| 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 | 41 | Very low | 41.1 | Very low | 221 Ų | 221 | 139.3 Ų | 139.3 | 100% | 1.089 | 76% | 0.759 | S | S | * | * | 0 | 81.4 | 0 | -59.5 | 178.3 | -174.5 | 0 | 0 | 106.4 | |||||
| 2 | D | 36.2 | Very low | 40.4 | Very low | 144 Ų | 144 | 136.8 Ų | 136.8 | 77% | 0.77 | 76% | 0.76 | S | S | * | * | cis | 62 | 119.2 | 41.8 | -55.3 | -70.3 | 0 | 0 | 0 | 110.9 | ||||
| 3 | L | 38.8 | Very low | 39.8 | Very low | 158 Ų | 158 | 134.2 Ų | 134.2 | 83% | 0.827 | 77% | 0.766 | S | S | * | * | cis | -138.3 | 159.7 | 8.5 | -74.4 | 99.4 | 0 | 0 | 0 | 114.5 | ||||
| 4 | R | 48.7 | Very low | 39.2 | Very low | 166 Ų | 166 | 132.2 Ų | 132.2 | 63% | 0.626 | 77% | 0.765 | S | S | * | * | trans | -107.5 | 135.7 | 146.9 | -178.5 | -171 | 171.8 | -105.9 | -15.6 | 108.2 | E6 | R4-E6 IonicContact CZ-OE1 3.18Å; R4-E6 IonicContact CZ-OE2 3.8Å; R4-E6 IonicContact NH1-OE1 2.71Å; R4-E6 PolarHBondContact NH1-OE1 3.18Å; R4-E6 IonicContact NH1-OE2 3.44Å; R4-E6 PolarHBondContact NH1-OE2 3.43Å; R4-E6 IonicContact NH2-OE1 2.73Å; R4-E6 PolarHBondContact NH2-OE1 3.27Å; R4-E6 IonicContact NH2-OE2 2.96Å | ||
| 5 | P | 56.8 | Low | 38.8 | Very low | 104 Ų | 104 | 135.6 Ų | 135.6 | 68% | 0.675 | 77% | 0.771 | S | S | * | * | -144.7 | 163.8 | 126.6 | 34 | -17.8 | 0 | 0 | 0 | 112.5 | |||||
| 6 | E | 36.5 | Very low | 38.4 | Very low | 123 Ų | 123 | 134 Ų | 134 | 58% | 0.575 | 76% | 0.764 | S | S | * | * | cis | -157.9 | -178.5 | -22.5 | -113.4 | -37.5 | -29.9 | 0 | 0 | 110.1 | R4 | R4-E6 IonicContact CZ-OE1 3.18Å; R4-E6 IonicContact CZ-OE2 3.8Å; R4-E6 IonicContact NH1-OE1 2.71Å; R4-E6 PolarHBondContact NH1-OE1 3.18Å; R4-E6 IonicContact NH1-OE2 3.44Å; R4-E6 PolarHBondContact NH1-OE2 3.43Å; R4-E6 IonicContact NH2-OE1 2.73Å; R4-E6 PolarHBondContact NH2-OE1 3.27Å; R4-E6 IonicContact NH2-OE2 2.96Å | ||
| 7 | L | 39.2 | Very low | 38.3 | Very low | 130 Ų | 130 | 136.1 Ų | 136.1 | 68% | 0.681 | 77% | 0.766 | S | S | * | * | trans | -124.1 | 165.4 | 153.2 | -74 | 174.7 | 0 | 0 | 0 | 109.5 | ||||
| 8 | P | 49.2 | Very low | 38.8 | Very low | 130 Ų | 130 | 135.4 Ų | 135.4 | 84% | 0.844 | 77% | 0.768 | S | S | * | * | -141 | 167.6 | 123 | 37.5 | -25.4 | 0 | 0 | 0 | 114.9 | |||||
| 9 | T | 38.6 | Very low | 38.2 | Very low | 122 Ų | 122 | 132.3 Ų | 132.3 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | trans | -135.7 | 135.2 | -174.2 | -55.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 10 | V | 34.5 | Very low | 37.9 | Very low | 132 Ų | 132 | 131.1 Ų | 131.1 | 80% | 0.8 | 78% | 0.775 | S | S | * | * | trans | -160.2 | 130.4 | 156.3 | -92.8 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 11 | S | 32.5 | Very low | 37.5 | Very low | 102 Ų | 102 | 129.7 Ų | 129.7 | 71% | 0.713 | 78% | 0.778 | S | S | * | * | 70.1 | 136.4 | 65.9 | -56.6 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 12 | S | 32.7 | Very low | 37 | Very low | 110 Ų | 110 | 124.1 Ų | 124.1 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | cis | -170.3 | 169.6 | -9.7 | -98.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 13 | A | 32.4 | Very low | 36.9 | Very low | 102 Ų | 102 | 121.7 Ų | 121.7 | 84% | 0.843 | 77% | 0.767 | S | S | * | * | trans | 68.9 | 167.7 | 167.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 14 | S | 31.8 | Very low | 36.6 | Very low | 107 Ų | 107 | 119.3 Ų | 119.3 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | cis | 179.3 | 142.6 | -37.7 | -176.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 15 | Q | 32.8 | Very low | 35.9 | Very low | 183 Ų | 183 | 116 Ų | 116 | 86% | 0.855 | 78% | 0.778 | S | S | * | * | trans | 145.8 | 105.5 | 147.5 | -79.2 | -175.6 | 12.1 | 0 | 0 | 112.2 | ||||
| 16 | V | 32.3 | Very low | 35.1 | Very low | 110 Ų | 110 | 116 Ų | 116 | 67% | 0.667 | 79% | 0.788 | S | S | * | * | 73 | 136.4 | 86.4 | -122.8 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 17 | H | 37.2 | Very low | 35.2 | Very low | 169 Ų | 169 | 115 Ų | 115 | 78% | 0.782 | 80% | 0.8 | S | S | * | * | trans | 73.2 | 165 | 160.7 | -57 | -58.5 | 0 | 0 | 0 | 119 | ||||
| 18 | P | 46.4 | Very low | 35.1 | Very low | 124 Ų | 124 | 114.1 Ų | 114.1 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | -119.5 | 174.6 | -58.1 | 36.7 | -22.9 | 0 | 0 | 0 | 109.7 | |||||
| 19 | G | 28 | Very low | 34.9 | Very low | 76 Ų | 76 | 115.1 Ų | 115.1 | 78% | 0.784 | 80% | 0.802 | S | S | * | * | cis | 122.4 | 112.6 | 22.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 20 | A | 32.1 | Very low | 35.3 | Very low | 109 Ų | 109 | 114.9 Ų | 114.9 | 90% | 0.901 | 80% | 0.802 | S | S | * | * | trans | -145.1 | 138.3 | 175 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 21 | A | 30.4 | Very low | 35.7 | Very low | 101 Ų | 101 | 113.9 Ų | 113.9 | 84% | 0.835 | 80% | 0.796 | S | S | * | * | trans | -141.6 | 178.5 | -172 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 22 | A | 30.7 | Very low | 36.6 | Very low | 105 Ų | 105 | 114.9 Ų | 114.9 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | trans | 72.2 | 151.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 23 | A | 32.4 | Very low | 37.2 | Very low | 92 Ų | 92 | 117.7 Ų | 117.7 | 76% | 0.76 | 81% | 0.806 | S | S | * | * | cis | -137.3 | 147.4 | -1.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 24 | A | 33.8 | Very low | 37.6 | Very low | 109 Ų | 109 | 118.1 Ų | 118.1 | 90% | 0.901 | 81% | 0.809 | S | S | * | * | trans | -87 | 130.3 | 154.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 25 | A | 33.3 | Very low | 38 | Very low | 95 Ų | 95 | 116.2 Ų | 116.2 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | trans | -144.4 | 127 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 26 | A | 39.4 | Very low | 38.5 | Very low | 106 Ų | 106 | 115.3 Ų | 115.3 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | trans | -77.3 | 136.2 | 169 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 27 | A | 39.5 | Very low | 39.6 | Very low | 101 Ų | 101 | 118.4 Ų | 118.4 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -111.6 | 114.6 | 173 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 28 | S | 36.9 | Very low | 40.5 | Very low | 112 Ų | 112 | 118.9 Ų | 118.9 | 78% | 0.783 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 160 | -175.9 | -61.1 | 0 | 0 | 0 | 0 | 113.3 | P30 | S28-P30 WeakPolarHBondContact O-CD 3.47Š|
| 29 | I | 45.7 | Very low | 40.7 | Very low | 151 Ų | 151 | 124.5 Ų | 124.5 | 77% | 0.774 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 134.7 | 170.6 | -60 | 160.6 | 0 | 0 | 0 | 111.1 | V31 | I29-V31 HydrophobicContact CG2-CG2 3.8Š|
| 30 | P | 47.4 | Very low | 41.8 | Very low | 117 Ų | 117 | 123.6 Ų | 123.6 | 76% | 0.76 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 122.4 | 145.6 | 32.9 | -27 | 0 | 0 | 0 | 110.3 | S28 | S28-P30 WeakPolarHBondContact O-CD 3.47Š|
| 31 | V | 42.1 | Very low | 42.7 | Very low | 111 Ų | 111 | 123.8 Ų | 123.8 | 67% | 0.673 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 125.9 | 168.2 | 174.5 | 0 | 0 | 0 | 0 | 108.3 | I29 M33 | I29-V31 HydrophobicContact CG2-CG2 3.8Å; V31-M33 HydrophobicContact CG1-CG 4.09Å |
| 32 | S | 51.3 | Low | 43.7 | Very low | 123 Ų | 123 | 124.3 Ų | 124.3 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -124.5 | 128.6 | 162.8 | -77.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 33 | M | 45.2 | Very low | 44.9 | Very low | 169 Ų | 169 | 126.7 Ų | 126.7 | 83% | 0.833 | 81% | 0.807 | S | S | * | * | trans | -105.1 | 163.1 | -171.5 | -82.2 | -75.3 | -164.7 | 0 | 0 | 112.7 | V31 | V31-M33 HydrophobicContact CG1-CG 4.09Š| ||
| 34 | A | 40.6 | Very low | 46 | Very low | 110 Ų | 110 | 130 Ų | 130 | 91% | 0.909 | 81% | 0.811 | S | S | * | * | trans | 70.1 | 141.5 | 161.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 35 | G | 39.8 | Very low | 46.9 | Very low | 67 Ų | 67 | 132.8 Ų | 132.8 | 69% | 0.691 | 81% | 0.81 | S | S | * | * | trans | 138 | 36.6 | 170 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 36 | N | 44.5 | Very low | 47.5 | Very low | 165 Ų | 165 | 139.3 Ų | 139.3 | 88% | 0.882 | 81% | 0.814 | S | S | * | * | trans | -179.8 | 73 | 149.8 | -94.7 | -22.8 | 0 | 0 | 0 | 112.5 | L38 | N36-L38 PolarHBondContact O-N 3Š| ||
| 37 | L | 54.3 | Low | 48 | Very low | 175 Ų | 175 | 137.9 Ų | 137.9 | 92% | 0.916 | 80% | 0.802 | S | S | * | * | trans | -85.2 | 90.1 | 172 | -65 | 176.8 | 0 | 0 | 0 | 110.4 | ||||
| 38 | L | 57 | Low | 48.8 | Very low | 178 Ų | 178 | 136.7 Ų | 136.7 | 93% | 0.932 | 79% | 0.793 | S | S | * | * | trans | 178.6 | 44.7 | 151.7 | -100.7 | 164 | 0 | 0 | 0 | 114.1 | N36 | N36-L38 PolarHBondContact O-N 3Š| ||
| 39 | R | 49.9 | Very low | 49.4 | Very low | 243 Ų | 243 | 138.9 Ų | 138.9 | 92% | 0.917 | 80% | 0.796 | S | S | * | * | trans | -136.7 | 109.7 | 159.4 | -150.8 | 159.8 | -164.2 | 145.9 | 5.7 | 110.1 | ||||
| 40 | G | 51 | Low | 50 | Low | 57 Ų | 57 | 140.2 Ų | 140.2 | 59% | 0.588 | 80% | 0.796 | S | S | * | * | trans | -58.1 | 151.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111 | P42 | G40-P42 WeakPolarHBondContact O-CD 3.46Å; G40-P42 VanDerWaalsContact O-N 3.16Å | ||
| 41 | P | 51.8 | Low | 50.7 | Low | 113 Ų | 113 | 143.9 Ų | 143.9 | 73% | 0.734 | 80% | 0.796 | S | S | * | * | trans | -58.9 | 121.9 | -175.8 | 24.5 | -33.7 | 0 | 0 | 0 | 109.5 | L43 | P41-L43 PolarHBondContact O-N 3.45Š| ||
| 42 | P | 51.3 | Low | 52.3 | Low | 111 Ų | 111 | 144.1 Ų | 144.1 | 72% | 0.721 | 80% | 0.8 | S | S | * | * | trans | -65.9 | 102.1 | 170 | 27.1 | -31.4 | 0 | 0 | 0 | 107.1 | G40 L44 | G40-P42 WeakPolarHBondContact O-CD 3.46Å; G40-P42 VanDerWaalsContact O-N 3.16Å; P42-L44 WeakPolarHBondContact O-CA 3.43Å; P42-L44 PolarHBondContact O-N 3.19Å | ||
| 43 | L | 55.5 | Low | 53.9 | Low | 155 Ų | 155 | 149.5 Ų | 149.5 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | trans | -50.1 | 118.8 | 172.8 | -66.1 | -175.2 | 0 | 0 | 0 | 107.2 | P41 L45 | P41-L43 PolarHBondContact O-N 3.45Å; L43-L45 PolarHBondContact O-N 3.04Å | ||
| 44 | L | 56.5 | Low | 55.7 | Low | 161 Ų | 161 | 146.6 Ų | 146.6 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | -54.4 | 109.6 | -151.9 | -68 | 171.1 | 0 | 0 | 0 | 111.1 | P42 R46 | P42-L44 WeakPolarHBondContact O-CA 3.43Å; P42-L44 PolarHBondContact O-N 3.19Å; L44-R46 PolarHBondContact O-N 2.6Å | ||
| 45 | L | 50.9 | Low | 58.2 | Low | 169 Ų | 169 | 145.4 Ų | 145.4 | 89% | 0.885 | 78% | 0.776 | S | S | * | * | trans | -62.3 | 80.5 | 152.6 | -106.6 | 73.1 | 0 | 0 | 0 | 106.1 | L43 A47 | L43-L45 PolarHBondContact O-N 3.04Å; L45-A47 PolarHBondContact O-N 2.92Å | ||
| 46 | R | 47.7 | Very low | 60.8 | Low | 231 Ų | 231 | 148.7 Ų | 148.7 | 87% | 0.872 | 77% | 0.771 | S | S | * | * | trans | -68.8 | 77 | 164.7 | -172.7 | -178.1 | -174.5 | 111.8 | 8.5 | 105.6 | L44 A48 | L44-R46 PolarHBondContact O-N 2.6Å; R46-A48 PolarHBondContact O-N 3.35Å | ||
| 47 | A | 49.6 | Very low | 63.3 | Low | 76 Ų | 76 | 141.2 Ų | 141.2 | 63% | 0.628 | 73% | 0.732 | S | S | * | * | trans | -46.5 | 115.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | L45 D49 | L45-A47 PolarHBondContact O-N 2.92Å; A47-D49 PolarHBondContact O-N 3.15Å | ||
| 48 | A | 55 | Low | 65.2 | Low | 77 Ų | 77 | 134.5 Ų | 134.5 | 64% | 0.636 | 70% | 0.702 | S | S | * | * | trans | -54.4 | 131.4 | -168.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | R46 K50 | R46-A48 PolarHBondContact O-N 3.35Å; A48-K50 WeakPolarHBondContact O-CA 3.43Å; A48-K50 WeakPolarHBondContact O-CB 3.31Å; A48-K50 PolarHBondContact O-N 3.21Å | ||
| 49 | D | 51 | Low | 67.1 | Low | 158 Ų | 158 | 128.5 Ų | 128.5 | 85% | 0.845 | 67% | 0.667 | S | S | * | * | trans | -68.5 | 91.8 | 178 | -141.3 | -36.1 | 0 | 0 | 0 | 106.6 | A47 Y51 | A47-D49 PolarHBondContact O-N 3.15Å; D49-Y51 PolarHBondContact O-N 3.34Å | ||
| 50 | K | 56.6 | Low | 69.4 | Low | 178 Ų | 178 | 117 Ų | 117 | 77% | 0.774 | 62% | 0.623 | S | S | * | * | trans | -81.6 | 34.7 | -148.8 | 44.4 | -178.7 | 162.3 | -72.1 | 0 | 114 | A48 | A48-K50 WeakPolarHBondContact O-CA 3.43Å; A48-K50 WeakPolarHBondContact O-CB 3.31Å; A48-K50 PolarHBondContact O-N 3.21Å | ||
| 51 | Y | 63.3 | Low | 71.5 | Confident | 194 Ų | 194 | 122.4 Ų | 122.4 | 76% | 0.761 | 63% | 0.626 | S | S | * | * | S | Bend | trans | -116.2 | 106.9 | 169.4 | -98.8 | -89.9 | 0 | 0 | 0 | 109.9 | D49 R53 | D49-Y51 PolarHBondContact O-N 3.34Å; Y51-R53 PolarHBondContact O-N 2.88Å |
| 52 | P | 76.4 | Confident | 73.7 | Confident | 117 Ų | 117 | 118.2 Ų | 118.2 | 76% | 0.76 | 60% | 0.597 | S | S | * | * | trans | -60.5 | 109.5 | 172.2 | 25.2 | -32.6 | 0 | 0 | 0 | 108.8 | T54 | P52-T54 PolarHBondContact O-N 3.3Å; P52-T54 VanDerWaalsContact O-N 3.08Å | ||
| 53 | R | 83.3 | Confident | 75.8 | Confident | 235 Ų | 235 | 115.9 Ų | 115.9 | 89% | 0.887 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 116.7 | -175.5 | -71.2 | -63.5 | -147.7 | -178.3 | 4.1 | 109.7 | Y51 | Y51-R53 PolarHBondContact O-N 2.88Š|
| 54 | T | 83.4 | Confident | 77.8 | Confident | 108 Ų | 108 | 111.8 Ų | 111.8 | 66% | 0.663 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -60 | 129 | -178.2 | 47.8 | 0 | 0 | 0 | 0 | 110.6 | P52 | P52-T54 PolarHBondContact O-N 3.3Å; P52-T54 VanDerWaalsContact O-N 3.08Å |
| 55 | P | 93 | Very high | 79.6 | Confident | 85 Ų | 85 | 107.2 Ų | 107.2 | 55% | 0.552 | 55% | 0.55 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 139.2 | -176.4 | 24.9 | -33.2 | 0 | 0 | 0 | 110.4 | L69 | P55-L69 HydrophobicContact CB-CB 4.17Å; P55-L69 HydrophobicContact CB-CD2 4.13Å; P55-L69 HydrophobicContact CG-CB 4.27Å; P55-L69 VanDerWaalsContact O-CB 3.25Å; P55-L69 WeakPolarHBondContact O-CB 3.19Å; P55-L69 PolarHBondContact O-N 3.33Å |
| 56 | K | 95.1 | Very high | 81.7 | Confident | 136 Ų | 136 | 104.1 Ų | 104.1 | 59% | 0.591 | 54% | 0.538 | S | S | * | . | B | Isolated β-bridge | trans | -104.8 | 148.1 | -179.2 | -71.8 | -178.9 | -82.6 | -170.8 | 0 | 111.1 | A58 V66 S67 | K56-A58 PolarHBondContact O-N 3.22Å; K56-A58 VanDerWaalsContact O-N 3.17Å; K56-V66 HydrophobicContact CD-CG1 3.65Å; K56-V66 HydrophobicContact CG-CG1 4.35Å; K56-S67 CarbonylContact C-O 3.56Å; K56-S67 WeakPolarHBondContact CA-O 3.31Å |
| 57 | C | 95.8 | Very high | 83.9 | Confident | 9 Ų | 9 | 94.9 Ų | 94.9 | 6% | 0.061 | 51% | 0.509 | C | S | . | . | trans | -68.3 | 113.2 | 178.6 | -173.5 | 0 | 0 | 0 | 0 | 111.2 | R59 C60 R61 S67 L69 | C57-R59 PolarHBondContact O-N 3.42Å; C57-C60 HydrophobicContact CB-CB 4.13Å; C57-C60 PolarHBondContact O-N 3.18Å; C57-R61 PolarHBondContact O-N 3.34Å; C57-R61 VanDerWaalsContact O-N 3.15Å; C57-S67 PolarHBondContact N-O 3.14Å; C57-L69 HydrophobicContact CB-CD1 4.36Å | ||
| 58 | A | 95.7 | Very high | 86 | Confident | 33 Ų | 33 | 93.8 Ų | 93.8 | 27% | 0.273 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -69.8 | -31.7 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113 | K56 R61 N62 I89 | K56-A58 PolarHBondContact O-N 3.22Å; K56-A58 VanDerWaalsContact O-N 3.17Å; A58-R61 PolarHBondContact O-N 2.9Å; A58-N62 PolarHBondContact O-N 3.02Å; A58-N62 PolarHBondContact O-OD1 3.42Å; A58-I89 HydrophobicContact CB-CD1 3.81Å; A58-I89 HydrophobicContact CB-CG2 4.43Å |
| 59 | R | 96.7 | Very high | 87.9 | Confident | 53 Ų | 53 | 93.7 Ų | 93.7 | 20% | 0.2 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -62.4 | -50.9 | 172.9 | -77.2 | 175.7 | 167.4 | -83.8 | -1.6 | 111.3 | C57 R61 N62 H63 W78 K79 C81 | C57-R59 PolarHBondContact O-N 3.42Å; R59-R61 VanDerWaalsContact C-N 3.32Å; R59-R61 PolarHBondContact O-N 3.45Å; R59-N62 WeakPolarHBondContact O-CB 3.48Å; R59-N62 PolarHBondContact O-N 3.06Å; R59-N62 VanDerWaalsContact O-N 3.16Å; R59-H63 PolarHBondContact O-CD2 2.86Å; R59-H63 VanDerWaalsContact O-CD2 3.32Å; R59-W78 HydrophobicContact CB-CB 4.5Å; R59-W78 WeakPolarHBondContact CD-O 3.31Å; R59-W78 PolarHBondContact NH1-O 3.29Å; R59-K79 PolarHBondContact NE-O 2.68Å; R59-K79 PolarHBondContact NH1-O 3.03Å; R59-K79 PolarHBondContact NH2-O 3.5Å; R59-C81 PolarHBondContact NH1-O 2.99Å |
| 60 | C | 97 | Very high | 89.8 | Confident | 1 Ų | 1 | 95.7 Ų | 95.7 | 1% | 0.007 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -60.5 | -41.3 | 178 | -57.7 | 0 | 0 | 0 | 0 | 112.3 | C57 N62 H63 G64 V65 H72 C76 W78 | C57-C60 HydrophobicContact CB-CB 4.13Å; C57-C60 PolarHBondContact O-N 3.18Å; C60-N62 PolarHBondContact O-N 3.35Å; C60-H63 CarbonylContact O-C 2.95Å; C60-H63 WeakPolarHBondContact O-CA 3.49Å; C60-H63 PolarHBondContact O-N 2.92Å; C60-G64 PolarHBondContact O-N 3.44Å; C60-V65 CarbonylContact C-O 3.58Å; C60-V65 WeakPolarHBondContact CB-O 3.42Å; C60-V65 PolarHBondContact O-N 2.86Å; C60-V65 VanDerWaalsContact O-N 3.15Å; C60-V65 VanDerWaalsContact O-O 3.09Å; C60-H72 PolarHBondContact SG-NE2 3.45Å; C60-C76 PolarHBondContact SG-SG 2.93Å; C60-W78 HydrophobicContact CB-CE3 4.01Å; C60-W78 HydrophobicContact CB-CZ3 3.9Å; C60-W78 VanDerWaalsContact SG-CE3 3.51Å |
| 61 | R | 96.4 | Very high | 91.5 | Very high | 171 Ų | 171 | 89.8 Ų | 89.8 | 65% | 0.645 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -57.2 | -35.9 | 177.2 | -170.8 | -175.8 | 67.2 | 143.5 | 0.7 | 112.5 | C57 A58 R59 H63 G64 V65 | C57-R61 PolarHBondContact O-N 3.34Å; C57-R61 VanDerWaalsContact O-N 3.15Å; A58-R61 PolarHBondContact O-N 2.9Å; R59-R61 VanDerWaalsContact C-N 3.32Å; R59-R61 PolarHBondContact O-N 3.45Å; R61-H63 PolarHBondContact O-N 2.86Å; R61-G64 PolarHBondContact O-N 3.15Å; R61-V65 PolarHBondContact N-O 2.88Å |
| 62 | N | 96.3 | Very high | 93.1 | Very high | 24 Ų | 24 | 82 Ų | 82 | 13% | 0.128 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -64.3 | -24.5 | 176.2 | -70.4 | -11.3 | 0 | 0 | 0 | 113.6 | A58 R59 C60 K85 C86 I89 | A58-N62 PolarHBondContact O-N 3.02Å; A58-N62 PolarHBondContact O-OD1 3.42Å; R59-N62 WeakPolarHBondContact O-CB 3.48Å; R59-N62 PolarHBondContact O-N 3.06Å; R59-N62 VanDerWaalsContact O-N 3.16Å; C60-N62 PolarHBondContact O-N 3.35Å; N62-K85 HydrophobicContact CB-CB 4.06Å; N62-K85 PolarHBondContact ND2-O 3.24Å; N62-K85 PolarHBondContact O-NZ 3.41Å; N62-C86 PolarHBondContact ND2-N 3.24Å; N62-C86 PolarHBondContact ND2-SG 3Å; N62-I89 WeakPolarHBondContact ND2-CD1 3.46Å |
| 63 | H | 97.3 | Very high | 93.8 | Very high | 62 Ų | 62 | 84.6 Ų | 84.6 | 29% | 0.287 | 45% | 0.449 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.4 | 20.9 | 179.2 | -61.7 | -79.3 | 0 | 0 | 0 | 112.4 | R59 C60 R61 V65 W78 C81 C83 C86 | R59-H63 PolarHBondContact O-CD2 2.86Å; R59-H63 VanDerWaalsContact O-CD2 3.32Å; C60-H63 CarbonylContact O-C 2.95Å; C60-H63 WeakPolarHBondContact O-CA 3.49Å; C60-H63 PolarHBondContact O-N 2.92Å; R61-H63 PolarHBondContact O-N 2.86Å; H63-V65 VanDerWaalsContact C-N 3.3Å; H63-V65 PolarHBondContact O-N 3.36Å; H63-W78 HydrophobicContact CB-CD2 4.01Å; H63-W78 HydrophobicContact CB-CG 4.4Å; H63-W78 HydrophobicContact CB-CH2 4.35Å; H63-W78 HydrophobicContact CB-CZ2 3.74Å; H63-W78 AromaticContact CD2-CD1 3.3Å; H63-W78 AromaticContact CD2-CD2 3.83Å; H63-W78 AromaticContact CD2-CG 3.35Å; H63-W78 AromaticContact CD2-NE1 3.71Å; H63-W78 AromaticContact CE1-CD1 3.78Å; H63-W78 AromaticContact CG-CD1 3.55Å; H63-W78 AromaticContact CG-CE2 3.76Å; H63-W78 AromaticContact CG-CG 3.9Å; H63-W78 AromaticContact CG-NE1 3.45Å; H63-W78 AromaticContact ND1-CD1 3.83Å; H63-W78 AromaticContact ND1-NE1 3.75Å; H63-W78 AromaticContact NE2-CD1 3.49Å; H63-W78 AromaticContact NE2-CG 3.83Å; H63-C81 VanDerWaalsContact CE1-SG 3.56Å; H63-C81 PolarHBondContact NE2-SG 2.96Å; H63-C81 VanDerWaalsContact NE2-SG 3.41Å; H63-C83 VanDerWaalsContact CE1-SG 3.56Å; H63-C86 PolarHBondContact NE2-SG 2.98Å; H63-C86 VanDerWaalsContact NE2-SG 3.44Å |
| 64 | G | 96.1 | Very high | 94.3 | Very high | 69 Ų | 69 | 82.2 Ų | 82.2 | 71% | 0.711 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.5 | -8.5 | 173 | 0 | 0 | 0 | 0 | 0 | 116.2 | C60 R61 | C60-G64 PolarHBondContact O-N 3.44Å; R61-G64 PolarHBondContact O-N 3.15Å |
| 65 | V | 95.8 | Very high | 94.9 | Very high | 65 Ų | 65 | 84.9 Ų | 84.9 | 39% | 0.394 | 44% | 0.439 | S | S | . | . | trans | -100.5 | 127.2 | -177.3 | 176.4 | 0 | 0 | 0 | 0 | 111.3 | C60 R61 H63 W78 | C60-V65 CarbonylContact C-O 3.58Å; C60-V65 WeakPolarHBondContact CB-O 3.42Å; C60-V65 PolarHBondContact O-N 2.86Å; C60-V65 VanDerWaalsContact O-N 3.15Å; C60-V65 VanDerWaalsContact O-O 3.09Å; R61-V65 PolarHBondContact N-O 2.88Å; H63-V65 VanDerWaalsContact C-N 3.3Å; H63-V65 PolarHBondContact O-N 3.36Å; V65-W78 HydrophobicContact CB-CH2 3.81Å; V65-W78 HydrophobicContact CB-CZ3 4.05Å; V65-W78 HydrophobicContact CG1-CH2 4.45Å; V65-W78 HydrophobicContact CG1-CZ3 4.46Å; V65-W78 HydrophobicContact CG2-CH2 3.71Å; V65-W78 HydrophobicContact CG2-CZ3 4.45Å | ||
| 66 | V | 94.2 | Very high | 95.1 | Very high | 104 Ų | 104 | 81.3 Ų | 81.3 | 63% | 0.63 | 42% | 0.417 | S | S | * | . | trans | -88.5 | 127 | 173.2 | 176.8 | 0 | 0 | 0 | 0 | 109.8 | K56 | K56-V66 HydrophobicContact CD-CG1 3.65Å; K56-V66 HydrophobicContact CG-CG1 4.35Å | ||
| 67 | S | 94.4 | Very high | 95.2 | Very high | 37 Ų | 37 | 84.3 Ų | 84.3 | 26% | 0.259 | 42% | 0.424 | S | S | . | . | trans | -140.3 | 145.7 | 171.2 | -166.5 | 0 | 0 | 0 | 0 | 110.1 | K56 C57 H72 | K56-S67 CarbonylContact C-O 3.56Å; K56-S67 WeakPolarHBondContact CA-O 3.31Å; C57-S67 PolarHBondContact N-O 3.14Å; S67-H72 PolarHBondContact OG-ND1 3.33Å | ||
| 68 | A | 94 | Very high | 95.2 | Very high | 53 Ų | 53 | 86.1 Ų | 86.1 | 44% | 0.438 | 43% | 0.43 | S | S | . | . | B | Isolated β-bridge | trans | -68.7 | 144.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | H72 | A68-H72 WeakPolarHBondContact O-CB 3.41Å |
| 69 | L | 93.5 | Very high | 95.2 | Very high | 76 Ų | 76 | 89.2 Ų | 89.2 | 40% | 0.398 | 44% | 0.437 | S | S | . | . | S | Bend | trans | -79.1 | -24.1 | -175.3 | -174.4 | 59.4 | 0 | 0 | 0 | 113.2 | P55 C57 G71 H72 | P55-L69 HydrophobicContact CB-CB 4.17Å; P55-L69 HydrophobicContact CB-CD2 4.13Å; P55-L69 HydrophobicContact CG-CB 4.27Å; P55-L69 VanDerWaalsContact O-CB 3.25Å; P55-L69 WeakPolarHBondContact O-CB 3.19Å; P55-L69 PolarHBondContact O-N 3.33Å; C57-L69 HydrophobicContact CB-CD1 4.36Å; L69-G71 PolarHBondContact O-N 2.92Å; L69-H72 PolarHBondContact O-N 2.86Å |
| 70 | K | 91.9 | Very high | 95.2 | Very high | 200 Ų | 200 | 92 Ų | 92 | 87% | 0.87 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | 126.3 | 176.6 | -175.4 | 73.2 | 174.5 | -175.1 | 0 | 109.4 | H72 | K70-H72 PolarHBondContact O-N 3.14Š|
| 71 | G | 92.4 | Very high | 95.2 | Very high | 54 Ų | 54 | 93.6 Ų | 93.6 | 56% | 0.557 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.7 | -34.3 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | L69 K73 | L69-G71 PolarHBondContact O-N 2.92Å; G71-K73 VanDerWaalsContact C-N 3.3Å; G71-K73 PolarHBondContact O-N 3.37Å; G71-K73 VanDerWaalsContact O-N 3.14Å |
| 72 | H | 95.4 | Very high | 95.3 | Very high | 31 Ų | 31 | 93.4 Ų | 93.4 | 14% | 0.144 | 48% | 0.475 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.1 | -16 | -168.9 | -172.3 | 79.8 | 0 | 0 | 0 | 116.1 | C60 S67 A68 L69 K70 R74 Y75 C76 | C60-H72 PolarHBondContact SG-NE2 3.45Å; S67-H72 PolarHBondContact OG-ND1 3.33Å; A68-H72 WeakPolarHBondContact O-CB 3.41Å; L69-H72 PolarHBondContact O-N 2.86Å; K70-H72 PolarHBondContact O-N 3.14Å; H72-R74 PolarHBondContact O-N 2.79Å; H72-R74 VanDerWaalsContact O-N 3.12Å; H72-Y75 CarbonylContact O-C 3.58Å; H72-Y75 PolarHBondContact O-N 2.89Å; H72-C76 WeakPolarHBondContact NE2-CA 3.33Å; H72-C76 WeakPolarHBondContact NE2-CB 3.39Å; H72-C76 PolarHBondContact NE2-SG 2.94Å; H72-C76 VanDerWaalsContact NE2-SG 3.45Å; H72-C76 WeakPolarHBondContact O-CB 3.45Å; H72-C76 PolarHBondContact O-N 2.93Å; H72-C76 VanDerWaalsContact O-N 3.15Å |
| 73 | K | 93 | Very high | 95.3 | Very high | 171 Ų | 171 | 94.4 Ų | 94.4 | 74% | 0.743 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.8 | -34.4 | -176.6 | -175.3 | 175.6 | -174.7 | -76.3 | 0 | 113.9 | G71 | G71-K73 VanDerWaalsContact C-N 3.3Å; G71-K73 PolarHBondContact O-N 3.37Å; G71-K73 VanDerWaalsContact O-N 3.14Å |
| 74 | R | 93.9 | Very high | 95.4 | Very high | 184 Ų | 184 | 95 Ų | 95 | 69% | 0.694 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -45.8 | 177.6 | -62.7 | -167.9 | -58.3 | -113.6 | 2.6 | 112.1 | H72 C76 | H72-R74 PolarHBondContact O-N 2.79Å; H72-R74 VanDerWaalsContact O-N 3.12Å; R74-C76 PolarHBondContact O-N 3.17Å |
| 75 | Y | 95.5 | Very high | 95.4 | Very high | 164 Ų | 164 | 97.5 Ų | 97.5 | 64% | 0.643 | 49% | 0.49 | S | S | * | . | S | Bend | trans | -86.9 | 24.1 | -174.7 | -44.7 | -73.4 | 0 | 0 | 0 | 113.5 | H72 R77 | H72-Y75 CarbonylContact O-C 3.58Å; H72-Y75 PolarHBondContact O-N 2.89Å; Y75-R77 PolarHBondContact O-N 3.36Å |
| 76 | C | 96.3 | Very high | 95.5 | Very high | 11 Ų | 11 | 94.4 Ų | 94.4 | 7% | 0.074 | 47% | 0.472 | C | S | . | . | trans | -81.8 | 112.5 | -178.3 | -174.9 | 0 | 0 | 0 | 0 | 110.3 | C60 H72 R74 W78 K79 | C60-C76 PolarHBondContact SG-SG 2.93Å; H72-C76 WeakPolarHBondContact NE2-CA 3.33Å; H72-C76 WeakPolarHBondContact NE2-CB 3.39Å; H72-C76 PolarHBondContact NE2-SG 2.94Å; H72-C76 VanDerWaalsContact NE2-SG 3.45Å; H72-C76 WeakPolarHBondContact O-CB 3.45Å; H72-C76 PolarHBondContact O-N 2.93Å; H72-C76 VanDerWaalsContact O-N 3.15Å; R74-C76 PolarHBondContact O-N 3.17Å; C76-W78 PolarHBondContact O-N 3.43Å; C76-K79 HydrophobicContact CB-CB 4.15Å; C76-K79 VanDerWaalsContact O-CB 3.25Å; C76-K79 WeakPolarHBondContact O-CB 3.49Å; C76-K79 PolarHBondContact O-N 3.18Å | ||
| 77 | R | 96.9 | Very high | 95.7 | Very high | 199 Ų | 199 | 93 Ų | 93 | 75% | 0.751 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | -13.1 | 178.1 | -167.9 | 165.4 | 68.1 | -179.4 | 3.5 | 114.4 | Y75 | Y75-R77 PolarHBondContact O-N 3.36Š|
| 78 | W | 97.2 | Very high | 95.9 | Very high | 46 Ų | 46 | 97 Ų | 97 | 17% | 0.174 | 48% | 0.481 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -121.2 | 22 | 175.3 | -55.5 | -84.9 | 0 | 0 | 0 | 113.2 | R59 C60 H63 V65 C76 D80 C81 | R59-W78 HydrophobicContact CB-CB 4.5Å; R59-W78 WeakPolarHBondContact CD-O 3.31Å; R59-W78 PolarHBondContact NH1-O 3.29Å; C60-W78 HydrophobicContact CB-CE3 4.01Å; C60-W78 HydrophobicContact CB-CZ3 3.9Å; C60-W78 VanDerWaalsContact SG-CE3 3.51Å; H63-W78 HydrophobicContact CB-CD2 4.01Å; H63-W78 HydrophobicContact CB-CG 4.4Å; H63-W78 HydrophobicContact CB-CH2 4.35Å; H63-W78 HydrophobicContact CB-CZ2 3.74Å; H63-W78 AromaticContact CD2-CD1 3.3Å; H63-W78 AromaticContact CD2-CD2 3.83Å; H63-W78 AromaticContact CD2-CG 3.35Å; H63-W78 AromaticContact CD2-NE1 3.71Å; H63-W78 AromaticContact CE1-CD1 3.78Å; H63-W78 AromaticContact CG-CD1 3.55Å; H63-W78 AromaticContact CG-CE2 3.76Å; H63-W78 AromaticContact CG-CG 3.9Å; H63-W78 AromaticContact CG-NE1 3.45Å; H63-W78 AromaticContact ND1-CD1 3.83Å; H63-W78 AromaticContact ND1-NE1 3.75Å; H63-W78 AromaticContact NE2-CD1 3.49Å; H63-W78 AromaticContact NE2-CG 3.83Å; V65-W78 HydrophobicContact CB-CH2 3.81Å; V65-W78 HydrophobicContact CB-CZ3 4.05Å; V65-W78 HydrophobicContact CG1-CH2 4.45Å; V65-W78 HydrophobicContact CG1-CZ3 4.46Å; V65-W78 HydrophobicContact CG2-CH2 3.71Å; V65-W78 HydrophobicContact CG2-CZ3 4.45Å; C76-W78 PolarHBondContact O-N 3.43Å; W78-D80 PolarHBondContact O-N 2.84Å; W78-C81 HydrophobicContact CB-CB 3.93Å; W78-C81 WeakPolarHBondContact O-CB 3.46Å; W78-C81 PolarHBondContact O-N 2.76Å; W78-C81 VanDerWaalsContact O-N 3.15Å |
| 79 | K | 95.8 | Very high | 96 | Very high | 99 Ų | 99 | 95.5 Ų | 95.5 | 43% | 0.43 | 47% | 0.466 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -44.3 | -47.9 | 178.7 | 176.5 | -173.5 | 157.4 | -72 | 0 | 111.9 | R59 C76 | R59-K79 PolarHBondContact NE-O 2.68Å; R59-K79 PolarHBondContact NH1-O 3.03Å; R59-K79 PolarHBondContact NH2-O 3.5Å; C76-K79 HydrophobicContact CB-CB 4.15Å; C76-K79 VanDerWaalsContact O-CB 3.25Å; C76-K79 WeakPolarHBondContact O-CB 3.49Å; C76-K79 PolarHBondContact O-N 3.18Å |
| 80 | D | 96 | Very high | 96.1 | Very high | 111 Ų | 111 | 93.6 Ų | 93.6 | 59% | 0.594 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.6 | 17 | -173.5 | -52.8 | -61.5 | 0 | 0 | 0 | 112.8 | W78 M82 | W78-D80 PolarHBondContact O-N 2.84Å; D80-M82 PolarHBondContact O-N 2.71Å |
| 81 | C | 97.3 | Very high | 96.4 | Very high | 35 Ų | 35 | 88 Ų | 88 | 24% | 0.236 | 44% | 0.438 | C | S | . | . | trans | -65.8 | 131.7 | 177 | -176.8 | 0 | 0 | 0 | 0 | 111.6 | R59 H63 W78 C86 | R59-C81 PolarHBondContact NH1-O 2.99Å; H63-C81 VanDerWaalsContact CE1-SG 3.56Å; H63-C81 PolarHBondContact NE2-SG 2.96Å; H63-C81 VanDerWaalsContact NE2-SG 3.41Å; W78-C81 HydrophobicContact CB-CB 3.93Å; W78-C81 WeakPolarHBondContact O-CB 3.46Å; W78-C81 PolarHBondContact O-N 2.76Å; W78-C81 VanDerWaalsContact O-N 3.15Å; C81-C86 WeakPolarHBondContact O-CB 3.43Å | ||
| 82 | M | 97.5 | Very high | 96.7 | Very high | 166 Ų | 166 | 93.6 Ų | 93.6 | 82% | 0.818 | 44% | 0.442 | S | S | * | . | trans | -105.5 | 11.7 | -176.9 | -61.4 | 176.3 | 67.5 | 0 | 0 | 114.3 | D80 T87 | D80-M82 PolarHBondContact O-N 2.71Å; M82-T87 PolarHBondContact O-OG1 2.79Å; M82-T87 VanDerWaalsContact O-OG1 3.07Å | ||
| 83 | C | 98.1 | Very high | 96.8 | Very high | 46 Ų | 46 | 97.5 Ų | 97.5 | 31% | 0.311 | 46% | 0.46 | S | S | . | . | S | Bend | trans | -62.1 | 150.7 | 175 | 77.3 | 0 | 0 | 0 | 0 | 111.1 | H63 K85 C86 T87 | H63-C83 VanDerWaalsContact CE1-SG 3.56Å; C83-K85 VanDerWaalsContact C-N 3.26Å; C83-K85 PolarHBondContact O-N 2.93Å; C83-C86 WeakPolarHBondContact O-CA 3.45Å; C83-C86 PolarHBondContact O-N 3.36Å; C83-T87 PolarHBondContact O-N 3.4Å; C83-T87 PolarHBondContact O-OG1 3.28Å |
| 84 | A | 97.7 | Very high | 97 | Very high | 74 Ų | 74 | 97 Ų | 97 | 61% | 0.612 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -48.2 | -43.4 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | C86 T87 L88 | A84-C86 VanDerWaalsContact C-N 3.29Å; A84-C86 PolarHBondContact O-N 3.2Å; A84-T87 PolarHBondContact O-N 2.71Å; A84-L88 WeakPolarHBondContact O-CB 3.49Å; A84-L88 VanDerWaalsContact O-CG 3.31Å; A84-L88 WeakPolarHBondContact O-CG 3.34Å; A84-L88 PolarHBondContact O-N 3.34Å |
| 85 | K | 97.7 | Very high | 97.2 | Very high | 121 Ų | 121 | 92.2 Ų | 92.2 | 53% | 0.526 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -59.5 | -35.5 | 176.3 | -71.6 | -175.3 | -77.2 | 177.7 | 0 | 113.3 | N62 C83 I89 | N62-K85 HydrophobicContact CB-CB 4.06Å; N62-K85 PolarHBondContact ND2-O 3.24Å; N62-K85 PolarHBondContact O-NZ 3.41Å; C83-K85 VanDerWaalsContact C-N 3.26Å; C83-K85 PolarHBondContact O-N 2.93Å; K85-I89 WeakPolarHBondContact O-CG1 3.49Å |
| 86 | C | 97.7 | Very high | 97.3 | Very high | 0 Ų | 0 | 89.4 Ų | 89.4 | 0% | 0 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -83.1 | -36.1 | 178.9 | -73.4 | 0 | 0 | 0 | 0 | 112.1 | N62 H63 C81 C83 A84 I89 A90 | N62-C86 PolarHBondContact ND2-N 3.24Å; N62-C86 PolarHBondContact ND2-SG 3Å; H63-C86 PolarHBondContact NE2-SG 2.98Å; H63-C86 VanDerWaalsContact NE2-SG 3.44Å; C81-C86 WeakPolarHBondContact O-CB 3.43Å; C83-C86 WeakPolarHBondContact O-CA 3.45Å; C83-C86 PolarHBondContact O-N 3.36Å; A84-C86 VanDerWaalsContact C-N 3.29Å; A84-C86 PolarHBondContact O-N 3.2Å; C86-I89 PolarHBondContact O-N 2.84Å; C86-I89 VanDerWaalsContact O-N 3.14Å; C86-A90 PolarHBondContact O-N 3.28Å |
| 87 | T | 98.1 | Very high | 97.4 | Very high | 75 Ų | 75 | 91.8 Ų | 91.8 | 46% | 0.46 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -61.2 | -44.3 | 173.1 | -52.2 | 0 | 0 | 0 | 0 | 111.5 | M82 C83 A84 I89 A90 E91 | M82-T87 PolarHBondContact O-OG1 2.79Å; M82-T87 VanDerWaalsContact O-OG1 3.07Å; C83-T87 PolarHBondContact O-N 3.4Å; C83-T87 PolarHBondContact O-OG1 3.28Å; A84-T87 PolarHBondContact O-N 2.71Å; T87-I89 PolarHBondContact O-N 2.99Å; T87-A90 WeakPolarHBondContact O-CB 3.3Å; T87-A90 PolarHBondContact O-N 3.34Å; T87-A90 VanDerWaalsContact O-N 3.11Å; T87-E91 PolarHBondContact O-N 2.89Å |
| 88 | L | 97.3 | Very high | 97.5 | Very high | 121 Ų | 121 | 85.3 Ų | 85.3 | 63% | 0.634 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -61.3 | -26.3 | 174.1 | -71.5 | 169.8 | 0 | 0 | 0 | 113.9 | A84 R92 | A84-L88 WeakPolarHBondContact O-CB 3.49Å; A84-L88 VanDerWaalsContact O-CG 3.31Å; A84-L88 WeakPolarHBondContact O-CG 3.34Å; A84-L88 PolarHBondContact O-N 3.34Å; L88-R92 WeakPolarHBondContact O-CB 3.3Å; L88-R92 PolarHBondContact O-N 2.85Å; L88-R92 VanDerWaalsContact O-N 3.14Å |
| 89 | I | 96.6 | Very high | 97.6 | Very high | 22 Ų | 22 | 88.7 Ų | 88.7 | 11% | 0.113 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -79.1 | -39.3 | 173.8 | -69.2 | -177.9 | 0 | 0 | 0 | 111.1 | A58 N62 K85 C86 T87 E91 R92 Q93 | A58-I89 HydrophobicContact CB-CD1 3.81Å; A58-I89 HydrophobicContact CB-CG2 4.43Å; N62-I89 WeakPolarHBondContact ND2-CD1 3.46Å; K85-I89 WeakPolarHBondContact O-CG1 3.49Å; C86-I89 PolarHBondContact O-N 2.84Å; C86-I89 VanDerWaalsContact O-N 3.14Å; T87-I89 PolarHBondContact O-N 2.99Å; I89-E91 VanDerWaalsContact C-N 3.32Å; I89-E91 PolarHBondContact O-N 3.41Å; I89-R92 PolarHBondContact O-N 2.82Å; I89-Q93 HydrophobicContact CG2-CG 4.43Å; I89-Q93 WeakPolarHBondContact O-CB 3.23Å; I89-Q93 VanDerWaalsContact O-CG 3.27Å; I89-Q93 WeakPolarHBondContact O-CG 3.26Å; I89-Q93 PolarHBondContact O-N 2.97Å |
| 90 | A | 96.9 | Very high | 97.7 | Very high | 35 Ų | 35 | 87.3 Ų | 87.3 | 29% | 0.289 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61 | -42.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | C86 T87 Q93 R94 | C86-A90 PolarHBondContact O-N 3.28Å; T87-A90 WeakPolarHBondContact O-CB 3.3Å; T87-A90 PolarHBondContact O-N 3.34Å; T87-A90 VanDerWaalsContact O-N 3.11Å; A90-Q93 WeakPolarHBondContact O-CB 3.33Å; A90-Q93 PolarHBondContact O-N 3.25Å; A90-R94 PolarHBondContact O-N 3Å |
| 91 | E | 97.7 | Very high | 97.8 | Very high | 83 Ų | 83 | 84.7 Ų | 84.7 | 39% | 0.388 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -67.2 | -44.6 | 177.2 | -167.8 | 50.2 | -125.4 | 0 | 0 | 112.3 | T87 I89 Q93 R94 V95 | T87-E91 PolarHBondContact O-N 2.89Å; I89-E91 VanDerWaalsContact C-N 3.32Å; I89-E91 PolarHBondContact O-N 3.41Å; E91-Q93 PolarHBondContact O-N 3.08Å; E91-R94 WeakPolarHBondContact O-CB 3.34Å; E91-R94 PolarHBondContact O-N 3.11Å; E91-R94 VanDerWaalsContact O-N 3.08Å; E91-R94 WeakPolarHBondContact OE1-CD 3.45Å; E91-R94 IonicContact OE2-CZ 2.66Å; E91-R94 IonicContact OE2-NH1 2.67Å; E91-R94 PolarHBondContact OE2-NH1 3.14Å; E91-V95 PolarHBondContact O-N 2.97Å |
| 92 | R | 97.9 | Very high | 97.8 | Very high | 172 Ų | 172 | 87.3 Ų | 87.3 | 65% | 0.649 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -55.9 | -38.3 | 171.6 | -178 | 179.2 | -63.1 | -86.1 | -3 | 112.2 | L88 I89 M96 | L88-R92 WeakPolarHBondContact O-CB 3.3Å; L88-R92 PolarHBondContact O-N 2.85Å; L88-R92 VanDerWaalsContact O-N 3.14Å; I89-R92 PolarHBondContact O-N 2.82Å; R92-M96 HydrophobicContact CG-CG 4.39Å; R92-M96 HydrophobicContact CG-SD 3.98Å; R92-M96 WeakPolarHBondContact O-CB 3.22Å; R92-M96 VanDerWaalsContact O-CG 3.24Å; R92-M96 WeakPolarHBondContact O-CG 3.41Å; R92-M96 PolarHBondContact O-N 2.83Å |
| 93 | Q | 96.9 | Very high | 97.9 | Very high | 113 Ų | 113 | 87.6 Ų | 87.6 | 53% | 0.528 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -69.6 | -37 | 177.4 | -76.1 | 175.1 | -20.2 | 0 | 0 | 112.4 | I89 A90 E91 A97 | I89-Q93 HydrophobicContact CG2-CG 4.43Å; I89-Q93 WeakPolarHBondContact O-CB 3.23Å; I89-Q93 VanDerWaalsContact O-CG 3.27Å; I89-Q93 WeakPolarHBondContact O-CG 3.26Å; I89-Q93 PolarHBondContact O-N 2.97Å; A90-Q93 WeakPolarHBondContact O-CB 3.33Å; A90-Q93 PolarHBondContact O-N 3.25Å; E91-Q93 PolarHBondContact O-N 3.08Å; Q93-A97 VanDerWaalsContact O-CB 3.26Å; Q93-A97 WeakPolarHBondContact O-CB 3.42Å; Q93-A97 PolarHBondContact O-N 3.21Å |
| 94 | R | 98.1 | Very high | 97.9 | Very high | 159 Ų | 159 | 94 Ų | 94 | 60% | 0.6 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60.3 | -53.2 | 171.4 | 174.6 | 179.5 | -74.1 | 116.3 | -3.6 | 111.3 | A90 E91 M96 A97 A98 | A90-R94 PolarHBondContact O-N 3Å; E91-R94 WeakPolarHBondContact O-CB 3.34Å; E91-R94 PolarHBondContact O-N 3.11Å; E91-R94 VanDerWaalsContact O-N 3.08Å; E91-R94 WeakPolarHBondContact OE1-CD 3.45Å; E91-R94 IonicContact OE2-CZ 2.66Å; E91-R94 IonicContact OE2-NH1 2.67Å; E91-R94 PolarHBondContact OE2-NH1 3.14Å; R94-M96 PolarHBondContact O-N 2.89Å; R94-A97 PolarHBondContact O-N 2.93Å; R94-A98 PolarHBondContact O-N 3.37Å |
| 95 | V | 98.1 | Very high | 97.9 | Very high | 84 Ų | 84 | 95.4 Ų | 95.4 | 51% | 0.509 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61 | -44.3 | 179.1 | 176.3 | 0 | 0 | 0 | 0 | 111.7 | E91 A97 A98 Q99 | E91-V95 PolarHBondContact O-N 2.97Å; V95-A97 VanDerWaalsContact C-N 3.35Å; V95-A97 PolarHBondContact O-N 3.49Å; V95-A98 PolarHBondContact O-N 3.48Å; V95-Q99 WeakPolarHBondContact O-CB 3.43Å; V95-Q99 PolarHBondContact O-N 2.95Å |
| 96 | M | 98.3 | Very high | 97.9 | Very high | 106 Ų | 106 | 94.6 Ų | 94.6 | 52% | 0.522 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -66 | -34.7 | 176.5 | -73.3 | -178.4 | 71.4 | 0 | 0 | 112.8 | R92 R94 Q99 V100 | R92-M96 HydrophobicContact CG-CG 4.39Å; R92-M96 HydrophobicContact CG-SD 3.98Å; R92-M96 WeakPolarHBondContact O-CB 3.22Å; R92-M96 VanDerWaalsContact O-CG 3.24Å; R92-M96 WeakPolarHBondContact O-CG 3.41Å; R92-M96 PolarHBondContact O-N 2.83Å; R94-M96 PolarHBondContact O-N 2.89Å; M96-Q99 PolarHBondContact O-N 3.48Å; M96-V100 WeakPolarHBondContact O-CB 3.18Å; M96-V100 VanDerWaalsContact O-CG2 3.27Å; M96-V100 WeakPolarHBondContact O-CG2 3.35Å; M96-V100 PolarHBondContact O-N 2.89Å |
| 97 | A | 98.3 | Very high | 97.9 | Very high | 61 Ų | 61 | 97.3 Ų | 97.3 | 50% | 0.504 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.6 | -45.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q93 R94 V95 Q99 V100 A101 | Q93-A97 VanDerWaalsContact O-CB 3.26Å; Q93-A97 WeakPolarHBondContact O-CB 3.42Å; Q93-A97 PolarHBondContact O-N 3.21Å; R94-A97 PolarHBondContact O-N 2.93Å; V95-A97 VanDerWaalsContact C-N 3.35Å; V95-A97 PolarHBondContact O-N 3.49Å; A97-Q99 PolarHBondContact O-N 3.2Å; A97-V100 PolarHBondContact O-N 3.14Å; A97-A101 WeakPolarHBondContact O-CB 3.25Å; A97-A101 PolarHBondContact O-N 3.31Å |
| 98 | A | 98.2 | Very high | 97.8 | Very high | 63 Ų | 63 | 99.2 Ų | 99.2 | 52% | 0.521 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R94 V95 V100 A101 L102 | R94-A98 PolarHBondContact O-N 3.37Å; V95-A98 PolarHBondContact O-N 3.48Å; A98-V100 VanDerWaalsContact C-N 3.34Å; A98-V100 PolarHBondContact O-N 3.3Å; A98-A101 PolarHBondContact O-N 3.43Å; A98-L102 WeakPolarHBondContact O-CB 3.3Å; A98-L102 PolarHBondContact O-N 3.23Å |
| 99 | Q | 98.6 | Very high | 97.7 | Very high | 116 Ų | 116 | 98 Ų | 98 | 54% | 0.542 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65 | -35.6 | 177.3 | -167.8 | -178.6 | 25.7 | 0 | 0 | 113 | V95 M96 A97 R103 | V95-Q99 WeakPolarHBondContact O-CB 3.43Å; V95-Q99 PolarHBondContact O-N 2.95Å; M96-Q99 PolarHBondContact O-N 3.48Å; A97-Q99 PolarHBondContact O-N 3.2Å; Q99-R103 PolarHBondContact O-N 3.16Å |
| 100 | V | 98.5 | Very high | 97.6 | Very high | 71 Ų | 71 | 103.8 Ų | 103.8 | 43% | 0.43 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -73.5 | -35.7 | 175.2 | 168.7 | 0 | 0 | 0 | 0 | 111.6 | M96 A97 A98 R104 | M96-V100 WeakPolarHBondContact O-CB 3.18Å; M96-V100 VanDerWaalsContact O-CG2 3.27Å; M96-V100 WeakPolarHBondContact O-CG2 3.35Å; M96-V100 PolarHBondContact O-N 2.89Å; A97-V100 PolarHBondContact O-N 3.14Å; A98-V100 VanDerWaalsContact C-N 3.34Å; A98-V100 PolarHBondContact O-N 3.3Å; V100-R104 WeakPolarHBondContact O-CD 3.48Å; V100-R104 VanDerWaalsContact O-CG 3.25Å; V100-R104 WeakPolarHBondContact O-CG 3.47Å; V100-R104 PolarHBondContact O-N 2.87Å; V100-R104 VanDerWaalsContact O-N 3.15Å |
| 101 | A | 98.3 | Very high | 97.6 | Very high | 56 Ų | 56 | 105.1 Ų | 105.1 | 46% | 0.463 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.6 | -52.1 | 173 | 0 | 0 | 0 | 0 | 0 | 111 | A97 A98 R103 R104 Q105 | A97-A101 WeakPolarHBondContact O-CB 3.25Å; A97-A101 PolarHBondContact O-N 3.31Å; A98-A101 PolarHBondContact O-N 3.43Å; A101-R103 VanDerWaalsContact C-N 3.34Å; A101-R103 PolarHBondContact O-N 3.15Å; A101-R104 WeakPolarHBondContact O-CB 3.49Å; A101-R104 PolarHBondContact O-N 3.46Å; A101-Q105 PolarHBondContact O-N 3.49Å |
| 102 | L | 98.4 | Very high | 97.4 | Very high | 90 Ų | 90 | 105.3 Ų | 105.3 | 47% | 0.471 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -56.1 | -44.1 | 178.3 | 179.1 | 62.3 | 0 | 0 | 0 | 112.5 | A98 R104 Q105 Q106 | A98-L102 WeakPolarHBondContact O-CB 3.3Å; A98-L102 PolarHBondContact O-N 3.23Å; L102-R104 VanDerWaalsContact C-N 3.32Å; L102-R104 PolarHBondContact O-N 3.46Å; L102-Q105 PolarHBondContact O-N 3.39Å; L102-Q106 HydrophobicContact CD1-CG 4.4Å; L102-Q106 WeakPolarHBondContact O-CG 3.39Å; L102-Q106 PolarHBondContact O-N 3.01Å |
| 103 | R | 98.3 | Very high | 97.1 | Very high | 171 Ų | 171 | 99.8 Ų | 99.8 | 65% | 0.645 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66.1 | -33.7 | 177 | -171.6 | -177.9 | -61.9 | 175.8 | 0.6 | 112.8 | Q99 A101 A107 | Q99-R103 PolarHBondContact O-N 3.16Å; A101-R103 VanDerWaalsContact C-N 3.34Å; A101-R103 PolarHBondContact O-N 3.15Å; R103-A107 WeakPolarHBondContact O-CB 3.41Å; R103-A107 PolarHBondContact O-N 3.48Å |
| 104 | R | 98.3 | Very high | 96.8 | Very high | 182 Ų | 182 | 101 Ų | 101 | 69% | 0.687 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -70.6 | -41.7 | 176 | -75.4 | 170.1 | 175.8 | -163.3 | -4 | 111.3 | V100 A101 L102 A107 Q108 | V100-R104 WeakPolarHBondContact O-CD 3.48Å; V100-R104 VanDerWaalsContact O-CG 3.25Å; V100-R104 WeakPolarHBondContact O-CG 3.47Å; V100-R104 PolarHBondContact O-N 2.87Å; V100-R104 VanDerWaalsContact O-N 3.15Å; A101-R104 WeakPolarHBondContact O-CB 3.49Å; A101-R104 PolarHBondContact O-N 3.46Å; L102-R104 VanDerWaalsContact C-N 3.32Å; L102-R104 PolarHBondContact O-N 3.46Å; R104-A107 PolarHBondContact O-N 3.44Å; R104-Q108 VanDerWaalsContact O-CB 3.32Å; R104-Q108 WeakPolarHBondContact O-CB 3.37Å; R104-Q108 PolarHBondContact O-N 2.99Å |
| 105 | Q | 98.1 | Very high | 96.5 | Very high | 103 Ų | 103 | 98.8 Ų | 98.8 | 48% | 0.481 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -57.5 | -52.5 | 171.9 | 174.9 | 177.5 | -4.7 | 0 | 0 | 110.4 | A101 L102 A107 Q108 E109 | A101-Q105 PolarHBondContact O-N 3.49Å; L102-Q105 PolarHBondContact O-N 3.39Å; Q105-A107 VanDerWaalsContact C-N 3.31Å; Q105-A107 PolarHBondContact O-N 3Å; Q105-Q108 CarbonylContact O-C 3.58Å; Q105-Q108 WeakPolarHBondContact O-CA 3.39Å; Q105-Q108 WeakPolarHBondContact O-CB 3.2Å; Q105-Q108 PolarHBondContact O-N 3.43Å; Q105-E109 HydrophobicContact CG-CG 4.23Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.49Å; Q105-E109 PolarHBondContact NE2-OE1 3.32Å; Q105-E109 WeakPolarHBondContact O-CB 3.44Å; Q105-E109 WeakPolarHBondContact O-CG 3.36Å; Q105-E109 PolarHBondContact O-N 2.94Å |
| 106 | Q | 98.1 | Very high | 95.8 | Very high | 104 Ų | 104 | 99.2 Ų | 99.2 | 49% | 0.486 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.8 | -40.5 | 177.7 | -72.3 | 174.3 | -34.9 | 0 | 0 | 113.2 | L102 Q108 E110 | L102-Q106 HydrophobicContact CD1-CG 4.4Å; L102-Q106 WeakPolarHBondContact O-CG 3.39Å; L102-Q106 PolarHBondContact O-N 3.01Å; Q106-Q108 VanDerWaalsContact C-N 3.34Å; Q106-E110 VanDerWaalsContact O-CB 3.26Å; Q106-E110 WeakPolarHBondContact O-CB 3.47Å; Q106-E110 PolarHBondContact O-N 3.24Å |
| 107 | A | 96.8 | Very high | 95 | Very high | 57 Ų | 57 | 100.7 Ų | 100.7 | 47% | 0.471 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -73.5 | -23.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | R103 R104 Q105 N111 | R103-A107 WeakPolarHBondContact O-CB 3.41Å; R103-A107 PolarHBondContact O-N 3.48Å; R104-A107 PolarHBondContact O-N 3.44Å; Q105-A107 VanDerWaalsContact C-N 3.31Å; Q105-A107 PolarHBondContact O-N 3Å; A107-N111 PolarHBondContact O-N 3.36Å |
| 108 | Q | 96.8 | Very high | 94 | Very high | 115 Ų | 115 | 103.1 Ų | 103.1 | 54% | 0.537 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -76.5 | -50.2 | 172.2 | 175.1 | 176.2 | -16.6 | 0 | 0 | 110.1 | R104 Q105 Q106 E110 N111 E112 | R104-Q108 VanDerWaalsContact O-CB 3.32Å; R104-Q108 WeakPolarHBondContact O-CB 3.37Å; R104-Q108 PolarHBondContact O-N 2.99Å; Q105-Q108 CarbonylContact O-C 3.58Å; Q105-Q108 WeakPolarHBondContact O-CA 3.39Å; Q105-Q108 WeakPolarHBondContact O-CB 3.2Å; Q105-Q108 PolarHBondContact O-N 3.43Å; Q106-Q108 VanDerWaalsContact C-N 3.34Å; Q108-E110 VanDerWaalsContact C-N 3.28Å; Q108-E110 PolarHBondContact O-N 3.29Å; Q108-N111 CarbonylContact O-C 3.58Å; Q108-N111 WeakPolarHBondContact O-CA 3.17Å; Q108-N111 PolarHBondContact O-N 2.77Å; Q108-E112 HydrophobicContact CG-CG 4.39Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.28Å; Q108-E112 PolarHBondContact NE2-OE1 3.44Å; Q108-E112 WeakPolarHBondContact O-CB 3.45Å; Q108-E112 WeakPolarHBondContact O-CG 3.41Å; Q108-E112 PolarHBondContact O-N 2.88Å |
| 109 | E | 95.2 | Very high | 92.9 | Very high | 94 Ų | 94 | 105.4 Ų | 105.4 | 44% | 0.439 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -55.8 | -40.9 | 173.6 | -69.6 | 166.6 | 171.3 | 0 | 0 | 111.4 | Q105 A113 | Q105-E109 HydrophobicContact CG-CG 4.23Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.49Å; Q105-E109 PolarHBondContact NE2-OE1 3.32Å; Q105-E109 WeakPolarHBondContact O-CB 3.44Å; Q105-E109 WeakPolarHBondContact O-CG 3.36Å; Q105-E109 PolarHBondContact O-N 2.94Å; E109-A113 WeakPolarHBondContact O-CB 3.47Å; E109-A113 PolarHBondContact O-N 3.45Å |
| 110 | E | 94.8 | Very high | 91.4 | Very high | 145 Ų | 145 | 105.5 Ų | 105.5 | 68% | 0.678 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.3 | -41.6 | 173.2 | -174.4 | -176.7 | 169.3 | 0 | 0 | 112.1 | Q106 Q108 R114 | Q106-E110 VanDerWaalsContact O-CB 3.26Å; Q106-E110 WeakPolarHBondContact O-CB 3.47Å; Q106-E110 PolarHBondContact O-N 3.24Å; Q108-E110 VanDerWaalsContact C-N 3.28Å; Q108-E110 PolarHBondContact O-N 3.29Å; E110-R114 VanDerWaalsContact O-CB 3.24Å; E110-R114 WeakPolarHBondContact O-CB 3.48Å; E110-R114 PolarHBondContact O-N 3.25Å |
| 111 | N | 95.2 | Very high | 89.8 | Confident | 63 Ų | 63 | 104 Ų | 104 | 34% | 0.337 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.3 | -43.7 | 176.6 | -178.3 | 79.2 | 0 | 0 | 0 | 112.1 | A107 Q108 R114 E115 | A107-N111 PolarHBondContact O-N 3.36Å; Q108-N111 CarbonylContact O-C 3.58Å; Q108-N111 WeakPolarHBondContact O-CA 3.17Å; Q108-N111 PolarHBondContact O-N 2.77Å; N111-R114 CarbonylContact O-C 3.37Å; N111-R114 WeakPolarHBondContact O-CB 3.48Å; N111-R114 PolarHBondContact O-N 3.42Å; N111-R114 PolarHBondContact OD1-NH2 3.38Å; N111-E115 PolarHBondContact ND2-OE2 2.9Å; N111-E115 VanDerWaalsContact O-CB 3.31Å; N111-E115 WeakPolarHBondContact O-CB 3.36Å; N111-E115 PolarHBondContact O-N 3.2Å |
| 112 | E | 94.2 | Very high | 88.4 | Confident | 86 Ų | 86 | 104.2 Ų | 104.2 | 40% | 0.402 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.3 | -45.1 | 176.8 | -72.4 | 169.1 | -172.4 | 0 | 0 | 110.4 | Q108 R114 E115 L116 | Q108-E112 HydrophobicContact CG-CG 4.39Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.28Å; Q108-E112 PolarHBondContact NE2-OE1 3.44Å; Q108-E112 WeakPolarHBondContact O-CB 3.45Å; Q108-E112 WeakPolarHBondContact O-CG 3.41Å; Q108-E112 PolarHBondContact O-N 2.88Å; E112-R114 VanDerWaalsContact C-N 3.33Å; E112-R114 PolarHBondContact O-N 2.88Å; E112-E115 PolarHBondContact O-N 3.39Å; E112-L116 WeakPolarHBondContact O-CB 3.33Å; E112-L116 VanDerWaalsContact O-CG 3.24Å; E112-L116 WeakPolarHBondContact O-CG 3.42Å; E112-L116 PolarHBondContact O-N 3.43Å |
| 113 | A | 92.7 | Very high | 86.8 | Confident | 57 Ų | 57 | 104 Ų | 104 | 47% | 0.471 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61 | -39.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | E109 Q117 | E109-A113 WeakPolarHBondContact O-CB 3.47Å; E109-A113 PolarHBondContact O-N 3.45Å; A113-Q117 VanDerWaalsContact O-CB 3.23Å; A113-Q117 WeakPolarHBondContact O-CB 3.47Å; A113-Q117 PolarHBondContact O-N 2.89Å |
| 114 | R | 90.4 | Very high | 85.1 | Confident | 137 Ų | 137 | 103.8 Ų | 103.8 | 52% | 0.517 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.9 | -33.5 | 175.5 | -172.6 | -164.3 | 62.7 | 67.2 | 7 | 112.5 | E110 N111 E112 L118 | E110-R114 VanDerWaalsContact O-CB 3.24Å; E110-R114 WeakPolarHBondContact O-CB 3.48Å; E110-R114 PolarHBondContact O-N 3.25Å; N111-R114 CarbonylContact O-C 3.37Å; N111-R114 WeakPolarHBondContact O-CB 3.48Å; N111-R114 PolarHBondContact O-N 3.42Å; N111-R114 PolarHBondContact OD1-NH2 3.38Å; E112-R114 VanDerWaalsContact C-N 3.33Å; E112-R114 PolarHBondContact O-N 2.88Å; R114-L118 PolarHBondContact O-N 3.28Å; R114-L118 VanDerWaalsContact O-N 3.11Å |
| 115 | E | 90.4 | Very high | 83.5 | Confident | 113 Ų | 113 | 95.6 Ų | 95.6 | 53% | 0.528 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -73.8 | -45.1 | 177.3 | -172.2 | 165.7 | 163 | 0 | 0 | 111.2 | N111 E112 Q117 L118 L119 | N111-E115 PolarHBondContact ND2-OE2 2.9Å; N111-E115 VanDerWaalsContact O-CB 3.31Å; N111-E115 WeakPolarHBondContact O-CB 3.36Å; N111-E115 PolarHBondContact O-N 3.2Å; E112-E115 PolarHBondContact O-N 3.39Å; E115-Q117 VanDerWaalsContact C-N 3.32Å; E115-Q117 PolarHBondContact O-N 3.43Å; E115-L118 WeakPolarHBondContact O-CB 3.26Å; E115-L118 PolarHBondContact O-N 2.9Å; E115-L119 WeakPolarHBondContact O-CB 3.33Å; E115-L119 PolarHBondContact O-N 2.91Å |
| 116 | L | 84.8 | Confident | 81.9 | Confident | 94 Ų | 94 | 94.9 Ų | 94.9 | 49% | 0.492 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -57.7 | -43.1 | 168.8 | -68.5 | 166.9 | 0 | 0 | 0 | 111.2 | E112 L118 L119 Y120 | E112-L116 WeakPolarHBondContact O-CB 3.33Å; E112-L116 VanDerWaalsContact O-CG 3.24Å; E112-L116 WeakPolarHBondContact O-CG 3.42Å; E112-L116 PolarHBondContact O-N 3.43Å; L116-L118 PolarHBondContact O-N 2.66Å; L116-L119 PolarHBondContact O-N 3.37Å; L116-Y120 HydrophobicContact CB-CD2 4.43Å; L116-Y120 HydrophobicContact CD2-CD2 4.25Å; L116-Y120 HydrophobicContact CD2-CE2 3.82Å; L116-Y120 WeakPolarHBondContact O-CB 3.21Å; L116-Y120 WeakPolarHBondContact O-CD2 3.34Å; L116-Y120 PolarHBondContact O-N 3.43Å |
| 117 | Q | 81.1 | Confident | 80.3 | Confident | 137 Ų | 137 | 92.8 Ų | 92.8 | 64% | 0.64 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64.1 | -26.9 | 175.5 | -176.3 | 58.5 | 46.6 | 0 | 0 | 112.9 | A113 E115 G121 | A113-Q117 VanDerWaalsContact O-CB 3.23Å; A113-Q117 WeakPolarHBondContact O-CB 3.47Å; A113-Q117 PolarHBondContact O-N 2.89Å; E115-Q117 VanDerWaalsContact C-N 3.32Å; E115-Q117 PolarHBondContact O-N 3.43Å; Q117-G121 WeakPolarHBondContact O-CA 3.32Å; Q117-G121 PolarHBondContact O-N 3.28Å |
| 118 | L | 77.8 | Confident | 79 | Confident | 111 Ų | 111 | 95.5 Ų | 95.5 | 58% | 0.581 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -78 | -41.9 | 173.5 | -161 | 73.1 | 0 | 0 | 0 | 111.3 | R114 E115 L116 T122 | R114-L118 PolarHBondContact O-N 3.28Å; R114-L118 VanDerWaalsContact O-N 3.11Å; E115-L118 WeakPolarHBondContact O-CB 3.26Å; E115-L118 PolarHBondContact O-N 2.9Å; L116-L118 PolarHBondContact O-N 2.66Å; L118-T122 WeakPolarHBondContact O-CG2 3.34Å; L118-T122 PolarHBondContact O-OG1 3.35Å; L118-T122 VanDerWaalsContact O-OG1 3.05Å |
| 119 | L | 74.9 | Confident | 77.5 | Confident | 111 Ų | 111 | 90.4 Ų | 90.4 | 58% | 0.581 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -70.5 | -35.3 | -178.9 | -173.6 | 63.9 | 0 | 0 | 0 | 113.3 | E115 L116 G125 | E115-L119 WeakPolarHBondContact O-CB 3.33Å; E115-L119 PolarHBondContact O-N 2.91Å; L116-L119 PolarHBondContact O-N 3.37Å; L119-G125 WeakPolarHBondContact O-CA 3.42Å |
| 120 | Y | 65.9 | Low | 76.1 | Confident | 119 Ų | 119 | 88.5 Ų | 88.5 | 47% | 0.467 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -105.7 | -17.4 | -179.1 | -68.8 | -76.2 | 0 | 0 | 0 | 114.2 | L116 L126 A129 | L116-Y120 HydrophobicContact CB-CD2 4.43Å; L116-Y120 HydrophobicContact CD2-CD2 4.25Å; L116-Y120 HydrophobicContact CD2-CE2 3.82Å; L116-Y120 WeakPolarHBondContact O-CB 3.21Å; L116-Y120 WeakPolarHBondContact O-CD2 3.34Å; L116-Y120 PolarHBondContact O-N 3.43Å; Y120-L126 VanDerWaalsContact O-CD1 3.28Å; Y120-L126 WeakPolarHBondContact O-CD1 3.49Å; Y120-L126 WeakPolarHBondContact O-CG 3.47Å; Y120-A129 HydrophobicContact CD1-CB 4.35Å; Y120-A129 HydrophobicContact CE1-CB 4.5Å |
| 121 | G | 66.5 | Low | 74.7 | Confident | 38 Ų | 38 | 85.5 Ų | 85.5 | 39% | 0.392 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -94.7 | -6.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q117 | Q117-G121 WeakPolarHBondContact O-CA 3.32Å; Q117-G121 PolarHBondContact O-N 3.28Å |
| 122 | T | 68.4 | Low | 73.8 | Confident | 61 Ų | 61 | 87.4 Ų | 87.4 | 37% | 0.374 | 49% | 0.492 | S | S | . | . | S | Bend | trans | -81.2 | 149.6 | 169.7 | 47.7 | 0 | 0 | 0 | 0 | 110.5 | L118 E124 G125 L126 | L118-T122 WeakPolarHBondContact O-CG2 3.34Å; L118-T122 PolarHBondContact O-OG1 3.35Å; L118-T122 VanDerWaalsContact O-OG1 3.05Å; T122-E124 PolarHBondContact O-N 2.87Å; T122-G125 WeakPolarHBondContact O-CA 3.23Å; T122-G125 PolarHBondContact O-N 2.91Å; T122-G125 PolarHBondContact OG1-N 2.8Å; T122-L126 WeakPolarHBondContact O-CD1 3.24Å; T122-L126 PolarHBondContact O-N 3.23Å |
| 123 | A | 64.3 | Low | 72.2 | Confident | 85 Ų | 85 | 85.7 Ų | 85.7 | 70% | 0.702 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.3 | -33.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | A127 | A123-A127 WeakPolarHBondContact O-CB 3.47Å; A123-A127 PolarHBondContact O-N 3Å |
| 124 | E | 63.5 | Low | 70.9 | Confident | 168 Ų | 168 | 88.1 Ų | 88.1 | 79% | 0.785 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -68.1 | -41.7 | 173.2 | -61.4 | 179.3 | 165.3 | 0 | 0 | 111.6 | T122 A127 L128 | T122-E124 PolarHBondContact O-N 2.87Å; E124-A127 PolarHBondContact O-N 2.89Å; E124-L128 WeakPolarHBondContact O-CB 3.18Å; E124-L128 PolarHBondContact O-N 3.2Å |
| 125 | G | 63.4 | Low | 69.3 | Low | 10 Ų | 10 | 85.1 Ų | 85.1 | 10% | 0.103 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -60.8 | -44.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | L119 T122 L128 A129 | L119-G125 WeakPolarHBondContact O-CA 3.42Å; T122-G125 WeakPolarHBondContact O-CA 3.23Å; T122-G125 PolarHBondContact O-N 2.91Å; T122-G125 PolarHBondContact OG1-N 2.8Å; G125-L128 PolarHBondContact O-N 2.84Å; G125-A129 WeakPolarHBondContact O-CB 3.36Å; G125-A129 PolarHBondContact O-N 3.41Å |
| 126 | L | 65.2 | Low | 67.5 | Low | 87 Ų | 87 | 84.3 Ų | 84.3 | 46% | 0.455 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.2 | -41.7 | 172.4 | -87.7 | 119.9 | 0 | 0 | 0 | 112.2 | Y120 T122 L128 A129 A130 I135 | Y120-L126 VanDerWaalsContact O-CD1 3.28Å; Y120-L126 WeakPolarHBondContact O-CD1 3.49Å; Y120-L126 WeakPolarHBondContact O-CG 3.47Å; T122-L126 WeakPolarHBondContact O-CD1 3.24Å; T122-L126 PolarHBondContact O-N 3.23Å; L126-L128 VanDerWaalsContact C-N 3.34Å; L126-A129 PolarHBondContact O-N 2.85Å; L126-A130 WeakPolarHBondContact O-CB 3.32Å; L126-A130 PolarHBondContact O-N 2.9Å; L126-I135 HydrophobicContact CD2-CD1 4.31Å |
| 127 | A | 64.4 | Low | 65.8 | Low | 60 Ų | 60 | 85.9 Ų | 85.9 | 50% | 0.496 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A123 E124 A130 A131 | A123-A127 WeakPolarHBondContact O-CB 3.47Å; A123-A127 PolarHBondContact O-N 3Å; E124-A127 PolarHBondContact O-N 2.89Å; A127-A130 PolarHBondContact O-N 2.99Å; A127-A131 WeakPolarHBondContact O-CB 3.39Å; A127-A131 PolarHBondContact O-N 2.9Å |
| 128 | L | 68.6 | Low | 64.2 | Low | 115 Ų | 115 | 90.3 Ų | 90.3 | 60% | 0.602 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -71.3 | -38.8 | 177.4 | -149.7 | 72.3 | 0 | 0 | 0 | 111.9 | E124 G125 L126 A130 A131 N132 | E124-L128 WeakPolarHBondContact O-CB 3.18Å; E124-L128 PolarHBondContact O-N 3.2Å; G125-L128 PolarHBondContact O-N 2.84Å; L126-L128 VanDerWaalsContact C-N 3.34Å; L128-A130 VanDerWaalsContact C-N 3.34Å; L128-A131 PolarHBondContact O-N 3.23Å; L128-N132 WeakPolarHBondContact O-CB 3.44Å; L128-N132 VanDerWaalsContact O-CG 3.23Å; L128-N132 PolarHBondContact O-N 2.93Å; L128-N132 PolarHBondContact O-ND2 3.01Å |
| 129 | A | 65.9 | Low | 62.7 | Low | 8 Ų | 8 | 90.6 Ų | 90.6 | 7% | 0.066 | 53% | 0.534 | C | S | . | . | H | α-helix | trans | -66.5 | -33.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | Y120 G125 L126 G133 I134 I135 | Y120-A129 HydrophobicContact CD1-CB 4.35Å; Y120-A129 HydrophobicContact CE1-CB 4.5Å; G125-A129 WeakPolarHBondContact O-CB 3.36Å; G125-A129 PolarHBondContact O-N 3.41Å; L126-A129 PolarHBondContact O-N 2.85Å; A129-G133 PolarHBondContact O-N 3.23Å; A129-I134 WeakPolarHBondContact O-CB 3.13Å; A129-I134 PolarHBondContact O-N 3.05Å; A129-I135 HydrophobicContact CB-CD1 4.02Å; A129-I135 HydrophobicContact CB-CG1 4.19Å |
| 130 | A | 66.4 | Low | 61.2 | Low | 53 Ų | 53 | 92.3 Ų | 92.3 | 44% | 0.438 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.7 | -45.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112 | L126 A127 L128 N132 G133 I135 | L126-A130 WeakPolarHBondContact O-CB 3.32Å; L126-A130 PolarHBondContact O-N 2.9Å; A127-A130 PolarHBondContact O-N 2.99Å; L128-A130 VanDerWaalsContact C-N 3.34Å; A130-N132 VanDerWaalsContact C-N 3.27Å; A130-N132 PolarHBondContact O-N 3.43Å; A130-G133 PolarHBondContact O-N 3.31Å; A130-I135 HydrophobicContact CB-CD1 4.29Å |
| 131 | A | 65.4 | Low | 59.9 | Low | 83 Ų | 83 | 96 Ų | 96 | 69% | 0.686 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62.2 | -33.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A127 L128 G133 | A127-A131 WeakPolarHBondContact O-CB 3.39Å; A127-A131 PolarHBondContact O-N 2.9Å; L128-A131 PolarHBondContact O-N 3.23Å; A131-G133 VanDerWaalsContact C-N 3.26Å; A131-G133 PolarHBondContact O-N 2.76Å |
| 132 | N | 75 | Confident | 58.9 | Low | 103 Ų | 103 | 101.9 Ų | 101.9 | 55% | 0.551 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | 5.5 | 174.3 | -67.2 | -25.9 | 0 | 0 | 0 | 113.7 | L128 A130 I134 | L128-N132 WeakPolarHBondContact O-CB 3.44Å; L128-N132 VanDerWaalsContact O-CG 3.23Å; L128-N132 PolarHBondContact O-N 2.93Å; L128-N132 PolarHBondContact O-ND2 3.01Å; A130-N132 VanDerWaalsContact C-N 3.27Å; A130-N132 PolarHBondContact O-N 3.43Å; N132-I134 VanDerWaalsContact C-N 3.25Å; N132-I134 HydrophobicContact CB-CD1 4.11Å; N132-I134 HydrophobicContact CB-CG1 4.17Å; N132-I134 PolarHBondContact O-N 2.79Å |
| 133 | G | 62.2 | Low | 57.5 | Low | 49 Ų | 49 | 104.2 Ų | 104.2 | 51% | 0.505 | 59% | 0.59 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 71 | 11 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | A129 A130 A131 I135 | A129-G133 PolarHBondContact O-N 3.23Å; A130-G133 PolarHBondContact O-N 3.31Å; A131-G133 VanDerWaalsContact C-N 3.26Å; A131-G133 PolarHBondContact O-N 2.76Å; G133-I135 VanDerWaalsContact C-N 3.31Å |
| 134 | I | 65.3 | Low | 56.2 | Low | 109 Ų | 109 | 109.5 Ų | 109.5 | 56% | 0.559 | 60% | 0.597 | S | S | * | * | trans | -75.3 | -24.8 | -177.5 | -56.1 | 173.1 | 0 | 0 | 0 | 111 | A129 N132 P136 | A129-I134 WeakPolarHBondContact O-CB 3.13Å; A129-I134 PolarHBondContact O-N 3.05Å; N132-I134 VanDerWaalsContact C-N 3.25Å; N132-I134 HydrophobicContact CB-CD1 4.11Å; N132-I134 HydrophobicContact CB-CG1 4.17Å; N132-I134 PolarHBondContact O-N 2.79Å; I134-P136 WeakPolarHBondContact O-CD 3.16Å | ||
| 135 | I | 55.9 | Low | 54.7 | Low | 73 Ų | 73 | 104.7 Ų | 104.7 | 37% | 0.374 | 59% | 0.593 | S | S | . | * | S | Bend | trans | -95.7 | 115.2 | 175.1 | -57.3 | 178.7 | 0 | 0 | 0 | 108.5 | L126 A129 A130 G133 | L126-I135 HydrophobicContact CD2-CD1 4.31Å; A129-I135 HydrophobicContact CB-CD1 4.02Å; A129-I135 HydrophobicContact CB-CG1 4.19Å; A130-I135 HydrophobicContact CB-CD1 4.29Å; G133-I135 VanDerWaalsContact C-N 3.31Å |
| 136 | P | 52.7 | Low | 53.5 | Low | 97 Ų | 97 | 110.3 Ų | 110.3 | 63% | 0.63 | 63% | 0.63 | S | S | * | * | trans | -59.6 | 136.3 | 173.8 | -23.1 | 33.6 | 0 | 0 | 0 | 110.7 | I134 R138 | I134-P136 WeakPolarHBondContact O-CD 3.16Å; P136-R138 PolarHBondContact O-N 3.31Å | ||
| 137 | P | 48.8 | Very low | 52 | Low | 126 Ų | 126 | 112.9 Ų | 112.9 | 82% | 0.818 | 65% | 0.65 | S | S | * | * | trans | -61.1 | 112.1 | 179.2 | 25 | -33.5 | 0 | 0 | 0 | 109.4 | P139 | P137-P139 WeakPolarHBondContact O-CD 3.43Š| ||
| 138 | R | 47.4 | Very low | 50.7 | Low | 230 Ų | 230 | 116 Ų | 116 | 87% | 0.868 | 66% | 0.658 | S | S | * | * | trans | -65.2 | 120.2 | 176 | -83.2 | -74.3 | -179.7 | 124.5 | -2.2 | 108.7 | P136 N140 | P136-R138 PolarHBondContact O-N 3.31Å; R138-N140 PolarHBondContact O-N 3Å | ||
| 139 | P | 46.6 | Very low | 49 | Very low | 117 Ų | 117 | 116 Ų | 116 | 76% | 0.76 | 67% | 0.667 | S | S | * | * | trans | -62.4 | 137.5 | 168.9 | 27.4 | -33.2 | 0 | 0 | 0 | 108.9 | P137 Y141 | P137-P139 WeakPolarHBondContact O-CD 3.43Å; P139-Y141 PolarHBondContact O-N 3.23Å | ||
| 140 | N | 43.3 | Very low | 47.6 | Very low | 147 Ų | 147 | 123.3 Ų | 123.3 | 79% | 0.786 | 70% | 0.7 | S | S | * | * | trans | -30.9 | 124.5 | -167.8 | -63.5 | -8.4 | 0 | 0 | 0 | 116.2 | R138 | R138-N140 PolarHBondContact O-N 3Š| ||
| 141 | Y | 38.8 | Very low | 46.1 | Very low | 198 Ų | 198 | 126.9 Ų | 126.9 | 78% | 0.776 | 72% | 0.722 | S | S | * | * | trans | -124.5 | 104.1 | 146.4 | 179.4 | -122.2 | 0 | 0 | 0 | 108.5 | P139 V143 | P139-Y141 PolarHBondContact O-N 3.23Å; Y141-V143 HydrophobicContact CD1-CG2 3.67Å; Y141-V143 HydrophobicContact CE1-CG2 3.4Å; Y141-V143 PolarHBondContact O-N 3.14Å | ||
| 142 | E | 45.7 | Very low | 44.6 | Very low | 160 Ų | 160 | 130.3 Ų | 130.3 | 75% | 0.748 | 73% | 0.729 | S | S | * | * | trans | -75 | 110.6 | 179.2 | -65.3 | -177.5 | 156.2 | 0 | 0 | 110.3 | F144 | E142-F144 PolarHBondContact O-N 2.98Š| ||
| 143 | V | 39.4 | Very low | 42.6 | Very low | 111 Ų | 111 | 130.8 Ų | 130.8 | 67% | 0.673 | 74% | 0.74 | S | S | * | * | trans | -95.1 | 85.7 | 167.8 | -176.7 | 0 | 0 | 0 | 0 | 109 | Y141 | Y141-V143 HydrophobicContact CD1-CG2 3.67Å; Y141-V143 HydrophobicContact CE1-CG2 3.4Å; Y141-V143 PolarHBondContact O-N 3.14Å | ||
| 144 | F | 36.2 | Very low | 41.3 | Very low | 195 Ų | 195 | 137.4 Ų | 137.4 | 86% | 0.855 | 76% | 0.758 | S | S | * | * | trans | 32.6 | 99 | 155.1 | -81.4 | -95.8 | 0 | 0 | 0 | 118.8 | E142 | E142-F144 PolarHBondContact O-N 2.98Š| ||
| 145 | G | 32 | Very low | 39.8 | Very low | 68 Ų | 68 | 137.9 Ų | 137.9 | 70% | 0.701 | 77% | 0.771 | S | S | * | * | 84.4 | 71.1 | 117 | 0 | 0 | 0 | 0 | 0 | 118.7 | V147 | G145-V147 PolarHBondContact O-N 3.11Š| |||
| 146 | S | 38.6 | Very low | 38.8 | Very low | 127 Ų | 127 | 139.6 Ų | 139.6 | 89% | 0.888 | 79% | 0.789 | S | S | * | * | trans | -68.9 | 110.5 | 150.7 | -66.4 | 0 | 0 | 0 | 0 | 109.8 | N148 | S146-N148 PolarHBondContact O-N 2.97Š| ||
| 147 | V | 33.7 | Very low | 38 | Very low | 142 Ų | 142 | 142.7 Ų | 142.7 | 86% | 0.861 | 80% | 0.799 | S | S | * | * | trans | -77.8 | 100.7 | 169.3 | -77.4 | 0 | 0 | 0 | 0 | 110.2 | G145 | G145-V147 PolarHBondContact O-N 3.11Š| ||
| 148 | N | 37 | Very low | 37.3 | Very low | 124 Ų | 124 | 143.6 Ų | 143.6 | 66% | 0.663 | 79% | 0.792 | S | S | * | * | trans | -98 | 135.8 | 161.1 | -170.7 | 29.6 | 0 | 0 | 0 | 109.1 | S146 | S146-N148 PolarHBondContact O-N 2.97Š| ||
| 149 | S | 32.2 | Very low | 36.5 | Very low | 115 Ų | 115 | 140.1 Ų | 140.1 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -142.2 | 99.7 | -179.2 | -70.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 150 | E | 37.5 | Very low | 35.9 | Very low | 163 Ų | 163 | 143.4 Ų | 143.4 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | trans | -98.1 | 124 | 177.9 | -61.3 | 175.4 | 100.2 | 0 | 0 | 110.2 | ||||
| 151 | S | 34.8 | Very low | 35.2 | Very low | 127 Ų | 127 | 143.5 Ų | 143.5 | 89% | 0.888 | 78% | 0.778 | S | S | * | * | trans | -164.4 | 113.8 | 157.4 | -85.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 152 | N | 33.7 | Very low | 34.9 | Very low | 155 Ų | 155 | 141.1 Ų | 141.1 | 83% | 0.829 | 78% | 0.778 | S | S | * | * | trans | -58.1 | 140 | 175.8 | 170.6 | 21.8 | 0 | 0 | 0 | 115.3 | ||||
| 153 | S | 32.6 | Very low | 34.7 | Very low | 114 Ų | 114 | 143 Ų | 143 | 80% | 0.797 | 78% | 0.783 | S | S | * | * | trans | -157.9 | 126.7 | 141 | 65.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 154 | E | 35.3 | Very low | 35.1 | Very low | 187 Ų | 187 | 143.6 Ų | 143.6 | 87% | 0.874 | 79% | 0.79 | S | S | * | * | trans | -93.3 | 142.2 | 177.9 | 178.7 | 177.2 | 73 | 0 | 0 | 112.5 | ||||
| 155 | S | 33.5 | Very low | 35.4 | Very low | 120 Ų | 120 | 141.8 Ų | 141.8 | 84% | 0.839 | 78% | 0.782 | S | S | * | * | trans | -164 | 154.1 | 157 | 38.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 156 | S | 34.9 | Very low | 35.4 | Very low | 108 Ų | 108 | 144.5 Ų | 144.5 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | trans | -108.4 | 147.2 | -172.5 | 177.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 157 | I | 37.1 | Very low | 35.4 | Very low | 162 Ų | 162 | 144.9 Ų | 144.9 | 83% | 0.831 | 77% | 0.773 | S | S | * | * | trans | 171.6 | 150.1 | 130.7 | -88.1 | 155.6 | 0 | 0 | 0 | 111.1 | ||||
| 158 | Q | 33.4 | Very low | 35.6 | Very low | 146 Ų | 146 | 144.8 Ų | 144.8 | 68% | 0.682 | 77% | 0.767 | S | S | * | * | trans | -91.1 | 160.8 | -178.6 | -51.4 | 152.1 | -15.8 | 0 | 0 | 111.9 | ||||
| 159 | K | 31.1 | Very low | 35.2 | Very low | 157 Ų | 157 | 144.2 Ų | 144.2 | 68% | 0.683 | 77% | 0.772 | S | S | * | * | 142.9 | 110.8 | 127.7 | -81.4 | 148.9 | -171.7 | 167.6 | 0 | 120.3 | |||||
| 160 | Y | 32.3 | Very low | 35.2 | Very low | 186 Ų | 186 | 142 Ų | 142 | 73% | 0.729 | 77% | 0.768 | S | S | * | * | trans | 59 | 178.7 | 138.4 | 79.1 | -110.5 | 0 | 0 | 0 | 124.5 | ||||
| 161 | E | 29.8 | Very low | 34.7 | Very low | 149 Ų | 149 | 140 Ų | 140 | 70% | 0.696 | 77% | 0.772 | S | S | * | * | trans | 72.3 | 99.8 | -162.5 | -60.7 | -47.6 | 135.5 | 0 | 0 | 114.9 | ||||
| 162 | L | 32.1 | Very low | 34.5 | Very low | 147 Ų | 147 | 139.6 Ų | 139.6 | 77% | 0.77 | 76% | 0.764 | S | S | * | * | cis | 88.2 | 143.1 | 35.8 | -74.6 | 106.6 | 0 | 0 | 0 | 117.4 | ||||
| 163 | F | 41.2 | Very low | 34.5 | Very low | 199 Ų | 199 | 138.3 Ų | 138.3 | 87% | 0.873 | 76% | 0.762 | S | S | * | * | trans | -97.5 | 167.3 | -163.2 | -61.8 | -99.3 | 0 | 0 | 0 | 113.7 | ||||
| 164 | P | 48 | Very low | 34.9 | Very low | 124 Ų | 124 | 138.2 Ų | 138.2 | 81% | 0.805 | 76% | 0.759 | S | S | * | * | -140.5 | 165.4 | 100.3 | 33.9 | -20 | 0 | 0 | 0 | 113.9 | |||||
| 165 | K | 42.8 | Very low | 34.6 | Very low | 158 Ų | 158 | 137.7 Ų | 137.7 | 69% | 0.687 | 76% | 0.756 | S | S | * | * | cis | 150.1 | 149.1 | -18.1 | 170.7 | 167.4 | 176.8 | 174.4 | 0 | 108.2 | ||||
| 166 | T | 32.4 | Very low | 34.3 | Very low | 125 Ų | 125 | 140.2 Ų | 140.2 | 77% | 0.767 | 75% | 0.752 | S | S | * | * | trans | -145.6 | -137.8 | 146.6 | 12.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 167 | Q | 37.1 | Very low | 33.9 | Very low | 135 Ų | 135 | 139.7 Ų | 139.7 | 63% | 0.631 | 75% | 0.748 | S | S | * | * | trans | -154.2 | 166.1 | -153.7 | -58.5 | -73.9 | 101.8 | 0 | 0 | 107.7 | ||||
| 168 | L | 37.9 | Very low | 33.5 | Very low | 140 Ų | 140 | 139.1 Ų | 139.1 | 73% | 0.733 | 75% | 0.752 | S | S | * | * | cis | -170 | 170.9 | -13.7 | -103.4 | 176.7 | 0 | 0 | 0 | 105.6 | ||||
| 169 | S | 30.3 | Very low | 33.2 | Very low | 112 Ų | 112 | 135.7 Ų | 135.7 | 78% | 0.783 | 76% | 0.756 | S | S | * | * | cis | -131.8 | -131.9 | -1.5 | -156.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 170 | G | 30.7 | Very low | 33.2 | Very low | 69 Ų | 69 | 137.4 Ų | 137.4 | 71% | 0.711 | 76% | 0.763 | S | S | * | * | cis | 131 | 124.7 | -6.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 171 | S | 27.6 | Very low | 33.5 | Very low | 120 Ų | 120 | 134.2 Ų | 134.2 | 84% | 0.839 | 77% | 0.765 | S | S | * | * | cis | -151.3 | 177.7 | 9.7 | -162.5 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 172 | T | 31.1 | Very low | 33.4 | Very low | 118 Ų | 118 | 130.9 Ų | 130.9 | 72% | 0.724 | 76% | 0.763 | S | S | * | * | trans | -85.1 | -172.8 | -179.8 | 56.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 173 | T | 32.7 | Very low | 33.2 | Very low | 129 Ų | 129 | 128.6 Ų | 128.6 | 79% | 0.791 | 76% | 0.76 | S | S | * | * | cis | -165 | 178.5 | 27.8 | -8.8 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 174 | P | 41 | Very low | 32.8 | Very low | 112 Ų | 112 | 125.3 Ų | 125.3 | 73% | 0.727 | 76% | 0.756 | S | S | * | * | trans | -114.3 | 171.7 | -160.7 | 43.6 | -39.4 | 0 | 0 | 0 | 119.5 | ||||
| 175 | Q | 29.3 | Very low | 31.8 | Very low | 176 Ų | 176 | 127.2 Ų | 127.2 | 82% | 0.822 | 75% | 0.754 | S | S | * | * | trans | 66 | 125.4 | 148.2 | -99.9 | -156.1 | 1.3 | 0 | 0 | 124.8 | ||||
| 176 | K | 27.3 | Very low | 31.6 | Very low | 173 Ų | 173 | 124.5 Ų | 124.5 | 75% | 0.752 | 76% | 0.755 | S | S | * | * | 91.7 | 102.4 | 125.3 | -162.6 | 177.4 | 178.8 | -173.5 | 0 | 122.2 | |||||
| 177 | S | 27.6 | Very low | 31.5 | Very low | 97 Ų | 97 | 125.1 Ų | 125.1 | 68% | 0.678 | 75% | 0.753 | S | S | * | * | trans | 88.8 | 153.4 | 133.2 | 76.6 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 178 | V | 28.1 | Very low | 31.4 | Very low | 149 Ų | 149 | 124 Ų | 124 | 90% | 0.903 | 76% | 0.76 | S | S | * | * | trans | 74.1 | 136.4 | 164.9 | -171 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 179 | G | 27.8 | Very low | 31.4 | Very low | 74 Ų | 74 | 121.7 Ų | 121.7 | 76% | 0.763 | 76% | 0.762 | S | S | * | * | trans | 123 | 123.1 | 154.4 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 180 | K | 30.5 | Very low | 32.4 | Very low | 194 Ų | 194 | 121.9 Ų | 121.9 | 84% | 0.843 | 76% | 0.761 | S | S | * | * | trans | -154.3 | 125.4 | 164 | -173.7 | 167.4 | -177.1 | 173.3 | 0 | 109.6 | ||||
| 181 | P | 37.8 | Very low | 32.4 | Very low | 118 Ų | 118 | 122.4 Ų | 122.4 | 77% | 0.766 | 77% | 0.766 | S | S | * | * | -119.1 | 159.7 | 110.1 | -1.8 | 23.5 | 0 | 0 | 0 | 110.4 | |||||
| 182 | A | 27.3 | Very low | 32.6 | Very low | 79 Ų | 79 | 125 Ų | 125 | 65% | 0.653 | 77% | 0.767 | S | S | * | * | 63.9 | 131.7 | 60.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 183 | S | 29.8 | Very low | 33.3 | Very low | 100 Ų | 100 | 125 Ų | 125 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | cis | -153.3 | 172.6 | 27.8 | -60.8 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 184 | T | 31.4 | Very low | 33.5 | Very low | 130 Ų | 130 | 124.4 Ų | 124.4 | 80% | 0.798 | 77% | 0.773 | S | S | * | * | trans | 64.6 | 142.1 | 152.6 | 35.7 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 185 | E | 28.3 | Very low | 34.3 | Very low | 164 Ų | 164 | 125 Ų | 125 | 77% | 0.766 | 78% | 0.777 | S | S | * | * | cis | -157.6 | 161.2 | 0.2 | 58.1 | -169.4 | 85.9 | 0 | 0 | 112.4 | ||||
| 186 | S | 36.9 | Very low | 34.9 | Very low | 100 Ų | 100 | 124.8 Ų | 124.8 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | trans | 57.9 | 138.2 | 154.4 | -48.8 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 187 | D | 31.4 | Very low | 35.3 | Very low | 138 Ų | 138 | 120.2 Ų | 120.2 | 74% | 0.738 | 78% | 0.783 | S | S | * | * | cis | -155.7 | 170.1 | 1.9 | -158.3 | -87.3 | 0 | 0 | 0 | 111.9 | ||||
| 188 | S | 34.2 | Very low | 36.1 | Very low | 111 Ų | 111 | 126.1 Ų | 126.1 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | 73.7 | 136.5 | 158.1 | -75.9 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 189 | A | 38.4 | Very low | 36.7 | Very low | 93 Ų | 93 | 127.5 Ų | 127.5 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | trans | -154.8 | -173.6 | -179 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 190 | P | 51.8 | Low | 36.8 | Very low | 116 Ų | 116 | 127.8 Ų | 127.8 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | cis | -130.8 | 178.7 | -3.5 | 41.8 | -25.1 | 0 | 0 | 0 | 114.8 | M192 | P190-M192 HydrophobicContact CB-CG 4.36Š| ||
| 191 | G | 30.5 | Very low | 36.9 | Very low | 80 Ų | 80 | 122.8 Ų | 122.8 | 83% | 0.825 | 79% | 0.793 | S | S | * | * | trans | -168.2 | 70.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 192 | M | 32 | Very low | 36.5 | Very low | 175 Ų | 175 | 120.9 Ų | 120.9 | 86% | 0.862 | 80% | 0.795 | S | S | * | * | trans | -78.4 | 143.1 | -155.7 | -53.4 | 168.8 | 79.5 | 0 | 0 | 114.7 | P190 | P190-M192 HydrophobicContact CB-CG 4.36Š| ||
| 193 | S | 44.8 | Very low | 37 | Very low | 117 Ų | 117 | 123.3 Ų | 123.3 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -109.4 | 161.2 | 165.5 | 55.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 194 | S | 37.5 | Very low | 37.1 | Very low | 117 Ų | 117 | 121.3 Ų | 121.3 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | -152.3 | 158.5 | 176.5 | -91.2 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 195 | P | 58.2 | Low | 37.7 | Very low | 124 Ų | 124 | 120 Ų | 120 | 81% | 0.805 | 80% | 0.798 | S | S | * | * | trans | -137.3 | -169.4 | -144.8 | 42.5 | -23.5 | 0 | 0 | 0 | 116.1 | ||||
| 196 | D | 42.3 | Very low | 38.3 | Very low | 171 Ų | 171 | 119 Ų | 119 | 91% | 0.914 | 79% | 0.794 | S | S | * | * | trans | -66.1 | 151.1 | 165.8 | -87.3 | -80.1 | 0 | 0 | 0 | 114.2 | ||||
| 197 | G | 35.4 | Very low | 38.3 | Very low | 77 Ų | 77 | 121 Ų | 121 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | -170.8 | 140.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 198 | R | 44.8 | Very low | 38.6 | Very low | 221 Ų | 221 | 117.8 Ų | 117.8 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -108.5 | 149.2 | -176.8 | -67.2 | 175.7 | 170.7 | -170.5 | -3.3 | 112.1 | ||||
| 199 | H | 39.1 | Very low | 39.1 | Very low | 179 Ų | 179 | 119.4 Ų | 119.4 | 83% | 0.829 | 80% | 0.796 | S | S | * | * | 153.1 | 134.4 | 115.6 | -89.1 | -79.9 | 0 | 0 | 0 | 114.8 | |||||
| 200 | G | 30.9 | Very low | 39.1 | Very low | 80 Ų | 80 | 120.5 Ų | 120.5 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | trans | 92.3 | 152.3 | 138.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 201 | G | 31.3 | Very low | 38.5 | Very low | 88 Ų | 88 | 122.7 Ų | 122.7 | 91% | 0.907 | 80% | 0.798 | S | S | * | * | trans | 97.8 | 136.9 | 168.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 202 | G | 31.1 | Very low | 38.9 | Very low | 79 Ų | 79 | 122.9 Ų | 122.9 | 81% | 0.814 | 79% | 0.787 | S | S | * | * | trans | -165.1 | 160.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 203 | S | 37 | Very low | 38.8 | Very low | 129 Ų | 129 | 123.1 Ų | 123.1 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | trans | -174.9 | 150.2 | 166.4 | -166.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 204 | G | 32.3 | Very low | 38.5 | Very low | 58 Ų | 58 | 124.2 Ų | 124.2 | 60% | 0.598 | 78% | 0.779 | S | S | * | * | trans | 92.9 | 114.3 | 131.5 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 205 | S | 44.4 | Very low | 38.1 | Very low | 103 Ų | 103 | 126.2 Ų | 126.2 | 72% | 0.72 | 78% | 0.78 | S | S | * | * | 68.3 | 158.1 | 129.6 | -68.6 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 206 | E | 40 | Very low | 37.3 | Very low | 144 Ų | 144 | 125.1 Ų | 125.1 | 67% | 0.673 | 78% | 0.776 | S | S | * | * | cis | -168.5 | 156.7 | -33.5 | 62.6 | -167.2 | 72.8 | 0 | 0 | 111.5 | ||||
| 207 | N | 37.8 | Very low | 37.6 | Very low | 140 Ų | 140 | 122.6 Ų | 122.6 | 75% | 0.749 | 77% | 0.769 | S | S | * | * | trans | 60.4 | 162 | 158.3 | -50.5 | -26.6 | 0 | 0 | 0 | 119.2 | ||||
| 208 | G | 37.1 | Very low | 37.4 | Very low | 72 Ų | 72 | 124.6 Ų | 124.6 | 74% | 0.742 | 77% | 0.765 | S | S | * | * | trans | 151.3 | 35 | 177 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 209 | D | 44.5 | Very low | 36.9 | Very low | 144 Ų | 144 | 119.6 Ų | 119.6 | 77% | 0.77 | 76% | 0.764 | S | S | * | * | trans | -73 | 148.8 | 171.6 | 47.9 | -60.9 | 0 | 0 | 0 | 113.3 | ||||
| 210 | S | 39.3 | Very low | 36.8 | Very low | 116 Ų | 116 | 120.4 Ų | 120.4 | 81% | 0.811 | 77% | 0.766 | S | S | * | * | trans | -167.1 | 156.6 | 166.5 | 48.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 211 | E | 38 | Very low | 37 | Very low | 162 Ų | 162 | 122.6 Ų | 122.6 | 76% | 0.757 | 77% | 0.765 | S | S | * | * | trans | -138.1 | 151.5 | -153.5 | 65.6 | -150.9 | 70.2 | 0 | 0 | 115.6 | ||||
| 212 | S | 38.5 | Very low | 37.3 | Very low | 84 Ų | 84 | 126.9 Ų | 126.9 | 59% | 0.587 | 77% | 0.766 | S | S | * | * | trans | 62.6 | 147 | 164 | 65.5 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 213 | F | 30.1 | Very low | 37.6 | Very low | 181 Ų | 181 | 131.2 Ų | 131.2 | 79% | 0.794 | 76% | 0.763 | S | S | * | * | -163.4 | 145.8 | 57.1 | -87.7 | -76.2 | 0 | 0 | 0 | 113.5 | |||||
| 214 | I | 39.1 | Very low | 37.5 | Very low | 140 Ų | 140 | 131.7 Ų | 131.7 | 72% | 0.718 | 76% | 0.755 | S | S | * | * | trans | -8.8 | 132.8 | 159.8 | 17.2 | 173.2 | 0 | 0 | 0 | 120.3 | ||||
| 215 | N | 29.8 | Very low | 37.5 | Very low | 158 Ų | 158 | 132.1 Ų | 132.1 | 85% | 0.845 | 76% | 0.759 | S | S | * | * | -165.9 | 151.7 | 107.6 | -105.4 | -69.1 | 0 | 0 | 0 | 113.4 | |||||
| 216 | S | 40.3 | Very low | 36.9 | Very low | 102 Ų | 102 | 136 Ų | 136 | 71% | 0.713 | 77% | 0.766 | S | S | * | * | trans | -108.4 | 177.5 | 178.8 | -56.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 217 | P | 49.7 | Very low | 36.6 | Very low | 118 Ų | 118 | 138.4 Ų | 138.4 | 77% | 0.766 | 78% | 0.778 | S | S | * | * | -152.6 | 134.5 | 88.4 | 37.9 | -18.2 | 0 | 0 | 0 | 118.2 | |||||
| 218 | V | 30.2 | Very low | 36.8 | Very low | 118 Ų | 118 | 137.9 Ų | 137.9 | 72% | 0.715 | 78% | 0.78 | S | S | * | * | trans | 57.3 | 127.4 | 132.9 | 89.1 | 0 | 0 | 0 | 0 | 123 | ||||
| 219 | S | 35.1 | Very low | 37.6 | Very low | 117 Ų | 117 | 140.3 Ų | 140.3 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | -154.5 | 157.7 | 128.5 | -84 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 220 | K | 36 | Very low | 36.9 | Very low | 196 Ų | 196 | 137.2 Ų | 137.2 | 85% | 0.852 | 78% | 0.784 | S | S | * | * | trans | -100.3 | 144.2 | -159.2 | -54 | 168.9 | -176.9 | 174.4 | 0 | 113.6 | ||||
| 221 | P | 35.4 | Very low | 36.6 | Very low | 125 Ų | 125 | 137.1 Ų | 137.1 | 81% | 0.812 | 78% | 0.783 | S | S | * | * | trans | -93.3 | 159.1 | 152.3 | 35.6 | -30.2 | 0 | 0 | 0 | 112.1 | ||||
| 222 | L | 37.5 | Very low | 36.6 | Very low | 179 Ų | 179 | 136 Ų | 136 | 94% | 0.937 | 79% | 0.787 | S | S | * | * | trans | -107 | 164.4 | 165.4 | -170 | 62.2 | 0 | 0 | 0 | 109 | ||||
| 223 | K | 38.4 | Very low | 36.4 | Very low | 170 Ų | 170 | 137.3 Ų | 137.3 | 74% | 0.739 | 80% | 0.796 | S | S | * | * | trans | -134.1 | 133.3 | -154.3 | -177.8 | 178.8 | 173 | -178.5 | 0 | 115 | ||||
| 224 | D | 33.2 | Very low | 36.6 | Very low | 138 Ų | 138 | 134.6 Ų | 134.6 | 74% | 0.738 | 80% | 0.8 | S | S | * | * | trans | 61.2 | 162.4 | 154.2 | -58.2 | -0.3 | 0 | 0 | 0 | 123 | ||||
| 225 | G | 32.6 | Very low | 36.5 | Very low | 67 Ų | 67 | 136.5 Ų | 136.5 | 69% | 0.691 | 81% | 0.811 | S | S | * | * | trans | 122.9 | 58 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 226 | E | 32.7 | Very low | 36.6 | Very low | 184 Ų | 184 | 132.2 Ų | 132.2 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | 58.8 | 103.5 | 95.6 | -71.3 | -168 | 91.8 | 0 | 0 | 116 | |||||
| 227 | E | 33.3 | Very low | 36.4 | Very low | 196 Ų | 196 | 132.6 Ų | 132.6 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | -172.7 | 178.6 | 108.8 | 57.3 | -169.3 | 120.2 | 0 | 0 | 112.6 | |||||
| 228 | T | 42.8 | Very low | 36.2 | Very low | 129 Ų | 129 | 134.1 Ų | 134.1 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -149.9 | 158.3 | -157.5 | -80.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 229 | P | 52.7 | Low | 36.9 | Very low | 123 Ų | 123 | 133.8 Ų | 133.8 | 80% | 0.799 | 81% | 0.811 | S | S | * | * | cis | -131.2 | -179 | 16.7 | 24.5 | 0.8 | 0 | 0 | 0 | 116.7 | ||||
| 230 | G | 29.9 | Very low | 37.3 | Very low | 78 Ų | 78 | 131.5 Ų | 131.5 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | trans | -176.6 | 84.7 | 166.1 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 231 | S | 32.7 | Very low | 37.5 | Very low | 114 Ų | 114 | 126.6 Ų | 126.6 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | trans | -64.5 | 157.7 | 172.8 | -42.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 232 | V | 37.8 | Very low | 37.9 | Very low | 139 Ų | 139 | 129.1 Ų | 129.1 | 84% | 0.842 | 80% | 0.798 | S | S | * | * | cis | -149 | 174.7 | 33.5 | -72.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 233 | S | 34.3 | Very low | 38.2 | Very low | 111 Ų | 111 | 126.7 Ų | 126.7 | 78% | 0.776 | 79% | 0.791 | S | S | * | * | trans | -58.1 | 157.8 | 176.4 | -43.2 | 0 | 0 | 0 | 0 | 116 | ||||
| 234 | S | 34.3 | Very low | 38.5 | Very low | 125 Ų | 125 | 126.3 Ų | 126.3 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | -155.2 | 119.3 | 129.9 | -104.3 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 235 | L | 37.7 | Very low | 39.2 | Very low | 179 Ų | 179 | 127.9 Ų | 127.9 | 94% | 0.937 | 80% | 0.797 | S | S | * | * | trans | -82 | 154.1 | 153.7 | -75.2 | 148.1 | 0 | 0 | 0 | 107.7 | ||||
| 236 | G | 33 | Very low | 39.5 | Very low | 69 Ų | 69 | 130.9 Ų | 130.9 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | 160.5 | 97.7 | 167.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 237 | S | 36.1 | Very low | 39.8 | Very low | 110 Ų | 110 | 130.3 Ų | 130.3 | 77% | 0.769 | 80% | 0.8 | S | S | * | * | trans | 46.9 | 131.9 | 140.6 | -59.4 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 238 | D | 44.5 | Very low | 39.9 | Very low | 149 Ų | 149 | 129.5 Ų | 129.5 | 80% | 0.797 | 80% | 0.796 | S | S | * | * | trans | -39.5 | 142.8 | 138.8 | 54.7 | -61.5 | 0 | 0 | 0 | 114.1 | ||||
| 239 | S | 44.3 | Very low | 39.5 | Very low | 111 Ų | 111 | 130.5 Ų | 130.5 | 78% | 0.776 | 79% | 0.792 | S | S | * | * | trans | -153.6 | 112.1 | 151.5 | -164.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 240 | G | 44.3 | Very low | 39.1 | Very low | 70 Ų | 70 | 128.8 Ų | 128.8 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | -79.7 | 133.6 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 241 | S | 40.7 | Very low | 39.1 | Very low | 93 Ų | 93 | 128.5 Ų | 128.5 | 65% | 0.65 | 77% | 0.766 | S | S | * | * | trans | -154.4 | 90.6 | 170.9 | -67.5 | 0 | 0 | 0 | 0 | 109.2 | T243 | S241-T243 PolarHBondContact O-N 3.34Š| ||
| 242 | E | 43 | Very low | 39.7 | Very low | 178 Ų | 178 | 128.5 Ų | 128.5 | 83% | 0.832 | 76% | 0.764 | S | S | * | * | trans | -54.6 | 129.7 | 153.6 | 48.6 | -96.2 | 64.9 | 0 | 0 | 110.1 | ||||
| 243 | T | 43.2 | Very low | 40 | Very low | 127 Ų | 127 | 125.7 Ų | 125.7 | 78% | 0.779 | 75% | 0.751 | S | S | * | * | trans | -131.5 | 77.7 | 166.6 | 39.9 | 0 | 0 | 0 | 0 | 108.7 | S241 | S241-T243 PolarHBondContact O-N 3.34Š| ||
| 244 | D | 44.4 | Very low | 40.7 | Very low | 162 Ų | 162 | 122.7 Ų | 122.7 | 87% | 0.866 | 73% | 0.729 | S | S | * | * | trans | -58.4 | 136.3 | 155 | -157.8 | -64.9 | 0 | 0 | 0 | 108.4 | ||||
| 245 | K | 49.3 | Very low | 41.6 | Very low | 171 Ų | 171 | 118.6 Ų | 118.6 | 74% | 0.743 | 70% | 0.703 | S | S | * | * | trans | -156.7 | 94.5 | -177.7 | -161.7 | 179.8 | 177.5 | 176.3 | 0 | 114.4 | ||||
| 246 | D | 37.4 | Very low | 42.5 | Very low | 130 Ų | 130 | 112.5 Ų | 112.5 | 70% | 0.695 | 68% | 0.679 | S | S | * | * | trans | 54.8 | 108.2 | 143.5 | -54.8 | -55.8 | 0 | 0 | 0 | 118.7 | ||||
| 247 | D | 41 | Very low | 43.9 | Very low | 173 Ų | 173 | 112 Ų | 112 | 93% | 0.925 | 66% | 0.664 | S | S | * | * | trans | -58.9 | 134.1 | 152.8 | -79.9 | -78 | 0 | 0 | 0 | 111.2 | ||||
| 248 | Q | 34.4 | Very low | 45.4 | Very low | 178 Ų | 178 | 114.9 Ų | 114.9 | 83% | 0.832 | 66% | 0.658 | S | S | * | * | trans | -114.6 | 129.6 | 173 | -172.7 | 87.9 | 98.3 | 0 | 0 | 109.9 | ||||
| 249 | E | 35 | Very low | 46.5 | Very low | 150 Ų | 150 | 109.6 Ų | 109.6 | 70% | 0.701 | 63% | 0.629 | S | S | * | * | trans | -48.1 | 148.5 | 175.2 | -117.3 | -98.9 | 120 | 0 | 0 | 112.8 | S251 | E249-S251 PolarHBondContact O-N 3.32Š| ||
| 250 | P | 43.3 | Very low | 47.6 | Very low | 88 Ų | 88 | 108.9 Ų | 108.9 | 57% | 0.571 | 61% | 0.614 | S | S | * | * | trans | -82.1 | 78.7 | -153.9 | 34.9 | -32.9 | 0 | 0 | 0 | 112.7 | ||||
| 251 | S | 30.6 | Very low | 49.6 | Very low | 71 Ų | 71 | 110.2 Ų | 110.2 | 50% | 0.497 | 61% | 0.605 | S | S | . | * | trans | -48.2 | 148.3 | 157.9 | -72 | 0 | 0 | 0 | 0 | 111.1 | E249 S253 S254 | E249-S251 PolarHBondContact O-N 3.32Å; S251-S253 PolarHBondContact O-N 3.14Å; S251-S254 PolarHBondContact O-N 3.5Å; S251-S254 VanDerWaalsContact O-N 3.14Å | ||
| 252 | P | 45.1 | Very low | 51.9 | Low | 115 Ų | 115 | 106 Ų | 106 | 75% | 0.747 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | -13.9 | -170.3 | 21.4 | -33.5 | 0 | 0 | 0 | 115 | S254 A255 | P252-S254 PolarHBondContact O-N 2.96Å; P252-S254 VanDerWaalsContact O-N 3.11Å; P252-A255 PolarHBondContact O-N 2.92Å |
| 253 | S | 43.9 | Very low | 54 | Low | 80 Ų | 80 | 97.5 Ų | 97.5 | 56% | 0.559 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -42.6 | -36.4 | 166.4 | -47.2 | 0 | 0 | 0 | 0 | 114.2 | S251 A255 A256 S257 | S251-S253 PolarHBondContact O-N 3.14Å; S253-A255 PolarHBondContact O-N 3.23Å; S253-A256 CarbonylContact O-C 3.59Å; S253-A256 WeakPolarHBondContact O-CA 3.31Å; S253-A256 WeakPolarHBondContact O-CB 3.43Å; S253-A256 PolarHBondContact O-N 2.95Å; S253-S257 PolarHBondContact O-N 3.08Å; S253-S257 PolarHBondContact O-OG 3.43Å |
| 254 | S | 50 | Low | 56.2 | Low | 47 Ų | 47 | 94.6 Ų | 94.6 | 33% | 0.329 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68 | -19.8 | -179.8 | -66.3 | 0 | 0 | 0 | 0 | 114.3 | S251 P252 S257 R258 | S251-S254 PolarHBondContact O-N 3.5Å; S251-S254 VanDerWaalsContact O-N 3.14Å; P252-S254 PolarHBondContact O-N 2.96Å; P252-S254 VanDerWaalsContact O-N 3.11Å; S254-S257 PolarHBondContact O-OG 3.22Å; S254-R258 WeakPolarHBondContact O-CG 3.49Å; S254-R258 VanDerWaalsContact O-CZ 3.23Å; S254-R258 PolarHBondContact O-NE 3.49Å |
| 255 | A | 52.1 | Low | 58.4 | Low | 40 Ų | 40 | 90.4 Ų | 90.4 | 33% | 0.331 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -81.7 | -34.3 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | P252 S253 H259 | P252-A255 PolarHBondContact O-N 2.92Å; S253-A255 PolarHBondContact O-N 3.23Å; A255-H259 VanDerWaalsContact O-CB 3.25Å; A255-H259 WeakPolarHBondContact O-CB 3.49Å; A255-H259 PolarHBondContact O-N 2.96Å |
| 256 | A | 57.7 | Low | 60.2 | Low | 51 Ų | 51 | 82.2 Ų | 82.2 | 42% | 0.421 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -72.2 | -39.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S253 H259 M260 | S253-A256 CarbonylContact O-C 3.59Å; S253-A256 WeakPolarHBondContact O-CA 3.31Å; S253-A256 WeakPolarHBondContact O-CB 3.43Å; S253-A256 PolarHBondContact O-N 2.95Å; A256-H259 WeakPolarHBondContact O-CB 3.35Å; A256-H259 PolarHBondContact O-N 3.5Å; A256-M260 WeakPolarHBondContact O-CG 3.32Å; A256-M260 PolarHBondContact O-N 3.39Å |
| 257 | S | 62.5 | Low | 62.7 | Low | 58 Ų | 58 | 78.3 Ų | 78.3 | 41% | 0.406 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65 | -45.4 | 175.4 | 62 | 0 | 0 | 0 | 0 | 111.6 | S253 S254 H259 M260 N261 | S253-S257 PolarHBondContact O-N 3.08Å; S253-S257 PolarHBondContact O-OG 3.43Å; S254-S257 PolarHBondContact O-OG 3.22Å; S257-H259 VanDerWaalsContact C-N 3.3Å; S257-H259 PolarHBondContact O-N 2.97Å; S257-M260 PolarHBondContact O-N 3.47Å; S257-N261 WeakPolarHBondContact O-CB 3.41Å; S257-N261 VanDerWaalsContact O-CG 3.22Å; S257-N261 PolarHBondContact O-N 3.3Å; S257-N261 PolarHBondContact O-ND2 3.18Å |
| 258 | R | 66 | Low | 65 | Low | 170 Ų | 170 | 79.4 Ų | 79.4 | 64% | 0.642 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -60.5 | -37.7 | 171.6 | -71.3 | -168.3 | -64.2 | -105.8 | 4.6 | 112.3 | S254 A262 | S254-R258 WeakPolarHBondContact O-CG 3.49Å; S254-R258 VanDerWaalsContact O-CZ 3.23Å; S254-R258 PolarHBondContact O-NE 3.49Å; R258-A262 WeakPolarHBondContact O-CB 3.48Å; R258-A262 PolarHBondContact O-N 3.05Å |
| 259 | H | 67.7 | Low | 67.6 | Low | 38 Ų | 38 | 74.6 Ų | 74.6 | 18% | 0.176 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.7 | -47.2 | 175.4 | -172.6 | -117.2 | 0 | 0 | 0 | 112.3 | A255 A256 S257 A262 I263 | A255-H259 VanDerWaalsContact O-CB 3.25Å; A255-H259 WeakPolarHBondContact O-CB 3.49Å; A255-H259 PolarHBondContact O-N 2.96Å; A256-H259 WeakPolarHBondContact O-CB 3.35Å; A256-H259 PolarHBondContact O-N 3.5Å; S257-H259 VanDerWaalsContact C-N 3.3Å; S257-H259 PolarHBondContact O-N 2.97Å; H259-A262 WeakPolarHBondContact O-CB 3.27Å; H259-A262 PolarHBondContact O-N 3.45Å; H259-I263 WeakPolarHBondContact O-CD1 3.24Å; H259-I263 VanDerWaalsContact O-CG1 3.22Å; H259-I263 WeakPolarHBondContact O-CG1 3.42Å; H259-I263 PolarHBondContact O-N 3.29Å |
| 260 | M | 68.6 | Low | 70.1 | Confident | 96 Ų | 96 | 68.5 Ų | 68.5 | 47% | 0.473 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -62.9 | -46.5 | 176.1 | -66.2 | -57.7 | 176.2 | 0 | 0 | 111.6 | A256 S257 A262 I263 D264 | A256-M260 WeakPolarHBondContact O-CG 3.32Å; A256-M260 PolarHBondContact O-N 3.39Å; S257-M260 PolarHBondContact O-N 3.47Å; M260-A262 VanDerWaalsContact C-N 3.28Å; M260-A262 PolarHBondContact O-N 3.32Å; M260-I263 PolarHBondContact O-N 3.36Å; M260-I263 HydrophobicContact SD-CD1 4.1Å; M260-D264 WeakPolarHBondContact O-CB 3.38Å; M260-D264 VanDerWaalsContact O-CG 3.22Å; M260-D264 PolarHBondContact O-N 3.07Å |
| 261 | N | 85.6 | Confident | 72.2 | Confident | 98 Ų | 98 | 69.6 Ų | 69.6 | 52% | 0.524 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -56.6 | -41.5 | 174.1 | -70.7 | -26.1 | 0 | 0 | 0 | 112.1 | S257 D264 I265 | S257-N261 WeakPolarHBondContact O-CB 3.41Å; S257-N261 VanDerWaalsContact O-CG 3.22Å; S257-N261 PolarHBondContact O-N 3.3Å; S257-N261 PolarHBondContact O-ND2 3.18Å; N261-D264 PolarHBondContact O-N 3.42Å; N261-I265 WeakPolarHBondContact O-CB 3.24Å; N261-I265 WeakPolarHBondContact O-CD1 3.5Å; N261-I265 WeakPolarHBondContact O-CG1 3.49Å; N261-I265 PolarHBondContact O-N 3.04Å |
| 262 | A | 88.3 | Confident | 74.6 | Confident | 4 Ų | 4 | 71.1 Ų | 71.1 | 3% | 0.033 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.8 | -46.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | R258 H259 M260 D264 I265 L266 L282 V289 | R258-A262 WeakPolarHBondContact O-CB 3.48Å; R258-A262 PolarHBondContact O-N 3.05Å; H259-A262 WeakPolarHBondContact O-CB 3.27Å; H259-A262 PolarHBondContact O-N 3.45Å; M260-A262 VanDerWaalsContact C-N 3.28Å; M260-A262 PolarHBondContact O-N 3.32Å; A262-D264 VanDerWaalsContact C-N 3.34Å; A262-D264 PolarHBondContact O-N 2.96Å; A262-I265 PolarHBondContact O-N 3.01Å; A262-L266 WeakPolarHBondContact O-CG 3.26Å; A262-L266 PolarHBondContact O-N 3.19Å; A262-L282 HydrophobicContact CB-CD1 4.1Å; A262-L282 HydrophobicContact CB-CD2 3.6Å; A262-V289 HydrophobicContact CB-CG2 3.35Å |
| 263 | I | 88.2 | Confident | 76.6 | Confident | 0 Ų | 0 | 68.7 Ų | 68.7 | 0% | 0 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 177 | -59.5 | 153.5 | 0 | 0 | 0 | 110.9 | H259 M260 I265 L266 T267 R275 E279 L282 | H259-I263 WeakPolarHBondContact O-CD1 3.24Å; H259-I263 VanDerWaalsContact O-CG1 3.22Å; H259-I263 WeakPolarHBondContact O-CG1 3.42Å; H259-I263 PolarHBondContact O-N 3.29Å; M260-I263 PolarHBondContact O-N 3.36Å; M260-I263 HydrophobicContact SD-CD1 4.1Å; I263-I265 VanDerWaalsContact C-N 3.34Å; I263-L266 PolarHBondContact O-N 2.96Å; I263-T267 VanDerWaalsContact O-CB 3.3Å; I263-T267 WeakPolarHBondContact O-CB 3.43Å; I263-T267 PolarHBondContact O-N 2.87Å; I263-T267 PolarHBondContact O-OG1 2.88Å; I263-R275 HydrophobicContact CG2-CG 3.57Å; I263-E279 HydrophobicContact CD1-CG 3.56Å; I263-E279 HydrophobicContact CG1-CG 3.73Å; I263-E279 HydrophobicContact CG2-CG 3.96Å; I263-L282 HydrophobicContact CG1-CD2 3.68Å |
| 264 | D | 89.2 | Confident | 78.8 | Confident | 66 Ų | 66 | 70.7 Ų | 70.7 | 35% | 0.353 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -72 | -29.1 | -179.2 | -65 | -17.1 | 0 | 0 | 0 | 112 | M260 N261 A262 R268 R275 | M260-D264 WeakPolarHBondContact O-CB 3.38Å; M260-D264 VanDerWaalsContact O-CG 3.22Å; M260-D264 PolarHBondContact O-N 3.07Å; N261-D264 PolarHBondContact O-N 3.42Å; A262-D264 VanDerWaalsContact C-N 3.34Å; A262-D264 PolarHBondContact O-N 2.96Å; D264-R268 WeakPolarHBondContact O-CB 3.5Å; D264-R268 PolarHBondContact O-N 2.88Å; D264-R275 IonicContact OD1-CZ 3.86Å; D264-R275 IonicContact OD1-NH1 3.72Å; D264-R275 PolarHBondContact OD1-NH1 3.05Å; D264-R275 IonicContact OD1-NH2 2.79Å; D264-R275 PolarHBondContact OD1-NH2 3.34Å |
| 265 | I | 90.1 | Very high | 80.7 | Confident | 74 Ų | 74 | 72.9 Ų | 72.9 | 38% | 0.379 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -66.2 | -52.2 | 166.4 | -71.3 | 162.8 | 0 | 0 | 0 | 110.3 | N261 A262 I263 T267 R268 V269 V289 | N261-I265 WeakPolarHBondContact O-CB 3.24Å; N261-I265 WeakPolarHBondContact O-CD1 3.5Å; N261-I265 WeakPolarHBondContact O-CG1 3.49Å; N261-I265 PolarHBondContact O-N 3.04Å; A262-I265 PolarHBondContact O-N 3.01Å; I263-I265 VanDerWaalsContact C-N 3.34Å; I265-T267 VanDerWaalsContact C-N 3.31Å; I265-T267 PolarHBondContact O-N 3.15Å; I265-R268 WeakPolarHBondContact O-CB 3.25Å; I265-R268 PolarHBondContact O-N 3.02Å; I265-R268 VanDerWaalsContact O-N 3.08Å; I265-V269 HydrophobicContact CG2-CG2 4.44Å; I265-V269 WeakPolarHBondContact O-CG2 3.45Å; I265-V269 PolarHBondContact O-N 3.21Å; I265-V289 HydrophobicContact CG2-CG1 4.11Å |
| 266 | L | 87.4 | Confident | 82.4 | Confident | 0 Ų | 0 | 74.5 Ų | 74.5 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -59.1 | -41.3 | 179.6 | -72.4 | 171.3 | 0 | 0 | 0 | 112 | A262 I263 R268 V269 F270 L278 L282 A292 I293 I296 | A262-L266 WeakPolarHBondContact O-CG 3.26Å; A262-L266 PolarHBondContact O-N 3.19Å; I263-L266 PolarHBondContact O-N 2.96Å; L266-R268 VanDerWaalsContact C-N 3.28Å; L266-R268 PolarHBondContact O-N 2.91Å; L266-V269 PolarHBondContact O-N 2.8Å; L266-F270 HydrophobicContact CD2-CD2 4.41Å; L266-F270 HydrophobicContact CD2-CE2 4.32Å; L266-F270 PolarHBondContact O-N 2.78Å; L266-L278 HydrophobicContact CB-CB 4.3Å; L266-L278 HydrophobicContact CB-CD1 4.12Å; L266-L278 HydrophobicContact CB-CD2 4.39Å; L266-L278 HydrophobicContact CD1-CB 4.46Å; L266-L282 HydrophobicContact CD1-CB 4.13Å; L266-L282 HydrophobicContact CD1-CD1 4.25Å; L266-L282 HydrophobicContact CD1-CD2 4.37Å; L266-L282 HydrophobicContact CD1-CG 4.49Å; L266-A292 HydrophobicContact CD1-CB 4.04Å; L266-A292 HydrophobicContact CD2-CB 4.29Å; L266-I293 HydrophobicContact CD2-CD1 4.49Å; L266-I293 HydrophobicContact CD2-CG1 3.63Å; L266-I296 HydrophobicContact CD2-CD1 4.05Å |
| 267 | T | 90.4 | Very high | 84 | Confident | 48 Ų | 48 | 74.1 Ų | 74.1 | 29% | 0.294 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -65.1 | -32.1 | 177.4 | -55.4 | 0 | 0 | 0 | 0 | 111.7 | I263 I265 P271 | I263-T267 VanDerWaalsContact O-CB 3.3Å; I263-T267 WeakPolarHBondContact O-CB 3.43Å; I263-T267 PolarHBondContact O-N 2.87Å; I263-T267 PolarHBondContact O-OG1 2.88Å; I265-T267 VanDerWaalsContact C-N 3.31Å; I265-T267 PolarHBondContact O-N 3.15Å; T267-P271 WeakPolarHBondContact O-CA 3.49Å |
| 268 | R | 88.7 | Confident | 85.2 | Confident | 195 Ų | 195 | 71.3 Ų | 71.3 | 74% | 0.736 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -77.7 | -31.1 | 175.6 | -170 | 178.8 | -61.4 | 133.8 | 7.4 | 113 | D264 I265 L266 | D264-R268 WeakPolarHBondContact O-CB 3.5Å; D264-R268 PolarHBondContact O-N 2.88Å; I265-R268 WeakPolarHBondContact O-CB 3.25Å; I265-R268 PolarHBondContact O-N 3.02Å; I265-R268 VanDerWaalsContact O-N 3.08Å; L266-R268 VanDerWaalsContact C-N 3.28Å; L266-R268 PolarHBondContact O-N 2.91Å |
| 269 | V | 88.9 | Confident | 86.4 | Confident | 77 Ų | 77 | 66.1 Ų | 66.1 | 47% | 0.467 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -79.9 | -38 | 177 | 175.2 | 0 | 0 | 0 | 0 | 111.5 | I265 L266 P271 | I265-V269 HydrophobicContact CG2-CG2 4.44Å; I265-V269 WeakPolarHBondContact O-CG2 3.45Å; I265-V269 PolarHBondContact O-N 3.21Å; L266-V269 PolarHBondContact O-N 2.8Å; V269-P271 VanDerWaalsContact O-CD 3.3Å; V269-P271 WeakPolarHBondContact O-CD 3.32Å |
| 270 | F | 88.1 | Confident | 87.4 | Confident | 22 Ų | 22 | 69.5 Ų | 69.5 | 10% | 0.096 | 36% | 0.362 | C | S | . | . | trans | -121.1 | 64.4 | -177.6 | -57.8 | -69.5 | 0 | 0 | 0 | 112.2 | L266 S272 H273 L278 I293 I296 L297 | L266-F270 HydrophobicContact CD2-CD2 4.41Å; L266-F270 HydrophobicContact CD2-CE2 4.32Å; L266-F270 PolarHBondContact O-N 2.78Å; F270-S272 PolarHBondContact O-N 3.48Å; F270-H273 HydrophobicContact CB-CB 4.18Å; F270-H273 PolarHBondContact O-N 3.02Å; F270-L278 HydrophobicContact CB-CD2 4.41Å; F270-L278 HydrophobicContact CD2-CD2 4.45Å; F270-I293 HydrophobicContact CE2-CG1 4.13Å; F270-I293 HydrophobicContact CE2-CG2 4.47Å; F270-I293 HydrophobicContact CZ-CG2 4.27Å; F270-I296 HydrophobicContact CD1-CG2 3.93Å; F270-I296 HydrophobicContact CD2-CD1 3.86Å; F270-I296 HydrophobicContact CD2-CG2 3.97Å; F270-I296 HydrophobicContact CE1-CG2 3.72Å; F270-I296 HydrophobicContact CE2-CB 4.03Å; F270-I296 HydrophobicContact CE2-CD1 3.8Å; F270-I296 HydrophobicContact CE2-CG2 3.75Å; F270-I296 HydrophobicContact CG-CG2 4.05Å; F270-I296 HydrophobicContact CZ-CB 4.08Å; F270-I296 HydrophobicContact CZ-CG2 3.63Å; F270-L297 HydrophobicContact CE1-CD2 3.92Å; F270-L297 HydrophobicContact CE1-CG 4.47Å; F270-L297 HydrophobicContact CZ-CD2 4.03Å; F270-L297 HydrophobicContact CZ-CG 4.1Å | ||
| 271 | P | 86.2 | Confident | 88.5 | Confident | 111 Ų | 111 | 65.9 Ų | 65.9 | 72% | 0.721 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -7.9 | -176.4 | 28.4 | -37 | 0 | 0 | 0 | 114.6 | T267 V269 | T267-P271 WeakPolarHBondContact O-CA 3.49Å; V269-P271 VanDerWaalsContact O-CD 3.3Å; V269-P271 WeakPolarHBondContact O-CD 3.32Å |
| 272 | S | 82 | Confident | 88.7 | Confident | 103 Ų | 103 | 61.2 Ų | 61.2 | 72% | 0.72 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.7 | -13.5 | 172.1 | 54.9 | 0 | 0 | 0 | 0 | 114.2 | F270 | F270-S272 PolarHBondContact O-N 3.48Š|
| 273 | H | 87.3 | Confident | 88.8 | Confident | 65 Ų | 65 | 67.8 Ų | 67.8 | 30% | 0.301 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -99.6 | 137.6 | -174.4 | -71.9 | 57.2 | 0 | 0 | 0 | 111.3 | F270 L278 | F270-H273 HydrophobicContact CB-CB 4.18Å; F270-H273 PolarHBondContact O-N 3.02Å; H273-L278 HydrophobicContact CB-CD1 4.36Å; H273-L278 HydrophobicContact CB-CD2 3.87Å; H273-L278 HydrophobicContact CB-CG 4.15Å |
| 274 | K | 89.7 | Confident | 88.7 | Confident | 122 Ų | 122 | 70.8 Ų | 70.8 | 53% | 0.53 | 38% | 0.381 | S | S | . | . | trans | -66.1 | 135.6 | 177.4 | -64.1 | -172.2 | -179.3 | -171.8 | 0 | 110.4 | S276 V277 L278 E312 | K274-S276 PolarHBondContact O-N 2.81Å; K274-S276 VanDerWaalsContact O-N 3.14Å; K274-V277 HydrophobicContact CB-CG2 4.29Å; K274-V277 WeakPolarHBondContact O-CB 3.34Å; K274-V277 PolarHBondContact O-N 2.88Å; K274-L278 PolarHBondContact O-N 3.44Å; K274-E312 IonicContact NZ-OE1 2.6Å; K274-E312 PolarHBondContact NZ-OE1 3.11Å | ||
| 275 | R | 90.7 | Very high | 88.6 | Confident | 93 Ų | 93 | 68 Ų | 68 | 35% | 0.351 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -50.3 | -41.2 | -178.5 | -169.1 | -173.7 | 174.1 | 101.5 | 1.1 | 113 | I263 D264 V277 L278 E279 | I263-R275 HydrophobicContact CG2-CG 3.57Å; D264-R275 IonicContact OD1-CZ 3.86Å; D264-R275 IonicContact OD1-NH1 3.72Å; D264-R275 PolarHBondContact OD1-NH1 3.05Å; D264-R275 IonicContact OD1-NH2 2.79Å; D264-R275 PolarHBondContact OD1-NH2 3.34Å; R275-V277 VanDerWaalsContact C-N 3.3Å; R275-V277 PolarHBondContact O-N 3.35Å; R275-L278 WeakPolarHBondContact O-CB 3.21Å; R275-L278 PolarHBondContact O-N 3.5Å; R275-L278 VanDerWaalsContact O-N 3.14Å; R275-E279 WeakPolarHBondContact CD-OE1 3.46Å; R275-E279 HydrophobicContact CG-CG 4.4Å; R275-E279 WeakPolarHBondContact CG-OE1 3.39Å; R275-E279 IonicContact CZ-OE1 3.48Å; R275-E279 IonicContact NE-OE1 3.75Å; R275-E279 PolarHBondContact NE-OE1 3.05Å; R275-E279 IonicContact NH2-OE1 3.34Å; R275-E279 WeakPolarHBondContact O-CB 3.39Å; R275-E279 WeakPolarHBondContact O-CG 3.31Å; R275-E279 PolarHBondContact O-N 3.05Å |
| 276 | S | 88 | Confident | 88.3 | Confident | 74 Ų | 74 | 67.6 Ų | 67.6 | 52% | 0.517 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.1 | -31.7 | 177.6 | 49.9 | 0 | 0 | 0 | 0 | 114.4 | K274 L280 | K274-S276 PolarHBondContact O-N 2.81Å; K274-S276 VanDerWaalsContact O-N 3.14Å; S276-L280 WeakPolarHBondContact O-CB 3.47Å; S276-L280 PolarHBondContact O-N 3.48Å |
| 277 | V | 89.5 | Confident | 88 | Confident | 42 Ų | 42 | 73.2 Ų | 73.2 | 26% | 0.255 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -74.6 | -39.5 | 175.3 | -177.8 | 0 | 0 | 0 | 0 | 110.2 | K274 R275 L280 V281 | K274-V277 HydrophobicContact CB-CG2 4.29Å; K274-V277 WeakPolarHBondContact O-CB 3.34Å; K274-V277 PolarHBondContact O-N 2.88Å; R275-V277 VanDerWaalsContact C-N 3.3Å; R275-V277 PolarHBondContact O-N 3.35Å; V277-L280 PolarHBondContact O-N 3.41Å; V277-V281 WeakPolarHBondContact O-CG2 3.27Å; V277-V281 PolarHBondContact O-N 2.9Å |
| 278 | L | 89.2 | Confident | 88 | Confident | 0 Ų | 0 | 73.8 Ų | 73.8 | 0% | 0 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -65.1 | -40.2 | 175.4 | -57.4 | 175.6 | 0 | 0 | 0 | 111.3 | L266 F270 H273 K274 R275 L282 I296 | L266-L278 HydrophobicContact CB-CB 4.3Å; L266-L278 HydrophobicContact CB-CD1 4.12Å; L266-L278 HydrophobicContact CB-CD2 4.39Å; L266-L278 HydrophobicContact CD1-CB 4.46Å; F270-L278 HydrophobicContact CB-CD2 4.41Å; F270-L278 HydrophobicContact CD2-CD2 4.45Å; H273-L278 HydrophobicContact CB-CD1 4.36Å; H273-L278 HydrophobicContact CB-CD2 3.87Å; H273-L278 HydrophobicContact CB-CG 4.15Å; K274-L278 PolarHBondContact O-N 3.44Å; R275-L278 WeakPolarHBondContact O-CB 3.21Å; R275-L278 PolarHBondContact O-N 3.5Å; R275-L278 VanDerWaalsContact O-N 3.14Å; L278-L282 WeakPolarHBondContact O-CB 3.4Å; L278-L282 PolarHBondContact O-N 2.81Å; L278-I296 HydrophobicContact CD2-CD1 3.49Å; L278-I296 VanDerWaalsContact CD2-CD1 3.49Å; L278-I296 HydrophobicContact CD2-CG1 4.44Å |
| 279 | E | 89.8 | Confident | 88 | Confident | 60 Ų | 60 | 66.1 Ų | 66.1 | 28% | 0.28 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 173 | -76.5 | 167.3 | 174.6 | 0 | 0 | 111.8 | I263 R275 L282 Q283 | I263-E279 HydrophobicContact CD1-CG 3.56Å; I263-E279 HydrophobicContact CG1-CG 3.73Å; I263-E279 HydrophobicContact CG2-CG 3.96Å; R275-E279 WeakPolarHBondContact CD-OE1 3.46Å; R275-E279 HydrophobicContact CG-CG 4.4Å; R275-E279 WeakPolarHBondContact CG-OE1 3.39Å; R275-E279 IonicContact CZ-OE1 3.48Å; R275-E279 IonicContact NE-OE1 3.75Å; R275-E279 PolarHBondContact NE-OE1 3.05Å; R275-E279 IonicContact NH2-OE1 3.34Å; R275-E279 WeakPolarHBondContact O-CB 3.39Å; R275-E279 WeakPolarHBondContact O-CG 3.31Å; R275-E279 PolarHBondContact O-N 3.05Å; E279-L282 PolarHBondContact O-N 3.29Å; E279-Q283 VanDerWaalsContact O-CB 3.31Å; E279-Q283 WeakPolarHBondContact O-CB 3.46Å; E279-Q283 PolarHBondContact O-N 2.93Å |
| 280 | L | 89.8 | Confident | 88.2 | Confident | 109 Ų | 109 | 66.6 Ų | 66.6 | 57% | 0.571 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -63.1 | -45.3 | 176.9 | -178 | 63.4 | 0 | 0 | 0 | 112.6 | S276 V277 Q283 G284 | S276-L280 WeakPolarHBondContact O-CB 3.47Å; S276-L280 PolarHBondContact O-N 3.48Å; V277-L280 PolarHBondContact O-N 3.41Å; L280-Q283 PolarHBondContact O-N 2.97Å; L280-G284 PolarHBondContact O-N 3.18Å |
| 281 | V | 90.5 | Very high | 88.1 | Confident | 21 Ų | 21 | 70.2 Ų | 70.2 | 13% | 0.127 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -65.4 | -43.8 | 177 | 175 | 0 | 0 | 0 | 0 | 110.8 | V277 Q283 G284 C285 A292 Q295 I296 | V277-V281 WeakPolarHBondContact O-CG2 3.27Å; V277-V281 PolarHBondContact O-N 2.9Å; V281-Q283 VanDerWaalsContact C-N 3.33Å; V281-Q283 PolarHBondContact O-N 3.15Å; V281-G284 PolarHBondContact O-N 3.43Å; V281-C285 WeakPolarHBondContact O-CB 3.44Å; V281-C285 PolarHBondContact O-N 3.18Å; V281-C285 PolarHBondContact O-SG 3.32Å; V281-A292 HydrophobicContact CG1-CB 4.08Å; V281-Q295 HydrophobicContact CG1-CB 3.96Å; V281-I296 HydrophobicContact CG1-CG1 4.21Å |
| 282 | L | 91.3 | Very high | 88.3 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -63 | -38.5 | 177.7 | -177.1 | 66.5 | 0 | 0 | 0 | 112 | A262 I263 L266 L278 E279 C285 K287 A292 | A262-L282 HydrophobicContact CB-CD1 4.1Å; A262-L282 HydrophobicContact CB-CD2 3.6Å; I263-L282 HydrophobicContact CG1-CD2 3.68Å; L266-L282 HydrophobicContact CD1-CB 4.13Å; L266-L282 HydrophobicContact CD1-CD1 4.25Å; L266-L282 HydrophobicContact CD1-CD2 4.37Å; L266-L282 HydrophobicContact CD1-CG 4.49Å; L278-L282 WeakPolarHBondContact O-CB 3.4Å; L278-L282 PolarHBondContact O-N 2.81Å; E279-L282 PolarHBondContact O-N 3.29Å; L282-C285 PolarHBondContact O-N 3.27Å; L282-K287 WeakPolarHBondContact O-CA 3.37Å; L282-K287 PolarHBondContact O-N 3.5Å; L282-A292 HydrophobicContact CD1-CB 4.15Å |
| 283 | Q | 89.4 | Confident | 88.6 | Confident | 141 Ų | 141 | 62.1 Ų | 62.1 | 66% | 0.659 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -64.7 | -41.2 | 173.3 | -178.6 | 171.6 | -16.2 | 0 | 0 | 111.8 | E279 L280 V281 G286 | E279-Q283 VanDerWaalsContact O-CB 3.31Å; E279-Q283 WeakPolarHBondContact O-CB 3.46Å; E279-Q283 PolarHBondContact O-N 2.93Å; L280-Q283 PolarHBondContact O-N 2.97Å; V281-Q283 VanDerWaalsContact C-N 3.33Å; V281-Q283 PolarHBondContact O-N 3.15Å; Q283-G286 PolarHBondContact O-N 3.23Å |
| 284 | G | 86.3 | Confident | 88.7 | Confident | 63 Ų | 63 | 64.3 Ų | 64.3 | 65% | 0.649 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -65.4 | -34.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | L280 V281 G286 | L280-G284 PolarHBondContact O-N 3.18Å; V281-G284 PolarHBondContact O-N 3.43Å; G284-G286 PolarHBondContact O-N 3.16Å |
| 285 | C | 86.7 | Confident | 88.5 | Confident | 8 Ų | 8 | 63.5 Ų | 63.5 | 5% | 0.054 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | 21.6 | 178.4 | -60.9 | 0 | 0 | 0 | 0 | 113.7 | V281 L282 K287 D288 Q291 A292 Q295 | V281-C285 WeakPolarHBondContact O-CB 3.44Å; V281-C285 PolarHBondContact O-N 3.18Å; V281-C285 PolarHBondContact O-SG 3.32Å; L282-C285 PolarHBondContact O-N 3.27Å; C285-K287 PolarHBondContact O-N 3.24Å; C285-D288 WeakPolarHBondContact O-CB 3.43Å; C285-D288 PolarHBondContact O-N 3.37Å; C285-Q291 HydrophobicContact CB-CB 3.94Å; C285-A292 HydrophobicContact CB-CB 4.26Å; C285-Q295 VanDerWaalsContact SG-CD 3.56Å; C285-Q295 PolarHBondContact SG-NE2 2.8Å |
| 286 | G | 83.7 | Confident | 88.3 | Confident | 66 Ų | 66 | 59.6 Ų | 59.6 | 68% | 0.68 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.8 | 18.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q283 G284 | Q283-G286 PolarHBondContact O-N 3.23Å; G284-G286 PolarHBondContact O-N 3.16Å |
| 287 | K | 82.1 | Confident | 88.2 | Confident | 118 Ų | 118 | 60.3 Ų | 60.3 | 51% | 0.513 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.7 | 18.1 | -173.2 | -49 | 166.8 | -174.4 | 167.7 | 0 | 115 | L282 C285 | L282-K287 WeakPolarHBondContact O-CA 3.37Å; L282-K287 PolarHBondContact O-N 3.5Å; C285-K287 PolarHBondContact O-N 3.24Å |
| 288 | D | 90.3 | Very high | 87.9 | Confident | 60 Ų | 60 | 64.8 Ų | 64.8 | 32% | 0.321 | 36% | 0.358 | S | S | . | . | trans | -81.4 | 123.7 | 167.3 | -174.8 | -4.4 | 0 | 0 | 0 | 111.1 | C285 V290 Q291 A292 | C285-D288 WeakPolarHBondContact O-CB 3.43Å; C285-D288 PolarHBondContact O-N 3.37Å; D288-V290 PolarHBondContact OD1-N 3.17Å; D288-Q291 HydrophobicContact CB-CB 4.24Å; D288-Q291 HydrophobicContact CB-CG 4.41Å; D288-Q291 WeakPolarHBondContact OD2-CG 3.25Å; D288-Q291 PolarHBondContact OD2-NE2 2.93Å; D288-A292 WeakPolarHBondContact O-CB 3.49Å; D288-A292 PolarHBondContact O-N 2.89Å | ||
| 289 | V | 89.3 | Confident | 86.9 | Confident | 34 Ų | 34 | 69.2 Ų | 69.2 | 21% | 0.206 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -66.8 | -36.6 | 177.3 | 177.6 | 0 | 0 | 0 | 0 | 111.8 | A262 I265 A292 I293 | A262-V289 HydrophobicContact CB-CG2 3.35Å; I265-V289 HydrophobicContact CG2-CG1 4.11Å; V289-A292 PolarHBondContact O-N 3.45Å; V289-I293 HydrophobicContact CG1-CD1 3.81Å; V289-I293 HydrophobicContact CG1-CG1 4.4Å; V289-I293 VanDerWaalsContact O-CG1 3.26Å; V289-I293 WeakPolarHBondContact O-CG1 3.39Å; V289-I293 PolarHBondContact O-N 3.15Å |
| 290 | V | 91.6 | Very high | 85.6 | Confident | 86 Ų | 86 | 68.3 Ų | 68.3 | 52% | 0.521 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -70.5 | -50.2 | -174.5 | -175.7 | 0 | 0 | 0 | 0 | 109.8 | D288 A292 I293 E294 | D288-V290 PolarHBondContact OD1-N 3.17Å; V290-A292 VanDerWaalsContact C-N 3.28Å; V290-A292 PolarHBondContact O-N 3.29Å; V290-I293 WeakPolarHBondContact O-CB 3.38Å; V290-I293 PolarHBondContact O-N 3.27Å; V290-I293 VanDerWaalsContact O-N 3.17Å; V290-E294 WeakPolarHBondContact O-CG 3.25Å; V290-E294 PolarHBondContact O-N 3.22Å |
| 291 | Q | 86.1 | Confident | 83.9 | Confident | 99 Ų | 99 | 66.3 Ų | 66.3 | 46% | 0.463 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61 | -36.2 | 174.6 | -70.2 | 176.1 | 69.4 | 0 | 0 | 112.2 | C285 D288 E294 Q295 | C285-Q291 HydrophobicContact CB-CB 3.94Å; D288-Q291 HydrophobicContact CB-CB 4.24Å; D288-Q291 HydrophobicContact CB-CG 4.41Å; D288-Q291 WeakPolarHBondContact OD2-CG 3.25Å; D288-Q291 PolarHBondContact OD2-NE2 2.93Å; Q291-E294 PolarHBondContact O-N 3.15Å; Q291-Q295 PolarHBondContact O-N 3.48Å |
| 292 | A | 91.5 | Very high | 82 | Confident | 0 Ų | 0 | 69.7 Ų | 69.7 | 0% | 0 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -64.8 | -43.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L266 V281 L282 C285 D288 V289 V290 Q295 I296 | L266-A292 HydrophobicContact CD1-CB 4.04Å; L266-A292 HydrophobicContact CD2-CB 4.29Å; V281-A292 HydrophobicContact CG1-CB 4.08Å; L282-A292 HydrophobicContact CD1-CB 4.15Å; C285-A292 HydrophobicContact CB-CB 4.26Å; D288-A292 WeakPolarHBondContact O-CB 3.49Å; D288-A292 PolarHBondContact O-N 2.89Å; V289-A292 PolarHBondContact O-N 3.45Å; V290-A292 VanDerWaalsContact C-N 3.28Å; V290-A292 PolarHBondContact O-N 3.29Å; A292-Q295 PolarHBondContact O-N 3.04Å; A292-I296 WeakPolarHBondContact O-CD1 3.1Å; A292-I296 VanDerWaalsContact O-CG1 3.23Å; A292-I296 WeakPolarHBondContact O-CG1 3.47Å; A292-I296 PolarHBondContact O-N 2.82Å |
| 293 | I | 88.9 | Confident | 80 | Confident | 44 Ų | 44 | 77.8 Ų | 77.8 | 23% | 0.226 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -59.9 | -46.2 | 173 | -70.6 | 166 | 0 | 0 | 0 | 110.5 | L266 F270 V289 V290 Q295 I296 L297 | L266-I293 HydrophobicContact CD2-CD1 4.49Å; L266-I293 HydrophobicContact CD2-CG1 3.63Å; F270-I293 HydrophobicContact CE2-CG1 4.13Å; F270-I293 HydrophobicContact CE2-CG2 4.47Å; F270-I293 HydrophobicContact CZ-CG2 4.27Å; V289-I293 HydrophobicContact CG1-CD1 3.81Å; V289-I293 HydrophobicContact CG1-CG1 4.4Å; V289-I293 VanDerWaalsContact O-CG1 3.26Å; V289-I293 WeakPolarHBondContact O-CG1 3.39Å; V289-I293 PolarHBondContact O-N 3.15Å; V290-I293 WeakPolarHBondContact O-CB 3.38Å; V290-I293 PolarHBondContact O-N 3.27Å; V290-I293 VanDerWaalsContact O-N 3.17Å; I293-Q295 PolarHBondContact O-N 3.49Å; I293-I296 PolarHBondContact O-N 3.4Å; I293-L297 HydrophobicContact CG2-CD1 3.7Å; I293-L297 HydrophobicContact CG2-CG 4.26Å; I293-L297 WeakPolarHBondContact O-CB 3.48Å; I293-L297 VanDerWaalsContact O-CG 3.3Å; I293-L297 WeakPolarHBondContact O-CG 3.06Å; I293-L297 PolarHBondContact O-N 3.15Å |
| 294 | E | 88.3 | Confident | 77.6 | Confident | 111 Ų | 111 | 75.2 Ų | 75.2 | 52% | 0.519 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 179.7 | -71.9 | -179.2 | 174.2 | 0 | 0 | 112.7 | V290 Q291 L297 N298 | V290-E294 WeakPolarHBondContact O-CG 3.25Å; V290-E294 PolarHBondContact O-N 3.22Å; Q291-E294 PolarHBondContact O-N 3.15Å; E294-L297 PolarHBondContact O-N 3.44Å; E294-N298 VanDerWaalsContact O-CB 3.31Å; E294-N298 WeakPolarHBondContact O-CB 3.46Å; E294-N298 VanDerWaalsContact O-CG 3.26Å; E294-N298 PolarHBondContact O-N 3.14Å; E294-N298 PolarHBondContact O-ND2 3.12Å |
| 295 | Q | 84.8 | Confident | 75.8 | Confident | 105 Ų | 105 | 78 Ų | 78 | 49% | 0.491 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.4 | -41.3 | 174 | -73.3 | -158.6 | 27.9 | 0 | 0 | 112.6 | V281 C285 Q291 A292 I293 N299 | V281-Q295 HydrophobicContact CG1-CB 3.96Å; C285-Q295 VanDerWaalsContact SG-CD 3.56Å; C285-Q295 PolarHBondContact SG-NE2 2.8Å; Q291-Q295 PolarHBondContact O-N 3.48Å; A292-Q295 PolarHBondContact O-N 3.04Å; I293-Q295 PolarHBondContact O-N 3.49Å; Q295-N299 WeakPolarHBondContact O-CB 3.37Å; Q295-N299 PolarHBondContact O-N 3.23Å |
| 296 | I | 87.2 | Confident | 73.7 | Confident | 10 Ų | 10 | 85.1 Ų | 85.1 | 5% | 0.051 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 176.1 | -67.1 | 159.8 | 0 | 0 | 0 | 110.3 | L266 F270 L278 V281 A292 I293 N299 S300 | L266-I296 HydrophobicContact CD2-CD1 4.05Å; F270-I296 HydrophobicContact CD1-CG2 3.93Å; F270-I296 HydrophobicContact CD2-CD1 3.86Å; F270-I296 HydrophobicContact CD2-CG2 3.97Å; F270-I296 HydrophobicContact CE1-CG2 3.72Å; F270-I296 HydrophobicContact CE2-CB 4.03Å; F270-I296 HydrophobicContact CE2-CD1 3.8Å; F270-I296 HydrophobicContact CE2-CG2 3.75Å; F270-I296 HydrophobicContact CG-CG2 4.05Å; F270-I296 HydrophobicContact CZ-CB 4.08Å; F270-I296 HydrophobicContact CZ-CG2 3.63Å; L278-I296 HydrophobicContact CD2-CD1 3.49Å; L278-I296 VanDerWaalsContact CD2-CD1 3.49Å; L278-I296 HydrophobicContact CD2-CG1 4.44Å; V281-I296 HydrophobicContact CG1-CG1 4.21Å; A292-I296 WeakPolarHBondContact O-CD1 3.1Å; A292-I296 VanDerWaalsContact O-CG1 3.23Å; A292-I296 WeakPolarHBondContact O-CG1 3.47Å; A292-I296 PolarHBondContact O-N 2.82Å; I293-I296 PolarHBondContact O-N 3.4Å; I296-N299 PolarHBondContact O-N 2.91Å; I296-S300 VanDerWaalsContact O-CB 3.31Å; I296-S300 WeakPolarHBondContact O-CB 3.44Å; I296-S300 PolarHBondContact O-N 3.36Å; I296-S300 PolarHBondContact O-OG 3.21Å |
| 297 | L | 85.6 | Confident | 71.5 | Confident | 90 Ų | 90 | 91.8 Ų | 91.8 | 47% | 0.471 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.6 | -42.3 | 179.6 | -70.3 | 174.9 | 0 | 0 | 0 | 112.7 | F270 I293 E294 N299 G301 | F270-L297 HydrophobicContact CE1-CD2 3.92Å; F270-L297 HydrophobicContact CE1-CG 4.47Å; F270-L297 HydrophobicContact CZ-CD2 4.03Å; F270-L297 HydrophobicContact CZ-CG 4.1Å; I293-L297 HydrophobicContact CG2-CD1 3.7Å; I293-L297 HydrophobicContact CG2-CG 4.26Å; I293-L297 WeakPolarHBondContact O-CB 3.48Å; I293-L297 VanDerWaalsContact O-CG 3.3Å; I293-L297 WeakPolarHBondContact O-CG 3.06Å; I293-L297 PolarHBondContact O-N 3.15Å; E294-L297 PolarHBondContact O-N 3.44Å; L297-N299 PolarHBondContact O-N 3.34Å; L297-G301 PolarHBondContact O-N 2.89Å |
| 298 | N | 83.3 | Confident | 69.5 | Low | 135 Ų | 135 | 91.4 Ų | 91.4 | 72% | 0.722 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.7 | -27.2 | 178 | -76.6 | -28 | 0 | 0 | 0 | 113 | E294 | E294-N298 VanDerWaalsContact O-CB 3.31Å; E294-N298 WeakPolarHBondContact O-CB 3.46Å; E294-N298 VanDerWaalsContact O-CG 3.26Å; E294-N298 PolarHBondContact O-N 3.14Å; E294-N298 PolarHBondContact O-ND2 3.12Å |
| 299 | N | 67.9 | Low | 66.6 | Low | 94 Ų | 94 | 91.9 Ų | 91.9 | 50% | 0.503 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -88.9 | -44.7 | 176.8 | -156.5 | 5.9 | 0 | 0 | 0 | 112 | Q295 I296 L297 G301 A302 W314 | Q295-N299 WeakPolarHBondContact O-CB 3.37Å; Q295-N299 PolarHBondContact O-N 3.23Å; I296-N299 PolarHBondContact O-N 2.91Å; L297-N299 PolarHBondContact O-N 3.34Å; N299-G301 VanDerWaalsContact C-N 3.26Å; N299-G301 PolarHBondContact O-N 2.71Å; N299-A302 WeakPolarHBondContact O-CB 3.42Å; N299-A302 PolarHBondContact O-N 2.9Å; N299-W314 WeakPolarHBondContact ND2-CH2 3.33Å |
| 300 | S | 64.1 | Low | 64.6 | Low | 40 Ų | 40 | 96.3 Ų | 96.3 | 28% | 0.28 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -70.1 | -19.2 | 177.3 | 58.4 | 0 | 0 | 0 | 0 | 113.8 | I296 A302 Q303 | I296-S300 VanDerWaalsContact O-CB 3.31Å; I296-S300 WeakPolarHBondContact O-CB 3.44Å; I296-S300 PolarHBondContact O-N 3.36Å; I296-S300 PolarHBondContact O-OG 3.21Å; S300-A302 PolarHBondContact O-N 2.94Å; S300-A302 VanDerWaalsContact O-N 3.15Å; S300-Q303 PolarHBondContact O-N 3.08Å |
| 301 | G | 52.6 | Low | 61.8 | Low | 67 Ų | 67 | 101.1 Ų | 101.1 | 69% | 0.691 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.4 | -18.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | L297 N299 Q303 | L297-G301 PolarHBondContact O-N 2.89Å; N299-G301 VanDerWaalsContact C-N 3.26Å; N299-G301 PolarHBondContact O-N 2.71Å; G301-Q303 VanDerWaalsContact C-N 3.34Å |
| 302 | A | 51 | Low | 59.6 | Low | 92 Ų | 92 | 102.8 Ų | 102.8 | 76% | 0.76 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.4 | -11.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | N299 S300 | N299-A302 WeakPolarHBondContact O-CB 3.42Å; N299-A302 PolarHBondContact O-N 2.9Å; S300-A302 PolarHBondContact O-N 2.94Å; S300-A302 VanDerWaalsContact O-N 3.15Å |
| 303 | Q | 50.2 | Low | 56.9 | Low | 171 Ų | 171 | 108 Ų | 108 | 80% | 0.799 | 64% | 0.638 | S | S | * | * | trans | -119.3 | 67.1 | -172.4 | -162.1 | 167.3 | 60.1 | 0 | 0 | 112.1 | S300 G301 | S300-Q303 PolarHBondContact O-N 3.08Å; G301-Q303 VanDerWaalsContact C-N 3.34Å | ||
| 304 | A | 39 | Very low | 54.3 | Low | 87 Ų | 87 | 115 Ų | 115 | 72% | 0.719 | 66% | 0.661 | S | S | * | * | trans | -59.5 | 144.8 | 167 | 0 | 0 | 0 | 0 | 0 | 111 | N306 | A304-N306 PolarHBondContact O-N 3.26Š| ||
| 305 | P | 46.8 | Very low | 51.9 | Low | 120 Ų | 120 | 115.3 Ų | 115.3 | 78% | 0.779 | 67% | 0.671 | S | S | * | * | trans | -79.1 | 118.8 | -159.1 | 29.2 | -35.6 | 0 | 0 | 0 | 113.3 | ||||
| 306 | N | 43 | Very low | 49.9 | Very low | 158 Ų | 158 | 115.4 Ų | 115.4 | 85% | 0.845 | 69% | 0.689 | S | S | * | * | trans | -159.7 | 144.3 | 157.4 | -114 | -59.4 | 0 | 0 | 0 | 113.9 | A304 | A304-N306 PolarHBondContact O-N 3.26Š| ||
| 307 | K | 38 | Very low | 47.5 | Very low | 207 Ų | 207 | 123.9 Ų | 123.9 | 90% | 0.9 | 73% | 0.729 | S | S | * | * | trans | 66.2 | 145.9 | -179 | -63.8 | -170.7 | 174.6 | -176 | 0 | 117.2 | ||||
| 308 | A | 39.4 | Very low | 45.6 | Very low | 109 Ų | 109 | 131.1 Ų | 131.1 | 90% | 0.901 | 75% | 0.75 | S | S | * | * | trans | -100.6 | 148.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 309 | G | 31 | Very low | 43.7 | Very low | 71 Ų | 71 | 133.9 Ų | 133.9 | 73% | 0.732 | 76% | 0.761 | S | S | * | * | trans | 164.8 | 129 | 176.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 310 | P | 47.3 | Very low | 42.3 | Very low | 127 Ų | 127 | 136.4 Ų | 136.4 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | trans | -97.6 | 129.4 | 179 | 34.7 | -29.4 | 0 | 0 | 0 | 111.9 | ||||
| 311 | E | 31.3 | Very low | 41.1 | Very low | 187 Ų | 187 | 143.6 Ų | 143.6 | 87% | 0.874 | 80% | 0.803 | S | S | * | * | trans | -169.4 | 168.7 | 150.9 | -103 | -112 | 80.3 | 0 | 0 | 110.7 | ||||
| 312 | E | 40.9 | Very low | 40.1 | Very low | 133 Ų | 133 | 147.9 Ų | 147.9 | 62% | 0.621 | 81% | 0.81 | S | S | * | * | trans | -107.6 | 130.7 | -172.2 | -52.9 | -169.4 | 107.7 | 0 | 0 | 111.9 | K274 | K274-E312 IonicContact NZ-OE1 2.6Å; K274-E312 PolarHBondContact NZ-OE1 3.11Å | ||
| 313 | T | 34.7 | Very low | 39.5 | Very low | 111 Ų | 111 | 147.2 Ų | 147.2 | 68% | 0.681 | 80% | 0.804 | S | S | * | * | trans | -151.1 | 97.4 | 162.7 | -41.9 | 0 | 0 | 0 | 0 | 111.7 | T315 | T313-T315 HydrophobicContact CG2-CG2 4.05Š| ||
| 314 | W | 34.5 | Very low | 38.7 | Very low | 190 Ų | 190 | 147.8 Ų | 147.8 | 72% | 0.72 | 81% | 0.807 | S | S | * | * | trans | -124.6 | 73.5 | 160.9 | -88.8 | 66.2 | 0 | 0 | 0 | 108 | N299 | N299-W314 WeakPolarHBondContact ND2-CH2 3.33Š| ||
| 315 | T | 37.5 | Very low | 38.3 | Very low | 117 Ų | 117 | 151.7 Ų | 151.7 | 72% | 0.718 | 81% | 0.81 | S | S | * | * | trans | -81.2 | 143.3 | 177.8 | 42.9 | 0 | 0 | 0 | 0 | 111.5 | T313 E317 | T313-T315 HydrophobicContact CG2-CG2 4.05Å; T315-E317 PolarHBondContact O-N 3.03Å | ||
| 316 | A | 41.8 | Very low | 38.7 | Very low | 107 Ų | 107 | 150.9 Ų | 150.9 | 88% | 0.884 | 81% | 0.805 | S | S | * | * | trans | -84.6 | 91.8 | -166 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 317 | E | 37.7 | Very low | 39.1 | Very low | 188 Ų | 188 | 149.7 Ų | 149.7 | 88% | 0.879 | 81% | 0.806 | S | S | * | * | trans | -132 | 69.7 | 169.6 | -73.2 | -157.3 | 109.9 | 0 | 0 | 113.3 | T315 | T315-E317 PolarHBondContact O-N 3.03Š| ||
| 318 | R | 46 | Very low | 38.7 | Very low | 243 Ų | 243 | 145 Ų | 145 | 92% | 0.917 | 81% | 0.806 | S | S | * | * | trans | -156.2 | 49.1 | 161.1 | -154.2 | 179.2 | -77.9 | -170.7 | -3.4 | 115.1 | ||||
| 319 | M | 42.6 | Very low | 38.2 | Very low | 192 Ų | 192 | 143.2 Ų | 143.2 | 95% | 0.946 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -126.6 | 19.7 | 174.6 | -66 | -163.5 | 76.4 | 0 | 0 | 114.8 | ||
| 320 | L | 39.5 | Very low | 38.2 | Very low | 148 Ų | 148 | 145.8 Ų | 145.8 | 78% | 0.775 | 81% | 0.805 | S | S | * | * | trans | -143.4 | 35.2 | -175 | -123.7 | 150.2 | 0 | 0 | 0 | 116.9 | ||||
| 321 | Q | 38 | Very low | 37.5 | Very low | 191 Ų | 191 | 144.3 Ų | 144.3 | 89% | 0.893 | 80% | 0.803 | S | S | * | * | trans | -143.3 | 78.7 | 155.8 | -102.7 | 93 | 51.2 | 0 | 0 | 106.5 | ||||
| 322 | N | 31.6 | Very low | 37.4 | Very low | 156 Ų | 156 | 142.6 Ų | 142.6 | 83% | 0.834 | 81% | 0.806 | S | S | * | * | 57.4 | 135.6 | 70.9 | -160.7 | 47.2 | 0 | 0 | 0 | 114.5 | |||||
| 323 | A | 38.5 | Very low | 37 | Very low | 78 Ų | 78 | 141.3 Ų | 141.3 | 65% | 0.645 | 82% | 0.818 | S | S | * | * | trans | -77.1 | 150.3 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 324 | Q | 32.7 | Very low | 36.8 | Very low | 184 Ų | 184 | 140.9 Ų | 140.9 | 86% | 0.86 | 83% | 0.826 | S | S | * | * | trans | -160.2 | 152.4 | 133.2 | -166.8 | 54.7 | 8.8 | 0 | 0 | 110.9 | ||||
| 325 | Q | 31.2 | Very low | 36.8 | Very low | 168 Ų | 168 | 138 Ų | 138 | 79% | 0.785 | 83% | 0.829 | S | S | * | * | trans | -116.9 | -178.1 | 176.5 | -132.3 | -164.6 | -3.7 | 0 | 0 | 111.3 | ||||
| 326 | P | 56.4 | Low | 37.2 | Very low | 104 Ų | 104 | 138.5 Ų | 138.5 | 68% | 0.675 | 83% | 0.834 | S | S | * | * | -87.4 | -174 | -127.7 | 43.7 | -35.4 | 0 | 0 | 0 | 114.6 | |||||
| 327 | P | 50.3 | Low | 36.8 | Very low | 132 Ų | 132 | 139.7 Ų | 139.7 | 86% | 0.857 | 83% | 0.831 | S | S | * | * | -142 | -168.8 | 94.4 | 38 | -21.8 | 0 | 0 | 0 | 114.4 | |||||
| 328 | A | 30.1 | Very low | 36.8 | Very low | 109 Ų | 109 | 142.4 Ų | 142.4 | 90% | 0.901 | 83% | 0.833 | S | S | * | * | trans | -117.6 | 164.8 | -168.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 329 | G | 29.1 | Very low | 36.6 | Very low | 71 Ų | 71 | 136.5 Ų | 136.5 | 73% | 0.732 | 83% | 0.826 | S | S | * | * | trans | 179.2 | 104.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 330 | S | 31.5 | Very low | 36.2 | Very low | 126 Ų | 126 | 135.4 Ų | 135.4 | 88% | 0.881 | 82% | 0.821 | S | S | * | * | trans | 47.4 | 103.6 | 141.1 | -54.2 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 331 | A | 31.4 | Very low | 36.1 | Very low | 95 Ų | 95 | 136.2 Ų | 136.2 | 79% | 0.785 | 83% | 0.825 | S | S | * | * | trans | 12.6 | 137.3 | 138.8 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 332 | T | 30.4 | Very low | 36.2 | Very low | 152 Ų | 152 | 132.9 Ų | 132.9 | 93% | 0.933 | 82% | 0.82 | S | S | * | * | -165 | 174.1 | 116.6 | 14.5 | 0 | 0 | 0 | 0 | 111 | |||||
| 333 | A | 30.6 | Very low | 37.1 | Very low | 106 Ų | 106 | 129.5 Ų | 129.5 | 88% | 0.876 | 82% | 0.822 | S | S | * | * | trans | -121.3 | 151.3 | -165 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 334 | A | 30.8 | Very low | 37 | Very low | 102 Ų | 102 | 130.4 Ų | 130.4 | 84% | 0.843 | 83% | 0.829 | S | S | * | * | trans | -157.6 | 150.1 | 156.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 335 | T | 35.9 | Very low | 37.6 | Very low | 130 Ų | 130 | 130.4 Ų | 130.4 | 80% | 0.798 | 83% | 0.831 | S | S | * | * | trans | -92.4 | 169.3 | 170.1 | 53.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 336 | P | 45.2 | Very low | 38 | Very low | 127 Ų | 127 | 128.9 Ų | 128.9 | 83% | 0.825 | 83% | 0.834 | S | S | * | * | -139.8 | 165.7 | 105.3 | 37.3 | -25.3 | 0 | 0 | 0 | 115.5 | |||||
| 337 | T | 33.5 | Very low | 37.4 | Very low | 131 Ų | 131 | 131.8 Ų | 131.8 | 80% | 0.804 | 84% | 0.843 | S | S | * | * | trans | -78 | 153.9 | -174.4 | 48.9 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 338 | R | 36.7 | Very low | 37.1 | Very low | 245 Ų | 245 | 129.3 Ų | 129.3 | 93% | 0.925 | 83% | 0.828 | S | S | * | * | trans | -163 | 165.5 | 136 | -107.3 | -168.7 | 158.5 | -176.3 | -7.7 | 111.2 | ||||
| 339 | P | 42.8 | Very low | 38.1 | Very low | 119 Ų | 119 | 132.2 Ų | 132.2 | 77% | 0.773 | 83% | 0.829 | S | S | * | * | trans | -96.5 | 169.5 | -145.5 | 37.9 | -40.7 | 0 | 0 | 0 | 116.8 | ||||
| 340 | M | 34.4 | Very low | 39.5 | Very low | 170 Ų | 170 | 139 Ų | 139 | 84% | 0.837 | 83% | 0.832 | S | S | * | * | trans | -73.1 | 152 | 173.3 | -67.5 | -175.2 | 69.6 | 0 | 0 | 114.1 | ||||
| 341 | L | 38 | Very low | 40.6 | Very low | 165 Ų | 165 | 137.6 Ų | 137.6 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | trans | -122.8 | 144.2 | 144.2 | -84.3 | 166.6 | 0 | 0 | 0 | 108.3 | ||||
| 342 | P | 39.8 | Very low | 41.4 | Very low | 121 Ų | 121 | 137.7 Ų | 137.7 | 79% | 0.786 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -85.3 | 141.6 | -175.4 | 33.2 | -34 | 0 | 0 | 0 | 112.6 | ||
| 343 | G | 49.2 | Very low | 42.5 | Very low | 85 Ų | 85 | 139.4 Ų | 139.4 | 88% | 0.876 | 82% | 0.818 | S | S | * | * | trans | 116.3 | 57.8 | 163.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 344 | A | 36.8 | Very low | 43.4 | Very low | 97 Ų | 97 | 138.9 Ų | 138.9 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | trans | -142.1 | 126.7 | 161.3 | 0 | 0 | 0 | 0 | 0 | 110.5 | T346 | A344-T346 PolarHBondContact O-N 2.76Š| ||
| 345 | M | 45.3 | Very low | 44 | Very low | 183 Ų | 183 | 140.3 Ų | 140.3 | 90% | 0.901 | 81% | 0.809 | S | S | * | * | trans | -77.8 | 118.3 | 177 | -69 | -68.8 | -159.4 | 0 | 0 | 110.1 | L347 | M345-L347 PolarHBondContact O-N 3.22Å; M345-L347 VanDerWaalsContact O-N 3.14Å | ||
| 346 | T | 39.7 | Very low | 44.4 | Very low | 136 Ų | 136 | 142.3 Ų | 142.3 | 83% | 0.834 | 81% | 0.814 | S | S | * | * | trans | -74.7 | 101.1 | 170.1 | 55.9 | 0 | 0 | 0 | 0 | 109.8 | A344 S348 | A344-T346 PolarHBondContact O-N 2.76Å; T346-S348 PolarHBondContact O-N 2.99Å | ||
| 347 | L | 44.3 | Very low | 44.5 | Very low | 166 Ų | 166 | 144.5 Ų | 144.5 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | trans | -61.7 | 119.3 | 171.4 | -73.1 | 172.4 | 0 | 0 | 0 | 109.5 | M345 | M345-L347 PolarHBondContact O-N 3.22Å; M345-L347 VanDerWaalsContact O-N 3.14Å | ||
| 348 | S | 42.9 | Very low | 45 | Very low | 79 Ų | 79 | 144 Ų | 144 | 55% | 0.552 | 81% | 0.812 | S | S | * | * | trans | -85.6 | 122.5 | -170.7 | -163.7 | 0 | 0 | 0 | 0 | 111 | T346 R350 | T346-S348 PolarHBondContact O-N 2.99Å; S348-R350 VanDerWaalsContact C-N 3.34Å; S348-R350 PolarHBondContact O-N 2.8Å; S348-R350 PolarHBondContact OG-NE 2.81Å; S348-R350 VanDerWaalsContact OG-NE 3.16Å | ||
| 349 | N | 52.1 | Low | 44.9 | Very low | 171 Ų | 171 | 140 Ų | 140 | 91% | 0.914 | 81% | 0.809 | S | S | * | * | trans | -65.5 | 89.6 | 170.6 | -74.6 | -2.7 | 0 | 0 | 0 | 110.3 | ||||
| 350 | R | 57.8 | Low | 44.5 | Very low | 213 Ų | 213 | 138.1 Ų | 138.1 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -131.7 | 130.2 | 176.5 | -68.3 | -178.1 | -177.1 | -97.5 | -1.9 | 110.3 | S348 | S348-R350 VanDerWaalsContact C-N 3.34Å; S348-R350 PolarHBondContact O-N 2.8Å; S348-R350 PolarHBondContact OG-NE 2.81Å; S348-R350 VanDerWaalsContact OG-NE 3.16Å | ||
| 351 | S | 54.9 | Low | 45 | Very low | 97 Ų | 97 | 135.7 Ų | 135.7 | 68% | 0.678 | 80% | 0.8 | S | S | * | * | trans | -68.6 | 150 | -174 | -176.3 | 0 | 0 | 0 | 0 | 112.5 | F353 | S351-F353 PolarHBondContact O-N 3.3Å; S351-F353 VanDerWaalsContact O-N 3.15Å | ||
| 352 | A | 47.5 | Very low | 44.9 | Very low | 97 Ų | 97 | 136.2 Ų | 136.2 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -73.2 | 1.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 353 | F | 54.8 | Low | 44.6 | Very low | 187 Ų | 187 | 140.2 Ų | 140.2 | 82% | 0.82 | 80% | 0.804 | S | S | * | * | trans | -117.2 | 89.3 | -178.5 | -65.9 | -79.7 | 0 | 0 | 0 | 111.2 | S351 | S351-F353 PolarHBondContact O-N 3.3Å; S351-F353 VanDerWaalsContact O-N 3.15Å | ||
| 354 | S | 49.9 | Very low | 43.9 | Very low | 95 Ų | 95 | 139.7 Ų | 139.7 | 66% | 0.664 | 80% | 0.798 | S | S | * | * | trans | -151.3 | 129.2 | 168.8 | -73.7 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 355 | P | 41.8 | Very low | 43.6 | Very low | 132 Ų | 132 | 140.1 Ų | 140.1 | 86% | 0.857 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 136.1 | -179.6 | -22.5 | 33.9 | 0 | 0 | 0 | 112.5 | Q357 | P355-Q357 PolarHBondContact O-N 2.67Š|
| 356 | L | 45.7 | Very low | 43.2 | Very low | 173 Ų | 173 | 139 Ų | 139 | 91% | 0.906 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -75 | 124.6 | 179.6 | -63.4 | 175.5 | 0 | 0 | 0 | 111.4 | ||
| 357 | Q | 47.4 | Very low | 43.5 | Very low | 173 Ų | 173 | 138.4 Ų | 138.4 | 81% | 0.808 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 142.3 | 164.6 | -71.7 | -85.9 | -27.8 | 0 | 0 | 109.5 | P355 | P355-Q357 PolarHBondContact O-N 2.67Š|
| 358 | P | 42.4 | Very low | 43.1 | Very low | 121 Ų | 121 | 133.5 Ų | 133.5 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 139.5 | 174.9 | 29.5 | -33.5 | 0 | 0 | 0 | 111.6 | ||
| 359 | N | 35.7 | Very low | 42.8 | Very low | 161 Ų | 161 | 136.4 Ų | 136.4 | 86% | 0.861 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 150.6 | -177 | -98.6 | -54.2 | 0 | 0 | 0 | 113.7 | ||
| 360 | A | 34.4 | Very low | 42.4 | Very low | 78 Ų | 78 | 138.9 Ų | 138.9 | 65% | 0.645 | 80% | 0.8 | S | S | * | * | trans | -112.9 | 139.9 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 361 | P | 44.7 | Very low | 42.1 | Very low | 120 Ų | 120 | 133.8 Ų | 133.8 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | trans | -79.9 | 139.4 | -173.5 | 31.7 | -34.8 | 0 | 0 | 0 | 112.5 | ||||
| 362 | H | 35.1 | Very low | 41.4 | Very low | 175 Ų | 175 | 138 Ų | 138 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | trans | -108.6 | 100.8 | 171.8 | 42.3 | -87 | 0 | 0 | 0 | 109.4 | ||||
| 363 | F | 33.9 | Very low | 40.8 | Very low | 206 Ų | 206 | 136 Ų | 136 | 90% | 0.904 | 80% | 0.798 | S | S | * | * | trans | -86.5 | 124.4 | 170.5 | -109.2 | -93 | 0 | 0 | 0 | 109.7 | ||||
| 364 | G | 34 | Very low | 39.8 | Very low | 74 Ų | 74 | 134.2 Ų | 134.2 | 76% | 0.763 | 80% | 0.802 | S | S | * | * | trans | -78.6 | 141.9 | 161.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 365 | A | 32.2 | Very low | 39.1 | Very low | 105 Ų | 105 | 137.1 Ų | 137.1 | 87% | 0.868 | 80% | 0.804 | S | S | * | * | trans | -121.6 | 137.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 366 | D | 36.6 | Very low | 39.2 | Very low | 159 Ų | 159 | 137.8 Ų | 137.8 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | trans | -116.5 | 136.3 | 179 | -155.1 | 15.9 | 0 | 0 | 0 | 108.2 | ||||
| 367 | P | 45.9 | Very low | 38.6 | Very low | 124 Ų | 124 | 132.9 Ų | 132.9 | 81% | 0.805 | 79% | 0.791 | S | S | * | * | trans | -96.6 | 114.3 | -157.7 | 34.3 | -32.5 | 0 | 0 | 0 | 115.5 | ||||
| 368 | G | 36.5 | Very low | 38.5 | Very low | 64 Ų | 64 | 132.7 Ų | 132.7 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | 101.7 | 109.9 | 123.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 369 | T | 35 | Very low | 38.5 | Very low | 140 Ų | 140 | 134.8 Ų | 134.8 | 86% | 0.859 | 80% | 0.799 | S | S | * | * | trans | -158.5 | 83.6 | 139.4 | -1.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 370 | Y | 44.5 | Very low | 38.9 | Very low | 223 Ų | 223 | 132.9 Ų | 132.9 | 88% | 0.875 | 80% | 0.796 | S | S | * | * | trans | 43.3 | 159.4 | 141.4 | -76.7 | -59.5 | 0 | 0 | 0 | 123.3 | ||||
| 371 | P | 51.1 | Low | 39 | Very low | 106 Ų | 106 | 136.9 Ų | 136.9 | 69% | 0.688 | 81% | 0.806 | S | S | * | * | -137.8 | 175.7 | -126.5 | 44.1 | -26 | 0 | 0 | 0 | 116.9 | |||||
| 372 | L | 39.9 | Very low | 38.7 | Very low | 186 Ų | 186 | 141.2 Ų | 141.2 | 97% | 0.974 | 81% | 0.806 | S | S | * | * | trans | -172.6 | 136.4 | 153.6 | -96.5 | 141.8 | 0 | 0 | 0 | 107.9 | ||||
| 373 | G | 35.4 | Very low | 38.8 | Very low | 55 Ų | 55 | 139.6 Ų | 139.6 | 57% | 0.567 | 80% | 0.803 | S | S | * | * | cis | 172.1 | 120.7 | -13.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 374 | T | 33.8 | Very low | 38.5 | Very low | 148 Ų | 148 | 133.4 Ų | 133.4 | 91% | 0.908 | 79% | 0.79 | S | S | * | * | trans | 68.7 | 160.9 | 175.1 | 78.5 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 375 | H | 34.7 | Very low | 38.4 | Very low | 156 Ų | 156 | 140.7 Ų | 140.7 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | cis | -149.4 | 153 | 10.1 | -165.8 | -147.4 | 0 | 0 | 0 | 112.4 | ||||
| 376 | L | 44.9 | Very low | 38.4 | Very low | 147 Ų | 147 | 140 Ų | 140 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | 54 | 116.8 | 171 | -61.2 | 176.5 | 0 | 0 | 0 | 120 | ||||
| 377 | G | 33.2 | Very low | 38.2 | Very low | 69 Ų | 69 | 135.7 Ų | 135.7 | 71% | 0.711 | 77% | 0.771 | S | S | * | * | trans | -127.4 | 145.3 | 151.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 378 | L | 45.1 | Very low | 37.9 | Very low | 170 Ų | 170 | 138.6 Ų | 138.6 | 89% | 0.89 | 77% | 0.774 | S | S | * | * | trans | -138.8 | 120 | 167 | -74.4 | 178.5 | 0 | 0 | 0 | 109.6 | ||||
| 379 | N | 41.9 | Very low | 38 | Very low | 164 Ų | 164 | 140 Ų | 140 | 88% | 0.877 | 77% | 0.773 | S | S | * | * | trans | -87.9 | 142.1 | 163 | -102.4 | -65.9 | 0 | 0 | 0 | 109.1 | ||||
| 380 | P | 43.8 | Very low | 38.4 | Very low | 121 Ų | 121 | 145 Ų | 145 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | trans | -111.8 | 129.5 | 154.8 | 4.2 | 16.7 | 0 | 0 | 0 | 112.2 | ||||
| 381 | L | 37.2 | Very low | 38.1 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 85% | 0.853 | 77% | 0.77 | S | S | * | * | trans | -71.1 | 146.4 | 174.7 | -79.8 | 157.8 | 0 | 0 | 0 | 112.9 | ||||
| 382 | R | 37.9 | Very low | 38.2 | Very low | 211 Ų | 211 | 141.8 Ų | 141.8 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | 35.3 | 141.1 | 124.6 | -104.6 | -93.8 | -166.8 | 137.7 | -1.8 | 120.3 | |||||
| 383 | L | 36.6 | Very low | 38.3 | Very low | 141 Ų | 141 | 136.9 Ų | 136.9 | 74% | 0.738 | 77% | 0.771 | S | S | * | * | trans | 90 | 132.8 | 146.5 | -89.3 | 160 | 0 | 0 | 0 | 122.2 | ||||
| 384 | A | 28 | Very low | 38.7 | Very low | 76 Ų | 76 | 143.6 Ų | 143.6 | 63% | 0.628 | 79% | 0.785 | S | S | * | * | trans | 80.1 | 127.4 | 135.1 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 385 | Y | 31.7 | Very low | 39 | Very low | 226 Ų | 226 | 144.1 Ų | 144.1 | 89% | 0.886 | 78% | 0.779 | S | S | * | * | trans | 64.1 | 167.1 | 150 | -84.8 | -123.2 | 0 | 0 | 0 | 118 | ||||
| 386 | S | 33.4 | Very low | 39.4 | Very low | 91 Ų | 91 | 143 Ų | 143 | 64% | 0.636 | 78% | 0.783 | S | S | * | * | cis | -167.9 | 130.3 | -42.3 | -175.8 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 387 | A | 32.3 | Very low | 40 | Very low | 69 Ų | 69 | 141 Ų | 141 | 57% | 0.57 | 78% | 0.779 | S | S | * | * | trans | 58.1 | 158.3 | 149.5 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 388 | H | 38.2 | Very low | 40.3 | Very low | 185 Ų | 185 | 147.7 Ų | 147.7 | 86% | 0.856 | 78% | 0.784 | S | S | * | * | trans | 75.3 | 137.3 | 167.3 | -51.8 | 107.7 | 0 | 0 | 0 | 117.1 | ||||
| 389 | S | 40.1 | Very low | 40.2 | Very low | 93 Ų | 93 | 145.7 Ų | 145.7 | 65% | 0.65 | 78% | 0.784 | S | S | * | * | cis | -154.5 | 169.8 | 2.6 | 56.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 390 | R | 43.4 | Very low | 40.2 | Very low | 246 Ų | 246 | 144.3 Ų | 144.3 | 93% | 0.928 | 78% | 0.782 | S | S | * | * | trans | 75.9 | 120.7 | 171.6 | -47.4 | 168.4 | -168.4 | -172.3 | 0.5 | 115.1 | ||||
| 391 | G | 36.7 | Very low | 40 | Very low | 72 Ų | 72 | 145.3 Ų | 145.3 | 74% | 0.742 | 79% | 0.786 | S | S | * | * | cis | 173.1 | 166.5 | -8.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 392 | L | 54.9 | Low | 40.3 | Very low | 189 Ų | 189 | 141 Ų | 141 | 99% | 0.99 | 78% | 0.78 | S | S | * | * | trans | 78.2 | 154.1 | 178.9 | -53 | 180 | 0 | 0 | 0 | 117.4 | ||||
| 393 | A | 41.4 | Very low | 40.6 | Very low | 82 Ų | 82 | 139.5 Ų | 139.5 | 68% | 0.678 | 79% | 0.788 | S | S | * | * | trans | -100.7 | 175.6 | -165.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 394 | F | 44.1 | Very low | 41 | Very low | 197 Ų | 197 | 139.7 Ų | 139.7 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | -147.7 | 164 | 51.8 | -90.7 | -92.7 | 0 | 0 | 0 | 115.7 | |||||
| 395 | M | 38.6 | Very low | 42 | Very low | 158 Ų | 158 | 141.7 Ų | 141.7 | 78% | 0.778 | 79% | 0.793 | S | S | * | * | trans | -37.6 | 142.1 | -177.3 | -63.2 | 159.1 | 57.1 | 0 | 0 | 119.2 | ||||
| 396 | T | 44 | Very low | 42.6 | Very low | 132 Ų | 132 | 135.6 Ų | 135.6 | 81% | 0.81 | 78% | 0.78 | S | S | * | * | trans | -132.1 | 126.6 | 142.6 | 46.2 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 397 | P | 56.4 | Low | 43.1 | Very low | 106 Ų | 106 | 139.8 Ų | 139.8 | 69% | 0.688 | 79% | 0.794 | S | S | * | * | trans | -93.4 | 105.1 | 179.1 | 32.8 | -30.7 | 0 | 0 | 0 | 113 | ||||
| 398 | Y | 41.1 | Very low | 43.2 | Very low | 210 Ų | 210 | 140.1 Ų | 140.1 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | trans | 40.9 | 113.1 | 144.1 | -57.1 | -76.5 | 0 | 0 | 0 | 121 | ||||
| 399 | S | 43.1 | Very low | 43.4 | Very low | 127 Ų | 127 | 141.5 Ų | 141.5 | 89% | 0.888 | 81% | 0.808 | S | S | * | * | trans | -66 | 138.4 | 134 | -50.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 400 | T | 40.9 | Very low | 43.4 | Very low | 136 Ų | 136 | 148.2 Ų | 148.2 | 83% | 0.834 | 82% | 0.819 | S | S | * | * | trans | -129.4 | 144.3 | 172.4 | 175 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 401 | T | 40.4 | Very low | 43.6 | Very low | 142 Ų | 142 | 141 Ų | 141 | 87% | 0.871 | 80% | 0.804 | S | S | * | * | trans | -122.3 | 131.2 | -166.9 | 10.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 402 | G | 42.1 | Very low | 44 | Very low | 71 Ų | 71 | 142.8 Ų | 142.8 | 73% | 0.732 | 80% | 0.803 | S | S | * | * | trans | 94 | 108.3 | 158.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 403 | L | 44.3 | Very low | 43.6 | Very low | 181 Ų | 181 | 141.3 Ų | 141.3 | 95% | 0.948 | 79% | 0.793 | S | S | * | * | -163.9 | 153.7 | 116.7 | -99.3 | 168.8 | 0 | 0 | 0 | 108.1 | |||||
| 404 | M | 46.8 | Very low | 43.6 | Very low | 144 Ų | 144 | 143.9 Ų | 143.9 | 71% | 0.709 | 80% | 0.795 | S | S | * | * | trans | -132.5 | 130.9 | -175.2 | -161.6 | -89.2 | 171.9 | 0 | 0 | 110 | T406 | M404-T406 HydrophobicContact CE-CG2 3.86Å; M404-T406 HydrophobicContact SD-CG2 3.63Å | ||
| 405 | P | 48.6 | Very low | 43.6 | Very low | 118 Ų | 118 | 142.8 Ų | 142.8 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | trans | -117.1 | 154.6 | 150.8 | -1.4 | 22.9 | 0 | 0 | 0 | 112.2 | ||||
| 406 | T | 43.3 | Very low | 44.2 | Very low | 99 Ų | 99 | 139.8 Ų | 139.8 | 61% | 0.607 | 79% | 0.787 | S | S | * | * | trans | -97.1 | 169.9 | -175.1 | 54.5 | 0 | 0 | 0 | 0 | 112.8 | M404 | M404-T406 HydrophobicContact CE-CG2 3.86Å; M404-T406 HydrophobicContact SD-CG2 3.63Å | ||
| 407 | L | 43.3 | Very low | 44 | Very low | 178 Ų | 178 | 139.9 Ų | 139.9 | 93% | 0.932 | 78% | 0.776 | S | S | * | * | trans | 73.9 | 136.6 | 162.4 | -61.7 | 159.2 | 0 | 0 | 0 | 117.5 | ||||
| 408 | G | 34.5 | Very low | 43.6 | Very low | 76 Ų | 76 | 139.8 Ų | 139.8 | 78% | 0.784 | 78% | 0.778 | S | S | * | * | trans | 159.6 | 95 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 409 | F | 42.8 | Very low | 43.8 | Very low | 214 Ų | 214 | 137 Ų | 137 | 94% | 0.939 | 78% | 0.778 | S | S | * | * | trans | -65.8 | 142.9 | 172.7 | -98 | -122.2 | 0 | 0 | 0 | 110.8 | ||||
| 410 | R | 41.6 | Very low | 44.3 | Very low | 234 Ų | 234 | 137.8 Ų | 137.8 | 88% | 0.883 | 77% | 0.771 | S | S | * | * | trans | -106.4 | 117.3 | 163.2 | -179.6 | 175.7 | 180 | 168.1 | 0.4 | 108.6 | ||||
| 411 | P | 47.3 | Very low | 44.9 | Very low | 96 Ų | 96 | 138.4 Ų | 138.4 | 62% | 0.623 | 77% | 0.767 | S | S | * | * | trans | -73.3 | 158.3 | 172 | 31.9 | -34.7 | 0 | 0 | 0 | 111 | ||||
| 412 | P | 43.9 | Very low | 45.7 | Very low | 109 Ų | 109 | 142.2 Ų | 142.2 | 71% | 0.708 | 77% | 0.766 | S | S | * | * | trans | -58.9 | 154.3 | 160.5 | -18.2 | 32.3 | 0 | 0 | 0 | 111.1 | ||||
| 413 | M | 47.2 | Very low | 45.7 | Very low | 158 Ų | 158 | 146.1 Ų | 146.1 | 78% | 0.778 | 77% | 0.77 | S | S | * | * | trans | -133.4 | 95.1 | 169.6 | -90.8 | -82.9 | -74.5 | 0 | 0 | 106.8 | Y415 | M413-Y415 PolarHBondContact O-N 2.96Š| ||
| 414 | D | 40.2 | Very low | 45.7 | Very low | 136 Ų | 136 | 148.9 Ų | 148.9 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -69.9 | 123.4 | 174.1 | -56.8 | -78.3 | 0 | 0 | 0 | 109.3 | ||||
| 415 | Y | 45.1 | Very low | 45.7 | Very low | 173 Ų | 173 | 147.5 Ų | 147.5 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | trans | -120.8 | 91.5 | -174 | -148.9 | -92 | 0 | 0 | 0 | 110.1 | M413 F417 | M413-Y415 PolarHBondContact O-N 2.96Å; Y415-F417 HydrophobicContact CD1-CD2 4.46Å; Y415-F417 HydrophobicContact CE1-CD2 4.02Å; Y415-F417 PolarHBondContact O-N 2.73Å | ||
| 416 | A | 51 | Low | 45.6 | Very low | 96 Ų | 96 | 149.7 Ų | 149.7 | 79% | 0.793 | 77% | 0.77 | S | S | * | * | trans | -73.3 | 118.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 417 | F | 40.6 | Very low | 45.6 | Very low | 133 Ų | 133 | 152.9 Ų | 152.9 | 58% | 0.583 | 78% | 0.782 | S | S | * | * | trans | -145.6 | 47.8 | 178.6 | -141.5 | -86.8 | 0 | 0 | 0 | 112.8 | Y415 L420 | Y415-F417 HydrophobicContact CD1-CD2 4.46Å; Y415-F417 HydrophobicContact CE1-CD2 4.02Å; Y415-F417 PolarHBondContact O-N 2.73Å; F417-L420 HydrophobicContact CE1-CD1 4.14Å; F417-L420 HydrophobicContact CZ-CD1 4.14Å | ||
| 418 | S | 46.6 | Very low | 45.4 | Very low | 104 Ų | 104 | 153.6 Ų | 153.6 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | -102.4 | -19 | -170.2 | -54.1 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 419 | D | 46.8 | Very low | 45.5 | Very low | 153 Ų | 153 | 159.1 Ų | 159.1 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.2 | -3.5 | -164.7 | -72.8 | -46.3 | 0 | 0 | 0 | 116.3 | ||
| 420 | L | 53.7 | Low | 45.1 | Very low | 142 Ų | 142 | 156.2 Ų | 156.2 | 74% | 0.743 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | -3.8 | -175.4 | -87.5 | 163.5 | 0 | 0 | 0 | 115.8 | F417 | F417-L420 HydrophobicContact CE1-CD1 4.14Å; F417-L420 HydrophobicContact CZ-CD1 4.14Å |
| 421 | I | 53.4 | Low | 44.7 | Very low | 149 Ų | 149 | 154.4 Ų | 154.4 | 76% | 0.764 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -97.7 | -18.9 | -173.8 | -60.7 | 178.7 | 0 | 0 | 0 | 112.7 | ||
| 422 | R | 56.3 | Low | 43.8 | Very low | 223 Ų | 223 | 153.2 Ų | 153.2 | 84% | 0.842 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -83.7 | -17.2 | -171.6 | -170.3 | 161.6 | -76.4 | 158.1 | -1.2 | 115 | ||
| 423 | D | 42.8 | Very low | 43.4 | Very low | 152 Ų | 152 | 159 Ų | 159 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | 23.4 | -163.4 | -154.3 | 28.3 | 0 | 0 | 0 | 115.5 | ||
| 424 | R | 44.3 | Very low | 42.8 | Very low | 240 Ų | 240 | 155.9 Ų | 155.9 | 91% | 0.906 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118 | 8.2 | -177 | -164.1 | 161.4 | 172.9 | 136.5 | -1 | 115.2 | ||
| 425 | T | 46.3 | Very low | 42.5 | Very low | 114 Ų | 114 | 155.5 Ų | 155.5 | 70% | 0.699 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -106.4 | 1.5 | -176.2 | 51.8 | 0 | 0 | 0 | 0 | 114.9 | ||
| 426 | M | 45.7 | Very low | 41.9 | Very low | 165 Ų | 165 | 150.6 Ų | 150.6 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | S | Bend | trans | -114.5 | 28.1 | -168.9 | -76.2 | -67.8 | 132.3 | 0 | 0 | 116 | ||
| 427 | L | 43.5 | Very low | 41.4 | Very low | 166 Ų | 166 | 153.2 Ų | 153.2 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | trans | -139 | 70.4 | 173.2 | -93.4 | 178.3 | 0 | 0 | 0 | 113.4 | ||||
| 428 | H | 40.6 | Very low | 41.1 | Very low | 193 Ų | 193 | 157.4 Ų | 157.4 | 89% | 0.894 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -156.2 | 37.3 | 160.3 | -138.5 | -73.7 | 0 | 0 | 0 | 117.3 | ||
| 429 | K | 36.7 | Very low | 40.5 | Very low | 192 Ų | 192 | 155.3 Ų | 155.3 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | trans | -153 | 95.1 | 170.2 | -168 | 178 | -179.2 | -177.8 | 0 | 114 | ||||
| 430 | E | 32.8 | Very low | 41.2 | Very low | 152 Ų | 152 | 153.8 Ų | 153.8 | 71% | 0.71 | 80% | 0.804 | S | S | * | * | trans | -168.6 | 117.2 | 141.2 | -110.4 | -43.7 | 123.3 | 0 | 0 | 110.6 | ||||
| 431 | Q | 33.4 | Very low | 40.6 | Very low | 197 Ų | 197 | 155.1 Ų | 155.1 | 92% | 0.921 | 81% | 0.811 | S | S | * | * | trans | -175.6 | 90.7 | 169.4 | -167 | 80.5 | 60.7 | 0 | 0 | 109.2 | ||||
| 432 | G | 29.4 | Very low | 39.9 | Very low | 71 Ų | 71 | 153.9 Ų | 153.9 | 73% | 0.732 | 81% | 0.811 | S | S | * | * | trans | 177.2 | 40.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 433 | Y | 34.6 | Very low | 38.9 | Very low | 229 Ų | 229 | 149.2 Ų | 149.2 | 90% | 0.898 | 80% | 0.802 | S | S | * | * | trans | -87.7 | 125.5 | 168.7 | -101.5 | -92.1 | 0 | 0 | 0 | 111.8 | ||||
| 434 | A | 34.6 | Very low | 38.5 | Very low | 94 Ų | 94 | 148.8 Ų | 148.8 | 78% | 0.777 | 80% | 0.8 | S | S | * | * | trans | 170.5 | 109.7 | 133.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 435 | S | 33.7 | Very low | 38.5 | Very low | 127 Ų | 127 | 142.9 Ų | 142.9 | 89% | 0.888 | 79% | 0.791 | S | S | * | * | trans | 40.4 | 121.2 | 131.5 | -151.9 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 436 | G | 33.4 | Very low | 39.1 | Very low | 70 Ų | 70 | 142.7 Ų | 142.7 | 72% | 0.722 | 79% | 0.792 | S | S | * | * | trans | 78.6 | 173.3 | 148.8 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 437 | L | 39.3 | Very low | 39 | Very low | 152 Ų | 152 | 140.8 Ų | 140.8 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | cis | -166.3 | 147.8 | -18.4 | -118.2 | 176.1 | 0 | 0 | 0 | 108.6 | ||||
| 438 | Y | 34.4 | Very low | 38.9 | Very low | 220 Ų | 220 | 140.9 Ų | 140.9 | 86% | 0.863 | 78% | 0.778 | S | S | * | * | trans | 63.9 | 149.1 | 175.2 | -78 | -93.8 | 0 | 0 | 0 | 120 | ||||
| 439 | G | 34 | Very low | 38.9 | Very low | 60 Ų | 60 | 143.7 Ų | 143.7 | 62% | 0.619 | 79% | 0.792 | S | S | * | * | trans | -130.9 | -149.9 | 149 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 440 | P | 63.2 | Low | 39 | Very low | 122 Ų | 122 | 141.3 Ų | 141.3 | 79% | 0.792 | 79% | 0.789 | S | S | * | * | cis | -119.5 | -169.8 | -18 | 42.3 | -29.1 | 0 | 0 | 0 | 111.1 | ||||
| 441 | L | 39.4 | Very low | 39.3 | Very low | 170 Ų | 170 | 140.7 Ų | 140.7 | 89% | 0.89 | 79% | 0.794 | S | S | * | * | trans | -156.5 | 168.9 | 147 | -139.7 | 74.1 | 0 | 0 | 0 | 112.7 | ||||
| 442 | V | 39.1 | Very low | 39.7 | Very low | 123 Ų | 123 | 137.6 Ų | 137.6 | 75% | 0.745 | 79% | 0.787 | S | S | * | * | trans | -135 | 155.8 | -169.4 | -67.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 443 | N | 35.9 | Very low | 40.3 | Very low | 124 Ų | 124 | 141.5 Ų | 141.5 | 66% | 0.663 | 79% | 0.79 | S | S | * | * | trans | 64.7 | 133.5 | 157.6 | -138.4 | 59.6 | 0 | 0 | 0 | 119.1 | ||||
| 444 | N | 33.3 | Very low | 40.6 | Very low | 144 Ų | 144 | 136.1 Ų | 136.1 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | 176.9 | 113.9 | 105.4 | -87.8 | -56.3 | 0 | 0 | 0 | 112.1 | |||||
| 445 | T | 44.3 | Very low | 41 | Very low | 116 Ų | 116 | 138.9 Ų | 138.9 | 71% | 0.712 | 78% | 0.783 | S | S | * | * | trans | -68.8 | 157.7 | 150.2 | 50.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 446 | P | 59.4 | Low | 41.5 | Very low | 110 Ų | 110 | 139.7 Ų | 139.7 | 71% | 0.714 | 78% | 0.776 | S | S | * | * | -154.3 | -179 | 66.7 | 42.7 | -22.4 | 0 | 0 | 0 | 117.2 | |||||
| 447 | D | 43.3 | Very low | 42.2 | Very low | 125 Ų | 125 | 145.1 Ų | 145.1 | 67% | 0.668 | 78% | 0.78 | S | S | * | * | trans | 44.6 | 148.2 | 144 | -77.6 | -5.4 | 0 | 0 | 0 | 120.5 | ||||
| 448 | K | 42.7 | Very low | 42.4 | Very low | 167 Ų | 167 | 144.5 Ų | 144.5 | 73% | 0.726 | 78% | 0.779 | S | S | * | * | cis | -158.1 | 175.6 | 6.4 | -119.1 | 159.8 | -172 | 141.3 | 0 | 106.2 | ||||
| 449 | Q | 39.8 | Very low | 43.1 | Very low | 253 Ų | 253 | 137.6 Ų | 137.6 | 100% | 1.182 | 77% | 0.771 | S | S | * | * | cis | -155.3 | 0 | 27.4 | -166 | 168.5 | -29.4 | 0 | 0 | 110.9 |
Retrieved 449 of 449 residues in 524 ms
(Link to these results)