Å; Q302-L304 VanDerWaalsContact C-N 3.3Å; Q302-L304 PolarHBondContact O-N 3.09Å; Q302-L305 WeakPolarHBondContact O-CB 3.25Å; Q302-L305 PolarHBondContact O-N 3.34Å; Q302-V306 WeakPolarHBondContact O-CG2 3Å; Q302-V306 PolarHBondContact O-N 3.45Å |
| 303 | D | 89.5 | Confident | 85.2 | Confident | 94 Ų | 94 | 57.6 Ų | 57.6 | 50% | 0.503 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.2 | -36.7 | 175 | -72.5 | -23.4 | 0 | 0 | 0 | 112 | R299 Y300 R307 | R299-D303 PolarHBondContact O-N 3.49Å; Y300-D303 PolarHBondContact O-N 3.48Å; D303-R307 WeakPolarHBondContact O-CG 3.45Å; D303-R307 PolarHBondContact O-N 3.16Å |
| 304 | L | 92.3 | Very high | 86 | Confident | 1 Ų | 1 | 59 Ų | 59 | 1% | 0.005 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.2 | -48.2 | 171.6 | -71.5 | -175.1 | 0 | 0 | 0 | 111.3 | Y264 Y300 L301 Q302 V306 R307 F308 L375 V379 | Y264-L304 HydrophobicContact CE2-CB 4.27Å; Y264-L304 VanDerWaalsContact OH-CB 3.31Å; Y264-L304 WeakPolarHBondContact OH-CB 3.38Å; Y300-L304 HydrophobicContact CD1-CD1 4.13Å; Y300-L304 HydrophobicContact CD1-CG 4.38Å; Y300-L304 HydrophobicContact CE1-CD1 3.74Å; Y300-L304 HydrophobicContact CE1-CD2 4.46Å; Y300-L304 HydrophobicContact CE1-CG 4.09Å; Y300-L304 WeakPolarHBondContact O-CG 3.38Å; Y300-L304 PolarHBondContact O-N 3.25Å; L301-L304 PolarHBondContact O-N 3.23Å; Q302-L304 VanDerWaalsContact C-N 3.3Å; Q302-L304 PolarHBondContact O-N 3.09Å; L304-V306 VanDerWaalsContact C-N 3.29Å; L304-V306 PolarHBondContact O-N 3.41Å; L304-R307 WeakPolarHBondContact O-CB 3.23Å; L304-R307 PolarHBondContact O-N 3.43Å; L304-F308 WeakPolarHBondContact O-CD2 3.3Å; L304-F308 PolarHBondContact O-N 2.72Å; L304-F308 VanDerWaalsContact O-N 3.13Å; L304-L375 WeakPolarHBondContact CD1-O 3.17Å; L304-L375 HydrophobicContact CD2-CB 3.8Å; L304-L375 HydrophobicContact CD2-CD1 4.44Å; L304-V379 HydrophobicContact CD1-CG2 3.72Å |
| 305 | L | 88.5 | Confident | 86.3 | Confident | 11 Ų | 11 | 56 Ų | 56 | 6% | 0.058 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -53.6 | -47.1 | 174.7 | 171.8 | 65.4 | 0 | 0 | 0 | 111.1 | Y264 S267 M268 L276 L301 Q302 R307 F308 Q309 | Y264-L305 HydrophobicContact CD1-CB 3.87Å; Y264-L305 HydrophobicContact CD1-CD1 3.85Å; Y264-L305 HydrophobicContact CD1-CG 4.44Å; Y264-L305 HydrophobicContact CE1-CB 3.95Å; Y264-L305 HydrophobicContact CG-CD1 4.32Å; S267-L305 VanDerWaalsContact CB-CD1 3.5Å; M268-L305 HydrophobicContact CE-CD1 3.91Å; L276-L305 HydrophobicContact CB-CD2 4.07Å; L276-L305 HydrophobicContact CD1-CB 4.04Å; L276-L305 HydrophobicContact CD1-CD2 3.82Å; L276-L305 HydrophobicContact CD1-CG 4.36Å; L301-L305 PolarHBondContact O-N 3.2Å; Q302-L305 WeakPolarHBondContact O-CB 3.25Å; Q302-L305 PolarHBondContact O-N 3.34Å; L305-R307 PolarHBondContact O-N 2.91Å; L305-F308 WeakPolarHBondContact O-CA 3.3Å; L305-F308 WeakPolarHBondContact O-CB 3.45Å; L305-F308 PolarHBondContact O-N 3.06Å; L305-Q309 HydrophobicContact CD1-CG 4.09Å; L305-Q309 HydrophobicContact CG-CG 4.19Å; L305-Q309 WeakPolarHBondContact O-CG 3.29Å; L305-Q309 PolarHBondContact O-N 3.14Å |
| 306 | V | 88 | Confident | 86.4 | Confident | 63 Ų | 63 | 55.6 Ų | 55.6 | 38% | 0.382 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -59.3 | -33.9 | 178.5 | 169 | 0 | 0 | 0 | 0 | 111.7 | Q302 L304 Q309 N310 | Q302-V306 WeakPolarHBondContact O-CG2 3Å; Q302-V306 PolarHBondContact O-N 3.45Å; L304-V306 VanDerWaalsContact C-N 3.29Å; L304-V306 PolarHBondContact O-N 3.41Å; V306-Q309 PolarHBondContact O-N 2.83Å; V306-N310 WeakPolarHBondContact CG1-ND2 3.44Å; V306-N310 VanDerWaalsContact O-CB 3.26Å; V306-N310 WeakPolarHBondContact O-CB 3.4Å; V306-N310 PolarHBondContact O-N 3.28Å; V306-N310 PolarHBondContact O-ND2 3.23Å |
| 307 | R | 91.4 | Very high | 86.5 | Confident | 134 Ų | 134 | 52.5 Ų | 52.5 | 51% | 0.506 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -68 | -40.4 | 173 | -66.8 | 165.9 | -171 | -115.9 | -1.4 | 112.6 | D303 L304 L305 C311 L372 | D303-R307 WeakPolarHBondContact O-CG 3.45Å; D303-R307 PolarHBondContact O-N 3.16Å; L304-R307 WeakPolarHBondContact O-CB 3.23Å; L304-R307 PolarHBondContact O-N 3.43Å; L305-R307 PolarHBondContact O-N 2.91Å; R307-C311 WeakPolarHBondContact O-CB 3.32Å; R307-C311 PolarHBondContact O-N 3.18Å; R307-L372 HydrophobicContact CB-CD2 4.42Å |
| 308 | F | 90.8 | Very high | 86.5 | Confident | 1 Ų | 1 | 51 Ų | 51 | 0% | 0.004 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.8 | -41.1 | 173.1 | -83.1 | -98.7 | 0 | 0 | 0 | 111.3 | L261 Y264 M268 L304 L305 C311 A312 V313 F318 L321 L372 L376 | L261-F308 HydrophobicContact CD2-CE1 3.65Å; L261-F308 HydrophobicContact CD2-CZ 3.89Å; Y264-F308 HydrophobicContact CD2-CD1 4.4Å; Y264-F308 AromaticContact CD2-CD2 3.6Å; Y264-F308 HydrophobicContact CD2-CD2 3.6Å; Y264-F308 HydrophobicContact CD2-CE1 4.42Å; Y264-F308 AromaticContact CD2-CE2 3.62Å; Y264-F308 HydrophobicContact CD2-CE2 3.62Å; Y264-F308 HydrophobicContact CD2-CG 4.02Å; Y264-F308 HydrophobicContact CD2-CZ 4.05Å; Y264-F308 AromaticContact CE2-CD2 3.99Å; Y264-F308 HydrophobicContact CE2-CD2 3.99Å; Y264-F308 AromaticContact CE2-CE2 3.81Å; Y264-F308 HydrophobicContact CE2-CE2 3.81Å; Y264-F308 HydrophobicContact CE2-CZ 4.49Å; Y264-F308 HydrophobicContact CG-CD2 4.33Å; Y264-F308 HydrophobicContact CG-CG 4.43Å; M268-F308 HydrophobicContact CE-CB 3.89Å; L304-F308 WeakPolarHBondContact O-CD2 3.3Å; L304-F308 PolarHBondContact O-N 2.72Å; L304-F308 VanDerWaalsContact O-N 3.13Å; L305-F308 WeakPolarHBondContact O-CA 3.3Å; L305-F308 WeakPolarHBondContact O-CB 3.45Å; L305-F308 PolarHBondContact O-N 3.06Å; F308-C311 PolarHBondContact O-N 3.29Å; F308-A312 PolarHBondContact O-N 3.03Å; F308-V313 HydrophobicContact CD1-CB 4.46Å; F308-V313 HydrophobicContact CD1-CG2 3.84Å; F308-F318 AromaticContact CD1-CE1 3.71Å; F308-F318 HydrophobicContact CD1-CE1 3.71Å; F308-F318 AromaticContact CD1-CZ 3.85Å; F308-F318 HydrophobicContact CD1-CZ 3.85Å; F308-F318 AromaticContact CE1-CE1 3.95Å; F308-F318 HydrophobicContact CE1-CE1 3.95Å; F308-L321 HydrophobicContact CE1-CD1 4.48Å; F308-L372 HydrophobicContact CD1-CD1 3.85Å; F308-L372 HydrophobicContact CD2-CD2 4.43Å; F308-L372 HydrophobicContact CE1-CB 4.15Å; F308-L372 HydrophobicContact CE1-CD1 3.78Å; F308-L372 HydrophobicContact CE2-CB 4.13Å; F308-L372 HydrophobicContact CE2-CD2 4.38Å; F308-L372 HydrophobicContact CG-CD1 4.25Å; F308-L372 HydrophobicContact CZ-CB 3.72Å; F308-L372 HydrophobicContact CZ-CD1 4.14Å; F308-L372 HydrophobicContact CZ-CG 4.39Å; F308-L376 HydrophobicContact CE2-CD2 3.9Å; F308-L376 HydrophobicContact CZ-CD1 4.49Å; F308-L376 HydrophobicContact CZ-CD2 3.89Å; F308-L376 HydrophobicContact CZ-CG 4.4Å |
| 309 | Q | 86.7 | Confident | 86.5 | Confident | 40 Ų | 40 | 53.1 Ų | 53.1 | 19% | 0.187 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 175.5 | -69.1 | 174.9 | -20.8 | 0 | 0 | 111.2 | M268 L270 L305 V306 C311 A312 | M268-Q309 HydrophobicContact CE-CB 4.31Å; M268-Q309 HydrophobicContact CE-CG 3.52Å; M268-Q309 HydrophobicContact SD-CG 3.76Å; L270-Q309 HydrophobicContact CD1-CB 4.23Å; L270-Q309 HydrophobicContact CD1-CG 3.85Å; L270-Q309 HydrophobicContact CD2-CG 4.49Å; L270-Q309 HydrophobicContact CG-CG 4.33Å; L305-Q309 HydrophobicContact CD1-CG 4.09Å; L305-Q309 HydrophobicContact CG-CG 4.19Å; L305-Q309 WeakPolarHBondContact O-CG 3.29Å; L305-Q309 PolarHBondContact O-N 3.14Å; V306-Q309 PolarHBondContact O-N 2.83Å; Q309-C311 PolarHBondContact O-N 3.36Å; Q309-A312 WeakPolarHBondContact O-CA 3.45Å; Q309-A312 PolarHBondContact O-N 3.12Å |
| 310 | N | 86.9 | Confident | 86.4 | Confident | 119 Ų | 119 | 46 Ų | 46 | 64% | 0.636 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -67.5 | -17 | 177.4 | -71.1 | -21.1 | 0 | 0 | 0 | 113.9 | V306 | V306-N310 WeakPolarHBondContact CG1-ND2 3.44Å; V306-N310 VanDerWaalsContact O-CB 3.26Å; V306-N310 WeakPolarHBondContact O-CB 3.4Å; V306-N310 PolarHBondContact O-N 3.28Å; V306-N310 PolarHBondContact O-ND2 3.23Å |
| 311 | C | 87.7 | Confident | 86.4 | Confident | 12 Ų | 12 | 41.9 Ų | 41.9 | 8% | 0.081 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -87.4 | -12.2 | 170.6 | -159.9 | 0 | 0 | 0 | 0 | 112.7 | R307 F308 Q309 V313 R365 L372 | R307-C311 WeakPolarHBondContact O-CB 3.32Å; R307-C311 PolarHBondContact O-N 3.18Å; F308-C311 PolarHBondContact O-N 3.29Å; Q309-C311 PolarHBondContact O-N 3.36Å; C311-V313 VanDerWaalsContact C-N 3.33Å; C311-V313 HydrophobicContact CB-CG2 3.92Å; C311-V313 PolarHBondContact O-N 3.37Å; C311-R365 PolarHBondContact O-NH1 3.41Å; C311-L372 HydrophobicContact CB-CD1 4.17Å |
| 312 | A | 86.3 | Confident | 86.3 | Confident | 65 Ų | 65 | 42.9 Ų | 42.9 | 54% | 0.537 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 46.3 | 56.5 | -173.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | F308 Q309 D314 R365 | F308-A312 PolarHBondContact O-N 3.03Å; Q309-A312 WeakPolarHBondContact O-CA 3.45Å; Q309-A312 PolarHBondContact O-N 3.12Å; A312-D314 PolarHBondContact O-N 3.31Å; A312-R365 PolarHBondContact O-NH2 2.92Å |
| 313 | V | 88.6 | Confident | 86 | Confident | 8 Ų | 8 | 40.7 Ų | 40.7 | 5% | 0.048 | 22% | 0.218 | C | C | . | . | trans | -67.9 | 122.2 | 178.8 | -173 | 0 | 0 | 0 | 0 | 109 | F308 C311 E317 F318 L321 L369 L372 | F308-V313 HydrophobicContact CD1-CB 4.46Å; F308-V313 HydrophobicContact CD1-CG2 3.84Å; C311-V313 VanDerWaalsContact C-N 3.33Å; C311-V313 HydrophobicContact CB-CG2 3.92Å; C311-V313 PolarHBondContact O-N 3.37Å; V313-E317 WeakPolarHBondContact CA-OE2 3.26Å; V313-E317 HydrophobicContact CG1-CB 3.71Å; V313-F318 HydrophobicContact CB-CD2 4.12Å; V313-F318 HydrophobicContact CB-CE2 3.67Å; V313-F318 HydrophobicContact CB-CZ 3.94Å; V313-F318 HydrophobicContact CG1-CD1 4.16Å; V313-F318 HydrophobicContact CG1-CD2 3.62Å; V313-F318 HydrophobicContact CG1-CE1 4.22Å; V313-F318 HydrophobicContact CG1-CE2 3.68Å; V313-F318 HydrophobicContact CG1-CG 3.87Å; V313-F318 HydrophobicContact CG1-CZ 3.99Å; V313-F318 WeakPolarHBondContact O-CE2 3.45Å; V313-L321 HydrophobicContact CG1-CD1 3.87Å; V313-L369 HydrophobicContact CB-CD2 4.32Å; V313-L369 HydrophobicContact CG1-CD2 4.07Å; V313-L369 HydrophobicContact CG2-CD2 3.7Å; V313-L372 HydrophobicContact CG2-CD1 3.65Å | ||
| 314 | D | 81.2 | Confident | 85.9 | Confident | 53 Ų | 53 | 37 Ų | 37 | 28% | 0.283 | 20% | 0.198 | S | C | . | . | trans | -91.2 | 176.6 | -179.4 | 73.2 | 48.9 | 0 | 0 | 0 | 113.4 | A312 S316 E317 F318 H354 R365 | A312-D314 PolarHBondContact O-N 3.31Å; D314-S316 PolarHBondContact O-N 3.24Å; D314-S316 WeakPolarHBondContact OD1-CA 3.27Å; D314-S316 WeakPolarHBondContact OD1-CB 3.29Å; D314-S316 PolarHBondContact OD1-N 3.03Å; D314-E317 PolarHBondContact N-OE2 3.31Å; D314-E317 PolarHBondContact O-N 3.48Å; D314-E317 PolarHBondContact OD1-N 3.48Å; D314-F318 VanDerWaalsContact O-CD2 3.26Å; D314-F318 WeakPolarHBondContact O-CD2 3.31Å; D314-F318 PolarHBondContact O-N 3.38Å; D314-H354 IonicContact OD1-CE1 3.86Å; D314-H354 IonicContact OD1-NE2 2.71Å; D314-H354 PolarHBondContact OD1-NE2 3.43Å; D314-H354 IonicContact OD2-CD2 3.98Å; D314-H354 IonicContact OD2-CE1 2.67Å; D314-H354 IonicContact OD2-NE2 3.88Å; D314-H354 PolarHBondContact OD2-NE2 3.41Å; D314-R365 IonicContact OD2-NH2 3.26Å | ||
| 315 | Q | 79.1 | Confident | 85.9 | Confident | 115 Ų | 115 | 37 Ų | 37 | 54% | 0.537 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -55.4 | -46.1 | -178.7 | -178.3 | 65.7 | 12 | 0 | 0 | 113.1 | Q265 E317 I319 | Q265-Q315 VanDerWaalsContact NE2-CD 3.26Å; Q315-E317 VanDerWaalsContact C-N 3.35Å; Q315-I319 HydrophobicContact CG-CD1 4.12Å; Q315-I319 WeakPolarHBondContact O-CD1 3.37Å; Q315-I319 WeakPolarHBondContact O-CG1 3.35Å; Q315-I319 PolarHBondContact O-N 2.76Å; Q315-I319 VanDerWaalsContact O-N 3.11Å |
| 316 | S | 77.4 | Confident | 85.8 | Confident | 55 Ų | 55 | 37 Ų | 37 | 39% | 0.385 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -69.4 | -37 | -177.8 | -62.4 | 0 | 0 | 0 | 0 | 111 | D314 I319 C320 H354 | D314-S316 PolarHBondContact O-N 3.24Å; D314-S316 WeakPolarHBondContact OD1-CA 3.27Å; D314-S316 WeakPolarHBondContact OD1-CB 3.29Å; D314-S316 PolarHBondContact OD1-N 3.03Å; S316-I319 PolarHBondContact O-N 2.99Å; S316-C320 PolarHBondContact O-N 3.43Å; S316-C320 PolarHBondContact O-SG 2.62Å; S316-H354 VanDerWaalsContact CB-CE1 3.47Å; S316-H354 WeakPolarHBondContact CB-CE1 3.46Å |
| 317 | E | 87.2 | Confident | 85.6 | Confident | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -69.3 | -43.9 | 176.5 | -66.4 | 170 | 161.5 | 0 | 0 | 111.7 | V313 D314 Q315 I319 C320 L321 L351 H354 R365 L369 | V313-E317 WeakPolarHBondContact CA-OE2 3.26Å; V313-E317 HydrophobicContact CG1-CB 3.71Å; D314-E317 PolarHBondContact N-OE2 3.31Å; D314-E317 PolarHBondContact O-N 3.48Å; D314-E317 PolarHBondContact OD1-N 3.48Å; Q315-E317 VanDerWaalsContact C-N 3.35Å; E317-I319 PolarHBondContact O-N 3.49Å; E317-C320 PolarHBondContact O-N 2.87Å; E317-L321 VanDerWaalsContact O-CB 3.31Å; E317-L321 WeakPolarHBondContact O-CB 3.21Å; E317-L321 WeakPolarHBondContact O-CG 3.17Å; E317-L321 PolarHBondContact O-N 2.98Å; E317-L351 HydrophobicContact CB-CD1 4.3Å; E317-L351 HydrophobicContact CG-CD1 4.01Å; E317-H354 VanDerWaalsContact CG-CD2 3.46Å; E317-H354 WeakPolarHBondContact CG-CD2 3.46Å; E317-H354 IonicContact OE1-CD2 3.29Å; E317-H354 IonicContact OE1-NE2 3.97Å; E317-R365 IonicContact OE1-CZ 3.87Å; E317-R365 IonicContact OE1-NE 3.18Å; E317-R365 PolarHBondContact OE1-NE 3.2Å; E317-R365 IonicContact OE1-NH2 3.56Å; E317-R365 PolarHBondContact OE1-NH2 3.48Å; E317-R365 IonicContact OE2-CZ 2.69Å; E317-R365 IonicContact OE2-NE 3.59Å; E317-R365 IonicContact OE2-NH2 3.79Å; E317-R365 PolarHBondContact OE2-NH2 2.93Å; E317-L369 HydrophobicContact CB-CD1 4.36Å; E317-L369 HydrophobicContact CB-CD2 4.45Å; E317-L369 VanDerWaalsContact CD-CD1 3.45Å; E317-L369 HydrophobicContact CG-CD1 3.89Å; E317-L369 WeakPolarHBondContact OE1-CD1 3.32Å |
| 318 | F | 84.7 | Confident | 85.4 | Confident | 2 Ų | 2 | 29.8 Ų | 29.8 | 1% | 0.009 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -57.5 | -38.3 | 171.7 | -87.9 | -66.1 | 0 | 0 | 0 | 112.1 | L261 Q265 M268 F308 V313 D314 K322 | L261-F318 HydrophobicContact CD2-CD1 4.13Å; L261-F318 HydrophobicContact CD2-CE1 4.28Å; L261-F318 WeakPolarHBondContact O-CD1 3.2Å; L261-F318 WeakPolarHBondContact O-CE1 3.36Å; Q265-F318 HydrophobicContact CB-CB 4.46Å; Q265-F318 HydrophobicContact CB-CD1 3.88Å; Q265-F318 HydrophobicContact CB-CD2 3.9Å; Q265-F318 HydrophobicContact CB-CE1 4Å; Q265-F318 HydrophobicContact CB-CE2 4.03Å; Q265-F318 HydrophobicContact CB-CG 3.83Å; Q265-F318 HydrophobicContact CB-CZ 4.08Å; Q265-F318 HydrophobicContact CG-CB 4.22Å; Q265-F318 HydrophobicContact CG-CD2 3.85Å; Q265-F318 HydrophobicContact CG-CE2 4.32Å; Q265-F318 HydrophobicContact CG-CG 3.96Å; M268-F318 HydrophobicContact CE-CZ 4.37Å; M268-F318 HydrophobicContact CG-CE2 4.08Å; M268-F318 HydrophobicContact CG-CZ 4.45Å; F308-F318 AromaticContact CD1-CE1 3.71Å; F308-F318 HydrophobicContact CD1-CE1 3.71Å; F308-F318 AromaticContact CD1-CZ 3.85Å; F308-F318 HydrophobicContact CD1-CZ 3.85Å; F308-F318 AromaticContact CE1-CE1 3.95Å; F308-F318 HydrophobicContact CE1-CE1 3.95Å; V313-F318 HydrophobicContact CB-CD2 4.12Å; V313-F318 HydrophobicContact CB-CE2 3.67Å; V313-F318 HydrophobicContact CB-CZ 3.94Å; V313-F318 HydrophobicContact CG1-CD1 4.16Å; V313-F318 HydrophobicContact CG1-CD2 3.62Å; V313-F318 HydrophobicContact CG1-CE1 4.22Å; V313-F318 HydrophobicContact CG1-CE2 3.68Å; V313-F318 HydrophobicContact CG1-CG 3.87Å; V313-F318 HydrophobicContact CG1-CZ 3.99Å; V313-F318 WeakPolarHBondContact O-CE2 3.45Å; D314-F318 VanDerWaalsContact O-CD2 3.26Å; D314-F318 WeakPolarHBondContact O-CD2 3.31Å; D314-F318 PolarHBondContact O-N 3.38Å; F318-K322 WeakPolarHBondContact O-CB 3.36Å; F318-K322 WeakPolarHBondContact O-CG 3.4Å; F318-K322 PolarHBondContact O-N 2.84Å |
| 319 | I | 80 | Confident | 85.3 | Confident | 46 Ų | 46 | 30.7 Ų | 30.7 | 24% | 0.236 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.3 | -46.8 | 176 | -69.4 | 163.1 | 0 | 0 | 0 | 110.8 | L193 Q315 S316 E317 K322 A323 | L193-I319 HydrophobicContact CB-CG2 3.94Å; L193-I319 HydrophobicContact CD1-CG2 3.61Å; L193-I319 HydrophobicContact CD2-CG2 3.63Å; L193-I319 HydrophobicContact CG-CG2 3.9Å; Q315-I319 HydrophobicContact CG-CD1 4.12Å; Q315-I319 WeakPolarHBondContact O-CD1 3.37Å; Q315-I319 WeakPolarHBondContact O-CG1 3.35Å; Q315-I319 PolarHBondContact O-N 2.76Å; Q315-I319 VanDerWaalsContact O-N 3.11Å; S316-I319 PolarHBondContact O-N 2.99Å; E317-I319 PolarHBondContact O-N 3.49Å; I319-K322 PolarHBondContact O-N 3.14Å; I319-A323 PolarHBondContact O-N 2.83Å; I319-A323 VanDerWaalsContact O-N 3.1Å |
| 320 | C | 84.4 | Confident | 85.5 | Confident | 8 Ų | 8 | 35.4 Ų | 35.4 | 5% | 0.054 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.3 | -43.4 | 177.3 | -63.6 | 0 | 0 | 0 | 0 | 112.4 | S316 E317 K322 A323 I324 L351 | S316-C320 PolarHBondContact O-N 3.43Å; S316-C320 PolarHBondContact O-SG 2.62Å; E317-C320 PolarHBondContact O-N 2.87Å; C320-K322 VanDerWaalsContact C-N 3.32Å; C320-K322 PolarHBondContact O-N 2.82Å; C320-A323 PolarHBondContact O-N 3.46Å; C320-A323 VanDerWaalsContact O-N 3.16Å; C320-I324 VanDerWaalsContact O-CG1 3.28Å; C320-I324 WeakPolarHBondContact O-CG1 2.9Å; C320-I324 PolarHBondContact O-N 3.32Å; C320-L351 HydrophobicContact CB-CB 3.94Å; C320-L351 HydrophobicContact CB-CD1 3.96Å; C320-L351 HydrophobicContact CB-CG 4.41Å |
| 321 | L | 90.3 | Very high | 85.6 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.9 | -39.2 | 177.7 | -72.7 | 172.5 | 0 | 0 | 0 | 111.7 | L261 F308 V313 E317 I324 A325 L351 L369 L373 | L261-L321 HydrophobicContact CD1-CB 4.39Å; L261-L321 HydrophobicContact CD2-CB 4.09Å; L261-L321 HydrophobicContact CD2-CD1 4.45Å; F308-L321 HydrophobicContact CE1-CD1 4.48Å; V313-L321 HydrophobicContact CG1-CD1 3.87Å; E317-L321 VanDerWaalsContact O-CB 3.31Å; E317-L321 WeakPolarHBondContact O-CB 3.21Å; E317-L321 WeakPolarHBondContact O-CG 3.17Å; E317-L321 PolarHBondContact O-N 2.98Å; L321-I324 PolarHBondContact O-N 3.4Å; L321-A325 VanDerWaalsContact O-CB 3.3Å; L321-A325 WeakPolarHBondContact O-CB 3.49Å; L321-A325 PolarHBondContact O-N 3.09Å; L321-L351 HydrophobicContact CD2-CD2 4.36Å; L321-L369 HydrophobicContact CD1-CD2 4.38Å; L321-L369 HydrophobicContact CD2-CB 4.38Å; L321-L369 WeakPolarHBondContact CD2-O 3.46Å; L321-L373 HydrophobicContact CB-CD2 4.18Å; L321-L373 HydrophobicContact CD2-CD1 4.02Å; L321-L373 HydrophobicContact CD2-CD2 3.95Å; L321-L373 HydrophobicContact CD2-CG 3.87Å |
| 322 | K | 84.5 | Confident | 85.7 | Confident | 23 Ų | 23 | 40 Ų | 40 | 10% | 0.1 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.2 | -42.2 | 173.3 | -73.7 | 171.6 | -172.5 | -172.5 | 0 | 112.3 | V200 L258 L261 F318 I319 C320 A325 L326 | V200-K322 HydrophobicContact CG1-CD 4.39Å; L258-K322 HydrophobicContact CD2-CB 3.76Å; L258-K322 HydrophobicContact CD2-CG 3.98Å; L258-K322 WeakPolarHBondContact CD2-O 3.34Å; L261-K322 HydrophobicContact CB-CD 4.47Å; L261-K322 HydrophobicContact CB-CG 3.81Å; L261-K322 HydrophobicContact CD1-CB 4.43Å; L261-K322 HydrophobicContact CD1-CG 3.75Å; L261-K322 HydrophobicContact CG-CG 4.38Å; F318-K322 WeakPolarHBondContact O-CB 3.36Å; F318-K322 WeakPolarHBondContact O-CG 3.4Å; F318-K322 PolarHBondContact O-N 2.84Å; I319-K322 PolarHBondContact O-N 3.14Å; C320-K322 VanDerWaalsContact C-N 3.32Å; C320-K322 PolarHBondContact O-N 2.82Å; K322-A325 PolarHBondContact O-N 2.93Å; K322-L326 VanDerWaalsContact O-CB 3.29Å; K322-L326 WeakPolarHBondContact O-CB 3.47Å; K322-L326 PolarHBondContact O-N 3.28Å |
| 323 | A | 79.9 | Confident | 85.7 | Confident | 4 Ų | 4 | 39.8 Ų | 39.8 | 3% | 0.033 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.7 | -41.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | L193 I319 C320 L326 F327 A347 | L193-A323 HydrophobicContact CD2-CB 3.72Å; I319-A323 PolarHBondContact O-N 2.83Å; I319-A323 VanDerWaalsContact O-N 3.1Å; C320-A323 PolarHBondContact O-N 3.46Å; C320-A323 VanDerWaalsContact O-N 3.16Å; A323-L326 PolarHBondContact O-N 3.1Å; A323-F327 HydrophobicContact CB-CD2 4.16Å; A323-F327 HydrophobicContact CB-CE2 3.96Å; A323-F327 WeakPolarHBondContact O-CB 3.26Å; A323-F327 WeakPolarHBondContact O-CD2 3.42Å; A323-F327 WeakPolarHBondContact O-CG 3.24Å; A323-F327 PolarHBondContact O-N 3.02Å; A323-A347 HydrophobicContact CB-CB 3.61Å |
| 324 | I | 88.4 | Confident | 85.3 | Confident | 16 Ų | 16 | 40.5 Ų | 40.5 | 8% | 0.082 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -66.4 | -37.3 | 174.3 | -61.4 | 163.1 | 0 | 0 | 0 | 111.2 | C320 L321 A347 V348 L351 L370 L373 | C320-I324 VanDerWaalsContact O-CG1 3.28Å; C320-I324 WeakPolarHBondContact O-CG1 2.9Å; C320-I324 PolarHBondContact O-N 3.32Å; L321-I324 PolarHBondContact O-N 3.4Å; I324-A347 HydrophobicContact CG1-CB 3.77Å; I324-V348 HydrophobicContact CD1-CG2 3.96Å; I324-V348 HydrophobicContact CG1-CG2 3.96Å; I324-L351 HydrophobicContact CD1-CD2 3.79Å; I324-L370 HydrophobicContact CD1-CD2 4Å; I324-L373 HydrophobicContact CB-CD1 4.02Å; I324-L373 HydrophobicContact CG2-CD1 3.52Å |
| 325 | A | 90.9 | Very high | 85.3 | Confident | 2 Ų | 2 | 43.2 Ų | 43.2 | 2% | 0.017 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.4 | -36 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | S254 D257 L261 L321 K322 R328 L373 | S254-A325 WeakPolarHBondContact CB-O 3.2Å; D257-A325 HydrophobicContact CB-CB 4.33Å; L261-A325 HydrophobicContact CD1-CB 3.98Å; L321-A325 VanDerWaalsContact O-CB 3.3Å; L321-A325 WeakPolarHBondContact O-CB 3.49Å; L321-A325 PolarHBondContact O-N 3.09Å; K322-A325 PolarHBondContact O-N 2.93Å; A325-R328 PolarHBondContact O-NE 3.4Å; A325-R328 PolarHBondContact O-NH2 3.23Å; A325-R328 VanDerWaalsContact O-NH2 3.14Å; A325-L373 HydrophobicContact CB-CD2 4.33Å |
| 326 | L | 86.7 | Confident | 85.3 | Confident | 10 Ų | 10 | 40.6 Ų | 40.6 | 5% | 0.052 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -78.1 | -48.8 | -179.8 | 175.7 | 64.9 | 0 | 0 | 0 | 112.9 | C196 L250 L251 L258 K322 A323 R328 | C196-L326 HydrophobicContact CB-CD2 4.12Å; L250-L326 HydrophobicContact CB-CD1 3.86Å; L250-L326 WeakPolarHBondContact CD2-O 3.41Å; L251-L326 HydrophobicContact CD2-CD1 3.96Å; L251-L326 HydrophobicContact CG-CD1 4.37Å; L258-L326 HydrophobicContact CD1-CB 4.44Å; L258-L326 HydrophobicContact CD1-CD1 4.13Å; L258-L326 HydrophobicContact CD2-CB 4.41Å; K322-L326 VanDerWaalsContact O-CB 3.29Å; K322-L326 WeakPolarHBondContact O-CB 3.47Å; K322-L326 PolarHBondContact O-N 3.28Å; A323-L326 PolarHBondContact O-N 3.1Å; L326-R328 PolarHBondContact O-N 3.36Å |
| 327 | F | 84.6 | Confident | 85.6 | Confident | 17 Ų | 17 | 40.5 Ų | 40.5 | 8% | 0.075 | 21% | 0.206 | C | C | . | . | trans | -80.5 | 85.1 | -174.4 | -60 | -45.7 | 0 | 0 | 0 | 111.2 | L250 A323 P329 V340 L343 Q344 | L250-F327 HydrophobicContact CD1-CD1 4.47Å; A323-F327 HydrophobicContact CB-CD2 4.16Å; A323-F327 HydrophobicContact CB-CE2 3.96Å; A323-F327 WeakPolarHBondContact O-CB 3.26Å; A323-F327 WeakPolarHBondContact O-CD2 3.42Å; A323-F327 WeakPolarHBondContact O-CG 3.24Å; A323-F327 PolarHBondContact O-N 3.02Å; F327-P329 WeakPolarHBondContact O-CD 3.41Å; F327-V340 HydrophobicContact CB-CG1 3.93Å; F327-L343 HydrophobicContact CB-CB 4.47Å; F327-L343 HydrophobicContact CD1-CB 4.06Å; F327-L343 HydrophobicContact CD1-CD1 4.24Å; F327-L343 HydrophobicContact CD2-CB 3.75Å; F327-L343 HydrophobicContact CE1-CB 4.21Å; F327-L343 HydrophobicContact CE1-CD1 3.95Å; F327-L343 HydrophobicContact CE2-CB 3.9Å; F327-L343 HydrophobicContact CG-CB 3.84Å; F327-L343 HydrophobicContact CZ-CB 4.13Å; F327-L343 HydrophobicContact CZ-CD1 4.27Å; F327-Q344 HydrophobicContact CB-CB 3.98Å; F327-Q344 WeakPolarHBondContact O-CG 3.48Å; F327-Q344 PolarHBondContact O-NE2 3.12Å | ||
| 328 | R | 87.2 | Confident | 85.3 | Confident | 30 Ų | 30 | 44.7 Ų | 44.7 | 11% | 0.113 | 23% | 0.231 | C | C | . | . | trans | -103.8 | 96.7 | 176.6 | -62.4 | -177.5 | -171.4 | -160.5 | -1.8 | 110.9 | L250 E253 D257 A325 L326 E330 A331 L334 | L250-R328 HydrophobicContact CD2-CB 4.37Å; E253-R328 VanDerWaalsContact O-CZ 3.32Å; E253-R328 PolarHBondContact O-NH1 2.85Å; D257-R328 IonicContact OD2-CZ 2.65Å; D257-R328 IonicContact OD2-NH1 2.74Å; D257-R328 IonicContact OD2-NH2 3.98Å; D257-R328 PolarHBondContact OD2-NH2 2.95Å; A325-R328 PolarHBondContact O-NE 3.4Å; A325-R328 PolarHBondContact O-NH2 3.23Å; A325-R328 VanDerWaalsContact O-NH2 3.14Å; L326-R328 PolarHBondContact O-N 3.36Å; R328-E330 PolarHBondContact O-N 3.15Å; R328-E330 VanDerWaalsContact O-N 3.15Å; R328-A331 HydrophobicContact CB-CB 4.26Å; R328-A331 WeakPolarHBondContact O-CB 3.26Å; R328-A331 PolarHBondContact O-N 3.28Å; R328-A331 VanDerWaalsContact O-N 3.12Å; R328-L334 VanDerWaalsContact O-CD1 3.27Å; R328-L334 WeakPolarHBondContact O-CD1 3.48Å | ||
| 329 | P | 88.1 | Confident | 84.8 | Confident | 20 Ų | 20 | 49.2 Ų | 49.2 | 13% | 0.13 | 25% | 0.253 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -17.2 | 177.5 | 26.3 | -33.8 | 0 | 0 | 0 | 113.6 | F327 A331 P337 V340 E341 Q344 | F327-P329 WeakPolarHBondContact O-CD 3.41Å; P329-A331 VanDerWaalsContact C-N 3.34Å; P329-P337 HydrophobicContact CB-CB 4.47Å; P329-P337 WeakPolarHBondContact CB-O 3.2Å; P329-P337 VanDerWaalsContact O-CB 3.24Å; P329-P337 WeakPolarHBondContact O-CB 3.38Å; P329-V340 HydrophobicContact CB-CB 4.33Å; P329-V340 HydrophobicContact CB-CG1 4.46Å; P329-E341 HydrophobicContact CB-CB 3.88Å; P329-E341 HydrophobicContact CG-CB 4.11Å; P329-E341 HydrophobicContact CG-CG 4.49Å; P329-Q344 VanDerWaalsContact CD-NE2 3.34Å |
| 330 | E | 92 | Very high | 84.4 | Confident | 139 Ų | 139 | 47.5 Ų | 47.5 | 65% | 0.65 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -82.3 | -6.5 | 177.2 | -48.4 | 82.2 | 177 | 0 | 0 | 113.8 | R328 R332 | R328-E330 PolarHBondContact O-N 3.15Å; R328-E330 VanDerWaalsContact O-N 3.15Å; E330-R332 PolarHBondContact O-N 3.47Å |
| 331 | A | 89.1 | Confident | 84.3 | Confident | 10 Ų | 10 | 51.7 Ų | 51.7 | 8% | 0.083 | 26% | 0.263 | C | S | . | . | trans | -62.4 | 136.5 | -178 | 0 | 0 | 0 | 0 | 0 | 111.7 | I249 L250 E253 R328 P329 L334 | I249-A331 HydrophobicContact CG2-CB 3.87Å; L250-A331 HydrophobicContact CD2-CB 4.12Å; E253-A331 HydrophobicContact CG-CB 4.25Å; R328-A331 HydrophobicContact CB-CB 4.26Å; R328-A331 WeakPolarHBondContact O-CB 3.26Å; R328-A331 PolarHBondContact O-N 3.28Å; R328-A331 VanDerWaalsContact O-N 3.12Å; P329-A331 VanDerWaalsContact C-N 3.34Å; A331-L334 HydrophobicContact CB-CD1 3.89Å; A331-L334 HydrophobicContact CB-CG 4.07Å; A331-L334 WeakPolarHBondContact O-CG 3.26Å | ||
| 332 | R | 89 | Confident | 83.5 | Confident | 218 Ų | 218 | 54 Ų | 54 | 82% | 0.823 | 28% | 0.277 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74 | 133 | -172.2 | -65.3 | 179.5 | 178.4 | 179.6 | 1 | 110.8 | I249 E330 | I249-R332 WeakPolarHBondContact CG2-O 3.35Å; E330-R332 PolarHBondContact O-N 3.47Å |
| 333 | G | 86.1 | Confident | 82.9 | Confident | 59 Ų | 59 | 55.1 Ų | 55.1 | 61% | 0.608 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90.2 | 2.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 334 | L | 80.3 | Confident | 83 | Confident | 23 Ų | 23 | 57.1 Ų | 57.1 | 12% | 0.12 | 29% | 0.293 | C | S | . | . | trans | -61.2 | 135.4 | 172.1 | -69.7 | 178.2 | 0 | 0 | 0 | 112.3 | I249 L250 R328 A331 P337 V340 | I249-L334 HydrophobicContact CG2-CD2 4.18Å; I249-L334 HydrophobicContact CG2-CG 4.46Å; L250-L334 HydrophobicContact CD1-CD2 4.48Å; L250-L334 HydrophobicContact CD2-CD1 4.19Å; L250-L334 HydrophobicContact CD2-CD2 4.02Å; L250-L334 HydrophobicContact CG-CD2 4.01Å; R328-L334 VanDerWaalsContact O-CD1 3.27Å; R328-L334 WeakPolarHBondContact O-CD1 3.48Å; A331-L334 HydrophobicContact CB-CD1 3.89Å; A331-L334 HydrophobicContact CB-CG 4.07Å; A331-L334 WeakPolarHBondContact O-CG 3.26Å; L334-P337 HydrophobicContact CB-CB 4.4Å; L334-P337 HydrophobicContact CD1-CB 4.35Å; L334-V340 HydrophobicContact CD1-CB 4.35Å; L334-V340 HydrophobicContact CD1-CG2 3.95Å; L334-V340 HydrophobicContact CD2-CG2 4.3Å | ||
| 335 | K | 81.1 | Confident | 82.5 | Confident | 110 Ų | 110 | 61.2 Ų | 61.2 | 48% | 0.478 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -81.3 | -32.3 | 179.3 | -64.3 | -174.4 | 179.4 | -179.8 | 0 | 114.5 | N242 | N242-K335 PolarHBondContact O-NZ 3.18Å; N242-K335 PolarHBondContact OD1-NZ 3.21Å |
| 336 | D | 78.4 | Confident | 81.7 | Confident | 60 Ų | 60 | 65 Ų | 65 | 32% | 0.321 | 33% | 0.332 | S | S | . | . | trans | -138 | 77.7 | 176.6 | -173.9 | -9.5 | 0 | 0 | 0 | 108.5 | K163 V338 Q339 V340 | K163-D336 IonicContact NZ-OD2 2.92Å; K163-D336 PolarHBondContact NZ-OD2 2.95Å; D336-V338 PolarHBondContact O-N 2.85Å; D336-V338 PolarHBondContact OD1-N 3.46Å; D336-Q339 HydrophobicContact CB-CB 4.09Å; D336-Q339 VanDerWaalsContact CG-CB 3.49Å; D336-Q339 WeakPolarHBondContact O-CB 3.48Å; D336-Q339 PolarHBondContact O-N 3.16Å; D336-Q339 VanDerWaalsContact O-N 3.15Å; D336-Q339 PolarHBondContact OD1-N 3.12Å; D336-Q339 WeakPolarHBondContact OD2-CB 3.28Å; D336-Q339 PolarHBondContact OD2-OE1 3.25Å; D336-V340 PolarHBondContact O-N 2.86Å | ||
| 337 | P | 84.2 | Confident | 81.2 | Confident | 54 Ų | 54 | 64.9 Ų | 64.9 | 35% | 0.351 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.6 | -29 | 179.5 | 25.6 | -34.3 | 0 | 0 | 0 | 112 | P329 L334 Q339 V340 E341 | P329-P337 HydrophobicContact CB-CB 4.47Å; P329-P337 WeakPolarHBondContact CB-O 3.2Å; P329-P337 VanDerWaalsContact O-CB 3.24Å; P329-P337 WeakPolarHBondContact O-CB 3.38Å; L334-P337 HydrophobicContact CB-CB 4.4Å; L334-P337 HydrophobicContact CD1-CB 4.35Å; P337-Q339 VanDerWaalsContact C-N 3.28Å; P337-Q339 PolarHBondContact O-N 2.85Å; P337-V340 WeakPolarHBondContact O-CA 3.33Å; P337-V340 WeakPolarHBondContact O-CB 3.35Å; P337-V340 PolarHBondContact O-N 3.25Å; P337-E341 PolarHBondContact O-N 2.84Å |
| 338 | V | 82.4 | Confident | 81.3 | Confident | 87 Ų | 87 | 66 Ų | 66 | 53% | 0.527 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.4 | -33.1 | 175.8 | -177.1 | 0 | 0 | 0 | 0 | 111.2 | D336 V342 | D336-V338 PolarHBondContact O-N 2.85Å; D336-V338 PolarHBondContact OD1-N 3.46Å; V338-V342 WeakPolarHBondContact O-CG2 3.33Å; V338-V342 PolarHBondContact O-N 3.43Å |
| 339 | Q | 73.8 | Confident | 81 | Confident | 97 Ų | 97 | 69.8 Ų | 69.8 | 45% | 0.453 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68 | -35.8 | 171.1 | -175.8 | 158.7 | -27.5 | 0 | 0 | 112.7 | D336 P337 V342 L343 | D336-Q339 HydrophobicContact CB-CB 4.09Å; D336-Q339 VanDerWaalsContact CG-CB 3.49Å; D336-Q339 WeakPolarHBondContact O-CB 3.48Å; D336-Q339 PolarHBondContact O-N 3.16Å; D336-Q339 VanDerWaalsContact O-N 3.15Å; D336-Q339 PolarHBondContact OD1-N 3.12Å; D336-Q339 WeakPolarHBondContact OD2-CB 3.28Å; D336-Q339 PolarHBondContact OD2-OE1 3.25Å; P337-Q339 VanDerWaalsContact C-N 3.28Å; P337-Q339 PolarHBondContact O-N 2.85Å; Q339-V342 PolarHBondContact O-N 3.26Å; Q339-L343 WeakPolarHBondContact O-CG 3.33Å; Q339-L343 PolarHBondContact O-N 3.03Å |
| 340 | V | 71.9 | Confident | 80.4 | Confident | 11 Ų | 11 | 71.5 Ų | 71.5 | 7% | 0.067 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -69.7 | -39.9 | 176 | -176.9 | 0 | 0 | 0 | 0 | 110.6 | L250 F327 P329 L334 D336 P337 V342 L343 Q344 | L250-V340 HydrophobicContact CD1-CG1 4.24Å; L250-V340 HydrophobicContact CD1-CG2 4.15Å; L250-V340 HydrophobicContact CD2-CG1 4.03Å; F327-V340 HydrophobicContact CB-CG1 3.93Å; P329-V340 HydrophobicContact CB-CB 4.33Å; P329-V340 HydrophobicContact CB-CG1 4.46Å; L334-V340 HydrophobicContact CD1-CB 4.35Å; L334-V340 HydrophobicContact CD1-CG2 3.95Å; L334-V340 HydrophobicContact CD2-CG2 4.3Å; D336-V340 PolarHBondContact O-N 2.86Å; P337-V340 WeakPolarHBondContact O-CA 3.33Å; P337-V340 WeakPolarHBondContact O-CB 3.35Å; P337-V340 PolarHBondContact O-N 3.25Å; V340-V342 PolarHBondContact O-N 3.27Å; V340-L343 PolarHBondContact O-N 3.04Å; V340-L343 VanDerWaalsContact O-N 3.14Å; V340-Q344 PolarHBondContact O-N 3.08Å |
| 341 | E | 81 | Confident | 80 | Confident | 95 Ų | 95 | 64.9 Ų | 64.9 | 44% | 0.444 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -57.5 | -46.5 | 173 | -171.7 | -179.5 | -163.4 | 0 | 0 | 111.2 | P329 P337 L343 Q344 D345 | P329-E341 HydrophobicContact CB-CB 3.88Å; P329-E341 HydrophobicContact CG-CB 4.11Å; P329-E341 HydrophobicContact CG-CG 4.49Å; P337-E341 PolarHBondContact O-N 2.84Å; E341-L343 VanDerWaalsContact C-N 3.29Å; E341-L343 PolarHBondContact O-N 3.13Å; E341-Q344 WeakPolarHBondContact O-CB 3.44Å; E341-Q344 PolarHBondContact O-N 2.99Å; E341-Q344 VanDerWaalsContact O-N 3.16Å; E341-D345 WeakPolarHBondContact O-CB 3.35Å; E341-D345 PolarHBondContact O-N 3.13Å |
| 342 | V | 73 | Confident | 79.9 | Confident | 48 Ų | 48 | 66.2 Ų | 66.2 | 29% | 0.291 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.2 | -33.2 | 175.8 | 169.4 | 0 | 0 | 0 | 0 | 112.9 | L165 V338 Q339 V340 Q346 | L165-V342 HydrophobicContact CD1-CG1 4.4Å; V338-V342 WeakPolarHBondContact O-CG2 3.33Å; V338-V342 PolarHBondContact O-N 3.43Å; Q339-V342 PolarHBondContact O-N 3.26Å; V340-V342 PolarHBondContact O-N 3.27Å; V342-Q346 VanDerWaalsContact O-CG 3.23Å; V342-Q346 WeakPolarHBondContact O-CG 3.5Å; V342-Q346 PolarHBondContact O-N 3.49Å |
| 343 | L | 73.2 | Confident | 79.6 | Confident | 48 Ų | 48 | 57.6 Ų | 57.6 | 25% | 0.251 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -75.1 | -36.5 | 175.2 | -68.9 | 169.1 | 0 | 0 | 0 | 111.8 | F327 Q339 V340 E341 Q346 A347 | F327-L343 HydrophobicContact CB-CB 4.47Å; F327-L343 HydrophobicContact CD1-CB 4.06Å; F327-L343 HydrophobicContact CD1-CD1 4.24Å; F327-L343 HydrophobicContact CD2-CB 3.75Å; F327-L343 HydrophobicContact CE1-CB 4.21Å; F327-L343 HydrophobicContact CE1-CD1 3.95Å; F327-L343 HydrophobicContact CE2-CB 3.9Å; F327-L343 HydrophobicContact CG-CB 3.84Å; F327-L343 HydrophobicContact CZ-CB 4.13Å; F327-L343 HydrophobicContact CZ-CD1 4.27Å; Q339-L343 WeakPolarHBondContact O-CG 3.33Å; Q339-L343 PolarHBondContact O-N 3.03Å; V340-L343 PolarHBondContact O-N 3.04Å; V340-L343 VanDerWaalsContact O-N 3.14Å; E341-L343 VanDerWaalsContact C-N 3.29Å; E341-L343 PolarHBondContact O-N 3.13Å; L343-Q346 PolarHBondContact O-N 3.36Å; L343-A347 PolarHBondContact O-N 3.47Å |
| 344 | Q | 81.9 | Confident | 79.3 | Confident | 45 Ų | 45 | 57.1 Ų | 57.1 | 21% | 0.21 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.9 | -48.8 | 172.4 | -168.5 | -170.2 | 78.7 | 0 | 0 | 110.9 | F327 P329 V340 E341 Q346 A347 V348 | F327-Q344 HydrophobicContact CB-CB 3.98Å; F327-Q344 WeakPolarHBondContact O-CG 3.48Å; F327-Q344 PolarHBondContact O-NE2 3.12Å; P329-Q344 VanDerWaalsContact CD-NE2 3.34Å; V340-Q344 PolarHBondContact O-N 3.08Å; E341-Q344 WeakPolarHBondContact O-CB 3.44Å; E341-Q344 PolarHBondContact O-N 2.99Å; E341-Q344 VanDerWaalsContact O-N 3.16Å; Q344-Q346 VanDerWaalsContact C-N 3.27Å; Q344-Q346 PolarHBondContact O-N 3.09Å; Q344-A347 PolarHBondContact O-N 3.37Å; Q344-A347 VanDerWaalsContact O-N 3.09Å; Q344-V348 WeakPolarHBondContact O-CG2 3.29Å; Q344-V348 PolarHBondContact O-N 2.91Å |
| 345 | D | 78.7 | Confident | 79.6 | Confident | 102 Ų | 102 | 56.1 Ų | 56.1 | 55% | 0.545 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -53.9 | -42.3 | 174.1 | -95.8 | -6.6 | 0 | 0 | 0 | 112.1 | E341 Y349 | E341-D345 WeakPolarHBondContact O-CB 3.35Å; E341-D345 PolarHBondContact O-N 3.13Å; D345-Y349 VanDerWaalsContact O-CB 3.31Å; D345-Y349 WeakPolarHBondContact O-CB 3.29Å; D345-Y349 PolarHBondContact O-N 3.49Å |
| 346 | Q | 73.3 | Confident | 79.8 | Confident | 81 Ų | 81 | 54.9 Ų | 54.9 | 38% | 0.379 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.8 | -44.5 | 176.2 | -75.7 | 170.4 | 18 | 0 | 0 | 111.8 | V342 L343 Q344 Y349 M350 | V342-Q346 VanDerWaalsContact O-CG 3.23Å; V342-Q346 WeakPolarHBondContact O-CG 3.5Å; V342-Q346 PolarHBondContact O-N 3.49Å; L343-Q346 PolarHBondContact O-N 3.36Å; Q344-Q346 VanDerWaalsContact C-N 3.27Å; Q344-Q346 PolarHBondContact O-N 3.09Å; Q346-Y349 PolarHBondContact O-N 2.88Å; Q346-M350 VanDerWaalsContact O-CG 3.3Å; Q346-M350 WeakPolarHBondContact O-CG 3.34Å; Q346-M350 PolarHBondContact O-N 3.13Å |
| 347 | A | 75.8 | Confident | 79.8 | Confident | 9 Ų | 9 | 55 Ų | 55 | 7% | 0.074 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.1 | -40.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.4 | A323 I324 L343 Q344 M350 L351 | A323-A347 HydrophobicContact CB-CB 3.61Å; I324-A347 HydrophobicContact CG1-CB 3.77Å; L343-A347 PolarHBondContact O-N 3.47Å; Q344-A347 PolarHBondContact O-N 3.37Å; Q344-A347 VanDerWaalsContact O-N 3.09Å; A347-M350 PolarHBondContact O-N 3.21Å; A347-L351 PolarHBondContact O-N 2.94Å |
| 348 | V | 87.2 | Confident | 79.2 | Confident | 40 Ų | 40 | 53.7 Ų | 53.7 | 24% | 0.242 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.7 | -45.2 | 173.6 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | I324 Q344 M350 L351 V352 F366 | I324-V348 HydrophobicContact CD1-CG2 3.96Å; I324-V348 HydrophobicContact CG1-CG2 3.96Å; Q344-V348 WeakPolarHBondContact O-CG2 3.29Å; Q344-V348 PolarHBondContact O-N 2.91Å; V348-M350 PolarHBondContact O-N 3.32Å; V348-L351 WeakPolarHBondContact O-CB 3.48Å; V348-L351 PolarHBondContact O-N 3.16Å; V348-V352 WeakPolarHBondContact O-CG2 3.43Å; V348-V352 PolarHBondContact O-N 3.21Å; V348-F366 HydrophobicContact CG1-CE2 4.01Å; V348-F366 HydrophobicContact CG1-CZ 3.8Å |
| 349 | Y | 81.4 | Confident | 78.1 | Confident | 110 Ų | 110 | 58.3 Ų | 58.3 | 43% | 0.431 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61 | -44.7 | 176.7 | 174.4 | -102.6 | 0 | 0 | 0 | 112.1 | N170 D345 Q346 L351 V352 Q353 | N170-Y349 PolarHBondContact O-OH 3.18Å; D345-Y349 VanDerWaalsContact O-CB 3.31Å; D345-Y349 WeakPolarHBondContact O-CB 3.29Å; D345-Y349 PolarHBondContact O-N 3.49Å; Q346-Y349 PolarHBondContact O-N 2.88Å; Y349-L351 VanDerWaalsContact C-N 3.31Å; Y349-L351 PolarHBondContact O-N 3.2Å; Y349-V352 WeakPolarHBondContact O-CB 3.4Å; Y349-V352 PolarHBondContact O-N 2.83Å; Y349-Q353 HydrophobicContact CD1-CG 4.18Å; Y349-Q353 HydrophobicContact CD2-CG 4.32Å; Y349-Q353 HydrophobicContact CE1-CG 3.69Å; Y349-Q353 HydrophobicContact CE2-CG 3.83Å; Y349-Q353 HydrophobicContact CG-CG 4.48Å; Y349-Q353 VanDerWaalsContact CZ-CG 3.49Å; Y349-Q353 WeakPolarHBondContact O-CG 3.39Å; Y349-Q353 PolarHBondContact O-N 2.65Å |
| 350 | M | 74.7 | Confident | 77.7 | Confident | 56 Ų | 56 | 59.9 Ų | 59.9 | 28% | 0.276 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -58.7 | -42.7 | 175.1 | -71.4 | -61.4 | -65.5 | 0 | 0 | 111.7 | L186 Q346 A347 V348 Q353 H354 | L186-M350 HydrophobicContact CD1-CE 4.37Å; Q346-M350 VanDerWaalsContact O-CG 3.3Å; Q346-M350 WeakPolarHBondContact O-CG 3.34Å; Q346-M350 PolarHBondContact O-N 3.13Å; A347-M350 PolarHBondContact O-N 3.21Å; V348-M350 PolarHBondContact O-N 3.32Å; M350-Q353 PolarHBondContact O-N 3.01Å; M350-H354 WeakPolarHBondContact O-CB 3.48Å; M350-H354 PolarHBondContact O-N 3.26Å |
| 351 | L | 83 | Confident | 77.8 | Confident | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63 | -42.1 | 175.1 | -171.4 | 59.8 | 0 | 0 | 0 | 112.1 | E317 C320 L321 I324 A347 V348 Y349 H354 C355 F366 L369 L370 | E317-L351 HydrophobicContact CB-CD1 4.3Å; E317-L351 HydrophobicContact CG-CD1 4.01Å; C320-L351 HydrophobicContact CB-CB 3.94Å; C320-L351 HydrophobicContact CB-CD1 3.96Å; C320-L351 HydrophobicContact CB-CG 4.41Å; L321-L351 HydrophobicContact CD2-CD2 4.36Å; I324-L351 HydrophobicContact CD1-CD2 3.79Å; A347-L351 PolarHBondContact O-N 2.94Å; V348-L351 WeakPolarHBondContact O-CB 3.48Å; V348-L351 PolarHBondContact O-N 3.16Å; Y349-L351 VanDerWaalsContact C-N 3.31Å; Y349-L351 PolarHBondContact O-N 3.2Å; L351-H354 PolarHBondContact O-N 2.96Å; L351-C355 WeakPolarHBondContact O-CB 3.38Å; L351-C355 PolarHBondContact O-N 2.74Å; L351-C355 PolarHBondContact O-SG 3.3Å; L351-F366 HydrophobicContact CB-CD2 4.4Å; L351-F366 HydrophobicContact CB-CE2 4.37Å; L351-F366 HydrophobicContact CD2-CD2 4.07Å; L351-F366 HydrophobicContact CD2-CE2 4.12Å; L351-F366 HydrophobicContact CG-CD2 3.97Å; L351-F366 HydrophobicContact CG-CE2 4.27Å; L351-L369 HydrophobicContact CD1-CD1 3.99Å; L351-L369 HydrophobicContact CD2-CB 4.43Å; L351-L370 HydrophobicContact CD2-CD2 3.99Å |
| 352 | V | 88.1 | Confident | 77.4 | Confident | 37 Ų | 37 | 61.7 Ų | 61.7 | 22% | 0.224 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.8 | -46.6 | 174.7 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | V348 Y349 C355 Q356 F366 | V348-V352 WeakPolarHBondContact O-CG2 3.43Å; V348-V352 PolarHBondContact O-N 3.21Å; Y349-V352 WeakPolarHBondContact O-CB 3.4Å; Y349-V352 PolarHBondContact O-N 2.83Å; V352-C355 PolarHBondContact O-N 3.42Å; V352-Q356 HydrophobicContact CG1-CG 4.26Å; V352-Q356 WeakPolarHBondContact O-CB 3.42Å; V352-Q356 VanDerWaalsContact O-CG 3.23Å; V352-Q356 WeakPolarHBondContact O-CG 3.46Å; V352-Q356 PolarHBondContact O-N 2.97Å; V352-F366 HydrophobicContact CB-CD2 4.47Å; V352-F366 HydrophobicContact CG2-CD1 4.38Å; V352-F366 HydrophobicContact CG2-CD2 3.57Å; V352-F366 HydrophobicContact CG2-CE1 4.16Å; V352-F366 HydrophobicContact CG2-CE2 3.32Å; V352-F366 HydrophobicContact CG2-CG 4.1Å; V352-F366 HydrophobicContact CG2-CZ 3.62Å |
| 353 | Q | 82.2 | Confident | 77.4 | Confident | 37 Ų | 37 | 65.6 Ų | 65.6 | 17% | 0.173 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.7 | -44.3 | 178.7 | -68.7 | -54 | -77.8 | 0 | 0 | 111.9 | Y349 M350 Q356 A357 | Y349-Q353 HydrophobicContact CD1-CG 4.18Å; Y349-Q353 HydrophobicContact CD2-CG 4.32Å; Y349-Q353 HydrophobicContact CE1-CG 3.69Å; Y349-Q353 HydrophobicContact CE2-CG 3.83Å; Y349-Q353 HydrophobicContact CG-CG 4.48Å; Y349-Q353 VanDerWaalsContact CZ-CG 3.49Å; Y349-Q353 WeakPolarHBondContact O-CG 3.39Å; Y349-Q353 PolarHBondContact O-N 2.65Å; M350-Q353 PolarHBondContact O-N 3.01Å; Q353-Q356 PolarHBondContact O-N 3.44Å; Q353-A357 PolarHBondContact O-N 3.5Å |
| 354 | H | 80.5 | Confident | 78 | Confident | 50 Ų | 50 | 68.9 Ų | 68.9 | 23% | 0.231 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -64.6 | -42.4 | 177.2 | -171.8 | 80.4 | 0 | 0 | 0 | 112.5 | D314 S316 E317 M350 L351 Q356 A357 S358 | D314-H354 IonicContact OD1-CE1 3.86Å; D314-H354 IonicContact OD1-NE2 2.71Å; D314-H354 PolarHBondContact OD1-NE2 3.43Å; D314-H354 IonicContact OD2-CD2 3.98Å; D314-H354 IonicContact OD2-CE1 2.67Å; D314-H354 IonicContact OD2-NE2 3.88Å; D314-H354 PolarHBondContact OD2-NE2 3.41Å; S316-H354 VanDerWaalsContact CB-CE1 3.47Å; S316-H354 WeakPolarHBondContact CB-CE1 3.46Å; E317-H354 VanDerWaalsContact CG-CD2 3.46Å; E317-H354 WeakPolarHBondContact CG-CD2 3.46Å; E317-H354 IonicContact OE1-CD2 3.29Å; E317-H354 IonicContact OE1-NE2 3.97Å; M350-H354 WeakPolarHBondContact O-CB 3.48Å; M350-H354 PolarHBondContact O-N 3.26Å; L351-H354 PolarHBondContact O-N 2.96Å; H354-Q356 VanDerWaalsContact C-N 3.34Å; H354-Q356 PolarHBondContact O-N 3.29Å; H354-A357 PolarHBondContact O-N 2.97Å; H354-S358 PolarHBondContact O-N 2.92Å; H354-S358 PolarHBondContact O-OG 2.75Å |
| 355 | C | 86.7 | Confident | 78.4 | Confident | 1 Ų | 1 | 69 Ų | 69 | 1% | 0.007 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -64.4 | -35.9 | 173.1 | -68.2 | 0 | 0 | 0 | 0 | 112.6 | L351 V352 S358 P362 R365 F366 | L351-C355 WeakPolarHBondContact O-CB 3.38Å; L351-C355 PolarHBondContact O-N 2.74Å; L351-C355 PolarHBondContact O-SG 3.3Å; V352-C355 PolarHBondContact O-N 3.42Å; C355-S358 VanDerWaalsContact O-CB 3.31Å; C355-S358 WeakPolarHBondContact O-CB 3.3Å; C355-S358 PolarHBondContact O-N 2.69Å; C355-P362 WeakPolarHBondContact O-CA 3.31Å; C355-P362 WeakPolarHBondContact O-CB 3.34Å; C355-R365 HydrophobicContact CB-CB 4.43Å; C355-F366 HydrophobicContact CB-CB 4.03Å; C355-F366 VanDerWaalsContact SG-CA 3.58Å |
| 356 | Q | 84.4 | Confident | 79 | Confident | 84 Ų | 84 | 66.7 Ų | 66.7 | 39% | 0.393 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -70.9 | -29.7 | 176.6 | -76.8 | 174.4 | -8.7 | 0 | 0 | 112.9 | V352 Q353 H354 S358 | V352-Q356 HydrophobicContact CG1-CG 4.26Å; V352-Q356 WeakPolarHBondContact O-CB 3.42Å; V352-Q356 VanDerWaalsContact O-CG 3.23Å; V352-Q356 WeakPolarHBondContact O-CG 3.46Å; V352-Q356 PolarHBondContact O-N 2.97Å; Q353-Q356 PolarHBondContact O-N 3.44Å; H354-Q356 VanDerWaalsContact C-N 3.34Å; H354-Q356 PolarHBondContact O-N 3.29Å; Q356-S358 VanDerWaalsContact C-N 3.29Å |
| 357 | A | 77.5 | Confident | 80 | Confident | 63 Ų | 63 | 64.2 Ų | 64.2 | 52% | 0.521 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -75.9 | -17.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q353 H354 | Q353-A357 PolarHBondContact O-N 3.5Å; H354-A357 PolarHBondContact O-N 2.97Å |
| 358 | S | 72.2 | Confident | 80.8 | Confident | 26 Ų | 26 | 70.4 Ų | 70.4 | 18% | 0.182 | 36% | 0.363 | C | S | . | . | trans | -73.6 | 130.7 | 178.1 | -61.9 | 0 | 0 | 0 | 0 | 111.7 | H354 C355 Q356 I360 | H354-S358 PolarHBondContact O-N 2.92Å; H354-S358 PolarHBondContact O-OG 2.75Å; C355-S358 VanDerWaalsContact O-CB 3.31Å; C355-S358 WeakPolarHBondContact O-CB 3.3Å; C355-S358 PolarHBondContact O-N 2.69Å; Q356-S358 VanDerWaalsContact C-N 3.29Å; S358-I360 PolarHBondContact O-N 3.02Å | ||
| 359 | Q | 59.4 | Low | 81.1 | Confident | 185 Ų | 185 | 68.5 Ų | 68.5 | 86% | 0.864 | 35% | 0.351 | S | S | * | . | S | Bend | trans | -71 | -14.1 | -175.2 | -62.3 | -64 | -35.1 | 0 | 0 | 114.5 | ||
| 360 | I | 66.2 | Low | 81.7 | Confident | 129 Ų | 129 | 65.8 Ų | 65.8 | 66% | 0.662 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -116.5 | 115.3 | -172.1 | -55.6 | 179.4 | 0 | 0 | 0 | 110.1 | S358 | S358-I360 PolarHBondContact O-N 3.02Š|
| 361 | N | 72.9 | Confident | 82.6 | Confident | 96 Ų | 96 | 68.9 Ų | 68.9 | 51% | 0.513 | 36% | 0.361 | S | S | . | . | trans | 45.2 | 54.8 | 173.8 | -64.3 | -28.7 | 0 | 0 | 0 | 114.7 | T363 Q364 R365 | N361-T363 VanDerWaalsContact C-N 3.3Å; N361-T363 PolarHBondContact O-N 3.33Å; N361-T363 VanDerWaalsContact O-N 3.15Å; N361-Q364 HydrophobicContact CB-CB 4.17Å; N361-Q364 HydrophobicContact CB-CG 4.42Å; N361-Q364 PolarHBondContact O-N 2.88Å; N361-R365 PolarHBondContact O-N 3.25Å | ||
| 362 | P | 73.2 | Confident | 83.2 | Confident | 49 Ų | 49 | 69.4 Ų | 69.4 | 32% | 0.318 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -53.7 | -42.4 | -170.1 | 20.7 | -34.4 | 0 | 0 | 0 | 113.5 | C355 Q364 R365 | C355-P362 WeakPolarHBondContact O-CA 3.31Å; C355-P362 WeakPolarHBondContact O-CB 3.34Å; P362-Q364 VanDerWaalsContact C-N 3.33Å; P362-Q364 PolarHBondContact O-N 3.22Å; P362-R365 PolarHBondContact O-N 3.24Å |
| 363 | T | 73.8 | Confident | 83.6 | Confident | 130 Ų | 130 | 68.2 Ų | 68.2 | 80% | 0.798 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -64.9 | -33.4 | 178.3 | -42.3 | 0 | 0 | 0 | 0 | 113.2 | N361 | N361-T363 VanDerWaalsContact C-N 3.3Å; N361-T363 PolarHBondContact O-N 3.33Å; N361-T363 VanDerWaalsContact O-N 3.15Å |
| 364 | Q | 85.6 | Confident | 84.2 | Confident | 117 Ų | 117 | 69.9 Ų | 69.9 | 55% | 0.547 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -86.3 | -32.1 | -179.2 | -57.8 | 179.7 | 9.7 | 0 | 0 | 111.9 | N361 P362 F366 G367 R368 | N361-Q364 HydrophobicContact CB-CB 4.17Å; N361-Q364 HydrophobicContact CB-CG 4.42Å; N361-Q364 PolarHBondContact O-N 2.88Å; P362-Q364 VanDerWaalsContact C-N 3.33Å; P362-Q364 PolarHBondContact O-N 3.22Å; Q364-F366 PolarHBondContact O-N 2.91Å; Q364-G367 PolarHBondContact O-N 3.33Å; Q364-R368 WeakPolarHBondContact O-CG 3.31Å; Q364-R368 PolarHBondContact O-N 3.32Å |
| 365 | R | 90.3 | Very high | 84.9 | Confident | 48 Ų | 48 | 69.5 Ų | 69.5 | 18% | 0.181 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -58.1 | -48.1 | -178.2 | -171.3 | 167.3 | -178.5 | 83.5 | 2.7 | 111.4 | C311 A312 D314 E317 C355 N361 P362 G367 R368 L369 | C311-R365 PolarHBondContact O-NH1 3.41Å; A312-R365 PolarHBondContact O-NH2 2.92Å; D314-R365 IonicContact OD2-NH2 3.26Å; E317-R365 IonicContact OE1-CZ 3.87Å; E317-R365 IonicContact OE1-NE 3.18Å; E317-R365 PolarHBondContact OE1-NE 3.2Å; E317-R365 IonicContact OE1-NH2 3.56Å; E317-R365 PolarHBondContact OE1-NH2 3.48Å; E317-R365 IonicContact OE2-CZ 2.69Å; E317-R365 IonicContact OE2-NE 3.59Å; E317-R365 IonicContact OE2-NH2 3.79Å; E317-R365 PolarHBondContact OE2-NH2 2.93Å; C355-R365 HydrophobicContact CB-CB 4.43Å; N361-R365 PolarHBondContact O-N 3.25Å; P362-R365 PolarHBondContact O-N 3.24Å; R365-G367 PolarHBondContact O-N 2.85Å; R365-R368 PolarHBondContact O-N 3.03Å; R365-L369 HydrophobicContact CG-CD1 3.85Å; R365-L369 VanDerWaalsContact O-CG 3.28Å; R365-L369 WeakPolarHBondContact O-CG 3.1Å; R365-L369 PolarHBondContact O-N 3.5Å |
| 366 | F | 91.7 | Very high | 85.3 | Confident | 52 Ų | 52 | 69.4 Ų | 69.4 | 23% | 0.228 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -54.3 | -50.6 | 174.5 | 174.7 | -107.3 | 0 | 0 | 0 | 112.7 | V348 L351 V352 C355 Q364 R368 L369 L370 | V348-F366 HydrophobicContact CG1-CE2 4.01Å; V348-F366 HydrophobicContact CG1-CZ 3.8Å; L351-F366 HydrophobicContact CB-CD2 4.4Å; L351-F366 HydrophobicContact CB-CE2 4.37Å; L351-F366 HydrophobicContact CD2-CD2 4.07Å; L351-F366 HydrophobicContact CD2-CE2 4.12Å; L351-F366 HydrophobicContact CG-CD2 3.97Å; L351-F366 HydrophobicContact CG-CE2 4.27Å; V352-F366 HydrophobicContact CB-CD2 4.47Å; V352-F366 HydrophobicContact CG2-CD1 4.38Å; V352-F366 HydrophobicContact CG2-CD2 3.57Å; V352-F366 HydrophobicContact CG2-CE1 4.16Å; V352-F366 HydrophobicContact CG2-CE2 3.32Å; V352-F366 HydrophobicContact CG2-CG 4.1Å; V352-F366 HydrophobicContact CG2-CZ 3.62Å; C355-F366 HydrophobicContact CB-CB 4.03Å; C355-F366 VanDerWaalsContact SG-CA 3.58Å; Q364-F366 PolarHBondContact O-N 2.91Å; F366-R368 PolarHBondContact O-N 3.45Å; F366-L369 PolarHBondContact O-N 3.49Å; F366-L370 HydrophobicContact CD1-CD1 4.36Å; F366-L370 HydrophobicContact CE1-CD1 3.64Å; F366-L370 HydrophobicContact CE1-CG 4.48Å; F366-L370 HydrophobicContact CE2-CD1 3.91Å; F366-L370 HydrophobicContact CE2-CD2 4.46Å; F366-L370 HydrophobicContact CE2-CG 4.12Å; F366-L370 HydrophobicContact CZ-CD1 3.38Å; F366-L370 HydrophobicContact CZ-CG 4.1Å; F366-L370 PolarHBondContact O-N 3.27Å |
| 367 | G | 92.4 | Very high | 85.6 | Confident | 29 Ų | 29 | 71.7 Ų | 71.7 | 30% | 0.299 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.2 | -42.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q364 R365 L369 L370 L371 | Q364-G367 PolarHBondContact O-N 3.33Å; R365-G367 PolarHBondContact O-N 2.85Å; G367-L369 PolarHBondContact O-N 2.9Å; G367-L370 PolarHBondContact O-N 2.95Å; G367-L371 VanDerWaalsContact O-CG 3.26Å; G367-L371 WeakPolarHBondContact O-CG 2.96Å; G367-L371 PolarHBondContact O-N 3.4Å; G367-L371 VanDerWaalsContact O-N 3.09Å |
| 368 | R | 92.5 | Very high | 86.4 | Confident | 139 Ų | 139 | 72.3 Ų | 72.3 | 53% | 0.525 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.4 | -42 | 177 | -73.4 | 178.2 | 68.2 | 118.6 | -2 | 112.2 | Q364 R365 F366 L371 L372 | Q364-R368 WeakPolarHBondContact O-CG 3.31Å; Q364-R368 PolarHBondContact O-N 3.32Å; R365-R368 PolarHBondContact O-N 3.03Å; F366-R368 PolarHBondContact O-N 3.45Å; R368-L371 PolarHBondContact O-N 2.99Å; R368-L372 PolarHBondContact O-N 3.06Å |
| 369 | L | 93.7 | Very high | 87.3 | Confident | 0 Ų | 0 | 71.4 Ų | 71.4 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -67.4 | -43.6 | 179.5 | -67.9 | 164.7 | 0 | 0 | 0 | 111.7 | V313 E317 L321 L351 R365 F366 G367 L371 L372 | V313-L369 HydrophobicContact CB-CD2 4.32Å; V313-L369 HydrophobicContact CG1-CD2 4.07Å; V313-L369 HydrophobicContact CG2-CD2 3.7Å; E317-L369 HydrophobicContact CB-CD1 4.36Å; E317-L369 HydrophobicContact CB-CD2 4.45Å; E317-L369 VanDerWaalsContact CD-CD1 3.45Å; E317-L369 HydrophobicContact CG-CD1 3.89Å; E317-L369 WeakPolarHBondContact OE1-CD1 3.32Å; L321-L369 HydrophobicContact CD1-CD2 4.38Å; L321-L369 HydrophobicContact CD2-CB 4.38Å; L321-L369 WeakPolarHBondContact CD2-O 3.46Å; L351-L369 HydrophobicContact CD1-CD1 3.99Å; L351-L369 HydrophobicContact CD2-CB 4.43Å; R365-L369 HydrophobicContact CG-CD1 3.85Å; R365-L369 VanDerWaalsContact O-CG 3.28Å; R365-L369 WeakPolarHBondContact O-CG 3.1Å; R365-L369 PolarHBondContact O-N 3.5Å; F366-L369 PolarHBondContact O-N 3.49Å; G367-L369 PolarHBondContact O-N 2.9Å; L369-L371 VanDerWaalsContact C-N 3.28Å; L369-L371 PolarHBondContact O-N 3.06Å; L369-L372 HydrophobicContact CD2-CD1 4.29Å; L369-L372 WeakPolarHBondContact O-CB 3.36Å; L369-L372 PolarHBondContact O-N 2.82Å; L369-L372 VanDerWaalsContact O-N 3.12Å |
| 370 | L | 94.3 | Very high | 88.8 | Confident | 53 Ų | 53 | 64.5 Ų | 64.5 | 28% | 0.277 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -61.5 | -36.2 | 174.4 | -72.2 | -171.3 | 0 | 0 | 0 | 112.7 | I324 L351 F366 G367 L372 L373 P374 | I324-L370 HydrophobicContact CD1-CD2 4Å; L351-L370 HydrophobicContact CD2-CD2 3.99Å; F366-L370 HydrophobicContact CD1-CD1 4.36Å; F366-L370 HydrophobicContact CE1-CD1 3.64Å; F366-L370 HydrophobicContact CE1-CG 4.48Å; F366-L370 HydrophobicContact CE2-CD1 3.91Å; F366-L370 HydrophobicContact CE2-CD2 4.46Å; F366-L370 HydrophobicContact CE2-CG 4.12Å; F366-L370 HydrophobicContact CZ-CD1 3.38Å; F366-L370 HydrophobicContact CZ-CG 4.1Å; F366-L370 PolarHBondContact O-N 3.27Å; G367-L370 PolarHBondContact O-N 2.95Å; L370-L372 PolarHBondContact O-N 3.01Å; L370-L373 HydrophobicContact CD2-CD1 4.42Å; L370-L373 PolarHBondContact O-N 2.82Å; L370-P374 WeakPolarHBondContact O-CD 3.11Å |
| 371 | L | 95 | Very high | 89.8 | Confident | 121 Ų | 121 | 60.3 Ų | 60.3 | 63% | 0.634 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -8.4 | 177 | -72.1 | 171.2 | 0 | 0 | 0 | 114.1 | G367 R368 L369 | G367-L371 VanDerWaalsContact O-CG 3.26Å; G367-L371 WeakPolarHBondContact O-CG 2.96Å; G367-L371 PolarHBondContact O-N 3.4Å; G367-L371 VanDerWaalsContact O-N 3.09Å; R368-L371 PolarHBondContact O-N 2.99Å; L369-L371 VanDerWaalsContact C-N 3.28Å; L369-L371 PolarHBondContact O-N 3.06Å |
| 372 | L | 95.6 | Very high | 90.5 | Very high | 11 Ų | 11 | 61.4 Ų | 61.4 | 6% | 0.058 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -30.6 | 170.4 | -61.7 | 174.5 | 0 | 0 | 0 | 112.4 | R307 F308 C311 V313 R368 L369 L370 L375 | R307-L372 HydrophobicContact CB-CD2 4.42Å; F308-L372 HydrophobicContact CD1-CD1 3.85Å; F308-L372 HydrophobicContact CD2-CD2 4.43Å; F308-L372 HydrophobicContact CE1-CB 4.15Å; F308-L372 HydrophobicContact CE1-CD1 3.78Å; F308-L372 HydrophobicContact CE2-CB 4.13Å; F308-L372 HydrophobicContact CE2-CD2 4.38Å; F308-L372 HydrophobicContact CG-CD1 4.25Å; F308-L372 HydrophobicContact CZ-CB 3.72Å; F308-L372 HydrophobicContact CZ-CD1 4.14Å; F308-L372 HydrophobicContact CZ-CG 4.39Å; C311-L372 HydrophobicContact CB-CD1 4.17Å; V313-L372 HydrophobicContact CG2-CD1 3.65Å; R368-L372 PolarHBondContact O-N 3.06Å; L369-L372 HydrophobicContact CD2-CD1 4.29Å; L369-L372 WeakPolarHBondContact O-CB 3.36Å; L369-L372 PolarHBondContact O-N 2.82Å; L369-L372 VanDerWaalsContact O-N 3.12Å; L370-L372 PolarHBondContact O-N 3.01Å; L372-L375 HydrophobicContact CD2-CD1 4.35Å; L372-L375 WeakPolarHBondContact O-CB 3.34Å; L372-L375 PolarHBondContact O-N 2.84Å; L372-L375 VanDerWaalsContact O-N 3.13Å |
| 373 | L | 95.4 | Very high | 91 | Very high | 13 Ų | 13 | 63.1 Ų | 63.1 | 7% | 0.068 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -65 | -41.2 | -175.7 | -63.2 | 174.9 | 0 | 0 | 0 | 113.8 | L261 L321 I324 A325 L370 L375 L376 | L261-L373 HydrophobicContact CD1-CD2 4.24Å; L321-L373 HydrophobicContact CB-CD2 4.18Å; L321-L373 HydrophobicContact CD2-CD1 4.02Å; L321-L373 HydrophobicContact CD2-CD2 3.95Å; L321-L373 HydrophobicContact CD2-CG 3.87Å; I324-L373 HydrophobicContact CB-CD1 4.02Å; I324-L373 HydrophobicContact CG2-CD1 3.52Å; A325-L373 HydrophobicContact CB-CD2 4.33Å; L370-L373 HydrophobicContact CD2-CD1 4.42Å; L370-L373 PolarHBondContact O-N 2.82Å; L373-L375 PolarHBondContact O-N 3.19Å; L373-L376 HydrophobicContact CD2-CD1 4.03Å; L373-L376 PolarHBondContact O-N 3.17Å |
| 374 | P | 95.6 | Very high | 91.4 | Very high | 72 Ų | 72 | 56.9 Ų | 56.9 | 47% | 0.468 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.9 | -26.7 | 172.6 | -25.3 | 35.5 | 0 | 0 | 0 | 113.9 | L370 L376 R377 | L370-P374 WeakPolarHBondContact O-CD 3.11Å; P374-L376 VanDerWaalsContact C-N 3.3Å; P374-L376 PolarHBondContact O-N 2.75Å; P374-R377 PolarHBondContact O-N 2.92Å |
| 375 | L | 94.9 | Very high | 91.1 | Very high | 41 Ų | 41 | 53 Ų | 53 | 22% | 0.215 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -76 | -15.5 | 178.9 | -56.2 | 178.6 | 0 | 0 | 0 | 113.4 | L304 L372 L373 T378 | L304-L375 WeakPolarHBondContact CD1-O 3.17Å; L304-L375 HydrophobicContact CD2-CB 3.8Å; L304-L375 HydrophobicContact CD2-CD1 4.44Å; L372-L375 HydrophobicContact CD2-CD1 4.35Å; L372-L375 WeakPolarHBondContact O-CB 3.34Å; L372-L375 PolarHBondContact O-N 2.84Å; L372-L375 VanDerWaalsContact O-N 3.13Å; L373-L375 PolarHBondContact O-N 3.19Å; L375-T378 PolarHBondContact O-OG1 3.15Å |
| 376 | L | 94.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -77.3 | -42.5 | 173.1 | -57.9 | 175.2 | 0 | 0 | 0 | 110.5 | D257 L260 L261 Y264 F308 L373 P374 T378 V379 | D257-L376 HydrophobicContact CB-CB 4.29Å; D257-L376 HydrophobicContact CB-CD1 4.16Å; D257-L376 WeakPolarHBondContact OD1-CB 3.28Å; L260-L376 HydrophobicContact CB-CD2 3.92Å; L260-L376 HydrophobicContact CD1-CB 4.36Å; L260-L376 HydrophobicContact CD1-CD2 4.1Å; L261-L376 HydrophobicContact CD1-CD1 3.9Å; L261-L376 HydrophobicContact CD2-CD1 3.89Å; L261-L376 HydrophobicContact CG-CD1 3.57Å; Y264-L376 HydrophobicContact CD2-CD2 4.3Å; Y264-L376 HydrophobicContact CE2-CD2 3.71Å; F308-L376 HydrophobicContact CE2-CD2 3.9Å; F308-L376 HydrophobicContact CZ-CD1 4.49Å; F308-L376 HydrophobicContact CZ-CD2 3.89Å; F308-L376 HydrophobicContact CZ-CG 4.4Å; L373-L376 HydrophobicContact CD2-CD1 4.03Å; L373-L376 PolarHBondContact O-N 3.17Å; P374-L376 VanDerWaalsContact C-N 3.3Å; P374-L376 PolarHBondContact O-N 2.75Å; L376-T378 PolarHBondContact O-N 3.42Å; L376-V379 PolarHBondContact O-N 3.31Å |
| 377 | R | 91.5 | Very high | 89.5 | Confident | 131 Ų | 131 | 50.8 Ų | 50.8 | 49% | 0.494 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.3 | -8.4 | -179.4 | -63.5 | -171 | 177.4 | 104.9 | -8.9 | 114.9 | D257 P374 V379 | D257-R377 IonicContact OD2-NE 3.71Å; P374-R377 PolarHBondContact O-N 2.92Å; R377-V379 VanDerWaalsContact C-N 3.3Å |
| 378 | T | 93.4 | Very high | 88.5 | Confident | 76 Ų | 76 | 51 Ų | 51 | 47% | 0.466 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.6 | -16 | 171.5 | 60 | 0 | 0 | 0 | 0 | 112.6 | Y300 L375 L376 | Y300-T378 WeakPolarHBondContact CE1-OG1 3.39Å; Y300-T378 WeakPolarHBondContact OH-CB 3.23Å; Y300-T378 PolarHBondContact OH-OG1 2.91Å; L375-T378 PolarHBondContact O-OG1 3.15Å; L376-T378 PolarHBondContact O-N 3.42Å |
| 379 | V | 91.4 | Very high | 87.5 | Confident | 7 Ų | 7 | 44.7 Ų | 44.7 | 4% | 0.042 | 24% | 0.24 | C | C | . | . | S | Bend | trans | -96.6 | 113.7 | 175.4 | -167.7 | 0 | 0 | 0 | 0 | 108.9 | N256 L260 Y300 L301 L304 L376 R377 I384 | N256-V379 PolarHBondContact ND2-O 3.03Å; L260-V379 HydrophobicContact CD1-CB 4.06Å; L260-V379 HydrophobicContact CD1-CG2 4.17Å; Y300-V379 HydrophobicContact CD1-CG2 4.02Å; Y300-V379 HydrophobicContact CE1-CG2 3.79Å; L301-V379 HydrophobicContact CD2-CG1 4.13Å; L301-V379 HydrophobicContact CD2-CG2 4.01Å; L304-V379 HydrophobicContact CD1-CG2 3.72Å; L376-V379 PolarHBondContact O-N 3.31Å; R377-V379 VanDerWaalsContact C-N 3.3Å; V379-I384 HydrophobicContact CG1-CD1 3.69Å; V379-I384 HydrophobicContact CG1-CG1 3.91Å |
| 380 | S | 90.5 | Very high | 86.1 | Confident | 41 Ų | 41 | 46.5 Ų | 46.5 | 29% | 0.287 | 26% | 0.258 | S | S | . | . | trans | -69.8 | 147.5 | -178.7 | 59.6 | 0 | 0 | 0 | 0 | 112.4 | D382 K383 I384 | S380-D382 VanDerWaalsContact C-N 3.29Å; S380-D382 PolarHBondContact O-N 3.35Å; S380-K383 WeakPolarHBondContact O-CB 3.47Å; S380-K383 PolarHBondContact O-N 3.16Å; S380-K383 VanDerWaalsContact O-N 3.13Å; S380-K383 WeakPolarHBondContact OG-CG 3.48Å; S380-I384 PolarHBondContact O-N 3.45Å | ||
| 381 | P | 88.4 | Confident | 84.6 | Confident | 41 Ų | 41 | 50 Ų | 50 | 27% | 0.266 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -54.8 | -43.3 | 175.2 | 20 | -31.6 | 0 | 0 | 0 | 112 | W255 N256 K383 I384 E385 | W255-P381 HydrophobicContact CH2-CB 4.31Å; W255-P381 HydrophobicContact CZ2-CB 3.44Å; W255-P381 VanDerWaalsContact CZ2-CB 3.44Å; N256-P381 HydrophobicContact CB-CB 4.28Å; P381-K383 PolarHBondContact O-N 2.81Å; P381-I384 PolarHBondContact O-N 2.78Å; P381-E385 PolarHBondContact O-N 2.84Å |
| 382 | D | 86.3 | Confident | 83.1 | Confident | 118 Ų | 118 | 47 Ų | 47 | 63% | 0.631 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -56.3 | -35.3 | 178.6 | -44.2 | -56.4 | 0 | 0 | 0 | 113.2 | S380 A386 | S380-D382 VanDerWaalsContact C-N 3.29Å; S380-D382 PolarHBondContact O-N 3.35Å; D382-A386 WeakPolarHBondContact O-CB 3.3Å; D382-A386 PolarHBondContact O-N 2.83Å |
| 383 | K | 84.7 | Confident | 81.4 | Confident | 85 Ų | 85 | 47.2 Ų | 47.2 | 37% | 0.37 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -69.7 | -46.3 | 176.5 | -76.8 | 179.5 | 179.3 | -164.3 | 0 | 110.7 | D297 S380 P381 E385 A386 M387 | D297-K383 WeakPolarHBondContact OD1-CE 3.37Å; D297-K383 IonicContact OD1-NZ 3.95Å; D297-K383 PolarHBondContact OD1-NZ 3.19Å; S380-K383 WeakPolarHBondContact O-CB 3.47Å; S380-K383 PolarHBondContact O-N 3.16Å; S380-K383 VanDerWaalsContact O-N 3.13Å; S380-K383 WeakPolarHBondContact OG-CG 3.48Å; P381-K383 PolarHBondContact O-N 2.81Å; K383-E385 VanDerWaalsContact C-N 3.3Å; K383-E385 PolarHBondContact O-N 3.18Å; K383-A386 PolarHBondContact O-N 2.86Å; K383-M387 VanDerWaalsContact O-CB 3.28Å; K383-M387 WeakPolarHBondContact O-CB 3.47Å; K383-M387 WeakPolarHBondContact O-CG 3.39Å; K383-M387 PolarHBondContact O-N 3.32Å |
| 384 | I | 81.5 | Confident | 79.9 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -61.2 | -42.3 | 176.1 | -63.5 | -56.8 | 0 | 0 | 0 | 110.6 | W255 F259 L260 L301 V379 S380 P381 M387 F388 F389 | W255-I384 HydrophobicContact CH2-CB 4.09Å; W255-I384 HydrophobicContact CH2-CG2 3.88Å; W255-I384 HydrophobicContact CZ3-CB 4.3Å; W255-I384 HydrophobicContact CZ3-CG2 3.64Å; F259-I384 HydrophobicContact CD1-CG2 3.52Å; F259-I384 HydrophobicContact CE1-CG2 3.69Å; F259-I384 HydrophobicContact CG-CG2 4.33Å; L260-I384 HydrophobicContact CD2-CD1 3.73Å; L260-I384 HydrophobicContact CG-CD1 4.31Å; L301-I384 HydrophobicContact CD1-CD1 4.42Å; L301-I384 HydrophobicContact CD2-CD1 4.36Å; V379-I384 HydrophobicContact CG1-CD1 3.69Å; V379-I384 HydrophobicContact CG1-CG1 3.91Å; S380-I384 PolarHBondContact O-N 3.45Å; P381-I384 PolarHBondContact O-N 2.78Å; I384-M387 PolarHBondContact O-N 3.48Å; I384-F388 HydrophobicContact CD1-CD2 4.36Å; I384-F388 HydrophobicContact CD1-CE2 4.12Å; I384-F388 HydrophobicContact CG2-CD2 4.13Å; I384-F388 PolarHBondContact O-N 2.95Å; I384-F389 HydrophobicContact CG2-CD2 4.23Å; I384-F389 HydrophobicContact CG2-CE2 3.93Å |
| 385 | E | 78.7 | Confident | 78.6 | Confident | 34 Ų | 34 | 57.7 Ų | 57.7 | 16% | 0.159 | 31% | 0.311 | C | S | . | . | I | π-helix | trans | -60.1 | -51.5 | 175.9 | -170.2 | 176.2 | 120.9 | 0 | 0 | 111.3 | W255 P381 K383 M387 F389 G390 P397 M398 | W255-E385 HydrophobicContact CH2-CB 4.44Å; P381-E385 PolarHBondContact O-N 2.84Å; K383-E385 VanDerWaalsContact C-N 3.3Å; K383-E385 PolarHBondContact O-N 3.18Å; E385-M387 PolarHBondContact O-N 3.2Å; E385-F389 HydrophobicContact CG-CB 4.23Å; E385-F389 CarbonylContact O-C 3.34Å; E385-F389 VanDerWaalsContact O-CA 3.3Å; E385-F389 WeakPolarHBondContact O-CA 3.47Å; E385-F389 WeakPolarHBondContact O-CB 3.45Å; E385-F389 PolarHBondContact O-N 3.47Å; E385-G390 PolarHBondContact O-N 2.98Å; E385-P397 VanDerWaalsContact OE2-CA 3.31Å; E385-P397 WeakPolarHBondContact OE2-CA 3.23Å; E385-M398 PolarHBondContact OE2-N 2.81Å |
| 386 | A | 76.6 | Confident | 77.6 | Confident | 45 Ų | 45 | 60 Ų | 60 | 37% | 0.372 | 32% | 0.32 | S | S | . | . | I | π-helix | trans | -59.8 | -44.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L290 D382 K383 | L290-A386 WeakPolarHBondContact CD1-O 3.17Å; L290-A386 WeakPolarHBondContact CD2-O 3.39Å; D382-A386 WeakPolarHBondContact O-CB 3.3Å; D382-A386 PolarHBondContact O-N 2.83Å; K383-A386 PolarHBondContact O-N 2.86Å |
| 387 | M | 72.9 | Confident | 76.9 | Confident | 10 Ų | 10 | 62.9 Ų | 62.9 | 5% | 0.049 | 34% | 0.339 | C | S | . | . | I | π-helix | trans | -70.9 | -39.2 | -175.1 | -69.3 | 175.1 | 80.9 | 0 | 0 | 113.7 | F293 D297 W298 L301 K383 I384 E385 | F293-M387 HydrophobicContact CD2-CB 4.24Å; F293-M387 HydrophobicContact CD2-CE 4.27Å; F293-M387 HydrophobicContact CD2-CG 3.68Å; F293-M387 HydrophobicContact CE2-CB 4.07Å; F293-M387 HydrophobicContact CE2-CE 3.58Å; F293-M387 HydrophobicContact CE2-CG 3.74Å; F293-M387 HydrophobicContact CZ-CE 4.26Å; D297-M387 HydrophobicContact CB-CE 4.29Å; D297-M387 HydrophobicContact CB-SD 4.16Å; W298-M387 HydrophobicContact CB-CE 4.2Å; W298-M387 HydrophobicContact CE3-CE 3.93Å; L301-M387 HydrophobicContact CD1-CE 3.57Å; L301-M387 HydrophobicContact CD1-SD 4.05Å; L301-M387 HydrophobicContact CG-CE 4.44Å; K383-M387 VanDerWaalsContact O-CB 3.28Å; K383-M387 WeakPolarHBondContact O-CB 3.47Å; K383-M387 WeakPolarHBondContact O-CG 3.39Å; K383-M387 PolarHBondContact O-N 3.32Å; I384-M387 PolarHBondContact O-N 3.48Å; E385-M387 PolarHBondContact O-N 3.2Å |
| 388 | F | 71.2 | Confident | 76.1 | Confident | 32 Ų | 32 | 56.7 Ų | 56.7 | 14% | 0.14 | 32% | 0.315 | C | S | . | . | I | π-helix | trans | -117.2 | -24.1 | -170.2 | -63.6 | -82 | 0 | 0 | 0 | 114.3 | F259 M263 L284 W298 L301 I384 H391 | F259-F388 AromaticContact CE1-CD2 3.74Å; F259-F388 HydrophobicContact CE1-CD2 3.74Å; F259-F388 HydrophobicContact CE1-CE2 4Å; F259-F388 HydrophobicContact CE1-CG 4.02Å; F259-F388 HydrophobicContact CE1-CZ 4.49Å; F259-F388 HydrophobicContact CZ-CB 4.1Å; F259-F388 HydrophobicContact CZ-CD1 4.04Å; F259-F388 HydrophobicContact CZ-CD2 4.01Å; F259-F388 HydrophobicContact CZ-CE1 4.49Å; F259-F388 HydrophobicContact CZ-CE2 4.46Å; F259-F388 AromaticContact CZ-CG 3.78Å; F259-F388 HydrophobicContact CZ-CG 3.78Å; M263-F388 HydrophobicContact CE-CZ 4.29Å; M263-F388 HydrophobicContact SD-CE1 3.98Å; M263-F388 HydrophobicContact SD-CE2 4.38Å; M263-F388 HydrophobicContact SD-CZ 3.65Å; L284-F388 HydrophobicContact CD1-CE1 4.37Å; W298-F388 HydrophobicContact CZ3-CE1 4.14Å; W298-F388 HydrophobicContact CZ3-CZ 4.01Å; L301-F388 HydrophobicContact CD1-CE2 3.8Å; L301-F388 HydrophobicContact CD1-CZ 3.98Å; I384-F388 HydrophobicContact CD1-CD2 4.36Å; I384-F388 HydrophobicContact CD1-CE2 4.12Å; I384-F388 HydrophobicContact CG2-CD2 4.13Å; I384-F388 PolarHBondContact O-N 2.95Å; F388-H391 PolarHBondContact O-CE1 3.48Å |
| 389 | F | 71.4 | Confident | 75.4 | Confident | 8 Ų | 8 | 55.6 Ų | 55.6 | 4% | 0.035 | 31% | 0.305 | C | S | . | . | I | π-helix | trans | -124.1 | -10.3 | -165.4 | -61.8 | -63.9 | 0 | 0 | 0 | 115.3 | F207 W255 F259 I384 E385 H391 V392 V393 M398 | F207-F389 HydrophobicContact CB-CE1 3.93Å; F207-F389 HydrophobicContact CB-CZ 4.13Å; F207-F389 HydrophobicContact CD1-CD1 4.22Å; F207-F389 AromaticContact CD1-CE1 3.33Å; F207-F389 HydrophobicContact CD1-CE1 3.33Å; F207-F389 AromaticContact CD1-CZ 3.87Å; F207-F389 HydrophobicContact CD1-CZ 3.87Å; F207-F389 HydrophobicContact CD2-CE1 4.31Å; F207-F389 HydrophobicContact CD2-CZ 4.02Å; F207-F389 HydrophobicContact CE1-CD1 4.48Å; F207-F389 AromaticContact CE1-CE1 3.85Å; F207-F389 HydrophobicContact CE1-CE1 3.85Å; F207-F389 HydrophobicContact CE1-CZ 4.26Å; F207-F389 HydrophobicContact CE2-CZ 4.41Å; F207-F389 AromaticContact CG-CE1 3.6Å; F207-F389 HydrophobicContact CG-CE1 3.6Å; F207-F389 AromaticContact CG-CZ 3.74Å; F207-F389 HydrophobicContact CG-CZ 3.74Å; W255-F389 HydrophobicContact CZ3-CD2 4.32Å; W255-F389 HydrophobicContact CZ3-CE2 4.01Å; F259-F389 HydrophobicContact CD2-CE2 4.05Å; F259-F389 AromaticContact CD2-CZ 3.71Å; F259-F389 HydrophobicContact CD2-CZ 3.71Å; F259-F389 HydrophobicContact CE1-CE2 4.41Å; F259-F389 HydrophobicContact CE2-CE1 4.49Å; F259-F389 AromaticContact CE2-CE2 3.91Å; F259-F389 HydrophobicContact CE2-CE2 3.91Å; F259-F389 AromaticContact CE2-CZ 3.45Å; F259-F389 HydrophobicContact CE2-CZ 3.45Å; F259-F389 VanDerWaalsContact CE2-CZ 3.45Å; F259-F389 HydrophobicContact CG-CE2 4.37Å; F259-F389 HydrophobicContact CG-CZ 4.46Å; F259-F389 HydrophobicContact CZ-CE2 4.09Å; F259-F389 HydrophobicContact CZ-CZ 4.01Å; I384-F389 HydrophobicContact CG2-CD2 4.23Å; I384-F389 HydrophobicContact CG2-CE2 3.93Å; E385-F389 HydrophobicContact CG-CB 4.23Å; E385-F389 CarbonylContact O-C 3.34Å; E385-F389 VanDerWaalsContact O-CA 3.3Å; E385-F389 WeakPolarHBondContact O-CA 3.47Å; E385-F389 WeakPolarHBondContact O-CB 3.45Å; E385-F389 PolarHBondContact O-N 3.47Å; F389-H391 PolarHBondContact O-N 3.35Å; F389-V392 PolarHBondContact O-N 2.99Å; F389-V393 HydrophobicContact CB-CG2 3.91Å; F389-V393 PolarHBondContact O-N 3.29Å; F389-M398 HydrophobicContact CB-CE 3.98Å; F389-M398 HydrophobicContact CD1-CE 3.7Å; F389-M398 HydrophobicContact CD2-CE 3.46Å; F389-M398 VanDerWaalsContact CD2-CE 3.46Å; F389-M398 HydrophobicContact CE1-CE 3.99Å; F389-M398 HydrophobicContact CE2-CE 3.75Å; F389-M398 HydrophobicContact CG-CE 3.41Å; F389-M398 VanDerWaalsContact CG-CE 3.41Å; F389-M398 HydrophobicContact CZ-CE 4Å |
| 390 | G | 65.2 | Low | 74.6 | Confident | 37 Ų | 37 | 60.3 Ų | 60.3 | 38% | 0.381 | 33% | 0.325 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | -30.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | E385 | E385-G390 PolarHBondContact O-N 2.98Š|
| 391 | H | 62.5 | Low | 73.8 | Confident | 128 Ų | 128 | 59.9 Ų | 59.9 | 59% | 0.593 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -33.3 | 175 | 66.9 | -83.5 | 0 | 0 | 0 | 113.4 | F388 F389 | F388-H391 PolarHBondContact O-CE1 3.48Å; F389-H391 PolarHBondContact O-N 3.35Å |
| 392 | V | 62.2 | Low | 73 | Confident | 56 Ų | 56 | 58.3 Ų | 58.3 | 34% | 0.339 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -46.9 | -176.8 | -172.2 | 0 | 0 | 0 | 0 | 111.1 | I210 F389 R394 | I210-V392 HydrophobicContact CD1-CG1 4.13Å; I210-V392 HydrophobicContact CG2-CG2 3.68Å; F389-V392 PolarHBondContact O-N 2.99Å; V392-R394 PolarHBondContact O-N 3.06Å |
| 393 | V | 60.4 | Low | 72.3 | Confident | 17 Ų | 17 | 53.8 Ų | 53.8 | 10% | 0.103 | 29% | 0.287 | C | S | . | . | S | Bend | trans | -89.6 | -4.2 | -160.5 | -171 | 0 | 0 | 0 | 0 | 113 | F389 G395 K396 M398 V401 | F389-V393 HydrophobicContact CB-CG2 3.91Å; F389-V393 PolarHBondContact O-N 3.29Å; V393-G395 PolarHBondContact O-N 2.58Å; V393-K396 HydrophobicContact CG1-CB 3.78Å; V393-K396 WeakPolarHBondContact CG1-O 3.12Å; V393-K396 PolarHBondContact O-N 2.88Å; V393-K396 VanDerWaalsContact O-N 3.15Å; V393-M398 HydrophobicContact CG2-CE 4.34Å; V393-V401 HydrophobicContact CB-CG2 4.44Å; V393-V401 HydrophobicContact CG1-CG2 3.25Å; V393-V401 HydrophobicContact CG2-CG2 4.32Å |
| 394 | R | 64.4 | Low | 71.5 | Confident | 235 Ų | 235 | 52.4 Ų | 52.4 | 89% | 0.887 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.6 | 36.5 | 179.4 | -58.3 | -173 | 177.6 | -139.9 | 0.7 | 113.2 | V392 K396 | V392-R394 PolarHBondContact O-N 3.06Å; R394-K396 VanDerWaalsContact C-N 3.34Å; R394-K396 PolarHBondContact O-N 3.33Å |
| 395 | G | 67.8 | Low | 70.8 | Confident | 69 Ų | 69 | 57 Ų | 57 | 71% | 0.711 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.4 | 14.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 116 | V393 | V393-G395 PolarHBondContact O-N 2.58Š|
| 396 | K | 73.7 | Confident | 70 | Confident | 89 Ų | 89 | 58.3 Ų | 58.3 | 39% | 0.387 | 31% | 0.312 | S | S | . | . | trans | -75.4 | 146.4 | 157.7 | -65.8 | -179.1 | 173.6 | -173.9 | 0 | 108.8 | V393 R394 K400 D404 | V393-K396 HydrophobicContact CG1-CB 3.78Å; V393-K396 WeakPolarHBondContact CG1-O 3.12Å; V393-K396 PolarHBondContact O-N 2.88Å; V393-K396 VanDerWaalsContact O-N 3.15Å; R394-K396 VanDerWaalsContact C-N 3.34Å; R394-K396 PolarHBondContact O-N 3.33Å; K396-K400 HydrophobicContact CD-CD 4.39Å; K396-K400 HydrophobicContact CG-CD 4.48Å; K396-D404 IonicContact NZ-OD2 2.69Å; K396-D404 PolarHBondContact NZ-OD2 3.03Å | ||
| 397 | P | 79.3 | Confident | 69.3 | Low | 61 Ų | 61 | 61.4 Ų | 61.4 | 40% | 0.396 | 32% | 0.317 | S | S | . | . | trans | -69.8 | 146.8 | 168.8 | 29.3 | -33.7 | 0 | 0 | 0 | 110.5 | E385 E399 K400 V401 | E385-P397 VanDerWaalsContact OE2-CA 3.31Å; E385-P397 WeakPolarHBondContact OE2-CA 3.23Å; P397-E399 VanDerWaalsContact C-N 3.25Å; P397-E399 PolarHBondContact O-N 2.77Å; P397-K400 HydrophobicContact CG-CB 3.91Å; P397-K400 WeakPolarHBondContact O-CB 3.22Å; P397-K400 PolarHBondContact O-N 3.45Å; P397-V401 PolarHBondContact O-N 2.86Å | ||
| 398 | M | 76.2 | Confident | 68.2 | Low | 1 Ų | 1 | 73.8 Ų | 73.8 | 1% | 0.005 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -56.8 | -36.9 | -178 | -177.8 | 61 | 74.8 | 0 | 0 | 112.5 | F207 W255 E385 F389 V393 K400 V401 L402 | F207-M398 HydrophobicContact CE1-CE 3.95Å; F207-M398 HydrophobicContact CE1-SD 4.13Å; F207-M398 HydrophobicContact CZ-CE 3.95Å; F207-M398 HydrophobicContact CZ-SD 3.77Å; W255-M398 HydrophobicContact CD2-CB 4.19Å; W255-M398 HydrophobicContact CD2-CG 3.57Å; W255-M398 HydrophobicContact CE3-CB 4.5Å; W255-M398 HydrophobicContact CE3-CG 3.72Å; W255-M398 HydrophobicContact CG-CG 4.17Å; W255-M398 HydrophobicContact CH2-CB 3.88Å; W255-M398 HydrophobicContact CH2-CG 3.95Å; W255-M398 HydrophobicContact CZ2-CB 3.49Å; W255-M398 VanDerWaalsContact CZ2-CB 3.49Å; W255-M398 HydrophobicContact CZ2-CG 3.8Å; W255-M398 HydrophobicContact CZ3-CB 4.37Å; W255-M398 HydrophobicContact CZ3-CE 4.33Å; W255-M398 HydrophobicContact CZ3-CG 3.91Å; E385-M398 PolarHBondContact OE2-N 2.81Å; F389-M398 HydrophobicContact CB-CE 3.98Å; F389-M398 HydrophobicContact CD1-CE 3.7Å; F389-M398 HydrophobicContact CD2-CE 3.46Å; F389-M398 VanDerWaalsContact CD2-CE 3.46Å; F389-M398 HydrophobicContact CE1-CE 3.99Å; F389-M398 HydrophobicContact CE2-CE 3.75Å; F389-M398 HydrophobicContact CG-CE 3.41Å; F389-M398 VanDerWaalsContact CG-CE 3.41Å; F389-M398 HydrophobicContact CZ-CE 4Å; V393-M398 HydrophobicContact CG2-CE 4.34Å; M398-K400 PolarHBondContact O-N 3.46Å; M398-V401 WeakPolarHBondContact O-CA 3.16Å; M398-V401 WeakPolarHBondContact O-CB 3.09Å; M398-V401 PolarHBondContact O-N 3.12Å; M398-V401 HydrophobicContact SD-CB 4.23Å; M398-L402 HydrophobicContact CG-CD1 4.34Å; M398-L402 HydrophobicContact CG-CG 4.47Å; M398-L402 WeakPolarHBondContact O-CG 3.28Å; M398-L402 PolarHBondContact O-N 3.36Å |
| 399 | E | 78 | Confident | 68.1 | Low | 53 Ų | 53 | 75.9 Ų | 75.9 | 25% | 0.248 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -55.3 | -43 | 175.1 | -62.4 | 73.7 | -161.6 | 0 | 0 | 110.3 | E252 W255 P397 V401 L402 C403 | E252-E399 HydrophobicContact CB-CB 4.45Å; E252-E399 HydrophobicContact CB-CG 4.22Å; E252-E399 HydrophobicContact CG-CB 4.05Å; E252-E399 HydrophobicContact CG-CG 4.36Å; W255-E399 PolarHBondContact NE1-OE1 2.97Å; P397-E399 VanDerWaalsContact C-N 3.25Å; P397-E399 PolarHBondContact O-N 2.77Å; E399-V401 VanDerWaalsContact C-N 3.33Å; E399-V401 PolarHBondContact O-N 3.43Å; E399-L402 PolarHBondContact O-N 3.46Å; E399-C403 WeakPolarHBondContact O-CB 3.35Å; E399-C403 PolarHBondContact O-N 2.93Å |
| 400 | K | 75.4 | Confident | 67.9 | Low | 107 Ų | 107 | 79.5 Ų | 79.5 | 47% | 0.465 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -67.3 | -32.4 | 176.5 | -173 | 172.4 | -175.2 | 172.7 | 0 | 112.4 | K396 P397 M398 D404 | K396-K400 HydrophobicContact CD-CD 4.39Å; K396-K400 HydrophobicContact CG-CD 4.48Å; P397-K400 HydrophobicContact CG-CB 3.91Å; P397-K400 WeakPolarHBondContact O-CB 3.22Å; P397-K400 PolarHBondContact O-N 3.45Å; M398-K400 PolarHBondContact O-N 3.46Å; K400-D404 VanDerWaalsContact O-CB 3.29Å; K400-D404 WeakPolarHBondContact O-CB 3.38Å; K400-D404 PolarHBondContact O-N 3.35Å |
| 401 | V | 73 | Confident | 68 | Low | 32 Ų | 32 | 81.8 Ų | 81.8 | 19% | 0.194 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -65.8 | -46.9 | 173.1 | -174.6 | 0 | 0 | 0 | 0 | 110.6 | V393 P397 M398 E399 C403 D404 L405 | V393-V401 HydrophobicContact CB-CG2 4.44Å; V393-V401 HydrophobicContact CG1-CG2 3.25Å; V393-V401 HydrophobicContact CG2-CG2 4.32Å; P397-V401 PolarHBondContact O-N 2.86Å; M398-V401 WeakPolarHBondContact O-CA 3.16Å; M398-V401 WeakPolarHBondContact O-CB 3.09Å; M398-V401 PolarHBondContact O-N 3.12Å; M398-V401 HydrophobicContact SD-CB 4.23Å; E399-V401 VanDerWaalsContact C-N 3.33Å; E399-V401 PolarHBondContact O-N 3.43Å; V401-C403 VanDerWaalsContact C-N 3.32Å; V401-C403 PolarHBondContact O-N 3.13Å; V401-D404 PolarHBondContact O-N 3.47Å; V401-L405 HydrophobicContact CG1-CD1 3.92Å; V401-L405 HydrophobicContact CG1-CG 4.29Å; V401-L405 WeakPolarHBondContact O-CB 3.48Å; V401-L405 VanDerWaalsContact O-CG 3.26Å; V401-L405 WeakPolarHBondContact O-CG 3.41Å; V401-L405 PolarHBondContact O-N 2.77Å |
| 402 | L | 71.2 | Confident | 68.4 | Low | 8 Ų | 8 | 79.1 Ų | 79.1 | 4% | 0.042 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -59.8 | -44.9 | 175.8 | -63.2 | 169.7 | 0 | 0 | 0 | 110.5 | W255 M398 E399 D404 L405 Y406 | W255-L402 HydrophobicContact CB-CD1 3.63Å; W255-L402 HydrophobicContact CG-CD1 3.88Å; M398-L402 HydrophobicContact CG-CD1 4.34Å; M398-L402 HydrophobicContact CG-CG 4.47Å; M398-L402 WeakPolarHBondContact O-CG 3.28Å; M398-L402 PolarHBondContact O-N 3.36Å; E399-L402 PolarHBondContact O-N 3.46Å; L402-D404 PolarHBondContact O-N 2.95Å; L402-L405 PolarHBondContact O-N 3.07Å; L402-Y406 WeakPolarHBondContact O-CD2 2.99Å; L402-Y406 PolarHBondContact O-N 2.93Å |
| 403 | C | 71.2 | Confident | 68.8 | Low | 23 Ų | 23 | 80.6 Ų | 80.6 | 16% | 0.155 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -60.1 | -42.5 | 174.9 | -133.2 | 0 | 0 | 0 | 0 | 112.6 | E252 E399 V401 K407 | E252-C403 PolarHBondContact OE1-SG 2.8Å; E399-C403 WeakPolarHBondContact O-CB 3.35Å; E399-C403 PolarHBondContact O-N 2.93Å; V401-C403 VanDerWaalsContact C-N 3.32Å; V401-C403 PolarHBondContact O-N 3.13Å; C403-K407 WeakPolarHBondContact O-CD 3.33Å; C403-K407 WeakPolarHBondContact O-CG 3.49Å; C403-K407 PolarHBondContact O-N 3.2Å; C403-K407 PolarHBondContact SG-NZ 2.69Å |
| 404 | D | 69.3 | Low | 69.3 | Low | 55 Ų | 55 | 84.8 Ų | 84.8 | 29% | 0.294 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -72 | -30.1 | 178.3 | -75.1 | -7.5 | 0 | 0 | 0 | 112 | K396 K400 V401 L402 | K396-D404 IonicContact NZ-OD2 2.69Å; K396-D404 PolarHBondContact NZ-OD2 3.03Å; K400-D404 VanDerWaalsContact O-CB 3.29Å; K400-D404 WeakPolarHBondContact O-CB 3.38Å; K400-D404 PolarHBondContact O-N 3.35Å; V401-D404 PolarHBondContact O-N 3.47Å; L402-D404 PolarHBondContact O-N 2.95Å |
| 405 | L | 66.2 | Low | 69.7 | Low | 97 Ų | 97 | 74.1 Ų | 74.1 | 51% | 0.508 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -74.9 | -40.1 | 176.8 | -75.8 | 171.2 | 0 | 0 | 0 | 112.7 | V401 L402 K407 | V401-L405 HydrophobicContact CG1-CD1 3.92Å; V401-L405 HydrophobicContact CG1-CG 4.29Å; V401-L405 WeakPolarHBondContact O-CB 3.48Å; V401-L405 VanDerWaalsContact O-CG 3.26Å; V401-L405 WeakPolarHBondContact O-CG 3.41Å; V401-L405 PolarHBondContact O-N 2.77Å; L402-L405 PolarHBondContact O-N 3.07Å; L405-K407 VanDerWaalsContact C-N 3.34Å |
| 406 | Y | 61.9 | Low | 69.8 | Low | 61 Ų | 61 | 74.5 Ų | 74.5 | 24% | 0.239 | 34% | 0.341 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -3.1 | -178.4 | -86.9 | -93.3 | 0 | 0 | 0 | 115 | V199 I248 L251 L402 | V199-Y406 WeakPolarHBondContact CG1-OH 3.3Å; V199-Y406 WeakPolarHBondContact CG2-OH 2.8Å; I248-Y406 HydrophobicContact CG1-CD1 4.41Å; I248-Y406 HydrophobicContact CG1-CG 4.1Å; L251-Y406 HydrophobicContact CD1-CD2 4.28Å; L251-Y406 HydrophobicContact CD1-CE1 4.17Å; L251-Y406 HydrophobicContact CD1-CE2 3.55Å; L251-Y406 VanDerWaalsContact CD1-CZ 3.5Å; L402-Y406 WeakPolarHBondContact O-CD2 2.99Å; L402-Y406 PolarHBondContact O-N 2.93Å |
| 407 | K | 62.9 | Low | 69.5 | Low | 110 Ų | 110 | 73.3 Ų | 73.3 | 48% | 0.478 | 34% | 0.337 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | -0 | 173.6 | -73.4 | 169.8 | -168.3 | 157.4 | 0 | 113.4 | W241 C403 L405 | W241-K407 HydrophobicContact CH2-CG 4.34Å; W241-K407 HydrophobicContact CZ2-CG 4.21Å; C403-K407 WeakPolarHBondContact O-CD 3.33Å; C403-K407 WeakPolarHBondContact O-CG 3.49Å; C403-K407 PolarHBondContact O-N 3.2Å; C403-K407 PolarHBondContact SG-NZ 2.69Å; L405-K407 VanDerWaalsContact C-N 3.34Å |
| 408 | R | 49.3 | Very low | 68.6 | Low | 271 Ų | 271 | 74.4 Ų | 74.4 | 100% | 1.023 | 33% | 0.332 | S | S | * | . | trans | -100.1 | 0 | 174.3 | -65.3 | 177.6 | -179 | -157.8 | -2.4 | 109.9 |
Retrieved 408 of 408 residues in 67.2 ms
(Link to these results)