| 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 | 41.6 | Very low | 39.6 | Very low | 225 Ų | 225 | 135.5 Ų | 135.5 | 100% | 1.108 | 73% | 0.734 | S | S | * | * | 0 | 111.9 | 0 | -55 | -176.3 | 86.3 | 0 | 0 | 105.7 | |||||
| 2 | T | 34.4 | Very low | 39.3 | Very low | 121 Ų | 121 | 135.8 Ų | 135.8 | 74% | 0.742 | 73% | 0.727 | S | S | * | * | 58.3 | 115.2 | 68.6 | 65.2 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 3 | S | 41.3 | Very low | 38.7 | Very low | 106 Ų | 106 | 139.2 Ų | 139.2 | 74% | 0.741 | 73% | 0.731 | S | S | * | * | cis | -143.2 | 160.3 | 16.4 | -59.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 4 | V | 38.8 | Very low | 38.1 | Very low | 127 Ų | 127 | 134.2 Ų | 134.2 | 77% | 0.77 | 73% | 0.73 | S | S | * | * | cis | 62.6 | 124.8 | 45.5 | -177.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 5 | T | 40.8 | Very low | 39.4 | Very low | 117 Ų | 117 | 133.7 Ų | 133.7 | 72% | 0.718 | 74% | 0.736 | S | S | * | * | cis | -155.4 | 140.3 | 45.5 | -10.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 6 | R | 38.7 | Very low | 38.8 | Very low | 186 Ų | 186 | 133.1 Ų | 133.1 | 70% | 0.702 | 74% | 0.737 | S | S | * | * | 77.1 | 99.8 | 100.5 | -169.5 | 175.5 | -167 | 132.2 | 11.3 | 115.4 | E8 | R6-E8 WeakPolarHBondContact CG-OE1 3.47Å; R6-E8 IonicContact CZ-OE1 4Å; R6-E8 IonicContact CZ-OE2 2.89Å; R6-E8 IonicContact NE-OE1 2.7Å; R6-E8 PolarHBondContact NE-OE1 2.71Å; R6-E8 VanDerWaalsContact NE-OE1 3.13Å; R6-E8 IonicContact NE-OE2 3.84Å; R6-E8 PolarHBondContact NE-OE2 2.61Å; R6-E8 IonicContact NH2-OE1 2.75Å; R6-E8 PolarHBondContact NH2-OE1 2.98Å; R6-E8 IonicContact NH2-OE2 2.84Å; R6-E8 PolarHBondContact NH2-OE2 3.03Å | |||
| 7 | S | 41.6 | Very low | 38.3 | Very low | 101 Ų | 101 | 134.6 Ų | 134.6 | 71% | 0.706 | 74% | 0.74 | S | S | * | * | 84.5 | -174 | 91.1 | -49 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 8 | E | 38.8 | Very low | 38.1 | Very low | 109 Ų | 109 | 132.7 Ų | 132.7 | 51% | 0.509 | 74% | 0.738 | S | S | . | * | cis | -162 | 152.8 | 9 | -128.2 | 129.9 | -116.1 | 0 | 0 | 106.3 | R6 | R6-E8 WeakPolarHBondContact CG-OE1 3.47Å; R6-E8 IonicContact CZ-OE1 4Å; R6-E8 IonicContact CZ-OE2 2.89Å; R6-E8 IonicContact NE-OE1 2.7Å; R6-E8 PolarHBondContact NE-OE1 2.71Å; R6-E8 VanDerWaalsContact NE-OE1 3.13Å; R6-E8 IonicContact NE-OE2 3.84Å; R6-E8 PolarHBondContact NE-OE2 2.61Å; R6-E8 IonicContact NH2-OE1 2.75Å; R6-E8 PolarHBondContact NH2-OE1 2.98Å; R6-E8 IonicContact NH2-OE2 2.84Å; R6-E8 PolarHBondContact NH2-OE2 3.03Å | ||
| 9 | I | 41.8 | Very low | 37.8 | Very low | 134 Ų | 134 | 135.9 Ų | 135.9 | 69% | 0.687 | 74% | 0.743 | S | S | * | * | cis | -178.3 | 171 | -10 | -172 | 163.2 | 0 | 0 | 0 | 109.4 | ||||
| 10 | I | 41.9 | Very low | 37.5 | Very low | 135 Ų | 135 | 134.7 Ų | 134.7 | 69% | 0.692 | 74% | 0.74 | S | S | * | * | trans | 78.9 | 142.4 | 154.3 | -92.7 | 152.2 | 0 | 0 | 0 | 117.6 | ||||
| 11 | D | 35.4 | Very low | 37.2 | Very low | 130 Ų | 130 | 136.1 Ų | 136.1 | 70% | 0.695 | 74% | 0.741 | S | S | * | * | cis | -154.9 | -178.6 | -1.5 | -138.5 | -11.9 | 0 | 0 | 0 | 116.4 | ||||
| 12 | E | 36.4 | Very low | 36.8 | Very low | 139 Ų | 139 | 131.8 Ų | 131.8 | 65% | 0.65 | 72% | 0.723 | S | S | * | * | trans | -49.9 | 179.2 | 161.9 | -56.8 | -170.9 | 124.2 | 0 | 0 | 114.9 | ||||
| 13 | K | 32.2 | Very low | 36.7 | Very low | 179 Ų | 179 | 134.9 Ų | 134.9 | 78% | 0.778 | 73% | 0.728 | S | S | * | * | cis | -171.6 | 134.9 | 35.3 | -154.7 | -178 | -159 | 81.9 | 0 | 115.6 | ||||
| 14 | G | 29.8 | Very low | 36.2 | Very low | 70 Ų | 70 | 137.6 Ų | 137.6 | 72% | 0.722 | 73% | 0.729 | S | S | * | * | trans | 85.9 | 165.5 | 135.7 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 15 | P | 57.4 | Low | 35.9 | Very low | 126 Ų | 126 | 139.3 Ų | 139.3 | 82% | 0.818 | 73% | 0.733 | S | S | * | * | trans | -128.5 | -155.4 | -164.4 | 33.3 | -10.1 | 0 | 0 | 0 | 113.6 | ||||
| 16 | V | 30.6 | Very low | 35.3 | Very low | 124 Ų | 124 | 141.5 Ų | 141.5 | 75% | 0.752 | 74% | 0.735 | S | S | * | * | trans | 120.4 | 105.7 | 149.6 | 178.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 17 | M | 30.5 | Very low | 35 | Very low | 159 Ų | 159 | 138 Ų | 138 | 78% | 0.783 | 74% | 0.739 | S | S | * | * | trans | 78.1 | 123.4 | 139.8 | -69.8 | -80.2 | -80 | 0 | 0 | 125.1 | ||||
| 18 | S | 33.9 | Very low | 34.4 | Very low | 101 Ų | 101 | 137.4 Ų | 137.4 | 71% | 0.706 | 74% | 0.735 | S | S | * | * | trans | 73.3 | 162.1 | 139.1 | 78 | 0 | 0 | 0 | 0 | 118 | ||||
| 19 | K | 32.1 | Very low | 34 | Very low | 193 Ų | 193 | 140 Ų | 140 | 84% | 0.839 | 75% | 0.752 | S | S | * | * | cis | -152.8 | 168.6 | 16.9 | -154.9 | 169.6 | -178.1 | -178.9 | 0 | 112.7 | ||||
| 20 | T | 32.4 | Very low | 33.5 | Very low | 112 Ų | 112 | 138.5 Ų | 138.5 | 69% | 0.687 | 75% | 0.753 | S | S | * | * | trans | -68.1 | 147.9 | 176.7 | 50.1 | 0 | 0 | 0 | 0 | 115 | ||||
| 21 | H | 30.5 | Very low | 33.4 | Very low | 164 Ų | 164 | 137.4 Ų | 137.4 | 76% | 0.759 | 76% | 0.755 | S | S | * | * | -170.2 | 145.8 | 106 | -122.6 | -33.8 | 0 | 0 | 0 | 113.5 | |||||
| 22 | D | 33.1 | Very low | 33.2 | Very low | 134 Ų | 134 | 137.5 Ų | 137.5 | 72% | 0.717 | 76% | 0.76 | S | S | * | * | trans | -68 | 157.2 | 158.7 | -47 | -96.5 | 0 | 0 | 0 | 111.8 | ||||
| 23 | H | 33.8 | Very low | 32.9 | Very low | 187 Ų | 187 | 137.7 Ų | 137.7 | 87% | 0.866 | 76% | 0.761 | S | S | * | * | trans | -149 | 122.1 | 135.9 | -98.1 | -62.7 | 0 | 0 | 0 | 111.6 | ||||
| 24 | Q | 30.9 | Very low | 32.9 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 76% | 0.762 | 76% | 0.757 | S | S | * | * | trans | -74.1 | 145.4 | 168.1 | 176.5 | -172.1 | 21.9 | 0 | 0 | 110.3 | ||||
| 25 | L | 32.1 | Very low | 32.9 | Very low | 162 Ų | 162 | 138.7 Ų | 138.7 | 85% | 0.848 | 76% | 0.755 | S | S | * | * | trans | -175.7 | 144.4 | 133.9 | -102.4 | 164 | 0 | 0 | 0 | 112.6 | ||||
| 26 | E | 28.5 | Very low | 31.6 | Very low | 163 Ų | 163 | 137.6 Ų | 137.6 | 76% | 0.762 | 75% | 0.746 | S | S | * | * | trans | -84.2 | 158 | 168.9 | -61.4 | 151.7 | 99.2 | 0 | 0 | 110.2 | ||||
| 27 | S | 30.4 | Very low | 31.6 | Very low | 112 Ų | 112 | 140.6 Ų | 140.6 | 78% | 0.783 | 75% | 0.749 | S | S | * | * | 176.6 | 154.3 | 110.7 | -162.9 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 28 | S | 29.9 | Very low | 31.6 | Very low | 90 Ų | 90 | 138.8 Ų | 138.8 | 63% | 0.629 | 75% | 0.747 | S | S | * | * | trans | -29.2 | 148.4 | 171.5 | 57.8 | 0 | 0 | 0 | 0 | 119 | ||||
| 29 | L | 30 | Very low | 31.5 | Very low | 163 Ų | 163 | 139.9 Ų | 139.9 | 85% | 0.853 | 76% | 0.755 | S | S | * | * | -177.9 | 128.6 | 96.6 | -91.3 | 168.1 | 0 | 0 | 0 | 111.9 | |||||
| 30 | S | 31.8 | Very low | 31.5 | Very low | 103 Ų | 103 | 135.6 Ų | 135.6 | 72% | 0.72 | 76% | 0.756 | S | S | * | * | trans | -97.5 | 165.7 | 152.3 | 65.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 31 | P | 40.5 | Very low | 31.4 | Very low | 112 Ų | 112 | 135.8 Ų | 135.8 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | -154.1 | -170.5 | 86 | 35 | -12.3 | 0 | 0 | 0 | 115.2 | |||||
| 32 | V | 29.9 | Very low | 31.3 | Very low | 132 Ų | 132 | 135.2 Ų | 135.2 | 80% | 0.8 | 76% | 0.763 | S | S | * | * | trans | 71.5 | 100.6 | 166.1 | -168.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 33 | E | 31.5 | Very low | 31.2 | Very low | 143 Ų | 143 | 136.1 Ų | 136.1 | 67% | 0.668 | 76% | 0.763 | S | S | * | * | cis | -145.6 | -120.7 | 2 | -155 | -170.1 | 56.2 | 0 | 0 | 113.2 | F35 | E33-F35 WeakPolarHBondContact OE1-CD2 3.45Å; E33-F35 VanDerWaalsContact OE1-CE2 3.24Å; E33-F35 WeakPolarHBondContact OE1-CE2 3.29Å | ||
| 34 | V | 30.6 | Very low | 31 | Very low | 116 Ų | 116 | 133.7 Ų | 133.7 | 70% | 0.703 | 75% | 0.754 | S | S | * | * | cis | -150.6 | 160.6 | 5.8 | 70.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 35 | F | 30.1 | Very low | 31 | Very low | 154 Ų | 154 | 134 Ų | 134 | 68% | 0.675 | 76% | 0.755 | S | S | * | * | trans | -56.3 | 131.4 | 177.9 | -68.3 | -101 | 0 | 0 | 0 | 111.8 | E33 | E33-F35 WeakPolarHBondContact OE1-CD2 3.45Å; E33-F35 VanDerWaalsContact OE1-CE2 3.24Å; E33-F35 WeakPolarHBondContact OE1-CE2 3.29Å | ||
| 36 | T | 29.6 | Very low | 30.9 | Very low | 102 Ų | 102 | 134.7 Ų | 134.7 | 63% | 0.626 | 75% | 0.754 | S | S | * | * | cis | 67.3 | 141.5 | 46.2 | 82.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 37 | K | 31.3 | Very low | 30.8 | Very low | 187 Ų | 187 | 130.4 Ų | 130.4 | 81% | 0.813 | 75% | 0.753 | S | S | * | * | cis | -159.8 | 173.4 | -6.5 | -124.1 | 173.8 | -177.1 | 176.2 | 0 | 110.8 | ||||
| 38 | T | 30.3 | Very low | 30.8 | Very low | 121 Ų | 121 | 131.4 Ų | 131.4 | 74% | 0.742 | 75% | 0.754 | S | S | * | * | trans | -29.3 | 150.9 | 164.7 | -22.6 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 39 | S | 31.3 | Very low | 31 | Very low | 125 Ų | 125 | 132.3 Ų | 132.3 | 87% | 0.874 | 76% | 0.76 | S | S | * | * | -166.3 | 157.8 | 127.7 | -83.5 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 40 | A | 32.5 | Very low | 31.2 | Very low | 103 Ų | 103 | 133.4 Ų | 133.4 | 85% | 0.851 | 76% | 0.761 | S | S | * | * | trans | -145 | 151.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 41 | S | 30.6 | Very low | 30.9 | Very low | 115 Ų | 115 | 137.6 Ų | 137.6 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -153.2 | 148.9 | 169.5 | 49.8 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 42 | L | 29 | Very low | 30.5 | Very low | 153 Ų | 153 | 142.8 Ų | 142.8 | 80% | 0.801 | 77% | 0.774 | S | S | * | * | cis | 92.9 | 77.1 | 19.8 | -158.5 | 73.4 | 0 | 0 | 0 | 116.2 | ||||
| 43 | E | 29.9 | Very low | 30.5 | Very low | 152 Ų | 152 | 143.9 Ų | 143.9 | 71% | 0.71 | 77% | 0.774 | S | S | * | * | 78.8 | 150.6 | 126.3 | -123.1 | 179.7 | -175.3 | 0 | 0 | 124.3 | |||||
| 44 | M | 30 | Very low | 30.4 | Very low | 137 Ų | 137 | 145.4 Ų | 145.4 | 68% | 0.675 | 78% | 0.781 | S | S | * | * | trans | 63.7 | 128.4 | 164.9 | -60.1 | -57.4 | -170.2 | 0 | 0 | 119.3 | ||||
| 45 | H | 30.7 | Very low | 30.5 | Very low | 170 Ų | 170 | 148.2 Ų | 148.2 | 79% | 0.787 | 79% | 0.791 | S | S | * | * | -159.8 | 130.3 | 65 | -95.7 | -85.4 | 0 | 0 | 0 | 116 | |||||
| 46 | Q | 29.6 | Very low | 30.3 | Very low | 176 Ų | 176 | 144.2 Ų | 144.2 | 82% | 0.822 | 79% | 0.793 | S | S | * | * | trans | 25.5 | 127.4 | 132 | -163.5 | 168 | 14.8 | 0 | 0 | 122.8 | ||||
| 47 | G | 27.1 | Very low | 30.3 | Very low | 72 Ų | 72 | 145.5 Ų | 145.5 | 74% | 0.742 | 81% | 0.806 | S | S | * | * | trans | -166.9 | 139.3 | 158.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 48 | V | 30.8 | Very low | 30.5 | Very low | 133 Ų | 133 | 142 Ų | 142 | 81% | 0.806 | 81% | 0.805 | S | S | * | * | trans | -143.1 | 133.4 | -171.5 | 175.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 49 | S | 33.8 | Very low | 31.1 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -167.7 | 102.9 | 156.9 | 53.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 50 | E | 34.7 | Very low | 31.1 | Very low | 186 Ų | 186 | 145 Ų | 145 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | 63.4 | 98.2 | 91.1 | -71.8 | -155.2 | 132 | 0 | 0 | 115.8 | |||||
| 51 | E | 26.1 | Very low | 31 | Very low | 191 Ų | 191 | 149.7 Ų | 149.7 | 89% | 0.893 | 81% | 0.805 | S | S | * | * | -142.9 | 155.5 | 128 | -170.2 | 160.2 | -168.4 | 0 | 0 | 109.5 | |||||
| 52 | R | 30.6 | Very low | 30.8 | Very low | 221 Ų | 221 | 147.4 Ų | 147.4 | 83% | 0.834 | 80% | 0.799 | S | S | * | * | trans | -145 | 105.8 | -155.9 | 177.7 | -163.5 | -172.6 | 175.9 | 5 | 112.3 | ||||
| 53 | I | 30.1 | Very low | 30.6 | Very low | 155 Ų | 155 | 149.1 Ų | 149.1 | 80% | 0.795 | 80% | 0.803 | S | S | * | * | trans | -131.4 | 96.7 | 161.7 | -53.4 | -178.3 | 0 | 0 | 0 | 110.2 | ||||
| 54 | H | 29.5 | Very low | 30.4 | Very low | 176 Ų | 176 | 148.2 Ų | 148.2 | 82% | 0.815 | 80% | 0.803 | S | S | * | * | trans | -107.7 | 117.2 | 159.6 | -80.5 | -71.7 | 0 | 0 | 0 | 108.9 | ||||
| 55 | L | 33.4 | Very low | 30.4 | Very low | 175 Ų | 175 | 147.4 Ų | 147.4 | 92% | 0.916 | 81% | 0.809 | S | S | * | * | trans | -138.9 | 95.1 | 155.3 | -79 | -178.6 | 0 | 0 | 0 | 109 | ||||
| 56 | G | 26.3 | Very low | 30.2 | Very low | 69 Ų | 69 | 146.1 Ų | 146.1 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | trans | -106.1 | 136.4 | 164 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 57 | S | 27.8 | Very low | 30.3 | Very low | 130 Ų | 130 | 145.9 Ų | 145.9 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -167.2 | 119.5 | 157.4 | -86 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 58 | S | 36.7 | Very low | 30.5 | Very low | 113 Ų | 113 | 147 Ų | 147 | 79% | 0.79 | 81% | 0.808 | S | S | * | * | trans | -123.2 | 143.1 | 149 | -166.8 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 59 | P | 41.8 | Very low | 30.5 | Very low | 108 Ų | 108 | 150.1 Ų | 150.1 | 70% | 0.701 | 81% | 0.813 | S | S | * | * | -153.3 | 153.4 | 96 | 37.8 | -19.6 | 0 | 0 | 0 | 117.4 | |||||
| 60 | K | 32 | Very low | 30.4 | Very low | 202 Ų | 202 | 153.1 Ų | 153.1 | 88% | 0.878 | 82% | 0.816 | S | S | * | * | trans | 35.3 | 134 | 135.4 | -55.7 | 176.7 | 178.9 | -179.1 | 0 | 120.9 | ||||
| 61 | K | 30.8 | Very low | 30.1 | Very low | 201 Ų | 201 | 153.3 Ų | 153.3 | 87% | 0.874 | 82% | 0.816 | S | S | * | * | -164.8 | 135.1 | 111.9 | -169.3 | 174.4 | 179.4 | -174 | 0 | 113.6 | |||||
| 62 | G | 25.4 | Very low | 30.2 | Very low | 66 Ų | 66 | 154 Ų | 154 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | trans | 81.1 | 151.8 | 156.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 63 | E | 24.8 | Very low | 30.3 | Very low | 190 Ų | 190 | 149.8 Ų | 149.8 | 89% | 0.888 | 80% | 0.804 | S | S | * | * | cis | -152.9 | 178.6 | -19.1 | -159.1 | 147 | 169.4 | 0 | 0 | 110.1 | ||||
| 64 | N | 27.4 | Very low | 30.1 | Very low | 132 Ų | 132 | 150 Ų | 150 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | trans | -81.1 | 151.3 | -162.4 | -150.5 | 17.4 | 0 | 0 | 0 | 114.2 | ||||
| 65 | C | 29.1 | Very low | 30.1 | Very low | 121 Ų | 121 | 146.2 Ų | 146.2 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | -175.9 | 133.2 | 121.8 | -93 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 66 | D | 27.1 | Very low | 29.8 | Very low | 142 Ų | 142 | 147.7 Ų | 147.7 | 76% | 0.759 | 79% | 0.794 | S | S | * | * | trans | -65.2 | 154.4 | 163.3 | -76.3 | -73.8 | 0 | 0 | 0 | 112 | ||||
| 67 | L | 30.9 | Very low | 29.9 | Very low | 172 Ų | 172 | 148.8 Ų | 148.8 | 90% | 0.901 | 79% | 0.791 | S | S | * | * | -153.3 | 140.7 | 118.1 | -104.3 | 179.3 | 0 | 0 | 0 | 110.1 | |||||
| 68 | S | 31.1 | Very low | 30 | Very low | 95 Ų | 95 | 151 Ų | 151 | 66% | 0.664 | 79% | 0.791 | S | S | * | * | trans | -83.9 | 157.4 | -176.8 | 54.3 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 69 | H | 31.6 | Very low | 29.6 | Very low | 198 Ų | 198 | 153.2 Ų | 153.2 | 92% | 0.917 | 79% | 0.789 | S | S | * | * | trans | -158.7 | 139.5 | 136.3 | -101.7 | -68.2 | 0 | 0 | 0 | 110.6 | ||||
| 70 | Q | 31.3 | Very low | 29 | Very low | 173 Ų | 173 | 156.6 Ų | 156.6 | 81% | 0.808 | 80% | 0.8 | S | S | * | * | trans | -142.5 | 109.8 | -175.2 | 177.5 | -166.1 | 32.8 | 0 | 0 | 109.9 | ||||
| 71 | E | 29.4 | Very low | 28.8 | Very low | 190 Ų | 190 | 152.1 Ų | 152.1 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | trans | -162.1 | 132.4 | 163.2 | -113.4 | 166.2 | 175 | 0 | 0 | 108.2 | ||||
| 72 | R | 26.9 | Very low | 29.5 | Very low | 206 Ų | 206 | 147.9 Ų | 147.9 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | cis | 98.5 | 84 | 14.7 | -156.1 | 179.8 | -159.6 | 177.8 | 7.8 | 116.3 | ||||
| 73 | L | 32.3 | Very low | 29.6 | Very low | 132 Ų | 132 | 153.9 Ų | 153.9 | 69% | 0.691 | 80% | 0.798 | S | S | * | * | trans | 78 | 125.8 | 143.3 | -61.7 | 173.8 | 0 | 0 | 0 | 121.4 | ||||
| 74 | Q | 27 | Very low | 29.9 | Very low | 158 Ų | 158 | 152 Ų | 152 | 74% | 0.738 | 79% | 0.789 | S | S | * | * | trans | 74.7 | 105.6 | 131.2 | -68.9 | -177.7 | 17 | 0 | 0 | 122.9 | ||||
| 75 | S | 28.5 | Very low | 30.1 | Very low | 98 Ų | 98 | 153.6 Ų | 153.6 | 69% | 0.685 | 79% | 0.792 | S | S | * | * | 80.3 | 147.9 | 112.8 | -55.3 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 76 | K | 27.5 | Very low | 30.1 | Very low | 205 Ų | 205 | 152.9 Ų | 152.9 | 89% | 0.891 | 79% | 0.788 | S | S | * | * | trans | 76.9 | 160.4 | 165.2 | -59.2 | 169.6 | -176.3 | 173.1 | 0 | 116.9 | ||||
| 77 | S | 28.4 | Very low | 30.2 | Very low | 92 Ų | 92 | 150.4 Ų | 150.4 | 64% | 0.643 | 79% | 0.788 | S | S | * | * | cis | 179.1 | 113 | -33.6 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 78 | L | 29.8 | Very low | 30.1 | Very low | 176 Ų | 176 | 147.6 Ų | 147.6 | 92% | 0.921 | 78% | 0.782 | S | S | * | * | trans | -150.5 | 125.2 | 160 | -66.6 | 176.4 | 0 | 0 | 0 | 107.3 | ||||
| 79 | H | 27.6 | Very low | 30.1 | Very low | 161 Ų | 161 | 153.1 Ų | 153.1 | 75% | 0.745 | 79% | 0.79 | S | S | * | * | cis | 91.2 | 80.1 | 19.7 | -156 | -65.5 | 0 | 0 | 0 | 116 | ||||
| 80 | L | 30.2 | Very low | 30.4 | Very low | 178 Ų | 178 | 152.2 Ų | 152.2 | 93% | 0.932 | 79% | 0.787 | S | S | * | * | trans | -143.6 | 130.6 | 163.1 | -76.1 | -179.2 | 0 | 0 | 0 | 111.8 | ||||
| 81 | S | 27.2 | Very low | 30.7 | Very low | 108 Ų | 108 | 150.3 Ų | 150.3 | 76% | 0.755 | 78% | 0.782 | S | S | * | * | trans | 176.9 | 157.2 | 171.3 | -171.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 82 | P | 46.7 | Very low | 31 | Very low | 112 Ų | 112 | 152.1 Ų | 152.1 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | cis | -123.4 | 179.4 | -43.9 | 37.5 | -24.4 | 0 | 0 | 0 | 111.2 | ||||
| 83 | Q | 27.9 | Very low | 31.4 | Very low | 193 Ų | 193 | 153.1 Ų | 153.1 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | trans | -143.9 | 144.8 | 152.8 | -166.4 | 159.8 | -8.3 | 0 | 0 | 111.8 | ||||
| 84 | E | 30.1 | Very low | 32 | Very low | 150 Ų | 150 | 154.6 Ų | 154.6 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | trans | -100 | -173.4 | -176.5 | -24 | 176.2 | 133.4 | 0 | 0 | 110.2 | ||||
| 85 | Q | 32.3 | Very low | 33 | Very low | 166 Ų | 166 | 151.4 Ų | 151.4 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | cis | -153.5 | 157.7 | 4.2 | -129.1 | -177.3 | 81.7 | 0 | 0 | 104.4 | ||||
| 86 | S | 28.4 | Very low | 33.9 | Very low | 105 Ų | 105 | 159.1 Ų | 159.1 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | cis | -151.1 | -167.1 | 5.4 | 54.6 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 87 | A | 30.1 | Very low | 34.4 | Very low | 90 Ų | 90 | 159.4 Ų | 159.4 | 74% | 0.744 | 79% | 0.793 | S | S | * | * | cis | -153.6 | -157.1 | 11.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 88 | S | 29 | Very low | 35 | Very low | 113 Ų | 113 | 166.5 Ų | 166.5 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | cis | -148.4 | -117.6 | 6.6 | 64.8 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 89 | Y | 30.8 | Very low | 35.5 | Very low | 211 Ų | 211 | 163.9 Ų | 163.9 | 83% | 0.827 | 80% | 0.802 | S | S | * | * | trans | -93.2 | 148.4 | -160.5 | -83.2 | -74.1 | 0 | 0 | 0 | 116.4 | ||||
| 90 | Q | 38.1 | Very low | 36.3 | Very low | 180 Ų | 180 | 161 Ų | 161 | 84% | 0.841 | 80% | 0.8 | S | S | * | * | trans | 72.5 | 67.5 | 158.9 | -67.9 | -174.5 | 6.8 | 0 | 0 | 118.7 | ||||
| 91 | D | 36.1 | Very low | 36.9 | Very low | 133 Ų | 133 | 161.7 Ų | 161.7 | 71% | 0.711 | 80% | 0.801 | S | S | * | * | 19.9 | 115.3 | 114.6 | -178 | 34.8 | 0 | 0 | 0 | 118.7 | R93 | D91-R93 PolarHBondContact OD1-N 3.02Å; D91-R93 VanDerWaalsContact OD1-N 3.17Å | |||
| 92 | R | 37 | Very low | 37.8 | Very low | 228 Ų | 228 | 165.7 Ų | 165.7 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | -151.6 | 87.7 | 126.2 | -119.1 | 179.5 | -178.4 | -156.2 | 0.4 | 111.6 | Q94 | R92-Q94 PolarHBondContact O-N 3.04Å; R92-Q94 VanDerWaalsContact O-N 3.08Å | |||
| 93 | R | 33.8 | Very low | 37.5 | Very low | 227 Ų | 227 | 166.6 Ų | 166.6 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | trans | -69.4 | 102.6 | 175.1 | -75.9 | -176.6 | 176.5 | -97.3 | 2.9 | 111.8 | D91 | D91-R93 PolarHBondContact OD1-N 3.02Å; D91-R93 VanDerWaalsContact OD1-N 3.17Å | ||
| 94 | Q | 45.1 | Very low | 38.1 | Very low | 163 Ų | 163 | 163.6 Ų | 163.6 | 76% | 0.762 | 79% | 0.794 | S | S | * | * | trans | -103.2 | 92.9 | 160.9 | -72.1 | -61.5 | -26 | 0 | 0 | 109.7 | R92 | R92-Q94 PolarHBondContact O-N 3.04Å; R92-Q94 VanDerWaalsContact O-N 3.08Å | ||
| 95 | S | 47.6 | Very low | 38.7 | Very low | 90 Ų | 90 | 162.6 Ų | 162.6 | 63% | 0.629 | 79% | 0.793 | S | S | * | * | trans | -77.3 | 125.8 | -175.7 | 61 | 0 | 0 | 0 | 0 | 111.8 | R97 | S95-R97 PolarHBondContact O-N 3.33Š| ||
| 96 | W | 47.6 | Very low | 39.4 | Very low | 261 Ų | 261 | 164.1 Ų | 164.1 | 99% | 0.989 | 79% | 0.792 | S | S | * | * | trans | -68.8 | 80.9 | 170.3 | -76.1 | 68.1 | 0 | 0 | 0 | 110.8 | ||||
| 97 | R | 39.4 | Very low | 40.6 | Very low | 211 Ų | 211 | 168.7 Ų | 168.7 | 80% | 0.796 | 79% | 0.793 | S | S | * | * | trans | -110.7 | 104.5 | 175.3 | -79.7 | -78.6 | -170.8 | -116.6 | 7 | 108.7 | S95 S99 | S95-R97 PolarHBondContact O-N 3.33Å; R97-S99 PolarHBondContact O-N 3.43Å | ||
| 98 | R | 39.5 | Very low | 41.7 | Very low | 240 Ų | 240 | 174.3 Ų | 174.3 | 91% | 0.906 | 80% | 0.801 | S | S | * | * | trans | 10.2 | 107.7 | 158.4 | -64.8 | 174 | 176.7 | -95.6 | 0.2 | 114.9 | S100 | R98-S100 PolarHBondContact O-N 3.41Š| ||
| 99 | S | 40.3 | Very low | 43.2 | Very low | 122 Ų | 122 | 174 Ų | 174 | 85% | 0.853 | 80% | 0.798 | S | S | * | * | trans | -53 | 123.2 | 168.8 | 41.2 | 0 | 0 | 0 | 0 | 110.5 | R97 | R97-S99 PolarHBondContact O-N 3.43Š| ||
| 100 | S | 44.8 | Very low | 44.6 | Very low | 101 Ų | 101 | 171.3 Ų | 171.3 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | -68.6 | 137.4 | -175.6 | -174.7 | 0 | 0 | 0 | 0 | 111.3 | R98 K102 | R98-S100 PolarHBondContact O-N 3.41Å; S100-K102 PolarHBondContact O-N 3.32Å | ||
| 101 | M | 42.5 | Very low | 45.5 | Very low | 192 Ų | 192 | 171 Ų | 171 | 95% | 0.946 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -74.4 | 66.2 | 170.7 | -73.7 | -174.1 | 67.3 | 0 | 0 | 111.3 | ||
| 102 | K | 47.8 | Very low | 46.7 | Very low | 192 Ų | 192 | 170.5 Ų | 170.5 | 84% | 0.835 | 80% | 0.8 | S | S | * | * | trans | -140.1 | 59 | 168.2 | -79.2 | -161.1 | 173.9 | -174 | 0 | 111.2 | S100 | S100-K102 PolarHBondContact O-N 3.32Š| ||
| 103 | E | 38.9 | Very low | 47.8 | Very low | 131 Ų | 131 | 165 Ų | 165 | 61% | 0.612 | 79% | 0.786 | S | S | * | * | trans | -124.6 | 117 | 154.8 | -169 | 157.5 | -144.1 | 0 | 0 | 110 | N105 R106 | E103-N105 PolarHBondContact O-N 3.1Å; E103-R106 HydrophobicContact CG-CG 4.33Å; E103-R106 IonicContact OE1-CZ 3.36Å; E103-R106 IonicContact OE1-NE 3.21Å; E103-R106 PolarHBondContact OE1-NE 3.25Å; E103-R106 IonicContact OE1-NH2 3.69Å; E103-R106 PolarHBondContact OE1-NH2 3.11Å; E103-R106 IonicContact OE2-NE 2.71Å | ||
| 104 | T | 40.3 | Very low | 49.3 | Very low | 129 Ų | 129 | 159.1 Ų | 159.1 | 79% | 0.791 | 77% | 0.768 | S | S | * | * | trans | -76.5 | 117.8 | -170 | 45.8 | 0 | 0 | 0 | 0 | 111.7 | R106 | T104-R106 VanDerWaalsContact C-N 3.25Å; T104-R106 PolarHBondContact O-N 3.02Å | ||
| 105 | N | 43.6 | Very low | 50.4 | Low | 129 Ų | 129 | 158.5 Ų | 158.5 | 69% | 0.69 | 77% | 0.765 | S | S | * | * | trans | 50.5 | 37.1 | 153.7 | -149 | -21.4 | 0 | 0 | 0 | 115.4 | E103 R107 | E103-N105 PolarHBondContact O-N 3.1Å; N105-R107 PolarHBondContact O-N 3.45Å | ||
| 106 | R | 46.9 | Very low | 51.5 | Low | 198 Ų | 198 | 154.9 Ų | 154.9 | 75% | 0.747 | 74% | 0.742 | S | S | * | * | trans | -70.4 | 77.1 | 163.7 | -70.5 | -159.2 | -163 | -117.9 | 7.3 | 109.5 | E103 T104 | E103-R106 HydrophobicContact CG-CG 4.33Å; E103-R106 IonicContact OE1-CZ 3.36Å; E103-R106 IonicContact OE1-NE 3.21Å; E103-R106 PolarHBondContact OE1-NE 3.25Å; E103-R106 IonicContact OE1-NH2 3.69Å; E103-R106 PolarHBondContact OE1-NH2 3.11Å; E103-R106 IonicContact OE2-NE 2.71Å; T104-R106 VanDerWaalsContact C-N 3.25Å; T104-R106 PolarHBondContact O-N 3.02Å | ||
| 107 | R | 52.8 | Low | 53 | Low | 201 Ų | 201 | 146.6 Ų | 146.6 | 76% | 0.758 | 72% | 0.716 | S | S | * | * | trans | -45.9 | 146.2 | 150.4 | -58.4 | -179.6 | -178 | -167.9 | -2.6 | 107.3 | N105 S109 | N105-R107 PolarHBondContact O-N 3.45Å; R107-S109 PolarHBondContact O-N 3.35Å | ||
| 108 | K | 54.8 | Low | 54.9 | Low | 209 Ų | 209 | 139.1 Ų | 139.1 | 91% | 0.909 | 69% | 0.694 | S | S | * | * | trans | -63.7 | 89.6 | 169.4 | -67.7 | -179.6 | -178.7 | 178.4 | 0 | 107.7 | L110 | K108-L110 PolarHBondContact O-N 3.18Š| ||
| 109 | S | 59.7 | Low | 57 | Low | 105 Ų | 105 | 132.5 Ų | 132.5 | 73% | 0.734 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -60 | 124.5 | 178.1 | 51.6 | 0 | 0 | 0 | 0 | 107.6 | R107 H111 | R107-S109 PolarHBondContact O-N 3.35Å; S109-H111 PolarHBondContact O-N 3.32Å |
| 110 | L | 60.3 | Low | 59.1 | Low | 155 Ų | 155 | 127.7 Ų | 127.7 | 81% | 0.812 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 143.2 | 168.8 | -59.3 | 175.3 | 0 | 0 | 0 | 108.3 | K108 | K108-L110 PolarHBondContact O-N 3.18Š|
| 111 | H | 57.5 | Low | 61 | Low | 175 Ų | 175 | 125.9 Ų | 125.9 | 81% | 0.81 | 63% | 0.625 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 138.3 | 177.4 | -76.9 | -87.3 | 0 | 0 | 0 | 109.5 | S109 I113 | S109-H111 PolarHBondContact O-N 3.32Å; H111-I113 PolarHBondContact O-N 3.39Å |
| 112 | P | 61 | Low | 63.1 | Low | 122 Ų | 122 | 126 Ų | 126 | 79% | 0.792 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 118.5 | -179.7 | -29 | 35.4 | 0 | 0 | 0 | 110.2 | H114 | P112-H114 PolarHBondContact O-N 3.25Å; P112-H114 VanDerWaalsContact O-N 3.08Å |
| 113 | I | 60.3 | Low | 64.8 | Low | 111 Ų | 111 | 121.1 Ų | 121.1 | 57% | 0.569 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 120.3 | -175.7 | -58.3 | 173.2 | 0 | 0 | 0 | 106.9 | H111 Q115 I117 T118 | H111-I113 PolarHBondContact O-N 3.39Å; I113-Q115 PolarHBondContact O-N 3.33Å; I113-I117 HydrophobicContact CG2-CG2 3.5Å; I113-T118 HydrophobicContact CB-CG2 4.42Å; I113-T118 HydrophobicContact CG2-CG2 3.75Å |
| 114 | H | 63.8 | Low | 67.1 | Low | 105 Ų | 105 | 115.7 Ų | 115.7 | 49% | 0.486 | 58% | 0.58 | S | S | . | * | trans | -53.5 | 115.7 | -174.7 | 171.2 | -60.6 | 0 | 0 | 0 | 109 | P112 G116 I117 K148 | P112-H114 PolarHBondContact O-N 3.25Å; P112-H114 VanDerWaalsContact O-N 3.08Å; H114-G116 VanDerWaalsContact C-N 3.26Å; H114-G116 PolarHBondContact ND1-N 3.26Å; H114-G116 PolarHBondContact O-N 2.92Å; H114-I117 VanDerWaalsContact O-CG2 3.32Å; H114-I117 WeakPolarHBondContact O-CG2 3.49Å; H114-I117 PolarHBondContact O-N 2.94Å; H114-K148 PolarHBondContact NE2-NZ 2.92Å | ||
| 115 | Q | 69.5 | Low | 69.2 | Low | 150 Ų | 150 | 111.9 Ų | 111.9 | 70% | 0.701 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -48.7 | -44.9 | -165.7 | -69.9 | 169.8 | -25.2 | 0 | 0 | 113.4 | I113 I117 T118 E119 | I113-Q115 PolarHBondContact O-N 3.33Å; Q115-I117 PolarHBondContact O-N 3.3Å; Q115-T118 PolarHBondContact O-N 3.18Å; Q115-T118 PolarHBondContact O-OG1 3.39Å; Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 3.37Å |
| 116 | G | 71.1 | Confident | 71 | Confident | 13 Ų | 13 | 110.9 Ų | 110.9 | 13% | 0.134 | 56% | 0.557 | C | S | . | * | H | α-helix | trans | -59.4 | -11.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 117.6 | H114 E119 F144 | H114-G116 VanDerWaalsContact C-N 3.26Å; H114-G116 PolarHBondContact ND1-N 3.26Å; H114-G116 PolarHBondContact O-N 2.92Å; G116-E119 WeakPolarHBondContact CA-OE2 3.36Å; G116-F144 WeakPolarHBondContact O-CE2 3.49Å |
| 117 | I | 77.7 | Confident | 72.9 | Confident | 87 Ų | 87 | 108.4 Ų | 108.4 | 45% | 0.446 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -93.5 | -30.1 | 173 | -143.4 | 173.9 | 0 | 0 | 0 | 111.7 | I113 H114 Q115 E119 L120 F144 | I113-I117 HydrophobicContact CG2-CG2 3.5Å; H114-I117 VanDerWaalsContact O-CG2 3.32Å; H114-I117 WeakPolarHBondContact O-CG2 3.49Å; H114-I117 PolarHBondContact O-N 2.94Å; Q115-I117 PolarHBondContact O-N 3.3Å; I117-E119 VanDerWaalsContact C-N 3.3Å; I117-L120 HydrophobicContact CG1-CD1 4.02Å; I117-F144 HydrophobicContact CD1-CE1 4.43Å; I117-F144 HydrophobicContact CG1-CE1 4.15Å |
| 118 | T | 79 | Confident | 74.3 | Confident | 55 Ų | 55 | 102 Ų | 102 | 34% | 0.337 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -75.8 | -19.4 | 167.4 | 39.5 | 0 | 0 | 0 | 0 | 113.1 | I113 Q115 S121 | I113-T118 HydrophobicContact CB-CG2 4.42Å; I113-T118 HydrophobicContact CG2-CG2 3.75Å; Q115-T118 PolarHBondContact O-N 3.18Å; Q115-T118 PolarHBondContact O-OG1 3.39Å; T118-S121 PolarHBondContact O-OG 3.33Å |
| 119 | E | 83.8 | Confident | 75.8 | Confident | 100 Ų | 100 | 94.5 Ų | 94.5 | 47% | 0.467 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -70.1 | -34.6 | 172.7 | -76.4 | 156.1 | -155.4 | 0 | 0 | 111.5 | Q115 G116 I117 S121 R122 S123 | Q115-E119 WeakPolarHBondContact O-CG 3.44Å; Q115-E119 PolarHBondContact O-N 3.37Å; G116-E119 WeakPolarHBondContact CA-OE2 3.36Å; I117-E119 VanDerWaalsContact C-N 3.3Å; E119-S121 VanDerWaalsContact C-N 3.34Å; E119-S121 PolarHBondContact O-N 3.11Å; E119-R122 CarbonylContact O-C 3.6Å; E119-R122 WeakPolarHBondContact O-CA 3.34Å; E119-R122 WeakPolarHBondContact O-CB 3.02Å; E119-R122 PolarHBondContact O-N 2.97Å; E119-S123 PolarHBondContact O-N 2.83Å; E119-S123 PolarHBondContact O-OG 2.93Å; E119-S123 VanDerWaalsContact O-OG 3.11Å |
| 120 | L | 85.9 | Confident | 77 | Confident | 21 Ų | 21 | 94.2 Ų | 94.2 | 11% | 0.11 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -57.3 | -42.8 | 178.2 | -56.7 | 176.5 | 0 | 0 | 0 | 113 | I117 R122 S123 I124 L137 F144 | I117-L120 HydrophobicContact CG1-CD1 4.02Å; L120-R122 VanDerWaalsContact C-N 3.28Å; L120-R122 PolarHBondContact O-N 3.48Å; L120-S123 WeakPolarHBondContact CA-OG 3.35Å; L120-S123 PolarHBondContact O-OG 3.42Å; L120-I124 VanDerWaalsContact O-CD1 3.29Å; L120-I124 WeakPolarHBondContact O-CD1 3.16Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; L120-L137 HydrophobicContact CB-CD1 4.16Å; L120-F144 HydrophobicContact CD1-CB 3.8Å; L120-F144 HydrophobicContact CD1-CD1 4.01Å; L120-F144 HydrophobicContact CD1-CD2 4.24Å; L120-F144 HydrophobicContact CD1-CG 3.78Å; L120-F144 HydrophobicContact CD2-CB 3.92Å; L120-F144 HydrophobicContact CD2-CD2 3.97Å; L120-F144 HydrophobicContact CD2-CG 4.13Å; L120-F144 HydrophobicContact CG-CB 4.5Å; L120-F144 HydrophobicContact CG-CD2 4.45Å; L120-F144 HydrophobicContact CG-CG 4.44Å |
| 121 | S | 83.4 | Confident | 78.2 | Confident | 64 Ų | 64 | 87.2 Ų | 87.2 | 45% | 0.448 | 47% | 0.467 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.3 | -11.3 | 177.5 | 59.1 | 0 | 0 | 0 | 0 | 113.7 | T118 E119 | T118-S121 PolarHBondContact O-OG 3.33Å; E119-S121 VanDerWaalsContact C-N 3.34Å; E119-S121 PolarHBondContact O-N 3.11Å |
| 122 | R | 85.9 | Confident | 79.5 | Confident | 195 Ų | 195 | 83 Ų | 83 | 74% | 0.736 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.4 | -28 | 176 | -170.6 | -174.4 | -64 | 170.9 | 0.6 | 112.8 | E119 L120 I124 | E119-R122 CarbonylContact O-C 3.6Å; E119-R122 WeakPolarHBondContact O-CA 3.34Å; E119-R122 WeakPolarHBondContact O-CB 3.02Å; E119-R122 PolarHBondContact O-N 2.97Å; L120-R122 VanDerWaalsContact C-N 3.28Å; L120-R122 PolarHBondContact O-N 3.48Å; R122-I124 PolarHBondContact O-N 2.85Å |
| 123 | S | 84.1 | Confident | 80.9 | Confident | 89 Ų | 89 | 80.6 Ų | 80.6 | 62% | 0.622 | 42% | 0.422 | S | S | * | . | S | Bend | trans | -74.5 | -9.9 | 177.1 | 49.4 | 0 | 0 | 0 | 0 | 114 | E119 L120 | E119-S123 PolarHBondContact O-N 2.83Å; E119-S123 PolarHBondContact O-OG 2.93Å; E119-S123 VanDerWaalsContact O-OG 3.11Å; L120-S123 WeakPolarHBondContact CA-OG 3.35Å; L120-S123 PolarHBondContact O-OG 3.42Å |
| 124 | I | 87.9 | Confident | 82.4 | Confident | 17 Ų | 17 | 77.3 Ų | 77.3 | 9% | 0.087 | 41% | 0.405 | C | S | . | . | S | Bend | trans | -90.2 | 131.4 | 177.1 | -61.7 | 162.4 | 0 | 0 | 0 | 108.4 | L120 R122 R133 C136 L137 | L120-I124 VanDerWaalsContact O-CD1 3.29Å; L120-I124 WeakPolarHBondContact O-CD1 3.16Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; R122-I124 PolarHBondContact O-N 2.85Å; I124-R133 HydrophobicContact CG2-CB 4.08Å; I124-R133 HydrophobicContact CG2-CG 3.97Å; I124-C136 HydrophobicContact CD1-CB 4.05Å; I124-C136 HydrophobicContact CG1-CB 4.08Å; I124-C136 HydrophobicContact CG2-CB 3.89Å; I124-L137 VanDerWaalsContact CD1-CA 3.48Å; I124-L137 HydrophobicContact CD1-CB 3.65Å; I124-L137 HydrophobicContact CD1-CD1 3.94Å; I124-L137 HydrophobicContact CD1-CG 4.4Å |
| 125 | S | 83.1 | Confident | 83.6 | Confident | 49 Ų | 49 | 72.8 Ų | 72.8 | 34% | 0.343 | 39% | 0.387 | S | S | . | . | trans | -55.2 | 142.9 | 178.3 | 157.8 | 0 | 0 | 0 | 0 | 111.7 | D127 R133 | S125-D127 VanDerWaalsContact C-N 3.33Å; S125-D127 WeakPolarHBondContact OG-CB 3.37Å; S125-D127 PolarHBondContact OG-N 3.38Å; S125-D127 PolarHBondContact OG-OD2 2.83Å; S125-R133 VanDerWaalsContact O-CD 3.3Å; S125-R133 WeakPolarHBondContact O-CD 3.23Å; S125-R133 WeakPolarHBondContact O-CG 3.35Å; S125-R133 PolarHBondContact O-NE 2.93Å | ||
| 126 | V | 83.3 | Confident | 84.6 | Confident | 108 Ų | 108 | 68 Ų | 68 | 66% | 0.655 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -85 | -9.2 | 174.1 | -65.9 | 0 | 0 | 0 | 0 | 112.9 | L128 | V126-L128 VanDerWaalsContact C-N 3.3Š|
| 127 | D | 85.1 | Confident | 85.5 | Confident | 145 Ų | 145 | 69.9 Ų | 69.9 | 78% | 0.775 | 38% | 0.376 | S | S | * | . | S | Bend | trans | -86.2 | -5.3 | -176.8 | -37.1 | -73.2 | 0 | 0 | 0 | 112.3 | S125 | S125-D127 VanDerWaalsContact C-N 3.33Å; S125-D127 WeakPolarHBondContact OG-CB 3.37Å; S125-D127 PolarHBondContact OG-N 3.38Å; S125-D127 PolarHBondContact OG-OD2 2.83Å |
| 128 | L | 83.6 | Confident | 86.2 | Confident | 68 Ų | 68 | 69.5 Ų | 69.5 | 36% | 0.356 | 37% | 0.374 | S | S | . | . | S | Bend | trans | -91.7 | 148.9 | 174.5 | -66.1 | 173.5 | 0 | 0 | 0 | 110.7 | V126 K132 R133 | V126-L128 VanDerWaalsContact C-N 3.3Å; L128-K132 HydrophobicContact CB-CB 4.16Å; L128-K132 HydrophobicContact CD2-CD 4.35Å; L128-R133 HydrophobicContact CB-CG 3.71Å; L128-R133 WeakPolarHBondContact O-CD 3.47Å; L128-R133 WeakPolarHBondContact O-CG 3.42Å |
| 129 | A | 85.5 | Confident | 86.7 | Confident | 51 Ų | 51 | 68.3 Ų | 68.3 | 42% | 0.421 | 37% | 0.366 | S | S | . | . | trans | -60 | 149.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S131 K132 R133 | A129-S131 VanDerWaalsContact C-N 3.26Å; A129-S131 PolarHBondContact O-N 3.48Å; A129-S131 VanDerWaalsContact O-N 3.16Å; A129-K132 WeakPolarHBondContact O-CA 3.27Å; A129-K132 WeakPolarHBondContact O-CB 3.37Å; A129-K132 PolarHBondContact O-N 3.29Å; A129-R133 WeakPolarHBondContact O-CG 3.42Å; A129-R133 PolarHBondContact O-N 2.87Å | ||
| 130 | E | 85.1 | Confident | 87.1 | Confident | 99 Ų | 99 | 65 Ų | 65 | 46% | 0.463 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -52.5 | -39.3 | -177 | -81.7 | 56.5 | -133.1 | 0 | 0 | 113.9 | R133 L134 F192 | E130-R133 PolarHBondContact O-N 2.75Å; E130-R133 IonicContact OE1-NH1 3.59Å; E130-R133 PolarHBondContact OE1-NH1 3.14Å; E130-L134 WeakPolarHBondContact O-CB 3.48Å; E130-L134 PolarHBondContact O-N 2.94Å; E130-F192 HydrophobicContact CB-CD1 3.89Å; E130-F192 HydrophobicContact CB-CD2 4.25Å; E130-F192 HydrophobicContact CB-CE1 3.71Å; E130-F192 HydrophobicContact CB-CE2 4.09Å; E130-F192 HydrophobicContact CB-CG 4.16Å; E130-F192 HydrophobicContact CB-CZ 3.82Å; E130-F192 HydrophobicContact CG-CD1 4.35Å; E130-F192 HydrophobicContact CG-CE1 4.19Å; E130-F192 WeakPolarHBondContact O-CZ 3.36Å |
| 131 | S | 84.7 | Confident | 87.3 | Confident | 8 Ų | 8 | 66.2 Ų | 66.2 | 6% | 0.056 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.5 | -43.7 | 175 | 37.6 | 0 | 0 | 0 | 0 | 112.6 | A129 L134 G135 Q189 | A129-S131 VanDerWaalsContact C-N 3.26Å; A129-S131 PolarHBondContact O-N 3.48Å; A129-S131 VanDerWaalsContact O-N 3.16Å; S131-L134 PolarHBondContact O-N 3.48Å; S131-G135 PolarHBondContact O-N 2.81Å; S131-Q189 PolarHBondContact OG-OE1 3.07Å |
| 132 | K | 86.4 | Confident | 87.6 | Confident | 87 Ų | 87 | 65.7 Ų | 65.7 | 38% | 0.378 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61 | -44.2 | 170.8 | -70 | -170.2 | 174 | -170.3 | 0 | 111.8 | L128 A129 L134 G135 C136 E183 | L128-K132 HydrophobicContact CB-CB 4.16Å; L128-K132 HydrophobicContact CD2-CD 4.35Å; A129-K132 WeakPolarHBondContact O-CA 3.27Å; A129-K132 WeakPolarHBondContact O-CB 3.37Å; A129-K132 PolarHBondContact O-N 3.29Å; K132-L134 VanDerWaalsContact C-N 3.27Å; K132-L134 PolarHBondContact O-N 3.19Å; K132-G135 PolarHBondContact O-N 2.84Å; K132-G135 VanDerWaalsContact O-N 3.16Å; K132-C136 PolarHBondContact O-N 2.89Å; K132-C136 PolarHBondContact O-SG 3.48Å; K132-E183 WeakPolarHBondContact CE-OE1 3.28Å; K132-E183 WeakPolarHBondContact CE-OE2 3.43Å; K132-E183 HydrophobicContact CG-CG 4.43Å; K132-E183 WeakPolarHBondContact CG-OE2 3.3Å; K132-E183 IonicContact NZ-OE1 3.68Å |
| 133 | R | 90.3 | Very high | 87.9 | Confident | 70 Ų | 70 | 60.2 Ų | 60.2 | 26% | 0.264 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -63.1 | -34.5 | 178.6 | -66.8 | 173.2 | 61.3 | -145.1 | 0.9 | 111.6 | I124 S125 L128 A129 E130 L137 | I124-R133 HydrophobicContact CG2-CB 4.08Å; I124-R133 HydrophobicContact CG2-CG 3.97Å; S125-R133 VanDerWaalsContact O-CD 3.3Å; S125-R133 WeakPolarHBondContact O-CD 3.23Å; S125-R133 WeakPolarHBondContact O-CG 3.35Å; S125-R133 PolarHBondContact O-NE 2.93Å; L128-R133 HydrophobicContact CB-CG 3.71Å; L128-R133 WeakPolarHBondContact O-CD 3.47Å; L128-R133 WeakPolarHBondContact O-CG 3.42Å; A129-R133 WeakPolarHBondContact O-CG 3.42Å; A129-R133 PolarHBondContact O-N 2.87Å; E130-R133 PolarHBondContact O-N 2.75Å; E130-R133 IonicContact OE1-NH1 3.59Å; E130-R133 PolarHBondContact OE1-NH1 3.14Å; R133-L137 VanDerWaalsContact O-CB 3.29Å; R133-L137 WeakPolarHBondContact O-CB 3.23Å; R133-L137 PolarHBondContact O-N 3.49Å |
| 134 | L | 90.2 | Very high | 88.1 | Confident | 43 Ų | 43 | 57.9 Ų | 57.9 | 23% | 0.225 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -68.4 | -43.8 | 171.8 | -176.1 | 58.4 | 0 | 0 | 0 | 112.2 | E130 S131 K132 L137 L138 L188 C191 F192 | E130-L134 WeakPolarHBondContact O-CB 3.48Å; E130-L134 PolarHBondContact O-N 2.94Å; S131-L134 PolarHBondContact O-N 3.48Å; K132-L134 VanDerWaalsContact C-N 3.27Å; K132-L134 PolarHBondContact O-N 3.19Å; L134-L137 PolarHBondContact O-N 3.34Å; L134-L137 VanDerWaalsContact O-N 3.13Å; L134-L138 WeakPolarHBondContact O-CG 3.16Å; L134-L138 PolarHBondContact O-N 3.46Å; L134-L188 HydrophobicContact CD2-CD2 3.89Å; L134-L188 HydrophobicContact CG-CD2 4.06Å; L134-C191 HydrophobicContact CD2-CB 3.91Å; L134-F192 HydrophobicContact CB-CE2 4.01Å; L134-F192 HydrophobicContact CB-CZ 3.99Å; L134-F192 HydrophobicContact CD2-CE2 3.72Å; L134-F192 HydrophobicContact CD2-CZ 3.99Å |
| 135 | G | 89.7 | Confident | 88.2 | Confident | 10 Ų | 10 | 59.8 Ų | 59.8 | 10% | 0.103 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -57.7 | -48.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | S131 K132 L137 L138 L139 | S131-G135 PolarHBondContact O-N 2.81Å; K132-G135 PolarHBondContact O-N 2.84Å; K132-G135 VanDerWaalsContact O-N 3.16Å; G135-L137 VanDerWaalsContact C-N 3.31Å; G135-L137 PolarHBondContact O-N 2.89Å; G135-L138 PolarHBondContact O-N 3.47Å; G135-L139 PolarHBondContact O-N 3Å; G135-L139 VanDerWaalsContact O-N 3.17Å |
| 136 | C | 89.9 | Confident | 88.5 | Confident | 48 Ų | 48 | 59 Ų | 59 | 32% | 0.324 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.2 | -40.2 | 172.5 | -62.9 | 0 | 0 | 0 | 0 | 112.2 | I124 K132 L139 S140 | I124-C136 HydrophobicContact CD1-CB 4.05Å; I124-C136 HydrophobicContact CG1-CB 4.08Å; I124-C136 HydrophobicContact CG2-CB 3.89Å; K132-C136 PolarHBondContact O-N 2.89Å; K132-C136 PolarHBondContact O-SG 3.48Å; C136-L139 PolarHBondContact O-N 3.15Å; C136-S140 WeakPolarHBondContact O-CB 3.35Å; C136-S140 PolarHBondContact O-N 3.37Å; C136-S140 PolarHBondContact O-OG 2.88Å; C136-S140 VanDerWaalsContact O-OG 3.12Å |
| 137 | L | 91.8 | Very high | 88.7 | Confident | 53 Ų | 53 | 60.3 Ų | 60.3 | 28% | 0.277 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -66.9 | -37.1 | 179.6 | -176.3 | 60.8 | 0 | 0 | 0 | 112.7 | L120 I124 R133 L134 G135 S141 | L120-L137 HydrophobicContact CB-CD1 4.16Å; I124-L137 VanDerWaalsContact CD1-CA 3.48Å; I124-L137 HydrophobicContact CD1-CB 3.65Å; I124-L137 HydrophobicContact CD1-CD1 3.94Å; I124-L137 HydrophobicContact CD1-CG 4.4Å; R133-L137 VanDerWaalsContact O-CB 3.29Å; R133-L137 WeakPolarHBondContact O-CB 3.23Å; R133-L137 PolarHBondContact O-N 3.49Å; L134-L137 PolarHBondContact O-N 3.34Å; L134-L137 VanDerWaalsContact O-N 3.13Å; G135-L137 VanDerWaalsContact C-N 3.31Å; G135-L137 PolarHBondContact O-N 2.89Å; L137-S141 WeakPolarHBondContact O-CB 3.32Å; L137-S141 PolarHBondContact O-N 2.88Å; L137-S141 PolarHBondContact O-OG 2.93Å |
| 138 | L | 91.4 | Very high | 88.9 | Confident | 79 Ų | 79 | 58 Ų | 58 | 41% | 0.414 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.8 | -47.4 | 172.8 | -69.2 | 169.3 | 0 | 0 | 0 | 110.7 | L134 G135 S141 F142 L188 | L134-L138 WeakPolarHBondContact O-CG 3.16Å; L134-L138 PolarHBondContact O-N 3.46Å; G135-L138 PolarHBondContact O-N 3.47Å; L138-S141 PolarHBondContact O-N 3.48Å; L138-F142 PolarHBondContact O-N 3.16Å; L138-L188 HydrophobicContact CD1-CD2 4.1Å |
| 139 | L | 90.6 | Very high | 89 | Confident | 31 Ų | 31 | 58.4 Ų | 58.4 | 16% | 0.162 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -63.6 | -47.2 | 178.3 | -174.5 | 62.2 | 0 | 0 | 0 | 112.3 | G135 C136 S141 F142 Q143 S172 L175 K176 | G135-L139 PolarHBondContact O-N 3Å; G135-L139 VanDerWaalsContact O-N 3.17Å; C136-L139 PolarHBondContact O-N 3.15Å; L139-S141 VanDerWaalsContact C-N 3.33Å; L139-S141 PolarHBondContact O-N 2.99Å; L139-F142 PolarHBondContact O-N 3.4Å; L139-Q143 WeakPolarHBondContact O-CG 3.41Å; L139-Q143 PolarHBondContact O-N 2.9Å; L139-S172 WeakPolarHBondContact CD1-O 3.43Å; L139-S172 WeakPolarHBondContact CD1-OG 3.35Å; L139-L175 HydrophobicContact CD1-CD2 4.31Å; L139-L175 HydrophobicContact CD1-CG 4.46Å; L139-K176 HydrophobicContact CD1-CB 4.17Å; L139-K176 HydrophobicContact CD2-CB 4.03Å; L139-K176 HydrophobicContact CD2-CD 4.27Å; L139-K176 HydrophobicContact CD2-CG 4.2Å |
| 140 | S | 90.4 | Very high | 89 | Confident | 29 Ų | 29 | 57.1 Ų | 57.1 | 20% | 0.203 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64 | -36.2 | 176.3 | -62 | 0 | 0 | 0 | 0 | 112.4 | C136 F144 | C136-S140 WeakPolarHBondContact O-CB 3.35Å; C136-S140 PolarHBondContact O-N 3.37Å; C136-S140 PolarHBondContact O-OG 2.88Å; C136-S140 VanDerWaalsContact O-OG 3.12Å; S140-F144 VanDerWaalsContact O-CB 3.27Å; S140-F144 WeakPolarHBondContact O-CB 3.3Å; S140-F144 PolarHBondContact O-N 2.77Å |
| 141 | S | 90.7 | Very high | 88.9 | Confident | 48 Ų | 48 | 55.6 Ų | 55.6 | 34% | 0.336 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67.9 | -39.6 | 175.2 | -60.2 | 0 | 0 | 0 | 0 | 112 | L137 L138 L139 F144 S145 | L137-S141 WeakPolarHBondContact O-CB 3.32Å; L137-S141 PolarHBondContact O-N 2.88Å; L137-S141 PolarHBondContact O-OG 2.93Å; L138-S141 PolarHBondContact O-N 3.48Å; L139-S141 VanDerWaalsContact C-N 3.33Å; L139-S141 PolarHBondContact O-N 2.99Å; S141-F144 PolarHBondContact O-N 2.88Å; S141-S145 WeakPolarHBondContact O-CB 3.32Å; S141-S145 PolarHBondContact O-N 2.95Å |
| 142 | F | 90.8 | Very high | 88.9 | Confident | 53 Ų | 53 | 62.7 Ų | 62.7 | 23% | 0.232 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.1 | -52.6 | 173.1 | 179.7 | -107.3 | 0 | 0 | 0 | 110.8 | L138 L139 F144 S145 I146 L171 L175 | L138-F142 PolarHBondContact O-N 3.16Å; L139-F142 PolarHBondContact O-N 3.4Å; F142-F144 VanDerWaalsContact C-N 3.33Å; F142-F144 PolarHBondContact O-N 3.49Å; F142-S145 PolarHBondContact O-N 2.76Å; F142-S145 PolarHBondContact O-OG 2.92Å; F142-I146 HydrophobicContact CD1-CG1 4.47Å; F142-I146 HydrophobicContact CE1-CG1 4.12Å; F142-I146 HydrophobicContact CE2-CD1 4.36Å; F142-I146 HydrophobicContact CE2-CG1 4.41Å; F142-I146 HydrophobicContact CZ-CD1 4.12Å; F142-I146 HydrophobicContact CZ-CG1 4.1Å; F142-I146 WeakPolarHBondContact O-CG1 3.39Å; F142-I146 PolarHBondContact O-N 3.28Å; F142-L171 HydrophobicContact CE1-CB 4.24Å; F142-L171 HydrophobicContact CZ-CB 3.9Å; F142-L175 HydrophobicContact CB-CD2 3.4Å; F142-L175 VanDerWaalsContact CB-CD2 3.4Å; F142-L175 HydrophobicContact CD1-CD2 3.8Å; F142-L175 HydrophobicContact CD2-CD2 4.11Å; F142-L175 HydrophobicContact CG-CD2 3.5Å |
| 143 | Q | 90.6 | Very high | 88.5 | Confident | 79 Ų | 79 | 60.7 Ų | 60.7 | 37% | 0.369 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -59.5 | -40.6 | 178.5 | -69.5 | 178.1 | -2.2 | 0 | 0 | 112.6 | L139 I146 Q147 S172 | L139-Q143 WeakPolarHBondContact O-CG 3.41Å; L139-Q143 PolarHBondContact O-N 2.9Å; Q143-I146 PolarHBondContact O-N 3.08Å; Q143-Q147 WeakPolarHBondContact O-CG 3.2Å; Q143-Q147 PolarHBondContact O-N 2.83Å; Q143-S172 PolarHBondContact NE2-OG 3.32Å |
| 144 | F | 90 | Very high | 87.8 | Confident | 40 Ų | 40 | 64.8 Ų | 64.8 | 18% | 0.175 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -62.3 | -40.5 | 173 | -179.2 | -99.1 | 0 | 0 | 0 | 112.4 | G116 I117 L120 S140 S141 F142 Q147 K148 | G116-F144 WeakPolarHBondContact O-CE2 3.49Å; I117-F144 HydrophobicContact CD1-CE1 4.43Å; I117-F144 HydrophobicContact CG1-CE1 4.15Å; L120-F144 HydrophobicContact CD1-CB 3.8Å; L120-F144 HydrophobicContact CD1-CD1 4.01Å; L120-F144 HydrophobicContact CD1-CD2 4.24Å; L120-F144 HydrophobicContact CD1-CG 3.78Å; L120-F144 HydrophobicContact CD2-CB 3.92Å; L120-F144 HydrophobicContact CD2-CD2 3.97Å; L120-F144 HydrophobicContact CD2-CG 4.13Å; L120-F144 HydrophobicContact CG-CB 4.5Å; L120-F144 HydrophobicContact CG-CD2 4.45Å; L120-F144 HydrophobicContact CG-CG 4.44Å; S140-F144 VanDerWaalsContact O-CB 3.27Å; S140-F144 WeakPolarHBondContact O-CB 3.3Å; S140-F144 PolarHBondContact O-N 2.77Å; S141-F144 PolarHBondContact O-N 2.88Å; F142-F144 VanDerWaalsContact C-N 3.33Å; F142-F144 PolarHBondContact O-N 3.49Å; F144-Q147 PolarHBondContact O-N 3.45Å; F144-K148 HydrophobicContact CD1-CG 4.17Å; F144-K148 HydrophobicContact CE1-CG 3.9Å; F144-K148 HydrophobicContact CE2-CG 4.48Å; F144-K148 HydrophobicContact CZ-CD 4.39Å; F144-K148 VanDerWaalsContact CZ-CE 3.4Å; F144-K148 HydrophobicContact CZ-CG 4.08Å; F144-K148 WeakPolarHBondContact O-CB 3.03Å; F144-K148 WeakPolarHBondContact O-CG 3.49Å; F144-K148 PolarHBondContact O-N 3.25Å |
| 145 | S | 89.5 | Confident | 86.9 | Confident | 58 Ų | 58 | 69.9 Ų | 69.9 | 41% | 0.406 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -66.3 | -39 | 177 | 74.3 | 0 | 0 | 0 | 0 | 112.4 | S141 F142 K148 L149 | S141-S145 WeakPolarHBondContact O-CB 3.32Å; S141-S145 PolarHBondContact O-N 2.95Å; F142-S145 PolarHBondContact O-N 2.76Å; F142-S145 PolarHBondContact O-OG 2.92Å; S145-K148 PolarHBondContact O-N 2.99Å; S145-L149 VanDerWaalsContact O-CB 3.3Å; S145-L149 WeakPolarHBondContact O-CB 3.43Å; S145-L149 PolarHBondContact O-N 3.46Å |
| 146 | I | 89.2 | Confident | 86.3 | Confident | 33 Ų | 33 | 71.9 Ų | 71.9 | 17% | 0.169 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -61.1 | -46.8 | 171.4 | -65.5 | -61.5 | 0 | 0 | 0 | 111 | F142 Q143 K148 L149 E150 F164 A168 | F142-I146 HydrophobicContact CD1-CG1 4.47Å; F142-I146 HydrophobicContact CE1-CG1 4.12Å; F142-I146 HydrophobicContact CE2-CD1 4.36Å; F142-I146 HydrophobicContact CE2-CG1 4.41Å; F142-I146 HydrophobicContact CZ-CD1 4.12Å; F142-I146 HydrophobicContact CZ-CG1 4.1Å; F142-I146 WeakPolarHBondContact O-CG1 3.39Å; F142-I146 PolarHBondContact O-N 3.28Å; Q143-I146 PolarHBondContact O-N 3.08Å; I146-K148 VanDerWaalsContact C-N 3.3Å; I146-K148 PolarHBondContact O-N 3.47Å; I146-L149 PolarHBondContact O-N 3.36Å; I146-L149 VanDerWaalsContact O-N 3.15Å; I146-E150 PolarHBondContact O-N 2.92Å; I146-F164 HydrophobicContact CD1-CZ 4.15Å; I146-F164 HydrophobicContact CG2-CE1 4Å; I146-F164 HydrophobicContact CG2-CZ 4.06Å; I146-A168 HydrophobicContact CD1-CB 4.09Å; I146-A168 HydrophobicContact CG1-CB 4.22Å; I146-A168 HydrophobicContact CG2-CB 3.79Å |
| 147 | Q | 87.5 | Confident | 85 | Confident | 135 Ų | 135 | 80 Ų | 80 | 63% | 0.631 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -64.6 | -32.1 | 177.5 | -72.1 | 175.5 | 13.6 | 0 | 0 | 113.1 | Q143 F144 P151 | Q143-Q147 WeakPolarHBondContact O-CG 3.2Å; Q143-Q147 PolarHBondContact O-N 2.83Å; F144-Q147 PolarHBondContact O-N 3.45Å; Q147-P151 WeakPolarHBondContact O-CD 3.3Å |
| 148 | K | 88.3 | Confident | 84 | Confident | 95 Ų | 95 | 81.3 Ų | 81.3 | 41% | 0.413 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -75.7 | -27.9 | 172.9 | -74.1 | -66.1 | -166.7 | 175.4 | 0 | 113 | H114 F144 S145 I146 F152 | H114-K148 PolarHBondContact NE2-NZ 2.92Å; F144-K148 HydrophobicContact CD1-CG 4.17Å; F144-K148 HydrophobicContact CE1-CG 3.9Å; F144-K148 HydrophobicContact CE2-CG 4.48Å; F144-K148 HydrophobicContact CZ-CD 4.39Å; F144-K148 VanDerWaalsContact CZ-CE 3.4Å; F144-K148 HydrophobicContact CZ-CG 4.08Å; F144-K148 WeakPolarHBondContact O-CB 3.03Å; F144-K148 WeakPolarHBondContact O-CG 3.49Å; F144-K148 PolarHBondContact O-N 3.25Å; S145-K148 PolarHBondContact O-N 2.99Å; I146-K148 VanDerWaalsContact C-N 3.3Å; I146-K148 PolarHBondContact O-N 3.47Å; K148-F152 VanDerWaalsContact O-CD2 3.24Å; K148-F152 WeakPolarHBondContact O-CD2 3.41Å; K148-F152 VanDerWaalsContact O-CE2 3.24Å; K148-F152 WeakPolarHBondContact O-CE2 3.32Å |
| 149 | L | 86.1 | Confident | 83.3 | Confident | 78 Ų | 78 | 84.4 Ų | 84.4 | 41% | 0.408 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -83.1 | -37.2 | 179.1 | -177.4 | 60.4 | 0 | 0 | 0 | 112.9 | S145 I146 P151 F152 L153 F164 | S145-L149 VanDerWaalsContact O-CB 3.3Å; S145-L149 WeakPolarHBondContact O-CB 3.43Å; S145-L149 PolarHBondContact O-N 3.46Å; I146-L149 PolarHBondContact O-N 3.36Å; I146-L149 VanDerWaalsContact O-N 3.15Å; L149-P151 VanDerWaalsContact C-CD 3.41Å; L149-F152 PolarHBondContact O-N 3Å; L149-L153 HydrophobicContact CD1-CD1 4.42Å; L149-L153 HydrophobicContact CD1-CD2 4.45Å; L149-L153 HydrophobicContact CD1-CG 4.25Å; L149-L153 HydrophobicContact CD2-CD1 4.13Å; L149-L153 HydrophobicContact CG-CD1 3.85Å; L149-L153 HydrophobicContact CG-CG 4.12Å; L149-L153 PolarHBondContact O-N 3.37Å; L149-F164 HydrophobicContact CD2-CE2 4.37Å; L149-F164 HydrophobicContact CD2-CZ 4.32Å |
| 150 | E | 85.7 | Confident | 82.8 | Confident | 23 Ų | 23 | 86 Ų | 86 | 11% | 0.107 | 45% | 0.447 | C | S | . | . | G | 310 helix | trans | -49.3 | -44.2 | -175.5 | -166.6 | -165.2 | 103.8 | 0 | 0 | 114.1 | I146 F152 L153 R154 L161 F164 R165 | I146-E150 PolarHBondContact O-N 2.92Å; E150-F152 VanDerWaalsContact C-N 3.32Å; E150-F152 PolarHBondContact O-N 3.35Å; E150-L153 PolarHBondContact O-N 3.49Å; E150-R154 IonicContact OE1-CZ 3.27Å; E150-R154 IonicContact OE1-NE 3.29Å; E150-R154 IonicContact OE1-NH2 3.66Å; E150-R154 PolarHBondContact OE1-NH2 3.33Å; E150-L161 HydrophobicContact CG-CD1 3.94Å; E150-L161 HydrophobicContact CG-CG 4.48Å; E150-F164 HydrophobicContact CB-CE1 4.14Å; E150-F164 HydrophobicContact CG-CD1 4.45Å; E150-F164 HydrophobicContact CG-CE1 4.22Å; E150-R165 VanDerWaalsContact CD-NH2 3.25Å; E150-R165 IonicContact OE1-CZ 2.71Å; E150-R165 IonicContact OE1-NE 2.66Å; E150-R165 IonicContact OE1-NH2 3.16Å; E150-R165 PolarHBondContact OE1-NH2 3.44Å; E150-R165 IonicContact OE2-CZ 3.96Å; E150-R165 IonicContact OE2-NE 3.66Å; E150-R165 PolarHBondContact OE2-NE 3.36Å; E150-R165 IonicContact OE2-NH2 2.74Å; E150-R165 PolarHBondContact OE2-NH2 2.89Å |
| 151 | P | 84.3 | Confident | 82.4 | Confident | 67 Ų | 67 | 87.9 Ų | 87.9 | 44% | 0.435 | 45% | 0.454 | S | S | . | . | G | 310 helix | trans | -60.8 | -38.1 | -179.6 | -24.1 | 35.6 | 0 | 0 | 0 | 113.5 | Q147 L149 L153 R154 | Q147-P151 WeakPolarHBondContact O-CD 3.3Å; L149-P151 VanDerWaalsContact C-CD 3.41Å; P151-L153 VanDerWaalsContact C-N 3.27Å; P151-L153 PolarHBondContact O-N 2.93Å; P151-R154 PolarHBondContact O-N 3.4Å |
| 152 | F | 82.8 | Confident | 82.1 | Confident | 157 Ų | 157 | 93.4 Ų | 93.4 | 69% | 0.689 | 48% | 0.475 | S | S | * | . | G | 310 helix | trans | -74.5 | -16.7 | -177.9 | -59.8 | -72.8 | 0 | 0 | 0 | 113.4 | K148 L149 E150 | K148-F152 VanDerWaalsContact O-CD2 3.24Å; K148-F152 WeakPolarHBondContact O-CD2 3.41Å; K148-F152 VanDerWaalsContact O-CE2 3.24Å; K148-F152 WeakPolarHBondContact O-CE2 3.32Å; L149-F152 PolarHBondContact O-N 3Å; E150-F152 VanDerWaalsContact C-N 3.32Å; E150-F152 PolarHBondContact O-N 3.35Å |
| 153 | L | 79.3 | Confident | 81.8 | Confident | 45 Ų | 45 | 94 Ų | 94 | 24% | 0.236 | 49% | 0.485 | C | S | . | . | G | 310 helix | trans | -92.1 | -2.9 | 178.3 | -61.7 | -178.6 | 0 | 0 | 0 | 113.3 | L149 E150 P151 T156 F164 | L149-L153 HydrophobicContact CD1-CD1 4.42Å; L149-L153 HydrophobicContact CD1-CD2 4.45Å; L149-L153 HydrophobicContact CD1-CG 4.25Å; L149-L153 HydrophobicContact CD2-CD1 4.13Å; L149-L153 HydrophobicContact CG-CD1 3.85Å; L149-L153 HydrophobicContact CG-CG 4.12Å; L149-L153 PolarHBondContact O-N 3.37Å; E150-L153 PolarHBondContact O-N 3.49Å; P151-L153 VanDerWaalsContact C-N 3.27Å; P151-L153 PolarHBondContact O-N 2.93Å; L153-T156 PolarHBondContact O-OG1 3.05Å; L153-F164 HydrophobicContact CD1-CD2 3.83Å; L153-F164 HydrophobicContact CD1-CE1 4.42Å; L153-F164 HydrophobicContact CD1-CE2 3.55Å; L153-F164 HydrophobicContact CD1-CG 4.38Å; L153-F164 HydrophobicContact CD1-CZ 3.88Å |
| 154 | R | 74.4 | Confident | 81.7 | Confident | 156 Ų | 156 | 92.2 Ų | 92.2 | 59% | 0.589 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -28.5 | -177.3 | -69.1 | 178.6 | 179.1 | -166 | 0.5 | 113.6 | E150 P151 L161 | E150-R154 IonicContact OE1-CZ 3.27Å; E150-R154 IonicContact OE1-NE 3.29Å; E150-R154 IonicContact OE1-NH2 3.66Å; E150-R154 PolarHBondContact OE1-NH2 3.33Å; P151-R154 PolarHBondContact O-N 3.4Å; R154-L161 HydrophobicContact CG-CD1 4.02Å |
| 155 | D | 71.8 | Confident | 81.6 | Confident | 151 Ų | 151 | 96.2 Ų | 96.2 | 81% | 0.807 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.1 | 1.5 | -176.4 | -55.7 | -41.6 | 0 | 0 | 0 | 113.1 | K157 | D155-K157 PolarHBondContact O-N 3.49Š|
| 156 | T | 76.5 | Confident | 81.6 | Confident | 51 Ų | 51 | 96.4 Ų | 96.4 | 31% | 0.313 | 50% | 0.495 | S | S | . | . | trans | -88.1 | 111.4 | -172.8 | 59 | 0 | 0 | 0 | 0 | 112.5 | L153 G158 F159 | L153-T156 PolarHBondContact O-OG1 3.05Å; T156-G158 PolarHBondContact O-N 3.12Å; T156-F159 PolarHBondContact O-N 3.49Å; T156-F159 WeakPolarHBondContact OG1-CD2 3.37Å; T156-F159 WeakPolarHBondContact OG1-CG 3.34Å | ||
| 157 | K | 63.1 | Low | 81.7 | Confident | 220 Ų | 220 | 101.7 Ų | 101.7 | 96% | 0.957 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | 99 | -175.6 | -166.9 | 175 | -173.9 | 177.1 | 0 | 112 | D155 | D155-K157 PolarHBondContact O-N 3.49Š|
| 158 | G | 71.2 | Confident | 81.8 | Confident | 80 Ų | 80 | 95.9 Ų | 95.9 | 83% | 0.825 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 130.7 | -11.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | T156 | T156-G158 PolarHBondContact O-N 3.12Š|
| 159 | F | 75.9 | Confident | 82 | Confident | 144 Ų | 144 | 95 Ų | 95 | 63% | 0.632 | 50% | 0.498 | S | S | * | . | trans | -90.5 | 135 | 176.4 | -72.6 | -100.5 | 0 | 0 | 0 | 111.2 | T156 | T156-F159 PolarHBondContact O-N 3.49Å; T156-F159 WeakPolarHBondContact OG1-CD2 3.37Å; T156-F159 WeakPolarHBondContact OG1-CG 3.34Å | ||
| 160 | S | 80.8 | Confident | 82.3 | Confident | 64 Ų | 64 | 94.4 Ų | 94.4 | 45% | 0.448 | 50% | 0.5 | S | S | . | . | trans | -102.4 | 118.1 | 168.1 | 61.2 | 0 | 0 | 0 | 0 | 110.1 | E162 S163 F164 | S160-E162 PolarHBondContact O-N 2.94Å; S160-E162 VanDerWaalsContact O-N 3.17Å; S160-S163 PolarHBondContact O-N 3.31Å; S160-S163 PolarHBondContact O-OG 2.95Å; S160-S163 WeakPolarHBondContact OG-CB 3.26Å; S160-S163 PolarHBondContact OG-OG 2.9Å; S160-F164 PolarHBondContact O-N 2.78Å; S160-F164 VanDerWaalsContact O-N 3.08Å | ||
| 161 | L | 82.1 | Confident | 82.7 | Confident | 68 Ų | 68 | 97.5 Ų | 97.5 | 36% | 0.356 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.5 | -28.6 | -177.4 | 179.7 | 145.8 | 0 | 0 | 0 | 112.7 | E150 R154 R165 | E150-L161 HydrophobicContact CG-CD1 3.94Å; E150-L161 HydrophobicContact CG-CG 4.48Å; R154-L161 HydrophobicContact CG-CD1 4.02Å; L161-R165 HydrophobicContact CD2-CG 4.38Å; L161-R165 WeakPolarHBondContact O-CB 3.24Å; L161-R165 WeakPolarHBondContact O-CG 3.4Å; L161-R165 PolarHBondContact O-N 3.33Å |
| 162 | E | 84.3 | Confident | 83.1 | Confident | 165 Ų | 165 | 94.8 Ų | 94.8 | 77% | 0.771 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.4 | -46.6 | 172.8 | -175.1 | 174.2 | -161.1 | 0 | 0 | 112.6 | S160 R165 A166 | S160-E162 PolarHBondContact O-N 2.94Å; S160-E162 VanDerWaalsContact O-N 3.17Å; E162-R165 PolarHBondContact O-N 2.87Å; E162-A166 WeakPolarHBondContact O-CB 3.35Å; E162-A166 PolarHBondContact O-N 3.1Å |
| 163 | S | 85.5 | Confident | 83.6 | Confident | 64 Ų | 64 | 91.3 Ų | 91.3 | 45% | 0.448 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -69.7 | -34.9 | 177.4 | 72.4 | 0 | 0 | 0 | 0 | 112.1 | S160 A166 K167 | S160-S163 PolarHBondContact O-N 3.31Å; S160-S163 PolarHBondContact O-OG 2.95Å; S160-S163 WeakPolarHBondContact OG-CB 3.26Å; S160-S163 PolarHBondContact OG-OG 2.9Å; S163-A166 PolarHBondContact O-N 3.04Å; S163-K167 WeakPolarHBondContact O-CB 3.35Å; S163-K167 WeakPolarHBondContact O-CG 3.48Å; S163-K167 PolarHBondContact O-N 2.94Å |
| 164 | F | 87.9 | Confident | 84.3 | Confident | 42 Ų | 42 | 95 Ų | 95 | 18% | 0.184 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -59.9 | -48.8 | 171.4 | 174.6 | -102.4 | 0 | 0 | 0 | 111.3 | I146 L149 E150 L153 S160 K167 A168 | I146-F164 HydrophobicContact CD1-CZ 4.15Å; I146-F164 HydrophobicContact CG2-CE1 4Å; I146-F164 HydrophobicContact CG2-CZ 4.06Å; L149-F164 HydrophobicContact CD2-CE2 4.37Å; L149-F164 HydrophobicContact CD2-CZ 4.32Å; E150-F164 HydrophobicContact CB-CE1 4.14Å; E150-F164 HydrophobicContact CG-CD1 4.45Å; E150-F164 HydrophobicContact CG-CE1 4.22Å; L153-F164 HydrophobicContact CD1-CD2 3.83Å; L153-F164 HydrophobicContact CD1-CE1 4.42Å; L153-F164 HydrophobicContact CD1-CE2 3.55Å; L153-F164 HydrophobicContact CD1-CG 4.38Å; L153-F164 HydrophobicContact CD1-CZ 3.88Å; S160-F164 PolarHBondContact O-N 2.78Å; S160-F164 VanDerWaalsContact O-N 3.08Å; F164-K167 PolarHBondContact O-N 3.13Å; F164-A168 WeakPolarHBondContact O-CB 3.39Å; F164-A168 PolarHBondContact O-N 3.21Å |
| 165 | R | 87.4 | Confident | 85.1 | Confident | 124 Ų | 124 | 89.8 Ų | 89.8 | 47% | 0.468 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.3 | -44.3 | 176.4 | -77 | -176.7 | 174.8 | 179.8 | 1.9 | 112.3 | E150 L161 E162 K167 A168 S169 | E150-R165 VanDerWaalsContact CD-NH2 3.25Å; E150-R165 IonicContact OE1-CZ 2.71Å; E150-R165 IonicContact OE1-NE 2.66Å; E150-R165 IonicContact OE1-NH2 3.16Å; E150-R165 PolarHBondContact OE1-NH2 3.44Å; E150-R165 IonicContact OE2-CZ 3.96Å; E150-R165 IonicContact OE2-NE 3.66Å; E150-R165 PolarHBondContact OE2-NE 3.36Å; E150-R165 IonicContact OE2-NH2 2.74Å; E150-R165 PolarHBondContact OE2-NH2 2.89Å; L161-R165 HydrophobicContact CD2-CG 4.38Å; L161-R165 WeakPolarHBondContact O-CB 3.24Å; L161-R165 WeakPolarHBondContact O-CG 3.4Å; L161-R165 PolarHBondContact O-N 3.33Å; E162-R165 PolarHBondContact O-N 2.87Å; R165-K167 VanDerWaalsContact C-N 3.31Å; R165-K167 PolarHBondContact O-N 2.98Å; R165-A168 PolarHBondContact O-N 3.3Å; R165-S169 WeakPolarHBondContact O-CB 3.41Å; R165-S169 PolarHBondContact O-N 2.94Å; R165-S169 PolarHBondContact O-OG 3.11Å |
| 166 | A | 90 | Very high | 86.2 | Confident | 63 Ų | 63 | 86 Ų | 86 | 52% | 0.521 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -58.6 | -42 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | E162 S163 S170 | E162-A166 WeakPolarHBondContact O-CB 3.35Å; E162-A166 PolarHBondContact O-N 3.1Å; S163-A166 PolarHBondContact O-N 3.04Å; A166-S170 WeakPolarHBondContact O-CB 3.37Å; A166-S170 PolarHBondContact O-N 2.97Å |
| 167 | K | 90.3 | Very high | 86.9 | Confident | 144 Ų | 144 | 89.5 Ų | 89.5 | 63% | 0.626 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -70 | -40.1 | 174.9 | -72.5 | -65.2 | -176.3 | -176.9 | 0 | 112.9 | S163 F164 R165 S170 L171 | S163-K167 WeakPolarHBondContact O-CB 3.35Å; S163-K167 WeakPolarHBondContact O-CG 3.48Å; S163-K167 PolarHBondContact O-N 2.94Å; F164-K167 PolarHBondContact O-N 3.13Å; R165-K167 VanDerWaalsContact C-N 3.31Å; R165-K167 PolarHBondContact O-N 2.98Å; K167-S170 PolarHBondContact O-N 3.39Å; K167-L171 WeakPolarHBondContact O-CB 3.43Å; K167-L171 WeakPolarHBondContact O-CG 3.5Å; K167-L171 PolarHBondContact O-N 3.49Å |
| 168 | A | 90.9 | Very high | 88.2 | Confident | 12 Ų | 12 | 85.2 Ų | 85.2 | 10% | 0.099 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -65 | -39.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | I146 F164 R165 S172 | I146-A168 HydrophobicContact CD1-CB 4.09Å; I146-A168 HydrophobicContact CG1-CB 4.22Å; I146-A168 HydrophobicContact CG2-CB 3.79Å; F164-A168 WeakPolarHBondContact O-CB 3.39Å; F164-A168 PolarHBondContact O-N 3.21Å; R165-A168 PolarHBondContact O-N 3.3Å; A168-S172 VanDerWaalsContact O-CB 3.24Å; A168-S172 WeakPolarHBondContact O-CB 3.44Å; A168-S172 PolarHBondContact O-N 3.09Å |
| 169 | S | 90.8 | Very high | 89.2 | Confident | 77 Ų | 77 | 81.8 Ų | 81.8 | 54% | 0.538 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -66.1 | -43.8 | 172.7 | -67 | 0 | 0 | 0 | 0 | 112.1 | R165 L171 S172 E173 | R165-S169 WeakPolarHBondContact O-CB 3.41Å; R165-S169 PolarHBondContact O-N 2.94Å; R165-S169 PolarHBondContact O-OG 3.11Å; S169-L171 PolarHBondContact O-N 2.9Å; S169-S172 WeakPolarHBondContact O-CB 3.46Å; S169-S172 PolarHBondContact O-N 3.14Å; S169-E173 PolarHBondContact O-N 3.39Å; S169-E173 VanDerWaalsContact O-N 3.07Å |
| 170 | S | 93.6 | Very high | 89.9 | Confident | 66 Ų | 66 | 78.7 Ų | 78.7 | 46% | 0.462 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -57.2 | -48.7 | 174.7 | -171.5 | 0 | 0 | 0 | 0 | 111.8 | A166 K167 S172 E173 E174 | A166-S170 WeakPolarHBondContact O-CB 3.37Å; A166-S170 PolarHBondContact O-N 2.97Å; K167-S170 PolarHBondContact O-N 3.39Å; S170-S172 VanDerWaalsContact C-N 3.32Å; S170-S172 PolarHBondContact O-N 3.16Å; S170-E173 PolarHBondContact O-N 3Å; S170-E174 WeakPolarHBondContact O-CB 3.42Å; S170-E174 PolarHBondContact O-N 3.35Å |
| 171 | L | 93.1 | Very high | 90.4 | Very high | 88 Ų | 88 | 77 Ų | 77 | 46% | 0.461 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -70 | -27 | 178 | -69.9 | 169 | 0 | 0 | 0 | 112.7 | F142 K167 S169 L175 | F142-L171 HydrophobicContact CE1-CB 4.24Å; F142-L171 HydrophobicContact CZ-CB 3.9Å; K167-L171 WeakPolarHBondContact O-CB 3.43Å; K167-L171 WeakPolarHBondContact O-CG 3.5Å; K167-L171 PolarHBondContact O-N 3.49Å; S169-L171 PolarHBondContact O-N 2.9Å; L171-L175 WeakPolarHBondContact O-CB 3.24Å; L171-L175 PolarHBondContact O-N 3.35Å |
| 172 | S | 92.6 | Very high | 90.7 | Very high | 9 Ų | 9 | 75.6 Ų | 75.6 | 6% | 0.063 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -69.8 | -40.2 | 175 | -177.2 | 0 | 0 | 0 | 0 | 112 | L139 Q143 A168 S169 S170 K176 | L139-S172 WeakPolarHBondContact CD1-O 3.43Å; L139-S172 WeakPolarHBondContact CD1-OG 3.35Å; Q143-S172 PolarHBondContact NE2-OG 3.32Å; A168-S172 VanDerWaalsContact O-CB 3.24Å; A168-S172 WeakPolarHBondContact O-CB 3.44Å; A168-S172 PolarHBondContact O-N 3.09Å; S169-S172 WeakPolarHBondContact O-CB 3.46Å; S169-S172 PolarHBondContact O-N 3.14Å; S170-S172 VanDerWaalsContact C-N 3.32Å; S170-S172 PolarHBondContact O-N 3.16Å; S172-K176 VanDerWaalsContact O-CB 3.28Å; S172-K176 WeakPolarHBondContact O-CB 3.49Å; S172-K176 PolarHBondContact O-N 3.06Å |
| 173 | E | 93.2 | Very high | 90.9 | Very high | 85 Ų | 85 | 70.9 Ų | 70.9 | 40% | 0.397 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -75.8 | -34.2 | 175.8 | -66.4 | -60.6 | 112.8 | 0 | 0 | 111.7 | S169 S170 K176 H177 | S169-E173 PolarHBondContact O-N 3.39Å; S169-E173 VanDerWaalsContact O-N 3.07Å; S170-E173 PolarHBondContact O-N 3Å; E173-K176 WeakPolarHBondContact O-CB 3.5Å; E173-K176 PolarHBondContact O-N 2.96Å; E173-K176 IonicContact OE1-NZ 2.97Å; E173-K176 IonicContact OE2-NZ 3.55Å; E173-K176 PolarHBondContact OE2-NZ 3.18Å; E173-H177 PolarHBondContact O-CD2 3.34Å; E173-H177 VanDerWaalsContact O-CD2 3.25Å; E173-H177 PolarHBondContact O-N 3.01Å |
| 174 | E | 94.6 | Very high | 91 | Very high | 122 Ų | 122 | 73.9 Ų | 73.9 | 57% | 0.57 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -63.3 | -45.6 | 171.1 | -171.6 | 173.4 | -173 | 0 | 0 | 111.7 | S170 K176 H177 F178 | S170-E174 WeakPolarHBondContact O-CB 3.42Å; S170-E174 PolarHBondContact O-N 3.35Å; E174-K176 VanDerWaalsContact C-N 3.31Å; E174-K176 PolarHBondContact O-N 2.88Å; E174-H177 PolarHBondContact O-N 3.22Å; E174-F178 WeakPolarHBondContact O-CB 3.47Å; E174-F178 PolarHBondContact O-N 2.98Å |
| 175 | L | 92.4 | Very high | 91 | Very high | 47 Ų | 47 | 75.8 Ų | 75.8 | 25% | 0.246 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -62.6 | -36 | 174.3 | 177 | 62.4 | 0 | 0 | 0 | 112.4 | L139 F142 L171 F178 A179 | L139-L175 HydrophobicContact CD1-CD2 4.31Å; L139-L175 HydrophobicContact CD1-CG 4.46Å; F142-L175 HydrophobicContact CB-CD2 3.4Å; F142-L175 VanDerWaalsContact CB-CD2 3.4Å; F142-L175 HydrophobicContact CD1-CD2 3.8Å; F142-L175 HydrophobicContact CD2-CD2 4.11Å; F142-L175 HydrophobicContact CG-CD2 3.5Å; L171-L175 WeakPolarHBondContact O-CB 3.24Å; L171-L175 PolarHBondContact O-N 3.35Å; L175-F178 PolarHBondContact O-N 3.22Å; L175-A179 WeakPolarHBondContact O-CB 3.42Å; L175-A179 PolarHBondContact O-N 2.98Å |
| 176 | K | 93 | Very high | 90.8 | Very high | 72 Ų | 72 | 70.9 Ų | 70.9 | 31% | 0.313 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.8 | -51 | 175.7 | 171.4 | -179.5 | 152.5 | -157.6 | 0 | 111.1 | L139 S172 E173 E174 F178 A179 D180 | L139-K176 HydrophobicContact CD1-CB 4.17Å; L139-K176 HydrophobicContact CD2-CB 4.03Å; L139-K176 HydrophobicContact CD2-CD 4.27Å; L139-K176 HydrophobicContact CD2-CG 4.2Å; S172-K176 VanDerWaalsContact O-CB 3.28Å; S172-K176 WeakPolarHBondContact O-CB 3.49Å; S172-K176 PolarHBondContact O-N 3.06Å; E173-K176 WeakPolarHBondContact O-CB 3.5Å; E173-K176 PolarHBondContact O-N 2.96Å; E173-K176 IonicContact OE1-NZ 2.97Å; E173-K176 IonicContact OE2-NZ 3.55Å; E173-K176 PolarHBondContact OE2-NZ 3.18Å; E174-K176 VanDerWaalsContact C-N 3.31Å; E174-K176 PolarHBondContact O-N 2.88Å; K176-F178 PolarHBondContact O-N 3.4Å; K176-A179 PolarHBondContact O-N 3.36Å; K176-D180 VanDerWaalsContact O-CG 3.23Å; K176-D180 PolarHBondContact O-N 3.31Å |
| 177 | H | 92.3 | Very high | 90.6 | Very high | 124 Ų | 124 | 70.5 Ų | 70.5 | 57% | 0.574 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -60.4 | -34.2 | 173.8 | -71 | -44.3 | 0 | 0 | 0 | 112.9 | E173 E174 D180 G181 | E173-H177 PolarHBondContact O-CD2 3.34Å; E173-H177 VanDerWaalsContact O-CD2 3.25Å; E173-H177 PolarHBondContact O-N 3.01Å; E174-H177 PolarHBondContact O-N 3.22Å; H177-D180 IonicContact ND1-OD2 3.91Å; H177-G181 PolarHBondContact O-N 2.98Å |
| 178 | F | 91 | Very high | 90.3 | Very high | 129 Ų | 129 | 64.1 Ų | 64.1 | 57% | 0.566 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -68.8 | -39 | 173.1 | -174 | -113.4 | 0 | 0 | 0 | 112.3 | E174 L175 K176 G181 L182 | E174-F178 WeakPolarHBondContact O-CB 3.47Å; E174-F178 PolarHBondContact O-N 2.98Å; L175-F178 PolarHBondContact O-N 3.22Å; K176-F178 PolarHBondContact O-N 3.4Å; F178-G181 PolarHBondContact O-N 3.18Å; F178-L182 HydrophobicContact CD1-CD1 3.84Å; F178-L182 HydrophobicContact CD1-CG 4.37Å; F178-L182 HydrophobicContact CE1-CD1 3.47Å; F178-L182 VanDerWaalsContact CE1-CD1 3.47Å; F178-L182 HydrophobicContact CE1-CG 4.1Å; F178-L182 HydrophobicContact CE2-CG 4.5Å; F178-L182 HydrophobicContact CZ-CD1 3.95Å; F178-L182 HydrophobicContact CZ-CD2 4.22Å; F178-L182 HydrophobicContact CZ-CG 4.16Å; F178-L182 WeakPolarHBondContact O-CG 3.44Å; F178-L182 PolarHBondContact O-N 2.99Å |
| 179 | A | 90.9 | Very high | 90.1 | Very high | 8 Ų | 8 | 67.6 Ų | 67.6 | 7% | 0.066 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -67.5 | -40.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | L175 K176 G181 L182 E183 | L175-A179 WeakPolarHBondContact O-CB 3.42Å; L175-A179 PolarHBondContact O-N 2.98Å; K176-A179 PolarHBondContact O-N 3.36Å; A179-G181 VanDerWaalsContact C-N 3.29Å; A179-G181 PolarHBondContact O-N 3.48Å; A179-L182 PolarHBondContact O-N 3.05Å; A179-E183 PolarHBondContact O-N 3.24Å |
| 180 | D | 90.6 | Very high | 89.8 | Confident | 79 Ų | 79 | 69.3 Ų | 69.3 | 42% | 0.422 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -59.3 | -43.4 | 170.8 | -59.7 | -30.8 | 0 | 0 | 0 | 110.1 | K176 H177 E183 T184 | K176-D180 VanDerWaalsContact O-CG 3.23Å; K176-D180 PolarHBondContact O-N 3.31Å; H177-D180 IonicContact ND1-OD2 3.91Å; D180-E183 WeakPolarHBondContact O-CB 3.46Å; D180-E183 PolarHBondContact O-N 2.81Å; D180-T184 PolarHBondContact O-N 3.03Å; D180-T184 VanDerWaalsContact O-N 3.12Å; D180-T184 PolarHBondContact O-OG1 3.14Å |
| 181 | G | 91.6 | Very high | 89.2 | Confident | 30 Ų | 30 | 70.2 Ų | 70.2 | 31% | 0.309 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -56.5 | -50.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | H177 F178 A179 E183 T184 D185 | H177-G181 PolarHBondContact O-N 2.98Å; F178-G181 PolarHBondContact O-N 3.18Å; A179-G181 VanDerWaalsContact C-N 3.29Å; A179-G181 PolarHBondContact O-N 3.48Å; G181-E183 PolarHBondContact O-N 3.29Å; G181-T184 PolarHBondContact O-N 3.14Å; G181-T184 PolarHBondContact O-OG1 2.6Å; G181-D185 PolarHBondContact O-N 2.89Å |
| 182 | L | 88.4 | Confident | 88.4 | Confident | 37 Ų | 37 | 70 Ų | 70 | 19% | 0.194 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -68.4 | -13 | 177.8 | -68.8 | 176.6 | 0 | 0 | 0 | 114.3 | F178 A179 D185 T187 L188 | F178-L182 HydrophobicContact CD1-CD1 3.84Å; F178-L182 HydrophobicContact CD1-CG 4.37Å; F178-L182 HydrophobicContact CE1-CD1 3.47Å; F178-L182 VanDerWaalsContact CE1-CD1 3.47Å; F178-L182 HydrophobicContact CE1-CG 4.1Å; F178-L182 HydrophobicContact CE2-CG 4.5Å; F178-L182 HydrophobicContact CZ-CD1 3.95Å; F178-L182 HydrophobicContact CZ-CD2 4.22Å; F178-L182 HydrophobicContact CZ-CG 4.16Å; F178-L182 WeakPolarHBondContact O-CG 3.44Å; F178-L182 PolarHBondContact O-N 2.99Å; A179-L182 PolarHBondContact O-N 3.05Å; L182-D185 VanDerWaalsContact C-OD1 3.26Å; L182-D185 VanDerWaalsContact CA-OD1 3.23Å; L182-D185 WeakPolarHBondContact CA-OD1 3.42Å; L182-T187 HydrophobicContact CD2-CG2 4.06Å; L182-T187 PolarHBondContact O-N 3.37Å; L182-L188 HydrophobicContact CB-CD1 4.14Å; L182-L188 HydrophobicContact CB-CG 3.89Å; L182-L188 WeakPolarHBondContact O-CB 3.24Å; L182-L188 WeakPolarHBondContact O-CG 3.39Å; L182-L188 PolarHBondContact O-N 2.74Å |
| 183 | E | 88.1 | Confident | 87.7 | Confident | 67 Ų | 67 | 75 Ų | 75 | 31% | 0.313 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -78 | -49.7 | 165.3 | -160.2 | -156.5 | 140.4 | 0 | 0 | 109.7 | K132 A179 D180 G181 D185 G186 L188 | K132-E183 WeakPolarHBondContact CE-OE1 3.28Å; K132-E183 WeakPolarHBondContact CE-OE2 3.43Å; K132-E183 HydrophobicContact CG-CG 4.43Å; K132-E183 WeakPolarHBondContact CG-OE2 3.3Å; K132-E183 IonicContact NZ-OE1 3.68Å; A179-E183 PolarHBondContact O-N 3.24Å; D180-E183 WeakPolarHBondContact O-CB 3.46Å; D180-E183 PolarHBondContact O-N 2.81Å; G181-E183 PolarHBondContact O-N 3.29Å; E183-D185 PolarHBondContact O-N 2.87Å; E183-G186 PolarHBondContact O-N 3.48Å; E183-G186 VanDerWaalsContact O-N 3.11Å; E183-L188 HydrophobicContact CB-CD1 4.34Å |
| 184 | T | 87.8 | Confident | 86 | Confident | 127 Ų | 127 | 77.4 Ų | 77.4 | 78% | 0.779 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -69.9 | -25.3 | -175.5 | 58.2 | 0 | 0 | 0 | 0 | 115.4 | D180 G181 G186 | D180-T184 PolarHBondContact O-N 3.03Å; D180-T184 VanDerWaalsContact O-N 3.12Å; D180-T184 PolarHBondContact O-OG1 3.14Å; G181-T184 PolarHBondContact O-N 3.14Å; G181-T184 PolarHBondContact O-OG1 2.6Å; T184-G186 VanDerWaalsContact C-N 3.26Å |
| 185 | D | 88.1 | Confident | 84.1 | Confident | 82 Ų | 82 | 75.4 Ų | 75.4 | 44% | 0.439 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | -0.6 | 173 | 83.3 | -23.4 | 0 | 0 | 0 | 113.4 | G181 L182 E183 T187 K190 | G181-D185 PolarHBondContact O-N 2.89Å; L182-D185 VanDerWaalsContact C-OD1 3.26Å; L182-D185 VanDerWaalsContact CA-OD1 3.23Å; L182-D185 WeakPolarHBondContact CA-OD1 3.42Å; E183-D185 PolarHBondContact O-N 2.87Å; D185-T187 PolarHBondContact O-N 3.25Å; D185-T187 WeakPolarHBondContact OD1-CA 3.26Å; D185-T187 WeakPolarHBondContact OD1-CB 3.18Å; D185-T187 PolarHBondContact OD1-N 3.31Å; D185-T187 PolarHBondContact OD1-OG1 3Å; D185-T187 WeakPolarHBondContact OD2-CB 3.19Å; D185-T187 PolarHBondContact OD2-OG1 3.34Å; D185-K190 PolarHBondContact O-NZ 2.86Å; D185-K190 VanDerWaalsContact O-NZ 3.11Å |
| 186 | G | 83.5 | Confident | 82.1 | Confident | 21 Ų | 21 | 80.1 Ų | 80.1 | 22% | 0.216 | 42% | 0.424 | C | S | . | . | S | Bend | trans | 69.3 | 10.9 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | E183 T184 Q189 K190 | E183-G186 PolarHBondContact O-N 3.48Å; E183-G186 VanDerWaalsContact O-N 3.11Å; T184-G186 VanDerWaalsContact C-N 3.26Å; G186-Q189 WeakPolarHBondContact O-CB 3.45Å; G186-Q189 PolarHBondContact O-N 2.8Å; G186-K190 WeakPolarHBondContact O-CG 3.21Å; G186-K190 PolarHBondContact O-N 2.72Å |
| 187 | T | 86 | Confident | 80.1 | Confident | 54 Ų | 54 | 78.3 Ų | 78.3 | 33% | 0.331 | 43% | 0.426 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71 | -36.6 | -178.8 | -66.8 | 0 | 0 | 0 | 0 | 112.2 | L182 D185 Q189 K190 | L182-T187 HydrophobicContact CD2-CG2 4.06Å; L182-T187 PolarHBondContact O-N 3.37Å; D185-T187 PolarHBondContact O-N 3.25Å; D185-T187 WeakPolarHBondContact OD1-CA 3.26Å; D185-T187 WeakPolarHBondContact OD1-CB 3.18Å; D185-T187 PolarHBondContact OD1-N 3.31Å; D185-T187 PolarHBondContact OD1-OG1 3Å; D185-T187 WeakPolarHBondContact OD2-CB 3.19Å; D185-T187 PolarHBondContact OD2-OG1 3.34Å; T187-Q189 VanDerWaalsContact C-N 3.28Å; T187-Q189 PolarHBondContact O-N 3.26Å; T187-K190 PolarHBondContact O-N 3.3Å; T187-K190 PolarHBondContact OG1-NZ 2.94Å |
| 188 | L | 84.5 | Confident | 78.2 | Confident | 10 Ų | 10 | 76.1 Ų | 76.1 | 5% | 0.052 | 42% | 0.415 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -29.6 | 168.1 | -68.6 | 174.8 | 0 | 0 | 0 | 112.4 | L134 L138 L182 E183 C191 F192 | L134-L188 HydrophobicContact CD2-CD2 3.89Å; L134-L188 HydrophobicContact CG-CD2 4.06Å; L138-L188 HydrophobicContact CD1-CD2 4.1Å; L182-L188 HydrophobicContact CB-CD1 4.14Å; L182-L188 HydrophobicContact CB-CG 3.89Å; L182-L188 WeakPolarHBondContact O-CB 3.24Å; L182-L188 WeakPolarHBondContact O-CG 3.39Å; L182-L188 PolarHBondContact O-N 2.74Å; E183-L188 HydrophobicContact CB-CD1 4.34Å; L188-C191 WeakPolarHBondContact O-CB 3.48Å; L188-C191 PolarHBondContact O-N 3.43Å; L188-F192 WeakPolarHBondContact O-CD2 3.18Å |
| 189 | Q | 85.5 | Confident | 76.4 | Confident | 86 Ų | 86 | 73 Ų | 73 | 40% | 0.402 | 41% | 0.413 | S | S | . | . | G | 310 helix | trans | -68.6 | -39.7 | 177.3 | -164.8 | 66.5 | 14.3 | 0 | 0 | 111.4 | S131 G186 T187 C191 F192 E193 | S131-Q189 PolarHBondContact OG-OE1 3.07Å; G186-Q189 WeakPolarHBondContact O-CB 3.45Å; G186-Q189 PolarHBondContact O-N 2.8Å; T187-Q189 VanDerWaalsContact C-N 3.28Å; T187-Q189 PolarHBondContact O-N 3.26Å; Q189-C191 PolarHBondContact O-N 2.75Å; Q189-C191 VanDerWaalsContact O-N 3.09Å; Q189-F192 PolarHBondContact O-N 2.86Å; Q189-E193 PolarHBondContact O-N 2.81Å |
| 190 | K | 84.4 | Confident | 74.8 | Confident | 112 Ų | 112 | 76.1 Ų | 76.1 | 49% | 0.487 | 43% | 0.434 | S | S | . | . | G | 310 helix | trans | -59.6 | -17.5 | 174.8 | -66.8 | 164.8 | -156.1 | 124.5 | 0 | 113.9 | D185 G186 T187 F192 | D185-K190 PolarHBondContact O-NZ 2.86Å; D185-K190 VanDerWaalsContact O-NZ 3.11Å; G186-K190 WeakPolarHBondContact O-CG 3.21Å; G186-K190 PolarHBondContact O-N 2.72Å; T187-K190 PolarHBondContact O-N 3.3Å; T187-K190 PolarHBondContact OG1-NZ 2.94Å; K190-F192 VanDerWaalsContact C-N 3.32Å |
| 191 | C | 81.4 | Confident | 73.4 | Confident | 86 Ų | 86 | 76.9 Ų | 76.9 | 58% | 0.581 | 44% | 0.438 | S | S | * | . | G | 310 helix | trans | -73.8 | -21.7 | 172.5 | -60.1 | 0 | 0 | 0 | 0 | 113.5 | L134 L188 Q189 | L134-C191 HydrophobicContact CD2-CB 3.91Å; L188-C191 WeakPolarHBondContact O-CB 3.48Å; L188-C191 PolarHBondContact O-N 3.43Å; Q189-C191 PolarHBondContact O-N 2.75Å; Q189-C191 VanDerWaalsContact O-N 3.09Å |
| 192 | F | 77.1 | Confident | 72.2 | Confident | 82 Ų | 82 | 82.1 Ų | 82.1 | 36% | 0.36 | 45% | 0.452 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.8 | -32.1 | 178.8 | -62.6 | -79.7 | 0 | 0 | 0 | 112.1 | E130 L134 L188 Q189 K190 H194 | E130-F192 HydrophobicContact CB-CD1 3.89Å; E130-F192 HydrophobicContact CB-CD2 4.25Å; E130-F192 HydrophobicContact CB-CE1 3.71Å; E130-F192 HydrophobicContact CB-CE2 4.09Å; E130-F192 HydrophobicContact CB-CG 4.16Å; E130-F192 HydrophobicContact CB-CZ 3.82Å; E130-F192 HydrophobicContact CG-CD1 4.35Å; E130-F192 HydrophobicContact CG-CE1 4.19Å; E130-F192 WeakPolarHBondContact O-CZ 3.36Å; L134-F192 HydrophobicContact CB-CE2 4.01Å; L134-F192 HydrophobicContact CB-CZ 3.99Å; L134-F192 HydrophobicContact CD2-CE2 3.72Å; L134-F192 HydrophobicContact CD2-CZ 3.99Å; L188-F192 WeakPolarHBondContact O-CD2 3.18Å; Q189-F192 PolarHBondContact O-N 2.86Å; K190-F192 VanDerWaalsContact C-N 3.32Å; F192-H194 PolarHBondContact O-N 2.95Å; F192-H194 VanDerWaalsContact O-N 3.12Å; F192-H194 PolarHBondContact O-ND1 3.23Å; F192-H194 VanDerWaalsContact O-ND1 3.1Å |
| 193 | E | 77.6 | Confident | 71.6 | Confident | 115 Ų | 115 | 84.3 Ų | 84.3 | 54% | 0.537 | 47% | 0.471 | S | S | . | . | S | Bend | trans | -50.7 | 120.1 | 167.3 | -70.2 | 175.9 | -176.7 | 0 | 0 | 110 | Q189 S195 | Q189-E193 PolarHBondContact O-N 2.81Å; E193-S195 PolarHBondContact O-N 3.42Å |
| 194 | H | 57.2 | Low | 71.3 | Confident | 135 Ų | 135 | 86.5 Ų | 86.5 | 63% | 0.625 | 48% | 0.484 | S | S | * | . | trans | -71 | 103.8 | 173 | -79.9 | 29.4 | 0 | 0 | 0 | 107.6 | F192 N196 K198 | F192-H194 PolarHBondContact O-N 2.95Å; F192-H194 VanDerWaalsContact O-N 3.12Å; F192-H194 PolarHBondContact O-ND1 3.23Å; F192-H194 VanDerWaalsContact O-ND1 3.1Å; H194-N196 PolarHBondContact O-N 2.99Å; H194-K198 HydrophobicContact CB-CD 4.08Å; H194-K198 PolarHBondContact CD2-NZ 3.33Å; H194-K198 PolarHBondContact NE2-NZ 2.95Å; H194-K198 VanDerWaalsContact NE2-NZ 3.1Å | ||
| 195 | S | 54.3 | Low | 71.2 | Confident | 81 Ų | 81 | 86.3 Ų | 86.3 | 57% | 0.566 | 48% | 0.475 | S | S | * | . | trans | -44.5 | 131.6 | -179.9 | 54.1 | 0 | 0 | 0 | 0 | 110.6 | E193 G197 K198 | E193-S195 PolarHBondContact O-N 3.42Å; S195-G197 PolarHBondContact O-N 2.83Å; S195-K198 WeakPolarHBondContact O-CB 3.19Å; S195-K198 PolarHBondContact O-N 3.41Å | ||
| 196 | N | 51.2 | Low | 71.3 | Confident | 146 Ų | 146 | 84.6 Ų | 84.6 | 78% | 0.781 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.7 | -13.5 | -174.1 | -79.9 | -61.9 | 0 | 0 | 0 | 113.8 | H194 K198 A199 | H194-N196 PolarHBondContact O-N 2.99Å; N196-K198 PolarHBondContact O-N 2.71Å; N196-A199 WeakPolarHBondContact O-CB 3.16Å; N196-A199 PolarHBondContact O-N 2.85Å |
| 197 | G | 50.4 | Low | 71.6 | Confident | 33 Ų | 33 | 86.4 Ų | 86.4 | 34% | 0.34 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -51.8 | -33.4 | 164.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | S195 A199 S200 D201 | S195-G197 PolarHBondContact O-N 2.83Å; G197-A199 PolarHBondContact O-N 2.64Å; G197-S200 WeakPolarHBondContact CA-OG 3.44Å; G197-S200 CarbonylContact O-C 3.52Å; G197-S200 PolarHBondContact O-N 2.81Å; G197-S200 VanDerWaalsContact O-N 3.09Å; G197-S200 PolarHBondContact O-OG 3.38Å; G197-D201 PolarHBondContact O-N 3.42Å |
| 198 | K | 53.1 | Low | 71.9 | Confident | 79 Ų | 79 | 86.3 Ų | 86.3 | 34% | 0.343 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -60.7 | -26.9 | 175.2 | -66.7 | -164.2 | -170.6 | -179.9 | 0 | 113.6 | H194 S195 N196 D201 F202 | H194-K198 HydrophobicContact CB-CD 4.08Å; H194-K198 PolarHBondContact CD2-NZ 3.33Å; H194-K198 PolarHBondContact NE2-NZ 2.95Å; H194-K198 VanDerWaalsContact NE2-NZ 3.1Å; S195-K198 WeakPolarHBondContact O-CB 3.19Å; S195-K198 PolarHBondContact O-N 3.41Å; N196-K198 PolarHBondContact O-N 2.71Å; K198-D201 WeakPolarHBondContact CA-OD2 3.36Å; K198-D201 PolarHBondContact O-N 3.42Å; K198-F202 WeakPolarHBondContact O-CD2 3.28Å; K198-F202 WeakPolarHBondContact O-CG 3.12Å; K198-F202 PolarHBondContact O-N 2.73Å |
| 199 | A | 52.9 | Low | 72.4 | Confident | 64 Ų | 64 | 88.3 Ų | 88.3 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.2 | -40.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | N196 G197 S203 | N196-A199 WeakPolarHBondContact O-CB 3.16Å; N196-A199 PolarHBondContact O-N 2.85Å; G197-A199 PolarHBondContact O-N 2.64Å; A199-S203 PolarHBondContact O-N 2.95Å |
| 200 | S | 56.7 | Low | 72.8 | Confident | 72 Ų | 72 | 89.5 Ų | 89.5 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67 | -37 | 168.2 | 36.5 | 0 | 0 | 0 | 0 | 112.3 | G197 S203 L204 | G197-S200 WeakPolarHBondContact CA-OG 3.44Å; G197-S200 CarbonylContact O-C 3.52Å; G197-S200 PolarHBondContact O-N 2.81Å; G197-S200 VanDerWaalsContact O-N 3.09Å; G197-S200 PolarHBondContact O-OG 3.38Å; S200-S203 PolarHBondContact O-N 3.28Å; S200-L204 VanDerWaalsContact O-CB 3.3Å; S200-L204 WeakPolarHBondContact O-CB 3.22Å; S200-L204 PolarHBondContact O-N 2.91Å |
| 201 | D | 60.9 | Low | 73.4 | Confident | 95 Ų | 95 | 89.4 Ų | 89.4 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.3 | -41.9 | 177.4 | -60 | -32.9 | 0 | 0 | 0 | 111.2 | G197 K198 L204 E205 | G197-D201 PolarHBondContact O-N 3.42Å; K198-D201 WeakPolarHBondContact CA-OD2 3.36Å; K198-D201 PolarHBondContact O-N 3.42Å; D201-L204 PolarHBondContact O-N 2.93Å; D201-E205 VanDerWaalsContact O-CB 3.22Å; D201-E205 WeakPolarHBondContact O-CB 3.35Å; D201-E205 PolarHBondContact O-N 2.95Å |
| 202 | F | 67.3 | Low | 74.2 | Confident | 140 Ų | 140 | 91.5 Ų | 91.5 | 61% | 0.614 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.8 | -39 | 174 | -77.8 | -55.5 | 0 | 0 | 0 | 112.7 | K198 L204 E205 A206 | K198-F202 WeakPolarHBondContact O-CD2 3.28Å; K198-F202 WeakPolarHBondContact O-CG 3.12Å; K198-F202 PolarHBondContact O-N 2.73Å; F202-L204 VanDerWaalsContact C-N 3.33Å; F202-E205 PolarHBondContact O-N 3.25Å; F202-A206 WeakPolarHBondContact O-CB 3.39Å; F202-A206 PolarHBondContact O-N 2.87Å |
| 203 | S | 76 | Confident | 75.1 | Confident | 84 Ų | 84 | 94.3 Ų | 94.3 | 59% | 0.587 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -67.1 | -35.2 | 174.9 | -171.5 | 0 | 0 | 0 | 0 | 112.3 | A199 S200 S207 | A199-S203 PolarHBondContact O-N 2.95Å; S200-S203 PolarHBondContact O-N 3.28Å; S203-S207 PolarHBondContact O-N 3.28Å; S203-S207 VanDerWaalsContact O-N 3.12Å |
| 204 | L | 82.2 | Confident | 76.1 | Confident | 112 Ų | 112 | 95.1 Ų | 95.1 | 59% | 0.586 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -75 | -38.9 | 176.5 | -177.2 | 146.5 | 0 | 0 | 0 | 111.1 | S200 D201 F202 S207 V208 | S200-L204 VanDerWaalsContact O-CB 3.3Å; S200-L204 WeakPolarHBondContact O-CB 3.22Å; S200-L204 PolarHBondContact O-N 2.91Å; D201-L204 PolarHBondContact O-N 2.93Å; F202-L204 VanDerWaalsContact C-N 3.33Å; L204-S207 PolarHBondContact O-N 2.88Å; L204-V208 HydrophobicContact CD2-CG2 4.06Å; L204-V208 HydrophobicContact CG-CG2 4.5Å; L204-V208 VanDerWaalsContact O-CB 3.24Å; L204-V208 WeakPolarHBondContact O-CB 3.46Å; L204-V208 WeakPolarHBondContact O-CG2 3.24Å; L204-V208 PolarHBondContact O-N 3.48Å |
| 205 | E | 86.1 | Confident | 78 | Confident | 123 Ų | 123 | 93.3 Ų | 93.3 | 58% | 0.575 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.4 | -41.9 | 174.3 | -177.9 | 168.4 | -145.6 | 0 | 0 | 111.3 | D201 F202 V208 A209 | D201-E205 VanDerWaalsContact O-CB 3.22Å; D201-E205 WeakPolarHBondContact O-CB 3.35Å; D201-E205 PolarHBondContact O-N 2.95Å; F202-E205 PolarHBondContact O-N 3.25Å; E205-V208 CarbonylContact O-C 3.58Å; E205-V208 PolarHBondContact O-N 3Å; E205-A209 WeakPolarHBondContact O-CB 3.36Å; E205-A209 PolarHBondContact O-N 3.47Å |
| 206 | A | 88.5 | Confident | 80 | Confident | 46 Ų | 46 | 93.8 Ų | 93.8 | 38% | 0.38 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.4 | -51.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F202 V208 A209 E210 | F202-A206 WeakPolarHBondContact O-CB 3.39Å; F202-A206 PolarHBondContact O-N 2.87Å; A206-V208 VanDerWaalsContact C-N 3.28Å; A206-V208 PolarHBondContact O-N 3.39Å; A206-A209 WeakPolarHBondContact O-CA 3.4Å; A206-A209 WeakPolarHBondContact O-CB 3.17Å; A206-A209 PolarHBondContact O-N 2.94Å; A206-E210 WeakPolarHBondContact O-CG 3.29Å; A206-E210 PolarHBondContact O-N 2.78Å |
| 207 | S | 89.4 | Confident | 82.3 | Confident | 59 Ų | 59 | 93 Ų | 93 | 41% | 0.413 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.1 | -35 | 177.3 | -173.8 | 0 | 0 | 0 | 0 | 112.8 | S203 L204 M211 | S203-S207 PolarHBondContact O-N 3.28Å; S203-S207 VanDerWaalsContact O-N 3.12Å; L204-S207 PolarHBondContact O-N 2.88Å; S207-M211 VanDerWaalsContact O-CB 3.26Å; S207-M211 WeakPolarHBondContact O-CB 3.35Å; S207-M211 PolarHBondContact O-N 2.98Å |
| 208 | V | 93.5 | Very high | 84.6 | Confident | 52 Ų | 52 | 97.3 Ų | 97.3 | 32% | 0.315 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -71.5 | -28.6 | 173.5 | 165.4 | 0 | 0 | 0 | 0 | 112 | L204 E205 A206 K212 | L204-V208 HydrophobicContact CD2-CG2 4.06Å; L204-V208 HydrophobicContact CG-CG2 4.5Å; L204-V208 VanDerWaalsContact O-CB 3.24Å; L204-V208 WeakPolarHBondContact O-CB 3.46Å; L204-V208 WeakPolarHBondContact O-CG2 3.24Å; L204-V208 PolarHBondContact O-N 3.48Å; E205-V208 CarbonylContact O-C 3.58Å; E205-V208 PolarHBondContact O-N 3Å; A206-V208 VanDerWaalsContact C-N 3.28Å; A206-V208 PolarHBondContact O-N 3.39Å; V208-K212 HydrophobicContact CG1-CD 4.33Å; V208-K212 VanDerWaalsContact O-CD 3.3Å; V208-K212 WeakPolarHBondContact O-CD 3.44Å; V208-K212 WeakPolarHBondContact O-CG 3.36Å; V208-K212 PolarHBondContact O-N 2.98Å; V208-K212 VanDerWaalsContact O-N 3.12Å |
| 209 | A | 93.8 | Very high | 86.7 | Confident | 52 Ų | 52 | 95.9 Ų | 95.9 | 43% | 0.43 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -72.2 | -47.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | E205 A206 M211 K212 E213 | E205-A209 WeakPolarHBondContact O-CB 3.36Å; E205-A209 PolarHBondContact O-N 3.47Å; A206-A209 WeakPolarHBondContact O-CA 3.4Å; A206-A209 WeakPolarHBondContact O-CB 3.17Å; A206-A209 PolarHBondContact O-N 2.94Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 2.7Å; A209-K212 WeakPolarHBondContact O-CB 3.4Å; A209-K212 PolarHBondContact O-N 3.02Å; A209-K212 VanDerWaalsContact O-N 3.13Å; A209-E213 PolarHBondContact O-N 2.91Å |
| 210 | E | 95.3 | Very high | 88.8 | Confident | 111 Ų | 111 | 97.7 Ų | 97.7 | 52% | 0.519 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -56 | -46.7 | 172.3 | -69.2 | 170.3 | -178.3 | 0 | 0 | 111.1 | A206 K212 E213 Y214 | A206-E210 WeakPolarHBondContact O-CG 3.29Å; A206-E210 PolarHBondContact O-N 2.78Å; E210-K212 VanDerWaalsContact C-N 3.32Å; E210-K212 PolarHBondContact O-N 3.15Å; E210-E213 WeakPolarHBondContact O-CB 3.26Å; E210-E213 PolarHBondContact O-N 3.42Å; E210-E213 VanDerWaalsContact O-N 3.11Å; E210-Y214 HydrophobicContact CB-CE2 4.36Å; E210-Y214 WeakPolarHBondContact O-CD2 3.1Å; E210-Y214 PolarHBondContact O-N 3.08Å |
| 211 | M | 96.9 | Very high | 90.8 | Very high | 111 Ų | 111 | 98.2 Ų | 98.2 | 55% | 0.547 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.1 | -38.3 | 176.9 | -171.3 | -177.1 | -64.5 | 0 | 0 | 112.3 | S207 A209 Y214 I215 | S207-M211 VanDerWaalsContact O-CB 3.26Å; S207-M211 WeakPolarHBondContact O-CB 3.35Å; S207-M211 PolarHBondContact O-N 2.98Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 2.7Å; M211-Y214 PolarHBondContact O-N 3.1Å; M211-I215 HydrophobicContact CG-CD1 4.04Å; M211-I215 WeakPolarHBondContact O-CB 3.31Å; M211-I215 WeakPolarHBondContact O-CD1 3.36Å; M211-I215 WeakPolarHBondContact O-CG1 3.47Å; M211-I215 PolarHBondContact O-N 3.4Å |
| 212 | K | 97.2 | Very high | 92.6 | Very high | 130 Ų | 130 | 101.1 Ų | 101.1 | 57% | 0.565 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.2 | -40.8 | 173.3 | -73.9 | 161.4 | -172.3 | 166.1 | 0 | 111.6 | V208 A209 E210 I215 T216 | V208-K212 HydrophobicContact CG1-CD 4.33Å; V208-K212 VanDerWaalsContact O-CD 3.3Å; V208-K212 WeakPolarHBondContact O-CD 3.44Å; V208-K212 WeakPolarHBondContact O-CG 3.36Å; V208-K212 PolarHBondContact O-N 2.98Å; V208-K212 VanDerWaalsContact O-N 3.12Å; A209-K212 WeakPolarHBondContact O-CB 3.4Å; A209-K212 PolarHBondContact O-N 3.02Å; A209-K212 VanDerWaalsContact O-N 3.13Å; E210-K212 VanDerWaalsContact C-N 3.32Å; E210-K212 PolarHBondContact O-N 3.15Å; K212-I215 PolarHBondContact O-N 3.36Å; K212-T216 WeakPolarHBondContact O-CG2 3.32Å; K212-T216 PolarHBondContact O-N 3.29Å; K212-T216 PolarHBondContact O-OG1 3.46Å |
| 213 | E | 96.8 | Very high | 94 | Very high | 140 Ų | 140 | 100.2 Ų | 100.2 | 65% | 0.654 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -48.6 | 175.4 | -168.8 | -179.8 | 154.8 | 0 | 0 | 110.9 | A209 E210 I215 T216 K217 | A209-E213 PolarHBondContact O-N 2.91Å; E210-E213 WeakPolarHBondContact O-CB 3.26Å; E210-E213 PolarHBondContact O-N 3.42Å; E210-E213 VanDerWaalsContact O-N 3.11Å; E213-I215 VanDerWaalsContact C-N 3.33Å; E213-I215 PolarHBondContact O-N 3.07Å; E213-T216 PolarHBondContact O-N 3.27Å; E213-T216 VanDerWaalsContact O-N 3.11Å; E213-T216 PolarHBondContact O-OG1 2.88Å; E213-K217 WeakPolarHBondContact O-CB 3.33Å; E213-K217 PolarHBondContact O-N 2.8Å |
| 214 | Y | 97.6 | Very high | 95.1 | Very high | 133 Ų | 133 | 100.6 Ų | 100.6 | 52% | 0.522 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.1 | -42 | 173.9 | -72.2 | -59.2 | 0 | 0 | 0 | 112.4 | E210 M211 T216 K217 F218 | E210-Y214 HydrophobicContact CB-CE2 4.36Å; E210-Y214 WeakPolarHBondContact O-CD2 3.1Å; E210-Y214 PolarHBondContact O-N 3.08Å; M211-Y214 PolarHBondContact O-N 3.1Å; Y214-T216 PolarHBondContact O-N 3.18Å; Y214-K217 PolarHBondContact O-N 3Å; Y214-F218 WeakPolarHBondContact O-CB 3.47Å; Y214-F218 WeakPolarHBondContact O-CD2 3.39Å; Y214-F218 WeakPolarHBondContact O-CG 3.35Å; Y214-F218 PolarHBondContact O-N 2.88Å |
| 215 | I | 97.9 | Very high | 95.9 | Very high | 96 Ų | 96 | 102.8 Ų | 102.8 | 49% | 0.492 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.6 | -42.7 | 174.8 | -73.1 | 163.4 | 0 | 0 | 0 | 111.3 | M211 K212 E213 S219 | M211-I215 HydrophobicContact CG-CD1 4.04Å; M211-I215 WeakPolarHBondContact O-CB 3.31Å; M211-I215 WeakPolarHBondContact O-CD1 3.36Å; M211-I215 WeakPolarHBondContact O-CG1 3.47Å; M211-I215 PolarHBondContact O-N 3.4Å; K212-I215 PolarHBondContact O-N 3.36Å; E213-I215 VanDerWaalsContact C-N 3.33Å; E213-I215 PolarHBondContact O-N 3.07Å; I215-S219 VanDerWaalsContact O-CB 3.28Å; I215-S219 WeakPolarHBondContact O-CB 3.28Å; I215-S219 PolarHBondContact O-N 3.36Å; I215-S219 PolarHBondContact O-OG 3.17Å |
| 216 | T | 97.4 | Very high | 96.4 | Very high | 92 Ų | 92 | 101.2 Ų | 101.2 | 56% | 0.564 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -68.1 | -40.3 | 176.2 | 58 | 0 | 0 | 0 | 0 | 112.4 | K212 E213 Y214 S219 L220 | K212-T216 WeakPolarHBondContact O-CG2 3.32Å; K212-T216 PolarHBondContact O-N 3.29Å; K212-T216 PolarHBondContact O-OG1 3.46Å; E213-T216 PolarHBondContact O-N 3.27Å; E213-T216 VanDerWaalsContact O-N 3.11Å; E213-T216 PolarHBondContact O-OG1 2.88Å; Y214-T216 PolarHBondContact O-N 3.18Å; T216-S219 PolarHBondContact O-N 3.46Å; T216-L220 PolarHBondContact O-N 3.08Å |
| 217 | K | 98.1 | Very high | 96.9 | Very high | 128 Ų | 128 | 105.5 Ų | 105.5 | 56% | 0.557 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.4 | -51 | 176.1 | -176.7 | -178.8 | 176.3 | -177.4 | 0 | 111.7 | E213 Y214 S219 L220 E221 | E213-K217 WeakPolarHBondContact O-CB 3.33Å; E213-K217 PolarHBondContact O-N 2.8Å; Y214-K217 PolarHBondContact O-N 3Å; K217-S219 VanDerWaalsContact C-N 3.29Å; K217-S219 PolarHBondContact O-N 3.13Å; K217-L220 PolarHBondContact O-N 2.8Å; K217-E221 WeakPolarHBondContact O-CB 3.38Å; K217-E221 PolarHBondContact O-N 3.26Å |
| 218 | F | 98.1 | Very high | 97.3 | Very high | 125 Ų | 125 | 106 Ų | 106 | 55% | 0.548 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.6 | -29.4 | 177.5 | -66.6 | -49.6 | 0 | 0 | 0 | 112.7 | Y214 R222 | Y214-F218 WeakPolarHBondContact O-CB 3.47Å; Y214-F218 WeakPolarHBondContact O-CD2 3.39Å; Y214-F218 WeakPolarHBondContact O-CG 3.35Å; Y214-F218 PolarHBondContact O-N 2.88Å; F218-R222 WeakPolarHBondContact O-CB 3.42Å; F218-R222 PolarHBondContact O-N 3.32Å |
| 219 | S | 97.8 | Very high | 97.5 | Very high | 49 Ų | 49 | 108.2 Ų | 108.2 | 34% | 0.343 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.6 | -41.2 | 173.4 | -62.3 | 0 | 0 | 0 | 0 | 112.1 | I215 T216 K217 Q223 | I215-S219 VanDerWaalsContact O-CB 3.28Å; I215-S219 WeakPolarHBondContact O-CB 3.28Å; I215-S219 PolarHBondContact O-N 3.36Å; I215-S219 PolarHBondContact O-OG 3.17Å; T216-S219 PolarHBondContact O-N 3.46Å; K217-S219 VanDerWaalsContact C-N 3.29Å; K217-S219 PolarHBondContact O-N 3.13Å; S219-Q223 PolarHBondContact O-N 2.96Å; S219-Q223 VanDerWaalsContact O-N 3.12Å |
| 220 | L | 98 | Very high | 97.7 | Very high | 102 Ų | 102 | 110.8 Ų | 110.8 | 53% | 0.534 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68.3 | -44.3 | 173.8 | 178.1 | 61.9 | 0 | 0 | 0 | 111.5 | T216 K217 R222 Q223 I224 | T216-L220 PolarHBondContact O-N 3.08Å; K217-L220 PolarHBondContact O-N 2.8Å; L220-R222 PolarHBondContact O-N 3.5Å; L220-Q223 WeakPolarHBondContact O-CB 3.48Å; L220-Q223 PolarHBondContact O-N 3Å; L220-Q223 VanDerWaalsContact O-N 3.16Å; L220-I224 HydrophobicContact CD1-CD1 4.43Å; L220-I224 HydrophobicContact CG-CD1 4.18Å; L220-I224 WeakPolarHBondContact O-CG1 3.45Å; L220-I224 PolarHBondContact O-N 3.15Å |
| 221 | E | 98.4 | Very high | 97.8 | Very high | 82 Ų | 82 | 110.7 Ų | 110.7 | 38% | 0.383 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.7 | -45.2 | 176.7 | -177.6 | 172.8 | 173.8 | 0 | 0 | 111.4 | K217 Q223 I224 W225 | K217-E221 WeakPolarHBondContact O-CB 3.38Å; K217-E221 PolarHBondContact O-N 3.26Å; E221-Q223 VanDerWaalsContact C-N 3.34Å; E221-Q223 PolarHBondContact O-N 3.12Å; E221-I224 WeakPolarHBondContact O-CB 3.5Å; E221-I224 PolarHBondContact O-N 3.33Å; E221-I224 VanDerWaalsContact O-N 3.15Å; E221-W225 PolarHBondContact O-N 3.43Å; E221-W225 PolarHBondContact OE1-NE1 2.69Å |
| 222 | R | 97.8 | Very high | 97.8 | Very high | 156 Ų | 156 | 112.3 Ų | 112.3 | 59% | 0.589 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.3 | -45.2 | 173.1 | -170.7 | -172.8 | 66 | -143.1 | -9.3 | 111.6 | F218 L220 I224 W225 D226 | F218-R222 WeakPolarHBondContact O-CB 3.42Å; F218-R222 PolarHBondContact O-N 3.32Å; L220-R222 PolarHBondContact O-N 3.5Å; R222-I224 VanDerWaalsContact C-N 3.27Å; R222-I224 PolarHBondContact O-N 3.16Å; R222-W225 PolarHBondContact O-N 3.47Å; R222-W225 VanDerWaalsContact O-N 3.13Å; R222-D226 IonicContact NE-OD2 3.52Å; R222-D226 WeakPolarHBondContact O-CB 3.42Å; R222-D226 PolarHBondContact O-N 3.4Å |
| 223 | Q | 98 | Very high | 97.8 | Very high | 121 Ų | 121 | 111.2 Ų | 111.2 | 57% | 0.565 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60 | -36.3 | 176.9 | -178.1 | -177.6 | -19.3 | 0 | 0 | 112.4 | S219 L220 E221 Q227 | S219-Q223 PolarHBondContact O-N 2.96Å; S219-Q223 VanDerWaalsContact O-N 3.12Å; L220-Q223 WeakPolarHBondContact O-CB 3.48Å; L220-Q223 PolarHBondContact O-N 3Å; L220-Q223 VanDerWaalsContact O-N 3.16Å; E221-Q223 VanDerWaalsContact C-N 3.34Å; E221-Q223 PolarHBondContact O-N 3.12Å; Q223-Q227 WeakPolarHBondContact O-CB 3.41Å; Q223-Q227 PolarHBondContact O-N 2.96Å |
| 224 | I | 98.3 | Very high | 97.8 | Very high | 93 Ų | 93 | 110.8 Ų | 110.8 | 48% | 0.477 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.3 | -43.8 | 174.7 | -66.1 | 166.5 | 0 | 0 | 0 | 110.5 | L220 E221 R222 Q227 L228 | L220-I224 HydrophobicContact CD1-CD1 4.43Å; L220-I224 HydrophobicContact CG-CD1 4.18Å; L220-I224 WeakPolarHBondContact O-CG1 3.45Å; L220-I224 PolarHBondContact O-N 3.15Å; E221-I224 WeakPolarHBondContact O-CB 3.5Å; E221-I224 PolarHBondContact O-N 3.33Å; E221-I224 VanDerWaalsContact O-N 3.15Å; R222-I224 VanDerWaalsContact C-N 3.27Å; R222-I224 PolarHBondContact O-N 3.16Å; I224-Q227 PolarHBondContact O-N 3.31Å; I224-L228 VanDerWaalsContact O-CB 3.32Å; I224-L228 WeakPolarHBondContact O-CB 3.19Å; I224-L228 PolarHBondContact O-N 2.91Å |
| 225 | W | 98.5 | Very high | 97.7 | Very high | 157 Ų | 157 | 108.2 Ų | 108.2 | 60% | 0.595 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63.8 | -42.3 | 174.9 | -74.6 | 113.7 | 0 | 0 | 0 | 112.7 | E221 R222 Q227 L228 L229 | E221-W225 PolarHBondContact O-N 3.43Å; E221-W225 PolarHBondContact OE1-NE1 2.69Å; R222-W225 PolarHBondContact O-N 3.47Å; R222-W225 VanDerWaalsContact O-N 3.13Å; W225-Q227 VanDerWaalsContact C-N 3.33Å; W225-Q227 PolarHBondContact O-N 2.98Å; W225-L228 HydrophobicContact CE3-CD2 4.07Å; W225-L228 HydrophobicContact CZ3-CD2 3.96Å; W225-L228 PolarHBondContact O-N 2.86Å; W225-L229 VanDerWaalsContact O-CB 3.31Å; W225-L229 WeakPolarHBondContact O-CB 3.07Å; W225-L229 PolarHBondContact O-N 3.47Å |
| 226 | D | 98.3 | Very high | 97.5 | Very high | 91 Ų | 91 | 106.4 Ų | 106.4 | 49% | 0.487 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.1 | -42.9 | 175.3 | -66 | -31.7 | 0 | 0 | 0 | 110.7 | R222 L230 | R222-D226 IonicContact NE-OD2 3.52Å; R222-D226 WeakPolarHBondContact O-CB 3.42Å; R222-D226 PolarHBondContact O-N 3.4Å; D226-L230 WeakPolarHBondContact O-CB 3.39Å; D226-L230 PolarHBondContact O-N 2.94Å; D226-L230 VanDerWaalsContact O-N 3.08Å |
| 227 | Q | 97.9 | Very high | 97.3 | Very high | 136 Ų | 136 | 108.5 Ų | 108.5 | 64% | 0.636 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -68.5 | -40.9 | 176.7 | -175 | 175.1 | 15 | 0 | 0 | 112.6 | Q223 I224 W225 L230 H231 | Q223-Q227 WeakPolarHBondContact O-CB 3.41Å; Q223-Q227 PolarHBondContact O-N 2.96Å; I224-Q227 PolarHBondContact O-N 3.31Å; W225-Q227 VanDerWaalsContact C-N 3.33Å; W225-Q227 PolarHBondContact O-N 2.98Å; Q227-L230 PolarHBondContact O-N 3.11Å; Q227-H231 WeakPolarHBondContact O-CB 3.46Å; Q227-H231 PolarHBondContact O-N 3.46Å |
| 228 | L | 98.3 | Very high | 97 | Very high | 69 Ų | 69 | 106.6 Ų | 106.6 | 36% | 0.361 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -67.7 | -39.7 | 178.9 | -173.4 | 64.6 | 0 | 0 | 0 | 111.6 | I224 W225 H231 Y232 | I224-L228 VanDerWaalsContact O-CB 3.32Å; I224-L228 WeakPolarHBondContact O-CB 3.19Å; I224-L228 PolarHBondContact O-N 2.91Å; W225-L228 HydrophobicContact CE3-CD2 4.07Å; W225-L228 HydrophobicContact CZ3-CD2 3.96Å; W225-L228 PolarHBondContact O-N 2.86Å; L228-H231 PolarHBondContact O-N 3.31Å; L228-Y232 HydrophobicContact CD1-CD2 4.06Å; L228-Y232 HydrophobicContact CD1-CE2 3.59Å; L228-Y232 HydrophobicContact CD2-CE2 4.48Å; L228-Y232 HydrophobicContact CG-CD2 4.05Å; L228-Y232 HydrophobicContact CG-CE2 3.87Å; L228-Y232 WeakPolarHBondContact O-CD2 3.47Å; L228-Y232 PolarHBondContact O-N 2.85Å; L228-Y232 VanDerWaalsContact O-N 3.07Å |
| 229 | L | 98.1 | Very high | 96.7 | Very high | 99 Ų | 99 | 104.6 Ų | 104.6 | 52% | 0.518 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.8 | -49.4 | 172.6 | -176 | 76.3 | 0 | 0 | 0 | 110.7 | W225 H231 Y232 Q233 | W225-L229 VanDerWaalsContact O-CB 3.31Å; W225-L229 WeakPolarHBondContact O-CB 3.07Å; W225-L229 PolarHBondContact O-N 3.47Å; L229-H231 VanDerWaalsContact C-N 3.34Å; L229-H231 PolarHBondContact O-N 2.9Å; L229-Y232 PolarHBondContact O-N 3.22Å; L229-Q233 WeakPolarHBondContact O-CB 3.12Å; L229-Q233 VanDerWaalsContact O-CG 3.29Å; L229-Q233 WeakPolarHBondContact O-CG 3.3Å; L229-Q233 PolarHBondContact O-N 2.85Å |
| 230 | L | 97.8 | Very high | 96.4 | Very high | 106 Ų | 106 | 108.6 Ų | 108.6 | 56% | 0.555 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.4 | -39 | 179.3 | -173.6 | 66.3 | 0 | 0 | 0 | 111.9 | D226 Q227 Q233 Q234 | D226-L230 WeakPolarHBondContact O-CB 3.39Å; D226-L230 PolarHBondContact O-N 2.94Å; D226-L230 VanDerWaalsContact O-N 3.08Å; Q227-L230 PolarHBondContact O-N 3.11Å; L230-Q233 PolarHBondContact O-N 3.5Å; L230-Q234 WeakPolarHBondContact O-CB 3.18Å; L230-Q234 PolarHBondContact O-N 3.37Å |
| 231 | H | 97.7 | Very high | 95.8 | Very high | 109 Ų | 109 | 106.9 Ų | 106.9 | 51% | 0.505 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -58.7 | -52.9 | 174.4 | -175.4 | -72.9 | 0 | 0 | 0 | 111.3 | Q227 L228 L229 Q233 Q234 E235 | Q227-H231 WeakPolarHBondContact O-CB 3.46Å; Q227-H231 PolarHBondContact O-N 3.46Å; L228-H231 PolarHBondContact O-N 3.31Å; L229-H231 VanDerWaalsContact C-N 3.34Å; L229-H231 PolarHBondContact O-N 2.9Å; H231-Q233 VanDerWaalsContact C-N 3.32Å; H231-Q233 PolarHBondContact O-N 2.83Å; H231-Q234 PolarHBondContact O-N 3.13Å; H231-E235 IonicContact CE1-OE2 3.13Å; H231-E235 PolarHBondContact CE1-OE2 3.43Å; H231-E235 VanDerWaalsContact CE1-OE2 3.27Å; H231-E235 IonicContact ND1-OE2 2.64Å; H231-E235 PolarHBondContact ND1-OE2 3.37Å; H231-E235 VanDerWaalsContact O-CB 3.26Å; H231-E235 WeakPolarHBondContact O-CB 3.24Å; H231-E235 PolarHBondContact O-N 3.42Å |
| 232 | Y | 96.8 | Very high | 95.1 | Very high | 144 Ų | 144 | 108.3 Ų | 108.3 | 57% | 0.565 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -68 | -29.9 | -179.6 | -76.6 | -55.4 | 0 | 0 | 0 | 113.5 | L228 L229 E235 A236 | L228-Y232 HydrophobicContact CD1-CD2 4.06Å; L228-Y232 HydrophobicContact CD1-CE2 3.59Å; L228-Y232 HydrophobicContact CD2-CE2 4.48Å; L228-Y232 HydrophobicContact CG-CD2 4.05Å; L228-Y232 HydrophobicContact CG-CE2 3.87Å; L228-Y232 WeakPolarHBondContact O-CD2 3.47Å; L228-Y232 PolarHBondContact O-N 2.85Å; L228-Y232 VanDerWaalsContact O-N 3.07Å; L229-Y232 PolarHBondContact O-N 3.22Å; Y232-E235 WeakPolarHBondContact CD1-OE2 3.2Å; Y232-A236 VanDerWaalsContact O-CB 3.24Å; Y232-A236 WeakPolarHBondContact O-CB 3.24Å; Y232-A236 PolarHBondContact O-N 3.3Å |
| 233 | Q | 96.8 | Very high | 94.1 | Very high | 108 Ų | 108 | 102.8 Ų | 102.8 | 51% | 0.505 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.8 | -47.8 | 171.2 | -75 | 174.2 | -4.7 | 0 | 0 | 111.4 | L229 L230 H231 A236 E237 | L229-Q233 WeakPolarHBondContact O-CB 3.12Å; L229-Q233 VanDerWaalsContact O-CG 3.29Å; L229-Q233 WeakPolarHBondContact O-CG 3.3Å; L229-Q233 PolarHBondContact O-N 2.85Å; L230-Q233 PolarHBondContact O-N 3.5Å; H231-Q233 VanDerWaalsContact C-N 3.32Å; H231-Q233 PolarHBondContact O-N 2.83Å; Q233-A236 PolarHBondContact O-N 3.12Å; Q233-E237 WeakPolarHBondContact O-CB 3.26Å; Q233-E237 PolarHBondContact O-N 2.77Å |
| 234 | Q | 96.1 | Very high | 92.6 | Very high | 131 Ų | 131 | 99.8 Ų | 99.8 | 61% | 0.612 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.9 | -40.4 | 177.4 | -175.4 | 179.5 | -5.3 | 0 | 0 | 111.9 | L230 H231 E237 E238 | L230-Q234 WeakPolarHBondContact O-CB 3.18Å; L230-Q234 PolarHBondContact O-N 3.37Å; H231-Q234 PolarHBondContact O-N 3.13Å; Q234-E237 PolarHBondContact O-N 2.94Å; Q234-E238 WeakPolarHBondContact O-CB 3.44Å; Q234-E238 PolarHBondContact O-N 3.11Å |
| 235 | E | 95.6 | Very high | 91.1 | Very high | 79 Ų | 79 | 97.7 Ų | 97.7 | 37% | 0.369 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.7 | -42 | 176.2 | -175.6 | 175.5 | -174.3 | 0 | 0 | 111.3 | H231 Y232 E238 I239 | H231-E235 IonicContact CE1-OE2 3.13Å; H231-E235 PolarHBondContact CE1-OE2 3.43Å; H231-E235 VanDerWaalsContact CE1-OE2 3.27Å; H231-E235 IonicContact ND1-OE2 2.64Å; H231-E235 PolarHBondContact ND1-OE2 3.37Å; H231-E235 VanDerWaalsContact O-CB 3.26Å; H231-E235 WeakPolarHBondContact O-CB 3.24Å; H231-E235 PolarHBondContact O-N 3.42Å; Y232-E235 WeakPolarHBondContact CD1-OE2 3.2Å; E235-E238 PolarHBondContact O-N 3.32Å; E235-I239 HydrophobicContact CG-CD1 3.87Å; E235-I239 WeakPolarHBondContact O-CB 3.38Å; E235-I239 WeakPolarHBondContact O-CD1 3.39Å; E235-I239 WeakPolarHBondContact O-CG1 3.47Å; E235-I239 PolarHBondContact O-N 2.88Å |
| 236 | A | 93.7 | Very high | 89.2 | Confident | 58 Ų | 58 | 95.4 Ų | 95.4 | 48% | 0.479 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.9 | -40.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y232 Q233 L240 | Y232-A236 VanDerWaalsContact O-CB 3.24Å; Y232-A236 WeakPolarHBondContact O-CB 3.24Å; Y232-A236 PolarHBondContact O-N 3.3Å; Q233-A236 PolarHBondContact O-N 3.12Å; A236-L240 VanDerWaalsContact O-CB 3.28Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 2.71Å |
| 237 | E | 92.6 | Very high | 87.3 | Confident | 136 Ų | 136 | 93.8 Ų | 93.8 | 64% | 0.636 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -67.3 | -37.7 | 175.1 | -174.7 | 173.1 | -158 | 0 | 0 | 111.9 | Q233 Q234 S241 | Q233-E237 WeakPolarHBondContact O-CB 3.26Å; Q233-E237 PolarHBondContact O-N 2.77Å; Q234-E237 PolarHBondContact O-N 2.94Å; E237-S241 WeakPolarHBondContact O-CB 3.22Å; E237-S241 PolarHBondContact O-N 3.41Å; E237-S241 PolarHBondContact O-OG 2.81Å |
| 238 | E | 92.9 | Very high | 85.3 | Confident | 87 Ų | 87 | 94.4 Ų | 94.4 | 41% | 0.407 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.1 | -45.4 | 175.3 | -172.9 | -78 | 146.9 | 0 | 0 | 111.3 | Q234 E235 L240 S241 R242 | Q234-E238 WeakPolarHBondContact O-CB 3.44Å; Q234-E238 PolarHBondContact O-N 3.11Å; E235-E238 PolarHBondContact O-N 3.32Å; E238-L240 VanDerWaalsContact C-N 3.34Å; E238-L240 PolarHBondContact O-N 3.38Å; E238-S241 PolarHBondContact O-N 2.73Å; E238-R242 WeakPolarHBondContact O-CB 3.12Å; E238-R242 PolarHBondContact O-N 2.83Å; E238-R242 IonicContact OE1-CZ 2.6Å; E238-R242 IonicContact OE1-NH1 3.68Å; E238-R242 PolarHBondContact OE1-NH1 3.25Å; E238-R242 IonicContact OE2-CZ 3.19Å; E238-R242 IonicContact OE2-NH1 2.72Å; E238-R242 PolarHBondContact OE2-NH1 2.89Å |
| 239 | I | 91.8 | Very high | 83.3 | Confident | 83 Ų | 83 | 97.2 Ų | 97.2 | 43% | 0.426 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 174.6 | -70.8 | 163.4 | 0 | 0 | 0 | 110.8 | E235 G243 | E235-I239 HydrophobicContact CG-CD1 3.87Å; E235-I239 WeakPolarHBondContact O-CB 3.38Å; E235-I239 WeakPolarHBondContact O-CD1 3.39Å; E235-I239 WeakPolarHBondContact O-CG1 3.47Å; E235-I239 PolarHBondContact O-N 2.88Å; I239-G243 PolarHBondContact O-N 3.48Å |
| 240 | L | 90.6 | Very high | 81 | Confident | 134 Ų | 134 | 96 Ų | 96 | 70% | 0.702 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.1 | -42.9 | 178.1 | -177 | 63.7 | 0 | 0 | 0 | 111.8 | A236 E238 G243 S244 | A236-L240 VanDerWaalsContact O-CB 3.28Å; A236-L240 WeakPolarHBondContact O-CB 3.46Å; A236-L240 PolarHBondContact O-N 2.71Å; E238-L240 VanDerWaalsContact C-N 3.34Å; E238-L240 PolarHBondContact O-N 3.38Å; L240-G243 PolarHBondContact O-N 2.74Å; L240-S244 PolarHBondContact O-N 2.98Å |
| 241 | S | 85.9 | Confident | 78.5 | Confident | 66 Ų | 66 | 98.8 Ų | 98.8 | 46% | 0.462 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.8 | -43.6 | 178.3 | -62.5 | 0 | 0 | 0 | 0 | 111.9 | E237 E238 S244 A245 | E237-S241 WeakPolarHBondContact O-CB 3.22Å; E237-S241 PolarHBondContact O-N 3.41Å; E237-S241 PolarHBondContact O-OG 2.81Å; E238-S241 PolarHBondContact O-N 2.73Å; S241-S244 PolarHBondContact O-N 3.39Å; S241-A245 WeakPolarHBondContact O-CB 3.47Å; S241-A245 PolarHBondContact O-N 3.12Å |
| 242 | R | 83.1 | Confident | 76 | Confident | 111 Ų | 111 | 100 Ų | 100 | 42% | 0.419 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -62.3 | -46.1 | 173.9 | -175 | 177.1 | 67.3 | -120.8 | -3.6 | 110.5 | E238 S244 A245 E246 | E238-R242 WeakPolarHBondContact O-CB 3.12Å; E238-R242 PolarHBondContact O-N 2.83Å; E238-R242 IonicContact OE1-CZ 2.6Å; E238-R242 IonicContact OE1-NH1 3.68Å; E238-R242 PolarHBondContact OE1-NH1 3.25Å; E238-R242 IonicContact OE2-CZ 3.19Å; E238-R242 IonicContact OE2-NH1 2.72Å; E238-R242 PolarHBondContact OE2-NH1 2.89Å; R242-S244 VanDerWaalsContact C-N 3.28Å; R242-S244 PolarHBondContact O-N 3Å; R242-A245 PolarHBondContact O-N 2.89Å; R242-A245 VanDerWaalsContact O-N 3.14Å; R242-E246 WeakPolarHBondContact O-CB 3.3Å; R242-E246 PolarHBondContact O-N 3.28Å |
| 243 | G | 76.4 | Confident | 73.4 | Confident | 40 Ų | 40 | 99.5 Ų | 99.5 | 41% | 0.412 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -57.1 | -39.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113 | I239 L240 A247 | I239-G243 PolarHBondContact O-N 3.48Å; L240-G243 PolarHBondContact O-N 2.74Å; G243-A247 WeakPolarHBondContact O-CB 3.48Å; G243-A247 PolarHBondContact O-N 2.74Å |
| 244 | S | 68.2 | Low | 71.1 | Confident | 58 Ų | 58 | 100.8 Ų | 100.8 | 41% | 0.406 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -70.9 | -38.2 | 174.7 | -167.7 | 0 | 0 | 0 | 0 | 113.4 | L240 S241 R242 K248 | L240-S244 PolarHBondContact O-N 2.98Å; S241-S244 PolarHBondContact O-N 3.39Å; R242-S244 VanDerWaalsContact C-N 3.28Å; R242-S244 PolarHBondContact O-N 3Å; S244-K248 WeakPolarHBondContact O-CD 3.35Å; S244-K248 WeakPolarHBondContact O-CG 3.5Å; S244-K248 PolarHBondContact O-N 2.83Å |
| 245 | A | 65.3 | Low | 68.7 | Low | 49 Ų | 49 | 100.3 Ų | 100.3 | 41% | 0.405 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.8 | -45.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | S241 R242 K248 I249 | S241-A245 WeakPolarHBondContact O-CB 3.47Å; S241-A245 PolarHBondContact O-N 3.12Å; R242-A245 PolarHBondContact O-N 2.89Å; R242-A245 VanDerWaalsContact O-N 3.14Å; A245-K248 PolarHBondContact O-N 2.93Å; A245-I249 WeakPolarHBondContact O-CD1 3.4Å; A245-I249 VanDerWaalsContact O-CG1 3.26Å; A245-I249 WeakPolarHBondContact O-CG1 3.49Å; A245-I249 PolarHBondContact O-N 3.39Å |
| 246 | E | 59.3 | Low | 66.7 | Low | 109 Ų | 109 | 101.8 Ų | 101.8 | 51% | 0.509 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64.1 | -44.3 | 177.7 | -169.3 | 164.4 | -161.6 | 0 | 0 | 110.5 | R242 K248 I249 T250 | R242-E246 WeakPolarHBondContact O-CB 3.3Å; R242-E246 PolarHBondContact O-N 3.28Å; E246-K248 VanDerWaalsContact C-N 3.34Å; E246-K248 PolarHBondContact O-N 3.49Å; E246-I249 PolarHBondContact O-N 2.82Å; E246-T250 WeakPolarHBondContact O-CB 3.08Å; E246-T250 PolarHBondContact O-N 3.25Å; E246-T250 PolarHBondContact O-OG1 2.86Å |
| 247 | A | 57.8 | Low | 64.7 | Low | 57 Ų | 57 | 106.4 Ų | 106.4 | 47% | 0.471 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -54.6 | -46.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | G243 I249 T250 E251 | G243-A247 WeakPolarHBondContact O-CB 3.48Å; G243-A247 PolarHBondContact O-N 2.74Å; A247-I249 VanDerWaalsContact C-N 3.28Å; A247-I249 PolarHBondContact O-N 2.9Å; A247-T250 PolarHBondContact O-N 2.83Å; A247-E251 WeakPolarHBondContact O-CB 3.06Å; A247-E251 PolarHBondContact O-N 3.01Å |
| 248 | K | 56.3 | Low | 63 | Low | 149 Ų | 149 | 105 Ų | 105 | 65% | 0.648 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66.8 | -24.8 | 177.3 | -74.9 | 168.7 | 179.4 | 159.6 | 0 | 114 | S244 A245 E246 | S244-K248 WeakPolarHBondContact O-CD 3.35Å; S244-K248 WeakPolarHBondContact O-CG 3.5Å; S244-K248 PolarHBondContact O-N 2.83Å; A245-K248 PolarHBondContact O-N 2.93Å; E246-K248 VanDerWaalsContact C-N 3.34Å; E246-K248 PolarHBondContact O-N 3.49Å |
| 249 | I | 55.8 | Low | 61.4 | Low | 129 Ų | 129 | 107.9 Ų | 107.9 | 66% | 0.662 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -82.8 | -37.1 | 175.2 | -68.8 | 163.3 | 0 | 0 | 0 | 110.5 | A245 E246 A247 | A245-I249 WeakPolarHBondContact O-CD1 3.4Å; A245-I249 VanDerWaalsContact O-CG1 3.26Å; A245-I249 WeakPolarHBondContact O-CG1 3.49Å; A245-I249 PolarHBondContact O-N 3.39Å; E246-I249 PolarHBondContact O-N 2.82Å; A247-I249 VanDerWaalsContact C-N 3.28Å; A247-I249 PolarHBondContact O-N 2.9Å |
| 250 | T | 50.3 | Low | 59.9 | Low | 72 Ų | 72 | 113.8 Ų | 113.8 | 44% | 0.442 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -81.1 | -27.1 | -176.3 | -54 | 0 | 0 | 0 | 0 | 113.6 | E246 A247 V252 K253 | E246-T250 WeakPolarHBondContact O-CB 3.08Å; E246-T250 PolarHBondContact O-N 3.25Å; E246-T250 PolarHBondContact O-OG1 2.86Å; A247-T250 PolarHBondContact O-N 2.83Å; T250-V252 PolarHBondContact O-N 3.31Å; T250-K253 PolarHBondContact O-N 2.69Å |
| 251 | E | 44.7 | Very low | 58.9 | Low | 166 Ų | 166 | 111.4 Ų | 111.4 | 78% | 0.776 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.5 | -22.6 | -177.5 | -172.4 | 168.8 | -159.3 | 0 | 0 | 114.3 | A247 | A247-E251 WeakPolarHBondContact O-CB 3.06Å; A247-E251 PolarHBondContact O-N 3.01Å |
| 252 | V | 46.9 | Very low | 58.5 | Low | 135 Ų | 135 | 110.3 Ų | 110.3 | 82% | 0.818 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.1 | -12.3 | -177.4 | 179.8 | 0 | 0 | 0 | 0 | 113.8 | T250 | T250-V252 PolarHBondContact O-N 3.31Š|
| 253 | K | 41.2 | Very low | 58.4 | Low | 132 Ų | 132 | 111 Ų | 111 | 57% | 0.574 | 62% | 0.621 | S | S | * | * | trans | -143.6 | 88.8 | -179.5 | -155.8 | -171.6 | -168.6 | -167.9 | 0 | 113.5 | T250 E255 | T250-K253 PolarHBondContact O-N 2.69Å; K253-E255 HydrophobicContact CD-CB 4.39Å; K253-E255 VanDerWaalsContact CE-OE1 3.24Å; K253-E255 WeakPolarHBondContact CE-OE1 3.43Å; K253-E255 HydrophobicContact CG-CB 4.36Å; K253-E255 IonicContact NZ-OE1 2.81Å; K253-E255 PolarHBondContact NZ-OE1 3.03Å; K253-E255 PolarHBondContact O-N 3.09Å | ||
| 254 | V | 48.9 | Very low | 58.8 | Low | 135 Ų | 135 | 115 Ų | 115 | 82% | 0.818 | 63% | 0.629 | S | S | * | * | trans | -71 | 75.8 | 156.6 | -174.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 255 | E | 44.9 | Very low | 59.6 | Low | 121 Ų | 121 | 114.7 Ų | 114.7 | 57% | 0.565 | 62% | 0.623 | S | S | * | * | trans | -63.4 | 141.9 | 164.6 | -165.7 | 159.2 | -98.9 | 0 | 0 | 108.2 | K253 M257 | K253-E255 HydrophobicContact CD-CB 4.39Å; K253-E255 VanDerWaalsContact CE-OE1 3.24Å; K253-E255 WeakPolarHBondContact CE-OE1 3.43Å; K253-E255 HydrophobicContact CG-CB 4.36Å; K253-E255 IonicContact NZ-OE1 2.81Å; K253-E255 PolarHBondContact NZ-OE1 3.03Å; K253-E255 PolarHBondContact O-N 3.09Å; E255-M257 PolarHBondContact O-N 3.19Å | ||
| 256 | P | 53.7 | Low | 60.5 | Low | 111 Ų | 111 | 119.8 Ų | 119.8 | 72% | 0.721 | 64% | 0.638 | S | S | * | * | trans | -63.2 | 100.9 | -173.9 | -23.3 | 34.6 | 0 | 0 | 0 | 110.8 | T258 | P256-T258 PolarHBondContact O-N 3.45Š| ||
| 257 | M | 52.7 | Low | 61.8 | Low | 155 Ų | 155 | 119.7 Ų | 119.7 | 76% | 0.764 | 65% | 0.645 | S | S | * | * | trans | -58.3 | 99.3 | -178 | -165.6 | 66.3 | 168 | 0 | 0 | 108.5 | E255 Y259 | E255-M257 PolarHBondContact O-N 3.19Å; M257-Y259 WeakPolarHBondContact O-CD2 3.24Å; M257-Y259 WeakPolarHBondContact O-CE2 3.24Å; M257-Y259 PolarHBondContact O-N 3.2Å | ||
| 258 | T | 57.4 | Low | 63.1 | Low | 105 Ų | 105 | 120.7 Ų | 120.7 | 64% | 0.644 | 64% | 0.642 | S | S | * | * | trans | -66.3 | 110.1 | -174.7 | 49.9 | 0 | 0 | 0 | 0 | 108.1 | P256 R260 | P256-T258 PolarHBondContact O-N 3.45Å; T258-R260 PolarHBondContact O-N 3.2Å | ||
| 259 | Y | 57.4 | Low | 64.4 | Low | 149 Ų | 149 | 119.2 Ų | 119.2 | 58% | 0.584 | 64% | 0.641 | S | S | * | * | trans | -70 | 41.4 | -175.9 | -68.7 | -87.1 | 0 | 0 | 0 | 113.2 | M257 G261 S262 N265 L268 | M257-Y259 WeakPolarHBondContact O-CD2 3.24Å; M257-Y259 WeakPolarHBondContact O-CE2 3.24Å; M257-Y259 PolarHBondContact O-N 3.2Å; Y259-G261 PolarHBondContact O-N 2.93Å; Y259-S262 WeakPolarHBondContact O-CB 3.3Å; Y259-S262 PolarHBondContact O-N 2.94Å; Y259-N265 PolarHBondContact O-OD1 3.42Å; Y259-L268 HydrophobicContact CD1-CD1 4.4Å; Y259-L268 HydrophobicContact CD2-CD1 4.04Å; Y259-L268 HydrophobicContact CG-CD1 3.8Å | ||
| 260 | R | 61.6 | Low | 65.9 | Low | 207 Ų | 207 | 118.1 Ų | 118.1 | 78% | 0.781 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.2 | -7.4 | -168.2 | -170.4 | 179.5 | -81.8 | -104.4 | 4.5 | 114.4 | T258 | T258-R260 PolarHBondContact O-N 3.2Š|
| 261 | G | 68.6 | Low | 67.8 | Low | 84 Ų | 84 | 122.3 Ų | 122.3 | 87% | 0.866 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.7 | 9.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 115 | Y259 | Y259-G261 PolarHBondContact O-N 2.93Š|
| 262 | S | 77.8 | Confident | 69.9 | Low | 42 Ų | 42 | 117.4 Ų | 117.4 | 29% | 0.294 | 64% | 0.635 | S | S | . | * | trans | -72.8 | 141.9 | 175.7 | 177.8 | 0 | 0 | 0 | 0 | 111.2 | Y259 Q264 N265 | Y259-S262 WeakPolarHBondContact O-CB 3.3Å; Y259-S262 PolarHBondContact O-N 2.94Å; S262-Q264 PolarHBondContact O-N 3.4Å; S262-Q264 VanDerWaalsContact O-N 3.15Å; S262-Q264 PolarHBondContact OG-N 3.24Å; S262-Q264 VanDerWaalsContact OG-N 3.1Å; S262-N265 WeakPolarHBondContact O-CB 3.49Å; S262-N265 PolarHBondContact O-N 3.06Å | ||
| 263 | S | 81.4 | Confident | 72.1 | Confident | 127 Ų | 127 | 115.5 Ų | 115.5 | 89% | 0.888 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | -18.8 | 168.8 | 54 | 0 | 0 | 0 | 0 | 113.1 | ||
| 264 | Q | 84.6 | Confident | 74.5 | Confident | 123 Ų | 123 | 116 Ų | 116 | 58% | 0.575 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | 13.1 | 174.9 | -64.1 | -177.4 | -26.8 | 0 | 0 | 113.1 | S262 E266 V267 L268 | S262-Q264 PolarHBondContact O-N 3.4Å; S262-Q264 VanDerWaalsContact O-N 3.15Å; S262-Q264 PolarHBondContact OG-N 3.24Å; S262-Q264 VanDerWaalsContact OG-N 3.1Å; Q264-E266 PolarHBondContact O-N 3.1Å; Q264-V267 PolarHBondContact O-N 3.49Å; Q264-L268 WeakPolarHBondContact O-CG 3.36Å; Q264-L268 PolarHBondContact O-N 3.02Å |
| 265 | N | 85.5 | Confident | 76.7 | Confident | 51 Ų | 51 | 116 Ų | 116 | 27% | 0.273 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -54.4 | -36.1 | -178.9 | 176 | 67.5 | 0 | 0 | 0 | 112.8 | Y259 S262 L268 N269 | Y259-N265 PolarHBondContact O-OD1 3.42Å; S262-N265 WeakPolarHBondContact O-CB 3.49Å; S262-N265 PolarHBondContact O-N 3.06Å; N265-L268 PolarHBondContact O-N 3.35Å; N265-N269 PolarHBondContact ND2-ND2 3.29Å; N265-N269 WeakPolarHBondContact O-CB 3.32Å; N265-N269 VanDerWaalsContact O-CG 3.3Å; N265-N269 PolarHBondContact O-N 3.08Å; N265-N269 PolarHBondContact O-ND2 3.02Å; N265-N269 PolarHBondContact OD1-ND2 3.03Å |
| 266 | E | 83.6 | Confident | 79.1 | Confident | 157 Ų | 157 | 116 Ų | 116 | 73% | 0.734 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -61.5 | -48.4 | 174 | -174.7 | 173.9 | -172.5 | 0 | 0 | 112.1 | Q264 L268 N269 T270 | Q264-E266 PolarHBondContact O-N 3.1Å; E266-L268 PolarHBondContact O-N 3.32Å; E266-N269 PolarHBondContact O-N 2.99Å; E266-T270 WeakPolarHBondContact O-CB 3.44Å; E266-T270 PolarHBondContact O-N 2.73Å; E266-T270 PolarHBondContact O-OG1 3.12Å |
| 267 | V | 87.8 | Confident | 81.1 | Confident | 106 Ų | 106 | 114.7 Ų | 114.7 | 64% | 0.642 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.1 | -42.4 | 177.9 | -176.6 | 0 | 0 | 0 | 0 | 111.3 | Q264 T270 | Q264-V267 PolarHBondContact O-N 3.49Å; V267-T270 PolarHBondContact O-N 2.89Å |
| 268 | L | 83.9 | Confident | 83.1 | Confident | 78 Ų | 78 | 113.3 Ų | 113.3 | 41% | 0.408 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -67.3 | -37 | -179.9 | -66.8 | 171.9 | 0 | 0 | 0 | 112.6 | Y259 Q264 N265 E266 T270 | Y259-L268 HydrophobicContact CD1-CD1 4.4Å; Y259-L268 HydrophobicContact CD2-CD1 4.04Å; Y259-L268 HydrophobicContact CG-CD1 3.8Å; Q264-L268 WeakPolarHBondContact O-CG 3.36Å; Q264-L268 PolarHBondContact O-N 3.02Å; N265-L268 PolarHBondContact O-N 3.35Å; E266-L268 PolarHBondContact O-N 3.32Å; L268-T270 VanDerWaalsContact C-N 3.34Å |
| 269 | N | 82.9 | Confident | 84.9 | Confident | 119 Ų | 119 | 113.2 Ų | 113.2 | 64% | 0.636 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -76.3 | -20.8 | 174 | -68.9 | -51 | 0 | 0 | 0 | 113 | N265 E266 K271 | N265-N269 PolarHBondContact ND2-ND2 3.29Å; N265-N269 WeakPolarHBondContact O-CB 3.32Å; N265-N269 VanDerWaalsContact O-CG 3.3Å; N265-N269 PolarHBondContact O-N 3.08Å; N265-N269 PolarHBondContact O-ND2 3.02Å; N265-N269 PolarHBondContact OD1-ND2 3.03Å; E266-N269 PolarHBondContact O-N 2.99Å; N269-K271 PolarHBondContact O-N 2.78Å |
| 270 | T | 88.4 | Confident | 86.7 | Confident | 106 Ų | 106 | 109.5 Ų | 109.5 | 65% | 0.65 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | 15 | 177.2 | -51.6 | 0 | 0 | 0 | 0 | 112.5 | E266 V267 L268 P272 | E266-T270 WeakPolarHBondContact O-CB 3.44Å; E266-T270 PolarHBondContact O-N 2.73Å; E266-T270 PolarHBondContact O-OG1 3.12Å; V267-T270 PolarHBondContact O-N 2.89Å; L268-T270 VanDerWaalsContact C-N 3.34Å; T270-P272 WeakPolarHBondContact O-CD 3.42Å |
| 271 | K | 89.5 | Confident | 88.3 | Confident | 159 Ų | 159 | 104.5 Ų | 104.5 | 69% | 0.691 | 56% | 0.558 | S | S | * | * | trans | -64.3 | 119.3 | 176.9 | -177.5 | -179.2 | 177.8 | -178.2 | 0 | 111 | N269 Y274 | N269-K271 PolarHBondContact O-N 2.78Å; K271-Y274 HydrophobicContact CG-CE2 4.39Å | ||
| 272 | P | 89.5 | Confident | 89.6 | Confident | 64 Ų | 64 | 103.5 Ų | 103.5 | 42% | 0.416 | 54% | 0.538 | S | S | . | . | trans | -76 | 157.4 | 179.4 | 32.1 | -35.4 | 0 | 0 | 0 | 112.2 | T270 Y274 | T270-P272 WeakPolarHBondContact O-CD 3.42Å; P272-Y274 HydrophobicContact CG-CD2 4.47Å; P272-Y274 HydrophobicContact CG-CE1 4.08Å; P272-Y274 HydrophobicContact CG-CE2 3.82Å; P272-Y274 WeakPolarHBondContact O-CD2 3.27Å; P272-Y274 PolarHBondContact O-N 2.99Å; P272-Y274 VanDerWaalsContact O-N 3.07Å | ||
| 273 | D | 91.9 | Very high | 90.4 | Very high | 94 Ų | 94 | 107 Ų | 107 | 50% | 0.503 | 55% | 0.548 | S | S | . | . | trans | -79.6 | 87.2 | 176.6 | -176.4 | -6.1 | 0 | 0 | 0 | 111.5 | Q275 K276 I277 | D273-Q275 PolarHBondContact O-N 2.78Å; D273-Q275 WeakPolarHBondContact OD1-CA 3.49Å; D273-Q275 WeakPolarHBondContact OD1-CB 3.48Å; D273-Q275 PolarHBondContact OD1-N 3.17Å; D273-K276 HydrophobicContact CB-CB 4.07Å; D273-K276 PolarHBondContact O-N 2.98Å; D273-K276 PolarHBondContact OD1-N 3.08Å; D273-K276 WeakPolarHBondContact OD2-CB 3.48Å; D273-I277 WeakPolarHBondContact O-CG1 3.32Å; D273-I277 PolarHBondContact O-N 3.15Å | ||
| 274 | Y | 93.3 | Very high | 91.1 | Very high | 142 Ų | 142 | 105 Ų | 105 | 56% | 0.557 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.1 | -26.2 | 174.7 | -61.4 | -79.6 | 0 | 0 | 0 | 113.5 | K271 P272 I277 L278 | K271-Y274 HydrophobicContact CG-CE2 4.39Å; P272-Y274 HydrophobicContact CG-CD2 4.47Å; P272-Y274 HydrophobicContact CG-CE1 4.08Å; P272-Y274 HydrophobicContact CG-CE2 3.82Å; P272-Y274 WeakPolarHBondContact O-CD2 3.27Å; P272-Y274 PolarHBondContact O-N 2.99Å; P272-Y274 VanDerWaalsContact O-N 3.07Å; Y274-I277 HydrophobicContact CD1-CD1 4.48Å; Y274-I277 PolarHBondContact O-N 3.02Å; Y274-L278 WeakPolarHBondContact O-CG 3.33Å; Y274-L278 PolarHBondContact O-N 3.04Å |
| 275 | Q | 94.3 | Very high | 91.7 | Very high | 136 Ų | 136 | 106.1 Ų | 106.1 | 64% | 0.636 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -73.8 | -39.7 | 179.8 | -176.7 | 168.3 | -21.3 | 0 | 0 | 110.9 | D273 I277 L278 Q279 | D273-Q275 PolarHBondContact O-N 2.78Å; D273-Q275 WeakPolarHBondContact OD1-CA 3.49Å; D273-Q275 WeakPolarHBondContact OD1-CB 3.48Å; D273-Q275 PolarHBondContact OD1-N 3.17Å; Q275-I277 VanDerWaalsContact C-N 3.32Å; Q275-L278 PolarHBondContact O-N 3.05Å; Q275-Q279 WeakPolarHBondContact O-CG 3.41Å; Q275-Q279 PolarHBondContact O-N 2.88Å |
| 276 | K | 94.8 | Very high | 92.2 | Very high | 121 Ų | 121 | 107.9 Ų | 107.9 | 53% | 0.526 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.3 | -34.4 | 169.4 | -179.2 | 175.9 | -177.9 | 178.6 | 0 | 112.6 | D273 N280 | D273-K276 HydrophobicContact CB-CB 4.07Å; D273-K276 PolarHBondContact O-N 2.98Å; D273-K276 PolarHBondContact OD1-N 3.08Å; D273-K276 WeakPolarHBondContact OD2-CB 3.48Å; K276-N280 WeakPolarHBondContact O-CB 3.18Å; K276-N280 PolarHBondContact O-N 3.32Å; K276-N280 PolarHBondContact O-ND2 2.89Å |
| 277 | I | 95.3 | Very high | 92.8 | Very high | 84 Ų | 84 | 104 Ų | 104 | 43% | 0.431 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63 | -48.1 | 172.2 | -65.7 | 170 | 0 | 0 | 0 | 110.3 | D273 Y274 Q275 Q279 N280 Q281 | D273-I277 WeakPolarHBondContact O-CG1 3.32Å; D273-I277 PolarHBondContact O-N 3.15Å; Y274-I277 HydrophobicContact CD1-CD1 4.48Å; Y274-I277 PolarHBondContact O-N 3.02Å; Q275-I277 VanDerWaalsContact C-N 3.32Å; I277-Q279 PolarHBondContact O-N 2.95Å; I277-N280 PolarHBondContact O-N 3.37Å; I277-N280 VanDerWaalsContact O-N 3.14Å; I277-Q281 PolarHBondContact O-N 2.95Å |
| 278 | L | 95.9 | Very high | 93.3 | Very high | 125 Ų | 125 | 104 Ų | 104 | 65% | 0.654 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.8 | -43.7 | 176.3 | -74.1 | 162.5 | 0 | 0 | 0 | 112.6 | Y274 Q275 N280 Q281 S282 | Y274-L278 WeakPolarHBondContact O-CG 3.33Å; Y274-L278 PolarHBondContact O-N 3.04Å; Q275-L278 PolarHBondContact O-N 3.05Å; L278-N280 VanDerWaalsContact C-N 3.26Å; L278-N280 PolarHBondContact O-N 2.89Å; L278-Q281 WeakPolarHBondContact O-CB 3.33Å; L278-Q281 PolarHBondContact O-N 3.4Å; L278-Q281 VanDerWaalsContact O-N 3.14Å; L278-S282 PolarHBondContact O-N 3.32Å; L278-S282 VanDerWaalsContact O-N 3.09Å |
| 279 | Q | 95 | Very high | 93.9 | Very high | 104 Ų | 104 | 106 Ų | 106 | 49% | 0.486 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.2 | -32 | 174.2 | -74.2 | 177.6 | -5 | 0 | 0 | 113 | Q275 I277 K283 | Q275-Q279 WeakPolarHBondContact O-CG 3.41Å; Q275-Q279 PolarHBondContact O-N 2.88Å; I277-Q279 PolarHBondContact O-N 2.95Å; Q279-K283 WeakPolarHBondContact O-CG 3.35Å; Q279-K283 PolarHBondContact O-N 3.29Å |
| 280 | N | 95.6 | Very high | 94.6 | Very high | 71 Ų | 71 | 106 Ų | 106 | 38% | 0.38 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -74.4 | -33.2 | 174.6 | -72.4 | -11.2 | 0 | 0 | 0 | 112 | K276 I277 L278 K283 V284 | K276-N280 WeakPolarHBondContact O-CB 3.18Å; K276-N280 PolarHBondContact O-N 3.32Å; K276-N280 PolarHBondContact O-ND2 2.89Å; I277-N280 PolarHBondContact O-N 3.37Å; I277-N280 VanDerWaalsContact O-N 3.14Å; L278-N280 VanDerWaalsContact C-N 3.26Å; L278-N280 PolarHBondContact O-N 2.89Å; N280-K283 PolarHBondContact O-N 2.93Å; N280-K283 PolarHBondContact OD1-NZ 2.93Å; N280-V284 WeakPolarHBondContact O-CG2 3.41Å; N280-V284 PolarHBondContact O-N 2.98Å |
| 281 | Q | 94.9 | Very high | 95.1 | Very high | 101 Ų | 101 | 104.7 Ų | 104.7 | 47% | 0.472 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.2 | -41 | 171.6 | -65.4 | -60.7 | -30.1 | 0 | 0 | 111.6 | I277 L278 K283 V284 F285 | I277-Q281 PolarHBondContact O-N 2.95Å; L278-Q281 WeakPolarHBondContact O-CB 3.33Å; L278-Q281 PolarHBondContact O-N 3.4Å; L278-Q281 VanDerWaalsContact O-N 3.14Å; Q281-K283 VanDerWaalsContact C-N 3.34Å; Q281-K283 PolarHBondContact O-N 2.67Å; Q281-V284 WeakPolarHBondContact O-CB 3.4Å; Q281-V284 PolarHBondContact O-N 3.05Å; Q281-F285 VanDerWaalsContact O-CD2 3.24Å; Q281-F285 WeakPolarHBondContact O-CD2 3.5Å; Q281-F285 PolarHBondContact O-N 3.1Å; Q281-F285 VanDerWaalsContact O-N 3.13Å |
| 282 | S | 94.9 | Very high | 95.5 | Very high | 64 Ų | 64 | 102.5 Ų | 102.5 | 45% | 0.448 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -53.2 | -51 | 173.1 | -162.5 | 0 | 0 | 0 | 0 | 111.4 | L278 V284 F285 D286 | L278-S282 PolarHBondContact O-N 3.32Å; L278-S282 VanDerWaalsContact O-N 3.09Å; S282-V284 PolarHBondContact O-N 2.68Å; S282-V284 VanDerWaalsContact O-N 3.16Å; S282-F285 WeakPolarHBondContact O-CA 3.11Å; S282-F285 WeakPolarHBondContact O-CB 3.33Å; S282-F285 PolarHBondContact O-N 3.34Å; S282-D286 PolarHBondContact O-N 3.09Å; S282-D286 VanDerWaalsContact O-OD1 3.1Å |
| 283 | K | 95.1 | Very high | 95.8 | Very high | 115 Ų | 115 | 104.1 Ų | 104.1 | 50% | 0.5 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.6 | -25.1 | 178.7 | -62.5 | 166.1 | -162.2 | 162.3 | 0 | 114.1 | Q279 N280 Q281 D286 C287 | Q279-K283 WeakPolarHBondContact O-CG 3.35Å; Q279-K283 PolarHBondContact O-N 3.29Å; N280-K283 PolarHBondContact O-N 2.93Å; N280-K283 PolarHBondContact OD1-NZ 2.93Å; Q281-K283 VanDerWaalsContact C-N 3.34Å; Q281-K283 PolarHBondContact O-N 2.67Å; K283-D286 WeakPolarHBondContact CA-OD2 3.33Å; K283-C287 VanDerWaalsContact O-CB 3.24Å; K283-C287 WeakPolarHBondContact O-CB 3.4Å; K283-C287 PolarHBondContact O-N 3.06Å; K283-C287 VanDerWaalsContact O-N 3.1Å |
| 284 | V | 97.2 | Very high | 96.1 | Very high | 84 Ų | 84 | 106.1 Ų | 106.1 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -75.5 | -35.5 | 173.8 | 171.4 | 0 | 0 | 0 | 0 | 110.8 | N280 Q281 S282 M288 | N280-V284 WeakPolarHBondContact O-CG2 3.41Å; N280-V284 PolarHBondContact O-N 2.98Å; Q281-V284 WeakPolarHBondContact O-CB 3.4Å; Q281-V284 PolarHBondContact O-N 3.05Å; S282-V284 PolarHBondContact O-N 2.68Å; S282-V284 VanDerWaalsContact O-N 3.16Å; V284-M288 WeakPolarHBondContact O-CB 3.42Å; V284-M288 PolarHBondContact O-N 3.47Å |
| 285 | F | 96.4 | Very high | 96.3 | Very high | 147 Ų | 147 | 104.7 Ų | 104.7 | 65% | 0.645 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.5 | -47.8 | 169.5 | -72.1 | -72.5 | 0 | 0 | 0 | 111.6 | Q281 S282 C287 M288 E289 | Q281-F285 VanDerWaalsContact O-CD2 3.24Å; Q281-F285 WeakPolarHBondContact O-CD2 3.5Å; Q281-F285 PolarHBondContact O-N 3.1Å; Q281-F285 VanDerWaalsContact O-N 3.13Å; S282-F285 WeakPolarHBondContact O-CA 3.11Å; S282-F285 WeakPolarHBondContact O-CB 3.33Å; S282-F285 PolarHBondContact O-N 3.34Å; F285-C287 PolarHBondContact O-N 2.88Å; F285-M288 PolarHBondContact O-N 3.05Å; F285-E289 PolarHBondContact O-N 3.12Å |
| 286 | D | 96.4 | Very high | 96.4 | Very high | 89 Ų | 89 | 103.1 Ų | 103.1 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -54.7 | -39.4 | 176.8 | -47.9 | -23.4 | 0 | 0 | 0 | 111.4 | S282 K283 L290 | S282-D286 PolarHBondContact O-N 3.09Å; S282-D286 VanDerWaalsContact O-OD1 3.1Å; K283-D286 WeakPolarHBondContact CA-OD2 3.33Å; D286-L290 PolarHBondContact O-N 3.44Å |
| 287 | C | 96.2 | Very high | 96.6 | Very high | 74 Ų | 74 | 99 Ų | 99 | 50% | 0.5 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -71.2 | -41.2 | 176.3 | -172.8 | 0 | 0 | 0 | 0 | 112.8 | K283 F285 L290 V291 | K283-C287 VanDerWaalsContact O-CB 3.24Å; K283-C287 WeakPolarHBondContact O-CB 3.4Å; K283-C287 PolarHBondContact O-N 3.06Å; K283-C287 VanDerWaalsContact O-N 3.1Å; F285-C287 PolarHBondContact O-N 2.88Å; C287-L290 PolarHBondContact O-N 3.25Å; C287-V291 WeakPolarHBondContact O-CG2 3.41Å; C287-V291 PolarHBondContact O-N 3.11Å; C287-V291 VanDerWaalsContact O-N 3.11Å |
| 288 | M | 97.3 | Very high | 96.6 | Very high | 108 Ų | 108 | 98.2 Ų | 98.2 | 53% | 0.532 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.4 | -39.4 | 177.1 | -175.2 | 69 | 80.7 | 0 | 0 | 111.7 | V284 F285 V291 M292 | V284-M288 WeakPolarHBondContact O-CB 3.42Å; V284-M288 PolarHBondContact O-N 3.47Å; F285-M288 PolarHBondContact O-N 3.05Å; M288-V291 PolarHBondContact O-N 2.77Å; M288-M292 HydrophobicContact CG-CE 4.33Å; M288-M292 WeakPolarHBondContact O-CG 3.34Å; M288-M292 PolarHBondContact O-N 3.32Å |
| 289 | E | 97.3 | Very high | 96.7 | Very high | 120 Ų | 120 | 96.4 Ų | 96.4 | 56% | 0.561 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59 | -50.3 | 174.8 | -174.4 | 168.8 | -153.4 | 0 | 0 | 110.9 | F285 V291 M292 D293 | F285-E289 PolarHBondContact O-N 3.12Å; E289-V291 VanDerWaalsContact C-N 3.33Å; E289-V291 PolarHBondContact O-N 2.63Å; E289-M292 PolarHBondContact O-N 3.14Å; E289-M292 VanDerWaalsContact O-N 3.12Å; E289-D293 PolarHBondContact O-N 2.81Å |
| 290 | L | 97.7 | Very high | 96.8 | Very high | 119 Ų | 119 | 97.4 Ų | 97.4 | 62% | 0.623 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -57.8 | -41.4 | 176.7 | -177.6 | 63.3 | 0 | 0 | 0 | 113 | D286 C287 D293 E294 | D286-L290 PolarHBondContact O-N 3.44Å; C287-L290 PolarHBondContact O-N 3.25Å; L290-D293 PolarHBondContact O-N 2.72Å; L290-E294 WeakPolarHBondContact O-CB 3.48Å; L290-E294 PolarHBondContact O-N 3.36Å |
| 291 | V | 97.8 | Very high | 96.9 | Very high | 78 Ų | 78 | 100.7 Ų | 100.7 | 47% | 0.473 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -67.9 | -36.5 | 177.5 | 170.4 | 0 | 0 | 0 | 0 | 111.8 | C287 M288 E289 L295 | C287-V291 WeakPolarHBondContact O-CG2 3.41Å; C287-V291 PolarHBondContact O-N 3.11Å; C287-V291 VanDerWaalsContact O-N 3.11Å; M288-V291 PolarHBondContact O-N 2.77Å; E289-V291 VanDerWaalsContact C-N 3.33Å; E289-V291 PolarHBondContact O-N 2.63Å; V291-L295 VanDerWaalsContact O-CB 3.26Å; V291-L295 WeakPolarHBondContact O-CB 3.49Å; V291-L295 PolarHBondContact O-N 2.89Å |
| 292 | M | 97.7 | Very high | 97 | Very high | 112 Ų | 112 | 100.6 Ų | 100.6 | 55% | 0.552 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -67.9 | -39.7 | 174.1 | -71.7 | -171.7 | -60 | 0 | 0 | 112 | M288 E289 L295 Q296 | M288-M292 HydrophobicContact CG-CE 4.33Å; M288-M292 WeakPolarHBondContact O-CG 3.34Å; M288-M292 PolarHBondContact O-N 3.32Å; E289-M292 PolarHBondContact O-N 3.14Å; E289-M292 VanDerWaalsContact O-N 3.12Å; M292-L295 PolarHBondContact O-N 2.84Å; M292-Q296 VanDerWaalsContact O-CB 3.32Å; M292-Q296 WeakPolarHBondContact O-CB 3.49Å; M292-Q296 PolarHBondContact O-N 2.75Å |
| 293 | D | 97.8 | Very high | 97.1 | Very high | 98 Ų | 98 | 101.7 Ų | 101.7 | 52% | 0.524 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.3 | -43.7 | 176.7 | -89 | -4.8 | 0 | 0 | 0 | 112.4 | E289 L290 L295 Q296 G297 | E289-D293 PolarHBondContact O-N 2.81Å; L290-D293 PolarHBondContact O-N 2.72Å; D293-L295 VanDerWaalsContact C-N 3.35Å; D293-L295 PolarHBondContact O-N 2.7Å; D293-Q296 PolarHBondContact O-N 3.13Å; D293-G297 PolarHBondContact O-N 2.9Å |
| 294 | E | 97.1 | Very high | 97.2 | Very high | 136 Ų | 136 | 98.6 Ų | 98.6 | 64% | 0.636 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62 | -42.4 | 174.8 | -175.9 | 175.9 | -165.7 | 0 | 0 | 111.5 | L290 G297 S298 | L290-E294 WeakPolarHBondContact O-CB 3.48Å; L290-E294 PolarHBondContact O-N 3.36Å; E294-G297 PolarHBondContact O-N 3.5Å; E294-S298 WeakPolarHBondContact O-CB 3.46Å; E294-S298 PolarHBondContact O-N 3.47Å; E294-S298 PolarHBondContact O-OG 3.33Å |
| 295 | L | 97.6 | Very high | 97.2 | Very high | 113 Ų | 113 | 100.4 Ų | 100.4 | 59% | 0.592 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -63.8 | -44.6 | 175.1 | -179.5 | 61.1 | 0 | 0 | 0 | 111.5 | V291 M292 D293 S298 V299 | V291-L295 VanDerWaalsContact O-CB 3.26Å; V291-L295 WeakPolarHBondContact O-CB 3.49Å; V291-L295 PolarHBondContact O-N 2.89Å; M292-L295 PolarHBondContact O-N 2.84Å; D293-L295 VanDerWaalsContact C-N 3.35Å; D293-L295 PolarHBondContact O-N 2.7Å; L295-S298 PolarHBondContact O-N 3.27Å; L295-V299 WeakPolarHBondContact O-CG2 3.42Å; L295-V299 PolarHBondContact O-N 2.82Å |
| 296 | Q | 97.3 | Very high | 97.3 | Very high | 102 Ų | 102 | 97.5 Ų | 97.5 | 48% | 0.477 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.8 | -39.7 | 178.3 | -163.5 | -162.2 | 77.3 | 0 | 0 | 111.7 | M292 D293 V299 K300 | M292-Q296 VanDerWaalsContact O-CB 3.32Å; M292-Q296 WeakPolarHBondContact O-CB 3.49Å; M292-Q296 PolarHBondContact O-N 2.75Å; D293-Q296 PolarHBondContact O-N 3.13Å; Q296-V299 PolarHBondContact O-N 2.95Å; Q296-K300 HydrophobicContact CG-CD 4.49Å; Q296-K300 VanDerWaalsContact O-CG 3.3Å; Q296-K300 WeakPolarHBondContact O-CG 3.48Å; Q296-K300 PolarHBondContact O-N 3.11Å |
| 297 | G | 97.2 | Very high | 97.3 | Very high | 35 Ų | 35 | 98.5 Ų | 98.5 | 36% | 0.361 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.5 | -45.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | D293 E294 V299 K300 Q301 | D293-G297 PolarHBondContact O-N 2.9Å; E294-G297 PolarHBondContact O-N 3.5Å; G297-V299 PolarHBondContact O-N 3.35Å; G297-K300 PolarHBondContact O-N 2.89Å; G297-Q301 PolarHBondContact O-N 2.97Å |
| 298 | S | 97.1 | Very high | 97.3 | Very high | 68 Ų | 68 | 101.7 Ų | 101.7 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 176.7 | -60.9 | 0 | 0 | 0 | 0 | 112.4 | E294 L295 Q301 L302 | E294-S298 WeakPolarHBondContact O-CB 3.46Å; E294-S298 PolarHBondContact O-N 3.47Å; E294-S298 PolarHBondContact O-OG 3.33Å; L295-S298 PolarHBondContact O-N 3.27Å; S298-Q301 PolarHBondContact O-N 3.34Å; S298-L302 PolarHBondContact O-N 3.34Å |
| 299 | V | 97.7 | Very high | 97.2 | Very high | 87 Ų | 87 | 98 Ų | 98 | 53% | 0.527 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.2 | -41.8 | 175.3 | 170.4 | 0 | 0 | 0 | 0 | 111.6 | L295 Q296 G297 Q301 L302 Q303 | L295-V299 WeakPolarHBondContact O-CG2 3.42Å; L295-V299 PolarHBondContact O-N 2.82Å; Q296-V299 PolarHBondContact O-N 2.95Å; G297-V299 PolarHBondContact O-N 3.35Å; V299-Q301 PolarHBondContact O-N 3.37Å; V299-L302 PolarHBondContact O-N 2.93Å; V299-Q303 WeakPolarHBondContact O-CB 3.4Å; V299-Q303 PolarHBondContact O-N 3.45Å |
| 300 | K | 97.1 | Very high | 97.1 | Very high | 125 Ų | 125 | 96.6 Ų | 96.6 | 54% | 0.543 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.6 | -41.5 | 174.4 | -74.4 | 163.8 | 172.9 | 172.1 | 0 | 112 | Q296 G297 Q303 A304 | Q296-K300 HydrophobicContact CG-CD 4.49Å; Q296-K300 VanDerWaalsContact O-CG 3.3Å; Q296-K300 WeakPolarHBondContact O-CG 3.48Å; Q296-K300 PolarHBondContact O-N 3.11Å; G297-K300 PolarHBondContact O-N 2.89Å; K300-Q303 PolarHBondContact O-N 3.27Å; K300-A304 PolarHBondContact O-N 2.98Å |
| 301 | Q | 97.5 | Very high | 96.9 | Very high | 139 Ų | 139 | 96.2 Ų | 96.2 | 65% | 0.65 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -65.2 | -41.2 | 177.2 | -174.9 | 61.3 | 28.5 | 0 | 0 | 111.9 | G297 S298 V299 A304 F305 | G297-Q301 PolarHBondContact O-N 2.97Å; S298-Q301 PolarHBondContact O-N 3.34Å; V299-Q301 PolarHBondContact O-N 3.37Å; Q301-A304 PolarHBondContact O-N 3.45Å; Q301-F305 PolarHBondContact O-N 3.35Å; Q301-F305 VanDerWaalsContact O-N 3.08Å |
| 302 | L | 97.3 | Very high | 96.7 | Very high | 100 Ų | 100 | 95.6 Ų | 95.6 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.3 | -42.4 | 174.3 | 179.8 | 60.7 | 0 | 0 | 0 | 111.8 | S298 V299 F305 M306 | S298-L302 PolarHBondContact O-N 3.34Å; V299-L302 PolarHBondContact O-N 2.93Å; L302-F305 PolarHBondContact O-N 2.89Å; L302-M306 HydrophobicContact CG-CE 4.46Å; L302-M306 WeakPolarHBondContact O-CG 3.34Å; L302-M306 PolarHBondContact O-N 3.01Å |
| 303 | Q | 97.2 | Very high | 96.5 | Very high | 87 Ų | 87 | 97 Ų | 97 | 41% | 0.407 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.4 | -47.6 | 175.9 | -178.6 | 62.8 | 27 | 0 | 0 | 111.5 | V299 K300 F305 M306 E307 | V299-Q303 WeakPolarHBondContact O-CB 3.4Å; V299-Q303 PolarHBondContact O-N 3.45Å; K300-Q303 PolarHBondContact O-N 3.27Å; Q303-F305 VanDerWaalsContact C-N 3.33Å; Q303-F305 PolarHBondContact O-N 2.85Å; Q303-M306 PolarHBondContact O-N 3.22Å; Q303-M306 VanDerWaalsContact O-N 3.16Å; Q303-M306 VanDerWaalsContact OE1-CE 3.26Å; Q303-E307 WeakPolarHBondContact CG-OE1 3.24Å; Q303-E307 PolarHBondContact NE2-OE1 3.04Å; Q303-E307 WeakPolarHBondContact O-CG 3.37Å; Q303-E307 PolarHBondContact O-N 2.83Å |
| 304 | A | 97 | Very high | 96.3 | Very high | 49 Ų | 49 | 98.1 Ų | 98.1 | 41% | 0.405 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.1 | -40.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | K300 Q301 E307 E308 | K300-A304 PolarHBondContact O-N 2.98Å; Q301-A304 PolarHBondContact O-N 3.45Å; A304-E307 PolarHBondContact O-N 2.91Å; A304-E308 PolarHBondContact O-N 2.86Å |
| 305 | F | 97.4 | Very high | 96.1 | Very high | 122 Ų | 122 | 97.2 Ų | 97.2 | 54% | 0.535 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.5 | -37.8 | 174.8 | 173.9 | -101.7 | 0 | 0 | 0 | 112.9 | Q301 L302 Q303 S309 | Q301-F305 PolarHBondContact O-N 3.35Å; Q301-F305 VanDerWaalsContact O-N 3.08Å; L302-F305 PolarHBondContact O-N 2.89Å; Q303-F305 VanDerWaalsContact C-N 3.33Å; Q303-F305 PolarHBondContact O-N 2.85Å; F305-S309 WeakPolarHBondContact O-CB 3.44Å; F305-S309 PolarHBondContact O-N 2.86Å; F305-S309 PolarHBondContact O-OG 3.12Å |
| 306 | M | 96.7 | Very high | 95.9 | Very high | 87 Ų | 87 | 95.6 Ų | 95.6 | 43% | 0.429 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.2 | -39.2 | 173.9 | -70.2 | -169.5 | -62.3 | 0 | 0 | 112 | L302 Q303 S309 T310 | L302-M306 HydrophobicContact CG-CE 4.46Å; L302-M306 WeakPolarHBondContact O-CG 3.34Å; L302-M306 PolarHBondContact O-N 3.01Å; Q303-M306 PolarHBondContact O-N 3.22Å; Q303-M306 VanDerWaalsContact O-N 3.16Å; Q303-M306 VanDerWaalsContact OE1-CE 3.26Å; M306-S309 PolarHBondContact O-N 2.88Å; M306-T310 WeakPolarHBondContact O-CB 3.41Å; M306-T310 WeakPolarHBondContact O-CG2 3.45Å; M306-T310 PolarHBondContact O-N 3.19Å; M306-T310 PolarHBondContact O-OG1 3.48Å |
| 307 | E | 97.1 | Very high | 95.6 | Very high | 110 Ų | 110 | 94 Ų | 94 | 51% | 0.514 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.1 | -43.4 | 176.1 | -73.5 | 176 | -159.8 | 0 | 0 | 112.2 | Q303 A304 T310 Q311 | Q303-E307 WeakPolarHBondContact CG-OE1 3.24Å; Q303-E307 PolarHBondContact NE2-OE1 3.04Å; Q303-E307 WeakPolarHBondContact O-CG 3.37Å; Q303-E307 PolarHBondContact O-N 2.83Å; A304-E307 PolarHBondContact O-N 2.91Å; E307-T310 WeakPolarHBondContact CA-OG1 3.29Å; E307-T310 PolarHBondContact O-OG1 3.47Å; E307-T310 VanDerWaalsContact O-OG1 3.14Å; E307-Q311 VanDerWaalsContact O-CB 3.23Å; E307-Q311 WeakPolarHBondContact O-CB 3.4Å; E307-Q311 PolarHBondContact O-N 3.36Å |
| 308 | E | 96.3 | Very high | 95.2 | Very high | 141 Ų | 141 | 95.5 Ų | 95.5 | 66% | 0.659 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.5 | -45.4 | 173.4 | -177.4 | 171.7 | -154.1 | 0 | 0 | 111.4 | A304 Q311 C312 | A304-E308 PolarHBondContact O-N 2.86Å; E308-Q311 PolarHBondContact O-N 3.32Å; E308-C312 VanDerWaalsContact O-CB 3.3Å; E308-C312 WeakPolarHBondContact O-CB 3.32Å; E308-C312 PolarHBondContact O-N 2.94Å |
| 309 | S | 94.8 | Very high | 94.7 | Very high | 30 Ų | 30 | 98.8 Ų | 98.8 | 21% | 0.21 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -61 | -49.2 | 178.9 | -65.3 | 0 | 0 | 0 | 0 | 111.8 | F305 M306 Q311 C312 F313 | F305-S309 WeakPolarHBondContact O-CB 3.44Å; F305-S309 PolarHBondContact O-N 2.86Å; F305-S309 PolarHBondContact O-OG 3.12Å; M306-S309 PolarHBondContact O-N 2.88Å; S309-Q311 PolarHBondContact O-N 2.93Å; S309-C312 WeakPolarHBondContact O-CB 3.5Å; S309-C312 PolarHBondContact O-N 2.88Å; S309-F313 WeakPolarHBondContact O-CD2 3.28Å; S309-F313 WeakPolarHBondContact O-CG 3.5Å; S309-F313 PolarHBondContact O-N 2.89Å |
| 310 | T | 95.2 | Very high | 94 | Very high | 90 Ų | 90 | 100.6 Ų | 100.6 | 55% | 0.552 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -65.1 | -38.5 | 177.9 | 50.8 | 0 | 0 | 0 | 0 | 111.8 | M306 E307 C312 F313 Q314 | M306-T310 WeakPolarHBondContact O-CB 3.41Å; M306-T310 WeakPolarHBondContact O-CG2 3.45Å; M306-T310 PolarHBondContact O-N 3.19Å; M306-T310 PolarHBondContact O-OG1 3.48Å; E307-T310 WeakPolarHBondContact CA-OG1 3.29Å; E307-T310 PolarHBondContact O-OG1 3.47Å; E307-T310 VanDerWaalsContact O-OG1 3.14Å; T310-C312 VanDerWaalsContact C-N 3.34Å; T310-C312 PolarHBondContact O-N 3.29Å; T310-F313 PolarHBondContact O-N 3.31Å; T310-Q314 VanDerWaalsContact O-CB 3.3Å; T310-Q314 WeakPolarHBondContact O-CB 3.42Å; T310-Q314 PolarHBondContact O-N 3.17Å |
| 311 | Q | 94.5 | Very high | 93.2 | Very high | 111 Ų | 111 | 96.5 Ų | 96.5 | 52% | 0.519 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.7 | -37.5 | 173.1 | -164.1 | -165.4 | 94.9 | 0 | 0 | 111.9 | E307 E308 S309 Q314 K315 | E307-Q311 VanDerWaalsContact O-CB 3.23Å; E307-Q311 WeakPolarHBondContact O-CB 3.4Å; E307-Q311 PolarHBondContact O-N 3.36Å; E308-Q311 PolarHBondContact O-N 3.32Å; S309-Q311 PolarHBondContact O-N 2.93Å; Q311-Q314 PolarHBondContact O-N 3.4Å; Q311-K315 HydrophobicContact CG-CD 4.45Å; Q311-K315 WeakPolarHBondContact O-CB 3.34Å; Q311-K315 WeakPolarHBondContact O-CD 3.39Å; Q311-K315 VanDerWaalsContact O-CG 3.23Å; Q311-K315 WeakPolarHBondContact O-CG 3.5Å; Q311-K315 PolarHBondContact O-N 3.13Å |
| 312 | C | 93.1 | Very high | 92.4 | Very high | 65 Ų | 65 | 96.1 Ų | 96.1 | 44% | 0.439 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.7 | -49.8 | 174.9 | -171.1 | 0 | 0 | 0 | 0 | 111.7 | E308 S309 T310 Q314 K315 V316 | E308-C312 VanDerWaalsContact O-CB 3.3Å; E308-C312 WeakPolarHBondContact O-CB 3.32Å; E308-C312 PolarHBondContact O-N 2.94Å; S309-C312 WeakPolarHBondContact O-CB 3.5Å; S309-C312 PolarHBondContact O-N 2.88Å; T310-C312 VanDerWaalsContact C-N 3.34Å; T310-C312 PolarHBondContact O-N 3.29Å; C312-Q314 VanDerWaalsContact C-N 3.3Å; C312-Q314 PolarHBondContact O-N 3.04Å; C312-K315 WeakPolarHBondContact O-CB 3.35Å; C312-K315 PolarHBondContact O-N 3.34Å; C312-K315 VanDerWaalsContact O-N 3.15Å; C312-V316 PolarHBondContact O-N 2.83Å |
| 313 | F | 94.1 | Very high | 91.4 | Very high | 143 Ų | 143 | 100 Ų | 100 | 63% | 0.627 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.1 | -40.4 | 174.8 | -69.7 | -55 | 0 | 0 | 0 | 112 | S309 T310 V316 S317 | S309-F313 WeakPolarHBondContact O-CD2 3.28Å; S309-F313 WeakPolarHBondContact O-CG 3.5Å; S309-F313 PolarHBondContact O-N 2.89Å; T310-F313 PolarHBondContact O-N 3.31Å; F313-V316 WeakPolarHBondContact O-CG2 3.13Å; F313-V316 PolarHBondContact O-N 3.07Å; F313-S317 WeakPolarHBondContact O-CB 3.29Å; F313-S317 PolarHBondContact O-N 3.37Å |
| 314 | Q | 93.3 | Very high | 90 | Very high | 121 Ų | 121 | 99.1 Ų | 99.1 | 57% | 0.565 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.5 | -39.8 | 175.6 | -169.6 | 68.1 | -13.4 | 0 | 0 | 112.2 | T310 Q311 C312 V318 | T310-Q314 VanDerWaalsContact O-CB 3.3Å; T310-Q314 WeakPolarHBondContact O-CB 3.42Å; T310-Q314 PolarHBondContact O-N 3.17Å; Q311-Q314 PolarHBondContact O-N 3.4Å; C312-Q314 VanDerWaalsContact C-N 3.3Å; C312-Q314 PolarHBondContact O-N 3.04Å; Q314-V318 WeakPolarHBondContact O-CB 3.43Å; Q314-V318 VanDerWaalsContact O-CG2 3.27Å; Q314-V318 WeakPolarHBondContact O-CG2 3.23Å; Q314-V318 PolarHBondContact O-N 3.42Å |
| 315 | K | 93.8 | Very high | 88.3 | Confident | 117 Ų | 117 | 101.4 Ų | 101.4 | 51% | 0.509 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.1 | -50.3 | 173.8 | -78.1 | 160.3 | 169.3 | 169.5 | 0 | 111.5 | Q311 C312 V318 Q319 | Q311-K315 HydrophobicContact CG-CD 4.45Å; Q311-K315 WeakPolarHBondContact O-CB 3.34Å; Q311-K315 WeakPolarHBondContact O-CD 3.39Å; Q311-K315 VanDerWaalsContact O-CG 3.23Å; Q311-K315 WeakPolarHBondContact O-CG 3.5Å; Q311-K315 PolarHBondContact O-N 3.13Å; C312-K315 WeakPolarHBondContact O-CB 3.35Å; C312-K315 PolarHBondContact O-N 3.34Å; C312-K315 VanDerWaalsContact O-N 3.15Å; K315-V318 PolarHBondContact O-N 3.39Å; K315-Q319 WeakPolarHBondContact O-CG 3.37Å; K315-Q319 PolarHBondContact O-N 2.89Å |
| 316 | V | 92.6 | Very high | 86.5 | Confident | 78 Ų | 78 | 103 Ų | 103 | 47% | 0.473 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -71.2 | -35.4 | -179.5 | -59.4 | 0 | 0 | 0 | 0 | 112.5 | C312 F313 Q319 L320 | C312-V316 PolarHBondContact O-N 2.83Å; F313-V316 WeakPolarHBondContact O-CG2 3.13Å; F313-V316 PolarHBondContact O-N 3.07Å; V316-Q319 PolarHBondContact O-N 3Å; V316-L320 WeakPolarHBondContact O-CB 3.33Å; V316-L320 PolarHBondContact O-N 3.29Å |
| 317 | S | 89.9 | Confident | 84.5 | Confident | 70 Ų | 70 | 106.1 Ų | 106.1 | 49% | 0.49 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.6 | -47 | 173.2 | -178.4 | 0 | 0 | 0 | 0 | 111.5 | F313 Q319 L320 G321 | F313-S317 WeakPolarHBondContact O-CB 3.29Å; F313-S317 PolarHBondContact O-N 3.37Å; S317-Q319 PolarHBondContact O-N 3.16Å; S317-L320 PolarHBondContact O-N 2.99Å; S317-G321 PolarHBondContact O-N 3.44Å |
| 318 | V | 88.7 | Confident | 82.3 | Confident | 66 Ų | 66 | 103.4 Ų | 103.4 | 40% | 0.4 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.9 | -37 | 175.6 | 170 | 0 | 0 | 0 | 0 | 112 | Q314 K315 K322 | Q314-V318 WeakPolarHBondContact O-CB 3.43Å; Q314-V318 VanDerWaalsContact O-CG2 3.27Å; Q314-V318 WeakPolarHBondContact O-CG2 3.23Å; Q314-V318 PolarHBondContact O-N 3.42Å; K315-V318 PolarHBondContact O-N 3.39Å; V318-K322 HydrophobicContact CG1-CD 4.14Å; V318-K322 WeakPolarHBondContact O-CB 3.46Å; V318-K322 VanDerWaalsContact O-CG 3.24Å; V318-K322 WeakPolarHBondContact O-CG 3.3Å; V318-K322 PolarHBondContact O-N 3.48Å |
| 319 | Q | 86.8 | Confident | 80.5 | Confident | 137 Ų | 137 | 102.9 Ų | 102.9 | 64% | 0.64 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -67.2 | -43.1 | 174.5 | -75.6 | -175.5 | 14.6 | 0 | 0 | 112.5 | K315 V316 S317 K322 R323 | K315-Q319 WeakPolarHBondContact O-CG 3.37Å; K315-Q319 PolarHBondContact O-N 2.89Å; V316-Q319 PolarHBondContact O-N 3Å; S317-Q319 PolarHBondContact O-N 3.16Å; Q319-K322 PolarHBondContact O-N 2.86Å; Q319-R323 WeakPolarHBondContact O-CB 3.44Å; Q319-R323 PolarHBondContact O-N 3.28Å |
| 320 | L | 83.8 | Confident | 78.7 | Confident | 125 Ų | 125 | 107.2 Ų | 107.2 | 65% | 0.654 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66 | -43.9 | 177.3 | -177.7 | 62.4 | 0 | 0 | 0 | 111.1 | V316 S317 R323 S324 | V316-L320 WeakPolarHBondContact O-CB 3.33Å; V316-L320 PolarHBondContact O-N 3.29Å; S317-L320 PolarHBondContact O-N 2.99Å; L320-R323 PolarHBondContact O-N 2.99Å; L320-S324 VanDerWaalsContact O-CB 3.28Å; L320-S324 WeakPolarHBondContact O-CB 3.37Å; L320-S324 PolarHBondContact O-N 3.22Å |
| 321 | G | 80.6 | Confident | 77 | Confident | 38 Ų | 38 | 105.6 Ų | 105.6 | 39% | 0.392 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -59 | -46.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | S317 L325 | S317-G321 PolarHBondContact O-N 3.44Å; G321-L325 WeakPolarHBondContact O-CB 2.94Å; G321-L325 PolarHBondContact O-N 3.27Å |
| 322 | K | 81.2 | Confident | 75.4 | Confident | 132 Ų | 132 | 105.3 Ų | 105.3 | 57% | 0.574 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -59.1 | -52.9 | 172 | -77.4 | 173 | 179.8 | -178.8 | 0 | 111.4 | V318 Q319 S324 L325 Q326 | V318-K322 HydrophobicContact CG1-CD 4.14Å; V318-K322 WeakPolarHBondContact O-CB 3.46Å; V318-K322 VanDerWaalsContact O-CG 3.24Å; V318-K322 WeakPolarHBondContact O-CG 3.3Å; V318-K322 PolarHBondContact O-N 3.48Å; Q319-K322 PolarHBondContact O-N 2.86Å; K322-S324 PolarHBondContact O-N 3.42Å; K322-L325 PolarHBondContact O-N 3.34Å; K322-Q326 WeakPolarHBondContact O-CB 3.5Å; K322-Q326 PolarHBondContact O-N 3.11Å |
| 323 | R | 75.6 | Confident | 74 | Confident | 180 Ų | 180 | 104.4 Ų | 104.4 | 68% | 0.679 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -60.9 | -43.6 | -176 | -162 | 175.2 | -168.3 | 120.2 | 0.7 | 112 | Q319 L320 Q327 | Q319-R323 WeakPolarHBondContact O-CB 3.44Å; Q319-R323 PolarHBondContact O-N 3.28Å; L320-R323 PolarHBondContact O-N 2.99Å; R323-Q327 WeakPolarHBondContact O-CB 3.34Å; R323-Q327 WeakPolarHBondContact O-CG 3.37Å; R323-Q327 PolarHBondContact O-N 2.84Å |
| 324 | S | 67.7 | Low | 72.4 | Confident | 70 Ų | 70 | 102.9 Ų | 102.9 | 49% | 0.49 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.7 | -51.5 | 174.1 | -178.3 | 0 | 0 | 0 | 0 | 112 | L320 K322 Q326 L328 | L320-S324 VanDerWaalsContact O-CB 3.28Å; L320-S324 WeakPolarHBondContact O-CB 3.37Å; L320-S324 PolarHBondContact O-N 3.22Å; K322-S324 PolarHBondContact O-N 3.42Å; S324-Q326 VanDerWaalsContact C-N 3.29Å; S324-Q326 PolarHBondContact O-N 3.2Å; S324-L328 WeakPolarHBondContact O-CG 3.49Å; S324-L328 PolarHBondContact O-N 3Å; S324-L328 VanDerWaalsContact O-N 3.11Å |
| 325 | L | 60.6 | Low | 70.8 | Confident | 96 Ų | 96 | 105.1 Ų | 105.1 | 50% | 0.503 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -75.6 | -15.2 | -175.1 | -158.2 | 71.8 | 0 | 0 | 0 | 114.2 | G321 K322 R334 | G321-L325 WeakPolarHBondContact O-CB 2.94Å; G321-L325 PolarHBondContact O-N 3.27Å; K322-L325 PolarHBondContact O-N 3.34Å; L325-R334 PolarHBondContact O-NH1 3.07Å |
| 326 | Q | 59.4 | Low | 69.2 | Low | 155 Ų | 155 | 105.3 Ų | 105.3 | 72% | 0.724 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -104.3 | -21.3 | 179.5 | -164.2 | 170.1 | 13.1 | 0 | 0 | 113.1 | K322 S324 | K322-Q326 WeakPolarHBondContact O-CB 3.5Å; K322-Q326 PolarHBondContact O-N 3.11Å; S324-Q326 VanDerWaalsContact C-N 3.29Å; S324-Q326 PolarHBondContact O-N 3.2Å |
| 327 | Q | 54.8 | Low | 67.8 | Low | 154 Ų | 154 | 107.3 Ų | 107.3 | 72% | 0.72 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -74 | -19 | 157 | -71.6 | -171 | -81.7 | 0 | 0 | 111.7 | R323 D329 | R323-Q327 WeakPolarHBondContact O-CB 3.34Å; R323-Q327 WeakPolarHBondContact O-CG 3.37Å; R323-Q327 PolarHBondContact O-N 2.84Å; Q327-D329 PolarHBondContact O-N 2.87Å |
| 328 | L | 52.3 | Low | 66.2 | Low | 53 Ų | 53 | 111.6 Ų | 111.6 | 28% | 0.277 | 58% | 0.576 | S | S | . | * | trans | -78.4 | 56.1 | 164.2 | -71.9 | 169.8 | 0 | 0 | 0 | 112.4 | S324 R334 | S324-L328 WeakPolarHBondContact O-CG 3.49Å; S324-L328 PolarHBondContact O-N 3Å; S324-L328 VanDerWaalsContact O-N 3.11Å; L328-R334 PolarHBondContact O-NH1 2.66Å | ||
| 329 | D | 58.9 | Low | 64.6 | Low | 129 Ų | 129 | 113.8 Ų | 113.8 | 69% | 0.69 | 59% | 0.585 | S | S | * | * | trans | -52.1 | 165.1 | 150.6 | -137.8 | 14 | 0 | 0 | 0 | 109.5 | Q327 S331 | Q327-D329 PolarHBondContact O-N 2.87Å; D329-S331 VanDerWaalsContact C-N 3.27Å; D329-S331 PolarHBondContact O-N 3.01Å | ||
| 330 | P | 56.9 | Low | 63.1 | Low | 121 Ų | 121 | 114.4 Ų | 114.4 | 79% | 0.786 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -69.2 | 64.8 | -149.1 | 29 | -38 | 0 | 0 | 0 | 117 | ||
| 331 | S | 58.8 | Low | 61.6 | Low | 56 Ų | 56 | 116.2 Ų | 116.2 | 39% | 0.392 | 60% | 0.597 | S | S | . | * | trans | -79.4 | 140.5 | 178.4 | 176 | 0 | 0 | 0 | 0 | 111.1 | D329 A333 R334 | D329-S331 VanDerWaalsContact C-N 3.27Å; D329-S331 PolarHBondContact O-N 3.01Å; S331-A333 PolarHBondContact O-N 2.97Å; S331-R334 WeakPolarHBondContact O-CB 3.45Å; S331-R334 PolarHBondContact O-N 3.41Å | ||
| 332 | P | 61.6 | Low | 59.9 | Low | 105 Ų | 105 | 121.3 Ų | 121.3 | 68% | 0.682 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.9 | -31.4 | -176.7 | -30.1 | 36.2 | 0 | 0 | 0 | 115.3 | R334 K335 | P332-R334 PolarHBondContact O-N 3.28Å; P332-R334 VanDerWaalsContact O-N 3.11Å; P332-K335 WeakPolarHBondContact O-CB 3.4Å; P332-K335 PolarHBondContact O-N 3.44Å |
| 333 | A | 61.8 | Low | 57.9 | Low | 47 Ų | 47 | 121.2 Ų | 121.2 | 39% | 0.388 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -55 | -29.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | S331 K335 L336 L337 | S331-A333 PolarHBondContact O-N 2.97Å; A333-K335 PolarHBondContact O-N 3.31Å; A333-L336 PolarHBondContact O-N 3.16Å; A333-L336 VanDerWaalsContact O-N 3.1Å; A333-L337 PolarHBondContact O-N 2.89Å |
| 334 | R | 61.5 | Low | 56.5 | Low | 111 Ų | 111 | 118.1 Ų | 118.1 | 42% | 0.419 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -66.7 | -21.2 | 179.6 | -158.2 | 168 | -178.1 | 152.8 | 1.8 | 112.9 | L325 L328 S331 P332 K338 | L325-R334 PolarHBondContact O-NH1 3.07Å; L328-R334 PolarHBondContact O-NH1 2.66Å; S331-R334 WeakPolarHBondContact O-CB 3.45Å; S331-R334 PolarHBondContact O-N 3.41Å; P332-R334 PolarHBondContact O-N 3.28Å; P332-R334 VanDerWaalsContact O-N 3.11Å; R334-K338 WeakPolarHBondContact O-CB 3.39Å; R334-K338 PolarHBondContact O-N 3.32Å |
| 335 | K | 59.9 | Low | 55.1 | Low | 167 Ų | 167 | 121 Ų | 121 | 73% | 0.726 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -71.8 | -38.8 | 171.1 | -68.1 | -174.7 | 177.3 | -179.6 | 0 | 112.1 | P332 A333 K338 L339 | P332-K335 WeakPolarHBondContact O-CB 3.4Å; P332-K335 PolarHBondContact O-N 3.44Å; A333-K335 PolarHBondContact O-N 3.31Å; K335-K338 PolarHBondContact O-N 2.97Å; K335-L339 WeakPolarHBondContact O-CG 2.76Å; K335-L339 PolarHBondContact O-N 2.96Å |
| 336 | L | 60.3 | Low | 54 | Low | 122 Ų | 122 | 121 Ų | 121 | 64% | 0.639 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -66.4 | -45.8 | -179.9 | -61.7 | 174.1 | 0 | 0 | 0 | 111.6 | A333 K338 L339 Q340 | A333-L336 PolarHBondContact O-N 3.16Å; A333-L336 VanDerWaalsContact O-N 3.1Å; L336-K338 VanDerWaalsContact C-N 3.32Å; L336-K338 PolarHBondContact O-N 3.25Å; L336-L339 PolarHBondContact O-N 2.87Å; L336-Q340 PolarHBondContact O-N 3.3Å |
| 337 | L | 61.7 | Low | 53.1 | Low | 119 Ų | 119 | 120.3 Ų | 120.3 | 62% | 0.623 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -65 | -34.6 | 176.9 | -67.6 | 174.4 | 0 | 0 | 0 | 112.6 | A333 L339 Q340 L341 | A333-L337 PolarHBondContact O-N 2.89Å; L337-L339 VanDerWaalsContact C-N 3.35Å; L337-Q340 PolarHBondContact O-N 2.97Å; L337-L341 PolarHBondContact O-N 3.12Å |
| 338 | K | 57.4 | Low | 52.2 | Low | 161 Ų | 161 | 124.9 Ų | 124.9 | 70% | 0.7 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -71.7 | -29.1 | 178.9 | -155 | 175.4 | -174.2 | -174.9 | 0 | 112.8 | R334 K335 L336 | R334-K338 WeakPolarHBondContact O-CB 3.39Å; R334-K338 PolarHBondContact O-N 3.32Å; K335-K338 PolarHBondContact O-N 2.97Å; L336-K338 VanDerWaalsContact C-N 3.32Å; L336-K338 PolarHBondContact O-N 3.25Å |
| 339 | L | 54.6 | Low | 51.4 | Low | 111 Ų | 111 | 125.4 Ų | 125.4 | 58% | 0.581 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -69.1 | -41 | 171.5 | -73.3 | 166.1 | 0 | 0 | 0 | 112.1 | K335 L336 L337 L341 Q342 | K335-L339 WeakPolarHBondContact O-CG 2.76Å; K335-L339 PolarHBondContact O-N 2.96Å; L336-L339 PolarHBondContact O-N 2.87Å; L337-L339 VanDerWaalsContact C-N 3.35Å; L339-L341 VanDerWaalsContact C-N 3.28Å; L339-L341 PolarHBondContact O-N 3.05Å; L339-Q342 PolarHBondContact O-N 3.45Å |
| 340 | Q | 55.6 | Low | 50.3 | Low | 151 Ų | 151 | 125.5 Ų | 125.5 | 71% | 0.706 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -60.2 | -37 | 177 | -72.5 | -70.3 | -16 | 0 | 0 | 112.5 | L336 L337 Q342 | L336-Q340 PolarHBondContact O-N 3.3Å; L337-Q340 PolarHBondContact O-N 2.97Å; Q340-Q342 VanDerWaalsContact C-N 3.31Å; Q340-Q342 PolarHBondContact O-N 2.97Å |
| 341 | L | 53.3 | Low | 49.3 | Very low | 163 Ų | 163 | 123.6 Ų | 123.6 | 85% | 0.853 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | -0.2 | 179.8 | -145.9 | 76.6 | 0 | 0 | 0 | 114.4 | L337 L339 | L337-L341 PolarHBondContact O-N 3.12Å; L339-L341 VanDerWaalsContact C-N 3.28Å; L339-L341 PolarHBondContact O-N 3.05Å |
| 342 | Q | 44.2 | Very low | 48.2 | Very low | 144 Ų | 144 | 126.8 Ų | 126.8 | 67% | 0.673 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.8 | 8.5 | -176.7 | -154.7 | 164.1 | 13.9 | 0 | 0 | 113.6 | L339 Q340 P344 | L339-Q342 PolarHBondContact O-N 3.45Å; Q340-Q342 VanDerWaalsContact C-N 3.31Å; Q340-Q342 PolarHBondContact O-N 2.97Å; Q342-P344 VanDerWaalsContact O-CD 3.29Å; Q342-P344 WeakPolarHBondContact O-CD 3.14Å |
| 343 | N | 38.4 | Very low | 47.2 | Very low | 130 Ų | 130 | 127.2 Ų | 127.2 | 70% | 0.695 | 73% | 0.726 | S | S | * | * | trans | -105.7 | 96.4 | 172.9 | -73.7 | -34.6 | 0 | 0 | 0 | 111 | ||||
| 344 | P | 45.9 | Very low | 46.1 | Very low | 115 Ų | 115 | 137.9 Ų | 137.9 | 75% | 0.747 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 127.6 | 174.7 | 31.8 | -32.6 | 0 | 0 | 0 | 111.9 | Q342 | Q342-P344 VanDerWaalsContact O-CD 3.29Å; Q342-P344 WeakPolarHBondContact O-CD 3.14Å |
| 345 | P | 39.9 | Very low | 45.3 | Very low | 130 Ų | 130 | 139.2 Ų | 139.2 | 84% | 0.844 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -72 | 127.8 | 156.9 | -10 | 27.2 | 0 | 0 | 0 | 109 | ||
| 346 | A | 37 | Very low | 44.5 | Very low | 98 Ų | 98 | 137.7 Ų | 137.7 | 81% | 0.81 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 152.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | R348 | A346-R348 PolarHBondContact O-N 2.66Š|
| 347 | T | 40.8 | Very low | 43.6 | Very low | 140 Ų | 140 | 138.6 Ų | 138.6 | 86% | 0.859 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 118.1 | -177 | -44.6 | 0 | 0 | 0 | 0 | 115.7 | ||
| 348 | R | 35.8 | Very low | 42.6 | Very low | 249 Ų | 249 | 139.8 Ų | 139.8 | 94% | 0.94 | 81% | 0.807 | S | S | * | * | trans | -147.3 | 142.7 | 142.5 | -66.8 | -167.4 | -179.9 | -162.2 | -0.1 | 108.3 | A346 | A346-R348 PolarHBondContact O-N 2.66Š| ||
| 349 | G | 34.2 | Very low | 41.6 | Very low | 65 Ų | 65 | 138.4 Ų | 138.4 | 67% | 0.67 | 81% | 0.814 | S | S | * | * | cis | 149.4 | 120.4 | -6.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 350 | S | 37.3 | Very low | 40.8 | Very low | 131 Ų | 131 | 140.3 Ų | 140.3 | 92% | 0.916 | 83% | 0.829 | S | S | * | * | trans | 60.5 | 127.4 | -178.8 | -63.3 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 351 | G | 35.7 | Very low | 39.7 | Very low | 81 Ų | 81 | 139.5 Ų | 139.5 | 84% | 0.835 | 84% | 0.838 | S | S | * | * | trans | -93.8 | -161.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 352 | S | 35.5 | Very low | 38.7 | Very low | 122 Ų | 122 | 137.7 Ų | 137.7 | 85% | 0.853 | 84% | 0.837 | S | S | * | * | trans | -155.4 | 160.7 | 165.1 | -168 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 353 | C | 40.2 | Very low | 38.2 | Very low | 115 Ų | 115 | 137.2 Ų | 137.2 | 78% | 0.777 | 85% | 0.851 | S | S | * | * | trans | -63.6 | 154.5 | -175.1 | -40.9 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 354 | Q | 38.1 | Very low | 38.2 | Very low | 270 Ų | 270 | 137.8 Ų | 137.8 | 100% | 1.262 | 87% | 0.865 | S | S | * | * | -152.2 | 0 | 102.4 | -108.9 | 176.2 | -10 | 0 | 0 | 111.2 |
Retrieved 354 of 354 residues in 331.5 ms
(Link to these results)