| 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 | 33.5 | Very low | 41.4 | Very low | 248 Ų | 248 | 141.9 Ų | 141.9 | 100% | 1.222 | 82% | 0.818 | S | S | * | * | 0 | 156.8 | 0 | -71.1 | 167.4 | 171.7 | 0 | 0 | 108.2 | |||||
| 2 | A | 34.4 | Very low | 40.9 | Very low | 103 Ų | 103 | 137 Ų | 137 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | trans | -27.5 | 160.7 | 178 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 3 | A | 38.3 | Very low | 40.5 | Very low | 102 Ų | 102 | 140 Ų | 140 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | cis | -169.5 | -176.9 | -15.2 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 4 | A | 43.5 | Very low | 40.9 | Very low | 93 Ų | 93 | 142.4 Ų | 142.4 | 77% | 0.769 | 82% | 0.816 | S | S | * | * | cis | -142.4 | 168.8 | 3.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 5 | K | 51.2 | Low | 40.4 | Very low | 161 Ų | 161 | 143.5 Ų | 143.5 | 70% | 0.7 | 82% | 0.816 | S | S | * | * | cis | 87.7 | 90.7 | 28.2 | -149.2 | -156.8 | -175.1 | -148.9 | 0 | 117.5 | E7 | K5-E7 WeakPolarHBondContact CE-OE1 3.47Å; K5-E7 HydrophobicContact CG-CG 4.43Å; K5-E7 IonicContact NZ-OE1 3.56Å; K5-E7 PolarHBondContact NZ-OE1 3.5Å | ||
| 6 | T | 43.8 | Very low | 40 | Very low | 133 Ų | 133 | 140.4 Ų | 140.4 | 82% | 0.816 | 81% | 0.805 | S | S | * | * | trans | -156.7 | 115.1 | 148.5 | -63.1 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 7 | E | 43.7 | Very low | 39.9 | Very low | 109 Ų | 109 | 143.4 Ų | 143.4 | 51% | 0.509 | 81% | 0.81 | S | S | . | * | 77.9 | 95.6 | 50.1 | -63.2 | -78.6 | -167.6 | 0 | 0 | 114.6 | K5 | K5-E7 WeakPolarHBondContact CE-OE1 3.47Å; K5-E7 HydrophobicContact CG-CG 4.43Å; K5-E7 IonicContact NZ-OE1 3.56Å; K5-E7 PolarHBondContact NZ-OE1 3.5Å | |||
| 8 | M | 38.7 | Very low | 40 | Very low | 192 Ų | 192 | 141.7 Ų | 141.7 | 95% | 0.946 | 81% | 0.806 | S | S | * | * | trans | -150.8 | 151.5 | 146.6 | -87.4 | -147 | 74.3 | 0 | 0 | 109.7 | ||||
| 9 | I | 37.9 | Very low | 39.5 | Very low | 142 Ų | 142 | 142.7 Ų | 142.7 | 73% | 0.728 | 81% | 0.808 | S | S | * | * | trans | -125.7 | 150 | -154.8 | -62.7 | 171.6 | 0 | 0 | 0 | 111.5 | ||||
| 10 | L | 37.4 | Very low | 39.2 | Very low | 152 Ų | 152 | 141.2 Ų | 141.2 | 80% | 0.796 | 81% | 0.807 | S | S | * | * | trans | -63 | 166.5 | 172.9 | -87.7 | 148.8 | 0 | 0 | 0 | 113.1 | ||||
| 11 | P | 53 | Low | 38.8 | Very low | 126 Ų | 126 | 143.1 Ų | 143.1 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | -130.6 | 160.3 | 107.6 | 37.1 | -31.5 | 0 | 0 | 0 | 113.2 | |||||
| 12 | A | 34.9 | Very low | 39 | Very low | 83 Ų | 83 | 136.7 Ų | 136.7 | 69% | 0.686 | 78% | 0.783 | S | S | * | * | trans | -107.5 | 158 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 13 | L | 36 | Very low | 38.9 | Very low | 176 Ų | 176 | 141 Ų | 141 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | trans | -127.2 | 135.5 | 156.1 | -79.3 | 172.1 | 0 | 0 | 0 | 108.6 | ||||
| 14 | Q | 45.7 | Very low | 38.6 | Very low | 174 Ų | 174 | 141.7 Ų | 141.7 | 81% | 0.813 | 78% | 0.784 | S | S | * | * | trans | -103.3 | 165.6 | 168.1 | -65.1 | -177.1 | -35.6 | 0 | 0 | 109.2 | ||||
| 15 | I | 33.8 | Very low | 38.6 | Very low | 159 Ų | 159 | 142.1 Ų | 142.1 | 82% | 0.815 | 78% | 0.779 | S | S | * | * | 179.2 | 142.5 | 119.4 | -92.9 | 156.6 | 0 | 0 | 0 | 112 | |||||
| 16 | S | 34.7 | Very low | 37.5 | Very low | 93 Ų | 93 | 143.4 Ų | 143.4 | 65% | 0.65 | 79% | 0.79 | S | S | * | * | trans | 48.1 | 108.9 | 161.1 | 67.8 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 17 | E | 37.3 | Very low | 36.8 | Very low | 191 Ų | 191 | 143.5 Ų | 143.5 | 89% | 0.893 | 79% | 0.785 | S | S | * | * | 64.6 | 153.6 | 119.2 | -66.1 | -165.2 | 137.9 | 0 | 0 | 123.7 | |||||
| 18 | P | 42.8 | Very low | 36.2 | Very low | 114 Ų | 114 | 145 Ų | 145 | 74% | 0.74 | 80% | 0.797 | S | S | * | * | trans | -102.1 | 153.5 | -173.4 | 39.4 | -33.1 | 0 | 0 | 0 | 114.3 | ||||
| 19 | L | 30.9 | Very low | 35.8 | Very low | 160 Ų | 160 | 146 Ų | 146 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | trans | -122.9 | 128.8 | 166.7 | -89.4 | 170.6 | 0 | 0 | 0 | 112.1 | ||||
| 20 | S | 32.6 | Very low | 36 | Very low | 112 Ų | 112 | 144.4 Ų | 144.4 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | trans | -84.1 | 137.4 | 178.5 | -52 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 21 | F | 29.8 | Very low | 35.7 | Very low | 183 Ų | 183 | 145 Ų | 145 | 80% | 0.803 | 79% | 0.787 | S | S | * | * | trans | -137.2 | 155.1 | 165.5 | -84.2 | -74.5 | 0 | 0 | 0 | 109.7 | ||||
| 22 | P | 39.8 | Very low | 34.8 | Very low | 113 Ų | 113 | 147.1 Ų | 147.1 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | -117.2 | 160.8 | -129.3 | 11.2 | 11.9 | 0 | 0 | 0 | 115 | |||||
| 23 | H | 31.6 | Very low | 34.6 | Very low | 193 Ų | 193 | 149.9 Ų | 149.9 | 89% | 0.894 | 79% | 0.789 | S | S | * | * | trans | -69.3 | 132.2 | 156.5 | -93.8 | -93.4 | 0 | 0 | 0 | 111 | ||||
| 24 | S | 32.3 | Very low | 34.6 | Very low | 116 Ų | 116 | 149.6 Ų | 149.6 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -159.6 | 155.2 | 151 | -93 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 25 | P | 42.5 | Very low | 33.9 | Very low | 102 Ų | 102 | 146.7 Ų | 146.7 | 66% | 0.662 | 78% | 0.777 | S | S | * | * | trans | -97.4 | 172.2 | -160.3 | 38.5 | -37 | 0 | 0 | 0 | 114.1 | ||||
| 26 | M | 28.5 | Very low | 34 | Very low | 189 Ų | 189 | 146.6 Ų | 146.6 | 93% | 0.931 | 78% | 0.775 | S | S | * | * | trans | -134.9 | 124.8 | 155.9 | -84.3 | -66.3 | 159.1 | 0 | 0 | 109.9 | ||||
| 27 | D | 30 | Very low | 33.8 | Very low | 134 Ų | 134 | 149.7 Ų | 149.7 | 72% | 0.717 | 78% | 0.781 | S | S | * | * | trans | -102.3 | 157.7 | 170.5 | -92.4 | -60.5 | 0 | 0 | 0 | 110.6 | ||||
| 28 | N | 30.5 | Very low | 33.5 | Very low | 142 Ų | 142 | 147.2 Ų | 147.2 | 76% | 0.759 | 77% | 0.773 | S | S | * | * | trans | 74.1 | 170.3 | 154.3 | -97.5 | -66.5 | 0 | 0 | 0 | 121.2 | ||||
| 29 | Y | 29.6 | Very low | 33 | Very low | 211 Ų | 211 | 147.4 Ų | 147.4 | 83% | 0.827 | 78% | 0.777 | S | S | * | * | trans | 77.9 | 141 | 178.9 | -62.4 | -88.1 | 0 | 0 | 0 | 117.6 | ||||
| 30 | P | 43.2 | Very low | 33.2 | Very low | 109 Ų | 109 | 144.6 Ų | 144.6 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | cis | -134.9 | 168.3 | -41.1 | 34.9 | -19.1 | 0 | 0 | 0 | 114.8 | ||||
| 31 | K | 30.6 | Very low | 33.2 | Very low | 165 Ų | 165 | 144.5 Ų | 144.5 | 72% | 0.717 | 78% | 0.777 | S | S | * | * | trans | -65.1 | 136.4 | 167.4 | -170.6 | -169.1 | -167.3 | -168 | 0 | 110.6 | E33 | K31-E33 HydrophobicContact CD-CG 4.41Å; K31-E33 WeakPolarHBondContact CE-OE1 3.46Å; K31-E33 IonicContact NZ-OE1 2.59Å; K31-E33 PolarHBondContact NZ-OE1 3.32Å | ||
| 32 | L | 34 | Very low | 33.1 | Very low | 170 Ų | 170 | 139.4 Ų | 139.4 | 89% | 0.89 | 78% | 0.776 | S | S | * | * | trans | -109 | 126.5 | 164.8 | -80.4 | 170.8 | 0 | 0 | 0 | 110.1 | ||||
| 33 | E | 31.4 | Very low | 32.9 | Very low | 142 Ų | 142 | 140.4 Ų | 140.4 | 66% | 0.664 | 78% | 0.78 | S | S | * | * | trans | -112.1 | 135.2 | 164 | -68.9 | 176.2 | 177 | 0 | 0 | 107.1 | K31 | K31-E33 HydrophobicContact CD-CG 4.41Å; K31-E33 WeakPolarHBondContact CE-OE1 3.46Å; K31-E33 IonicContact NZ-OE1 2.59Å; K31-E33 PolarHBondContact NZ-OE1 3.32Å | ||
| 34 | E | 35.8 | Very low | 34 | Very low | 170 Ų | 170 | 136 Ų | 136 | 79% | 0.794 | 77% | 0.769 | S | S | * | * | trans | -112 | 130.4 | 176.3 | -171 | 173.2 | -163.3 | 0 | 0 | 109.9 | ||||
| 35 | V | 30.6 | Very low | 33.8 | Very low | 113 Ų | 113 | 139 Ų | 139 | 69% | 0.685 | 77% | 0.768 | S | S | * | * | trans | -123.7 | 129.2 | -178.3 | 176.7 | 0 | 0 | 0 | 0 | 108.6 | M37 | V35-M37 HydrophobicContact CG1-CE 4.43Å; V35-M37 HydrophobicContact CG1-CG 4.29Å | ||
| 36 | M | 34.9 | Very low | 33.3 | Very low | 157 Ų | 157 | 141.6 Ų | 141.6 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | trans | -125.7 | 144.4 | 175.3 | -86 | -166.4 | -91.6 | 0 | 0 | 112.9 | ||||
| 37 | M | 31 | Very low | 33.4 | Very low | 157 Ų | 157 | 138 Ų | 138 | 77% | 0.773 | 76% | 0.763 | S | S | * | * | trans | -157.6 | 148.2 | -161.6 | -78.4 | -63.8 | -177.9 | 0 | 0 | 110.3 | V35 | V35-M37 HydrophobicContact CG1-CE 4.43Å; V35-M37 HydrophobicContact CG1-CG 4.29Å | ||
| 38 | L | 31.3 | Very low | 33.4 | Very low | 140 Ų | 140 | 136.5 Ų | 136.5 | 73% | 0.733 | 77% | 0.77 | S | S | * | * | cis | -161.7 | 108 | -15.3 | -159.9 | -175.3 | 0 | 0 | 0 | 109.1 | ||||
| 39 | S | 31.2 | Very low | 33.4 | Very low | 118 Ų | 118 | 135.7 Ų | 135.7 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | trans | -147 | 138.1 | 175.6 | -65.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 40 | S | 35.5 | Very low | 33.6 | Very low | 101 Ų | 101 | 129.7 Ų | 129.7 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | cis | 161 | 107.2 | -37.7 | 53.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 41 | A | 32.8 | Very low | 34.1 | Very low | 110 Ų | 110 | 130.1 Ų | 130.1 | 91% | 0.909 | 77% | 0.772 | S | S | * | * | trans | -167.4 | 143.6 | 166.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 42 | G | 28.5 | Very low | 34.3 | Very low | 76 Ų | 76 | 131.3 Ų | 131.3 | 78% | 0.784 | 78% | 0.781 | S | S | * | * | trans | 93.1 | 57.2 | 144.6 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 43 | T | 34.2 | Very low | 34.2 | Very low | 133 Ų | 133 | 126.6 Ų | 126.6 | 82% | 0.816 | 77% | 0.773 | S | S | * | * | trans | -41 | 169.7 | 152.1 | 40.7 | 0 | 0 | 0 | 0 | 117 | ||||
| 44 | P | 55.6 | Low | 34.2 | Very low | 101 Ų | 101 | 125.3 Ų | 125.3 | 66% | 0.656 | 79% | 0.787 | S | S | * | * | cis | -149.2 | -171.1 | -20.5 | 38.9 | -18.2 | 0 | 0 | 0 | 117.3 | ||||
| 45 | F | 29 | Very low | 33.9 | Very low | 180 Ų | 180 | 120.1 Ų | 120.1 | 79% | 0.789 | 78% | 0.778 | S | S | * | * | trans | 68.9 | 146.9 | 157.9 | -86.1 | -83.9 | 0 | 0 | 0 | 117.3 | ||||
| 46 | L | 32.2 | Very low | 33.9 | Very low | 155 Ų | 155 | 125.4 Ų | 125.4 | 81% | 0.812 | 79% | 0.792 | S | S | * | * | cis | -134.6 | 176.1 | 25.5 | -114.8 | 165.7 | 0 | 0 | 0 | 115 | ||||
| 47 | T | 30.3 | Very low | 33.5 | Very low | 113 Ų | 113 | 121.3 Ų | 121.3 | 69% | 0.693 | 79% | 0.791 | S | S | * | * | trans | -94.1 | 153.7 | -167.7 | 51.9 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 48 | A | 30.1 | Very low | 33.5 | Very low | 104 Ų | 104 | 120.1 Ų | 120.1 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | trans | -165.9 | 158.4 | 139.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 49 | S | 29.4 | Very low | 33.3 | Very low | 125 Ų | 125 | 116.9 Ų | 116.9 | 87% | 0.874 | 80% | 0.798 | S | S | * | * | trans | -117.2 | 168.1 | -167.7 | -55.8 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 50 | A | 34.3 | Very low | 33.3 | Very low | 85 Ų | 85 | 119.6 Ų | 119.6 | 70% | 0.702 | 80% | 0.798 | S | S | * | * | trans | -76.4 | 176.3 | 167.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 51 | P | 53.6 | Low | 33.8 | Very low | 117 Ų | 117 | 120.1 Ų | 120.1 | 76% | 0.76 | 80% | 0.799 | S | S | * | * | -123.8 | 157.7 | 80.9 | 3.6 | 20 | 0 | 0 | 0 | 113.4 | |||||
| 52 | E | 34.5 | Very low | 33.5 | Very low | 191 Ų | 191 | 118.4 Ų | 118.4 | 89% | 0.893 | 79% | 0.792 | S | S | * | * | 64.2 | 136.2 | 67.9 | -55.4 | -169.7 | 161.1 | 0 | 0 | 115.4 | |||||
| 53 | G | 31.7 | Very low | 33.5 | Very low | 70 Ų | 70 | 123.4 Ų | 123.4 | 72% | 0.722 | 80% | 0.795 | S | S | * | * | cis | 177.4 | -171 | -1.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 54 | A | 30.8 | Very low | 33.9 | Very low | 116 Ų | 116 | 122 Ų | 122 | 96% | 0.959 | 79% | 0.788 | S | S | * | * | trans | 68.4 | 151.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 55 | G | 30.1 | Very low | 32.6 | Very low | 60 Ų | 60 | 127.8 Ų | 127.8 | 62% | 0.619 | 80% | 0.799 | S | S | * | * | cis | 162.9 | 143.7 | -12.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 56 | F | 30.7 | Very low | 32.6 | Very low | 224 Ų | 224 | 126.2 Ų | 126.2 | 98% | 0.982 | 80% | 0.798 | S | S | * | * | trans | 66.2 | 156.7 | 173.6 | -59.3 | -86.5 | 0 | 0 | 0 | 117.5 | ||||
| 57 | G | 27 | Very low | 32.4 | Very low | 72 Ų | 72 | 127.8 Ų | 127.8 | 74% | 0.742 | 80% | 0.801 | S | S | * | * | cis | -152.3 | -159.3 | 5.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 58 | S | 30.5 | Very low | 32.4 | Very low | 131 Ų | 131 | 130 Ų | 130 | 92% | 0.916 | 81% | 0.808 | S | S | * | * | trans | -134.9 | 157.4 | -154.7 | 55.9 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 59 | G | 27.3 | Very low | 32.4 | Very low | 72 Ų | 72 | 131.2 Ų | 131.2 | 74% | 0.742 | 81% | 0.81 | S | S | * | * | trans | 111 | 158.1 | 164.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 60 | E | 32.3 | Very low | 32.3 | Very low | 176 Ų | 176 | 128.1 Ų | 128.1 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | cis | 175.5 | 177.2 | -9 | -114 | -81.5 | 93.9 | 0 | 0 | 104.8 | ||||
| 61 | P | 45.2 | Very low | 32.3 | Very low | 111 Ų | 111 | 132.3 Ų | 132.3 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | -113.4 | -173.2 | -113.9 | 42.6 | -32.5 | 0 | 0 | 0 | 115.8 | |||||
| 62 | G | 26.7 | Very low | 31.2 | Very low | 75 Ų | 75 | 132.9 Ų | 132.9 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -159.1 | 127.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 63 | E | 28.6 | Very low | 31.4 | Very low | 181 Ų | 181 | 131.2 Ų | 131.2 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | -98.3 | -162.4 | 173.3 | -61.8 | -160.9 | 139.2 | 0 | 0 | 111.8 | ||||
| 64 | P | 43.1 | Very low | 31.4 | Very low | 104 Ų | 104 | 131.3 Ų | 131.3 | 68% | 0.675 | 80% | 0.796 | S | S | * | * | -121.4 | 155.7 | -83.5 | 36.1 | -21.9 | 0 | 0 | 0 | 112.5 | |||||
| 65 | Y | 27.7 | Very low | 31.8 | Very low | 221 Ų | 221 | 133.1 Ų | 133.1 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | trans | -141.8 | 144.5 | 174.9 | -82.2 | -80.5 | 0 | 0 | 0 | 113.9 | H67 | Y65-H67 PolarHBondContact O-N 3.13Š| ||
| 66 | D | 28.9 | Very low | 32 | Very low | 147 Ų | 147 | 135.7 Ų | 135.7 | 79% | 0.786 | 79% | 0.788 | S | S | * | * | trans | -66.3 | 122.6 | -169.5 | -60.3 | -84.3 | 0 | 0 | 0 | 115.1 | L68 | D66-L68 PolarHBondContact O-N 3.22Š| ||
| 67 | H | 28.4 | Very low | 31.9 | Very low | 189 Ų | 189 | 131.7 Ų | 131.7 | 88% | 0.875 | 78% | 0.777 | S | S | * | * | trans | -86.7 | 77.6 | 163.8 | -84.9 | -35.1 | 0 | 0 | 0 | 112.2 | Y65 S69 | Y65-H67 PolarHBondContact O-N 3.13Å; H67-S69 PolarHBondContact O-N 3.07Å | ||
| 68 | L | 30.6 | Very low | 32.2 | Very low | 160 Ų | 160 | 137.2 Ų | 137.2 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | -50.4 | 135.2 | 161.3 | -79 | 168.2 | 0 | 0 | 0 | 110.8 | D66 G70 | D66-L68 PolarHBondContact O-N 3.22Å; L68-G70 PolarHBondContact O-N 3.48Å | ||
| 69 | S | 30.1 | Very low | 32.1 | Very low | 129 Ų | 129 | 136.5 Ų | 136.5 | 90% | 0.902 | 77% | 0.767 | S | S | * | * | trans | -68.3 | 94.8 | -168.6 | -51.7 | 0 | 0 | 0 | 0 | 113.4 | H67 | H67-S69 PolarHBondContact O-N 3.07Š| ||
| 70 | G | 27.1 | Very low | 32.1 | Very low | 60 Ų | 60 | 139 Ų | 139 | 62% | 0.619 | 77% | 0.771 | S | S | * | * | trans | -82.3 | 126.5 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L68 T72 | L68-G70 PolarHBondContact O-N 3.48Å; G70-T72 VanDerWaalsContact C-N 3.28Å; G70-T72 PolarHBondContact O-N 3.06Å | ||
| 71 | D | 34.6 | Very low | 32 | Very low | 172 Ų | 172 | 139 Ų | 139 | 92% | 0.92 | 77% | 0.771 | S | S | * | * | trans | -63.8 | 84.8 | 169.7 | -88.1 | -41.9 | 0 | 0 | 0 | 111 | L73 | D71-L73 PolarHBondContact O-N 3.08Å; D71-L73 VanDerWaalsContact O-N 3.12Å | ||
| 72 | T | 29.3 | Very low | 31.3 | Very low | 130 Ų | 130 | 143 Ų | 143 | 80% | 0.798 | 78% | 0.778 | S | S | * | * | trans | -73.8 | 101.2 | 167.7 | 46.2 | 0 | 0 | 0 | 0 | 109 | G70 S74 | G70-T72 VanDerWaalsContact C-N 3.28Å; G70-T72 PolarHBondContact O-N 3.06Å; T72-S74 VanDerWaalsContact C-N 3.3Å; T72-S74 PolarHBondContact O-N 2.92Å | ||
| 73 | L | 39.7 | Very low | 31.7 | Very low | 155 Ų | 155 | 145.2 Ų | 145.2 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | trans | -56 | 100.1 | 157.4 | -80.8 | 166.5 | 0 | 0 | 0 | 107.4 | D71 D75 | D71-L73 PolarHBondContact O-N 3.08Å; D71-L73 VanDerWaalsContact O-N 3.12Å; L73-D75 VanDerWaalsContact C-N 3.31Å; L73-D75 PolarHBondContact O-N 3.21Å | ||
| 74 | S | 31.1 | Very low | 31.7 | Very low | 73 Ų | 73 | 143.5 Ų | 143.5 | 51% | 0.51 | 78% | 0.78 | S | S | . | * | trans | -68.6 | 92.8 | 176.8 | 61 | 0 | 0 | 0 | 0 | 108.6 | T72 I76 | T72-S74 VanDerWaalsContact C-N 3.3Å; T72-S74 PolarHBondContact O-N 2.92Å; S74-I76 PolarHBondContact O-N 2.87Å | ||
| 75 | D | 39.6 | Very low | 31.1 | Very low | 153 Ų | 153 | 143 Ų | 143 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -63.6 | 79.3 | 167.7 | -80.2 | -40.6 | 0 | 0 | 0 | 108.6 | L73 N77 | L73-D75 VanDerWaalsContact C-N 3.31Å; L73-D75 PolarHBondContact O-N 3.21Å; D75-N77 PolarHBondContact O-N 3.07Å | ||
| 76 | I | 33.7 | Very low | 31.2 | Very low | 115 Ų | 115 | 141.5 Ų | 141.5 | 59% | 0.59 | 79% | 0.786 | S | S | * | * | trans | -68.5 | 90.7 | 160.3 | -61.4 | -178.9 | 0 | 0 | 0 | 105.5 | S74 Y78 | S74-I76 PolarHBondContact O-N 2.87Å; I76-Y78 VanDerWaalsContact C-N 3.31Å; I76-Y78 HydrophobicContact CG2-CD2 4.36Å; I76-Y78 HydrophobicContact CG2-CE2 4.27Å; I76-Y78 PolarHBondContact O-N 3.25Å | ||
| 77 | N | 29.1 | Very low | 31.3 | Very low | 139 Ų | 139 | 142.3 Ų | 142.3 | 74% | 0.743 | 79% | 0.785 | S | S | * | * | trans | -63.6 | 92.9 | 173.9 | -172.8 | 24.2 | 0 | 0 | 0 | 107.9 | D75 T79 | D75-N77 PolarHBondContact O-N 3.07Å; N77-T79 VanDerWaalsContact C-N 3.26Å; N77-T79 PolarHBondContact O-N 3.22Å | ||
| 78 | Y | 31.9 | Very low | 31.2 | Very low | 189 Ų | 189 | 140 Ų | 140 | 74% | 0.741 | 78% | 0.784 | S | S | * | * | trans | -64.1 | 91.1 | 174.5 | -89.3 | -79.2 | 0 | 0 | 0 | 109.1 | I76 C80 | I76-Y78 VanDerWaalsContact C-N 3.31Å; I76-Y78 HydrophobicContact CG2-CD2 4.36Å; I76-Y78 HydrophobicContact CG2-CE2 4.27Å; I76-Y78 PolarHBondContact O-N 3.25Å; Y78-C80 PolarHBondContact O-N 2.9Å | ||
| 79 | T | 29.7 | Very low | 31.1 | Very low | 116 Ų | 116 | 141.2 Ų | 141.2 | 71% | 0.712 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 124.1 | 162.9 | 45.1 | 0 | 0 | 0 | 0 | 108.2 | N77 E81 | N77-T79 VanDerWaalsContact C-N 3.26Å; N77-T79 PolarHBondContact O-N 3.22Å; T79-E81 PolarHBondContact O-N 3.48Å |
| 80 | C | 27.7 | Very low | 31.3 | Very low | 123 Ų | 123 | 140.8 Ų | 140.8 | 83% | 0.831 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 121.6 | 172.4 | -166.6 | 0 | 0 | 0 | 0 | 108.3 | Y78 K82 | Y78-C80 PolarHBondContact O-N 2.9Å; C80-K82 PolarHBondContact O-N 3.13Å |
| 81 | E | 30.1 | Very low | 31.4 | Very low | 176 Ų | 176 | 144.5 Ų | 144.5 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 136.2 | 165 | -66.7 | 176.2 | 132.2 | 0 | 0 | 108.2 | T79 | T79-E81 PolarHBondContact O-N 3.48Š|
| 82 | K | 29.4 | Very low | 31.3 | Very low | 196 Ų | 196 | 144.9 Ų | 144.9 | 85% | 0.852 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 130.2 | 173.2 | -67 | 177.5 | 179.5 | 176.4 | 0 | 108.1 | C80 | C80-K82 PolarHBondContact O-N 3.13Š|
| 83 | P | 34.6 | Very low | 31.4 | Very low | 121 Ų | 121 | 150.6 Ų | 150.6 | 79% | 0.786 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 149.8 | 156.8 | 29.5 | -33.1 | 0 | 0 | 0 | 109.4 | ||
| 84 | V | 30 | Very low | 31.3 | Very low | 146 Ų | 146 | 150.8 Ų | 150.8 | 89% | 0.885 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 151 | 172.3 | 176.7 | 0 | 0 | 0 | 0 | 109.3 | ||
| 85 | A | 30.5 | Very low | 31.7 | Very low | 94 Ų | 94 | 152.3 Ų | 152.3 | 78% | 0.777 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -77 | 133.6 | -170 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 86 | E | 29.1 | Very low | 31.5 | Very low | 189 Ų | 189 | 151.1 Ų | 151.1 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | trans | -105.8 | 158.7 | 152.9 | -76.3 | -166.2 | 125.8 | 0 | 0 | 110.3 | ||||
| 87 | Q | 30.7 | Very low | 31.6 | Very low | 164 Ų | 164 | 153.3 Ų | 153.3 | 77% | 0.766 | 81% | 0.808 | S | S | * | * | trans | -87.9 | 123.2 | -161.7 | -62.8 | 174.5 | -1.9 | 0 | 0 | 112.6 | ||||
| 88 | T | 25.9 | Very low | 31.6 | Very low | 140 Ų | 140 | 152.1 Ų | 152.1 | 86% | 0.859 | 81% | 0.81 | S | S | * | * | trans | -90.8 | 107.7 | 177.2 | -53.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 89 | Y | 29.7 | Very low | 31.5 | Very low | 185 Ų | 185 | 153 Ų | 153 | 73% | 0.725 | 81% | 0.814 | S | S | * | * | trans | -73.4 | 149.7 | 166.2 | -72.5 | -88.7 | 0 | 0 | 0 | 111.3 | T91 | Y89-T91 PolarHBondContact O-N 2.99Š| ||
| 90 | P | 33.6 | Very low | 31.8 | Very low | 121 Ų | 121 | 154.1 Ų | 154.1 | 79% | 0.786 | 82% | 0.821 | S | S | * | * | trans | -84.3 | 106.8 | -168.3 | 31.8 | -35.2 | 0 | 0 | 0 | 113.8 | ||||
| 91 | T | 29.8 | Very low | 31.8 | Very low | 137 Ų | 137 | 150.9 Ų | 150.9 | 84% | 0.84 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 116.5 | 169.1 | -48.1 | 0 | 0 | 0 | 0 | 110.8 | Y89 | Y89-T91 PolarHBondContact O-N 2.99Š|
| 92 | Q | 32.5 | Very low | 31.9 | Very low | 181 Ų | 181 | 153.4 Ų | 153.4 | 85% | 0.846 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 142.4 | 177.4 | -65 | -174.2 | 0.7 | 0 | 0 | 112.1 | ||
| 93 | R | 31 | Very low | 31.9 | Very low | 250 Ų | 250 | 154.1 Ų | 154.1 | 94% | 0.943 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -84 | 120.2 | 169 | -80.2 | -176.9 | 171.3 | 179.8 | -2.7 | 110.4 | ||
| 94 | L | 37.1 | Very low | 31.8 | Very low | 159 Ų | 159 | 153.9 Ų | 153.9 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -84.2 | 148.6 | 161.3 | -73.5 | 164.6 | 0 | 0 | 0 | 110.5 | ||
| 95 | P | 39.3 | Very low | 31.9 | Very low | 105 Ų | 105 | 155.1 Ų | 155.1 | 68% | 0.682 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 160.3 | 176 | 30.9 | -35 | 0 | 0 | 0 | 112.3 | I97 | P95-I97 PolarHBondContact O-N 2.63Š|
| 96 | P | 35.8 | Very low | 32.1 | Very low | 127 Ų | 127 | 159.3 Ų | 159.3 | 83% | 0.825 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 126.2 | -173.7 | 29.2 | -35 | 0 | 0 | 0 | 112.8 | ||
| 97 | I | 35 | Very low | 32.6 | Very low | 161 Ų | 161 | 156 Ų | 156 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | trans | -89.1 | 105.2 | 169.5 | -58.2 | 175.6 | 0 | 0 | 0 | 108.5 | P95 | P95-I97 PolarHBondContact O-N 2.63Š| ||
| 98 | S | 30.3 | Very low | 32.5 | Very low | 114 Ų | 114 | 152.8 Ų | 152.8 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | trans | -86.2 | 112.5 | 169.3 | 54 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 99 | Y | 29.8 | Very low | 33 | Very low | 207 Ų | 207 | 152.2 Ų | 152.2 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | trans | -121.8 | 111.2 | 175.8 | -160.5 | -93.8 | 0 | 0 | 0 | 112.1 | G101 | Y99-G101 PolarHBondContact O-N 3.08Š| ||
| 100 | T | 36.3 | Very low | 33 | Very low | 141 Ų | 141 | 149.5 Ų | 149.5 | 87% | 0.865 | 81% | 0.81 | S | S | * | * | trans | -88 | 85.3 | 176.4 | 49 | 0 | 0 | 0 | 0 | 110.7 | R102 | T100-R102 PolarHBondContact O-N 3.27Š| ||
| 101 | G | 27.6 | Very low | 32.7 | Very low | 55 Ų | 55 | 149.2 Ų | 149.2 | 57% | 0.567 | 81% | 0.81 | S | S | * | * | trans | -80.6 | 99.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y99 | Y99-G101 PolarHBondContact O-N 3.08Š| ||
| 102 | R | 30.9 | Very low | 32.8 | Very low | 229 Ų | 229 | 147.2 Ų | 147.2 | 86% | 0.864 | 80% | 0.802 | S | S | * | * | trans | -73 | 134.5 | 159.7 | -95.7 | 179.3 | 166.6 | 164.2 | -5.9 | 109 | T100 | T100-R102 PolarHBondContact O-N 3.27Š| ||
| 103 | F | 30.1 | Very low | 32.8 | Very low | 210 Ų | 210 | 145.5 Ų | 145.5 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -85.8 | 110.3 | 161.1 | -85.1 | -90.2 | 0 | 0 | 0 | 109.4 | ||||
| 104 | T | 31.8 | Very low | 32.9 | Very low | 116 Ų | 116 | 138.4 Ų | 138.4 | 71% | 0.712 | 79% | 0.787 | S | S | * | * | trans | -130.8 | 125.9 | 164.6 | 42.5 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 105 | L | 33.8 | Very low | 32.7 | Very low | 173 Ų | 173 | 137.3 Ų | 137.3 | 91% | 0.906 | 78% | 0.781 | S | S | * | * | trans | -82 | 129.3 | 177.9 | -65.2 | 165.8 | 0 | 0 | 0 | 109.3 | ||||
| 106 | E | 32.8 | Very low | 32.4 | Very low | 182 Ų | 182 | 143.5 Ų | 143.5 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -104 | 137.2 | 166.3 | -73.3 | -164.1 | 153.1 | 0 | 0 | 111.2 | ||||
| 107 | P | 40.6 | Very low | 32.1 | Very low | 119 Ų | 119 | 142 Ų | 142 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | trans | -87.6 | 125.7 | 149.9 | 33.3 | -26.3 | 0 | 0 | 0 | 109.4 | ||||
| 108 | A | 28.3 | Very low | 32.1 | Very low | 97 Ų | 97 | 142.7 Ų | 142.7 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | -77.5 | 134 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 109 | T | 36.2 | Very low | 33.3 | Very low | 127 Ų | 127 | 141.9 Ų | 141.9 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | trans | -130.5 | 96 | 164.9 | 55.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 110 | T | 30.4 | Very low | 33.7 | Very low | 129 Ų | 129 | 138.6 Ų | 138.6 | 79% | 0.791 | 78% | 0.776 | S | S | * | * | trans | 35.4 | 133.9 | 138.5 | 52.7 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 111 | C | 27.6 | Very low | 33.6 | Very low | 114 Ų | 114 | 140.1 Ų | 140.1 | 77% | 0.77 | 78% | 0.778 | S | S | * | * | trans | 100.7 | 109.7 | 146 | -67.9 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 112 | S | 31.7 | Very low | 33.8 | Very low | 96 Ų | 96 | 141.2 Ų | 141.2 | 67% | 0.671 | 79% | 0.789 | S | S | * | * | 71.7 | 117.6 | 128.8 | 65.8 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 113 | N | 33.1 | Very low | 34 | Very low | 145 Ų | 145 | 138.1 Ų | 138.1 | 78% | 0.775 | 79% | 0.789 | S | S | * | * | 69.6 | 99.1 | 126 | -61.5 | -3.4 | 0 | 0 | 0 | 120 | |||||
| 114 | S | 32.3 | Very low | 34.3 | Very low | 101 Ų | 101 | 138 Ų | 138 | 71% | 0.706 | 79% | 0.789 | S | S | * | * | 77.6 | 128.9 | 105.8 | -69.2 | 0 | 0 | 0 | 0 | 122.8 | |||||
| 115 | L | 33.3 | Very low | 34.5 | Very low | 136 Ų | 136 | 138.9 Ų | 138.9 | 71% | 0.712 | 79% | 0.793 | S | S | * | * | trans | 83.2 | 109.4 | 141.9 | -88 | 86.5 | 0 | 0 | 0 | 121.9 | ||||
| 116 | W | 31.7 | Very low | 34.6 | Very low | 235 Ų | 235 | 134 Ų | 134 | 89% | 0.89 | 79% | 0.786 | S | S | * | * | trans | 80.2 | 155 | 130.7 | -73.4 | 41.7 | 0 | 0 | 0 | 122.2 | ||||
| 117 | A | 30.4 | Very low | 34.9 | Very low | 95 Ų | 95 | 133.3 Ų | 133.3 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | 76.9 | 98.9 | 153.9 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 118 | E | 35.1 | Very low | 34.6 | Very low | 175 Ų | 175 | 135.7 Ų | 135.7 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | -58.5 | 174.3 | 135.8 | -72.8 | -83.3 | 147.3 | 0 | 0 | 111.8 | ||||
| 119 | P | 56.4 | Low | 35 | Very low | 97 Ų | 97 | 137 Ų | 137 | 63% | 0.63 | 79% | 0.793 | S | S | * | * | cis | -138.1 | -161.3 | -15.1 | 21.7 | 5.6 | 0 | 0 | 0 | 113.8 | ||||
| 120 | I | 37.3 | Very low | 35 | Very low | 139 Ų | 139 | 138.1 Ų | 138.1 | 71% | 0.713 | 79% | 0.794 | S | S | * | * | trans | 99.5 | 118.1 | 146.2 | -56.2 | -169.5 | 0 | 0 | 0 | 120.5 | ||||
| 121 | L | 34 | Very low | 35.2 | Very low | 173 Ų | 173 | 138.5 Ų | 138.5 | 91% | 0.906 | 80% | 0.796 | S | S | * | * | trans | 49.9 | 136.8 | 152.2 | -65.8 | 166.2 | 0 | 0 | 0 | 122 | ||||
| 122 | G | 31.6 | Very low | 35.7 | Very low | 77 Ų | 77 | 137.3 Ų | 137.3 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | -179.4 | 82 | 167.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 123 | L | 35.4 | Very low | 36.6 | Very low | 164 Ų | 164 | 138.8 Ų | 138.8 | 86% | 0.859 | 80% | 0.801 | S | S | * | * | trans | -51.9 | 144.5 | 175 | -66.2 | 156 | 0 | 0 | 0 | 113.3 | ||||
| 124 | F | 36.8 | Very low | 36.8 | Very low | 209 Ų | 209 | 138.3 Ų | 138.3 | 92% | 0.917 | 80% | 0.804 | S | S | * | * | trans | -157.4 | 164.1 | 132.2 | -112.7 | -72.6 | 0 | 0 | 0 | 112.8 | ||||
| 125 | T | 36.7 | Very low | 37 | Very low | 133 Ų | 133 | 139.1 Ų | 139.1 | 82% | 0.816 | 81% | 0.809 | S | S | * | * | trans | -106 | 161.7 | -167.2 | 52.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 126 | G | 34.5 | Very low | 37.1 | Very low | 72 Ų | 72 | 137.3 Ų | 137.3 | 74% | 0.742 | 81% | 0.808 | S | S | * | * | trans | 178.1 | 83.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 127 | L | 39.5 | Very low | 37.3 | Very low | 167 Ų | 167 | 131.3 Ų | 131.3 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | trans | 33 | 114.3 | 142.9 | -72.1 | 159.3 | 0 | 0 | 0 | 122.3 | ||||
| 128 | M | 34.6 | Very low | 37.6 | Very low | 168 Ų | 168 | 131.9 Ų | 131.9 | 83% | 0.828 | 80% | 0.8 | S | S | * | * | 11.2 | 133.3 | 123.1 | -64.1 | -70.6 | -173.6 | 0 | 0 | 119.7 | |||||
| 129 | S | 37.1 | Very low | 37.8 | Very low | 124 Ų | 124 | 129 Ų | 129 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | -159.7 | 146.4 | 124.3 | -84.9 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 130 | N | 36.2 | Very low | 36.6 | Very low | 151 Ų | 151 | 128.1 Ų | 128.1 | 81% | 0.807 | 80% | 0.801 | S | S | * | * | trans | -82.5 | 166.7 | 169.1 | -71 | -57.3 | 0 | 0 | 0 | 110.7 | ||||
| 131 | V | 34.2 | Very low | 36.4 | Very low | 138 Ų | 138 | 126.6 Ų | 126.6 | 84% | 0.836 | 80% | 0.802 | S | S | * | * | 161.1 | 127.9 | 120.7 | 158.3 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 132 | A | 37.2 | Very low | 36.5 | Very low | 88 Ų | 88 | 123.4 Ų | 123.4 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | -100.2 | 160.4 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 133 | P | 50.4 | Low | 36.6 | Very low | 127 Ų | 127 | 128.1 Ų | 128.1 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -135.9 | 158.3 | 135.2 | 35 | -23.1 | 0 | 0 | 0 | 114.7 | ||||
| 134 | T | 38.9 | Very low | 36.3 | Very low | 136 Ų | 136 | 125.5 Ų | 125.5 | 83% | 0.834 | 79% | 0.787 | S | S | * | * | trans | -105.4 | 144.4 | 178.8 | 51.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 135 | S | 35 | Very low | 36.2 | Very low | 117 Ų | 117 | 120.7 Ų | 120.7 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -174.3 | 157 | 155.4 | 46 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 136 | S | 35.5 | Very low | 36 | Very low | 98 Ų | 98 | 119 Ų | 119 | 69% | 0.685 | 77% | 0.773 | S | S | * | * | cis | -173.9 | 152.6 | -32.4 | 51.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 137 | S | 36.5 | Very low | 35.9 | Very low | 110 Ų | 110 | 120.9 Ų | 120.9 | 77% | 0.769 | 77% | 0.774 | S | S | * | * | trans | 64.6 | 161.6 | 156.1 | 70.8 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 138 | S | 37.8 | Very low | 35.5 | Very low | 106 Ų | 106 | 117.9 Ų | 117.9 | 74% | 0.741 | 77% | 0.767 | S | S | * | * | cis | -149.5 | 170.2 | 11 | -53.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 139 | S | 37.5 | Very low | 35.4 | Very low | 115 Ų | 115 | 115.6 Ų | 115.6 | 80% | 0.804 | 77% | 0.768 | S | S | * | * | trans | -38 | 173.8 | 159.7 | 55.5 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 140 | A | 32 | Very low | 35.1 | Very low | 79 Ų | 79 | 115 Ų | 115 | 65% | 0.653 | 76% | 0.764 | S | S | * | * | cis | -154.7 | 150.9 | 19.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 141 | S | 33.7 | Very low | 34.7 | Very low | 106 Ų | 106 | 113.8 Ų | 113.8 | 74% | 0.741 | 76% | 0.762 | S | S | * | * | 48.7 | 139.8 | 76.8 | 30.1 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 142 | S | 35.6 | Very low | 34.7 | Very low | 107 Ų | 107 | 114.8 Ų | 114.8 | 75% | 0.748 | 76% | 0.761 | S | S | * | * | cis | -170.8 | -173.1 | -1.5 | -96.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 143 | Q | 34.5 | Very low | 35.2 | Very low | 176 Ų | 176 | 116.4 Ų | 116.4 | 82% | 0.822 | 76% | 0.764 | S | S | * | * | trans | 89.8 | 144.4 | 159.4 | -52.8 | -165.4 | 37.7 | 0 | 0 | 117.6 | ||||
| 144 | T | 28.2 | Very low | 34.4 | Very low | 109 Ų | 109 | 116.1 Ų | 116.1 | 67% | 0.669 | 77% | 0.765 | S | S | * | * | cis | -165.6 | 148.5 | -3 | 14.2 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 145 | S | 34 | Very low | 34 | Very low | 108 Ų | 108 | 115.5 Ų | 115.5 | 76% | 0.755 | 77% | 0.766 | S | S | * | * | trans | 48.7 | 152 | 144.1 | 61.4 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 146 | S | 32.7 | Very low | 33.8 | Very low | 97 Ų | 97 | 115.4 Ų | 115.4 | 68% | 0.678 | 77% | 0.766 | S | S | * | * | cis | -175.1 | 154.4 | -1.4 | 39.4 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 147 | S | 33.2 | Very low | 33.5 | Very low | 111 Ų | 111 | 117.9 Ų | 117.9 | 78% | 0.776 | 78% | 0.777 | S | S | * | * | trans | 57.6 | 157 | 151.2 | 51 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 148 | S | 31.4 | Very low | 33.2 | Very low | 104 Ų | 104 | 118.2 Ų | 118.2 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | cis | -160.8 | 138.7 | 3.6 | 30 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 149 | S | 32.3 | Very low | 32.8 | Very low | 121 Ų | 121 | 119 Ų | 119 | 85% | 0.846 | 79% | 0.785 | S | S | * | * | 82.4 | 100.5 | 70.4 | -53.5 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 150 | S | 29.6 | Very low | 32.5 | Very low | 111 Ų | 111 | 118.7 Ų | 118.7 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -175.1 | 118.4 | 153.8 | 45.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 151 | T | 28.3 | Very low | 32.5 | Very low | 126 Ų | 126 | 119.8 Ų | 119.8 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | 73.4 | 95.8 | 70.2 | 60.8 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 152 | I | 35 | Very low | 32.2 | Very low | 159 Ų | 159 | 120.6 Ų | 120.6 | 82% | 0.815 | 79% | 0.786 | S | S | * | * | 48.1 | 126.1 | 114 | -68.8 | 174.2 | 0 | 0 | 0 | 116.6 | |||||
| 153 | P | 47.8 | Very low | 31.9 | Very low | 122 Ų | 122 | 120.3 Ų | 120.3 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | -145.8 | 162.3 | 67 | 41 | -23.6 | 0 | 0 | 0 | 119.6 | |||||
| 154 | S | 33.3 | Very low | 31.7 | Very low | 120 Ų | 120 | 116.6 Ų | 116.6 | 84% | 0.839 | 78% | 0.778 | S | S | * | * | trans | -82.5 | 154.3 | 159.6 | -45.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 155 | S | 30.4 | Very low | 31.8 | Very low | 123 Ų | 123 | 116.4 Ų | 116.4 | 86% | 0.86 | 78% | 0.781 | S | S | * | * | trans | -134.2 | 124 | 164.5 | 52.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 156 | S | 30.1 | Very low | 31.7 | Very low | 116 Ų | 116 | 116.7 Ų | 116.7 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -104.8 | 150.6 | 161.6 | 48.9 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 157 | T | 29.5 | Very low | 31.6 | Very low | 149 Ų | 149 | 121.5 Ų | 121.5 | 91% | 0.914 | 80% | 0.795 | S | S | * | * | trans | -128.8 | 146.6 | 162.3 | 41.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 158 | S | 29.8 | Very low | 31.6 | Very low | 117 Ų | 117 | 121.8 Ų | 121.8 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -130.3 | 155.9 | -170.6 | 50.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 159 | S | 30 | Very low | 31.6 | Very low | 123 Ų | 123 | 122.7 Ų | 122.7 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -147.1 | 89.1 | 168.2 | 42.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 160 | S | 32.1 | Very low | 31.5 | Very low | 109 Ų | 109 | 122 Ų | 122 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | trans | -70.3 | 164 | 150.5 | 50.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 161 | S | 31.7 | Very low | 31.6 | Very low | 101 Ų | 101 | 124.5 Ų | 124.5 | 71% | 0.706 | 80% | 0.802 | S | S | * | * | cis | -159.6 | 170 | 8.7 | 19.1 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 162 | T | 27.3 | Very low | 31.5 | Very low | 124 Ų | 124 | 124.6 Ų | 124.6 | 76% | 0.761 | 80% | 0.798 | S | S | * | * | -167.8 | 166.4 | 65.3 | 41.4 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 163 | S | 29.4 | Very low | 31.2 | Very low | 100 Ų | 100 | 122.2 Ų | 122.2 | 70% | 0.699 | 79% | 0.791 | S | S | * | * | trans | -20.9 | 155.7 | 162.6 | 54 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 164 | S | 29.6 | Very low | 30.2 | Very low | 99 Ų | 99 | 121.1 Ų | 121.1 | 69% | 0.692 | 79% | 0.785 | S | S | * | * | -161.7 | 155.2 | 52.7 | -58.8 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 165 | S | 30.4 | Very low | 30.2 | Very low | 104 Ų | 104 | 122 Ų | 122 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | trans | 49.8 | 103.5 | 143.4 | 59.8 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 166 | S | 32.7 | Very low | 30.3 | Very low | 115 Ų | 115 | 123.8 Ų | 123.8 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | 22.4 | 130.8 | 116.5 | -40.5 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 167 | Q | 30.6 | Very low | 30.2 | Very low | 198 Ų | 198 | 125.4 Ų | 125.4 | 93% | 0.925 | 77% | 0.768 | S | S | * | * | -164.4 | 163.4 | 109.2 | -107.6 | 177.5 | 32.8 | 0 | 0 | 112.5 | |||||
| 168 | S | 33.1 | Very low | 30.3 | Very low | 117 Ų | 117 | 123.3 Ų | 123.3 | 82% | 0.818 | 76% | 0.76 | S | S | * | * | trans | -138.5 | 129.1 | 179.7 | 57.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 169 | S | 30.8 | Very low | 30.5 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 85% | 0.853 | 76% | 0.757 | S | S | * | * | trans | -146.2 | 133 | 170.3 | 49.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 170 | S | 30.9 | Very low | 31.8 | Very low | 106 Ų | 106 | 125.1 Ų | 125.1 | 74% | 0.741 | 75% | 0.752 | S | S | * | * | trans | -97.7 | -178.4 | 169.3 | 52.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 171 | L | 30.1 | Very low | 32 | Very low | 165 Ų | 165 | 125.6 Ų | 125.6 | 86% | 0.864 | 75% | 0.746 | S | S | * | * | trans | 102.2 | 157 | 174.2 | -57.1 | 164.8 | 0 | 0 | 0 | 115.6 | ||||
| 172 | N | 27.1 | Very low | 32.9 | Very low | 128 Ų | 128 | 126.3 Ų | 126.3 | 68% | 0.684 | 75% | 0.748 | S | S | * | * | cis | 177.9 | 150.9 | -49.6 | -175.7 | 28 | 0 | 0 | 0 | 108.2 | ||||
| 173 | T | 28.1 | Very low | 33.2 | Very low | 109 Ų | 109 | 127.2 Ų | 127.2 | 67% | 0.669 | 75% | 0.747 | S | S | * | * | trans | 67.8 | 142.3 | 156.7 | 30.5 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 174 | S | 27.3 | Very low | 33.4 | Very low | 98 Ų | 98 | 132.8 Ų | 132.8 | 69% | 0.685 | 75% | 0.754 | S | S | * | * | trans | 77.7 | 116.6 | 149.9 | -59.5 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 175 | I | 33.7 | Very low | 33.4 | Very low | 138 Ų | 138 | 132.3 Ų | 132.3 | 71% | 0.708 | 75% | 0.751 | S | S | * | * | 93.3 | 117.7 | 56.2 | -73.1 | 160 | 0 | 0 | 0 | 112.6 | |||||
| 176 | H | 31.3 | Very low | 33.5 | Very low | 162 Ų | 162 | 132.5 Ų | 132.5 | 75% | 0.75 | 76% | 0.759 | S | S | * | * | 179.5 | 150.6 | 126.1 | -97.7 | -67.5 | 0 | 0 | 0 | 115.4 | |||||
| 177 | H | 29 | Very low | 33.5 | Very low | 150 Ų | 150 | 131.4 Ų | 131.4 | 69% | 0.694 | 76% | 0.756 | S | S | * | * | trans | 10 | 120.1 | 166.5 | -59.9 | -55.8 | 0 | 0 | 0 | 125.7 | ||||
| 178 | S | 31.8 | Very low | 34.2 | Very low | 105 Ų | 105 | 127.9 Ų | 127.9 | 73% | 0.734 | 75% | 0.751 | S | S | * | * | 37.2 | 114.3 | 99.4 | -45.8 | 0 | 0 | 0 | 0 | 123 | |||||
| 179 | E | 34 | Very low | 34.2 | Very low | 160 Ų | 160 | 128.2 Ų | 128.2 | 75% | 0.748 | 75% | 0.748 | S | S | * | * | trans | 53 | 164.5 | 132.4 | -90.5 | -152.1 | -128.1 | 0 | 0 | 122.8 | N181 | E179-N181 PolarHBondContact OE2-ND2 3.47Š| ||
| 180 | P | 56.4 | Low | 34.1 | Very low | 117 Ų | 117 | 132.8 Ų | 132.8 | 76% | 0.76 | 75% | 0.748 | S | S | * | * | cis | -138.7 | 169 | 21.6 | 42.3 | -23.1 | 0 | 0 | 0 | 121.1 | ||||
| 181 | N | 35.7 | Very low | 34.1 | Very low | 120 Ų | 120 | 132.2 Ų | 132.2 | 64% | 0.642 | 74% | 0.744 | S | S | * | * | trans | -13.1 | 156.3 | 153.7 | -83 | -75.1 | 0 | 0 | 0 | 122.4 | E179 | E179-N181 PolarHBondContact OE2-ND2 3.47Š| ||
| 182 | P | 52.2 | Low | 34.3 | Very low | 115 Ų | 115 | 130 Ų | 130 | 75% | 0.747 | 74% | 0.743 | S | S | * | * | -155.2 | 132.3 | 86.8 | 38.5 | -17.2 | 0 | 0 | 0 | 122.1 | |||||
| 183 | I | 32.9 | Very low | 35.3 | Very low | 144 Ų | 144 | 130 Ų | 130 | 74% | 0.738 | 75% | 0.749 | S | S | * | * | 48.6 | 147.9 | 127.9 | -25.9 | 179.2 | 0 | 0 | 0 | 124.1 | |||||
| 184 | Y | 32.8 | Very low | 35.4 | Very low | 216 Ų | 216 | 132.1 Ų | 132.1 | 85% | 0.847 | 76% | 0.757 | S | S | * | * | trans | 93.8 | 141.7 | 163.2 | -88.3 | -104.6 | 0 | 0 | 0 | 119 | ||||
| 185 | S | 31.2 | Very low | 35.6 | Very low | 90 Ų | 90 | 131.7 Ų | 131.7 | 63% | 0.629 | 75% | 0.754 | S | S | * | * | cis | -174.8 | 141.8 | -32 | -96.7 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 186 | A | 32.6 | Very low | 35.4 | Very low | 108 Ų | 108 | 131.6 Ų | 131.6 | 89% | 0.893 | 76% | 0.755 | S | S | * | * | trans | 54.5 | 161.7 | 148.2 | 0 | 0 | 0 | 0 | 0 | 123 | ||||
| 187 | A | 31.9 | Very low | 35.3 | Very low | 91 Ų | 91 | 131.4 Ų | 131.4 | 75% | 0.752 | 76% | 0.757 | S | S | * | * | trans | -132.7 | 173.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 188 | P | 44.6 | Very low | 35.6 | Very low | 125 Ų | 125 | 133.5 Ų | 133.5 | 81% | 0.812 | 77% | 0.765 | S | S | * | * | trans | -107.7 | 172.4 | 162.9 | 37.7 | -29.7 | 0 | 0 | 0 | 113.5 | ||||
| 189 | T | 32.8 | Very low | 36.4 | Very low | 124 Ų | 124 | 134.2 Ų | 134.2 | 76% | 0.761 | 77% | 0.767 | S | S | * | * | trans | -143.9 | -166.6 | -164.6 | 53.6 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 190 | Y | 28.9 | Very low | 36.1 | Very low | 217 Ų | 217 | 132.6 Ų | 132.6 | 85% | 0.851 | 76% | 0.764 | S | S | * | * | trans | 76.7 | 153.4 | 174.3 | -85.8 | -120.6 | 0 | 0 | 0 | 117.7 | ||||
| 191 | S | 31.1 | Very low | 35 | Very low | 94 Ų | 94 | 134.5 Ų | 134.5 | 66% | 0.657 | 76% | 0.763 | S | S | * | * | cis | -175.6 | 157.3 | -30.9 | -97.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 192 | S | 35.1 | Very low | 35 | Very low | 119 Ų | 119 | 132.9 Ų | 132.9 | 83% | 0.832 | 76% | 0.76 | S | S | * | * | trans | -80.1 | 159.4 | 171.8 | -45.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 193 | P | 47.5 | Very low | 34.3 | Very low | 127 Ų | 127 | 135.7 Ų | 135.7 | 83% | 0.825 | 76% | 0.764 | S | S | * | * | trans | -113.2 | 173.3 | 150.5 | 37.4 | -28.7 | 0 | 0 | 0 | 112.3 | ||||
| 194 | N | 31.2 | Very low | 34.2 | Very low | 155 Ų | 155 | 131.7 Ų | 131.7 | 83% | 0.829 | 76% | 0.758 | S | S | * | * | trans | -133.5 | 154.8 | -174 | -130.7 | -8.9 | 0 | 0 | 0 | 111.5 | ||||
| 195 | S | 30.1 | Very low | 34 | Very low | 89 Ų | 89 | 130.9 Ų | 130.9 | 62% | 0.622 | 76% | 0.759 | S | S | * | * | trans | 59.8 | 152.8 | 150.9 | 70.2 | 0 | 0 | 0 | 0 | 124 | ||||
| 196 | D | 30.6 | Very low | 34 | Very low | 136 Ų | 136 | 130 Ų | 130 | 73% | 0.727 | 76% | 0.757 | S | S | * | * | trans | 106.3 | 122 | 140.2 | -65.2 | -47 | 0 | 0 | 0 | 124.1 | ||||
| 197 | I | 29 | Very low | 33.9 | Very low | 157 Ų | 157 | 131.2 Ų | 131.2 | 81% | 0.805 | 75% | 0.753 | S | S | * | * | trans | 87.4 | 127.6 | 141.9 | -68 | 164 | 0 | 0 | 0 | 121.4 | ||||
| 198 | F | 34.3 | Very low | 34.1 | Very low | 194 Ų | 194 | 131.6 Ų | 131.6 | 85% | 0.851 | 75% | 0.751 | S | S | * | * | trans | -86 | 152.8 | 167.9 | -91.4 | -88.5 | 0 | 0 | 0 | 111.8 | ||||
| 199 | P | 48.8 | Very low | 33.4 | Very low | 121 Ų | 121 | 131 Ų | 131 | 79% | 0.786 | 76% | 0.757 | S | S | * | * | -144.1 | -176.8 | 96.6 | 22.1 | 0.8 | 0 | 0 | 0 | 112.5 | |||||
| 200 | D | 29.3 | Very low | 33.2 | Very low | 125 Ų | 125 | 128.9 Ų | 128.9 | 67% | 0.668 | 76% | 0.759 | S | S | * | * | cis | -179 | 168.9 | -29 | 177.8 | 26.8 | 0 | 0 | 0 | 105.9 | ||||
| 201 | Q | 32 | Very low | 33.3 | Very low | 158 Ų | 158 | 124.1 Ų | 124.1 | 74% | 0.738 | 76% | 0.758 | S | S | * | * | trans | 74.9 | 150.2 | 160.7 | -49 | -158.9 | 4.8 | 0 | 0 | 120.3 | ||||
| 202 | S | 35.4 | Very low | 33.3 | Very low | 85 Ų | 85 | 125.3 Ų | 125.3 | 59% | 0.594 | 76% | 0.76 | S | S | * | * | cis | -168.4 | 172.8 | -25.4 | 56.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 203 | Q | 37.7 | Very low | 33 | Very low | 175 Ų | 175 | 127.2 Ų | 127.2 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | trans | 76.8 | 141.7 | 163.8 | -37.7 | -162.6 | 14.4 | 0 | 0 | 118.7 | ||||
| 204 | G | 30.6 | Very low | 32.1 | Very low | 60 Ų | 60 | 131.3 Ų | 131.3 | 62% | 0.619 | 76% | 0.757 | S | S | * | * | cis | 164.2 | 159.3 | -12.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 205 | F | 29 | Very low | 32.6 | Very low | 199 Ų | 199 | 129.4 Ų | 129.4 | 87% | 0.873 | 75% | 0.753 | S | S | * | * | trans | 66.9 | 148.7 | 163.8 | -57.7 | -83.7 | 0 | 0 | 0 | 118.2 | ||||
| 206 | A | 31.5 | Very low | 33.6 | Very low | 70 Ų | 70 | 130.7 Ų | 130.7 | 58% | 0.579 | 76% | 0.759 | S | S | * | * | cis | -169.9 | 166.1 | -18.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 207 | T | 30.8 | Very low | 34 | Very low | 134 Ų | 134 | 129.9 Ų | 129.9 | 82% | 0.822 | 76% | 0.761 | S | S | * | * | trans | 61.8 | 158.9 | 153.5 | 45.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 208 | S | 35.1 | Very low | 34.1 | Very low | 100 Ų | 100 | 127 Ų | 127 | 70% | 0.699 | 76% | 0.761 | S | S | * | * | cis | -175.7 | 147.5 | -35.3 | 54.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 209 | A | 30 | Very low | 34.2 | Very low | 113 Ų | 113 | 129.1 Ų | 129.1 | 93% | 0.934 | 77% | 0.765 | S | S | * | * | trans | 66.1 | 155.3 | 162.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 210 | G | 29.8 | Very low | 34.1 | Very low | 79 Ų | 79 | 129 Ų | 129 | 81% | 0.814 | 76% | 0.764 | S | S | * | * | trans | 144.8 | 137.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 211 | S | 30.9 | Very low | 34.3 | Very low | 117 Ų | 117 | 131 Ų | 131 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -144.3 | -176.8 | -171.9 | 54.3 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 212 | V | 30.7 | Very low | 34.3 | Very low | 118 Ų | 118 | 127 Ų | 127 | 72% | 0.715 | 78% | 0.776 | S | S | * | * | trans | 99.3 | 88.5 | 162.5 | -170.7 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 213 | Q | 28.6 | Very low | 34.1 | Very low | 159 Ų | 159 | 133.2 Ų | 133.2 | 74% | 0.743 | 79% | 0.793 | S | S | * | * | 72.8 | 104.9 | 106.6 | -151.1 | 172.4 | -10.9 | 0 | 0 | 124.5 | |||||
| 214 | Y | 28 | Very low | 34 | Very low | 213 Ų | 213 | 131.6 Ų | 131.6 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | 61.4 | 175 | 145.6 | -75.3 | -109.6 | 0 | 0 | 0 | 119.7 | ||||
| 215 | P | 42.6 | Very low | 33.8 | Very low | 116 Ų | 116 | 134.9 Ų | 134.9 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | cis | -122.9 | -174.5 | -13.9 | 22.2 | 3 | 0 | 0 | 0 | 114.1 | ||||
| 216 | P | 50 | Low | 33.9 | Very low | 116 Ų | 116 | 131.4 Ų | 131.4 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | trans | -108.4 | 157 | -171.9 | 39.5 | -34.1 | 0 | 0 | 0 | 117.5 | ||||
| 217 | P | 39.1 | Very low | 34 | Very low | 119 Ų | 119 | 134.3 Ų | 134.3 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | trans | -98.7 | 139.1 | 155.4 | 35.7 | -28.1 | 0 | 0 | 0 | 111.2 | ||||
| 218 | A | 31.5 | Very low | 34.1 | Very low | 97 Ų | 97 | 133.3 Ų | 133.3 | 80% | 0.802 | 82% | 0.816 | S | S | * | * | cis | 82.6 | 101.2 | 48.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 219 | Y | 36.9 | Very low | 33.9 | Very low | 238 Ų | 238 | 137.9 Ų | 137.9 | 93% | 0.933 | 82% | 0.824 | S | S | * | * | trans | -81.4 | 143.9 | 173.9 | -79.8 | -90.4 | 0 | 0 | 0 | 112.7 | ||||
| 220 | P | 45.8 | Very low | 34.3 | Very low | 118 Ų | 118 | 138.2 Ų | 138.2 | 77% | 0.766 | 82% | 0.816 | S | S | * | * | trans | -115.3 | 159.4 | 154.4 | 36.5 | -27.4 | 0 | 0 | 0 | 113 | ||||
| 221 | N | 33.8 | Very low | 34.6 | Very low | 168 Ų | 168 | 140.2 Ų | 140.2 | 90% | 0.898 | 81% | 0.813 | S | S | * | * | trans | -81.9 | 142 | -170.6 | -75.8 | -48.1 | 0 | 0 | 0 | 115.8 | ||||
| 222 | G | 32.8 | Very low | 35 | Very low | 74 Ų | 74 | 140.2 Ų | 140.2 | 76% | 0.763 | 81% | 0.81 | S | S | * | * | trans | 30.9 | 127.9 | 135.1 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 223 | K | 31 | Very low | 35.1 | Very low | 215 Ų | 215 | 142.9 Ų | 142.9 | 94% | 0.935 | 82% | 0.817 | S | S | * | * | trans | -143 | 145.8 | 151.3 | -99.7 | 163.5 | -174.1 | 171.3 | 0 | 109.7 | ||||
| 224 | T | 34.7 | Very low | 35.6 | Very low | 140 Ų | 140 | 142.8 Ų | 142.8 | 86% | 0.859 | 82% | 0.82 | S | S | * | * | trans | -92.2 | 143.9 | -179.5 | 42.2 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 225 | C | 26.6 | Very low | 36.4 | Very low | 129 Ų | 129 | 137.1 Ų | 137.1 | 87% | 0.872 | 81% | 0.809 | S | S | * | * | trans | -155.9 | 147.8 | 154.1 | -112.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 226 | S | 32.5 | Very low | 36 | Very low | 126 Ų | 126 | 139.1 Ų | 139.1 | 88% | 0.881 | 81% | 0.813 | S | S | * | * | trans | -86.3 | 139.2 | -174.6 | -50.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 227 | T | 32.3 | Very low | 35.3 | Very low | 132 Ų | 132 | 143.8 Ų | 143.8 | 81% | 0.81 | 82% | 0.818 | S | S | * | * | trans | -123.6 | 110.5 | 173.3 | -28.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 228 | S | 32.6 | Very low | 35.2 | Very low | 112 Ų | 112 | 146.1 Ų | 146.1 | 78% | 0.783 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -84.9 | 123.2 | 175.4 | 53.4 | 0 | 0 | 0 | 0 | 111.1 | ||
| 229 | F | 32 | Very low | 35.2 | Very low | 197 Ų | 197 | 150.8 Ų | 150.8 | 86% | 0.864 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 132.3 | 171.5 | -72.2 | -92.6 | 0 | 0 | 0 | 110.7 | ||
| 230 | P | 39.1 | Very low | 35.4 | Very low | 119 Ų | 119 | 145.3 Ų | 145.3 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 135.7 | 170.4 | 31.2 | -32.7 | 0 | 0 | 0 | 111 | ||
| 231 | V | 34.7 | Very low | 34.8 | Very low | 122 Ų | 122 | 147.3 Ų | 147.3 | 74% | 0.739 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -87.1 | 132.9 | 171.1 | 178.7 | 0 | 0 | 0 | 0 | 108.8 | M233 | V231-M233 PolarHBondContact O-N 2.86Š|
| 232 | P | 38.8 | Very low | 34.8 | Very low | 117 Ų | 117 | 148.6 Ų | 148.6 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 116.5 | 176.9 | 27.1 | -33.6 | 0 | 0 | 0 | 111.1 | ||
| 233 | M | 32.8 | Very low | 34.6 | Very low | 173 Ų | 173 | 153.3 Ų | 153.3 | 85% | 0.852 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 137 | 169.9 | -63.1 | -100 | 80.2 | 0 | 0 | 109.9 | V231 | V231-M233 PolarHBondContact O-N 2.86Š|
| 234 | I | 40 | Very low | 34.6 | Very low | 157 Ų | 157 | 146.4 Ų | 146.4 | 81% | 0.805 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -92.7 | 131.8 | 169 | -59.9 | 175.9 | 0 | 0 | 0 | 107.2 | ||
| 235 | P | 44.3 | Very low | 34.3 | Very low | 94 Ų | 94 | 148.6 Ų | 148.6 | 61% | 0.61 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 137.4 | -170.7 | 27.5 | -35.3 | 0 | 0 | 0 | 113.6 | Y237 | P235-Y237 HydrophobicContact CG-CE2 4.4Å; P235-Y237 PolarHBondContact O-N 2.79Å |
| 236 | D | 34.6 | Very low | 34.6 | Very low | 159 Ų | 159 | 149.8 Ų | 149.8 | 85% | 0.85 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 118.5 | 169.6 | -78.2 | -58 | 0 | 0 | 0 | 111.1 | L238 | D236-L238 PolarHBondContact O-N 3.22Š|
| 237 | Y | 35.5 | Very low | 34.3 | Very low | 214 Ų | 214 | 148.8 Ų | 148.8 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 116.4 | 173.8 | -88.8 | -90.2 | 0 | 0 | 0 | 111.4 | P235 | P235-Y237 HydrophobicContact CG-CE2 4.4Å; P235-Y237 PolarHBondContact O-N 2.79Å |
| 238 | L | 36.3 | Very low | 34.1 | Very low | 167 Ų | 167 | 150.1 Ų | 150.1 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 142.2 | -173.1 | -70.5 | 162.6 | 0 | 0 | 0 | 114.1 | D236 | D236-L238 PolarHBondContact O-N 3.22Š|
| 239 | F | 32.6 | Very low | 34.1 | Very low | 196 Ų | 196 | 151.1 Ų | 151.1 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -78.1 | 137.6 | 162.1 | -76.7 | -99.7 | 0 | 0 | 0 | 110.4 | Q241 | F239-Q241 PolarHBondContact O-N 3.35Š|
| 240 | P | 41 | Very low | 34.4 | Very low | 122 Ų | 122 | 147 Ų | 147 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 118.7 | 167.3 | -15.8 | 30.3 | 0 | 0 | 0 | 110.9 | ||
| 241 | Q | 32.7 | Very low | 34.3 | Very low | 160 Ų | 160 | 147.4 Ų | 147.4 | 75% | 0.748 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 126.3 | 160.9 | -72.2 | -169.7 | -2.3 | 0 | 0 | 109.2 | F239 | F239-Q241 PolarHBondContact O-N 3.35Š|
| 242 | Q | 33.1 | Very low | 34 | Very low | 196 Ų | 196 | 147.9 Ų | 147.9 | 92% | 0.916 | 80% | 0.797 | S | S | * | * | trans | -92.1 | 101.7 | 162 | -74.7 | -171.6 | -38.3 | 0 | 0 | 108.9 | ||||
| 243 | Q | 30 | Very low | 33.7 | Very low | 172 Ų | 172 | 148.8 Ų | 148.8 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | -85.1 | 105.4 | 163.3 | -66.9 | -176.3 | 1.8 | 0 | 0 | 107.8 | ||||
| 244 | G | 29.9 | Very low | 33.6 | Very low | 71 Ų | 71 | 148.9 Ų | 148.9 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | -93.9 | 107 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110 | I246 | G244-I246 PolarHBondContact O-N 3.26Š| ||
| 245 | E | 30.2 | Very low | 33.5 | Very low | 186 Ų | 186 | 146.5 Ų | 146.5 | 87% | 0.869 | 78% | 0.781 | S | S | * | * | trans | -73.8 | 121.4 | 176 | -173.2 | 175.5 | -160.8 | 0 | 0 | 110.3 | ||||
| 246 | I | 31.7 | Very low | 32.5 | Very low | 153 Ų | 153 | 151.7 Ų | 151.7 | 79% | 0.785 | 79% | 0.794 | S | S | * | * | trans | -133.4 | 106.5 | 172.5 | -58.4 | -179.4 | 0 | 0 | 0 | 108.2 | G244 | G244-I246 PolarHBondContact O-N 3.26Š| ||
| 247 | S | 25.3 | Very low | 32.3 | Very low | 106 Ų | 106 | 152.4 Ų | 152.4 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -94.5 | 123.4 | 174.6 | -177.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 248 | L | 29.2 | Very low | 31.8 | Very low | 159 Ų | 159 | 147.6 Ų | 147.6 | 83% | 0.832 | 79% | 0.791 | S | S | * | * | trans | -142.5 | 146.2 | 167 | -79.6 | -179.2 | 0 | 0 | 0 | 111.1 | ||||
| 249 | V | 31.8 | Very low | 31.6 | Very low | 134 Ų | 134 | 148.8 Ų | 148.8 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | trans | -85 | 143 | -170.5 | 177.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 250 | P | 38.9 | Very low | 31.5 | Very low | 111 Ų | 111 | 144.6 Ų | 144.6 | 72% | 0.721 | 79% | 0.787 | S | S | * | * | trans | -87.2 | 158.6 | -178.7 | 35.4 | -37.2 | 0 | 0 | 0 | 114.1 | ||||
| 251 | P | 36.3 | Very low | 30.9 | Very low | 127 Ų | 127 | 146.4 Ų | 146.4 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | trans | -106.1 | 163.7 | 159.6 | 37.1 | -29.7 | 0 | 0 | 0 | 113.4 | ||||
| 252 | D | 29.2 | Very low | 30.9 | Very low | 131 Ų | 131 | 147.1 Ų | 147.1 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | trans | -83.3 | 150.6 | -167.7 | -89 | -75 | 0 | 0 | 0 | 117.4 | ||||
| 253 | Q | 32 | Very low | 30.9 | Very low | 137 Ų | 137 | 143.7 Ų | 143.7 | 64% | 0.64 | 79% | 0.787 | S | S | * | * | trans | 53.4 | 146.9 | 133.2 | -62.4 | 179.4 | 63 | 0 | 0 | 120.7 | ||||
| 254 | K | 31.5 | Very low | 30.8 | Very low | 175 Ų | 175 | 140.3 Ų | 140.3 | 76% | 0.761 | 78% | 0.783 | S | S | * | * | cis | -154.1 | -169.6 | 3.7 | -121.7 | 175.5 | -178.8 | 148.4 | 0 | 110.2 | ||||
| 255 | P | 36.7 | Very low | 31.4 | Very low | 107 Ų | 107 | 145.5 Ų | 145.5 | 70% | 0.695 | 79% | 0.793 | S | S | * | * | trans | -94.9 | 166.7 | -142.2 | 41.4 | -37.9 | 0 | 0 | 0 | 115.3 | ||||
| 256 | F | 24.5 | Very low | 31.8 | Very low | 202 Ų | 202 | 142.5 Ų | 142.5 | 89% | 0.886 | 79% | 0.788 | S | S | * | * | trans | -136.7 | 166.3 | 148 | -123.5 | -90.8 | 0 | 0 | 0 | 111.8 | ||||
| 257 | Q | 29.3 | Very low | 32.1 | Very low | 175 Ų | 175 | 140.3 Ų | 140.3 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -80.7 | 158.1 | -153.4 | -68.3 | -177.8 | -17.2 | 0 | 0 | 116.5 | ||||
| 258 | S | 26.9 | Very low | 32.8 | Very low | 113 Ų | 113 | 143.1 Ų | 143.1 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | -62.8 | 133.7 | 169.7 | 52.2 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 259 | Q | 30.6 | Very low | 33.3 | Very low | 191 Ų | 191 | 140.1 Ų | 140.1 | 89% | 0.893 | 78% | 0.781 | S | S | * | * | trans | -131.1 | 118.4 | 146.4 | -73.2 | -164 | -5.6 | 0 | 0 | 110.2 | ||||
| 260 | S | 30.9 | Very low | 33.9 | Very low | 109 Ų | 109 | 139.7 Ų | 139.7 | 76% | 0.762 | 78% | 0.779 | S | S | * | * | trans | -79.9 | 129 | 170 | 51.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 261 | N | 28.8 | Very low | 34.3 | Very low | 159 Ų | 159 | 141.7 Ų | 141.7 | 85% | 0.85 | 78% | 0.782 | S | S | * | * | trans | -157.6 | 98.6 | 154.6 | -99 | -38 | 0 | 0 | 0 | 111.1 | ||||
| 262 | Q | 32.7 | Very low | 34.5 | Very low | 176 Ų | 176 | 145.1 Ų | 145.1 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | trans | -91.3 | 123.4 | 162.6 | -80.6 | -78.9 | -6.6 | 0 | 0 | 108.1 | S264 | Q262-S264 PolarHBondContact O-N 3.19Å; Q262-S264 VanDerWaalsContact O-N 3.12Å | ||
| 263 | P | 33 | Very low | 35 | Very low | 123 Ų | 123 | 142.7 Ų | 142.7 | 80% | 0.799 | 78% | 0.783 | S | S | * | * | trans | -72.2 | 101.3 | 166.3 | -13.9 | 29.9 | 0 | 0 | 0 | 109.1 | ||||
| 264 | S | 27 | Very low | 35.3 | Very low | 101 Ų | 101 | 146.2 Ų | 146.2 | 71% | 0.706 | 80% | 0.796 | S | S | * | * | trans | -66.8 | 147 | 175.1 | 50.8 | 0 | 0 | 0 | 0 | 111.6 | Q262 T266 | Q262-S264 PolarHBondContact O-N 3.19Å; Q262-S264 VanDerWaalsContact O-N 3.12Å; S264-T266 PolarHBondContact O-N 3.17Å | ||
| 265 | L | 42.8 | Very low | 35.6 | Very low | 181 Ų | 181 | 142.4 Ų | 142.4 | 95% | 0.948 | 80% | 0.797 | S | S | * | * | trans | -59.8 | 126.9 | 175.1 | -67.6 | 165.7 | 0 | 0 | 0 | 110.6 | ||||
| 266 | T | 37.9 | Very low | 36.2 | Very low | 123 Ų | 123 | 143.4 Ų | 143.4 | 76% | 0.755 | 80% | 0.801 | S | S | * | * | trans | -109.2 | 147.6 | 169.7 | 50.9 | 0 | 0 | 0 | 0 | 110.6 | S264 | S264-T266 PolarHBondContact O-N 3.17Š| ||
| 267 | P | 39.7 | Very low | 37.4 | Very low | 107 Ų | 107 | 143.2 Ų | 143.2 | 70% | 0.695 | 80% | 0.803 | S | S | * | * | trans | -77 | 161.1 | -164.6 | 29.7 | -36.2 | 0 | 0 | 0 | 114.7 | S269 | P267-S269 PolarHBondContact O-N 3.31Š| ||
| 268 | L | 39.8 | Very low | 38.2 | Very low | 165 Ų | 165 | 139.6 Ų | 139.6 | 86% | 0.864 | 79% | 0.793 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | 33.7 | -168.8 | -151.5 | 78.6 | 0 | 0 | 0 | 115.1 | ||
| 269 | S | 38.8 | Very low | 39.2 | Very low | 95 Ų | 95 | 138 Ų | 138 | 66% | 0.664 | 80% | 0.795 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.2 | -17.3 | -170.7 | 51.2 | 0 | 0 | 0 | 0 | 115.6 | P267 | P267-S269 PolarHBondContact O-N 3.31Š|
| 270 | T | 45.7 | Very low | 40.1 | Very low | 125 Ų | 125 | 133.7 Ų | 133.7 | 77% | 0.767 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -92.6 | -18.5 | -171.8 | -44.9 | 0 | 0 | 0 | 0 | 114.3 | K272 | T270-K272 VanDerWaalsContact C-N 3.29Å; T270-K272 PolarHBondContact O-N 2.89Å |
| 271 | I | 45.9 | Very low | 40.7 | Very low | 153 Ų | 153 | 135.5 Ų | 135.5 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | trans | -86.5 | 64.1 | -174.9 | -44.4 | -179.8 | 0 | 0 | 0 | 111 | ||||
| 272 | K | 41.4 | Very low | 41.6 | Very low | 199 Ų | 199 | 131 Ų | 131 | 87% | 0.865 | 76% | 0.758 | S | S | * | * | trans | -136 | 27.7 | -179.9 | -141.2 | 172.9 | -173.2 | 176.6 | 0 | 114.9 | T270 | T270-K272 VanDerWaalsContact C-N 3.29Å; T270-K272 PolarHBondContact O-N 2.89Å | ||
| 273 | A | 39.9 | Very low | 42.3 | Very low | 81 Ų | 81 | 128.6 Ų | 128.6 | 67% | 0.669 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -129.4 | -1.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 274 | F | 37.3 | Very low | 42.8 | Very low | 211 Ų | 211 | 130 Ų | 130 | 93% | 0.925 | 74% | 0.744 | S | S | * | * | trans | -136.2 | 59.8 | -177.4 | -80.1 | -78.7 | 0 | 0 | 0 | 112.4 | ||||
| 275 | A | 38.2 | Very low | 43.6 | Very low | 94 Ų | 94 | 129 Ų | 129 | 78% | 0.777 | 73% | 0.73 | S | S | * | * | trans | -125.5 | 28.2 | -173.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 276 | T | 49.8 | Very low | 43.9 | Very low | 129 Ų | 129 | 124.5 Ų | 124.5 | 79% | 0.791 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -142.7 | 68.4 | -177.6 | 54.8 | 0 | 0 | 0 | 0 | 113.3 | ||
| 277 | Q | 49.2 | Very low | 44.1 | Very low | 197 Ų | 197 | 124.1 Ų | 124.1 | 92% | 0.921 | 69% | 0.692 | S | S | * | * | S | Bend | trans | 176.5 | 38.2 | 151.7 | -100.1 | 170.4 | 27.2 | 0 | 0 | 118.6 | ||
| 278 | T | 45.3 | Very low | 44.6 | Very low | 99 Ų | 99 | 125 Ų | 125 | 61% | 0.607 | 69% | 0.687 | S | S | * | * | trans | -137.8 | 9.7 | 168.7 | 57.7 | 0 | 0 | 0 | 0 | 117.2 | S280 Q281 D282 | T278-S280 PolarHBondContact O-N 2.86Å; T278-Q281 PolarHBondContact O-N 3.03Å; T278-D282 WeakPolarHBondContact CB-OD2 3.42Å; T278-D282 PolarHBondContact OG1-OD2 3.49Å | ||
| 279 | G | 47.4 | Very low | 45 | Very low | 81 Ų | 81 | 121.2 Ų | 121.2 | 84% | 0.835 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | 26.7 | -166.2 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||
| 280 | S | 49.6 | Very low | 45.4 | Very low | 100 Ų | 100 | 122.5 Ų | 122.5 | 70% | 0.699 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.1 | -34.4 | 175.1 | -170.5 | 0 | 0 | 0 | 0 | 113.8 | T278 | T278-S280 PolarHBondContact O-N 2.86Š|
| 281 | Q | 44.1 | Very low | 45.4 | Very low | 147 Ų | 147 | 118.7 Ų | 118.7 | 69% | 0.687 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -78.9 | -35.1 | 176 | -65.9 | -168.7 | 3.1 | 0 | 0 | 111.6 | T278 L283 K284 N285 | T278-Q281 PolarHBondContact O-N 3.03Å; Q281-L283 PolarHBondContact O-N 3.19Å; Q281-K284 WeakPolarHBondContact O-CB 3.48Å; Q281-K284 PolarHBondContact O-N 2.92Å; Q281-K284 VanDerWaalsContact O-N 3.08Å; Q281-N285 PolarHBondContact O-N 2.96Å; Q281-N285 PolarHBondContact O-ND2 3.31Å |
| 282 | D | 47.1 | Very low | 45.2 | Very low | 63 Ų | 63 | 116.8 Ų | 116.8 | 34% | 0.337 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -69.6 | -28.6 | -174 | -67.1 | -38.1 | 0 | 0 | 0 | 114.1 | T278 K284 N285 I286 | T278-D282 WeakPolarHBondContact CB-OD2 3.42Å; T278-D282 PolarHBondContact OG1-OD2 3.49Å; D282-K284 VanDerWaalsContact C-N 3.34Å; D282-K284 PolarHBondContact O-N 3.1Å; D282-N285 CarbonylContact O-C 3.54Å; D282-N285 PolarHBondContact O-N 2.69Å; D282-N285 PolarHBondContact OD1-ND2 3.34Å; D282-I286 WeakPolarHBondContact O-CB 3.31Å; D282-I286 WeakPolarHBondContact O-CD1 3.39Å; D282-I286 WeakPolarHBondContact O-CG1 3.48Å; D282-I286 PolarHBondContact O-N 3.26Å |
| 283 | L | 48.4 | Very low | 44.7 | Very low | 126 Ų | 126 | 115.3 Ų | 115.3 | 66% | 0.66 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -66.6 | -34.9 | 171.1 | -71.3 | 175.9 | 0 | 0 | 0 | 112.4 | Q281 Y287 | Q281-L283 PolarHBondContact O-N 3.19Å; L283-Y287 WeakPolarHBondContact O-CB 3.47Å; L283-Y287 PolarHBondContact O-N 3.15Å; L283-Y287 VanDerWaalsContact O-N 3.07Å |
| 284 | K | 43.5 | Very low | 44.5 | Very low | 154 Ų | 154 | 116.4 Ų | 116.4 | 67% | 0.67 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -67.7 | -43.1 | 169.3 | -80.9 | -178.9 | 176.7 | 173.8 | 0 | 111 | Q281 D282 I286 Y287 Q288 | Q281-K284 WeakPolarHBondContact O-CB 3.48Å; Q281-K284 PolarHBondContact O-N 2.92Å; Q281-K284 VanDerWaalsContact O-N 3.08Å; D282-K284 VanDerWaalsContact C-N 3.34Å; D282-K284 PolarHBondContact O-N 3.1Å; K284-I286 PolarHBondContact O-N 3.4Å; K284-Y287 PolarHBondContact O-N 3.21Å; K284-Q288 WeakPolarHBondContact O-CB 3.49Å; K284-Q288 PolarHBondContact O-N 3.39Å |
| 285 | N | 44.1 | Very low | 44.5 | Very low | 78 Ų | 78 | 110.4 Ų | 110.4 | 42% | 0.417 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -65.8 | -35.9 | 178.9 | -64.3 | -29.3 | 0 | 0 | 0 | 112.8 | Q281 D282 Q288 S289 | Q281-N285 PolarHBondContact O-N 2.96Å; Q281-N285 PolarHBondContact O-ND2 3.31Å; D282-N285 CarbonylContact O-C 3.54Å; D282-N285 PolarHBondContact O-N 2.69Å; D282-N285 PolarHBondContact OD1-ND2 3.34Å; N285-Q288 PolarHBondContact O-N 2.99Å; N285-S289 WeakPolarHBondContact O-CB 3.16Å; N285-S289 PolarHBondContact O-N 2.83Å; N285-S289 PolarHBondContact O-OG 3Å |
| 286 | I | 49.1 | Very low | 44.8 | Very low | 87 Ų | 87 | 117.6 Ų | 117.6 | 45% | 0.446 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -67.9 | -47.5 | 174.5 | -70.5 | 163 | 0 | 0 | 0 | 109.9 | D282 K284 Q288 S289 Q290 | D282-I286 WeakPolarHBondContact O-CB 3.31Å; D282-I286 WeakPolarHBondContact O-CD1 3.39Å; D282-I286 WeakPolarHBondContact O-CG1 3.48Å; D282-I286 PolarHBondContact O-N 3.26Å; K284-I286 PolarHBondContact O-N 3.4Å; I286-Q288 VanDerWaalsContact C-N 3.33Å; I286-Q288 PolarHBondContact O-N 2.78Å; I286-S289 WeakPolarHBondContact CA-OG 3.38Å; I286-S289 PolarHBondContact O-N 2.83Å; I286-S289 PolarHBondContact O-OG 3.36Å; I286-Q290 WeakPolarHBondContact O-CB 3.35Å; I286-Q290 WeakPolarHBondContact O-CG 3.31Å; I286-Q290 PolarHBondContact O-N 3.5Å |
| 287 | Y | 42.5 | Very low | 44.5 | Very low | 116 Ų | 116 | 118.3 Ų | 118.3 | 46% | 0.455 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -58.9 | -46 | 173.7 | -166.4 | -96.8 | 0 | 0 | 0 | 111.2 | L283 K284 S289 Q290 L291 | L283-Y287 WeakPolarHBondContact O-CB 3.47Å; L283-Y287 PolarHBondContact O-N 3.15Å; L283-Y287 VanDerWaalsContact O-N 3.07Å; K284-Y287 PolarHBondContact O-N 3.21Å; Y287-S289 PolarHBondContact O-N 3.11Å; Y287-Q290 CarbonylContact O-C 3.59Å; Y287-Q290 PolarHBondContact O-N 3.17Å; Y287-L291 HydrophobicContact CD1-CG 4.36Å; Y287-L291 HydrophobicContact CE1-CD2 4.19Å; Y287-L291 HydrophobicContact CE1-CG 4.41Å; Y287-L291 WeakPolarHBondContact O-CG 3.32Å; Y287-L291 PolarHBondContact O-N 2.71Å |
| 288 | Q | 48.5 | Very low | 44 | Very low | 124 Ų | 124 | 120 Ų | 120 | 58% | 0.579 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -78.8 | -13.2 | -174.9 | -167.8 | 166.5 | -6.6 | 0 | 0 | 114.6 | K284 N285 I286 | K284-Q288 WeakPolarHBondContact O-CB 3.49Å; K284-Q288 PolarHBondContact O-N 3.39Å; N285-Q288 PolarHBondContact O-N 2.99Å; I286-Q288 VanDerWaalsContact C-N 3.33Å; I286-Q288 PolarHBondContact O-N 2.78Å |
| 289 | S | 48.4 | Very low | 43.5 | Very low | 86 Ų | 86 | 124 Ų | 124 | 60% | 0.601 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -94.3 | -27.2 | 168.5 | 57 | 0 | 0 | 0 | 0 | 112.9 | N285 I286 Y287 | N285-S289 WeakPolarHBondContact O-CB 3.16Å; N285-S289 PolarHBondContact O-N 2.83Å; N285-S289 PolarHBondContact O-OG 3Å; I286-S289 WeakPolarHBondContact CA-OG 3.38Å; I286-S289 PolarHBondContact O-N 2.83Å; I286-S289 PolarHBondContact O-OG 3.36Å; Y287-S289 PolarHBondContact O-N 3.11Å |
| 290 | Q | 47 | Very low | 43.1 | Very low | 122 Ų | 122 | 129.3 Ų | 129.3 | 57% | 0.57 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -81 | -18.6 | 168 | -67.9 | -160.6 | 42.9 | 0 | 0 | 113.4 | I286 Y287 I292 | I286-Q290 WeakPolarHBondContact O-CB 3.35Å; I286-Q290 WeakPolarHBondContact O-CG 3.31Å; I286-Q290 PolarHBondContact O-N 3.5Å; Y287-Q290 CarbonylContact O-C 3.59Å; Y287-Q290 PolarHBondContact O-N 3.17Å; Q290-I292 PolarHBondContact O-N 2.99Å; Q290-I292 VanDerWaalsContact O-N 3.1Å |
| 291 | L | 46.3 | Very low | 42.6 | Very low | 46 Ų | 46 | 130.1 Ų | 130.1 | 24% | 0.241 | 62% | 0.622 | C | S | . | * | S | Bend | trans | -55.4 | 116.4 | 158.1 | -74.7 | -174.2 | 0 | 0 | 0 | 108.3 | Y287 K293 T367 | Y287-L291 HydrophobicContact CD1-CG 4.36Å; Y287-L291 HydrophobicContact CE1-CD2 4.19Å; Y287-L291 HydrophobicContact CE1-CG 4.41Å; Y287-L291 WeakPolarHBondContact O-CG 3.32Å; Y287-L291 PolarHBondContact O-N 2.71Å; L291-K293 VanDerWaalsContact C-N 3.25Å; L291-K293 PolarHBondContact O-N 2.76Å; L291-T367 HydrophobicContact CD2-CG2 3.52Å |
| 292 | I | 41.4 | Very low | 43 | Very low | 113 Ų | 113 | 129.5 Ų | 129.5 | 58% | 0.579 | 63% | 0.628 | S | S | * | * | trans | -61 | 94.9 | 165.7 | -60.1 | 170.6 | 0 | 0 | 0 | 106.3 | Q290 I363 | Q290-I292 PolarHBondContact O-N 2.99Å; Q290-I292 VanDerWaalsContact O-N 3.1Å; I292-I363 HydrophobicContact CD1-CD1 4.33Å | ||
| 293 | K | 30.7 | Very low | 43.1 | Very low | 168 Ų | 168 | 137.2 Ų | 137.2 | 73% | 0.73 | 65% | 0.653 | S | S | * | * | trans | -41.4 | 120 | 172.6 | -69.6 | 178.8 | -180 | 175.5 | 0 | 106.6 | L291 S295 | L291-K293 VanDerWaalsContact C-N 3.25Å; L291-K293 PolarHBondContact O-N 2.76Å; K293-S295 VanDerWaalsContact C-N 3.34Å; K293-S295 VanDerWaalsContact O-CA 3.25Å; K293-S295 WeakPolarHBondContact O-CA 3.37Å; K293-S295 PolarHBondContact O-N 3.5Å; K293-S295 PolarHBondContact O-OG 2.85Å; K293-S295 VanDerWaalsContact O-OG 3.06Å | ||
| 294 | P | 37 | Very low | 43 | Very low | 104 Ų | 104 | 136 Ų | 136 | 68% | 0.675 | 65% | 0.653 | S | S | * | * | trans | -57 | 99.8 | -160.4 | 19.6 | -33 | 0 | 0 | 0 | 108.7 | R296 | P294-R296 PolarHBondContact O-N 3.14Š| ||
| 295 | S | 36.8 | Very low | 43.5 | Very low | 85 Ų | 85 | 134.3 Ų | 134.3 | 59% | 0.594 | 66% | 0.66 | S | S | * | * | trans | -69.3 | 106.2 | -157.3 | -68.7 | 0 | 0 | 0 | 0 | 106.9 | K293 M297 | K293-S295 VanDerWaalsContact C-N 3.34Å; K293-S295 VanDerWaalsContact O-CA 3.25Å; K293-S295 WeakPolarHBondContact O-CA 3.37Å; K293-S295 PolarHBondContact O-N 3.5Å; K293-S295 PolarHBondContact O-OG 2.85Å; K293-S295 VanDerWaalsContact O-OG 3.06Å; S295-M297 VanDerWaalsContact C-N 3.34Å; S295-M297 WeakPolarHBondContact O-CA 3.4Å; S295-M297 PolarHBondContact O-N 3.35Å | ||
| 296 | R | 44.3 | Very low | 44 | Very low | 244 Ų | 244 | 139.8 Ų | 139.8 | 92% | 0.921 | 68% | 0.68 | S | S | * | * | trans | -47.2 | 99.5 | -172.2 | -178.9 | -172 | -166.7 | -173.9 | 6.2 | 107.4 | P294 R298 | P294-R296 PolarHBondContact O-N 3.14Å; R296-R298 PolarHBondContact O-N 3.3Å | ||
| 297 | M | 44 | Very low | 44.3 | Very low | 145 Ų | 145 | 139.8 Ų | 139.8 | 71% | 0.714 | 69% | 0.685 | S | S | * | * | trans | -49.9 | 117.4 | -146.8 | -67.5 | -146.5 | 78.8 | 0 | 0 | 109.4 | S295 K299 | S295-M297 VanDerWaalsContact C-N 3.34Å; S295-M297 WeakPolarHBondContact O-CA 3.4Å; S295-M297 PolarHBondContact O-N 3.35Å; M297-K299 PolarHBondContact O-N 2.86Å | ||
| 298 | R | 39.2 | Very low | 45 | Very low | 232 Ų | 232 | 137.4 Ų | 137.4 | 88% | 0.875 | 68% | 0.683 | S | S | * | * | trans | -55.5 | 101 | 174.8 | 176.9 | -175.5 | -84.1 | -165.3 | -3.6 | 104 | R296 Y300 | R296-R298 PolarHBondContact O-N 3.3Å; R298-Y300 PolarHBondContact O-N 2.9Å | ||
| 299 | K | 34.9 | Very low | 45.6 | Very low | 183 Ų | 183 | 138.5 Ų | 138.5 | 80% | 0.796 | 70% | 0.701 | S | S | * | * | trans | -60.2 | 107 | -175.8 | -72.8 | -176.3 | 178.1 | -177.9 | 0 | 104.2 | M297 P301 | M297-K299 PolarHBondContact O-N 2.86Å; K299-P301 WeakPolarHBondContact O-CD 3.3Å; K299-P301 VanDerWaalsContact O-N 3.07Å | ||
| 300 | Y | 38 | Very low | 46.4 | Very low | 192 Ų | 192 | 142.6 Ų | 142.6 | 75% | 0.753 | 71% | 0.71 | S | S | * | * | trans | -48.1 | 121.6 | 160.4 | -68.5 | -79.1 | 0 | 0 | 0 | 104.7 | R298 T302 | R298-Y300 PolarHBondContact O-N 2.9Å; Y300-T302 PolarHBondContact O-N 2.85Å | ||
| 301 | P | 39.6 | Very low | 47.8 | Very low | 117 Ų | 117 | 142 Ų | 142 | 76% | 0.76 | 71% | 0.708 | S | S | * | * | trans | -49.4 | 121.7 | -175.4 | -29.8 | 35.6 | 0 | 0 | 0 | 107.9 | K299 R303 | K299-P301 WeakPolarHBondContact O-CD 3.3Å; K299-P301 VanDerWaalsContact O-N 3.07Å; P301-R303 PolarHBondContact O-N 2.7Å | ||
| 302 | T | 51.3 | Low | 49.7 | Very low | 134 Ų | 134 | 146.2 Ų | 146.2 | 82% | 0.822 | 72% | 0.721 | S | S | * | * | trans | -70.5 | 78.6 | 179.4 | 42.1 | 0 | 0 | 0 | 0 | 106.9 | Y300 | Y300-T302 PolarHBondContact O-N 2.85Š| ||
| 303 | R | 50.7 | Low | 51.8 | Low | 225 Ų | 225 | 144.6 Ų | 144.6 | 85% | 0.849 | 72% | 0.717 | S | S | * | * | trans | -55.9 | 132.7 | -174.8 | -159.1 | 175.1 | -156.8 | -103.6 | 2.9 | 106.8 | P301 S305 | P301-R303 PolarHBondContact O-N 2.7Å; R303-S305 PolarHBondContact O-N 3.41Å | ||
| 304 | P | 45.9 | Very low | 54.7 | Low | 101 Ų | 101 | 141.2 Ų | 141.2 | 66% | 0.656 | 70% | 0.701 | S | S | * | * | trans | -54 | 129.9 | -175.9 | 19.9 | -32.6 | 0 | 0 | 0 | 110 | K306 | P304-K306 PolarHBondContact O-N 3.39Š| ||
| 305 | S | 54.3 | Low | 57.3 | Low | 119 Ų | 119 | 138.6 Ų | 138.6 | 83% | 0.832 | 69% | 0.688 | S | S | * | * | trans | -71.4 | 73.1 | 177.6 | -175.7 | 0 | 0 | 0 | 0 | 109.9 | R303 | R303-S305 PolarHBondContact O-N 3.41Š| ||
| 306 | K | 53.7 | Low | 60 | Low | 192 Ų | 192 | 135.3 Ų | 135.3 | 84% | 0.835 | 67% | 0.665 | S | S | * | * | trans | -124 | 54.5 | 176.6 | -71.7 | -166.1 | 172.7 | -169.9 | 0 | 110.6 | P304 | P304-K306 PolarHBondContact O-N 3.39Š| ||
| 307 | T | 55.9 | Low | 62.2 | Low | 88 Ų | 88 | 128.2 Ų | 128.2 | 54% | 0.54 | 65% | 0.65 | S | S | . | * | S | Bend | trans | -107.6 | 142.4 | 153.3 | 47.5 | 0 | 0 | 0 | 0 | 107.2 | ||
| 308 | P | 57.1 | Low | 64.4 | Low | 66 Ų | 66 | 123.5 Ų | 123.5 | 43% | 0.429 | 63% | 0.629 | S | S | . | * | trans | -56.5 | 149.1 | 175.2 | -27.2 | 37.6 | 0 | 0 | 0 | 112 | H310 E311 | P308-H310 PolarHBondContact O-N 3.32Å; P308-E311 HydrophobicContact CB-CG 4.37Å; P308-E311 WeakPolarHBondContact CG-OE1 3.42Å; P308-E311 PolarHBondContact O-N 2.93Å | ||
| 309 | P | 61 | Low | 66.6 | Low | 147 Ų | 147 | 121.1 Ų | 121.1 | 96% | 0.955 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -12.4 | -167.2 | -25.8 | 35.6 | 0 | 0 | 0 | 116.6 | ||
| 310 | H | 64.4 | Low | 69.3 | Low | 171 Ų | 171 | 118.5 Ų | 118.5 | 79% | 0.792 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.1 | -3 | -172.8 | -156.4 | -105.6 | 0 | 0 | 0 | 114.3 | P308 R312 | P308-H310 PolarHBondContact O-N 3.32Å; H310-R312 PolarHBondContact O-N 2.9Å |
| 311 | E | 77 | Confident | 71.9 | Confident | 111 Ų | 111 | 110.3 Ų | 110.3 | 52% | 0.519 | 60% | 0.599 | S | S | . | * | trans | -76.9 | 112.2 | 178.5 | -77.5 | 176.9 | -158.6 | 0 | 0 | 110.9 | P308 | P308-E311 HydrophobicContact CB-CG 4.37Å; P308-E311 WeakPolarHBondContact CG-OE1 3.42Å; P308-E311 PolarHBondContact O-N 2.93Å | ||
| 312 | R | 85.4 | Confident | 74.3 | Confident | 134 Ų | 134 | 112.1 Ų | 112.1 | 51% | 0.506 | 60% | 0.602 | S | S | . | * | trans | -121 | 74.8 | 171.7 | -62.6 | 171.8 | 76.7 | 146.8 | 0.5 | 108.7 | H310 Y314 R324 F325 | H310-R312 PolarHBondContact O-N 2.9Å; R312-Y314 VanDerWaalsContact C-N 3.29Å; R312-Y314 PolarHBondContact O-N 2.8Å; R312-R324 HydrophobicContact CB-CB 3.86Å; R312-R324 VanDerWaalsContact CZ-O 3.26Å; R312-R324 PolarHBondContact NE-O 2.93Å; R312-R324 PolarHBondContact NH2-O 2.91Å; R312-R324 PolarHBondContact O-NE 2.85Å; R312-R324 PolarHBondContact O-NH2 3.17Å; R312-F325 CarbonylContact C-O 3.26Å; R312-F325 VanDerWaalsContact C-O 3.26Å; R312-F325 VanDerWaalsContact CA-O 3.23Å; R312-F325 WeakPolarHBondContact CA-O 3.49Å | ||
| 313 | P | 86.9 | Confident | 76.2 | Confident | 79 Ų | 79 | 111.5 Ų | 111.5 | 51% | 0.513 | 58% | 0.584 | S | S | . | * | trans | -69.9 | -28.3 | -170.1 | -18 | 33 | 0 | 0 | 0 | 112.7 | A315 | P313-A315 PolarHBondContact O-N 3.43Š| ||
| 314 | Y | 90.6 | Very high | 78.2 | Confident | 96 Ų | 96 | 107.2 Ų | 107.2 | 38% | 0.376 | 57% | 0.568 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88.6 | 87.1 | -170.7 | -57 | -77.2 | 0 | 0 | 0 | 110.8 | R312 R324 F325 S326 | R312-Y314 VanDerWaalsContact C-N 3.29Å; R312-Y314 PolarHBondContact O-N 2.8Å; Y314-R324 CarbonylContact O-C 3.58Å; Y314-R324 WeakPolarHBondContact O-CA 3.5Å; Y314-F325 PolarHBondContact N-O 3.5Å; Y314-F325 WeakPolarHBondContact O-CD2 3.48Å; Y314-F325 PolarHBondContact O-N 3.28Å; Y314-S326 WeakPolarHBondContact CE2-O 3.25Å |
| 315 | A | 91.3 | Very high | 80.4 | Confident | 50 Ų | 50 | 104 Ų | 104 | 41% | 0.413 | 54% | 0.544 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.2 | 156.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | P313 R324 L331 | P313-A315 PolarHBondContact O-N 3.43Å; A315-R324 HydrophobicContact CB-CG 4.12Å; A315-L331 WeakPolarHBondContact O-CD1 3.45Å; A315-L331 VanDerWaalsContact O-CD2 3.25Å; A315-L331 WeakPolarHBondContact O-CD2 3.5Å |
| 316 | C | 94.4 | Very high | 82.2 | Confident | 15 Ų | 15 | 100.4 Ų | 100.4 | 10% | 0.101 | 52% | 0.519 | C | S | . | . | trans | -76 | 129.3 | 170.3 | -167.4 | 0 | 0 | 0 | 0 | 110.5 | V318 C321 R323 L331 H334 H338 | C316-V318 PolarHBondContact O-N 2.97Å; C316-C321 HydrophobicContact CB-CB 4.48Å; C316-C321 WeakPolarHBondContact CB-O 3.23Å; C316-R323 PolarHBondContact N-O 3.37Å; C316-L331 HydrophobicContact CB-CD1 4.37Å; C316-H334 PolarHBondContact SG-NE2 3.21Å; C316-H334 VanDerWaalsContact SG-NE2 3.41Å; C316-H338 VanDerWaalsContact SG-CD2 3.56Å; C316-H338 PolarHBondContact SG-NE2 3.18Å | ||
| 317 | P | 90 | Very high | 84 | Confident | 95 Ų | 95 | 97.3 Ų | 97.3 | 62% | 0.617 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -74.7 | 31.4 | 174.7 | -17.2 | 32.5 | 0 | 0 | 0 | 114.5 | ||
| 318 | V | 91.7 | Very high | 85.7 | Confident | 46 Ų | 46 | 96 Ų | 96 | 28% | 0.279 | 50% | 0.496 | S | S | . | . | trans | -127.2 | 110.7 | -177.2 | 176.9 | 0 | 0 | 0 | 0 | 107.2 | C316 T320 C321 H338 | C316-V318 PolarHBondContact O-N 2.97Å; V318-T320 WeakPolarHBondContact CG1-OG1 3.05Å; V318-T320 PolarHBondContact O-N 2.88Å; V318-C321 HydrophobicContact CB-CB 4.35Å; V318-C321 HydrophobicContact CG1-CB 4.42Å; V318-C321 PolarHBondContact O-N 3.21Å; V318-H338 HydrophobicContact CG2-CB 4.36Å | ||
| 319 | E | 85.2 | Confident | 87.3 | Confident | 182 Ų | 182 | 95.7 Ų | 95.7 | 85% | 0.85 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.4 | -21.9 | -172.7 | -52.9 | -50.6 | 122.4 | 0 | 0 | 114.3 | C321 | E319-C321 VanDerWaalsContact C-N 3.29Å; E319-C321 PolarHBondContact O-N 3.49Å |
| 320 | T | 91.6 | Very high | 88.8 | Confident | 128 Ų | 128 | 90.9 Ų | 90.9 | 79% | 0.785 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.8 | 16.6 | 174.4 | 57.2 | 0 | 0 | 0 | 0 | 113.6 | V318 | V318-T320 WeakPolarHBondContact CG1-OG1 3.05Å; V318-T320 PolarHBondContact O-N 2.88Å |
| 321 | C | 91.5 | Very high | 90.2 | Very high | 21 Ų | 21 | 83.8 Ų | 83.8 | 14% | 0.142 | 42% | 0.423 | C | S | . | . | trans | -150.2 | 93 | -174.2 | -156.4 | 0 | 0 | 0 | 0 | 114.9 | C316 V318 E319 R323 | C316-C321 HydrophobicContact CB-CB 4.48Å; C316-C321 WeakPolarHBondContact CB-O 3.23Å; V318-C321 HydrophobicContact CB-CB 4.35Å; V318-C321 HydrophobicContact CG1-CB 4.42Å; V318-C321 PolarHBondContact O-N 3.21Å; E319-C321 VanDerWaalsContact C-N 3.29Å; E319-C321 PolarHBondContact O-N 3.49Å; C321-R323 PolarHBondContact O-N 2.88Å | ||
| 322 | D | 90.6 | Very high | 90.9 | Very high | 154 Ų | 154 | 82.2 Ų | 82.2 | 82% | 0.824 | 42% | 0.422 | S | S | * | . | trans | -67.4 | 15.3 | -179.7 | -44.7 | -83.4 | 0 | 0 | 0 | 115.5 | R324 | D322-R324 PolarHBondContact O-N 3.38Š| ||
| 323 | R | 90.7 | Very high | 91.2 | Very high | 122 Ų | 122 | 80 Ų | 80 | 46% | 0.46 | 41% | 0.413 | S | S | . | . | trans | -75.8 | 111.6 | -172.4 | -73.8 | -173.5 | 169.9 | -153.9 | -2.8 | 111.5 | C316 C321 F325 | C316-R323 PolarHBondContact N-O 3.37Å; C321-R323 PolarHBondContact O-N 2.88Å; R323-F325 HydrophobicContact CB-CE2 3.78Å; R323-F325 HydrophobicContact CB-CZ 3.81Å; R323-F325 WeakPolarHBondContact O-CE2 3.33Å | ||
| 324 | R | 93.8 | Very high | 91.5 | Very high | 135 Ų | 135 | 76.8 Ų | 76.8 | 51% | 0.509 | 39% | 0.391 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 145 | 173.7 | -58.6 | 179.5 | 62.6 | 160.4 | 2.9 | 112.1 | R312 Y314 A315 D322 | R312-R324 HydrophobicContact CB-CB 3.86Å; R312-R324 VanDerWaalsContact CZ-O 3.26Å; R312-R324 PolarHBondContact NE-O 2.93Å; R312-R324 PolarHBondContact NH2-O 2.91Å; R312-R324 PolarHBondContact O-NE 2.85Å; R312-R324 PolarHBondContact O-NH2 3.17Å; Y314-R324 CarbonylContact O-C 3.58Å; Y314-R324 WeakPolarHBondContact O-CA 3.5Å; A315-R324 HydrophobicContact CB-CG 4.12Å; D322-R324 PolarHBondContact O-N 3.38Å |
| 325 | F | 92.1 | Very high | 91.6 | Very high | 32 Ų | 32 | 74.8 Ų | 74.8 | 14% | 0.14 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.3 | 153.5 | -174.5 | -60.5 | -85 | 0 | 0 | 0 | 112.7 | R312 Y314 R323 R327 E330 L331 H334 | R312-F325 CarbonylContact C-O 3.26Å; R312-F325 VanDerWaalsContact C-O 3.26Å; R312-F325 VanDerWaalsContact CA-O 3.23Å; R312-F325 WeakPolarHBondContact CA-O 3.49Å; Y314-F325 PolarHBondContact N-O 3.5Å; Y314-F325 WeakPolarHBondContact O-CD2 3.48Å; Y314-F325 PolarHBondContact O-N 3.28Å; R323-F325 HydrophobicContact CB-CE2 3.78Å; R323-F325 HydrophobicContact CB-CZ 3.81Å; R323-F325 WeakPolarHBondContact O-CE2 3.33Å; F325-R327 VanDerWaalsContact C-N 3.33Å; F325-E330 HydrophobicContact CB-CB 3.94Å; F325-E330 HydrophobicContact CD1-CB 3.71Å; F325-E330 HydrophobicContact CG-CB 4.05Å; F325-L331 HydrophobicContact CB-CB 4.39Å; F325-L331 HydrophobicContact CD2-CB 3.97Å; F325-L331 HydrophobicContact CD2-CD1 3.99Å; F325-L331 HydrophobicContact CE2-CD1 4.2Å; F325-L331 HydrophobicContact CG-CB 4.35Å; F325-H334 HydrophobicContact CE1-CB 4.09Å; F325-H334 HydrophobicContact CE2-CB 3.8Å; F325-H334 AromaticContact CE2-CD2 3.25Å; F325-H334 WeakPolarHBondContact CE2-CD2 3.5Å; F325-H334 AromaticContact CE2-CG 3.66Å; F325-H334 HydrophobicContact CZ-CB 3.44Å; F325-H334 VanDerWaalsContact CZ-CB 3.44Å; F325-H334 AromaticContact CZ-CD2 3.43Å; F325-H334 VanDerWaalsContact CZ-CD2 3.43Å; F325-H334 WeakPolarHBondContact CZ-CD2 3.37Å; F325-H334 AromaticContact CZ-CG 3.37Å |
| 326 | S | 92.4 | Very high | 91.7 | Very high | 44 Ų | 44 | 75.5 Ų | 75.5 | 31% | 0.308 | 38% | 0.379 | S | S | . | . | S | Bend | trans | -74.5 | -27.6 | 176.4 | 74.4 | 0 | 0 | 0 | 0 | 112 | Y314 E330 | Y314-S326 WeakPolarHBondContact CE2-O 3.25Å; S326-E330 PolarHBondContact N-OE2 3.06Å; S326-E330 PolarHBondContact OG-OE2 3.45Å |
| 327 | R | 91.3 | Very high | 91.5 | Very high | 128 Ų | 128 | 79.6 Ų | 79.6 | 48% | 0.483 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -136 | 147.6 | -172.1 | -67.7 | 155.7 | 53.5 | 175.8 | -2.2 | 112.5 | F325 D329 E330 L331 | F325-R327 VanDerWaalsContact C-N 3.33Å; R327-D329 VanDerWaalsContact C-N 3.32Å; R327-D329 WeakPolarHBondContact CB-OD1 3.43Å; R327-D329 IonicContact CZ-OD1 3.22Å; R327-D329 VanDerWaalsContact CZ-OD1 3.22Å; R327-D329 IonicContact CZ-OD2 3.69Å; R327-D329 IonicContact NE-OD1 3.9Å; R327-D329 PolarHBondContact NE-OD1 3.25Å; R327-D329 IonicContact NE-OD2 3.95Å; R327-D329 IonicContact NH2-OD1 2.8Å; R327-D329 PolarHBondContact NH2-OD1 3.48Å; R327-D329 IonicContact NH2-OD2 2.9Å; R327-D329 PolarHBondContact NH2-OD2 2.82Å; R327-D329 PolarHBondContact O-N 2.77Å; R327-E330 HydrophobicContact CB-CG 4.01Å; R327-E330 PolarHBondContact N-OE2 3.29Å; R327-E330 IonicContact NE-OE1 3.21Å; R327-E330 WeakPolarHBondContact O-CB 3.48Å; R327-E330 PolarHBondContact O-N 3.1Å; R327-E330 VanDerWaalsContact O-N 3.15Å; R327-L331 PolarHBondContact O-N 3.44Å |
| 328 | S | 91.8 | Very high | 91.6 | Very high | 60 Ų | 60 | 78.7 Ų | 78.7 | 42% | 0.42 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -58.1 | -40.7 | 174.6 | 52.6 | 0 | 0 | 0 | 0 | 112.8 | E330 L331 T332 | S328-E330 PolarHBondContact O-N 2.97Å; S328-L331 PolarHBondContact O-N 3.16Å; S328-L331 VanDerWaalsContact O-N 3.15Å; S328-T332 PolarHBondContact O-N 2.69Å; S328-T332 PolarHBondContact O-OG1 3.43Å |
| 329 | D | 89.9 | Confident | 91.5 | Very high | 60 Ų | 60 | 80 Ų | 80 | 32% | 0.321 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -69.3 | -17.5 | -180 | 74.7 | -88.3 | 0 | 0 | 0 | 114.1 | R327 R333 | R327-D329 VanDerWaalsContact C-N 3.32Å; R327-D329 WeakPolarHBondContact CB-OD1 3.43Å; R327-D329 IonicContact CZ-OD1 3.22Å; R327-D329 VanDerWaalsContact CZ-OD1 3.22Å; R327-D329 IonicContact CZ-OD2 3.69Å; R327-D329 IonicContact NE-OD1 3.9Å; R327-D329 PolarHBondContact NE-OD1 3.25Å; R327-D329 IonicContact NE-OD2 3.95Å; R327-D329 IonicContact NH2-OD1 2.8Å; R327-D329 PolarHBondContact NH2-OD1 3.48Å; R327-D329 IonicContact NH2-OD2 2.9Å; R327-D329 PolarHBondContact NH2-OD2 2.82Å; R327-D329 PolarHBondContact O-N 2.77Å; D329-R333 VanDerWaalsContact O-CB 3.3Å; D329-R333 WeakPolarHBondContact O-CB 3.42Å; D329-R333 PolarHBondContact O-N 2.84Å; D329-R333 PolarHBondContact O-NH2 2.79Å; D329-R333 IonicContact OD2-CZ 2.82Å; D329-R333 IonicContact OD2-NH2 3.9Å; D329-R333 PolarHBondContact OD2-NH2 3.37Å |
| 330 | E | 91.8 | Very high | 91.8 | Very high | 45 Ų | 45 | 73.2 Ų | 73.2 | 21% | 0.21 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -79.5 | -45 | 170.7 | -62.7 | 170.5 | 165.2 | 0 | 0 | 110.2 | F325 S326 R327 S328 R333 H334 | F325-E330 HydrophobicContact CB-CB 3.94Å; F325-E330 HydrophobicContact CD1-CB 3.71Å; F325-E330 HydrophobicContact CG-CB 4.05Å; S326-E330 PolarHBondContact N-OE2 3.06Å; S326-E330 PolarHBondContact OG-OE2 3.45Å; R327-E330 HydrophobicContact CB-CG 4.01Å; R327-E330 PolarHBondContact N-OE2 3.29Å; R327-E330 IonicContact NE-OE1 3.21Å; R327-E330 WeakPolarHBondContact O-CB 3.48Å; R327-E330 PolarHBondContact O-N 3.1Å; R327-E330 VanDerWaalsContact O-N 3.15Å; S328-E330 PolarHBondContact O-N 2.97Å; E330-R333 WeakPolarHBondContact O-CB 3.27Å; E330-R333 PolarHBondContact O-N 3.43Å; E330-H334 WeakPolarHBondContact O-CB 3.37Å; E330-H334 PolarHBondContact O-N 3.35Å |
| 331 | L | 94 | Very high | 91.8 | Very high | 22 Ų | 22 | 72.5 Ų | 72.5 | 12% | 0.115 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -60.4 | -50.4 | 173.2 | 173.4 | 60.5 | 0 | 0 | 0 | 111.9 | A315 C316 F325 R327 S328 R333 H334 I335 | A315-L331 WeakPolarHBondContact O-CD1 3.45Å; A315-L331 VanDerWaalsContact O-CD2 3.25Å; A315-L331 WeakPolarHBondContact O-CD2 3.5Å; C316-L331 HydrophobicContact CB-CD1 4.37Å; F325-L331 HydrophobicContact CB-CB 4.39Å; F325-L331 HydrophobicContact CD2-CB 3.97Å; F325-L331 HydrophobicContact CD2-CD1 3.99Å; F325-L331 HydrophobicContact CE2-CD1 4.2Å; F325-L331 HydrophobicContact CG-CB 4.35Å; R327-L331 PolarHBondContact O-N 3.44Å; S328-L331 PolarHBondContact O-N 3.16Å; S328-L331 VanDerWaalsContact O-N 3.15Å; L331-R333 PolarHBondContact O-N 3.49Å; L331-R333 VanDerWaalsContact O-N 3.16Å; L331-H334 WeakPolarHBondContact O-CA 3.38Å; L331-H334 WeakPolarHBondContact O-CB 3.48Å; L331-H334 PolarHBondContact O-N 3.07Å; L331-I335 HydrophobicContact CD1-CD1 3.82Å; L331-I335 HydrophobicContact CD1-CG1 3.92Å; L331-I335 HydrophobicContact CD2-CD1 4.47Å; L331-I335 HydrophobicContact CG-CD1 3.82Å; L331-I335 HydrophobicContact CG-CG1 4.37Å; L331-I335 WeakPolarHBondContact O-CG1 3.38Å; L331-I335 PolarHBondContact O-N 3.48Å |
| 332 | T | 92.1 | Very high | 91.8 | Very high | 78 Ų | 78 | 77.1 Ų | 77.1 | 48% | 0.479 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -58.8 | -30.7 | 177.6 | -50.9 | 0 | 0 | 0 | 0 | 112.2 | S328 | S328-T332 PolarHBondContact O-N 2.69Å; S328-T332 PolarHBondContact O-OG1 3.43Å |
| 333 | R | 92.1 | Very high | 91.8 | Very high | 89 Ų | 89 | 73.4 Ų | 73.4 | 34% | 0.336 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -76.8 | -34 | 174.9 | -173 | -166.8 | -48.7 | 123.5 | 14.8 | 112.2 | D329 E330 L331 R355 | D329-R333 VanDerWaalsContact O-CB 3.3Å; D329-R333 WeakPolarHBondContact O-CB 3.42Å; D329-R333 PolarHBondContact O-N 2.84Å; D329-R333 PolarHBondContact O-NH2 2.79Å; D329-R333 IonicContact OD2-CZ 2.82Å; D329-R333 IonicContact OD2-NH2 3.9Å; D329-R333 PolarHBondContact OD2-NH2 3.37Å; E330-R333 WeakPolarHBondContact O-CB 3.27Å; E330-R333 PolarHBondContact O-N 3.43Å; L331-R333 PolarHBondContact O-N 3.49Å; L331-R333 VanDerWaalsContact O-N 3.16Å; R333-R355 HydrophobicContact CG-CG 4.16Å |
| 334 | H | 92.8 | Very high | 92 | Very high | 11 Ų | 11 | 70.6 Ų | 70.6 | 5% | 0.051 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -70.6 | -41.8 | 175.2 | 170.6 | 46.9 | 0 | 0 | 0 | 112.5 | C316 F325 E330 L331 R336 I337 H338 | C316-H334 PolarHBondContact SG-NE2 3.21Å; C316-H334 VanDerWaalsContact SG-NE2 3.41Å; F325-H334 HydrophobicContact CE1-CB 4.09Å; F325-H334 HydrophobicContact CE2-CB 3.8Å; F325-H334 AromaticContact CE2-CD2 3.25Å; F325-H334 WeakPolarHBondContact CE2-CD2 3.5Å; F325-H334 AromaticContact CE2-CG 3.66Å; F325-H334 HydrophobicContact CZ-CB 3.44Å; F325-H334 VanDerWaalsContact CZ-CB 3.44Å; F325-H334 AromaticContact CZ-CD2 3.43Å; F325-H334 VanDerWaalsContact CZ-CD2 3.43Å; F325-H334 WeakPolarHBondContact CZ-CD2 3.37Å; F325-H334 AromaticContact CZ-CG 3.37Å; E330-H334 WeakPolarHBondContact O-CB 3.37Å; E330-H334 PolarHBondContact O-N 3.35Å; L331-H334 WeakPolarHBondContact O-CA 3.38Å; L331-H334 WeakPolarHBondContact O-CB 3.48Å; L331-H334 PolarHBondContact O-N 3.07Å; H334-R336 PolarHBondContact O-N 3.37Å; H334-R336 VanDerWaalsContact O-N 3.1Å; H334-I337 VanDerWaalsContact O-CB 3.24Å; H334-I337 WeakPolarHBondContact O-CB 3.21Å; H334-I337 WeakPolarHBondContact O-CG1 3.4Å; H334-I337 PolarHBondContact O-N 3.48Å; H334-H338 AromaticContact CE1-CE1 4Å; H334-H338 AromaticContact CE1-NE2 3.32Å; H334-H338 PolarHBondContact CE1-NE2 2.76Å; H334-H338 VanDerWaalsContact CE1-NE2 3.32Å; H334-H338 AromaticContact NE2-CD2 3.95Å; H334-H338 AromaticContact NE2-NE2 3.23Å; H334-H338 PolarHBondContact NE2-NE2 2.93Å |
| 335 | I | 92.6 | Very high | 92.1 | Very high | 54 Ų | 54 | 68.4 Ų | 68.4 | 28% | 0.277 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -56.6 | -29.2 | 178.1 | -70.1 | 167 | 0 | 0 | 0 | 111.8 | L331 I337 H338 T339 | L331-I335 HydrophobicContact CD1-CD1 3.82Å; L331-I335 HydrophobicContact CD1-CG1 3.92Å; L331-I335 HydrophobicContact CD2-CD1 4.47Å; L331-I335 HydrophobicContact CG-CD1 3.82Å; L331-I335 HydrophobicContact CG-CG1 4.37Å; L331-I335 WeakPolarHBondContact O-CG1 3.38Å; L331-I335 PolarHBondContact O-N 3.48Å; I335-I337 PolarHBondContact O-N 3.08Å; I335-H338 PolarHBondContact O-N 3.36Å; I335-H338 VanDerWaalsContact O-N 3.11Å; I335-T339 HydrophobicContact CG2-CG2 3.98Å; I335-T339 PolarHBondContact O-N 3.12Å; I335-T339 PolarHBondContact O-OG1 2.68Å |
| 336 | R | 93.3 | Very high | 92.2 | Very high | 64 Ų | 64 | 66.9 Ų | 66.9 | 24% | 0.242 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -64.3 | -13.8 | 173.3 | -63 | 177.2 | -172 | -172 | -3.3 | 114.9 | H334 T339 G340 Q341 S354 | H334-R336 PolarHBondContact O-N 3.37Å; H334-R336 VanDerWaalsContact O-N 3.1Å; R336-T339 WeakPolarHBondContact CA-OG1 3.49Å; R336-G340 CarbonylContact O-C 3.41Å; R336-G340 WeakPolarHBondContact O-CA 3.41Å; R336-G340 PolarHBondContact O-N 3.22Å; R336-Q341 HydrophobicContact CB-CB 4.38Å; R336-Q341 HydrophobicContact CG-CB 4.18Å; R336-Q341 PolarHBondContact O-N 2.92Å; R336-S354 PolarHBondContact NH1-O 2.7Å |
| 337 | I | 91.1 | Very high | 92.3 | Very high | 101 Ų | 101 | 74.4 Ų | 74.4 | 52% | 0.518 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -75.2 | -48.8 | 171.4 | -56.8 | 179 | 0 | 0 | 0 | 108.6 | H334 I335 G340 | H334-I337 VanDerWaalsContact O-CB 3.24Å; H334-I337 WeakPolarHBondContact O-CB 3.21Å; H334-I337 WeakPolarHBondContact O-CG1 3.4Å; H334-I337 PolarHBondContact O-N 3.48Å; I335-I337 PolarHBondContact O-N 3.08Å; I337-G340 PolarHBondContact O-N 2.77Å |
| 338 | H | 91.1 | Very high | 92.4 | Very high | 76 Ų | 76 | 72.3 Ų | 72.3 | 35% | 0.352 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66.8 | -45.1 | 177.7 | -58.5 | -55.4 | 0 | 0 | 0 | 112.5 | C316 V318 H334 I335 G340 | C316-H338 VanDerWaalsContact SG-CD2 3.56Å; C316-H338 PolarHBondContact SG-NE2 3.18Å; V318-H338 HydrophobicContact CG2-CB 4.36Å; H334-H338 AromaticContact CE1-CE1 4Å; H334-H338 AromaticContact CE1-NE2 3.32Å; H334-H338 PolarHBondContact CE1-NE2 2.76Å; H334-H338 VanDerWaalsContact CE1-NE2 3.32Å; H334-H338 AromaticContact NE2-CD2 3.95Å; H334-H338 AromaticContact NE2-NE2 3.23Å; H334-H338 PolarHBondContact NE2-NE2 2.93Å; I335-H338 PolarHBondContact O-N 3.36Å; I335-H338 VanDerWaalsContact O-N 3.11Å; H338-G340 VanDerWaalsContact C-N 3.27Å; H338-G340 PolarHBondContact O-N 3.46Å |
| 339 | T | 90.3 | Very high | 92.5 | Very high | 74 Ų | 74 | 72.3 Ų | 72.3 | 45% | 0.454 | 36% | 0.361 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -82.9 | 0.4 | 179.3 | 63.1 | 0 | 0 | 0 | 0 | 113.9 | I335 R336 Q341 | I335-T339 HydrophobicContact CG2-CG2 3.98Å; I335-T339 PolarHBondContact O-N 3.12Å; I335-T339 PolarHBondContact O-OG1 2.68Å; R336-T339 WeakPolarHBondContact CA-OG1 3.49Å; T339-Q341 PolarHBondContact O-N 3.28Å; T339-Q341 WeakPolarHBondContact OG1-CG 3.2Å |
| 340 | G | 90.7 | Very high | 92.6 | Very high | 39 Ų | 39 | 74.8 Ų | 74.8 | 40% | 0.402 | 37% | 0.372 | S | S | . | . | trans | 61.8 | 2.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | R336 I337 H338 K342 | R336-G340 CarbonylContact O-C 3.41Å; R336-G340 WeakPolarHBondContact O-CA 3.41Å; R336-G340 PolarHBondContact O-N 3.22Å; I337-G340 PolarHBondContact O-N 2.77Å; H338-G340 VanDerWaalsContact C-N 3.27Å; H338-G340 PolarHBondContact O-N 3.46Å; G340-K342 WeakPolarHBondContact O-CG 3.06Å; G340-K342 PolarHBondContact O-N 2.81Å | ||
| 341 | Q | 91.9 | Very high | 92.7 | Very high | 113 Ų | 113 | 80.7 Ų | 80.7 | 53% | 0.528 | 39% | 0.392 | S | S | . | . | trans | -62.9 | 122.5 | -167.9 | -77.5 | -175.7 | 2.7 | 0 | 0 | 113.4 | R336 T339 P343 | R336-Q341 HydrophobicContact CB-CB 4.38Å; R336-Q341 HydrophobicContact CG-CB 4.18Å; R336-Q341 PolarHBondContact O-N 2.92Å; T339-Q341 PolarHBondContact O-N 3.28Å; T339-Q341 WeakPolarHBondContact OG1-CG 3.2Å; Q341-P343 WeakPolarHBondContact O-CD 3.46Å | ||
| 342 | K | 92.6 | Very high | 92.7 | Very high | 118 Ų | 118 | 83.1 Ų | 83.1 | 51% | 0.513 | 41% | 0.406 | S | S | . | . | trans | -123.6 | 69.3 | -177.9 | -69.4 | 157 | -170.5 | 166.1 | 0 | 111.5 | G340 F344 N352 F353 | G340-K342 WeakPolarHBondContact O-CG 3.06Å; G340-K342 PolarHBondContact O-N 2.81Å; K342-F344 PolarHBondContact O-N 3.25Å; K342-F344 VanDerWaalsContact O-N 3.12Å; K342-N352 HydrophobicContact CB-CB 3.69Å; K342-F353 CarbonylContact C-O 3.1Å; K342-F353 VanDerWaalsContact CA-O 3.28Å; K342-F353 WeakPolarHBondContact CA-O 3.5Å | ||
| 343 | P | 90.6 | Very high | 92.8 | Very high | 76 Ų | 76 | 81.1 Ų | 81.1 | 49% | 0.494 | 39% | 0.39 | S | S | . | . | trans | -73.2 | 0.1 | -169.6 | 30.4 | -37.2 | 0 | 0 | 0 | 115.6 | Q341 | Q341-P343 WeakPolarHBondContact O-CD 3.46Š| ||
| 344 | F | 94.7 | Very high | 92.8 | Very high | 64 Ų | 64 | 78.8 Ų | 78.8 | 28% | 0.281 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 97.8 | -177.8 | -58.6 | -73.2 | 0 | 0 | 0 | 111.2 | K342 F353 R355 S356 L359 | K342-F344 PolarHBondContact O-N 3.25Å; K342-F344 VanDerWaalsContact O-N 3.12Å; F344-F353 HydrophobicContact CB-CB 4.34Å; F344-F353 WeakPolarHBondContact CB-O 3.19Å; F344-F353 PolarHBondContact N-O 3.48Å; F344-F353 PolarHBondContact O-N 2.71Å; F344-R355 VanDerWaalsContact CD2-CA 3.49Å; F344-S356 VanDerWaalsContact CD2-N 3.34Å; F344-L359 HydrophobicContact CB-CB 4.14Å; F344-L359 HydrophobicContact CB-CD2 3.84Å |
| 345 | Q | 95.1 | Very high | 92.8 | Very high | 88 Ų | 88 | 82.3 Ų | 82.3 | 41% | 0.411 | 40% | 0.4 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.1 | 139.8 | -179.9 | -167.3 | 162.2 | 46.4 | 0 | 0 | 113.1 | M350 N352 L359 | Q345-M350 WeakPolarHBondContact CG-O 3.35Å; Q345-M350 PolarHBondContact NE2-O 3.01Å; Q345-N352 WeakPolarHBondContact CA-OD1 3.43Å; Q345-N352 WeakPolarHBondContact CB-OD1 3.15Å; Q345-N352 WeakPolarHBondContact CG-OD1 3.44Å; Q345-N352 PolarHBondContact NE2-OD1 2.87Å; Q345-L359 WeakPolarHBondContact O-CD2 3.42Å |
| 346 | C | 94.8 | Very high | 92.7 | Very high | 1 Ų | 1 | 82.1 Ų | 82.1 | 1% | 0.007 | 40% | 0.404 | C | S | . | . | trans | -84.9 | 117.2 | 167.4 | -172.6 | 0 | 0 | 0 | 0 | 111 | I348 C349 M350 R351 F353 L359 | C346-I348 PolarHBondContact O-N 2.82Å; C346-I348 VanDerWaalsContact O-N 3.12Å; C346-C349 PolarHBondContact O-N 3.12Å; C346-M350 WeakPolarHBondContact O-CA 3.19Å; C346-M350 PolarHBondContact O-N 2.68Å; C346-R351 PolarHBondContact N-O 3.27Å; C346-F353 HydrophobicContact CB-CE2 4.26Å; C346-L359 HydrophobicContact CB-CD1 3.6Å | ||
| 347 | R | 93.9 | Very high | 92.6 | Very high | 201 Ų | 201 | 82 Ų | 82 | 76% | 0.758 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -12.5 | 179.6 | -63.4 | -177.4 | -178.8 | 176 | -2.1 | 115.2 | ||
| 348 | I | 92.9 | Very high | 92.6 | Very high | 85 Ų | 85 | 80.6 Ų | 80.6 | 44% | 0.436 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92 | -30.9 | -175.3 | -57.6 | 173.6 | 0 | 0 | 0 | 111.9 | C346 H366 | C346-I348 PolarHBondContact O-N 2.82Å; C346-I348 VanDerWaalsContact O-N 3.12Å; I348-H366 HydrophobicContact CD1-CB 3.65Å; I348-H366 HydrophobicContact CG2-CB 4.19Å |
| 349 | C | 93.7 | Very high | 92.8 | Very high | 59 Ų | 59 | 77.9 Ų | 77.9 | 40% | 0.399 | 39% | 0.387 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -138.4 | 13.7 | -177.8 | 65.2 | 0 | 0 | 0 | 0 | 113.6 | C346 R351 H362 H366 | C346-C349 PolarHBondContact O-N 3.12Å; C349-R351 PolarHBondContact O-N 3.5Å; C349-H362 PolarHBondContact SG-NE2 3.05Å; C349-H366 PolarHBondContact SG-NE2 2.8Å |
| 350 | M | 93.1 | Very high | 92.9 | Very high | 112 Ų | 112 | 77.6 Ų | 77.6 | 55% | 0.552 | 39% | 0.386 | S | S | * | . | trans | 53.8 | 7.7 | -179.2 | -55.2 | -53.7 | -86.8 | 0 | 0 | 116.7 | Q345 C346 | Q345-M350 WeakPolarHBondContact CG-O 3.35Å; Q345-M350 PolarHBondContact NE2-O 3.01Å; C346-M350 WeakPolarHBondContact O-CA 3.19Å; C346-M350 PolarHBondContact O-N 2.68Å | ||
| 351 | R | 93.9 | Very high | 93 | Very high | 169 Ų | 169 | 77.6 Ų | 77.6 | 64% | 0.638 | 38% | 0.378 | S | S | * | . | trans | -68.4 | 133 | 179.7 | -169.6 | 171.2 | -174.1 | 157.8 | 4.4 | 111.7 | C346 C349 F353 | C346-R351 PolarHBondContact N-O 3.27Å; C349-R351 PolarHBondContact O-N 3.5Å; R351-F353 HydrophobicContact CB-CE2 4.07Å; R351-F353 HydrophobicContact CB-CZ 4.43Å; R351-F353 HydrophobicContact CG-CE2 3.98Å; R351-F353 HydrophobicContact CG-CZ 3.99Å; R351-F353 WeakPolarHBondContact O-CD2 3.5Å; R351-F353 WeakPolarHBondContact O-CE2 3.16Å | ||
| 352 | N | 94.4 | Very high | 93 | Very high | 74 Ų | 74 | 73.6 Ų | 73.6 | 40% | 0.396 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 140 | -174.8 | -70.1 | -44.9 | 0 | 0 | 0 | 112.8 | K342 Q345 | K342-N352 HydrophobicContact CB-CB 3.69Å; Q345-N352 WeakPolarHBondContact CA-OD1 3.43Å; Q345-N352 WeakPolarHBondContact CB-OD1 3.15Å; Q345-N352 WeakPolarHBondContact CG-OD1 3.44Å; Q345-N352 PolarHBondContact NE2-OD1 2.87Å |
| 353 | F | 93.1 | Very high | 93 | Very high | 35 Ų | 35 | 69.7 Ų | 69.7 | 15% | 0.154 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 146.1 | -178 | -62 | -93.7 | 0 | 0 | 0 | 111.9 | K342 F344 C346 R351 R355 H358 L359 H362 | K342-F353 CarbonylContact C-O 3.1Å; K342-F353 VanDerWaalsContact CA-O 3.28Å; K342-F353 WeakPolarHBondContact CA-O 3.5Å; F344-F353 HydrophobicContact CB-CB 4.34Å; F344-F353 WeakPolarHBondContact CB-O 3.19Å; F344-F353 PolarHBondContact N-O 3.48Å; F344-F353 PolarHBondContact O-N 2.71Å; C346-F353 HydrophobicContact CB-CE2 4.26Å; R351-F353 HydrophobicContact CB-CE2 4.07Å; R351-F353 HydrophobicContact CB-CZ 4.43Å; R351-F353 HydrophobicContact CG-CE2 3.98Å; R351-F353 HydrophobicContact CG-CZ 3.99Å; R351-F353 WeakPolarHBondContact O-CD2 3.5Å; R351-F353 WeakPolarHBondContact O-CE2 3.16Å; F353-R355 VanDerWaalsContact C-N 3.32Å; F353-H358 HydrophobicContact CD1-CB 4.15Å; F353-L359 HydrophobicContact CB-CB 4.34Å; F353-L359 HydrophobicContact CD2-CB 4.18Å; F353-L359 HydrophobicContact CD2-CD1 4.01Å; F353-L359 HydrophobicContact CE2-CD1 4.25Å; F353-L359 HydrophobicContact CG-CB 4.35Å; F353-H362 HydrophobicContact CE1-CB 4.05Å; F353-H362 HydrophobicContact CE2-CB 4.16Å; F353-H362 AromaticContact CE2-CD2 3.32Å; F353-H362 WeakPolarHBondContact CE2-CD2 3.23Å; F353-H362 AromaticContact CE2-CG 3.89Å; F353-H362 HydrophobicContact CZ-CB 3.63Å; F353-H362 AromaticContact CZ-CD2 3.26Å; F353-H362 WeakPolarHBondContact CZ-CD2 3.41Å; F353-H362 AromaticContact CZ-CG 3.38Å; F353-H362 AromaticContact CZ-NE2 3.99Å |
| 354 | S | 92.4 | Very high | 93.1 | Very high | 40 Ų | 40 | 68.2 Ų | 68.2 | 28% | 0.28 | 33% | 0.328 | S | S | . | . | S | Bend | trans | -75.6 | -17.5 | 177.5 | 55.2 | 0 | 0 | 0 | 0 | 114.1 | R336 | R336-S354 PolarHBondContact NH1-O 2.7Š|
| 355 | R | 91.8 | Very high | 93 | Very high | 85 Ų | 85 | 69.9 Ų | 69.9 | 32% | 0.321 | 34% | 0.343 | S | S | . | . | S | Bend | trans | -136.9 | 145.2 | -176.9 | -62 | 163.6 | 51.2 | 160.2 | -4.6 | 112.7 | R333 F344 F353 D357 H358 L359 | R333-R355 HydrophobicContact CG-CG 4.16Å; F344-R355 VanDerWaalsContact CD2-CA 3.49Å; F353-R355 VanDerWaalsContact C-N 3.32Å; R355-D357 WeakPolarHBondContact CB-OD1 3.47Å; R355-D357 IonicContact CZ-OD1 3.48Å; R355-D357 IonicContact CZ-OD2 3.5Å; R355-D357 IonicContact NE-OD1 3.57Å; R355-D357 PolarHBondContact NE-OD1 3.46Å; R355-D357 IonicContact NE-OD2 2.78Å; R355-D357 VanDerWaalsContact NH2-CG 3.35Å; R355-D357 IonicContact NH2-OD1 3.05Å; R355-D357 PolarHBondContact NH2-OD1 2.9Å; R355-D357 IonicContact NH2-OD2 3.5Å; R355-D357 PolarHBondContact NH2-OD2 2.78Å; R355-H358 HydrophobicContact CB-CB 4.36Å; R355-H358 WeakPolarHBondContact CD-NE2 3.44Å; R355-H358 PolarHBondContact NE-CE1 2.96Å; R355-H358 PolarHBondContact NE-NE2 3.05Å; R355-H358 PolarHBondContact NH2-CE1 2.89Å; R355-H358 PolarHBondContact O-N 3.24Å; R355-L359 PolarHBondContact O-N 2.75Å |
| 356 | S | 92.2 | Very high | 92.8 | Very high | 51 Ų | 51 | 68.7 Ų | 68.7 | 36% | 0.357 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -73.4 | -30.9 | -179.1 | 50.7 | 0 | 0 | 0 | 0 | 113.8 | F344 H358 L359 T360 | F344-S356 VanDerWaalsContact CD2-N 3.34Å; S356-H358 VanDerWaalsContact C-N 3.35Å; S356-L359 PolarHBondContact O-N 2.74Å; S356-T360 WeakPolarHBondContact O-CB 3.48Å; S356-T360 PolarHBondContact O-N 3.46Å; S356-T360 PolarHBondContact O-OG1 2.89Å |
| 357 | D | 90.3 | Very high | 92.5 | Very high | 60 Ų | 60 | 70.4 Ų | 70.4 | 32% | 0.321 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.4 | -39.1 | 174.1 | 68.8 | -57.9 | 0 | 0 | 0 | 111.2 | R355 T360 T361 | R355-D357 WeakPolarHBondContact CB-OD1 3.47Å; R355-D357 IonicContact CZ-OD1 3.48Å; R355-D357 IonicContact CZ-OD2 3.5Å; R355-D357 IonicContact NE-OD1 3.57Å; R355-D357 PolarHBondContact NE-OD1 3.46Å; R355-D357 IonicContact NE-OD2 2.78Å; R355-D357 VanDerWaalsContact NH2-CG 3.35Å; R355-D357 IonicContact NH2-OD1 3.05Å; R355-D357 PolarHBondContact NH2-OD1 2.9Å; R355-D357 IonicContact NH2-OD2 3.5Å; R355-D357 PolarHBondContact NH2-OD2 2.78Å; D357-T360 WeakPolarHBondContact O-CB 3.49Å; D357-T360 PolarHBondContact O-N 3.24Å; D357-T361 WeakPolarHBondContact O-CG2 3.41Å; D357-T361 PolarHBondContact O-N 2.85Å; D357-T361 PolarHBondContact O-OG1 2.85Å |
| 358 | H | 92.3 | Very high | 92.3 | Very high | 73 Ų | 73 | 63 Ų | 63 | 34% | 0.338 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.5 | -46.7 | 174.5 | -65.1 | -1.7 | 0 | 0 | 0 | 111.5 | F353 R355 S356 T360 T361 H362 | F353-H358 HydrophobicContact CD1-CB 4.15Å; R355-H358 HydrophobicContact CB-CB 4.36Å; R355-H358 WeakPolarHBondContact CD-NE2 3.44Å; R355-H358 PolarHBondContact NE-CE1 2.96Å; R355-H358 PolarHBondContact NE-NE2 3.05Å; R355-H358 PolarHBondContact NH2-CE1 2.89Å; R355-H358 PolarHBondContact O-N 3.24Å; S356-H358 VanDerWaalsContact C-N 3.35Å; H358-T360 VanDerWaalsContact C-N 3.32Å; H358-T360 PolarHBondContact O-N 2.74Å; H358-T361 WeakPolarHBondContact CA-OG1 3.43Å; H358-T361 PolarHBondContact O-N 2.9Å; H358-T361 PolarHBondContact O-OG1 3.25Å; H358-H362 WeakPolarHBondContact O-CB 3.41Å; H358-H362 PolarHBondContact O-N 3.11Å |
| 359 | L | 94.6 | Very high | 92.1 | Very high | 19 Ų | 19 | 62.8 Ų | 62.8 | 10% | 0.099 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -56.4 | -44.7 | 171.4 | 171.9 | 60.8 | 0 | 0 | 0 | 111.7 | F344 Q345 C346 F353 R355 S356 T361 H362 I363 | F344-L359 HydrophobicContact CB-CB 4.14Å; F344-L359 HydrophobicContact CB-CD2 3.84Å; Q345-L359 WeakPolarHBondContact O-CD2 3.42Å; C346-L359 HydrophobicContact CB-CD1 3.6Å; F353-L359 HydrophobicContact CB-CB 4.34Å; F353-L359 HydrophobicContact CD2-CB 4.18Å; F353-L359 HydrophobicContact CD2-CD1 4.01Å; F353-L359 HydrophobicContact CE2-CD1 4.25Å; F353-L359 HydrophobicContact CG-CB 4.35Å; R355-L359 PolarHBondContact O-N 2.75Å; S356-L359 PolarHBondContact O-N 2.74Å; L359-T361 VanDerWaalsContact C-N 3.33Å; L359-T361 PolarHBondContact O-N 3.41Å; L359-H362 PolarHBondContact O-N 3.11Å; L359-H362 VanDerWaalsContact O-N 3.11Å; L359-I363 HydrophobicContact CD1-CD1 4.01Å; L359-I363 HydrophobicContact CD1-CG1 4.08Å; L359-I363 HydrophobicContact CG-CD1 4.03Å; L359-I363 WeakPolarHBondContact O-CG1 3.5Å; L359-I363 PolarHBondContact O-N 3.36Å |
| 360 | T | 92.6 | Very high | 91.9 | Very high | 68 Ų | 68 | 65.8 Ų | 65.8 | 42% | 0.417 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -61.5 | -40.9 | 178.9 | -55.3 | 0 | 0 | 0 | 0 | 111.6 | S356 D357 H358 | S356-T360 WeakPolarHBondContact O-CB 3.48Å; S356-T360 PolarHBondContact O-N 3.46Å; S356-T360 PolarHBondContact O-OG1 2.89Å; D357-T360 WeakPolarHBondContact O-CB 3.49Å; D357-T360 PolarHBondContact O-N 3.24Å; H358-T360 VanDerWaalsContact C-N 3.32Å; H358-T360 PolarHBondContact O-N 2.74Å |
| 361 | T | 91.8 | Very high | 91.7 | Very high | 39 Ų | 39 | 64.1 Ų | 64.1 | 24% | 0.239 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -72.1 | -28.3 | 174.7 | 55.2 | 0 | 0 | 0 | 0 | 113.3 | D357 H358 L359 R383 | D357-T361 WeakPolarHBondContact O-CG2 3.41Å; D357-T361 PolarHBondContact O-N 2.85Å; D357-T361 PolarHBondContact O-OG1 2.85Å; H358-T361 WeakPolarHBondContact CA-OG1 3.43Å; H358-T361 PolarHBondContact O-N 2.9Å; H358-T361 PolarHBondContact O-OG1 3.25Å; L359-T361 VanDerWaalsContact C-N 3.33Å; L359-T361 PolarHBondContact O-N 3.41Å; T361-R383 HydrophobicContact CG2-CG 3.7Å |
| 362 | H | 92.8 | Very high | 91.6 | Very high | 29 Ų | 29 | 59.1 Ų | 59.1 | 13% | 0.134 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -73.6 | -36.8 | 174.6 | 173.5 | 49.7 | 0 | 0 | 0 | 112.5 | C349 F353 H358 L359 R364 T365 H366 | C349-H362 PolarHBondContact SG-NE2 3.05Å; F353-H362 HydrophobicContact CE1-CB 4.05Å; F353-H362 HydrophobicContact CE2-CB 4.16Å; F353-H362 AromaticContact CE2-CD2 3.32Å; F353-H362 WeakPolarHBondContact CE2-CD2 3.23Å; F353-H362 AromaticContact CE2-CG 3.89Å; F353-H362 HydrophobicContact CZ-CB 3.63Å; F353-H362 AromaticContact CZ-CD2 3.26Å; F353-H362 WeakPolarHBondContact CZ-CD2 3.41Å; F353-H362 AromaticContact CZ-CG 3.38Å; F353-H362 AromaticContact CZ-NE2 3.99Å; H358-H362 WeakPolarHBondContact O-CB 3.41Å; H358-H362 PolarHBondContact O-N 3.11Å; L359-H362 PolarHBondContact O-N 3.11Å; L359-H362 VanDerWaalsContact O-N 3.11Å; H362-R364 PolarHBondContact O-N 2.89Å; H362-R364 VanDerWaalsContact O-N 3.11Å; H362-T365 PolarHBondContact CE1-OG1 3.41Å; H362-T365 PolarHBondContact ND1-OG1 2.97Å; H362-T365 VanDerWaalsContact ND1-OG1 3.16Å; H362-T365 WeakPolarHBondContact O-CB 3.5Å; H362-T365 PolarHBondContact O-N 3.31Å; H362-T365 PolarHBondContact O-OG1 2.84Å; H362-H366 AromaticContact CD2-NE2 4Å; H362-H366 AromaticContact CE1-CE1 3.94Å; H362-H366 AromaticContact CE1-NE2 3.28Å; H362-H366 PolarHBondContact CE1-NE2 3.11Å; H362-H366 VanDerWaalsContact CE1-NE2 3.28Å; H362-H366 AromaticContact NE2-CD2 3.93Å; H362-H366 AromaticContact NE2-NE2 3.1Å; H362-H366 PolarHBondContact NE2-NE2 2.99Å; H362-H366 VanDerWaalsContact NE2-NE2 3.1Å |
| 363 | I | 92.8 | Very high | 91.5 | Very high | 36 Ų | 36 | 57.7 Ų | 57.7 | 19% | 0.185 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -56.7 | -32.2 | 175.8 | -70.6 | 164.8 | 0 | 0 | 0 | 111.1 | I292 L359 T365 H366 T367 | I292-I363 HydrophobicContact CD1-CD1 4.33Å; L359-I363 HydrophobicContact CD1-CD1 4.01Å; L359-I363 HydrophobicContact CD1-CG1 4.08Å; L359-I363 HydrophobicContact CG-CD1 4.03Å; L359-I363 WeakPolarHBondContact O-CG1 3.5Å; L359-I363 PolarHBondContact O-N 3.36Å; I363-T365 PolarHBondContact O-N 3.46Å; I363-H366 PolarHBondContact O-N 2.96Å; I363-T367 HydrophobicContact CG2-CG2 4.25Å; I363-T367 PolarHBondContact O-N 3.29Å; I363-T367 VanDerWaalsContact O-N 3.11Å |
| 364 | R | 93.2 | Very high | 91.5 | Very high | 45 Ų | 45 | 56.1 Ų | 56.1 | 17% | 0.17 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -64.6 | -18.5 | 173.4 | -62.1 | -170.3 | 179.9 | 128.1 | 12.8 | 115.2 | H362 H366 G368 E369 A382 | H362-R364 PolarHBondContact O-N 2.89Å; H362-R364 VanDerWaalsContact O-N 3.11Å; R364-H366 VanDerWaalsContact C-N 3.3Å; R364-G368 WeakPolarHBondContact O-CA 3.45Å; R364-G368 PolarHBondContact O-N 2.98Å; R364-E369 HydrophobicContact CB-CB 4.3Å; R364-E369 HydrophobicContact CG-CB 4.01Å; R364-E369 IonicContact NE-OE2 3.96Å; R364-E369 PolarHBondContact O-N 2.9Å; R364-A382 HydrophobicContact CB-CB 4.4Å; R364-A382 WeakPolarHBondContact CD-O 3.22Å; R364-A382 PolarHBondContact NH1-O 2.9Å |
| 365 | T | 91.4 | Very high | 91.5 | Very high | 98 Ų | 98 | 61.7 Ų | 61.7 | 60% | 0.601 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -74.7 | -25.1 | 172.4 | 69.4 | 0 | 0 | 0 | 0 | 111.9 | H362 I363 | H362-T365 PolarHBondContact CE1-OG1 3.41Å; H362-T365 PolarHBondContact ND1-OG1 2.97Å; H362-T365 VanDerWaalsContact ND1-OG1 3.16Å; H362-T365 WeakPolarHBondContact O-CB 3.5Å; H362-T365 PolarHBondContact O-N 3.31Å; H362-T365 PolarHBondContact O-OG1 2.84Å; I363-T365 PolarHBondContact O-N 3.46Å |
| 366 | H | 90.3 | Very high | 91.4 | Very high | 63 Ų | 63 | 62.6 Ų | 62.6 | 29% | 0.292 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -85.1 | -41.1 | 174.5 | -58.8 | -64.5 | 0 | 0 | 0 | 112.1 | I348 C349 H362 I363 R364 | I348-H366 HydrophobicContact CD1-CB 3.65Å; I348-H366 HydrophobicContact CG2-CB 4.19Å; C349-H366 PolarHBondContact SG-NE2 2.8Å; H362-H366 AromaticContact CD2-NE2 4Å; H362-H366 AromaticContact CE1-CE1 3.94Å; H362-H366 AromaticContact CE1-NE2 3.28Å; H362-H366 PolarHBondContact CE1-NE2 3.11Å; H362-H366 VanDerWaalsContact CE1-NE2 3.28Å; H362-H366 AromaticContact NE2-CD2 3.93Å; H362-H366 AromaticContact NE2-NE2 3.1Å; H362-H366 PolarHBondContact NE2-NE2 2.99Å; H362-H366 VanDerWaalsContact NE2-NE2 3.1Å; I363-H366 PolarHBondContact O-N 2.96Å; R364-H366 VanDerWaalsContact C-N 3.3Å |
| 367 | T | 89.5 | Confident | 91.4 | Very high | 38 Ų | 38 | 63.1 Ų | 63.1 | 23% | 0.233 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -83 | -13.2 | 180 | 66.7 | 0 | 0 | 0 | 0 | 114.2 | L291 I363 E369 | L291-T367 HydrophobicContact CD2-CG2 3.52Å; I363-T367 HydrophobicContact CG2-CG2 4.25Å; I363-T367 PolarHBondContact O-N 3.29Å; I363-T367 VanDerWaalsContact O-N 3.11Å; T367-E369 PolarHBondContact O-N 2.78Å; T367-E369 WeakPolarHBondContact OG1-CB 3.3Å; T367-E369 WeakPolarHBondContact OG1-CG 3.49Å; T367-E369 PolarHBondContact OG1-N 3.2Å |
| 368 | G | 89.1 | Confident | 91.4 | Very high | 45 Ų | 45 | 62.6 Ų | 62.6 | 46% | 0.464 | 35% | 0.353 | S | S | . | . | trans | 71.6 | 3.6 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | R364 K370 | R364-G368 WeakPolarHBondContact O-CA 3.45Å; R364-G368 PolarHBondContact O-N 2.98Å; G368-K370 PolarHBondContact O-N 3.37Å | ||
| 369 | E | 88.8 | Confident | 91.4 | Very high | 81 Ų | 81 | 66.8 Ų | 66.8 | 38% | 0.379 | 37% | 0.366 | S | S | . | . | trans | -59.5 | 121 | -176.8 | -83.6 | -179.3 | -156.5 | 0 | 0 | 113 | R364 T367 P371 | R364-E369 HydrophobicContact CB-CB 4.3Å; R364-E369 HydrophobicContact CG-CB 4.01Å; R364-E369 IonicContact NE-OE2 3.96Å; R364-E369 PolarHBondContact O-N 2.9Å; T367-E369 PolarHBondContact O-N 2.78Å; T367-E369 WeakPolarHBondContact OG1-CB 3.3Å; T367-E369 WeakPolarHBondContact OG1-CG 3.49Å; T367-E369 PolarHBondContact OG1-N 3.2Å; E369-P371 WeakPolarHBondContact O-CD 3.44Å | ||
| 370 | K | 89.8 | Confident | 91.3 | Very high | 122 Ų | 122 | 72.5 Ų | 72.5 | 53% | 0.53 | 39% | 0.39 | S | S | . | . | trans | -125 | 75.7 | 178 | -68.3 | 165.1 | -170.1 | 170.4 | 0 | 110.3 | G368 F372 K380 F381 | G368-K370 PolarHBondContact O-N 3.37Å; K370-F372 VanDerWaalsContact C-N 3.27Å; K370-F372 PolarHBondContact O-N 3.24Å; K370-K380 HydrophobicContact CB-CB 3.66Å; K370-F381 CarbonylContact C-O 3.23Å; K370-F381 VanDerWaalsContact C-O 3.23Å; K370-F381 WeakPolarHBondContact CA-O 3.42Å | ||
| 371 | P | 89.1 | Confident | 91.2 | Very high | 76 Ų | 76 | 70.7 Ų | 70.7 | 49% | 0.494 | 38% | 0.377 | S | S | . | . | trans | -73.5 | -14.3 | -173.4 | 28.9 | -34.7 | 0 | 0 | 0 | 114 | E369 A373 | E369-P371 WeakPolarHBondContact O-CD 3.44Å; P371-A373 PolarHBondContact O-N 3.15Å | ||
| 372 | F | 91.6 | Very high | 91 | Very high | 64 Ų | 64 | 69.7 Ų | 69.7 | 28% | 0.281 | 37% | 0.372 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 89.8 | -174.4 | -61.6 | -71.3 | 0 | 0 | 0 | 111.6 | K370 F381 R387 | K370-F372 VanDerWaalsContact C-N 3.27Å; K370-F372 PolarHBondContact O-N 3.24Å; F372-F381 HydrophobicContact CB-CB 4.29Å; F372-F381 PolarHBondContact N-O 3.15Å; F372-F381 VanDerWaalsContact N-O 3.14Å; F372-F381 PolarHBondContact O-N 2.86Å; F372-R387 HydrophobicContact CB-CB 4.16Å |
| 373 | A | 91.4 | Very high | 90.9 | Very high | 45 Ų | 45 | 72.3 Ų | 72.3 | 37% | 0.372 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 134.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112 | P371 K380 R387 | P371-A373 PolarHBondContact O-N 3.15Å; A373-K380 HydrophobicContact CB-CG 4.21Å; A373-R387 VanDerWaalsContact O-CD 3.3Å; A373-R387 WeakPolarHBondContact O-CD 3.41Å; A373-R387 PolarHBondContact O-NH1 2.84Å; A373-R387 VanDerWaalsContact O-NH1 3.08Å |
| 374 | C | 93.8 | Very high | 90.8 | Very high | 1 Ų | 1 | 72.9 Ų | 72.9 | 1% | 0.007 | 39% | 0.388 | C | S | . | . | trans | -74.3 | 123.7 | 168.7 | -177.5 | 0 | 0 | 0 | 0 | 110.2 | I376 C377 G378 R379 F381 R387 | C374-I376 PolarHBondContact O-N 3.03Å; C374-C377 PolarHBondContact O-N 2.84Å; C374-C377 VanDerWaalsContact SG-SG 3.65Å; C374-G378 VanDerWaalsContact O-CA 3.31Å; C374-G378 WeakPolarHBondContact O-CA 3.41Å; C374-G378 PolarHBondContact O-N 2.87Å; C374-R379 WeakPolarHBondContact CB-O 3.47Å; C374-R379 PolarHBondContact N-O 3.25Å; C374-F381 HydrophobicContact CB-CE2 4.21Å; C374-R387 HydrophobicContact CB-CG 4.43Å | ||
| 375 | E | 91.9 | Very high | 90.7 | Very high | 158 Ų | 158 | 73.4 Ų | 73.4 | 74% | 0.738 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -28.3 | -178.1 | -66.7 | 143.6 | -134.4 | 0 | 0 | 113 | R387 | E375-R387 IonicContact OE1-CZ 3.26Å; E375-R387 VanDerWaalsContact OE1-CZ 3.26Å; E375-R387 IonicContact OE1-NH1 2.63Å; E375-R387 PolarHBondContact OE1-NH1 3.46Å; E375-R387 IonicContact OE1-NH2 2.99Å; E375-R387 PolarHBondContact OE1-NH2 3.16Å |
| 376 | I | 90.5 | Very high | 90.7 | Very high | 104 Ų | 104 | 71 Ų | 71 | 53% | 0.533 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | -26.3 | -173.4 | -58.5 | 169.8 | 0 | 0 | 0 | 112.7 | C374 H394 | C374-I376 PolarHBondContact O-N 3.03Å; I376-H394 HydrophobicContact CB-CB 4.45Å; I376-H394 HydrophobicContact CD1-CB 3.54Å; I376-H394 HydrophobicContact CG2-CB 4.02Å |
| 377 | C | 92.6 | Very high | 90.9 | Very high | 62 Ų | 62 | 70.8 Ų | 70.8 | 42% | 0.419 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -142.7 | 7.5 | -171.4 | 69.2 | 0 | 0 | 0 | 0 | 115 | C374 R379 H390 H394 | C374-C377 PolarHBondContact O-N 2.84Å; C374-C377 VanDerWaalsContact SG-SG 3.65Å; C377-R379 PolarHBondContact O-N 3.24Å; C377-H390 PolarHBondContact SG-NE2 3.41Å; C377-H394 PolarHBondContact SG-NE2 3.02Å; C377-H394 VanDerWaalsContact SG-NE2 3.36Å |
| 378 | G | 89 | Confident | 91 | Very high | 48 Ų | 48 | 75.3 Ų | 75.3 | 50% | 0.495 | 39% | 0.389 | S | S | . | . | trans | 67.6 | -12.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | C374 K380 | C374-G378 VanDerWaalsContact O-CA 3.31Å; C374-G378 WeakPolarHBondContact O-CA 3.41Å; C374-G378 PolarHBondContact O-N 2.87Å; G378-K380 WeakPolarHBondContact O-CG 3.26Å; G378-K380 PolarHBondContact O-N 3.43Å | ||
| 379 | R | 92.1 | Very high | 91.2 | Very high | 161 Ų | 161 | 80 Ų | 80 | 61% | 0.608 | 39% | 0.393 | S | S | * | . | trans | -58.7 | 126.5 | -174.3 | -169.4 | 171 | -176.8 | 167.7 | 3.2 | 111.3 | C374 C377 F381 | C374-R379 WeakPolarHBondContact CB-O 3.47Å; C374-R379 PolarHBondContact N-O 3.25Å; C377-R379 PolarHBondContact O-N 3.24Å; R379-F381 HydrophobicContact CB-CE2 4.01Å; R379-F381 HydrophobicContact CB-CZ 4.27Å; R379-F381 HydrophobicContact CG-CE2 3.93Å; R379-F381 HydrophobicContact CG-CZ 3.79Å; R379-F381 WeakPolarHBondContact O-CD2 3.32Å; R379-F381 VanDerWaalsContact O-CE2 3.23Å; R379-F381 WeakPolarHBondContact O-CE2 3.33Å | ||
| 380 | K | 92.7 | Very high | 91.4 | Very high | 139 Ų | 139 | 77.2 Ų | 77.2 | 60% | 0.604 | 38% | 0.38 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 138.6 | -174.7 | -57.1 | -174.1 | -179.1 | 178 | 0 | 112.2 | K370 A373 G378 | K370-K380 HydrophobicContact CB-CB 3.66Å; A373-K380 HydrophobicContact CB-CG 4.21Å; G378-K380 WeakPolarHBondContact O-CG 3.26Å; G378-K380 PolarHBondContact O-N 3.43Å |
| 381 | F | 90.6 | Very high | 91.5 | Very high | 30 Ų | 30 | 72.8 Ų | 72.8 | 13% | 0.132 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 154.5 | -176.9 | -62.5 | -87 | 0 | 0 | 0 | 112.1 | K370 F372 C374 R379 E386 R387 H390 | K370-F381 CarbonylContact C-O 3.23Å; K370-F381 VanDerWaalsContact C-O 3.23Å; K370-F381 WeakPolarHBondContact CA-O 3.42Å; F372-F381 HydrophobicContact CB-CB 4.29Å; F372-F381 PolarHBondContact N-O 3.15Å; F372-F381 VanDerWaalsContact N-O 3.14Å; F372-F381 PolarHBondContact O-N 2.86Å; C374-F381 HydrophobicContact CB-CE2 4.21Å; R379-F381 HydrophobicContact CB-CE2 4.01Å; R379-F381 HydrophobicContact CB-CZ 4.27Å; R379-F381 HydrophobicContact CG-CE2 3.93Å; R379-F381 HydrophobicContact CG-CZ 3.79Å; R379-F381 WeakPolarHBondContact O-CD2 3.32Å; R379-F381 VanDerWaalsContact O-CE2 3.23Å; R379-F381 WeakPolarHBondContact O-CE2 3.33Å; F381-E386 HydrophobicContact CB-CB 4.02Å; F381-E386 HydrophobicContact CD1-CB 3.78Å; F381-E386 HydrophobicContact CG-CB 4.15Å; F381-R387 HydrophobicContact CB-CB 4.37Å; F381-R387 HydrophobicContact CD2-CB 4.01Å; F381-R387 HydrophobicContact CD2-CG 4.07Å; F381-R387 HydrophobicContact CG-CB 4.35Å; F381-H390 HydrophobicContact CE1-CB 4.12Å; F381-H390 HydrophobicContact CE2-CB 3.95Å; F381-H390 AromaticContact CE2-CD2 3.5Å; F381-H390 VanDerWaalsContact CE2-CD2 3.5Å; F381-H390 WeakPolarHBondContact CE2-CD2 3.5Å; F381-H390 AromaticContact CE2-CG 3.85Å; F381-H390 HydrophobicContact CZ-CB 3.51Å; F381-H390 AromaticContact CZ-CD2 3.42Å; F381-H390 VanDerWaalsContact CZ-CD2 3.42Å; F381-H390 WeakPolarHBondContact CZ-CD2 3.37Å; F381-H390 AromaticContact CZ-CG 3.36Å |
| 382 | A | 88.8 | Confident | 91.7 | Very high | 18 Ų | 18 | 76.2 Ų | 76.2 | 15% | 0.149 | 37% | 0.37 | C | S | . | . | S | Bend | trans | -80.8 | -26.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112 | R364 E386 | R364-A382 HydrophobicContact CB-CB 4.4Å; R364-A382 WeakPolarHBondContact CD-O 3.22Å; R364-A382 PolarHBondContact NH1-O 2.9Å; A382-E386 PolarHBondContact N-OE2 3.16Å; A382-E386 VanDerWaalsContact N-OE2 3.17Å |
| 383 | R | 89.4 | Confident | 91.7 | Very high | 85 Ų | 85 | 77.1 Ų | 77.1 | 32% | 0.321 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -125.9 | 157.1 | 177.6 | -55.6 | -177.2 | -73.3 | 148.2 | -12.1 | 113.5 | T361 D385 E386 R387 | T361-R383 HydrophobicContact CG2-CG 3.7Å; R383-D385 WeakPolarHBondContact CB-OD1 3.38Å; R383-D385 WeakPolarHBondContact CD-OD1 3.43Å; R383-D385 IonicContact CZ-OD1 3.83Å; R383-D385 IonicContact CZ-OD2 2.87Å; R383-D385 IonicContact NE-OD1 2.74Å; R383-D385 VanDerWaalsContact NH1-CG 3.3Å; R383-D385 IonicContact NH1-OD1 2.89Å; R383-D385 PolarHBondContact NH1-OD1 2.87Å; R383-D385 IonicContact NH1-OD2 3.59Å; R383-D385 PolarHBondContact NH1-OD2 3.42Å; R383-D385 IonicContact NH2-OD2 2.64Å; R383-E386 HydrophobicContact CB-CB 4.49Å; R383-E386 HydrophobicContact CB-CG 4.03Å; R383-E386 IonicContact CZ-OE1 3.27Å; R383-E386 PolarHBondContact N-OE2 3.34Å; R383-E386 VanDerWaalsContact NE-CD 3.34Å; R383-E386 IonicContact NE-OE1 2.96Å; R383-E386 PolarHBondContact NE-OE1 3Å; R383-E386 IonicContact NH2-OE1 3.45Å; R383-E386 PolarHBondContact NH2-OE1 3.37Å; R383-R387 PolarHBondContact O-N 3.23Å |
| 384 | S | 90.9 | Very high | 91.5 | Very high | 47 Ų | 47 | 76.5 Ų | 76.5 | 33% | 0.329 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -73.4 | -32.7 | 178.5 | -171.6 | 0 | 0 | 0 | 0 | 112.3 | R387 K388 | S384-R387 PolarHBondContact O-N 3.4Å; S384-K388 WeakPolarHBondContact O-CB 3.24Å; S384-K388 WeakPolarHBondContact O-CG 3.35Å; S384-K388 PolarHBondContact O-N 3.1Å |
| 385 | D | 90.7 | Very high | 91.2 | Very high | 57 Ų | 57 | 81 Ų | 81 | 31% | 0.305 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -66.9 | -37.7 | 176 | 70.6 | -84.2 | 0 | 0 | 0 | 112.3 | R383 R387 K388 R389 | R383-D385 WeakPolarHBondContact CB-OD1 3.38Å; R383-D385 WeakPolarHBondContact CD-OD1 3.43Å; R383-D385 IonicContact CZ-OD1 3.83Å; R383-D385 IonicContact CZ-OD2 2.87Å; R383-D385 IonicContact NE-OD1 2.74Å; R383-D385 VanDerWaalsContact NH1-CG 3.3Å; R383-D385 IonicContact NH1-OD1 2.89Å; R383-D385 PolarHBondContact NH1-OD1 2.87Å; R383-D385 IonicContact NH1-OD2 3.59Å; R383-D385 PolarHBondContact NH1-OD2 3.42Å; R383-D385 IonicContact NH2-OD2 2.64Å; D385-R387 VanDerWaalsContact C-N 3.34Å; D385-K388 PolarHBondContact O-N 3.24Å; D385-R389 WeakPolarHBondContact O-CB 3.44Å; D385-R389 WeakPolarHBondContact O-CG 3.25Å; D385-R389 PolarHBondContact O-N 3.21Å; D385-R389 IonicContact OD2-CZ 2.75Å; D385-R389 IonicContact OD2-NE 2.68Å; D385-R389 PolarHBondContact OD2-NE 3.31Å; D385-R389 IonicContact OD2-NH2 3.7Å; D385-R389 PolarHBondContact OD2-NH2 3.21Å |
| 386 | E | 91.3 | Very high | 90.8 | Very high | 46 Ų | 46 | 82.2 Ų | 82.2 | 22% | 0.215 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.5 | -47.1 | 174.5 | -67.4 | 166.4 | 172.1 | 0 | 0 | 110.1 | F381 A382 R383 R389 H390 | F381-E386 HydrophobicContact CB-CB 4.02Å; F381-E386 HydrophobicContact CD1-CB 3.78Å; F381-E386 HydrophobicContact CG-CB 4.15Å; A382-E386 PolarHBondContact N-OE2 3.16Å; A382-E386 VanDerWaalsContact N-OE2 3.17Å; R383-E386 HydrophobicContact CB-CB 4.49Å; R383-E386 HydrophobicContact CB-CG 4.03Å; R383-E386 IonicContact CZ-OE1 3.27Å; R383-E386 PolarHBondContact N-OE2 3.34Å; R383-E386 VanDerWaalsContact NE-CD 3.34Å; R383-E386 IonicContact NE-OE1 2.96Å; R383-E386 PolarHBondContact NE-OE1 3Å; R383-E386 IonicContact NH2-OE1 3.45Å; R383-E386 PolarHBondContact NH2-OE1 3.37Å; E386-R389 PolarHBondContact O-N 3.28Å; E386-H390 WeakPolarHBondContact O-CB 3.25Å; E386-H390 PolarHBondContact O-N 3.03Å |
| 387 | R | 94.9 | Very high | 90.3 | Very high | 59 Ų | 59 | 82.8 Ų | 82.8 | 22% | 0.223 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 174.4 | -165.2 | -161.2 | 88.3 | 134.6 | 5.8 | 111.9 | F372 A373 C374 E375 F381 R383 S384 D385 R389 H390 T391 | F372-R387 HydrophobicContact CB-CB 4.16Å; A373-R387 VanDerWaalsContact O-CD 3.3Å; A373-R387 WeakPolarHBondContact O-CD 3.41Å; A373-R387 PolarHBondContact O-NH1 2.84Å; A373-R387 VanDerWaalsContact O-NH1 3.08Å; C374-R387 HydrophobicContact CB-CG 4.43Å; E375-R387 IonicContact OE1-CZ 3.26Å; E375-R387 VanDerWaalsContact OE1-CZ 3.26Å; E375-R387 IonicContact OE1-NH1 2.63Å; E375-R387 PolarHBondContact OE1-NH1 3.46Å; E375-R387 IonicContact OE1-NH2 2.99Å; E375-R387 PolarHBondContact OE1-NH2 3.16Å; F381-R387 HydrophobicContact CB-CB 4.37Å; F381-R387 HydrophobicContact CD2-CB 4.01Å; F381-R387 HydrophobicContact CD2-CG 4.07Å; F381-R387 HydrophobicContact CG-CB 4.35Å; R383-R387 PolarHBondContact O-N 3.23Å; S384-R387 PolarHBondContact O-N 3.4Å; D385-R387 VanDerWaalsContact C-N 3.34Å; R387-R389 PolarHBondContact O-N 3.47Å; R387-H390 PolarHBondContact O-N 2.8Å; R387-T391 PolarHBondContact O-N 3.32Å; R387-T391 PolarHBondContact O-OG1 2.97Å |
| 388 | K | 92.8 | Very high | 89.5 | Confident | 133 Ų | 133 | 87.3 Ų | 87.3 | 58% | 0.578 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -60.4 | -44.1 | 178.6 | -76.8 | 179.8 | 178.6 | -171.2 | 0 | 112 | S384 D385 T391 K392 | S384-K388 WeakPolarHBondContact O-CB 3.24Å; S384-K388 WeakPolarHBondContact O-CG 3.35Å; S384-K388 PolarHBondContact O-N 3.1Å; D385-K388 PolarHBondContact O-N 3.24Å; K388-T391 WeakPolarHBondContact CA-OG1 3.28Å; K388-T391 PolarHBondContact O-N 3.1Å; K388-T391 PolarHBondContact O-OG1 2.86Å; K388-K392 PolarHBondContact O-N 2.9Å |
| 389 | R | 92.5 | Very high | 88.8 | Confident | 143 Ų | 143 | 89.4 Ų | 89.4 | 54% | 0.54 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -64.5 | -40.1 | 174.6 | -73.9 | -177.9 | -69.5 | 128.2 | -2.7 | 111.4 | D385 E386 R387 K392 | D385-R389 WeakPolarHBondContact O-CB 3.44Å; D385-R389 WeakPolarHBondContact O-CG 3.25Å; D385-R389 PolarHBondContact O-N 3.21Å; D385-R389 IonicContact OD2-CZ 2.75Å; D385-R389 IonicContact OD2-NE 2.68Å; D385-R389 PolarHBondContact OD2-NE 3.31Å; D385-R389 IonicContact OD2-NH2 3.7Å; D385-R389 PolarHBondContact OD2-NH2 3.21Å; E386-R389 PolarHBondContact O-N 3.28Å; R387-R389 PolarHBondContact O-N 3.47Å; R389-K392 PolarHBondContact O-N 2.79Å |
| 390 | H | 93.7 | Very high | 87.9 | Confident | 23 Ų | 23 | 88.6 Ų | 88.6 | 11% | 0.106 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.2 | -40.6 | 174.2 | -177.2 | 59.4 | 0 | 0 | 0 | 113 | C377 F381 E386 R387 K392 I393 H394 | C377-H390 PolarHBondContact SG-NE2 3.41Å; F381-H390 HydrophobicContact CE1-CB 4.12Å; F381-H390 HydrophobicContact CE2-CB 3.95Å; F381-H390 AromaticContact CE2-CD2 3.5Å; F381-H390 VanDerWaalsContact CE2-CD2 3.5Å; F381-H390 WeakPolarHBondContact CE2-CD2 3.5Å; F381-H390 AromaticContact CE2-CG 3.85Å; F381-H390 HydrophobicContact CZ-CB 3.51Å; F381-H390 AromaticContact CZ-CD2 3.42Å; F381-H390 VanDerWaalsContact CZ-CD2 3.42Å; F381-H390 WeakPolarHBondContact CZ-CD2 3.37Å; F381-H390 AromaticContact CZ-CG 3.36Å; E386-H390 WeakPolarHBondContact O-CB 3.25Å; E386-H390 PolarHBondContact O-N 3.03Å; R387-H390 PolarHBondContact O-N 2.8Å; H390-K392 VanDerWaalsContact C-N 3.26Å; H390-K392 PolarHBondContact O-N 3.33Å; H390-I393 VanDerWaalsContact O-CB 3.27Å; H390-I393 WeakPolarHBondContact O-CB 3.47Å; H390-I393 PolarHBondContact O-N 3.23Å; H390-H394 AromaticContact CD2-NE2 3.65Å; H390-H394 AromaticContact CE1-NE2 3.5Å; H390-H394 PolarHBondContact CE1-NE2 3.12Å; H390-H394 AromaticContact NE2-CD2 3.89Å; H390-H394 AromaticContact NE2-CE1 3.9Å; H390-H394 AromaticContact NE2-NE2 3Å; H390-H394 PolarHBondContact NE2-NE2 3.49Å |
| 391 | T | 91.6 | Very high | 86.8 | Confident | 29 Ų | 29 | 90 Ų | 90 | 18% | 0.178 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -61.2 | -33.2 | 175.8 | 42.2 | 0 | 0 | 0 | 0 | 112.7 | R387 K388 I393 H394 L395 | R387-T391 PolarHBondContact O-N 3.32Å; R387-T391 PolarHBondContact O-OG1 2.97Å; K388-T391 WeakPolarHBondContact CA-OG1 3.28Å; K388-T391 PolarHBondContact O-N 3.1Å; K388-T391 PolarHBondContact O-OG1 2.86Å; T391-I393 PolarHBondContact O-N 2.88Å; T391-H394 PolarHBondContact O-N 2.85Å; T391-H394 VanDerWaalsContact O-N 3.11Å; T391-L395 WeakPolarHBondContact O-CD1 3.41Å; T391-L395 PolarHBondContact O-N 2.87Å |
| 392 | K | 92.8 | Very high | 85.7 | Confident | 148 Ų | 148 | 91.5 Ų | 91.5 | 64% | 0.643 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -61.3 | -24.1 | 172.7 | -69.8 | -171.4 | 175.5 | -169.1 | 0 | 113.4 | K388 R389 H390 R396 | K388-K392 PolarHBondContact O-N 2.9Å; R389-K392 PolarHBondContact O-N 2.79Å; H390-K392 VanDerWaalsContact C-N 3.26Å; H390-K392 PolarHBondContact O-N 3.33Å; K392-R396 WeakPolarHBondContact O-CG 3.15Å; K392-R396 PolarHBondContact O-N 3.12Å; K392-R396 VanDerWaalsContact O-N 3.17Å |
| 393 | I | 91.2 | Very high | 84.6 | Confident | 83 Ų | 83 | 97.2 Ų | 97.2 | 43% | 0.426 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -69 | -43.4 | 174.7 | -53.8 | 177.5 | 0 | 0 | 0 | 110 | H390 T391 L395 R396 Q397 | H390-I393 VanDerWaalsContact O-CB 3.27Å; H390-I393 WeakPolarHBondContact O-CB 3.47Å; H390-I393 PolarHBondContact O-N 3.23Å; T391-I393 PolarHBondContact O-N 2.88Å; I393-L395 PolarHBondContact O-N 2.94Å; I393-R396 PolarHBondContact O-N 2.64Å; I393-Q397 WeakPolarHBondContact O-CG 3.48Å; I393-Q397 PolarHBondContact O-N 2.94Å |
| 394 | H | 88.8 | Confident | 83.3 | Confident | 32 Ų | 32 | 101.5 Ų | 101.5 | 15% | 0.148 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -65.6 | -35.9 | 177.7 | -65.1 | -61.2 | 0 | 0 | 0 | 112.7 | I376 C377 H390 T391 Q397 K398 | I376-H394 HydrophobicContact CB-CB 4.45Å; I376-H394 HydrophobicContact CD1-CB 3.54Å; I376-H394 HydrophobicContact CG2-CB 4.02Å; C377-H394 PolarHBondContact SG-NE2 3.02Å; C377-H394 VanDerWaalsContact SG-NE2 3.36Å; H390-H394 AromaticContact CD2-NE2 3.65Å; H390-H394 AromaticContact CE1-NE2 3.5Å; H390-H394 PolarHBondContact CE1-NE2 3.12Å; H390-H394 AromaticContact NE2-CD2 3.89Å; H390-H394 AromaticContact NE2-CE1 3.9Å; H390-H394 AromaticContact NE2-NE2 3Å; H390-H394 PolarHBondContact NE2-NE2 3.49Å; T391-H394 PolarHBondContact O-N 2.85Å; T391-H394 VanDerWaalsContact O-N 3.11Å; H394-Q397 PolarHBondContact O-N 2.85Å; H394-K398 WeakPolarHBondContact O-CB 3.48Å; H394-K398 PolarHBondContact O-N 3Å |
| 395 | L | 86.4 | Confident | 81.9 | Confident | 96 Ų | 96 | 102 Ų | 102 | 50% | 0.503 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.9 | -56.9 | 170.7 | -83.6 | 75.3 | 0 | 0 | 0 | 110 | T391 I393 Q397 K398 D399 | T391-L395 WeakPolarHBondContact O-CD1 3.41Å; T391-L395 PolarHBondContact O-N 2.87Å; I393-L395 PolarHBondContact O-N 2.94Å; L395-Q397 PolarHBondContact O-N 2.85Å; L395-K398 WeakPolarHBondContact O-CA 3.12Å; L395-K398 VanDerWaalsContact O-CB 3.31Å; L395-K398 WeakPolarHBondContact O-CB 3.12Å; L395-K398 PolarHBondContact O-N 2.81Å; L395-D399 VanDerWaalsContact C-OD2 3.27Å; L395-D399 PolarHBondContact O-N 3.48Å |
| 396 | R | 82.8 | Confident | 80.4 | Confident | 184 Ų | 184 | 101.3 Ų | 101.3 | 69% | 0.694 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -58.2 | -25.4 | 179.1 | -65.6 | 176.9 | 81.2 | -167.6 | 8.1 | 114 | K392 I393 D399 K400 | K392-R396 WeakPolarHBondContact O-CG 3.15Å; K392-R396 PolarHBondContact O-N 3.12Å; K392-R396 VanDerWaalsContact O-N 3.17Å; I393-R396 PolarHBondContact O-N 2.64Å; R396-D399 WeakPolarHBondContact CA-OD2 2.98Å; R396-K400 WeakPolarHBondContact O-CG 3.36Å; R396-K400 PolarHBondContact O-N 3.36Å |
| 397 | Q | 80.5 | Confident | 78.7 | Confident | 115 Ų | 115 | 102.9 Ų | 102.9 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -78.8 | -37.3 | 172.1 | -74.9 | 177.1 | -15.1 | 0 | 0 | 112.9 | I393 H394 L395 K401 | I393-Q397 WeakPolarHBondContact O-CG 3.48Å; I393-Q397 PolarHBondContact O-N 2.94Å; H394-Q397 PolarHBondContact O-N 2.85Å; L395-Q397 PolarHBondContact O-N 2.85Å; Q397-K401 WeakPolarHBondContact O-CB 3.39Å; Q397-K401 PolarHBondContact O-N 3.48Å; Q397-K401 VanDerWaalsContact O-N 3.1Å |
| 398 | K | 75.4 | Confident | 76.8 | Confident | 158 Ų | 158 | 103.9 Ų | 103.9 | 69% | 0.687 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62 | -45.9 | 171.3 | -173.4 | -172.3 | 177.9 | -171 | 0 | 110.6 | H394 L395 K401 A402 | H394-K398 WeakPolarHBondContact O-CB 3.48Å; H394-K398 PolarHBondContact O-N 3Å; L395-K398 WeakPolarHBondContact O-CA 3.12Å; L395-K398 VanDerWaalsContact O-CB 3.31Å; L395-K398 WeakPolarHBondContact O-CB 3.12Å; L395-K398 PolarHBondContact O-N 2.81Å; K398-K401 PolarHBondContact O-N 3.34Å; K398-K401 VanDerWaalsContact O-N 3.13Å; K398-A402 PolarHBondContact O-N 3.16Å |
| 399 | D | 74.6 | Confident | 75 | Confident | 91 Ų | 91 | 102.7 Ų | 102.7 | 49% | 0.487 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.2 | -50.6 | -178 | -51 | -30.3 | 0 | 0 | 0 | 110.5 | L395 R396 K401 A402 E403 | L395-D399 VanDerWaalsContact C-OD2 3.27Å; L395-D399 PolarHBondContact O-N 3.48Å; R396-D399 WeakPolarHBondContact CA-OD2 2.98Å; D399-K401 VanDerWaalsContact C-N 3.26Å; D399-K401 PolarHBondContact O-N 3.45Å; D399-A402 WeakPolarHBondContact O-CB 3.44Å; D399-A402 PolarHBondContact O-N 2.93Å; D399-A402 VanDerWaalsContact O-N 3.08Å; D399-E403 PolarHBondContact O-N 3.17Å |
| 400 | K | 73.5 | Confident | 73.1 | Confident | 144 Ų | 144 | 102 Ų | 102 | 63% | 0.626 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -61.1 | -29.5 | 174.1 | -74.7 | -171.8 | 172.8 | -153.4 | 0 | 114.2 | R396 K404 | R396-K400 WeakPolarHBondContact O-CG 3.36Å; R396-K400 PolarHBondContact O-N 3.36Å; K400-K404 WeakPolarHBondContact O-CB 3.4Å; K400-K404 PolarHBondContact O-N 3.43Å |
| 401 | K | 70.4 | Confident | 71.1 | Confident | 168 Ų | 168 | 107.4 Ų | 107.4 | 73% | 0.73 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -75.4 | -33.9 | 174.9 | -170.3 | 176.3 | 179.3 | -177.8 | 0 | 111.6 | Q397 K398 D399 A405 | Q397-K401 WeakPolarHBondContact O-CB 3.39Å; Q397-K401 PolarHBondContact O-N 3.48Å; Q397-K401 VanDerWaalsContact O-N 3.1Å; K398-K401 PolarHBondContact O-N 3.34Å; K398-K401 VanDerWaalsContact O-N 3.13Å; D399-K401 VanDerWaalsContact C-N 3.26Å; D399-K401 PolarHBondContact O-N 3.45Å; K401-A405 WeakPolarHBondContact O-CB 3.48Å; K401-A405 PolarHBondContact O-N 2.8Å |
| 402 | A | 67.6 | Low | 69.1 | Low | 63 Ų | 63 | 110.8 Ų | 110.8 | 52% | 0.521 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -70.5 | -43.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | K398 D399 K404 A405 G406 | K398-A402 PolarHBondContact O-N 3.16Å; D399-A402 WeakPolarHBondContact O-CB 3.44Å; D399-A402 PolarHBondContact O-N 2.93Å; D399-A402 VanDerWaalsContact O-N 3.08Å; A402-K404 PolarHBondContact O-N 3.11Å; A402-A405 WeakPolarHBondContact O-CB 3.16Å; A402-A405 PolarHBondContact O-N 2.94Å; A402-A405 VanDerWaalsContact O-N 3.07Å; A402-G406 PolarHBondContact O-N 3.23Å |
| 403 | E | 64.7 | Low | 66.6 | Low | 137 Ų | 137 | 108.3 Ų | 108.3 | 64% | 0.64 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -54.6 | -51.7 | 174 | -175 | -172.9 | 175.8 | 0 | 0 | 111.6 | D399 A405 G406 A407 | D399-E403 PolarHBondContact O-N 3.17Å; E403-A405 PolarHBondContact O-N 3.23Å; E403-G406 PolarHBondContact O-N 3.28Å; E403-A407 PolarHBondContact O-N 3.46Å |
| 404 | K | 62.9 | Low | 64.7 | Low | 176 Ų | 176 | 110.7 Ų | 110.7 | 77% | 0.765 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -66.4 | -20.3 | 177.1 | -171.7 | 166.6 | -178.1 | 174.6 | 0 | 113.8 | K400 A402 | K400-K404 WeakPolarHBondContact O-CB 3.4Å; K400-K404 PolarHBondContact O-N 3.43Å; A402-K404 PolarHBondContact O-N 3.11Å |
| 405 | A | 61.3 | Low | 62.6 | Low | 58 Ų | 58 | 114.1 Ų | 114.1 | 48% | 0.479 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -82.1 | -40.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112 | K401 A402 E403 A407 A408 | K401-A405 WeakPolarHBondContact O-CB 3.48Å; K401-A405 PolarHBondContact O-N 2.8Å; A402-A405 WeakPolarHBondContact O-CB 3.16Å; A402-A405 PolarHBondContact O-N 2.94Å; A402-A405 VanDerWaalsContact O-N 3.07Å; E403-A405 PolarHBondContact O-N 3.23Å; A405-A407 VanDerWaalsContact C-N 3.35Å; A405-A407 PolarHBondContact O-N 3.4Å; A405-A408 PolarHBondContact O-N 3.22Å |
| 406 | G | 58.3 | Low | 60.5 | Low | 41 Ų | 41 | 115.1 Ų | 115.1 | 42% | 0.423 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -63.4 | -38.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | A402 E403 A408 V409 | A402-G406 PolarHBondContact O-N 3.23Å; E403-G406 PolarHBondContact O-N 3.28Å; G406-A408 PolarHBondContact O-N 3.46Å; G406-V409 PolarHBondContact O-N 3.22Å; G406-V409 VanDerWaalsContact O-N 3.13Å |
| 407 | A | 56.8 | Low | 58.5 | Low | 79 Ų | 79 | 111.6 Ų | 111.6 | 65% | 0.653 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | -15.7 | 176 | 0 | 0 | 0 | 0 | 0 | 114.5 | E403 A405 | E403-A407 PolarHBondContact O-N 3.46Å; A405-A407 VanDerWaalsContact C-N 3.35Å; A405-A407 PolarHBondContact O-N 3.4Å |
| 408 | A | 54.8 | Low | 56.3 | Low | 81 Ų | 81 | 110.2 Ų | 110.2 | 67% | 0.669 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | -6.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | A405 G406 | A405-A408 PolarHBondContact O-N 3.22Å; G406-A408 PolarHBondContact O-N 3.46Å |
| 409 | V | 54.4 | Low | 54.4 | Low | 107 Ų | 107 | 108.2 Ų | 108.2 | 65% | 0.648 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.4 | -12.9 | -168.3 | 179.6 | 0 | 0 | 0 | 0 | 113.4 | G406 T411 | G406-V409 PolarHBondContact O-N 3.22Å; G406-V409 VanDerWaalsContact O-N 3.13Å; V409-T411 PolarHBondContact O-N 3.34Å |
| 410 | V | 53 | Low | 53.5 | Low | 128 Ų | 128 | 109.5 Ų | 109.5 | 78% | 0.776 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -80.8 | -15.9 | -173.1 | -174.9 | 0 | 0 | 0 | 0 | 113.2 | S412 | V410-S412 PolarHBondContact O-N 2.59Š|
| 411 | T | 51.3 | Low | 51.6 | Low | 137 Ų | 137 | 107.6 Ų | 107.6 | 84% | 0.84 | 72% | 0.719 | S | S | * | * | trans | -97.9 | 58.1 | -175.3 | -40 | 0 | 0 | 0 | 0 | 113.2 | V409 | V409-T411 PolarHBondContact O-N 3.34Š| ||
| 412 | S | 49.3 | Very low | 49.8 | Very low | 101 Ų | 101 | 105.1 Ų | 105.1 | 71% | 0.706 | 72% | 0.723 | S | S | * | * | trans | -144.1 | 72.3 | 167.5 | 64.9 | 0 | 0 | 0 | 0 | 112 | V410 | V410-S412 PolarHBondContact O-N 2.59Š| ||
| 413 | A | 41.3 | Very low | 48.3 | Very low | 96 Ų | 96 | 106 Ų | 106 | 79% | 0.793 | 73% | 0.726 | S | S | * | * | trans | -72.6 | 144.9 | 163.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 414 | P | 50.1 | Low | 47 | Very low | 132 Ų | 132 | 109.9 Ų | 109.9 | 86% | 0.857 | 74% | 0.736 | S | S | * | * | trans | -75.7 | 155.1 | -179.2 | 31.8 | -35.6 | 0 | 0 | 0 | 112.5 | ||||
| 415 | A | 45.3 | Very low | 46.5 | Very low | 104 Ų | 104 | 107 Ų | 107 | 86% | 0.86 | 74% | 0.735 | S | S | * | * | trans | -106.3 | 127.9 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 416 | S | 41.3 | Very low | 45.4 | Very low | 117 Ų | 117 | 109.6 Ų | 109.6 | 82% | 0.818 | 75% | 0.75 | S | S | * | * | trans | -166.9 | 144.8 | 164.6 | 45.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 417 | S | 40.9 | Very low | 45.1 | Very low | 110 Ų | 110 | 113.6 Ų | 113.6 | 77% | 0.769 | 77% | 0.768 | S | S | * | * | cis | -157.3 | 143.4 | 3.9 | 50.2 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 418 | A | 34.9 | Very low | 44.2 | Very low | 87 Ų | 87 | 117.2 Ų | 117.2 | 72% | 0.719 | 78% | 0.775 | S | S | * | * | trans | 50.2 | 111.3 | 144.7 | 0 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 419 | S | 35.3 | Very low | 43.1 | Very low | 115 Ų | 115 | 120.4 Ų | 120.4 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | 64.7 | 161.5 | 118.9 | -62.7 | 0 | 0 | 0 | 0 | 123 | |||||
| 420 | P | 55.1 | Low | 42.2 | Very low | 119 Ų | 119 | 119.3 Ų | 119.3 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | cis | -135.5 | 158.8 | -16.6 | 32 | -11.6 | 0 | 0 | 0 | 117.8 | ||||
| 421 | A | 34 | Very low | 41.4 | Very low | 103 Ų | 103 | 123.6 Ų | 123.6 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | 33.2 | 123.4 | 141.5 | 0 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 422 | S | 33.2 | Very low | 41.3 | Very low | 116 Ų | 116 | 122.4 Ų | 122.4 | 81% | 0.811 | 78% | 0.782 | S | S | * | * | trans | -171.1 | 166.1 | 138.1 | -173.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 423 | S | 35.3 | Very low | 40.8 | Very low | 83 Ų | 83 | 123.1 Ų | 123.1 | 58% | 0.58 | 79% | 0.787 | S | S | * | * | -165 | 159.3 | -72.3 | 54.8 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 424 | Y | 38.7 | Very low | 41.3 | Very low | 217 Ų | 217 | 124.4 Ų | 124.4 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | trans | 69.2 | 164.9 | 177.7 | -60.1 | -78.5 | 0 | 0 | 0 | 116.3 | ||||
| 425 | P | 50.9 | Low | 40.9 | Very low | 116 Ų | 116 | 124.7 Ų | 124.7 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | -135.5 | 165.7 | -83.3 | 35.5 | -15.4 | 0 | 0 | 0 | 115.9 | |||||
| 426 | S | 39.3 | Very low | 40.2 | Very low | 112 Ų | 112 | 124.7 Ų | 124.7 | 78% | 0.783 | 78% | 0.78 | S | S | * | * | trans | -84.1 | 151 | 173.9 | -40 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 427 | P | 51.4 | Low | 40.1 | Very low | 126 Ų | 126 | 124 Ų | 124 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -94.9 | 158.9 | 148.4 | 35.3 | -29.9 | 0 | 0 | 0 | 111.6 | ||||
| 428 | I | 37.2 | Very low | 39.9 | Very low | 155 Ų | 155 | 128.9 Ų | 128.9 | 80% | 0.795 | 78% | 0.778 | S | S | * | * | trans | -114.6 | 133.7 | 179.9 | -61.3 | 164.4 | 0 | 0 | 0 | 109.7 | ||||
| 429 | T | 33.3 | Very low | 40.5 | Very low | 147 Ų | 147 | 130 Ų | 130 | 90% | 0.902 | 78% | 0.778 | S | S | * | * | trans | -141.5 | 157.9 | 158.5 | 25.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 430 | S | 35.5 | Very low | 40.8 | Very low | 85 Ų | 85 | 129.7 Ų | 129.7 | 59% | 0.594 | 78% | 0.776 | S | S | * | * | trans | -141.9 | 159.1 | -150.6 | 50.8 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 431 | Y | 35.7 | Very low | 40.5 | Very low | 217 Ų | 217 | 130.1 Ų | 130.1 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | trans | 68.7 | 161.9 | 171 | -57.4 | -72.4 | 0 | 0 | 0 | 117.1 | ||||
| 432 | P | 49.2 | Very low | 40.5 | Very low | 113 Ų | 113 | 131.6 Ų | 131.6 | 73% | 0.734 | 78% | 0.777 | S | S | * | * | cis | -129.2 | 168.6 | -41.9 | 35.5 | -21.9 | 0 | 0 | 0 | 112.8 | ||||
| 433 | S | 39.7 | Very low | 40.9 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 80% | 0.804 | 78% | 0.776 | S | S | * | * | trans | -68 | 157.2 | 165.2 | -47.3 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 434 | P | 50.2 | Low | 40.6 | Very low | 124 Ų | 124 | 133.8 Ų | 133.8 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | -130.7 | 156.5 | 124.9 | 36.9 | -30.6 | 0 | 0 | 0 | 113.9 | |||||
| 435 | V | 42.5 | Very low | 40.2 | Very low | 137 Ų | 137 | 129 Ų | 129 | 83% | 0.83 | 78% | 0.784 | S | S | * | * | trans | -79.3 | 143.1 | 170.9 | -177.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 436 | S | 29.9 | Very low | 39.3 | Very low | 105 Ų | 105 | 134.3 Ų | 134.3 | 73% | 0.734 | 79% | 0.791 | S | S | * | * | trans | -147.9 | 115.3 | 159 | -164 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 437 | S | 39.9 | Very low | 38.9 | Very low | 102 Ų | 102 | 134.1 Ų | 134.1 | 71% | 0.713 | 79% | 0.789 | S | S | * | * | trans | -108.5 | 121 | 172.6 | 53.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 438 | Y | 37.4 | Very low | 38.1 | Very low | 213 Ų | 213 | 133.3 Ų | 133.3 | 84% | 0.835 | 79% | 0.786 | S | S | * | * | trans | -150.1 | 164.9 | 178.5 | -95.9 | -51.9 | 0 | 0 | 0 | 111.3 | ||||
| 439 | P | 47.5 | Very low | 38.5 | Very low | 109 Ų | 109 | 132.1 Ų | 132.1 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | -127.5 | 179.7 | -119.1 | 43.1 | -29 | 0 | 0 | 0 | 115.1 | |||||
| 440 | S | 40.4 | Very low | 38.4 | Very low | 110 Ų | 110 | 131.1 Ų | 131.1 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | trans | -64.2 | 137 | 163.7 | -48.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 441 | P | 49.4 | Very low | 38.4 | Very low | 128 Ų | 128 | 135 Ų | 135 | 83% | 0.831 | 79% | 0.791 | S | S | * | * | trans | -81.2 | 155.3 | 163.7 | 33.7 | -33 | 0 | 0 | 0 | 111.4 | ||||
| 442 | V | 34.2 | Very low | 38 | Very low | 133 Ų | 133 | 131.4 Ų | 131.4 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | -108.1 | 166.9 | 178.1 | -154.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 443 | T | 40.6 | Very low | 37.1 | Very low | 129 Ų | 129 | 129.9 Ų | 129.9 | 79% | 0.791 | 78% | 0.783 | S | S | * | * | trans | -37.7 | 141 | 176.3 | 50.9 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 444 | S | 29.2 | Very low | 36.7 | Very low | 117 Ų | 117 | 135 Ų | 135 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -138.7 | 138.6 | 149.7 | -172.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 445 | C | 31.7 | Very low | 36.4 | Very low | 116 Ų | 116 | 134 Ų | 134 | 78% | 0.784 | 78% | 0.78 | S | S | * | * | trans | -98.2 | 144.9 | 176.7 | -57.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 446 | Y | 31.7 | Very low | 36.1 | Very low | 228 Ų | 228 | 132.9 Ų | 132.9 | 89% | 0.894 | 78% | 0.778 | S | S | * | * | trans | -141.9 | 144.1 | 162.2 | -131.9 | -92.3 | 0 | 0 | 0 | 112.3 | ||||
| 447 | S | 31.3 | Very low | 36.9 | Very low | 108 Ų | 108 | 133.3 Ų | 133.3 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -90.4 | 149.1 | -166.6 | -54 | 0 | 0 | 0 | 0 | 113.2 | ||
| 448 | S | 33.4 | Very low | 36.5 | Very low | 108 Ų | 108 | 134.2 Ų | 134.2 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 140.1 | 167.5 | -53.5 | 0 | 0 | 0 | 0 | 111.6 | ||
| 449 | P | 45.9 | Very low | 36.4 | Very low | 131 Ų | 131 | 130.5 Ų | 130.5 | 85% | 0.851 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 165 | 171.6 | 32.4 | -35 | 0 | 0 | 0 | 112.4 | ||
| 450 | V | 32 | Very low | 35.7 | Very low | 125 Ų | 125 | 129.5 Ų | 129.5 | 76% | 0.758 | 79% | 0.785 | S | S | * | * | trans | -128.4 | 132.8 | -166.2 | 164 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 451 | H | 33.8 | Very low | 35.2 | Very low | 168 Ų | 168 | 131 Ų | 131 | 78% | 0.778 | 79% | 0.79 | S | S | * | * | trans | 51.5 | 129.4 | 160 | -89.7 | -116.8 | 0 | 0 | 0 | 122.4 | ||||
| 452 | T | 28.6 | Very low | 34.5 | Very low | 140 Ų | 140 | 129.6 Ų | 129.6 | 86% | 0.859 | 78% | 0.779 | S | S | * | * | -171.6 | 169.9 | 128.6 | 19.4 | 0 | 0 | 0 | 0 | 109 | |||||
| 453 | S | 30.5 | Very low | 34.4 | Very low | 81 Ų | 81 | 133.4 Ų | 133.4 | 57% | 0.566 | 78% | 0.78 | S | S | * | * | -158.1 | 141.8 | -93.6 | 51.4 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 454 | Y | 31.4 | Very low | 34.8 | Very low | 223 Ų | 223 | 132.9 Ų | 132.9 | 88% | 0.875 | 78% | 0.779 | S | S | * | * | trans | 66.3 | 170.8 | 168.9 | -64.1 | -68.8 | 0 | 0 | 0 | 117.1 | ||||
| 455 | P | 43.7 | Very low | 35.1 | Very low | 103 Ų | 103 | 133.4 Ų | 133.4 | 67% | 0.669 | 78% | 0.783 | S | S | * | * | -137.9 | 168.9 | -51.7 | 38.7 | -24.5 | 0 | 0 | 0 | 115.4 | |||||
| 456 | S | 34.8 | Very low | 35.2 | Very low | 114 Ų | 114 | 132.9 Ų | 132.9 | 80% | 0.797 | 79% | 0.787 | S | S | * | * | trans | 69.4 | 168.4 | 149.3 | -81.6 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 457 | P | 46.7 | Very low | 35.4 | Very low | 114 Ų | 114 | 126.9 Ų | 126.9 | 74% | 0.74 | 78% | 0.778 | S | S | * | * | cis | -123.2 | 159.7 | 10.1 | 41.2 | -27.7 | 0 | 0 | 0 | 117.4 | ||||
| 458 | S | 31.7 | Very low | 35.5 | Very low | 121 Ų | 121 | 130.7 Ų | 130.7 | 85% | 0.846 | 79% | 0.786 | S | S | * | * | trans | -89.4 | 146.4 | 159.1 | -52.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 459 | V | 36 | Very low | 35.5 | Very low | 135 Ų | 135 | 130.7 Ų | 130.7 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -123.3 | 137.1 | 167.9 | 179 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 460 | A | 32.9 | Very low | 35 | Very low | 88 Ų | 88 | 131.6 Ų | 131.6 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | trans | -123.2 | 147.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 461 | T | 30.3 | Very low | 35 | Very low | 141 Ų | 141 | 131.3 Ų | 131.3 | 87% | 0.865 | 79% | 0.789 | S | S | * | * | trans | -139 | 148.7 | 169.6 | -45.4 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 462 | T | 34.5 | Very low | 34.8 | Very low | 99 Ų | 99 | 133.1 Ų | 133.1 | 61% | 0.607 | 79% | 0.794 | S | S | * | * | trans | -138.7 | 162.9 | -153.5 | -41 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 463 | Y | 32.3 | Very low | 35.1 | Very low | 213 Ų | 213 | 134.1 Ų | 134.1 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | trans | 79.3 | 159.2 | 164 | -58.8 | -67.2 | 0 | 0 | 0 | 118.4 | ||||
| 464 | P | 48.1 | Very low | 35.3 | Very low | 117 Ų | 117 | 134.4 Ų | 134.4 | 76% | 0.76 | 79% | 0.792 | S | S | * | * | cis | -128.8 | 159.3 | -23.8 | 26.9 | -7.9 | 0 | 0 | 0 | 114.3 | ||||
| 465 | S | 36.4 | Very low | 35.6 | Very low | 129 Ų | 129 | 132.2 Ų | 132.2 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | trans | -91 | 137.5 | 159.6 | -57.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 466 | A | 33.3 | Very low | 35 | Very low | 105 Ų | 105 | 134.3 Ų | 134.3 | 87% | 0.868 | 79% | 0.793 | S | S | * | * | trans | -118.7 | 130.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 467 | S | 35.3 | Very low | 34.8 | Very low | 102 Ų | 102 | 132.9 Ų | 132.9 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | trans | -99 | 150 | 172.2 | 51.3 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 468 | M | 33.6 | Very low | 34.1 | Very low | 187 Ų | 187 | 134 Ų | 134 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -141.1 | 130 | 159.6 | -87.5 | -67.6 | 107 | 0 | 0 | 108.5 | ||||
| 469 | S | 34 | Very low | 34 | Very low | 108 Ų | 108 | 133.4 Ų | 133.4 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | trans | -111.1 | 141.5 | 175.7 | -56.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 470 | T | 34.5 | Very low | 33.8 | Very low | 150 Ų | 150 | 136.7 Ų | 136.7 | 92% | 0.92 | 79% | 0.792 | S | S | * | * | trans | -134.6 | 127 | 157.9 | 38.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 471 | T | 33.2 | Very low | 34.7 | Very low | 120 Ų | 120 | 137.6 Ų | 137.6 | 74% | 0.736 | 79% | 0.791 | S | S | * | * | trans | -104 | 140.5 | 174.6 | -56.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 472 | F | 29.2 | Very low | 34.8 | Very low | 205 Ų | 205 | 135.8 Ų | 135.8 | 90% | 0.899 | 78% | 0.784 | S | S | * | * | trans | -151.8 | 163.9 | 146.9 | -133 | -92.1 | 0 | 0 | 0 | 112.3 | ||||
| 473 | Q | 34.8 | Very low | 34.8 | Very low | 161 Ų | 161 | 136.6 Ų | 136.6 | 75% | 0.752 | 79% | 0.794 | S | S | * | * | trans | -115.4 | 163.5 | -163.8 | -74.1 | -177.5 | -55.5 | 0 | 0 | 115.5 | ||||
| 474 | S | 34.2 | Very low | 34.9 | Very low | 88 Ų | 88 | 133 Ų | 133 | 62% | 0.615 | 79% | 0.794 | S | S | * | * | trans | 68.5 | 121.2 | 139 | 62.2 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 475 | Q | 37.5 | Very low | 34.2 | Very low | 176 Ų | 176 | 131.3 Ų | 131.3 | 82% | 0.822 | 79% | 0.79 | S | S | * | * | -174.5 | 124.8 | 119.5 | -93.8 | 151.5 | 69.5 | 0 | 0 | 107.5 | |||||
| 476 | I | 31.5 | Very low | 34.1 | Very low | 148 Ų | 148 | 130.1 Ų | 130.1 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | 62.4 | 91.1 | 68.4 | -58.3 | 173.6 | 0 | 0 | 0 | 109.9 | |||||
| 477 | A | 30.9 | Very low | 34.1 | Very low | 83 Ų | 83 | 132.7 Ų | 132.7 | 69% | 0.686 | 78% | 0.78 | S | S | * | * | 58.1 | 111 | 86.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 478 | T | 31.1 | Very low | 34.1 | Very low | 139 Ų | 139 | 134.6 Ų | 134.6 | 85% | 0.853 | 78% | 0.781 | S | S | * | * | -171.2 | 177.5 | 73.4 | 43.3 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 479 | S | 29.5 | Very low | 34.1 | Very low | 107 Ų | 107 | 136.4 Ų | 136.4 | 75% | 0.748 | 78% | 0.779 | S | S | * | * | cis | -169.6 | 175.7 | 38.3 | 54.5 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 480 | F | 33.2 | Very low | 34.1 | Very low | 204 Ų | 204 | 136.3 Ų | 136.3 | 90% | 0.895 | 78% | 0.779 | S | S | * | * | trans | -110.9 | -175.2 | 166.1 | -85.3 | -84.6 | 0 | 0 | 0 | 109 | ||||
| 481 | P | 51.3 | Low | 34 | Very low | 107 Ų | 107 | 134.7 Ų | 134.7 | 70% | 0.695 | 77% | 0.773 | S | S | * | * | cis | -130.8 | 175.8 | -11.7 | 33.7 | -15 | 0 | 0 | 0 | 115 | ||||
| 482 | S | 33 | Very low | 34.7 | Very low | 104 Ų | 104 | 135.3 Ų | 135.3 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | 157.5 | 118.8 | 118.2 | -69.2 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 483 | S | 34.6 | Very low | 34.9 | Very low | 115 Ų | 115 | 131.8 Ų | 131.8 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | trans | 30.4 | 129.7 | 132.2 | -47.8 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 484 | V | 33.7 | Very low | 35.5 | Very low | 139 Ų | 139 | 129.9 Ų | 129.9 | 84% | 0.842 | 78% | 0.776 | S | S | * | * | -176.9 | 142.3 | 109.4 | 145.8 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 485 | A | 33.5 | Very low | 35.5 | Very low | 81 Ų | 81 | 131.9 Ų | 131.9 | 67% | 0.669 | 79% | 0.785 | S | S | * | * | trans | 52.6 | 106 | 160.4 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 486 | S | 35.1 | Very low | 36.2 | Very low | 103 Ų | 103 | 128.7 Ų | 128.7 | 72% | 0.72 | 78% | 0.779 | S | S | * | * | 44.5 | 116.2 | 119 | -47.2 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 487 | N | 32.9 | Very low | 36 | Very low | 159 Ų | 159 | 129.4 Ų | 129.4 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | -167.9 | 159.4 | 91.5 | -101.6 | -40.4 | 0 | 0 | 0 | 115.7 | |||||
| 488 | I | 34.1 | Very low | 36.2 | Very low | 142 Ų | 142 | 130.5 Ų | 130.5 | 73% | 0.728 | 79% | 0.786 | S | S | * | * | trans | -74.4 | 131.4 | -171 | -62.8 | 155.1 | 0 | 0 | 0 | 112.5 | ||||
| 489 | Y | 35 | Very low | 36.3 | Very low | 226 Ų | 226 | 131 Ų | 131 | 89% | 0.886 | 78% | 0.784 | S | S | * | * | -165.2 | 142.6 | 120.8 | -122.1 | -87.4 | 0 | 0 | 0 | 111.5 | |||||
| 490 | S | 33 | Very low | 36.5 | Very low | 106 Ų | 106 | 134.3 Ų | 134.3 | 74% | 0.741 | 79% | 0.79 | S | S | * | * | trans | -100.3 | 134 | -168.4 | -56.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 491 | S | 33.2 | Very low | 36.8 | Very low | 115 Ų | 115 | 133.4 Ų | 133.4 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -151.5 | 129 | 158.5 | -83.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 492 | P | 47.1 | Very low | 35.8 | Very low | 133 Ų | 133 | 134.8 Ų | 134.8 | 86% | 0.864 | 80% | 0.795 | S | S | * | * | trans | -85 | 141.9 | -175.9 | 32.7 | -34.1 | 0 | 0 | 0 | 113.3 | ||||
| 493 | V | 34.1 | Very low | 36.1 | Very low | 132 Ų | 132 | 136.1 Ų | 136.1 | 80% | 0.8 | 80% | 0.799 | S | S | * | * | trans | -109.6 | 137.5 | 168.9 | 175.8 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 494 | P | 47 | Very low | 36 | Very low | 120 Ų | 120 | 139.1 Ų | 139.1 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | trans | -89.4 | 142.3 | -169.5 | 33.9 | -35.6 | 0 | 0 | 0 | 114.5 | ||||
| 495 | T | 33.9 | Very low | 35.8 | Very low | 131 Ų | 131 | 137.7 Ų | 137.7 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | -144.9 | 176.8 | 166.9 | 70 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 496 | P | 51.7 | Low | 36.4 | Very low | 108 Ų | 108 | 139.7 Ų | 139.7 | 70% | 0.701 | 81% | 0.807 | S | S | * | * | -133.3 | -152.3 | -107.8 | 32.3 | -6.3 | 0 | 0 | 0 | 114.6 | |||||
| 497 | L | 29.2 | Very low | 36.4 | Very low | 163 Ų | 163 | 146 Ų | 146 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | trans | 77.9 | 151 | -175.3 | -68.5 | 85.1 | 0 | 0 | 0 | 114.7 | ||||
| 498 | S | 33.5 | Very low | 36.4 | Very low | 107 Ų | 107 | 144.9 Ų | 144.9 | 75% | 0.748 | 81% | 0.814 | S | S | * | * | cis | -134.3 | 154.1 | 8.7 | -174 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 499 | D | 34 | Very low | 36.5 | Very low | 149 Ų | 149 | 145.7 Ų | 145.7 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | trans | -64.2 | 148.1 | 161.6 | -70.7 | -70.8 | 0 | 0 | 0 | 112.2 | ||||
| 500 | M | 34.5 | Very low | 36.7 | Very low | 177 Ų | 177 | 143.4 Ų | 143.4 | 87% | 0.872 | 82% | 0.816 | S | S | * | * | trans | -151.1 | 124.2 | 153.5 | -96.3 | -97.4 | 71.1 | 0 | 0 | 107.6 | ||||
| 501 | Q | 37.6 | Very low | 37 | Very low | 184 Ų | 184 | 146.2 Ų | 146.2 | 86% | 0.86 | 82% | 0.821 | S | S | * | * | trans | -82.6 | 135.3 | -176.7 | -63.4 | 170.6 | -41.7 | 0 | 0 | 111.7 | ||||
| 502 | T | 32.3 | Very low | 37.2 | Very low | 137 Ų | 137 | 150.2 Ų | 150.2 | 84% | 0.84 | 85% | 0.847 | S | S | * | * | trans | -143.7 | 141.8 | 157.2 | -39.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 503 | T | 37.9 | Very low | 36.7 | Very low | 132 Ų | 132 | 151.1 Ų | 151.1 | 81% | 0.81 | 85% | 0.846 | S | S | * | * | trans | -79.4 | 141.1 | -173.3 | 46.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 504 | L | 33.1 | Very low | 36.8 | Very low | 178 Ų | 178 | 152.1 Ų | 152.1 | 93% | 0.932 | 85% | 0.848 | S | S | * | * | trans | -137.4 | 138.4 | 168.6 | -79.1 | 178.1 | 0 | 0 | 0 | 112.9 | ||||
| 505 | S | 28.4 | Very low | 36.3 | Very low | 108 Ų | 108 | 153.9 Ų | 153.9 | 76% | 0.755 | 85% | 0.852 | S | S | * | * | trans | -92.2 | 153.9 | 175.1 | -158.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 506 | P | 46.3 | Very low | 36.4 | Very low | 124 Ų | 124 | 155.2 Ų | 155.2 | 81% | 0.805 | 86% | 0.855 | S | S | * | * | trans | -74.1 | 146.2 | -160.8 | 29.3 | -35.1 | 0 | 0 | 0 | 113.5 | ||||
| 507 | R | 34.9 | Very low | 35.5 | Very low | 235 Ų | 235 | 158.2 Ų | 158.2 | 89% | 0.887 | 87% | 0.865 | S | S | * | * | trans | -120.6 | 139.9 | 162.4 | -80.2 | -174.6 | 169.5 | 168.8 | -1.8 | 110.4 | ||||
| 508 | T | 33.3 | Very low | 35.9 | Very low | 135 Ų | 135 | 157.9 Ų | 157.9 | 83% | 0.828 | 87% | 0.865 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 132.5 | 176.2 | 36.8 | 0 | 0 | 0 | 0 | 113.1 | ||
| 509 | I | 36.7 | Very low | 36.1 | Very low | 159 Ų | 159 | 161.5 Ų | 161.5 | 82% | 0.815 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -86 | 121.9 | 164 | -65.3 | 170.4 | 0 | 0 | 0 | 107.4 | ||
| 510 | E | 38.3 | Very low | 36.2 | Very low | 178 Ų | 178 | 162.5 Ų | 162.5 | 83% | 0.832 | 88% | 0.88 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 148.1 | 166.6 | -67.4 | -170.5 | 130.5 | 0 | 0 | 110.2 | ||
| 511 | I | 39.3 | Very low | 36.4 | Very low | 165 Ų | 165 | 161.3 Ų | 161.3 | 85% | 0.846 | 88% | 0.88 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 128.9 | 179.6 | -58.9 | 171.9 | 0 | 0 | 0 | 108.2 | ||
| 512 | C | 38.2 | Very low | 36.2 | Very low | 200 Ų | 200 | 159.2 Ų | 159.2 | 100% | 1.351 | 88% | 0.882 | S | S | * | * | trans | -89.2 | 0 | 170.3 | -64.7 | 0 | 0 | 0 | 0 | 111.6 |
Retrieved 512 of 512 residues in 273.9 ms
(Link to these results)