| 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 | 39.4 | Very low | 39.3 | Very low | 247 Ų | 247 | 133.4 Ų | 133.4 | 100% | 1.217 | 74% | 0.739 | S | S | * | * | 0 | 135.7 | 0 | -71.6 | 176.7 | 169.6 | 0 | 0 | 107 | |||||
| 2 | A | 38 | Very low | 38.9 | Very low | 93 Ų | 93 | 138.4 Ų | 138.4 | 77% | 0.769 | 75% | 0.747 | S | S | * | * | trans | 14.3 | 119.4 | 172 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 3 | S | 42.4 | Very low | 38.1 | Very low | 106 Ų | 106 | 134.2 Ų | 134.2 | 74% | 0.741 | 76% | 0.756 | S | S | * | * | 69.8 | 134.8 | 70.7 | -75.2 | 0 | 0 | 0 | 0 | 113 | |||||
| 4 | D | 41.7 | Very low | 37.9 | Very low | 125 Ų | 125 | 131.9 Ų | 131.9 | 67% | 0.668 | 76% | 0.762 | S | S | * | * | cis | -160.4 | 147 | -2 | -104.2 | -62.9 | 0 | 0 | 0 | 105.9 | ||||
| 5 | V | 44.1 | Very low | 37.7 | Very low | 116 Ų | 116 | 131.4 Ų | 131.4 | 70% | 0.703 | 77% | 0.769 | S | S | * | * | 58.2 | 128.3 | 79.3 | 172.6 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 6 | K | 41.2 | Very low | 37.4 | Very low | 162 Ų | 162 | 132.3 Ų | 132.3 | 70% | 0.704 | 77% | 0.77 | S | S | * | * | cis | -164.5 | 170.1 | 3.6 | -123.4 | 177 | -175.3 | -116.5 | 0 | 112.1 | ||||
| 7 | E | 37.8 | Very low | 37.3 | Very low | 144 Ų | 144 | 132.3 Ų | 132.3 | 67% | 0.673 | 77% | 0.772 | S | S | * | * | trans | 10.1 | 158.6 | 139.3 | -76.4 | 167.8 | 137.7 | 0 | 0 | 121.4 | ||||
| 8 | S | 38.4 | Very low | 37 | Very low | 91 Ų | 91 | 131 Ų | 131 | 64% | 0.636 | 77% | 0.772 | S | S | * | * | cis | 158.9 | 169.9 | -13 | 61.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 9 | E | 39.8 | Very low | 37 | Very low | 155 Ų | 155 | 132.7 Ų | 132.7 | 72% | 0.724 | 78% | 0.776 | S | S | * | * | trans | 72.4 | 165.8 | 168.2 | -76.3 | -78.5 | 54.2 | 0 | 0 | 116.8 | ||||
| 10 | V | 33.5 | Very low | 36.7 | Very low | 114 Ų | 114 | 133.5 Ų | 133.5 | 69% | 0.691 | 78% | 0.777 | S | S | * | * | cis | -145.6 | 137.6 | 10.5 | 85.3 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 11 | L | 36.1 | Very low | 36.7 | Very low | 114 Ų | 114 | 133.8 Ų | 133.8 | 60% | 0.597 | 78% | 0.776 | S | S | * | * | trans | 25 | 145 | 147.1 | -64 | 170.1 | 0 | 0 | 0 | 126.8 | ||||
| 12 | K | 34.1 | Very low | 36.5 | Very low | 194 Ų | 194 | 127.8 Ų | 127.8 | 84% | 0.843 | 76% | 0.758 | S | S | * | * | trans | 75 | 136.5 | 132.6 | -80.3 | 168.7 | -179.2 | 174.4 | 0 | 122.7 | ||||
| 13 | G | 28.3 | Very low | 36.4 | Very low | 83 Ų | 83 | 130.6 Ų | 130.6 | 86% | 0.856 | 76% | 0.76 | S | S | * | * | trans | 165.4 | 119.9 | 151.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 14 | A | 35.9 | Very low | 36.2 | Very low | 103 Ų | 103 | 131.5 Ų | 131.5 | 85% | 0.851 | 77% | 0.766 | S | S | * | * | trans | -125.1 | 142.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 15 | S | 35.1 | Very low | 35.8 | Very low | 124 Ų | 124 | 133 Ų | 133 | 87% | 0.867 | 77% | 0.774 | S | S | * | * | trans | -176.7 | 166.2 | 153.2 | 52.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 16 | N | 32.9 | Very low | 35.4 | Very low | 146 Ų | 146 | 133.8 Ų | 133.8 | 78% | 0.781 | 78% | 0.783 | S | S | * | * | trans | -98.1 | 161 | -164 | -67 | -33.4 | 0 | 0 | 0 | 115.2 | ||||
| 17 | T | 35.3 | Very low | 35 | Very low | 132 Ų | 132 | 132.2 Ų | 132.2 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | trans | 56.6 | 120.7 | 144.6 | 48.5 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 18 | S | 32.6 | Very low | 35 | Very low | 109 Ų | 109 | 131.2 Ų | 131.2 | 76% | 0.762 | 79% | 0.791 | S | S | * | * | 177.7 | 144 | 108.1 | 44.7 | 0 | 0 | 0 | 0 | 115 | |||||
| 19 | L | 36.1 | Very low | 35.4 | Very low | 163 Ų | 163 | 132.7 Ų | 132.7 | 85% | 0.853 | 80% | 0.799 | S | S | * | * | trans | 45.1 | 117.2 | 142.2 | -59.7 | 168.7 | 0 | 0 | 0 | 121.5 | ||||
| 20 | N | 31.5 | Very low | 35.1 | Very low | 149 Ų | 149 | 130.2 Ų | 130.2 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | 147.3 | 156.5 | 91.8 | -146.4 | 7.1 | 0 | 0 | 0 | 113.9 | |||||
| 21 | N | 35.9 | Very low | 35 | Very low | 140 Ų | 140 | 135.9 Ų | 135.9 | 75% | 0.749 | 81% | 0.807 | S | S | * | * | trans | -74.8 | 161.3 | -180 | -58 | -30.6 | 0 | 0 | 0 | 113.5 | ||||
| 22 | S | 36.5 | Very low | 34.9 | Very low | 120 Ų | 120 | 136.4 Ų | 136.4 | 84% | 0.839 | 82% | 0.816 | S | S | * | * | -173 | 137.2 | 125.3 | -78.4 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 23 | D | 36.2 | Very low | 34.8 | Very low | 152 Ų | 152 | 134.6 Ų | 134.6 | 81% | 0.813 | 82% | 0.815 | S | S | * | * | trans | -73.6 | 177.1 | 172.8 | -67.3 | -71.8 | 0 | 0 | 0 | 113.1 | ||||
| 24 | S | 36.5 | Very low | 34.8 | Very low | 125 Ų | 125 | 134.2 Ų | 134.2 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -149.2 | 81.7 | 168.7 | -67.1 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 25 | D | 34.2 | Very low | 34.6 | Very low | 157 Ų | 157 | 136.4 Ų | 136.4 | 84% | 0.84 | 81% | 0.809 | S | S | * | * | trans | -79 | 151.3 | 161.5 | -87.4 | -41.3 | 0 | 0 | 0 | 111.1 | ||||
| 26 | C | 35.7 | Very low | 34.4 | Very low | 132 Ų | 132 | 138 Ų | 138 | 89% | 0.892 | 81% | 0.807 | S | S | * | * | trans | -112 | 133.6 | 174.1 | -176.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 27 | V | 31.9 | Very low | 34.2 | Very low | 129 Ų | 129 | 135.1 Ų | 135.1 | 78% | 0.782 | 81% | 0.811 | S | S | * | * | trans | -117.8 | 146.9 | -166.2 | 175.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 28 | T | 37.5 | Very low | 33.9 | Very low | 124 Ų | 124 | 136 Ų | 136 | 76% | 0.761 | 81% | 0.811 | S | S | * | * | trans | -67.7 | 167.9 | 175.1 | -22.4 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 29 | P | 48.6 | Very low | 33.8 | Very low | 122 Ų | 122 | 141.7 Ų | 141.7 | 79% | 0.792 | 82% | 0.815 | S | S | * | * | -140.8 | -172.7 | 127.5 | 31.7 | -13.9 | 0 | 0 | 0 | 115.2 | |||||
| 30 | S | 32.3 | Very low | 33.6 | Very low | 103 Ų | 103 | 141.8 Ų | 141.8 | 72% | 0.72 | 81% | 0.812 | S | S | * | * | trans | -143.2 | 160.7 | -139.4 | 59.5 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 31 | R | 32.3 | Very low | 33.6 | Very low | 232 Ų | 232 | 139.7 Ų | 139.7 | 88% | 0.875 | 81% | 0.805 | S | S | * | * | trans | 69.1 | 151.2 | 158.7 | -77.2 | 177.4 | 142.8 | 166.9 | -8.2 | 116.4 | ||||
| 32 | T | 33 | Very low | 33.3 | Very low | 126 Ų | 126 | 138.9 Ų | 138.9 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | -151.5 | 168.9 | 51.1 | 48.8 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 33 | D | 33.1 | Very low | 33.1 | Very low | 156 Ų | 156 | 137.3 Ų | 137.3 | 83% | 0.834 | 79% | 0.794 | S | S | * | * | trans | -9.9 | 159.1 | 163.8 | -58.8 | -90.9 | 0 | 0 | 0 | 124.5 | ||||
| 34 | G | 28.6 | Very low | 32.8 | Very low | 75 Ų | 75 | 137.8 Ų | 137.8 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | trans | 153.2 | 69.2 | 151.7 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 35 | D | 30.7 | Very low | 32.4 | Very low | 148 Ų | 148 | 137 Ų | 137 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | 39.7 | 149.2 | 137.5 | -144.8 | 25.7 | 0 | 0 | 0 | 127.1 | ||||
| 36 | L | 31.6 | Very low | 32.3 | Very low | 159 Ų | 159 | 134.5 Ų | 134.5 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | trans | 46.2 | 133.9 | 157.5 | -76.5 | 169.7 | 0 | 0 | 0 | 124.3 | ||||
| 37 | G | 28.2 | Very low | 32.1 | Very low | 84 Ų | 84 | 133.5 Ų | 133.5 | 87% | 0.866 | 78% | 0.779 | S | S | * | * | trans | 175.8 | 106 | 160.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 38 | N | 29.6 | Very low | 31.8 | Very low | 151 Ų | 151 | 130.4 Ų | 130.4 | 81% | 0.807 | 77% | 0.774 | S | S | * | * | trans | -107.9 | 134.7 | -166.8 | -165.2 | 25.4 | 0 | 0 | 0 | 114.2 | ||||
| 39 | R | 29.6 | Very low | 31.5 | Very low | 228 Ų | 228 | 133.8 Ų | 133.8 | 86% | 0.86 | 78% | 0.781 | S | S | * | * | trans | 166.9 | 127.1 | 145 | -99.9 | 170.3 | 164.5 | -179.8 | -6.4 | 111.4 | ||||
| 40 | Q | 32.4 | Very low | 30.6 | Very low | 166 Ų | 166 | 132.6 Ų | 132.6 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | 58.2 | 127.9 | 56.8 | -99.5 | -172.7 | 1.9 | 0 | 0 | 112.6 | |||||
| 41 | T | 30.8 | Very low | 30.3 | Very low | 105 Ų | 105 | 137.2 Ų | 137.2 | 64% | 0.644 | 78% | 0.777 | S | S | * | * | cis | -162.1 | 156.6 | 33 | 49.7 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 42 | T | 30.6 | Very low | 30.2 | Very low | 123 Ų | 123 | 134.7 Ų | 134.7 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | trans | 61 | 153.3 | 135.5 | 55.4 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 43 | S | 31.6 | Very low | 30.1 | Very low | 87 Ų | 87 | 135.3 Ų | 135.3 | 61% | 0.608 | 77% | 0.771 | S | S | * | * | cis | 174.2 | 169 | -21.1 | 57.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 44 | L | 29.9 | Very low | 30 | Very low | 161 Ų | 161 | 132.4 Ų | 132.4 | 84% | 0.843 | 76% | 0.763 | S | S | * | * | trans | 75 | 133.6 | 160.7 | -57.1 | 158 | 0 | 0 | 0 | 117.3 | ||||
| 45 | S | 27.3 | Very low | 30.1 | Very low | 108 Ų | 108 | 135.8 Ų | 135.8 | 76% | 0.755 | 76% | 0.764 | S | S | * | * | cis | 109.9 | 138.9 | 2.9 | -163.2 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 46 | S | 32.6 | Very low | 30.1 | Very low | 105 Ų | 105 | 136.6 Ų | 136.6 | 73% | 0.734 | 76% | 0.763 | S | S | * | * | trans | 75.1 | 148.8 | 161.6 | 153.6 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 47 | S | 31 | Very low | 30.1 | Very low | 112 Ų | 112 | 136 Ų | 136 | 78% | 0.783 | 76% | 0.76 | S | S | * | * | cis | -173 | 173.6 | -11.8 | -74.3 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 48 | G | 27.5 | Very low | 30.3 | Very low | 64 Ų | 64 | 140.5 Ų | 140.5 | 66% | 0.66 | 76% | 0.763 | S | S | * | * | trans | 102.2 | 120.9 | 158.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 49 | E | 30.6 | Very low | 30.5 | Very low | 194 Ų | 194 | 142.5 Ų | 142.5 | 91% | 0.907 | 77% | 0.768 | S | S | * | * | 69.2 | 136.5 | 69.7 | -72.5 | -166.3 | 105.4 | 0 | 0 | 114.4 | |||||
| 50 | S | 28.6 | Very low | 30.5 | Very low | 98 Ų | 98 | 135.5 Ų | 135.5 | 69% | 0.685 | 77% | 0.767 | S | S | * | * | cis | -169.2 | 157.8 | -10.3 | 61 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 51 | R | 27.3 | Very low | 30.5 | Very low | 200 Ų | 200 | 133.9 Ų | 133.9 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | trans | 57.9 | 123.2 | 138.7 | -172.5 | -179.2 | -174.8 | 165.2 | 2.7 | 123.6 | E53 | R51-E53 IonicContact CZ-OE2 3.32Å; R51-E53 VanDerWaalsContact CZ-OE2 3.32Å; R51-E53 IonicContact NE-OE2 2.97Å; R51-E53 PolarHBondContact NE-OE2 2.82Å; R51-E53 IonicContact NH2-OE2 2.77Å; R51-E53 PolarHBondContact NH2-OE2 3.12Å | ||
| 52 | M | 30.3 | Very low | 30.5 | Very low | 179 Ų | 179 | 134.8 Ų | 134.8 | 88% | 0.882 | 78% | 0.784 | S | S | * | * | -161.3 | 139.2 | 122.8 | -65.8 | -152.3 | 179 | 0 | 0 | 107 | |||||
| 53 | E | 30.3 | Very low | 30.6 | Very low | 139 Ų | 139 | 134 Ų | 134 | 65% | 0.65 | 79% | 0.79 | S | S | * | * | 60 | 125.4 | 60 | -81.4 | 175.5 | 91.5 | 0 | 0 | 112.6 | R51 | R51-E53 IonicContact CZ-OE2 3.32Å; R51-E53 VanDerWaalsContact CZ-OE2 3.32Å; R51-E53 IonicContact NE-OE2 2.97Å; R51-E53 PolarHBondContact NE-OE2 2.82Å; R51-E53 IonicContact NH2-OE2 2.77Å; R51-E53 PolarHBondContact NH2-OE2 3.12Å | |||
| 54 | S | 30 | Very low | 30.6 | Very low | 95 Ų | 95 | 135.4 Ų | 135.4 | 66% | 0.664 | 80% | 0.8 | S | S | * | * | cis | -159.4 | 157.8 | 13.2 | -41.7 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 55 | D | 31.2 | Very low | 30.7 | Very low | 145 Ų | 145 | 132.5 Ų | 132.5 | 78% | 0.775 | 80% | 0.799 | S | S | * | * | trans | 53.9 | 148.4 | 133.9 | -66.1 | -17.1 | 0 | 0 | 0 | 127.9 | ||||
| 56 | Q | 31.7 | Very low | 31.1 | Very low | 165 Ų | 165 | 135.5 Ų | 135.5 | 77% | 0.771 | 81% | 0.806 | S | S | * | * | trans | 101.3 | 95.5 | 145.1 | -87.3 | 161.8 | 82 | 0 | 0 | 121.9 | ||||
| 57 | D | 30.1 | Very low | 31.2 | Very low | 147 Ų | 147 | 140 Ų | 140 | 79% | 0.786 | 82% | 0.815 | S | S | * | * | 31.7 | 131.8 | 127.5 | -63.1 | -55 | 0 | 0 | 0 | 122 | |||||
| 58 | L | 33.6 | Very low | 31.3 | Very low | 178 Ų | 178 | 142 Ų | 142 | 93% | 0.932 | 82% | 0.817 | S | S | * | * | -165.3 | 145.3 | 117.9 | -104.9 | 166.8 | 0 | 0 | 0 | 113 | |||||
| 59 | Q | 33.4 | Very low | 31.5 | Very low | 194 Ų | 194 | 149.2 Ų | 149.2 | 91% | 0.907 | 83% | 0.825 | S | S | * | * | trans | -91.3 | 156 | 179.4 | -67.6 | 171.8 | -18.7 | 0 | 0 | 112.1 | ||||
| 60 | G | 29.1 | Very low | 31.7 | Very low | 81 Ų | 81 | 146.7 Ų | 146.7 | 84% | 0.835 | 81% | 0.813 | S | S | * | * | trans | 171.9 | 47.1 | 170.1 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 61 | S | 32.7 | Very low | 31.9 | Very low | 131 Ų | 131 | 151.4 Ų | 151.4 | 92% | 0.916 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 127.6 | 173.7 | -62.3 | 0 | 0 | 0 | 0 | 112.5 | ||
| 62 | S | 31.4 | Very low | 32 | Very low | 124 Ų | 124 | 146.8 Ų | 146.8 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 139.1 | 170.4 | 43.7 | 0 | 0 | 0 | 0 | 111.6 | ||
| 63 | A | 32.7 | Very low | 31.8 | Very low | 106 Ų | 106 | 148.9 Ų | 148.9 | 88% | 0.876 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -103.7 | 149.7 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 64 | S | 32.2 | Very low | 31.9 | Very low | 118 Ų | 118 | 151.5 Ų | 151.5 | 83% | 0.825 | 82% | 0.821 | S | S | * | * | trans | -129.6 | 111.2 | 157.6 | 50 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 65 | A | 32.2 | Very low | 31.9 | Very low | 99 Ų | 99 | 155.6 Ų | 155.6 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | 87.8 | 88.7 | 71.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 66 | L | 35.8 | Very low | 31.8 | Very low | 171 Ų | 171 | 155 Ų | 155 | 90% | 0.895 | 83% | 0.827 | S | S | * | * | trans | -115.8 | 130.9 | 158.5 | -75.2 | 171 | 0 | 0 | 0 | 107.7 | ||||
| 67 | E | 34 | Very low | 31.7 | Very low | 199 Ų | 199 | 154 Ų | 154 | 93% | 0.93 | 83% | 0.831 | S | S | * | * | trans | -162.3 | 155.4 | 134.3 | -120.7 | -175.2 | 119.3 | 0 | 0 | 113.5 | ||||
| 68 | N | 33.1 | Very low | 31.6 | Very low | 155 Ų | 155 | 153.9 Ų | 153.9 | 83% | 0.829 | 84% | 0.836 | S | S | * | * | trans | -81.9 | 163.8 | 176.6 | -82.3 | -58.3 | 0 | 0 | 0 | 111.7 | ||||
| 69 | R | 32.4 | Very low | 31.7 | Very low | 215 Ų | 215 | 154.6 Ų | 154.6 | 81% | 0.811 | 83% | 0.832 | S | S | * | * | 159.7 | 109.5 | 109.9 | -172.8 | 163.7 | -166.2 | 172.3 | 3.4 | 116.1 | |||||
| 70 | E | 32.9 | Very low | 31.5 | Very low | 142 Ų | 142 | 152 Ų | 152 | 66% | 0.664 | 83% | 0.829 | S | S | * | * | 42.1 | 116.7 | 128.2 | -162.2 | -159.7 | 164.8 | 0 | 0 | 121.7 | |||||
| 71 | K | 33.3 | Very low | 31.5 | Very low | 197 Ų | 197 | 158.9 Ų | 158.9 | 86% | 0.857 | 83% | 0.83 | S | S | * | * | -166.7 | 140.3 | 115.7 | -123.1 | 174.3 | -177.6 | 170.2 | 0 | 118.7 | |||||
| 72 | S | 28.9 | Very low | 31.2 | Very low | 102 Ų | 102 | 164 Ų | 164 | 71% | 0.713 | 83% | 0.829 | S | S | * | * | trans | -47.1 | 152.9 | 174.2 | -170.5 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 73 | R | 27.4 | Very low | 31 | Very low | 223 Ų | 223 | 164.1 Ų | 164.1 | 84% | 0.842 | 83% | 0.825 | S | S | * | * | -162 | 110.3 | 120.2 | -170.5 | 166.5 | 175.4 | 169.8 | -2.9 | 116.6 | |||||
| 74 | R | 32 | Very low | 31 | Very low | 195 Ų | 195 | 165.3 Ų | 165.3 | 74% | 0.736 | 82% | 0.821 | S | S | * | * | trans | 25.7 | 134 | 141.8 | -57.1 | 177.4 | -179 | 159.5 | 0.7 | 123.2 | ||||
| 75 | E | 30.8 | Very low | 31.7 | Very low | 180 Ų | 180 | 165.9 Ų | 165.9 | 84% | 0.841 | 82% | 0.822 | S | S | * | * | -164 | 116.8 | 105.6 | -99.6 | 175.7 | -178.2 | 0 | 0 | 108.8 | |||||
| 76 | N | 28.5 | Very low | 31.5 | Very low | 134 Ų | 134 | 164.7 Ų | 164.7 | 72% | 0.717 | 82% | 0.82 | S | S | * | * | 76.9 | 107.4 | 79.1 | -75.4 | -8.5 | 0 | 0 | 0 | 115.8 | |||||
| 77 | V | 29.3 | Very low | 31.2 | Very low | 142 Ų | 142 | 166.7 Ų | 166.7 | 86% | 0.861 | 82% | 0.822 | S | S | * | * | -167.4 | 124.8 | 124.2 | 165.8 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 78 | T | 28.3 | Very low | 31.2 | Very low | 145 Ų | 145 | 163.7 Ų | 163.7 | 89% | 0.89 | 82% | 0.817 | S | S | * | * | trans | -149.1 | 153.5 | 159.4 | -36.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 79 | K | 35 | Very low | 31.1 | Very low | 194 Ų | 194 | 165 Ų | 165 | 84% | 0.843 | 82% | 0.817 | S | S | * | * | trans | -81.7 | 140.4 | -163.9 | 168.3 | -173.5 | 179.9 | 179.3 | 0 | 116 | ||||
| 80 | T | 29.2 | Very low | 31.1 | Very low | 138 Ų | 138 | 162 Ų | 162 | 85% | 0.847 | 81% | 0.811 | S | S | * | * | trans | 177.1 | 169.2 | 157.4 | 24.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 81 | R | 28.9 | Very low | 31.1 | Very low | 226 Ų | 226 | 163 Ų | 163 | 85% | 0.853 | 82% | 0.815 | S | S | * | * | cis | -172.8 | 121.4 | -24.4 | 166.3 | -172.4 | 174.3 | -152 | -1.1 | 109 | ||||
| 82 | R | 26.5 | Very low | 30.9 | Very low | 238 Ų | 238 | 158.8 Ų | 158.8 | 90% | 0.898 | 81% | 0.811 | S | S | * | * | trans | -176.4 | 145.8 | 166.5 | -103.8 | 169.8 | -142.6 | -153 | 7.9 | 109.3 | ||||
| 83 | T | 28.1 | Very low | 30.9 | Very low | 127 Ų | 127 | 158 Ų | 158 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | cis | -160.4 | 154.7 | -6.9 | -8.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 84 | T | 32.2 | Very low | 30.8 | Very low | 131 Ų | 131 | 151.3 Ų | 151.3 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -82.4 | 178.6 | 160.2 | 36.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 85 | P | 47.8 | Very low | 30.7 | Very low | 130 Ų | 130 | 146 Ų | 146 | 84% | 0.844 | 83% | 0.825 | S | S | * | * | cis | -143.1 | -178.5 | 14.5 | 44 | -24.9 | 0 | 0 | 0 | 118.5 | ||||
| 86 | G | 26.3 | Very low | 30.6 | Very low | 75 Ų | 75 | 142.6 Ų | 142.6 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | trans | 132 | 147.5 | 155.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 87 | K | 30.2 | Very low | 30.9 | Very low | 213 Ų | 213 | 141.1 Ų | 141.1 | 93% | 0.926 | 82% | 0.821 | S | S | * | * | cis | -171.1 | 154.8 | -17.9 | -175.6 | 174.1 | 178.1 | -177.9 | 0 | 105.5 | ||||
| 88 | V | 33.9 | Very low | 31.3 | Very low | 136 Ų | 136 | 138.8 Ų | 138.8 | 82% | 0.824 | 82% | 0.817 | S | S | * | * | trans | -81.7 | 139.2 | -167.1 | 173.3 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 89 | Q | 32.3 | Very low | 32.6 | Very low | 181 Ų | 181 | 137.6 Ų | 137.6 | 85% | 0.846 | 81% | 0.811 | S | S | * | * | trans | -169.3 | 150.9 | 155.5 | -129.4 | 162.2 | -30.8 | 0 | 0 | 110 | ||||
| 90 | K | 31.6 | Very low | 32.4 | Very low | 153 Ų | 153 | 135 Ų | 135 | 67% | 0.665 | 81% | 0.812 | S | S | * | * | cis | -176.4 | 125.8 | -31.4 | 171.4 | -179 | 167.8 | -177.6 | 0 | 108.8 | ||||
| 91 | Q | 32.8 | Very low | 32.5 | Very low | 163 Ų | 163 | 133.7 Ų | 133.7 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | trans | 62.9 | 163.9 | 157.9 | -73.6 | 174.6 | -19.1 | 0 | 0 | 118 | ||||
| 92 | S | 29.7 | Very low | 32.9 | Very low | 109 Ų | 109 | 130.9 Ų | 130.9 | 76% | 0.762 | 81% | 0.809 | S | S | * | * | cis | -170.1 | 155.4 | -7 | 38.1 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 93 | G | 27.6 | Very low | 33.6 | Very low | 86 Ų | 86 | 125.4 Ų | 125.4 | 89% | 0.887 | 80% | 0.804 | S | S | * | * | trans | 81.6 | 155.9 | 155.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 94 | G | 26.9 | Very low | 33.9 | Very low | 81 Ų | 81 | 128.3 Ų | 128.3 | 84% | 0.835 | 81% | 0.806 | S | S | * | * | cis | 151.5 | 128.1 | -6.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 95 | G | 28.3 | Very low | 34.7 | Very low | 84 Ų | 84 | 126.4 Ų | 126.4 | 87% | 0.866 | 80% | 0.796 | S | S | * | * | trans | 78.7 | 164.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 96 | S | 29.7 | Very low | 33.8 | Very low | 108 Ų | 108 | 128.8 Ų | 128.8 | 76% | 0.755 | 80% | 0.795 | S | S | * | * | cis | -166 | 160.4 | -2.4 | -169.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 97 | S | 34.8 | Very low | 34 | Very low | 104 Ų | 104 | 130.4 Ų | 130.4 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | 29.2 | 147.2 | 142.4 | 59.8 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 98 | A | 36.3 | Very low | 35.3 | Very low | 92 Ų | 92 | 125.7 Ų | 125.7 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | cis | -171.8 | 174.2 | 4.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 99 | P | 57.3 | Low | 36 | Very low | 120 Ų | 120 | 125 Ų | 125 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | trans | -112.7 | 171.9 | -172.1 | 41.6 | -32.9 | 0 | 0 | 0 | 115.4 | ||||
| 100 | V | 30.6 | Very low | 35.9 | Very low | 141 Ų | 141 | 125 Ų | 125 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | -153.3 | 147 | 164.9 | -178 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 101 | S | 30.8 | Very low | 35.9 | Very low | 110 Ų | 110 | 124 Ų | 124 | 77% | 0.769 | 79% | 0.791 | S | S | * | * | cis | -178.9 | 149.2 | -35.8 | -89.4 | 0 | 0 | 0 | 0 | 106 | ||||
| 102 | L | 37.1 | Very low | 35.8 | Very low | 167 Ų | 167 | 121.8 Ų | 121.8 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -57.7 | 171 | 178.1 | -83.2 | 156.8 | 0 | 0 | 0 | 114.6 | ||||
| 103 | P | 41.8 | Very low | 35.6 | Very low | 122 Ų | 122 | 120.5 Ų | 120.5 | 79% | 0.792 | 80% | 0.797 | S | S | * | * | cis | -153.1 | -179.9 | 39 | 43 | -19.9 | 0 | 0 | 0 | 121.2 | ||||
| 104 | K | 34.2 | Very low | 35.8 | Very low | 189 Ų | 189 | 121.8 Ų | 121.8 | 82% | 0.822 | 79% | 0.793 | S | S | * | * | trans | -66.5 | -177.6 | 156.5 | -112.1 | -178.3 | 178 | 176.4 | 0 | 110.8 | ||||
| 105 | P | 49.4 | Very low | 36 | Very low | 91 Ų | 91 | 125.4 Ų | 125.4 | 59% | 0.591 | 79% | 0.792 | S | S | * | * | cis | -144.1 | -165.9 | 18.6 | 24 | 5.3 | 0 | 0 | 0 | 117 | ||||
| 106 | H | 28.5 | Very low | 36.4 | Very low | 180 Ų | 180 | 129.8 Ų | 129.8 | 83% | 0.833 | 79% | 0.79 | S | S | * | * | trans | 122.2 | 149.4 | 147.1 | -62.2 | -64 | 0 | 0 | 0 | 120.2 | ||||
| 107 | S | 29.6 | Very low | 36.6 | Very low | 109 Ų | 109 | 136 Ų | 136 | 76% | 0.762 | 80% | 0.797 | S | S | * | * | trans | -156.6 | -179.9 | 177.5 | 56 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 108 | P | 58.9 | Low | 36.7 | Very low | 114 Ų | 114 | 139.7 Ų | 139.7 | 74% | 0.74 | 80% | 0.802 | S | S | * | * | cis | -112 | -155.4 | -33.9 | 34.3 | -14 | 0 | 0 | 0 | 110.6 | ||||
| 109 | P | 47.4 | Very low | 36.6 | Very low | 122 Ų | 122 | 143.9 Ų | 143.9 | 79% | 0.792 | 81% | 0.806 | S | S | * | * | -149.1 | -168 | 86.1 | 40.1 | -19.5 | 0 | 0 | 0 | 116.4 | |||||
| 110 | E | 30.4 | Very low | 35.9 | Very low | 181 Ų | 181 | 143.2 Ų | 143.2 | 85% | 0.846 | 80% | 0.804 | S | S | * | * | trans | -79.4 | 175.6 | -164.9 | -54.8 | 165.6 | 120.3 | 0 | 0 | 114.2 | ||||
| 111 | V | 31.7 | Very low | 36.4 | Very low | 132 Ų | 132 | 143.4 Ų | 143.4 | 80% | 0.8 | 81% | 0.805 | S | S | * | * | -160.1 | 158 | 56.8 | 166.4 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 112 | S | 30.1 | Very low | 37.2 | Very low | 116 Ų | 116 | 142 Ų | 142 | 81% | 0.811 | 80% | 0.8 | S | S | * | * | trans | -47.7 | 151.7 | -174.3 | 56.4 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 113 | G | 27 | Very low | 37.8 | Very low | 81 Ų | 81 | 139.9 Ų | 139.9 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -160.7 | 144.6 | 156.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 114 | S | 30.5 | Very low | 37.9 | Very low | 114 Ų | 114 | 139.6 Ų | 139.6 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -107.7 | 160.1 | -157.6 | -162.6 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 115 | L | 32.3 | Very low | 38.6 | Very low | 156 Ų | 156 | 137.2 Ų | 137.2 | 82% | 0.817 | 78% | 0.782 | S | S | * | * | trans | 89 | 142.2 | 152.1 | -89.3 | 158.7 | 0 | 0 | 0 | 122.5 | ||||
| 116 | E | 35.4 | Very low | 38.3 | Very low | 176 Ų | 176 | 137.3 Ų | 137.3 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | trans | 81.5 | 134.3 | 165.4 | -79.5 | -174.5 | 95.5 | 0 | 0 | 123.2 | ||||
| 117 | R | 35.4 | Very low | 39.2 | Very low | 240 Ų | 240 | 139.5 Ų | 139.5 | 91% | 0.906 | 79% | 0.792 | S | S | * | * | trans | 77.3 | 83.1 | 161.6 | -107.9 | 168 | 178.6 | -120.3 | -4.2 | 120.1 | ||||
| 118 | Q | 36.4 | Very low | 39.9 | Very low | 180 Ų | 180 | 141.9 Ų | 141.9 | 84% | 0.841 | 80% | 0.796 | S | S | * | * | trans | -56.9 | 162 | 144.3 | -104 | 175.1 | -83 | 0 | 0 | 112.9 | ||||
| 119 | E | 34.6 | Very low | 39.5 | Very low | 180 Ų | 180 | 145.6 Ų | 145.6 | 84% | 0.841 | 80% | 0.795 | S | S | * | * | trans | 88.4 | 134.5 | 163.1 | -65 | -172.2 | 130.1 | 0 | 0 | 121.3 | ||||
| 120 | S | 42.4 | Very low | 39.1 | Very low | 106 Ų | 106 | 149.1 Ų | 149.1 | 74% | 0.741 | 80% | 0.803 | S | S | * | * | trans | 84.3 | 47.3 | 161.8 | 73 | 0 | 0 | 0 | 0 | 121 | A122 | S120-A122 VanDerWaalsContact C-N 3.29Å; S120-A122 PolarHBondContact O-N 3.13Å; S120-A122 VanDerWaalsContact O-N 3.12Å | ||
| 121 | V | 40.4 | Very low | 40 | Very low | 145 Ų | 145 | 149.9 Ų | 149.9 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | trans | -76.1 | 85.2 | 147.4 | -175.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 122 | A | 46.8 | Very low | 40.6 | Very low | 80 Ų | 80 | 147.1 Ų | 147.1 | 66% | 0.661 | 81% | 0.805 | S | S | * | * | trans | -143.1 | 22.4 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | S120 | S120-A122 VanDerWaalsContact C-N 3.29Å; S120-A122 PolarHBondContact O-N 3.13Å; S120-A122 VanDerWaalsContact O-N 3.12Å | ||
| 123 | T | 50.1 | Low | 41.1 | Very low | 124 Ų | 124 | 147.8 Ų | 147.8 | 76% | 0.761 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -132.7 | 1.3 | -170.3 | 46.8 | 0 | 0 | 0 | 0 | 116 | ||
| 124 | T | 44.8 | Very low | 41.8 | Very low | 115 Ų | 115 | 153.4 Ų | 153.4 | 71% | 0.706 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -112.2 | -20.8 | -176.8 | 49.2 | 0 | 0 | 0 | 0 | 115.5 | ||
| 125 | E | 48.1 | Very low | 42.1 | Very low | 139 Ų | 139 | 155.3 Ų | 155.3 | 65% | 0.65 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -86.1 | -21.3 | 179 | -152.5 | -172 | 137.2 | 0 | 0 | 113.5 | R127 R129 | E125-R127 PolarHBondContact O-N 3.34Å; E125-R127 VanDerWaalsContact O-N 3.13Å; E125-R129 IonicContact OE1-CZ 2.75Å; E125-R129 IonicContact OE1-NH1 3.15Å; E125-R129 PolarHBondContact OE1-NH1 2.91Å; E125-R129 IonicContact OE1-NH2 3.86Å |
| 126 | A | 43.8 | Very low | 42.3 | Very low | 94 Ų | 94 | 155.2 Ų | 155.2 | 78% | 0.777 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | 2.4 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 127 | R | 46.8 | Very low | 42.4 | Very low | 226 Ų | 226 | 155 Ų | 155 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | 2.7 | -174.3 | -163.4 | 164.1 | 174.2 | 84.2 | 1.7 | 114.8 | E125 | E125-R127 PolarHBondContact O-N 3.34Å; E125-R127 VanDerWaalsContact O-N 3.13Å |
| 128 | L | 44.6 | Very low | 42.3 | Very low | 159 Ų | 159 | 150.1 Ų | 150.1 | 83% | 0.832 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -126.6 | 30 | -175.1 | -69.9 | 174.9 | 0 | 0 | 0 | 114.7 | ||
| 129 | R | 51.5 | Low | 43.1 | Very low | 191 Ų | 191 | 151.8 Ų | 151.8 | 72% | 0.721 | 79% | 0.787 | S | S | * | * | trans | -135.8 | 37 | 177.1 | -71.8 | -167.2 | 174.1 | 97.5 | -3.1 | 115.1 | E125 | E125-R129 IonicContact OE1-CZ 2.75Å; E125-R129 IonicContact OE1-NH1 3.15Å; E125-R129 PolarHBondContact OE1-NH1 2.91Å; E125-R129 IonicContact OE1-NH2 3.86Å | ||
| 130 | M | 38.3 | Very low | 43 | Very low | 197 Ų | 197 | 151.3 Ų | 151.3 | 97% | 0.97 | 79% | 0.785 | S | S | * | * | trans | -128.8 | 64.8 | 164.7 | -70.9 | -166 | -64.5 | 0 | 0 | 110.6 | ||||
| 131 | E | 48.5 | Very low | 42.9 | Very low | 196 Ų | 196 | 154 Ų | 154 | 92% | 0.916 | 79% | 0.791 | S | S | * | * | trans | -118.7 | 129.2 | 162.5 | -177.7 | 172.5 | -162.1 | 0 | 0 | 106.1 | ||||
| 132 | G | 45.8 | Very low | 42.8 | Very low | 75 Ų | 75 | 155 Ų | 155 | 77% | 0.773 | 79% | 0.786 | S | S | * | * | trans | 100.6 | 67.6 | -178 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 133 | V | 39 | Very low | 42.3 | Very low | 130 Ų | 130 | 158.5 Ų | 158.5 | 79% | 0.788 | 79% | 0.794 | S | S | * | * | trans | -127.1 | 86.4 | 151.8 | -176.9 | 0 | 0 | 0 | 0 | 107.8 | L135 | V133-L135 HydrophobicContact CG1-CG 4.28Å; V133-L135 PolarHBondContact O-N 3.35Å | ||
| 134 | E | 42.5 | Very low | 41.4 | Very low | 198 Ų | 198 | 162.1 Ų | 162.1 | 93% | 0.925 | 80% | 0.799 | S | S | * | * | trans | -70 | 109.4 | 163.5 | -80.5 | 178 | 109.1 | 0 | 0 | 108.6 | ||||
| 135 | L | 36.3 | Very low | 41.7 | Very low | 154 Ų | 154 | 161.3 Ų | 161.3 | 81% | 0.806 | 80% | 0.796 | S | S | * | * | trans | -98.7 | 108.9 | 158.7 | -81.9 | 174.3 | 0 | 0 | 0 | 108.6 | V133 E137 | V133-L135 HydrophobicContact CG1-CG 4.28Å; V133-L135 PolarHBondContact O-N 3.35Å; L135-E137 PolarHBondContact O-N 3.48Å; L135-E137 VanDerWaalsContact O-N 3.12Å | ||
| 136 | K | 36.8 | Very low | 41.1 | Very low | 155 Ų | 155 | 165.9 Ų | 165.9 | 67% | 0.674 | 81% | 0.807 | S | S | * | * | trans | -53.8 | 105.7 | 176.3 | -174.6 | -170.5 | 179.8 | -155.5 | 0 | 110.5 | E138 | K136-E138 VanDerWaalsContact C-N 3.26Å; K136-E138 HydrophobicContact CD-CB 4.47Å; K136-E138 WeakPolarHBondContact CE-OE2 3.37Å; K136-E138 HydrophobicContact CG-CB 4.34Å; K136-E138 IonicContact NZ-OE1 2.95Å; K136-E138 PolarHBondContact NZ-OE1 3.03Å; K136-E138 IonicContact NZ-OE2 3.81Å; K136-E138 PolarHBondContact NZ-OE2 2.96Å; K136-E138 PolarHBondContact O-N 3.33Å | ||
| 137 | E | 36.8 | Very low | 40.9 | Very low | 170 Ų | 170 | 167 Ų | 167 | 79% | 0.794 | 81% | 0.807 | S | S | * | * | trans | -73.5 | 80 | 169 | -74 | -167.4 | 127.2 | 0 | 0 | 110.2 | L135 | L135-E137 PolarHBondContact O-N 3.48Å; L135-E137 VanDerWaalsContact O-N 3.12Å | ||
| 138 | E | 33.8 | Very low | 40.6 | Very low | 138 Ų | 138 | 164 Ų | 164 | 65% | 0.645 | 81% | 0.807 | S | S | * | * | trans | -96.3 | 76.5 | 167.7 | -170.1 | 166.4 | -130.2 | 0 | 0 | 108.5 | K136 | K136-E138 VanDerWaalsContact C-N 3.26Å; K136-E138 HydrophobicContact CD-CB 4.47Å; K136-E138 WeakPolarHBondContact CE-OE2 3.37Å; K136-E138 HydrophobicContact CG-CB 4.34Å; K136-E138 IonicContact NZ-OE1 2.95Å; K136-E138 PolarHBondContact NZ-OE1 3.03Å; K136-E138 IonicContact NZ-OE2 3.81Å; K136-E138 PolarHBondContact NZ-OE2 2.96Å; K136-E138 PolarHBondContact O-N 3.33Å | ||
| 139 | W | 53.6 | Low | 40.2 | Very low | 216 Ų | 216 | 162.2 Ų | 162.2 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 118.5 | 169.5 | -75.5 | 106.4 | 0 | 0 | 0 | 109.1 | D141 | W139-D141 PolarHBondContact O-N 3.34Š|
| 140 | Q | 31.9 | Very low | 39.4 | Very low | 170 Ų | 170 | 162.2 Ų | 162.2 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 128.5 | 175.8 | -70.3 | 170.3 | -26.3 | 0 | 0 | 110.8 | ||
| 141 | D | 41.5 | Very low | 39.5 | Very low | 162 Ų | 162 | 161.7 Ų | 161.7 | 87% | 0.866 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 117.1 | 151.5 | -67.4 | -52.4 | 0 | 0 | 0 | 107.4 | W139 | W139-D141 PolarHBondContact O-N 3.34Š|
| 142 | E | 37.9 | Very low | 38.9 | Very low | 165 Ų | 165 | 161.4 Ų | 161.4 | 77% | 0.771 | 81% | 0.807 | S | S | * | * | trans | -144.3 | 146.1 | 167.8 | -87 | -65.9 | 139.8 | 0 | 0 | 109.9 | ||||
| 143 | D | 35.2 | Very low | 38.3 | Very low | 155 Ų | 155 | 166.6 Ų | 166.6 | 83% | 0.829 | 81% | 0.811 | S | S | * | * | trans | -80.8 | 158.1 | -160.4 | -76.3 | -74.9 | 0 | 0 | 0 | 116.1 | ||||
| 144 | F | 32.3 | Very low | 38.1 | Very low | 200 Ų | 200 | 168.9 Ų | 168.9 | 88% | 0.877 | 82% | 0.817 | S | S | * | * | trans | -73.9 | 161.9 | 152.8 | -95.3 | -91.7 | 0 | 0 | 0 | 109.9 | ||||
| 145 | P | 51.1 | Low | 37.7 | Very low | 97 Ų | 97 | 167.7 Ų | 167.7 | 63% | 0.63 | 82% | 0.817 | S | S | * | * | cis | -139.5 | 169.9 | -0.2 | 36.7 | -17.8 | 0 | 0 | 0 | 115.8 | ||||
| 146 | R | 34.7 | Very low | 37.7 | Very low | 235 Ų | 235 | 169.1 Ų | 169.1 | 89% | 0.887 | 82% | 0.82 | S | S | * | * | 179.5 | 164.3 | 114.9 | -100.9 | -173.9 | -100 | -148.3 | -2.3 | 114.2 | |||||
| 147 | P | 40.2 | Very low | 37.5 | Very low | 119 Ų | 119 | 170.8 Ų | 170.8 | 77% | 0.773 | 83% | 0.828 | S | S | * | * | trans | -92.7 | 174 | -155.6 | 37.4 | -39.3 | 0 | 0 | 0 | 116.9 | ||||
| 148 | L | 39.8 | Very low | 37.2 | Very low | 162 Ų | 162 | 172.5 Ų | 172.5 | 85% | 0.848 | 83% | 0.833 | S | S | * | * | trans | -49 | 159.3 | -178.8 | -64.4 | 165.9 | 0 | 0 | 0 | 116.9 | ||||
| 149 | P | 35.4 | Very low | 37.1 | Very low | 121 Ų | 121 | 172.2 Ų | 172.2 | 79% | 0.786 | 85% | 0.846 | S | S | * | * | -104.8 | 169 | 128.8 | 35.6 | -31.8 | 0 | 0 | 0 | 112.2 | |||||
| 150 | E | 36.1 | Very low | 35.9 | Very low | 192 Ų | 192 | 165.2 Ų | 165.2 | 90% | 0.897 | 84% | 0.841 | S | S | * | * | trans | -90.2 | 176.6 | -152.4 | -66.4 | 163.1 | 158.4 | 0 | 0 | 115.9 | ||||
| 151 | E | 40.6 | Very low | 35.7 | Very low | 186 Ų | 186 | 164 Ų | 164 | 87% | 0.869 | 85% | 0.845 | S | S | * | * | trans | -55.2 | 149.1 | -172.4 | -46.5 | -179.3 | 151.4 | 0 | 0 | 115.6 | ||||
| 152 | E | 34.7 | Very low | 35.1 | Very low | 190 Ų | 190 | 162.1 Ų | 162.1 | 89% | 0.888 | 85% | 0.845 | S | S | * | * | trans | -160.2 | 130.1 | 133.1 | -113.3 | 165.8 | -164.3 | 0 | 0 | 112.5 | ||||
| 153 | E | 34.5 | Very low | 34.9 | Very low | 184 Ų | 184 | 163.2 Ų | 163.2 | 86% | 0.86 | 85% | 0.85 | S | S | * | * | trans | 59.7 | 98 | 142.2 | -151.9 | 163.7 | -116.3 | 0 | 0 | 121.7 | ||||
| 154 | L | 34.5 | Very low | 34.9 | Very low | 177 Ų | 177 | 162.6 Ų | 162.6 | 93% | 0.927 | 84% | 0.842 | S | S | * | * | trans | -152.5 | 74.3 | 151 | -97.1 | -176.1 | 0 | 0 | 0 | 110.7 | ||||
| 155 | D | 33.2 | Very low | 34.8 | Very low | 173 Ų | 173 | 163.6 Ų | 163.6 | 93% | 0.925 | 84% | 0.84 | S | S | * | * | trans | -130.2 | 46.5 | 177.2 | -122.6 | -14.6 | 0 | 0 | 0 | 111.8 | ||||
| 156 | E | 37.3 | Very low | 34 | Very low | 184 Ų | 184 | 166.1 Ų | 166.1 | 86% | 0.86 | 85% | 0.849 | S | S | * | * | trans | -147.1 | 73.7 | 179.2 | -158.1 | 160.5 | -132.9 | 0 | 0 | 113.1 | ||||
| 157 | F | 33 | Very low | 34.8 | Very low | 190 Ų | 190 | 160.2 Ų | 160.2 | 83% | 0.833 | 84% | 0.841 | S | S | * | * | trans | -146.7 | 18.9 | 174 | -134.5 | -91.4 | 0 | 0 | 0 | 116.9 | ||||
| 158 | F | 30.5 | Very low | 34.2 | Very low | 207 Ų | 207 | 157.7 Ų | 157.7 | 91% | 0.908 | 84% | 0.836 | S | S | * | * | trans | -140.4 | 64.6 | 175.7 | -73.9 | -73.4 | 0 | 0 | 0 | 113.7 | ||||
| 159 | S | 30.5 | Very low | 33.8 | Very low | 131 Ų | 131 | 161.8 Ų | 161.8 | 92% | 0.916 | 84% | 0.842 | S | S | * | * | trans | -150 | 91 | 161.2 | -82.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 160 | G | 28.1 | Very low | 33.6 | Very low | 70 Ų | 70 | 158.8 Ų | 158.8 | 72% | 0.722 | 83% | 0.832 | S | S | * | * | trans | -117.7 | 159.9 | 149.5 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 161 | T | 28.8 | Very low | 33.3 | Very low | 143 Ų | 143 | 159.1 Ų | 159.1 | 88% | 0.877 | 83% | 0.834 | S | S | * | * | cis | -162.6 | 146 | 9.7 | 44.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 162 | S | 29.1 | Very low | 32.8 | Very low | 124 Ų | 124 | 157.4 Ų | 157.4 | 87% | 0.867 | 83% | 0.831 | S | S | * | * | trans | -158.6 | 155.8 | 155.9 | 55.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 163 | E | 34.3 | Very low | 32.9 | Very low | 188 Ų | 188 | 156.2 Ų | 156.2 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | trans | -95.9 | 170.6 | -151.4 | -62.3 | 162.5 | 99.8 | 0 | 0 | 117.2 | ||||
| 164 | E | 33.3 | Very low | 32.9 | Very low | 142 Ų | 142 | 152.8 Ų | 152.8 | 66% | 0.664 | 82% | 0.822 | S | S | * | * | trans | 91 | 120.6 | 146.6 | -76.8 | -115.7 | 110.2 | 0 | 0 | 122.9 | ||||
| 165 | R | 30.5 | Very low | 33.4 | Very low | 221 Ų | 221 | 154.2 Ų | 154.2 | 83% | 0.834 | 82% | 0.82 | S | S | * | * | trans | 91.1 | 146.4 | 147.9 | -79.6 | 178.5 | -99.6 | 152 | -1.8 | 121.7 | ||||
| 166 | D | 35.8 | Very low | 33.8 | Very low | 150 Ų | 150 | 155.8 Ų | 155.8 | 80% | 0.802 | 82% | 0.819 | S | S | * | * | trans | -140.6 | 173.5 | -159.4 | -176.6 | 52.5 | 0 | 0 | 0 | 107.4 | ||||
| 167 | P | 51.3 | Low | 34 | Very low | 111 Ų | 111 | 151.5 Ų | 151.5 | 72% | 0.721 | 82% | 0.815 | S | S | * | * | cis | -122.4 | 178.8 | -18.7 | 17.7 | 5.8 | 0 | 0 | 0 | 114 | ||||
| 168 | G | 27.2 | Very low | 34.6 | Very low | 65 Ų | 65 | 152.4 Ų | 152.4 | 67% | 0.67 | 82% | 0.819 | S | S | * | * | trans | 151.9 | 117.2 | 141.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 169 | Y | 32.1 | Very low | 35.7 | Very low | 249 Ų | 249 | 152 Ų | 152 | 98% | 0.976 | 82% | 0.816 | S | S | * | * | trans | 54.8 | 146.7 | 158.9 | -77.3 | -103.1 | 0 | 0 | 0 | 118.5 | ||||
| 170 | G | 29.4 | Very low | 36.6 | Very low | 57 Ų | 57 | 155.2 Ų | 155.2 | 59% | 0.588 | 81% | 0.814 | S | S | * | * | cis | 138.2 | 101.1 | 4.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 171 | E | 31.5 | Very low | 37.5 | Very low | 199 Ų | 199 | 160 Ų | 160 | 93% | 0.93 | 82% | 0.822 | S | S | * | * | trans | 59.6 | 140.4 | 177.1 | -75.8 | 159.1 | 111.1 | 0 | 0 | 116.5 | ||||
| 172 | D | 30.3 | Very low | 38.5 | Very low | 151 Ų | 151 | 158.7 Ų | 158.7 | 81% | 0.807 | 82% | 0.819 | S | S | * | * | -161.3 | 164.1 | 60.2 | -169 | 9.1 | 0 | 0 | 0 | 112.6 | |||||
| 173 | Q | 36.7 | Very low | 39.4 | Very low | 165 Ų | 165 | 157.3 Ų | 157.3 | 77% | 0.771 | 82% | 0.815 | S | S | * | * | trans | -82.8 | 137.4 | 177.7 | -57.3 | 177 | 21.2 | 0 | 0 | 112.2 | ||||
| 174 | S | 33 | Very low | 40.2 | Very low | 111 Ų | 111 | 154.2 Ų | 154.2 | 78% | 0.776 | 81% | 0.811 | S | S | * | * | trans | -157.1 | 105.6 | 155.6 | -93.7 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 175 | K | 45.3 | Very low | 40.6 | Very low | 208 Ų | 208 | 155.5 Ų | 155.5 | 90% | 0.904 | 82% | 0.822 | S | S | * | * | trans | -35.5 | 129.8 | 168.1 | -57.8 | 156.5 | -175.3 | 169.6 | 0 | 113.2 | ||||
| 176 | K | 42.5 | Very low | 41.5 | Very low | 205 Ų | 205 | 152.9 Ų | 152.9 | 89% | 0.891 | 82% | 0.822 | S | S | * | * | trans | -131.4 | 131 | 160.7 | -70.3 | -175.4 | -178.3 | 170.1 | 0 | 111.1 | ||||
| 177 | A | 40.4 | Very low | 41.9 | Very low | 94 Ų | 94 | 150.8 Ų | 150.8 | 78% | 0.777 | 82% | 0.819 | S | S | * | * | trans | -76.4 | 150.9 | -169.7 | 0 | 0 | 0 | 0 | 0 | 113 | K179 | A177-K179 PolarHBondContact O-N 3.37Š| ||
| 178 | K | 47.1 | Very low | 41.5 | Very low | 209 Ų | 209 | 153 Ų | 153 | 91% | 0.909 | 82% | 0.824 | S | S | * | * | trans | -61.7 | 105.8 | 173.6 | -63.7 | -176.1 | 177 | -171.7 | 0 | 110.1 | K180 | K178-K180 PolarHBondContact O-N 3.22Š| ||
| 179 | K | 52.3 | Low | 42.2 | Very low | 198 Ų | 198 | 156 Ų | 156 | 86% | 0.861 | 83% | 0.829 | S | S | * | * | trans | -79 | 101.9 | 169.7 | -74 | -176.5 | 173.8 | -176.8 | 0 | 109.1 | A177 L181 | A177-K179 PolarHBondContact O-N 3.37Å; K179-L181 PolarHBondContact O-N 3.45Å | ||
| 180 | K | 50.3 | Low | 42.7 | Very low | 199 Ų | 199 | 152.7 Ų | 152.7 | 87% | 0.865 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 125.2 | 163.5 | -75.1 | -175.8 | 171.7 | -173.4 | 0 | 108.5 | K178 | K178-K180 PolarHBondContact O-N 3.22Š|
| 181 | L | 46 | Very low | 43.3 | Very low | 170 Ų | 170 | 157.6 Ų | 157.6 | 89% | 0.89 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -92.8 | 118 | 164.6 | -67.9 | 170.1 | 0 | 0 | 0 | 107.3 | K179 | K179-L181 PolarHBondContact O-N 3.45Š|
| 182 | S | 49.6 | Very low | 43.6 | Very low | 117 Ų | 117 | 158.2 Ų | 158.2 | 82% | 0.818 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 121 | 168.2 | -60.8 | 0 | 0 | 0 | 0 | 108.3 | ||
| 183 | A | 49.1 | Very low | 44 | Very low | 95 Ų | 95 | 155.7 Ų | 155.7 | 79% | 0.785 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 139.8 | 168.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 184 | P | 49.8 | Very low | 44 | Very low | 122 Ų | 122 | 157.3 Ų | 157.3 | 79% | 0.792 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 144.4 | 172.1 | 30.1 | -33 | 0 | 0 | 0 | 111.4 | ||
| 185 | D | 42.6 | Very low | 44.1 | Very low | 169 Ų | 169 | 156 Ų | 156 | 90% | 0.904 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 137.6 | 171.9 | -100.7 | -44.3 | 0 | 0 | 0 | 111.3 | ||
| 186 | M | 50.4 | Low | 43.6 | Very low | 166 Ų | 166 | 152.1 Ų | 152.1 | 82% | 0.818 | 84% | 0.839 | S | S | * | * | trans | -112.3 | 96.8 | 169.3 | 56.2 | 163.5 | -167.5 | 0 | 0 | 110.9 | ||||
| 187 | S | 43.4 | Very low | 43.4 | Very low | 106 Ų | 106 | 150 Ų | 150 | 74% | 0.741 | 84% | 0.836 | S | S | * | * | trans | -83.1 | 114 | 165.9 | 44.7 | 0 | 0 | 0 | 0 | 110 | T189 | S187-T189 PolarHBondContact O-N 2.93Š| ||
| 188 | L | 43.5 | Very low | 43.1 | Very low | 157 Ų | 157 | 153.4 Ų | 153.4 | 82% | 0.822 | 84% | 0.841 | S | S | * | * | trans | -92.3 | 93.9 | 172.4 | -69.9 | 174.2 | 0 | 0 | 0 | 110 | ||||
| 189 | T | 40.3 | Very low | 42.5 | Very low | 129 Ų | 129 | 149.1 Ų | 149.1 | 79% | 0.791 | 84% | 0.837 | S | S | * | * | trans | -94.3 | 110.5 | 164.8 | 48.6 | 0 | 0 | 0 | 0 | 109.2 | S187 D191 | S187-T189 PolarHBondContact O-N 2.93Å; T189-D191 PolarHBondContact O-N 2.98Å | ||
| 190 | L | 42.5 | Very low | 41.7 | Very low | 179 Ų | 179 | 147.1 Ų | 147.1 | 94% | 0.937 | 84% | 0.836 | S | S | * | * | trans | -79.6 | 112.7 | 167.8 | -79.4 | 166.7 | 0 | 0 | 0 | 108.7 | ||||
| 191 | D | 43.5 | Very low | 41.3 | Very low | 161 Ų | 161 | 146 Ų | 146 | 86% | 0.861 | 83% | 0.833 | S | S | * | * | trans | -86.3 | 157.5 | 173.8 | -166.9 | 23 | 0 | 0 | 0 | 111.8 | T189 | T189-D191 PolarHBondContact O-N 2.98Š| ||
| 192 | R | 37.8 | Very low | 40.9 | Very low | 211 Ų | 211 | 145.5 Ų | 145.5 | 80% | 0.796 | 83% | 0.831 | S | S | * | * | trans | -107 | 113.5 | -165.9 | 177.7 | 177.6 | 174.5 | 176.9 | -3 | 111 | ||||
| 193 | S | 37.3 | Very low | 40.6 | Very low | 98 Ų | 98 | 147.5 Ų | 147.5 | 69% | 0.685 | 83% | 0.827 | S | S | * | * | trans | 17 | 125.7 | 157.1 | 64.7 | 0 | 0 | 0 | 0 | 120 | ||||
| 194 | E | 36.8 | Very low | 40.6 | Very low | 200 Ų | 200 | 151 Ų | 151 | 94% | 0.935 | 83% | 0.827 | S | S | * | * | trans | -161.2 | 145.8 | 134.1 | 35.7 | -145.7 | 150.4 | 0 | 0 | 113.4 | ||||
| 195 | G | 35.3 | Very low | 40.2 | Very low | 82 Ų | 82 | 152.7 Ų | 152.7 | 85% | 0.845 | 83% | 0.828 | S | S | * | * | trans | 133.2 | 72.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 196 | S | 35.2 | Very low | 40 | Very low | 127 Ų | 127 | 149 Ų | 149 | 89% | 0.888 | 81% | 0.812 | S | S | * | * | -162.4 | 126.2 | 126.6 | -162.1 | 0 | 0 | 0 | 0 | 111 | |||||
| 197 | L | 37.6 | Very low | 39.9 | Very low | 160 Ų | 160 | 148 Ų | 148 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | trans | -88.1 | 138.5 | 179.8 | -58.9 | 162.2 | 0 | 0 | 0 | 109.7 | ||||
| 198 | L | 34.1 | Very low | 39.7 | Very low | 167 Ų | 167 | 151.4 Ų | 151.4 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | -156.4 | 112.4 | 137.9 | -84.1 | -163.7 | 0 | 0 | 0 | 110.8 | ||||
| 199 | S | 35.3 | Very low | 39.9 | Very low | 119 Ų | 119 | 151.4 Ų | 151.4 | 83% | 0.832 | 82% | 0.82 | S | S | * | * | trans | 32.9 | 117.5 | 147.9 | -47.8 | 0 | 0 | 0 | 0 | 121 | ||||
| 200 | D | 35.2 | Very low | 40.5 | Very low | 156 Ų | 156 | 152.4 Ų | 152.4 | 83% | 0.834 | 82% | 0.82 | S | S | * | * | trans | -110.4 | 114.9 | 163.1 | -175.9 | 22.9 | 0 | 0 | 0 | 108.2 | ||||
| 201 | E | 41.9 | Very low | 40.7 | Very low | 174 Ų | 174 | 151.7 Ų | 151.7 | 81% | 0.813 | 82% | 0.817 | S | S | * | * | trans | -155.3 | 96.1 | 161.9 | -165.8 | 162.5 | -166.6 | 0 | 0 | 108.6 | ||||
| 202 | L | 37.5 | Very low | 41 | Very low | 161 Ų | 161 | 151.6 Ų | 151.6 | 84% | 0.843 | 82% | 0.816 | S | S | * | * | trans | -99.6 | 101 | 179.1 | 174.6 | 67.4 | 0 | 0 | 0 | 109.3 | ||||
| 203 | E | 44.4 | Very low | 41.3 | Very low | 158 Ų | 158 | 150.1 Ų | 150.1 | 74% | 0.738 | 82% | 0.82 | S | S | * | * | trans | -99 | 121.1 | 164.1 | -72.2 | -165.8 | 148.3 | 0 | 0 | 110.9 | ||||
| 204 | E | 47.1 | Very low | 41.4 | Very low | 168 Ų | 168 | 154.7 Ų | 154.7 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | trans | 30.6 | 99.7 | 130.9 | -166.4 | 169.5 | -173.7 | 0 | 0 | 118.3 | ||||
| 205 | I | 41.7 | Very low | 42 | Very low | 159 Ų | 159 | 151.5 Ų | 151.5 | 82% | 0.815 | 83% | 0.825 | S | S | * | * | trans | -133 | 101.8 | 147.6 | -54.6 | 179.9 | 0 | 0 | 0 | 108.6 | ||||
| 206 | T | 38.4 | Very low | 42.6 | Very low | 91 Ų | 91 | 153.3 Ų | 153.3 | 56% | 0.558 | 82% | 0.822 | S | S | * | * | trans | -88.1 | 167.6 | 155.4 | 57 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 207 | D | 48.6 | Very low | 42.6 | Very low | 144 Ų | 144 | 152.5 Ų | 152.5 | 77% | 0.77 | 82% | 0.817 | S | S | * | * | trans | 66.6 | 91.7 | 157.5 | -44 | -44.4 | 0 | 0 | 0 | 118.2 | ||||
| 208 | L | 40.4 | Very low | 42.5 | Very low | 178 Ų | 178 | 152.2 Ų | 152.2 | 93% | 0.932 | 82% | 0.816 | S | S | * | * | trans | -126 | 112.6 | 149.2 | -89.7 | 167 | 0 | 0 | 0 | 108.4 | ||||
| 209 | D | 46.3 | Very low | 42.7 | Very low | 158 Ų | 158 | 151.2 Ų | 151.2 | 85% | 0.845 | 81% | 0.811 | S | S | * | * | trans | -85.3 | 161.9 | -169.3 | -153.4 | -1.3 | 0 | 0 | 0 | 112.8 | ||||
| 210 | L | 52.8 | Low | 43.1 | Very low | 150 Ų | 150 | 150.1 Ų | 150.1 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -88.1 | 120.1 | 176.6 | -63.7 | 165.8 | 0 | 0 | 0 | 109.9 | ||||
| 211 | D | 47.2 | Very low | 43.1 | Very low | 164 Ų | 164 | 150.3 Ų | 150.3 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | trans | 171 | 97.2 | 141.3 | -93 | -19.9 | 0 | 0 | 0 | 110.4 | ||||
| 212 | D | 50.1 | Low | 43.1 | Very low | 158 Ų | 158 | 148.3 Ų | 148.3 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | trans | -170.1 | 113.9 | 138.2 | -126.7 | -22.5 | 0 | 0 | 0 | 111.6 | ||||
| 213 | M | 44.6 | Very low | 42.9 | Very low | 180 Ų | 180 | 148.9 Ų | 148.9 | 89% | 0.887 | 79% | 0.791 | S | S | * | * | 163.3 | 116.9 | 122.9 | -85.5 | -153.8 | -61.3 | 0 | 0 | 110.8 | |||||
| 214 | E | 39.9 | Very low | 42.8 | Very low | 195 Ų | 195 | 147.9 Ų | 147.9 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | trans | -71 | 149.3 | 174.7 | -69.1 | -179.2 | 108.3 | 0 | 0 | 113.4 | ||||
| 215 | T | 47.5 | Very low | 42.4 | Very low | 133 Ų | 133 | 151.5 Ų | 151.5 | 82% | 0.816 | 79% | 0.793 | S | S | * | * | trans | -64.1 | 171 | 156.1 | 8.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 216 | P | 49.9 | Very low | 42.1 | Very low | 120 Ų | 120 | 152.6 Ų | 152.6 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | cis | -141.3 | -176.8 | 17.9 | 41.3 | -21.4 | 0 | 0 | 0 | 116.1 | ||||
| 217 | S | 33.8 | Very low | 42.2 | Very low | 110 Ų | 110 | 154.7 Ų | 154.7 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | 172.6 | 111.7 | 127.4 | -176.9 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 218 | D | 36 | Very low | 41.6 | Very low | 153 Ų | 153 | 152.9 Ų | 152.9 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | trans | 20.8 | 114.7 | 134 | -163.3 | 13.3 | 0 | 0 | 0 | 120.6 | ||||
| 219 | N | 39 | Very low | 41.8 | Very low | 147 Ų | 147 | 152 Ų | 152 | 79% | 0.786 | 80% | 0.802 | S | S | * | * | trans | -162.3 | 121 | 139.4 | -175.7 | -2.2 | 0 | 0 | 0 | 110.9 | ||||
| 220 | S | 43.4 | Very low | 41.5 | Very low | 96 Ų | 96 | 151 Ų | 151 | 67% | 0.671 | 80% | 0.797 | S | S | * | * | trans | -48.2 | 141.1 | 174.3 | 50.3 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 221 | N | 35.2 | Very low | 40.9 | Very low | 160 Ų | 160 | 151.1 Ų | 151.1 | 86% | 0.856 | 80% | 0.797 | S | S | * | * | -148.3 | 141.7 | 115.5 | -165.5 | 43.5 | 0 | 0 | 0 | 112.3 | |||||
| 222 | E | 41.8 | Very low | 41.2 | Very low | 131 Ų | 131 | 148.1 Ų | 148.1 | 61% | 0.612 | 79% | 0.787 | S | S | * | * | trans | -79.9 | 141.6 | -175.1 | -179.1 | -179.8 | -179.3 | 0 | 0 | 111.9 | ||||
| 223 | F | 33.8 | Very low | 40.5 | Very low | 173 Ų | 173 | 150.7 Ų | 150.7 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | -173.1 | 133.2 | 114 | -113.7 | -83.4 | 0 | 0 | 0 | 112.7 | |||||
| 224 | E | 41.9 | Very low | 40.2 | Very low | 138 Ų | 138 | 147.1 Ų | 147.1 | 65% | 0.645 | 78% | 0.781 | S | S | * | * | trans | -71 | 147.4 | -175.1 | -54.4 | 165.5 | 128.6 | 0 | 0 | 112.7 | ||||
| 225 | W | 38.3 | Very low | 40.5 | Very low | 243 Ų | 243 | 147.6 Ų | 147.6 | 92% | 0.92 | 78% | 0.78 | S | S | * | * | trans | -148.6 | 97.9 | 130.8 | -74.7 | 115.2 | 0 | 0 | 0 | 109.1 | V227 | W225-V227 PolarHBondContact O-N 3.42Š| ||
| 226 | E | 35 | Very low | 40.4 | Very low | 182 Ų | 182 | 146.8 Ų | 146.8 | 85% | 0.85 | 78% | 0.775 | S | S | * | * | trans | -62.3 | 122.9 | 160.6 | -67.3 | -170.3 | 142.8 | 0 | 0 | 108.9 | ||||
| 227 | V | 39.8 | Very low | 40.5 | Very low | 136 Ų | 136 | 146.7 Ų | 146.7 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | trans | -107.1 | 111.1 | 162.9 | 174.6 | 0 | 0 | 0 | 0 | 106.7 | W225 | W225-V227 PolarHBondContact O-N 3.42Š| ||
| 228 | S | 37.1 | Very low | 41.1 | Very low | 105 Ų | 105 | 149.7 Ų | 149.7 | 73% | 0.734 | 77% | 0.774 | S | S | * | * | trans | -62.6 | 150.7 | 176.9 | -49.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 229 | D | 45 | Very low | 41.7 | Very low | 160 Ų | 160 | 149.1 Ų | 149.1 | 86% | 0.856 | 77% | 0.77 | S | S | * | * | trans | -36.6 | 131 | 164.9 | -101.6 | -39.3 | 0 | 0 | 0 | 113.3 | ||||
| 230 | D | 39.7 | Very low | 42 | Very low | 136 Ų | 136 | 148.2 Ų | 148.2 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | -177.3 | 113.9 | 100.3 | -143.3 | -17.1 | 0 | 0 | 0 | 112.7 | |||||
| 231 | L | 40.5 | Very low | 42 | Very low | 153 Ų | 153 | 150.8 Ų | 150.8 | 80% | 0.801 | 77% | 0.766 | S | S | * | * | trans | 68.4 | 167.1 | 153.1 | -120.1 | 72.2 | 0 | 0 | 0 | 121 | ||||
| 232 | P | 52.9 | Low | 42.4 | Very low | 102 Ų | 102 | 151.8 Ų | 151.8 | 66% | 0.662 | 76% | 0.762 | S | S | * | * | -121.3 | 163.2 | -90.4 | 40.5 | -28 | 0 | 0 | 0 | 115.1 | |||||
| 233 | K | 34.3 | Very low | 42.3 | Very low | 211 Ų | 211 | 150.7 Ų | 150.7 | 92% | 0.917 | 77% | 0.765 | S | S | * | * | trans | -157.1 | 162.9 | 167.4 | -108.7 | 131 | -172.4 | 178 | 0 | 116.6 | ||||
| 234 | P | 39.9 | Very low | 43 | Very low | 106 Ų | 106 | 147 Ų | 147 | 69% | 0.688 | 76% | 0.756 | S | S | * | * | trans | -106.4 | 176 | -153.1 | 41.8 | -38.2 | 0 | 0 | 0 | 116.6 | T236 | P234-T236 PolarHBondContact O-N 3.02Š| ||
| 235 | K | 45.1 | Very low | 43.1 | Very low | 205 Ų | 205 | 147.2 Ų | 147.2 | 89% | 0.891 | 76% | 0.762 | S | S | * | * | trans | -64.9 | 113.5 | 178.9 | -54.3 | 174.6 | -179.1 | -175.8 | 0 | 113.2 | ||||
| 236 | T | 46.3 | Very low | 43.6 | Very low | 116 Ų | 116 | 140.6 Ų | 140.6 | 71% | 0.712 | 75% | 0.753 | S | S | * | * | trans | -149.5 | 55.8 | 169.9 | 55.4 | 0 | 0 | 0 | 0 | 113.4 | P234 | P234-T236 PolarHBondContact O-N 3.02Š| ||
| 237 | T | 51.4 | Low | 44.3 | Very low | 117 Ų | 117 | 137.9 Ų | 137.9 | 72% | 0.718 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -120.7 | -27.1 | 178 | 40.6 | 0 | 0 | 0 | 0 | 115.2 | I239 | T237-I239 PolarHBondContact O-N 2.98Š|
| 238 | E | 46.4 | Very low | 44.9 | Very low | 174 Ų | 174 | 138.2 Ų | 138.2 | 81% | 0.813 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -73.5 | -21 | -178.1 | -67.4 | -178.4 | 142.8 | 0 | 0 | 114.9 | ||
| 239 | I | 48.1 | Very low | 45.7 | Very low | 141 Ų | 141 | 142.1 Ų | 142.1 | 72% | 0.723 | 75% | 0.747 | S | S | * | * | H | α-helix | trans | -76.5 | -31.7 | -176.5 | -60.8 | 175.6 | 0 | 0 | 0 | 111.7 | T237 | T237-I239 PolarHBondContact O-N 2.98Å |
| 240 | L | 46.9 | Very low | 45.8 | Very low | 128 Ų | 128 | 139.9 Ų | 139.9 | 67% | 0.67 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -82.9 | -30.6 | -171.2 | -143.5 | 159.5 | 0 | 0 | 0 | 112.2 | T243 | L240-T243 PolarHBondContact O-N 3.28Å; L240-T243 PolarHBondContact O-OG1 2.89Å |
| 241 | Q | 43.1 | Very low | 47.2 | Very low | 150 Ų | 150 | 135.7 Ų | 135.7 | 70% | 0.701 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -72.6 | -34.3 | 179.8 | -151.1 | 159 | 17.8 | 0 | 0 | 112 | T243 V244 | Q241-T243 PolarHBondContact O-N 2.84Å; Q241-V244 PolarHBondContact O-N 3.24Å |
| 242 | K | 42.5 | Very low | 48.3 | Very low | 181 Ų | 181 | 131.8 Ų | 131.8 | 79% | 0.787 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | -12.2 | 176.6 | -166.3 | 167.2 | -176.9 | 174.1 | 0 | 114.4 | ||
| 243 | T | 40.4 | Very low | 48.5 | Very low | 107 Ų | 107 | 131.7 Ų | 131.7 | 66% | 0.656 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.3 | -0.4 | 178.7 | 44.5 | 0 | 0 | 0 | 0 | 114.9 | L240 Q241 | L240-T243 PolarHBondContact O-N 3.28Å; L240-T243 PolarHBondContact O-OG1 2.89Å; Q241-T243 PolarHBondContact O-N 2.84Å |
| 244 | V | 47.6 | Very low | 49.7 | Very low | 97 Ų | 97 | 126.1 Ų | 126.1 | 59% | 0.588 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.3 | -34.2 | -179 | -179.7 | 0 | 0 | 0 | 0 | 112.2 | Q241 S246 | Q241-V244 PolarHBondContact O-N 3.24Å; V244-S246 VanDerWaalsContact C-N 3.25Å; V244-S246 PolarHBondContact O-N 3.41Å; V244-S246 VanDerWaalsContact O-N 3.08Å |
| 245 | D | 44.9 | Very low | 50.7 | Low | 141 Ų | 141 | 127.2 Ų | 127.2 | 75% | 0.754 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -86.9 | 37 | -175.8 | -60.3 | -31.5 | 0 | 0 | 0 | 114.4 | ||
| 246 | S | 48.8 | Very low | 51.3 | Low | 105 Ų | 105 | 127.3 Ų | 127.3 | 73% | 0.734 | 66% | 0.664 | S | S | * | * | trans | -150.7 | 49.6 | 169.7 | -150.6 | 0 | 0 | 0 | 0 | 112.4 | V244 Q248 | V244-S246 VanDerWaalsContact C-N 3.25Å; V244-S246 PolarHBondContact O-N 3.41Å; V244-S246 VanDerWaalsContact O-N 3.08Å; S246-Q248 PolarHBondContact O-N 2.91Å | ||
| 247 | V | 49.2 | Very low | 51.6 | Low | 125 Ų | 125 | 128.1 Ų | 128.1 | 76% | 0.758 | 66% | 0.66 | S | S | * | * | trans | -78.9 | 103.1 | 153.2 | -178.8 | 0 | 0 | 0 | 0 | 106.3 | E249 | V247-E249 PolarHBondContact O-N 3.11Å; V247-E249 VanDerWaalsContact O-N 3.14Å | ||
| 248 | Q | 53 | Low | 51.6 | Low | 143 Ų | 143 | 127.8 Ų | 127.8 | 67% | 0.668 | 65% | 0.65 | S | S | * | * | trans | -70.1 | 107.3 | 175.5 | -174.1 | 164.5 | -1.1 | 0 | 0 | 108.5 | S246 Y250 | S246-Q248 PolarHBondContact O-N 2.91Å; Q248-Y250 WeakPolarHBondContact O-CD2 3.24Å; Q248-Y250 PolarHBondContact O-N 3.43Å; Q248-Y250 VanDerWaalsContact O-N 3.11Å | ||
| 249 | E | 54.5 | Low | 52.1 | Low | 186 Ų | 186 | 120.5 Ų | 120.5 | 87% | 0.869 | 62% | 0.622 | S | S | * | * | trans | -67.3 | 108.4 | 178.1 | -67.6 | -171.6 | 147.7 | 0 | 0 | 109.9 | V247 | V247-E249 PolarHBondContact O-N 3.11Å; V247-E249 VanDerWaalsContact O-N 3.14Å | ||
| 250 | Y | 46.2 | Very low | 52.9 | Low | 114 Ų | 114 | 119.9 Ų | 119.9 | 45% | 0.447 | 61% | 0.611 | S | S | . | * | trans | -73.5 | 143.1 | 176.5 | -68.7 | -72.3 | 0 | 0 | 0 | 111.2 | Q248 E254 E258 | Q248-Y250 WeakPolarHBondContact O-CD2 3.24Å; Q248-Y250 PolarHBondContact O-N 3.43Å; Q248-Y250 VanDerWaalsContact O-N 3.11Å; Y250-E254 HydrophobicContact CD1-CB 3.94Å; Y250-E254 HydrophobicContact CG-CB 4.36Å; Y250-E258 WeakPolarHBondContact CD2-OE2 3.49Å; Y250-E258 WeakPolarHBondContact CE2-OE1 3.48Å; Y250-E258 WeakPolarHBondContact CE2-OE2 3.45Å | ||
| 251 | S | 69.6 | Low | 54.6 | Low | 47 Ų | 47 | 122.1 Ų | 122.1 | 33% | 0.329 | 61% | 0.61 | S | S | . | * | trans | -62.2 | 154.3 | 168.7 | 65.7 | 0 | 0 | 0 | 0 | 111 | T253 E254 E255 | S251-T253 PolarHBondContact O-N 2.92Å; S251-T253 PolarHBondContact OG-OG1 3.47Å; S251-E254 WeakPolarHBondContact CB-OE2 3.34Å; S251-E254 PolarHBondContact N-OE2 3.33Å; S251-E254 CarbonylContact O-C 3.55Å; S251-E254 WeakPolarHBondContact O-CA 3.39Å; S251-E254 PolarHBondContact O-N 2.99Å; S251-E254 VanDerWaalsContact OG-CD 3.27Å; S251-E254 VanDerWaalsContact OG-CG 3.3Å; S251-E254 WeakPolarHBondContact OG-CG 3.38Å; S251-E254 PolarHBondContact OG-N 2.63Å; S251-E254 PolarHBondContact OG-OE2 3.5Å; S251-E255 PolarHBondContact O-N 3.41Å | ||
| 252 | A | 62.4 | Low | 56.8 | Low | 71 Ų | 71 | 120.2 Ų | 120.2 | 59% | 0.587 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60 | -15.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | R256 | A252-R256 WeakPolarHBondContact O-CG 3.37Š|
| 253 | T | 56.9 | Low | 59.1 | Low | 100 Ų | 100 | 117.4 Ų | 117.4 | 61% | 0.613 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | -46 | 167.8 | 31 | 0 | 0 | 0 | 0 | 112.2 | S251 R256 E257 | S251-T253 PolarHBondContact O-N 2.92Å; S251-T253 PolarHBondContact OG-OG1 3.47Å; T253-R256 WeakPolarHBondContact O-CB 3.41Å; T253-R256 PolarHBondContact O-N 3.21Å; T253-E257 PolarHBondContact O-N 3.05Å; T253-E257 VanDerWaalsContact O-N 3.14Å |
| 254 | E | 60.2 | Low | 61.6 | Low | 94 Ų | 94 | 116.3 Ų | 116.3 | 44% | 0.439 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -68.1 | -37.1 | 176.6 | -70.6 | 161.5 | 130.8 | 0 | 0 | 111.8 | Y250 S251 R256 E257 E258 | Y250-E254 HydrophobicContact CD1-CB 3.94Å; Y250-E254 HydrophobicContact CG-CB 4.36Å; S251-E254 WeakPolarHBondContact CB-OE2 3.34Å; S251-E254 PolarHBondContact N-OE2 3.33Å; S251-E254 CarbonylContact O-C 3.55Å; S251-E254 WeakPolarHBondContact O-CA 3.39Å; S251-E254 PolarHBondContact O-N 2.99Å; S251-E254 VanDerWaalsContact OG-CD 3.27Å; S251-E254 VanDerWaalsContact OG-CG 3.3Å; S251-E254 WeakPolarHBondContact OG-CG 3.38Å; S251-E254 PolarHBondContact OG-N 2.63Å; S251-E254 PolarHBondContact OG-OE2 3.5Å; E254-R256 PolarHBondContact O-N 2.88Å; E254-E257 CarbonylContact O-C 3.51Å; E254-E257 WeakPolarHBondContact O-CA 3.27Å; E254-E257 PolarHBondContact O-N 3.29Å; E254-E258 WeakPolarHBondContact O-CB 3.48Å; E254-E258 PolarHBondContact O-N 3.02Å |
| 255 | E | 60.8 | Low | 63.6 | Low | 129 Ų | 129 | 112 Ų | 112 | 60% | 0.603 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.9 | -33.8 | 173.1 | -164 | -160.4 | 164.6 | 0 | 0 | 111.6 | S251 G259 | S251-E255 PolarHBondContact O-N 3.41Å; E255-G259 PolarHBondContact O-N 3.37Å |
| 256 | R | 58.9 | Low | 65.6 | Low | 208 Ų | 208 | 113.9 Ų | 113.9 | 79% | 0.785 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -73.2 | -27.3 | 173.3 | -76.1 | -180 | 176.1 | -156.5 | 0.3 | 113 | A252 T253 E254 | A252-R256 WeakPolarHBondContact O-CG 3.37Å; T253-R256 WeakPolarHBondContact O-CB 3.41Å; T253-R256 PolarHBondContact O-N 3.21Å; E254-R256 PolarHBondContact O-N 2.88Å |
| 257 | E | 52.7 | Low | 67.2 | Low | 132 Ų | 132 | 109.4 Ų | 109.4 | 62% | 0.617 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -83.1 | -40.3 | 174.8 | -68.6 | -167.6 | 165.2 | 0 | 0 | 112.8 | T253 E254 G259 R260 | T253-E257 PolarHBondContact O-N 3.05Å; T253-E257 VanDerWaalsContact O-N 3.14Å; E254-E257 CarbonylContact O-C 3.51Å; E254-E257 WeakPolarHBondContact O-CA 3.27Å; E254-E257 PolarHBondContact O-N 3.29Å; E257-G259 PolarHBondContact O-N 3.3Å; E257-R260 CarbonylContact O-C 3.6Å; E257-R260 WeakPolarHBondContact O-CA 3.46Å; E257-R260 WeakPolarHBondContact O-CB 3.37Å; E257-R260 PolarHBondContact O-N 2.94Å |
| 258 | E | 51.6 | Low | 68.6 | Low | 110 Ų | 110 | 105.4 Ų | 105.4 | 51% | 0.514 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.2 | -32.4 | 168.8 | -173.3 | 179.1 | -143.7 | 0 | 0 | 111 | Y250 E254 R260 | Y250-E258 WeakPolarHBondContact CD2-OE2 3.49Å; Y250-E258 WeakPolarHBondContact CE2-OE1 3.48Å; Y250-E258 WeakPolarHBondContact CE2-OE2 3.45Å; E254-E258 WeakPolarHBondContact O-CB 3.48Å; E254-E258 PolarHBondContact O-N 3.02Å; E258-R260 CarbonylContact O-C 3.5Å; E258-R260 PolarHBondContact O-N 3.26Å |
| 259 | G | 56.5 | Low | 69.8 | Low | 22 Ų | 22 | 106.4 Ų | 106.4 | 23% | 0.227 | 50% | 0.502 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -47.1 | -31 | 163.1 | 0 | 0 | 0 | 0 | 0 | 113 | E255 E257 K277 | E255-G259 PolarHBondContact O-N 3.37Å; E257-G259 PolarHBondContact O-N 3.3Å; G259-K277 WeakPolarHBondContact O-CD 3.37Å; G259-K277 PolarHBondContact O-NZ 2.94Å |
| 260 | R | 63.9 | Low | 71.3 | Confident | 128 Ų | 128 | 103.9 Ų | 103.9 | 48% | 0.483 | 49% | 0.49 | S | S | . | . | S | Bend | trans | -93.6 | 93.9 | 169.9 | -62 | -179.2 | -175.8 | 149.8 | 2 | 109.7 | E257 E258 W262 | E257-R260 CarbonylContact O-C 3.6Å; E257-R260 WeakPolarHBondContact O-CA 3.46Å; E257-R260 WeakPolarHBondContact O-CB 3.37Å; E257-R260 PolarHBondContact O-N 2.94Å; E258-R260 CarbonylContact O-C 3.5Å; E258-R260 PolarHBondContact O-N 3.26Å; R260-W262 VanDerWaalsContact C-N 3.28Å; R260-W262 HydrophobicContact CB-CZ2 4.35Å; R260-W262 PolarHBondContact O-N 3.49Å |
| 261 | R | 83 | Confident | 73.4 | Confident | 175 Ų | 175 | 102.9 Ų | 102.9 | 66% | 0.66 | 49% | 0.492 | S | S | * | . | trans | -64.5 | 84 | 173.3 | -172.4 | -178.3 | -65.3 | 162.3 | 2.3 | 110.8 | M276 | R261-M276 HydrophobicContact CB-CB 4.31Å; R261-M276 HydrophobicContact CG-CB 4.38Å; R261-M276 WeakPolarHBondContact O-CA 3.43Å; R261-M276 WeakPolarHBondContact O-CB 3.24Å; R261-M276 VanDerWaalsContact O-CG 3.25Å; R261-M276 WeakPolarHBondContact O-CG 3.46Å; R261-M276 PolarHBondContact O-N 3.15Å | ||
| 262 | W | 89.4 | Confident | 74.4 | Confident | 109 Ų | 109 | 102.7 Ų | 102.7 | 41% | 0.413 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.5 | 138.8 | 178.2 | -66.5 | 101.9 | 0 | 0 | 0 | 111.3 | R260 R273 V274 D275 Y317 | R260-W262 VanDerWaalsContact C-N 3.28Å; R260-W262 HydrophobicContact CB-CZ2 4.35Å; R260-W262 PolarHBondContact O-N 3.49Å; W262-R273 HydrophobicContact CE3-CB 4.01Å; W262-R273 HydrophobicContact CZ3-CB 4.38Å; W262-V274 CarbonylContact C-O 3.6Å; W262-V274 WeakPolarHBondContact CA-O 3.28Å; W262-V274 VanDerWaalsContact CE3-C 3.43Å; W262-D275 HydrophobicContact CE3-CB 4.1Å; W262-D275 HydrophobicContact CH2-CB 3.97Å; W262-D275 HydrophobicContact CZ3-CB 3.75Å; W262-Y317 WeakPolarHBondContact CH2-OH 3.39Å |
| 263 | R | 91.6 | Very high | 75.8 | Confident | 123 Ų | 123 | 107 Ų | 107 | 46% | 0.464 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 137.6 | 167.3 | -175.2 | 170.7 | -177.7 | 171.5 | 3.5 | 109.4 | F265 V274 M276 | R263-F265 HydrophobicContact CB-CE2 4.08Å; R263-F265 HydrophobicContact CG-CD2 4.32Å; R263-F265 HydrophobicContact CG-CE2 3.82Å; R263-F265 HydrophobicContact CG-CZ 4.1Å; R263-V274 PolarHBondContact N-O 3.44Å; R263-V274 PolarHBondContact O-N 3.35Å; R263-M276 HydrophobicContact CB-CG 3.46Å; R263-M276 VanDerWaalsContact CB-CG 3.46Å; R263-M276 HydrophobicContact CB-SD 3.77Å; R263-M276 HydrophobicContact CG-SD 4.49Å |
| 264 | I | 91 | Very high | 77.6 | Confident | 83 Ų | 83 | 102.2 Ų | 102.2 | 43% | 0.426 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92 | 130 | 174.4 | -59 | 171.9 | 0 | 0 | 0 | 108.2 | R266 D271 R273 | I264-R266 HydrophobicContact CG2-CG 3.98Å; I264-D271 HydrophobicContact CG2-CB 3.91Å; I264-R273 HydrophobicContact CG1-CG 4.09Å |
| 265 | F | 90.6 | Very high | 79.2 | Confident | 8 Ų | 8 | 98.1 Ų | 98.1 | 4% | 0.035 | 44% | 0.439 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 134.7 | 168.1 | -68.4 | -89.1 | 0 | 0 | 0 | 108.5 | R263 F267 H272 V274 M276 Y325 L332 | R263-F265 HydrophobicContact CB-CE2 4.08Å; R263-F265 HydrophobicContact CG-CD2 4.32Å; R263-F265 HydrophobicContact CG-CE2 3.82Å; R263-F265 HydrophobicContact CG-CZ 4.1Å; F265-F267 HydrophobicContact CB-CD1 4Å; F265-F267 HydrophobicContact CB-CE1 4.12Å; F265-H272 PolarHBondContact N-O 3.37Å; F265-H272 PolarHBondContact O-N 3.21Å; F265-V274 HydrophobicContact CD2-CB 4.01Å; F265-V274 HydrophobicContact CD2-CG2 3.64Å; F265-V274 HydrophobicContact CE2-CB 4.03Å; F265-V274 HydrophobicContact CE2-CG1 4.35Å; F265-V274 HydrophobicContact CE2-CG2 4.07Å; F265-M276 HydrophobicContact CE2-SD 4.08Å; F265-M276 HydrophobicContact CZ-SD 4.38Å; F265-Y325 HydrophobicContact CE2-CD2 4.04Å; F265-Y325 AromaticContact CZ-CD2 3.6Å; F265-Y325 HydrophobicContact CZ-CD2 3.6Å; F265-Y325 HydrophobicContact CZ-CE2 4.09Å; F265-L332 HydrophobicContact CD1-CD1 4.48Å; F265-L332 HydrophobicContact CE1-CD1 4.29Å |
| 266 | R | 86.2 | Confident | 80.7 | Confident | 179 Ų | 179 | 92.8 Ų | 92.8 | 68% | 0.675 | 41% | 0.414 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 77.4 | -168.3 | -54 | -177.1 | 68.7 | -168.1 | -5.4 | 109.6 | I264 D271 | I264-R266 HydrophobicContact CG2-CG 3.98Å; R266-D271 VanDerWaalsContact CG-OD1 3.31Å; R266-D271 WeakPolarHBondContact CG-OD1 3.43Å; R266-D271 IonicContact CZ-OD1 3.08Å; R266-D271 IonicContact NE-OD1 2.93Å; R266-D271 PolarHBondContact NE-OD1 3.21Å; R266-D271 IonicContact NE-OD2 3.27Å; R266-D271 IonicContact NH2-OD1 2.7Å |
| 267 | F | 83.9 | Confident | 82.2 | Confident | 12 Ų | 12 | 88.8 Ų | 88.8 | 5% | 0.053 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 129.2 | -177.2 | 54 | -95 | 0 | 0 | 0 | 112.8 | F265 Q270 H272 K324 I327 E331 | F265-F267 HydrophobicContact CB-CD1 4Å; F265-F267 HydrophobicContact CB-CE1 4.12Å; F267-Q270 PolarHBondContact N-O 2.87Å; F267-H272 HydrophobicContact CD1-CB 4.37Å; F267-H272 AromaticContact CD1-ND1 3.9Å; F267-H272 AromaticContact CD2-CE1 3.58Å; F267-H272 AromaticContact CD2-ND1 3.77Å; F267-H272 HydrophobicContact CE1-CB 3.62Å; F267-H272 AromaticContact CE1-CG 3.54Å; F267-H272 AromaticContact CE1-ND1 3.65Å; F267-H272 AromaticContact CE2-CD2 3.78Å; F267-H272 AromaticContact CE2-CE1 3.22Å; F267-H272 WeakPolarHBondContact CE2-CE1 3.42Å; F267-H272 AromaticContact CE2-CG 3.83Å; F267-H272 AromaticContact CE2-ND1 3.51Å; F267-H272 AromaticContact CE2-NE2 3.41Å; F267-H272 WeakPolarHBondContact CE2-NE2 3.49Å; F267-H272 AromaticContact CG-ND1 3.97Å; F267-H272 HydrophobicContact CZ-CB 3.86Å; F267-H272 AromaticContact CZ-CD2 3.42Å; F267-H272 VanDerWaalsContact CZ-CD2 3.42Å; F267-H272 WeakPolarHBondContact CZ-CD2 3.44Å; F267-H272 AromaticContact CZ-CE1 3.59Å; F267-H272 AromaticContact CZ-CG 3.32Å; F267-H272 AromaticContact CZ-ND1 3.45Å; F267-H272 WeakPolarHBondContact CZ-ND1 3.37Å; F267-H272 AromaticContact CZ-NE2 3.59Å; F267-K324 HydrophobicContact CE1-CB 4.37Å; F267-K324 HydrophobicContact CZ-CB 4.28Å; F267-K324 HydrophobicContact CZ-CG 4.21Å; F267-I327 HydrophobicContact CB-CG2 4.28Å; F267-I327 HydrophobicContact CD1-CG2 4.11Å; F267-I327 HydrophobicContact CD2-CG2 3.64Å; F267-I327 HydrophobicContact CE1-CB 4.34Å; F267-I327 HydrophobicContact CE1-CG2 4.26Å; F267-I327 HydrophobicContact CE2-CB 4.35Å; F267-I327 HydrophobicContact CE2-CG2 3.8Å; F267-I327 HydrophobicContact CG-CG2 3.79Å; F267-I327 HydrophobicContact CZ-CB 4.21Å; F267-I327 HydrophobicContact CZ-CG2 4.1Å; F267-E331 WeakPolarHBondContact CA-OE2 3.42Å; F267-E331 WeakPolarHBondContact CB-OE2 3.4Å |
| 268 | G | 78.3 | Confident | 84.1 | Confident | 41 Ų | 41 | 83.8 Ų | 83.8 | 42% | 0.423 | 38% | 0.384 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.2 | -144.4 | -161.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q270 | G268-Q270 VanDerWaalsContact C-N 3.3Å; G268-Q270 PolarHBondContact O-N 3.02Å |
| 269 | D | 77.4 | Confident | 86.1 | Confident | 164 Ų | 164 | 78.5 Ų | 78.5 | 88% | 0.877 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | 23.4 | -179.1 | -53 | -51.1 | 0 | 0 | 0 | 113.2 | ||
| 270 | Q | 85.5 | Confident | 87.8 | Confident | 133 Ų | 133 | 82.3 Ų | 82.3 | 62% | 0.621 | 37% | 0.371 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -135.1 | 127.9 | -170.3 | -66.6 | -65.5 | -62.6 | 0 | 0 | 113.1 | F267 G268 H272 | F267-Q270 PolarHBondContact N-O 2.87Å; G268-Q270 VanDerWaalsContact C-N 3.3Å; G268-Q270 PolarHBondContact O-N 3.02Å; Q270-H272 PolarHBondContact O-N 3.07Å; Q270-H272 PolarHBondContact O-ND1 2.94Å |
| 271 | D | 90.4 | Very high | 89.2 | Confident | 92 Ų | 92 | 80.4 Ų | 80.4 | 49% | 0.492 | 38% | 0.375 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.6 | 107.6 | 176.6 | -85.1 | 25.9 | 0 | 0 | 0 | 110.6 | I264 R266 | I264-D271 HydrophobicContact CG2-CB 3.91Å; R266-D271 VanDerWaalsContact CG-OD1 3.31Å; R266-D271 WeakPolarHBondContact CG-OD1 3.43Å; R266-D271 IonicContact CZ-OD1 3.08Å; R266-D271 IonicContact NE-OD1 2.93Å; R266-D271 PolarHBondContact NE-OD1 3.21Å; R266-D271 IonicContact NE-OD2 3.27Å; R266-D271 IonicContact NH2-OD1 2.7Å |
| 272 | H | 90.4 | Very high | 89.7 | Confident | 44 Ų | 44 | 73.6 Ų | 73.6 | 20% | 0.204 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.9 | 109.3 | -177.2 | -68.2 | 80.8 | 0 | 0 | 0 | 111.3 | F265 F267 Q270 K324 | F265-H272 PolarHBondContact N-O 3.37Å; F265-H272 PolarHBondContact O-N 3.21Å; F267-H272 HydrophobicContact CD1-CB 4.37Å; F267-H272 AromaticContact CD1-ND1 3.9Å; F267-H272 AromaticContact CD2-CE1 3.58Å; F267-H272 AromaticContact CD2-ND1 3.77Å; F267-H272 HydrophobicContact CE1-CB 3.62Å; F267-H272 AromaticContact CE1-CG 3.54Å; F267-H272 AromaticContact CE1-ND1 3.65Å; F267-H272 AromaticContact CE2-CD2 3.78Å; F267-H272 AromaticContact CE2-CE1 3.22Å; F267-H272 WeakPolarHBondContact CE2-CE1 3.42Å; F267-H272 AromaticContact CE2-CG 3.83Å; F267-H272 AromaticContact CE2-ND1 3.51Å; F267-H272 AromaticContact CE2-NE2 3.41Å; F267-H272 WeakPolarHBondContact CE2-NE2 3.49Å; F267-H272 AromaticContact CG-ND1 3.97Å; F267-H272 HydrophobicContact CZ-CB 3.86Å; F267-H272 AromaticContact CZ-CD2 3.42Å; F267-H272 VanDerWaalsContact CZ-CD2 3.42Å; F267-H272 WeakPolarHBondContact CZ-CD2 3.44Å; F267-H272 AromaticContact CZ-CE1 3.59Å; F267-H272 AromaticContact CZ-CG 3.32Å; F267-H272 AromaticContact CZ-ND1 3.45Å; F267-H272 WeakPolarHBondContact CZ-ND1 3.37Å; F267-H272 AromaticContact CZ-NE2 3.59Å; Q270-H272 PolarHBondContact O-N 3.07Å; Q270-H272 PolarHBondContact O-ND1 2.94Å; H272-K324 HydrophobicContact CB-CD 4.45Å |
| 273 | R | 92.6 | Very high | 89.8 | Confident | 161 Ų | 161 | 70.4 Ų | 70.4 | 61% | 0.608 | 34% | 0.339 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -71.7 | 134.1 | 168.8 | -69.3 | -176.3 | -178 | -137.4 | 1.7 | 111.1 | W262 I264 | W262-R273 HydrophobicContact CE3-CB 4.01Å; W262-R273 HydrophobicContact CZ3-CB 4.38Å; I264-R273 HydrophobicContact CG1-CG 4.09Å |
| 274 | V | 94.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 71.6 Ų | 71.6 | 0% | 0 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.6 | 127.5 | -178.9 | 177.7 | 0 | 0 | 0 | 0 | 110.5 | W262 R263 F265 M276 I279 N321 K324 | W262-V274 CarbonylContact C-O 3.6Å; W262-V274 WeakPolarHBondContact CA-O 3.28Å; W262-V274 VanDerWaalsContact CE3-C 3.43Å; R263-V274 PolarHBondContact N-O 3.44Å; R263-V274 PolarHBondContact O-N 3.35Å; F265-V274 HydrophobicContact CD2-CB 4.01Å; F265-V274 HydrophobicContact CD2-CG2 3.64Å; F265-V274 HydrophobicContact CE2-CB 4.03Å; F265-V274 HydrophobicContact CE2-CG1 4.35Å; F265-V274 HydrophobicContact CE2-CG2 4.07Å; V274-M276 HydrophobicContact CG1-SD 4.18Å; V274-M276 PolarHBondContact O-N 3.45Å; V274-I279 HydrophobicContact CG1-CD1 3.75Å; V274-N321 WeakPolarHBondContact CA-OD1 3.38Å; V274-N321 HydrophobicContact CG1-CB 4.26Å; V274-N321 WeakPolarHBondContact CG1-O 3.31Å; V274-K324 HydrophobicContact CG2-CB 3.39Å; V274-K324 HydrophobicContact CG2-CD 4.08Å; V274-K324 HydrophobicContact CG2-CG 4.39Å |
| 275 | D | 93.6 | Very high | 90 | Very high | 7 Ų | 7 | 67.7 Ų | 67.7 | 4% | 0.037 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.4 | 102.6 | 175.1 | -179.2 | -17.5 | 0 | 0 | 0 | 110.2 | W262 K277 A278 I279 Y317 N321 | W262-D275 HydrophobicContact CE3-CB 4.1Å; W262-D275 HydrophobicContact CH2-CB 3.97Å; W262-D275 HydrophobicContact CZ3-CB 3.75Å; D275-K277 VanDerWaalsContact C-N 3.26Å; D275-K277 PolarHBondContact O-N 3.34Å; D275-K277 PolarHBondContact OD1-N 3.12Å; D275-A278 HydrophobicContact CB-CB 4.05Å; D275-A278 VanDerWaalsContact CG-CB 3.49Å; D275-A278 PolarHBondContact OD1-N 2.62Å; D275-A278 WeakPolarHBondContact OD2-CB 3.38Å; D275-I279 WeakPolarHBondContact O-CG1 3.45Å; D275-I279 PolarHBondContact O-N 3.15Å; D275-Y317 HydrophobicContact CB-CE1 4.41Å; D275-Y317 VanDerWaalsContact CB-OH 3.29Å; D275-Y317 WeakPolarHBondContact CB-OH 3.35Å; D275-Y317 PolarHBondContact OD2-OH 3.49Å; D275-N321 PolarHBondContact N-OD1 3.14Å |
| 276 | M | 92.5 | Very high | 90.1 | Very high | 18 Ų | 18 | 67.9 Ų | 67.9 | 9% | 0.089 | 33% | 0.328 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.8 | -11.5 | -176 | -59 | -69.4 | -72 | 0 | 0 | 113.8 | R261 R263 F265 V274 I279 K283 Y325 | R261-M276 HydrophobicContact CB-CB 4.31Å; R261-M276 HydrophobicContact CG-CB 4.38Å; R261-M276 WeakPolarHBondContact O-CA 3.43Å; R261-M276 WeakPolarHBondContact O-CB 3.24Å; R261-M276 VanDerWaalsContact O-CG 3.25Å; R261-M276 WeakPolarHBondContact O-CG 3.46Å; R261-M276 PolarHBondContact O-N 3.15Å; R263-M276 HydrophobicContact CB-CG 3.46Å; R263-M276 VanDerWaalsContact CB-CG 3.46Å; R263-M276 HydrophobicContact CB-SD 3.77Å; R263-M276 HydrophobicContact CG-SD 4.49Å; F265-M276 HydrophobicContact CE2-SD 4.08Å; F265-M276 HydrophobicContact CZ-SD 4.38Å; V274-M276 HydrophobicContact CG1-SD 4.18Å; V274-M276 PolarHBondContact O-N 3.45Å; M276-I279 HydrophobicContact SD-CD1 4Å; M276-K283 WeakPolarHBondContact O-CE 3.49Å; M276-K283 PolarHBondContact O-NZ 2.89Å; M276-Y325 HydrophobicContact CE-CD2 4.09Å; M276-Y325 HydrophobicContact CE-CE2 3.85Å; M276-Y325 HydrophobicContact SD-CD2 4.06Å; M276-Y325 HydrophobicContact SD-CE2 4.43Å |
| 277 | K | 90.9 | Very high | 90.4 | Very high | 124 Ų | 124 | 61.1 Ų | 61.1 | 54% | 0.539 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.9 | -47.3 | 173.5 | -177.7 | 174.5 | -178.9 | 174.8 | 0 | 110.2 | G259 D275 I279 E280 | G259-K277 WeakPolarHBondContact O-CD 3.37Å; G259-K277 PolarHBondContact O-NZ 2.94Å; D275-K277 VanDerWaalsContact C-N 3.26Å; D275-K277 PolarHBondContact O-N 3.34Å; D275-K277 PolarHBondContact OD1-N 3.12Å; K277-I279 PolarHBondContact O-N 3.49Å; K277-E280 VanDerWaalsContact O-CB 3.24Å; K277-E280 WeakPolarHBondContact O-CB 3.41Å; K277-E280 PolarHBondContact O-N 3.14Å |
| 278 | A | 91.8 | Very high | 90.8 | Very high | 26 Ų | 26 | 63.7 Ų | 63.7 | 22% | 0.215 | 32% | 0.321 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | -33.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | D275 Y317 | D275-A278 HydrophobicContact CB-CB 4.05Å; D275-A278 VanDerWaalsContact CG-CB 3.49Å; D275-A278 PolarHBondContact OD1-N 2.62Å; D275-A278 WeakPolarHBondContact OD2-CB 3.38Å; A278-Y317 HydrophobicContact CB-CD1 4.36Å; A278-Y317 HydrophobicContact CB-CE1 3.71Å |
| 279 | I | 93.9 | Very high | 91.4 | Very high | 0 Ų | 0 | 61.8 Ų | 61.8 | 0% | 0 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.8 | -1.6 | 178.3 | 71 | 175.4 | 0 | 0 | 0 | 114.2 | V274 D275 M276 K277 Y282 K283 N321 L322 Y325 | V274-I279 HydrophobicContact CG1-CD1 3.75Å; D275-I279 WeakPolarHBondContact O-CG1 3.45Å; D275-I279 PolarHBondContact O-N 3.15Å; M276-I279 HydrophobicContact SD-CD1 4Å; K277-I279 PolarHBondContact O-N 3.49Å; I279-Y282 CarbonylContact O-C 3.55Å; I279-Y282 WeakPolarHBondContact O-CA 3.3Å; I279-Y282 PolarHBondContact O-N 3.41Å; I279-K283 HydrophobicContact CG1-CG 4.27Å; I279-K283 PolarHBondContact O-N 3.22Å; I279-K283 VanDerWaalsContact O-N 3.08Å; I279-N321 HydrophobicContact CG2-CB 3.52Å; I279-L322 HydrophobicContact CB-CD1 4.27Å; I279-L322 HydrophobicContact CG2-CB 4.17Å; I279-Y325 VanDerWaalsContact CD1-CB 3.43Å; I279-Y325 HydrophobicContact CD1-CD1 4.07Å; I279-Y325 HydrophobicContact CD1-CD2 3.76Å; I279-Y325 HydrophobicContact CD1-CG 3.47Å; I279-Y325 VanDerWaalsContact CD1-CG 3.47Å |
| 280 | E | 92.4 | Very high | 91.9 | Very high | 101 Ų | 101 | 54.2 Ų | 54.2 | 47% | 0.472 | 26% | 0.262 | S | S | . | . | G | 310 helix | trans | -52.6 | -46.7 | -171.4 | 179.3 | 144.9 | -105.3 | 0 | 0 | 115.2 | K277 Y282 K283 | K277-E280 VanDerWaalsContact O-CB 3.24Å; K277-E280 WeakPolarHBondContact O-CB 3.41Å; K277-E280 PolarHBondContact O-N 3.14Å; E280-Y282 PolarHBondContact O-N 3.04Å; E280-Y282 VanDerWaalsContact O-N 3.14Å; E280-K283 PolarHBondContact O-N 2.8Å; E280-K283 IonicContact OE1-NZ 2.8Å; E280-K283 PolarHBondContact OE1-NZ 3.17Å |
| 281 | P | 93 | Very high | 92.1 | Very high | 88 Ų | 88 | 54.5 Ų | 54.5 | 57% | 0.571 | 26% | 0.258 | S | S | * | . | G | 310 helix | trans | -62.3 | -23.1 | 176.7 | -21.5 | 34.5 | 0 | 0 | 0 | 113.3 | ||
| 282 | Y | 93.8 | Very high | 91.7 | Very high | 33 Ų | 33 | 54.1 Ų | 54.1 | 13% | 0.129 | 25% | 0.25 | C | S | . | . | G | 310 helix | trans | -104.7 | -5.2 | -168.8 | -50.8 | -56.3 | 0 | 0 | 0 | 113.7 | I279 E280 K284 V285 F306 P308 Q312 I318 | I279-Y282 CarbonylContact O-C 3.55Å; I279-Y282 WeakPolarHBondContact O-CA 3.3Å; I279-Y282 PolarHBondContact O-N 3.41Å; E280-Y282 PolarHBondContact O-N 3.04Å; E280-Y282 VanDerWaalsContact O-N 3.14Å; Y282-K284 PolarHBondContact O-N 3.41Å; Y282-V285 VanDerWaalsContact O-CB 3.25Å; Y282-V285 WeakPolarHBondContact O-CB 3.39Å; Y282-V285 VanDerWaalsContact O-CG1 3.28Å; Y282-V285 WeakPolarHBondContact O-CG1 3.34Å; Y282-V285 PolarHBondContact O-N 3.18Å; Y282-F306 VanDerWaalsContact CD1-O 3.28Å; Y282-F306 WeakPolarHBondContact CD1-O 3.32Å; Y282-P308 HydrophobicContact CD1-CB 4.35Å; Y282-P308 HydrophobicContact CD2-CB 4.35Å; Y282-P308 HydrophobicContact CE1-CB 3.96Å; Y282-P308 HydrophobicContact CE2-CB 3.96Å; Y282-Q312 VanDerWaalsContact OH-CD 3.23Å; Y282-Q312 PolarHBondContact OH-NE2 2.99Å; Y282-Q312 PolarHBondContact OH-OE1 2.78Å; Y282-I318 HydrophobicContact CD2-CG2 3.59Å; Y282-I318 HydrophobicContact CE2-CG2 3.65Å |
| 283 | K | 92.2 | Very high | 91.3 | Very high | 41 Ų | 41 | 55.2 Ų | 55.2 | 18% | 0.178 | 27% | 0.273 | C | S | . | . | G | 310 helix | trans | -53.3 | -30.8 | 177.7 | -71.5 | 168.7 | -172.2 | 157.7 | 0 | 113 | M276 I279 E280 V285 I286 Y325 | M276-K283 WeakPolarHBondContact O-CE 3.49Å; M276-K283 PolarHBondContact O-NZ 2.89Å; I279-K283 HydrophobicContact CG1-CG 4.27Å; I279-K283 PolarHBondContact O-N 3.22Å; I279-K283 VanDerWaalsContact O-N 3.08Å; E280-K283 PolarHBondContact O-N 2.8Å; E280-K283 IonicContact OE1-NZ 2.8Å; E280-K283 PolarHBondContact OE1-NZ 3.17Å; K283-V285 PolarHBondContact O-N 2.81Å; K283-I286 PolarHBondContact O-N 2.89Å; K283-Y325 HydrophobicContact CB-CE1 4.22Å; K283-Y325 HydrophobicContact CG-CE1 4.19Å |
| 284 | K | 92.3 | Very high | 90.6 | Very high | 149 Ų | 149 | 52.9 Ų | 52.9 | 65% | 0.648 | 27% | 0.273 | S | S | * | . | G | 310 helix | trans | -66.1 | -8.1 | 176.3 | -63.3 | -176.6 | -177.9 | 179 | 0 | 114.3 | Y282 I286 F306 | Y282-K284 PolarHBondContact O-N 3.41Å; K284-I286 PolarHBondContact O-N 3.09Å; K284-F306 HydrophobicContact CB-CB 4.46Å; K284-F306 HydrophobicContact CB-CD2 3.82Å; K284-F306 HydrophobicContact CB-CE2 4.12Å; K284-F306 HydrophobicContact CB-CG 4.08Å; K284-F306 VanDerWaalsContact O-CD2 3.22Å; K284-F306 WeakPolarHBondContact O-CD2 3.22Å |
| 285 | V | 93.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 29% | 0.291 | C | S | . | . | G | 310 helix | trans | -59.7 | -28.3 | 174.3 | 77.4 | 0 | 0 | 0 | 0 | 112.3 | Y282 K283 F302 A303 F306 M307 L322 V326 | Y282-V285 VanDerWaalsContact O-CB 3.25Å; Y282-V285 WeakPolarHBondContact O-CB 3.39Å; Y282-V285 VanDerWaalsContact O-CG1 3.28Å; Y282-V285 WeakPolarHBondContact O-CG1 3.34Å; Y282-V285 PolarHBondContact O-N 3.18Å; K283-V285 PolarHBondContact O-N 2.81Å; V285-F302 HydrophobicContact CG1-CE2 4.22Å; V285-F302 HydrophobicContact CG2-CD2 4.25Å; V285-F302 HydrophobicContact CG2-CE1 4.01Å; V285-F302 HydrophobicContact CG2-CE2 3.67Å; V285-F302 HydrophobicContact CG2-CZ 3.54Å; V285-F302 CarbonylContact O-C 3.59Å; V285-F302 VanDerWaalsContact O-CA 3.28Å; V285-F302 WeakPolarHBondContact O-CA 3.45Å; V285-A303 PolarHBondContact O-N 3.04Å; V285-F306 HydrophobicContact CB-CB 4.47Å; V285-M307 HydrophobicContact CG2-CG 3.69Å; V285-M307 HydrophobicContact CG2-SD 4.06Å; V285-L322 HydrophobicContact CG1-CD1 3.78Å; V285-L322 HydrophobicContact CG1-CD2 4.27Å; V285-L322 HydrophobicContact CG1-CG 4.17Å; V285-V326 HydrophobicContact CG1-CG2 3.85Å |
| 286 | I | 94 | Very high | 89.2 | Confident | 13 Ų | 13 | 59.3 Ų | 59.3 | 7% | 0.067 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 133.4 | 176.7 | -177.7 | 162.4 | 0 | 0 | 0 | 109.7 | K283 K284 I300 V301 Y325 V326 T329 L330 | K283-I286 PolarHBondContact O-N 2.89Å; K284-I286 PolarHBondContact O-N 3.09Å; I286-I300 HydrophobicContact CD1-CG2 3.72Å; I286-I300 HydrophobicContact CG1-CG2 3.78Å; I286-V301 WeakPolarHBondContact CA-O 3.37Å; I286-Y325 HydrophobicContact CG2-CD1 4.19Å; I286-Y325 HydrophobicContact CG2-CE1 3.63Å; I286-V326 HydrophobicContact CB-CG2 4.36Å; I286-V326 HydrophobicContact CD1-CG1 4.17Å; I286-V326 HydrophobicContact CG2-CG2 4.1Å; I286-T329 HydrophobicContact CD1-CG2 3.99Å; I286-T329 HydrophobicContact CG1-CG2 4.38Å; I286-T329 HydrophobicContact CG2-CG2 4.46Å; I286-L330 HydrophobicContact CD1-CD2 4.01Å; I286-L330 HydrophobicContact CD1-CG 4.24Å |
| 287 | S | 92.7 | Very high | 89 | Confident | 37 Ų | 37 | 59.4 Ų | 59.4 | 26% | 0.259 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.2 | 155.6 | 173.6 | 56.2 | 0 | 0 | 0 | 0 | 111.4 | V301 | S287-V301 PolarHBondContact N-O 3.36Å; S287-V301 PolarHBondContact O-N 2.68Å |
| 288 | H | 91.8 | Very high | 89 | Confident | 66 Ų | 66 | 53.7 Ų | 53.7 | 31% | 0.306 | 29% | 0.292 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.7 | 122.2 | 173.6 | -174.9 | -109.3 | 0 | 0 | 0 | 109.3 | G290 Y291 | H288-G290 VanDerWaalsContact CE1-C 3.49Å; H288-G290 PolarHBondContact CE1-O 3.43Å; H288-G290 PolarHBondContact ND1-N 2.9Å; H288-G290 PolarHBondContact NE2-O 3.25Å; H288-Y291 AromaticContact CE1-CD2 3.93Å; H288-Y291 AromaticContact CE1-CE1 3.95Å; H288-Y291 AromaticContact CE1-CE2 3.58Å; H288-Y291 AromaticContact CE1-CZ 3.59Å; H288-Y291 AromaticContact NE2-CE1 3.7Å; H288-Y291 AromaticContact NE2-CZ 3.78Å |
| 289 | G | 89.9 | Confident | 89 | Confident | 1 Ų | 1 | 52.4 Ų | 52.4 | 1% | 0.01 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 16.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | I299 V422 | G289-I299 PolarHBondContact N-O 3.12Å; G289-V422 WeakPolarHBondContact O-CG2 3.36Å |
| 290 | G | 88.9 | Confident | 89 | Confident | 5 Ų | 5 | 52.5 Ų | 52.5 | 5% | 0.052 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 89.9 | -167.7 | -172.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | H288 I299 | H288-G290 VanDerWaalsContact CE1-C 3.49Å; H288-G290 PolarHBondContact CE1-O 3.43Å; H288-G290 PolarHBondContact ND1-N 2.9Å; H288-G290 PolarHBondContact NE2-O 3.25Å; G290-I299 WeakPolarHBondContact O-CB 3.32Å; G290-I299 PolarHBondContact O-N 3.13Å |
| 291 | Y | 88.4 | Confident | 89.1 | Confident | 139 Ų | 139 | 47.7 Ų | 47.7 | 55% | 0.545 | 26% | 0.26 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 154.3 | 179.9 | -59 | -83.9 | 0 | 0 | 0 | 111.1 | H288 G295 N297 A298 | H288-Y291 AromaticContact CE1-CD2 3.93Å; H288-Y291 AromaticContact CE1-CE1 3.95Å; H288-Y291 AromaticContact CE1-CE2 3.58Å; H288-Y291 AromaticContact CE1-CZ 3.59Å; H288-Y291 AromaticContact NE2-CE1 3.7Å; H288-Y291 AromaticContact NE2-CZ 3.78Å; Y291-G295 WeakPolarHBondContact CB-O 3.47Å; Y291-G295 VanDerWaalsContact CD1-O 3.24Å; Y291-G295 WeakPolarHBondContact CD1-O 3.42Å; Y291-N297 CarbonylContact C-O 3.6Å; Y291-N297 WeakPolarHBondContact CA-O 3.21Å; Y291-A298 HydrophobicContact CD1-CB 4.42Å; Y291-A298 HydrophobicContact CE1-CB 4.43Å |
| 292 | Y | 83.4 | Confident | 89.2 | Confident | 83 Ų | 83 | 45.2 Ų | 45.2 | 33% | 0.325 | 24% | 0.24 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.7 | 143.3 | -180 | 172.8 | -87.3 | 0 | 0 | 0 | 111.3 | D294 G295 N297 M339 | Y292-D294 PolarHBondContact O-N 2.97Å; Y292-G295 PolarHBondContact O-N 3.19Å; Y292-N297 PolarHBondContact N-O 2.74Å; Y292-M339 HydrophobicContact CD1-SD 4.41Å; Y292-M339 HydrophobicContact CD2-SD 4.34Å; Y292-M339 HydrophobicContact CG-SD 4.2Å |
| 293 | G | 81.4 | Confident | 89.2 | Confident | 67 Ų | 67 | 43.7 Ų | 43.7 | 69% | 0.691 | 24% | 0.235 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 74.4 | -117.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G295 | G293-G295 PolarHBondContact O-N 2.91Š|
| 294 | D | 78.4 | Confident | 89.2 | Confident | 113 Ų | 113 | 41.8 Ų | 41.8 | 60% | 0.604 | 23% | 0.226 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | 0.3 | 177.6 | 53.3 | 8.7 | 0 | 0 | 0 | 114.4 | Y292 L296 N297 | Y292-D294 PolarHBondContact O-N 2.97Å; D294-L296 VanDerWaalsContact C-N 3.34Å; D294-L296 WeakPolarHBondContact OD1-CB 3.47Å; D294-L296 PolarHBondContact OD1-N 2.72Å; D294-N297 PolarHBondContact OD1-ND2 2.89Å |
| 295 | G | 77.6 | Confident | 89.1 | Confident | 36 Ų | 36 | 35.3 Ų | 35.3 | 37% | 0.371 | 20% | 0.2 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 87.5 | -4.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y291 Y292 G293 | Y291-G295 WeakPolarHBondContact CB-O 3.47Å; Y291-G295 VanDerWaalsContact CD1-O 3.24Å; Y291-G295 WeakPolarHBondContact CD1-O 3.42Å; Y292-G295 PolarHBondContact O-N 3.19Å; G293-G295 PolarHBondContact O-N 2.91Å |
| 296 | L | 80.3 | Confident | 89.1 | Confident | 105 Ų | 105 | 38.8 Ų | 38.8 | 55% | 0.55 | 22% | 0.215 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | -18.6 | -179.8 | -56.7 | -179.7 | 0 | 0 | 0 | 113 | D294 | D294-L296 VanDerWaalsContact C-N 3.34Å; D294-L296 WeakPolarHBondContact OD1-CB 3.47Å; D294-L296 PolarHBondContact OD1-N 2.72Å |
| 297 | N | 87.8 | Confident | 89 | Confident | 20 Ų | 20 | 38.8 Ų | 38.8 | 11% | 0.107 | 22% | 0.215 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.9 | 110.5 | -170.2 | -61 | -95.9 | 0 | 0 | 0 | 111.1 | Y291 Y292 D294 N337 | Y291-N297 CarbonylContact C-O 3.6Å; Y291-N297 WeakPolarHBondContact CA-O 3.21Å; Y292-N297 PolarHBondContact N-O 2.74Å; D294-N297 PolarHBondContact OD1-ND2 2.89Å; N297-N337 VanDerWaalsContact CA-O 3.3Å; N297-N337 WeakPolarHBondContact CA-O 3.4Å; N297-N337 WeakPolarHBondContact OD1-CB 3.06Å; N297-N337 PolarHBondContact OD1-O 2.9Å |
| 298 | A | 91.1 | Very high | 89 | Confident | 4 Ų | 4 | 37 Ų | 37 | 3% | 0.033 | 20% | 0.203 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -70.6 | 140.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y291 I300 Y338 M339 | Y291-A298 HydrophobicContact CD1-CB 4.42Å; Y291-A298 HydrophobicContact CE1-CB 4.43Å; A298-I300 HydrophobicContact CB-CG1 4.48Å; A298-Y338 CarbonylContact O-C 3.6Å; A298-Y338 VanDerWaalsContact O-CA 3.28Å; A298-Y338 WeakPolarHBondContact O-CA 3.27Å; A298-Y338 WeakPolarHBondContact O-CB 3.41Å; A298-M339 PolarHBondContact O-N 3.28Å |
| 299 | I | 92.7 | Very high | 88.9 | Confident | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 127.7 | 167.4 | -58.1 | 157.4 | 0 | 0 | 0 | 107.5 | G289 G290 V341 V417 P418 | G289-I299 PolarHBondContact N-O 3.12Å; G290-I299 WeakPolarHBondContact O-CB 3.32Å; G290-I299 PolarHBondContact O-N 3.13Å; I299-V341 HydrophobicContact CG2-CG2 4.16Å; I299-V417 HydrophobicContact CD1-CG1 3.69Å; I299-V417 HydrophobicContact CG1-CG1 4.19Å; I299-V417 HydrophobicContact CG2-CG1 3.85Å; I299-P418 HydrophobicContact CD1-CG 3.76Å |
| 300 | I | 94.1 | Very high | 88.8 | Confident | 2 Ų | 2 | 40.7 Ų | 40.7 | 1% | 0.01 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 120.6 | -177.3 | -52 | -175.8 | 0 | 0 | 0 | 108.9 | I286 A298 L330 L333 V334 Y338 M339 I340 V341 | I286-I300 HydrophobicContact CD1-CG2 3.72Å; I286-I300 HydrophobicContact CG1-CG2 3.78Å; A298-I300 HydrophobicContact CB-CG1 4.48Å; I300-L330 HydrophobicContact CB-CD2 4.39Å; I300-L330 HydrophobicContact CD1-CD2 3.45Å; I300-L330 VanDerWaalsContact CD1-CD2 3.45Å; I300-L330 HydrophobicContact CG1-CD2 4.49Å; I300-L330 HydrophobicContact CG2-CD2 3.82Å; I300-L333 HydrophobicContact CD1-CB 3.95Å; I300-L333 HydrophobicContact CD1-CD1 4Å; I300-L333 HydrophobicContact CG1-CD1 4.28Å; I300-V334 HydrophobicContact CD1-CG2 4.17Å; I300-Y338 HydrophobicContact CD1-CD2 3.68Å; I300-Y338 HydrophobicContact CD1-CE2 4.16Å; I300-Y338 HydrophobicContact CD1-CG 4.46Å; I300-Y338 HydrophobicContact CG1-CD2 4.27Å; I300-M339 PolarHBondContact N-O 3.36Å; I300-I340 CarbonylContact O-C 3.6Å; I300-I340 VanDerWaalsContact O-CA 3.29Å; I300-I340 WeakPolarHBondContact O-CA 3.06Å; I300-V341 PolarHBondContact O-N 2.77Å |
| 301 | V | 94.6 | Very high | 88.6 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 123.9 | -176.9 | -175.3 | 0 | 0 | 0 | 0 | 108.6 | I286 S287 V341 L343 V422 | I286-V301 WeakPolarHBondContact CA-O 3.37Å; S287-V301 PolarHBondContact N-O 3.36Å; S287-V301 PolarHBondContact O-N 2.68Å; V301-V341 WeakPolarHBondContact CA-O 3.14Å; V301-L343 HydrophobicContact CG1-CD1 3.54Å; V301-L343 HydrophobicContact CG1-CG 4.01Å; V301-V422 HydrophobicContact CG2-CG1 3.94Å |
| 302 | F | 94.8 | Very high | 88.6 | Confident | 35 Ų | 35 | 40.8 Ų | 40.8 | 15% | 0.154 | 25% | 0.251 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 107.6 | 175.9 | -169 | -91.2 | 0 | 0 | 0 | 110 | V285 V304 M307 V326 I340 V341 Y342 L343 | V285-F302 HydrophobicContact CG1-CE2 4.22Å; V285-F302 HydrophobicContact CG2-CD2 4.25Å; V285-F302 HydrophobicContact CG2-CE1 4.01Å; V285-F302 HydrophobicContact CG2-CE2 3.67Å; V285-F302 HydrophobicContact CG2-CZ 3.54Å; V285-F302 CarbonylContact O-C 3.59Å; V285-F302 VanDerWaalsContact O-CA 3.28Å; V285-F302 WeakPolarHBondContact O-CA 3.45Å; F302-V304 HydrophobicContact CD1-CG2 4.03Å; F302-V304 HydrophobicContact CE1-CG2 4.08Å; F302-M307 HydrophobicContact CE1-SD 4.33Å; F302-M307 HydrophobicContact CZ-SD 3.88Å; F302-V326 HydrophobicContact CD2-CG1 4.47Å; F302-V326 HydrophobicContact CE2-CG1 4.17Å; F302-V326 HydrophobicContact CE2-CG2 4.04Å; F302-I340 HydrophobicContact CB-CG2 4.42Å; F302-V341 PolarHBondContact N-O 2.91Å; F302-Y342 HydrophobicContact CB-CD2 4.29Å; F302-Y342 AromaticContact CD1-CD2 3.49Å; F302-Y342 HydrophobicContact CD1-CD2 3.49Å; F302-Y342 VanDerWaalsContact CD1-CD2 3.49Å; F302-Y342 AromaticContact CD1-CE2 3.45Å; F302-Y342 HydrophobicContact CD1-CE2 3.45Å; F302-Y342 VanDerWaalsContact CD1-CE2 3.45Å; F302-Y342 HydrophobicContact CD1-CG 4.47Å; F302-Y342 HydrophobicContact CE1-CD2 4.21Å; F302-Y342 AromaticContact CE1-CE2 3.7Å; F302-Y342 HydrophobicContact CE1-CE2 3.7Å; F302-Y342 HydrophobicContact CG-CD2 4.2Å; F302-Y342 HydrophobicContact CG-CE2 4.5Å; F302-L343 PolarHBondContact O-N 2.86Å |
| 303 | A | 93.9 | Very high | 88.8 | Confident | 2 Ų | 2 | 42 Ų | 42 | 2% | 0.017 | 27% | 0.268 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 95.6 | -171.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | V285 C305 F306 P425 | V285-A303 PolarHBondContact O-N 3.04Å; A303-C305 PolarHBondContact O-N 2.86Å; A303-C305 VanDerWaalsContact O-N 3.14Å; A303-F306 HydrophobicContact CB-CD2 3.69Å; A303-F306 HydrophobicContact CB-CE2 3.96Å; A303-F306 PolarHBondContact O-N 2.82Å; A303-F306 VanDerWaalsContact O-N 3.11Å; A303-P425 HydrophobicContact CB-CG 3.94Å |
| 304 | V | 92.3 | Very high | 89.2 | Confident | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 27% | 0.266 | C | S | . | . | G | 310 helix | trans | -66.9 | -19.6 | -171.9 | -156.4 | 0 | 0 | 0 | 0 | 113 | F302 F306 M307 Y342 L343 T347 M352 | F302-V304 HydrophobicContact CD1-CG2 4.03Å; F302-V304 HydrophobicContact CE1-CG2 4.08Å; V304-F306 PolarHBondContact O-N 3.28Å; V304-F306 VanDerWaalsContact O-N 3.13Å; V304-M307 HydrophobicContact CG1-CB 4.36Å; V304-M307 HydrophobicContact CG1-CE 4.41Å; V304-M307 HydrophobicContact CG1-CG 3.8Å; V304-M307 WeakPolarHBondContact O-CB 3.39Å; V304-M307 PolarHBondContact O-N 2.9Å; V304-Y342 HydrophobicContact CG2-CD1 4.12Å; V304-Y342 HydrophobicContact CG2-CD2 4.41Å; V304-Y342 HydrophobicContact CG2-CE1 3.44Å; V304-Y342 VanDerWaalsContact CG2-CE1 3.44Å; V304-Y342 HydrophobicContact CG2-CE2 3.8Å; V304-Y342 WeakPolarHBondContact CG2-OH 3.37Å; V304-L343 WeakPolarHBondContact CG2-O 3.37Å; V304-L343 PolarHBondContact N-O 3.08Å; V304-T347 HydrophobicContact CB-CG2 4.05Å; V304-T347 HydrophobicContact CG1-CG2 3.83Å; V304-M352 HydrophobicContact CB-CE 4.49Å; V304-M352 HydrophobicContact CG1-CE 3.71Å; V304-M352 HydrophobicContact CG1-SD 4.28Å |
| 305 | C | 90.5 | Very high | 89.8 | Confident | 14 Ų | 14 | 41.1 Ų | 41.1 | 10% | 0.095 | 25% | 0.245 | C | C | . | . | G | 310 helix | trans | -57.9 | -25.5 | 173.6 | 58.8 | 0 | 0 | 0 | 0 | 113.2 | A303 T347 K351 | A303-C305 PolarHBondContact O-N 2.86Å; A303-C305 VanDerWaalsContact O-N 3.14Å; C305-T347 PolarHBondContact N-OG1 2.81Å; C305-K351 PolarHBondContact O-NZ 3.34Å |
| 306 | F | 91.9 | Very high | 90.5 | Very high | 73 Ų | 73 | 48.5 Ų | 48.5 | 32% | 0.32 | 26% | 0.262 | S | S | . | . | G | 310 helix | trans | -95.8 | 11.4 | 176.4 | -52.5 | -54.7 | 0 | 0 | 0 | 114.1 | Y282 K284 V285 A303 V304 P425 | Y282-F306 VanDerWaalsContact CD1-O 3.28Å; Y282-F306 WeakPolarHBondContact CD1-O 3.32Å; K284-F306 HydrophobicContact CB-CB 4.46Å; K284-F306 HydrophobicContact CB-CD2 3.82Å; K284-F306 HydrophobicContact CB-CE2 4.12Å; K284-F306 HydrophobicContact CB-CG 4.08Å; K284-F306 VanDerWaalsContact O-CD2 3.22Å; K284-F306 WeakPolarHBondContact O-CD2 3.22Å; V285-F306 HydrophobicContact CB-CB 4.47Å; A303-F306 HydrophobicContact CB-CD2 3.69Å; A303-F306 HydrophobicContact CB-CE2 3.96Å; A303-F306 PolarHBondContact O-N 2.82Å; A303-F306 VanDerWaalsContact O-N 3.11Å; V304-F306 PolarHBondContact O-N 3.28Å; V304-F306 VanDerWaalsContact O-N 3.13Å; F306-P425 HydrophobicContact CD2-CG 4.46Å; F306-P425 HydrophobicContact CE2-CB 4.1Å; F306-P425 HydrophobicContact CE2-CG 3.51Å; F306-P425 HydrophobicContact CZ-CB 3.8Å; F306-P425 HydrophobicContact CZ-CG 3.75Å |
| 307 | M | 92.3 | Very high | 91 | Very high | 12 Ų | 12 | 47.6 Ų | 47.6 | 6% | 0.059 | 25% | 0.252 | C | S | . | . | S | Bend | trans | -74.4 | 149.7 | 170.4 | -71.5 | -105.2 | -71.2 | 0 | 0 | 111.3 | V285 F302 V304 M319 L322 K351 P353 | V285-M307 HydrophobicContact CG2-CG 3.69Å; V285-M307 HydrophobicContact CG2-SD 4.06Å; F302-M307 HydrophobicContact CE1-SD 4.33Å; F302-M307 HydrophobicContact CZ-SD 3.88Å; V304-M307 HydrophobicContact CG1-CB 4.36Å; V304-M307 HydrophobicContact CG1-CE 4.41Å; V304-M307 HydrophobicContact CG1-CG 3.8Å; V304-M307 WeakPolarHBondContact O-CB 3.39Å; V304-M307 PolarHBondContact O-N 2.9Å; M307-M319 HydrophobicContact CE-CE 3.51Å; M307-M319 HydrophobicContact CE-SD 4.2Å; M307-M319 HydrophobicContact SD-CE 4.09Å; M307-M319 HydrophobicContact SD-SD 4.29Å; M307-L322 HydrophobicContact SD-CD2 4.28Å; M307-K351 HydrophobicContact CB-CB 4.22Å; M307-K351 WeakPolarHBondContact CE-O 3.22Å; M307-K351 WeakPolarHBondContact O-CD 3.42Å; M307-K351 VanDerWaalsContact O-CE 3.24Å; M307-K351 WeakPolarHBondContact O-CE 3.33Å; M307-P353 HydrophobicContact CE-CG 4.18Å |
| 308 | P | 92.1 | Very high | 91.3 | Very high | 1 Ų | 1 | 47.6 Ų | 47.6 | 1% | 0.006 | 25% | 0.251 | C | S | . | . | P | Polyproline II helix | trans | -62.9 | 154.1 | 172.5 | 28.6 | -36.2 | 0 | 0 | 0 | 111.2 | Y282 Y315 I318 M319 L322 | Y282-P308 HydrophobicContact CD1-CB 4.35Å; Y282-P308 HydrophobicContact CD2-CB 4.35Å; Y282-P308 HydrophobicContact CE1-CB 3.96Å; Y282-P308 HydrophobicContact CE2-CB 3.96Å; P308-Y315 HydrophobicContact CB-CD2 4.22Å; P308-Y315 HydrophobicContact CB-CE2 4.25Å; P308-Y315 HydrophobicContact CG-CD2 4.27Å; P308-Y315 HydrophobicContact CG-CE2 3.98Å; P308-I318 HydrophobicContact CB-CG2 4.17Å; P308-I318 HydrophobicContact CG-CG2 4.02Å; P308-M319 HydrophobicContact CG-CG 4.02Å; P308-M319 HydrophobicContact CG-SD 3.4Å; P308-M319 WeakPolarHBondContact CG-SD 3.4Å; P308-L322 HydrophobicContact CG-CD2 4.42Å |
| 309 | E | 90.4 | Very high | 91.4 | Very high | 79 Ų | 79 | 47.5 Ų | 47.5 | 37% | 0.369 | 25% | 0.251 | S | S | . | . | P | Polyproline II helix | trans | -90.5 | 141 | 176.5 | -64.9 | -168.4 | -168.2 | 0 | 0 | 111.3 | G311 Q312 Y315 K351 | E309-G311 PolarHBondContact O-N 2.94Å; E309-Q312 WeakPolarHBondContact O-CB 3.36Å; E309-Q312 PolarHBondContact O-N 3.34Å; E309-Y315 VanDerWaalsContact O-CD2 3.29Å; E309-Y315 WeakPolarHBondContact O-CD2 3.29Å; E309-K351 HydrophobicContact CG-CD 4.21Å; E309-K351 HydrophobicContact CG-CG 3.66Å; E309-K351 WeakPolarHBondContact OE1-CE 3.38Å; E309-K351 IonicContact OE1-NZ 2.7Å |
| 310 | S | 87.9 | Confident | 91.4 | Very high | 65 Ų | 65 | 50 Ų | 50 | 46% | 0.455 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.4 | -15.9 | -177.3 | 66.9 | 0 | 0 | 0 | 0 | 114.7 | K350 | S310-K350 WeakPolarHBondContact CB-O 3.45Å; S310-K350 PolarHBondContact N-O 3.32Å; S310-K350 PolarHBondContact OG-O 3.1Å |
| 311 | G | 85.4 | Confident | 91.4 | Very high | 74 Ų | 74 | 50.1 Ų | 50.1 | 76% | 0.763 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | -1.1 | 176 | 0 | 0 | 0 | 0 | 0 | 114.6 | E309 | E309-G311 PolarHBondContact O-N 2.94Š|
| 312 | Q | 87.2 | Confident | 91.4 | Very high | 72 Ų | 72 | 50.2 Ų | 50.2 | 34% | 0.336 | 27% | 0.265 | S | S | . | . | S | Bend | trans | -78.9 | 147 | 178.7 | -71.6 | -167.3 | 4.9 | 0 | 0 | 112.7 | Y282 E309 Y315 | Y282-Q312 VanDerWaalsContact OH-CD 3.23Å; Y282-Q312 PolarHBondContact OH-NE2 2.99Å; Y282-Q312 PolarHBondContact OH-OE1 2.78Å; E309-Q312 WeakPolarHBondContact O-CB 3.36Å; E309-Q312 PolarHBondContact O-N 3.34Å; Q312-Y315 WeakPolarHBondContact O-CB 3.28Å; Q312-Y315 PolarHBondContact O-N 3.02Å |
| 313 | P | 88.4 | Confident | 91.4 | Very high | 107 Ų | 107 | 49.6 Ų | 49.6 | 70% | 0.695 | 26% | 0.262 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.4 | 146.6 | 168.7 | 28.1 | -35.4 | 0 | 0 | 0 | 110 | Y315 | P313-Y315 PolarHBondContact O-N 3.25Å; P313-Y315 VanDerWaalsContact O-N 3.12Å |
| 314 | N | 89.4 | Confident | 91.3 | Very high | 122 Ų | 122 | 52.5 Ų | 52.5 | 65% | 0.652 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.9 | 21.4 | 179.8 | -56.7 | -29.6 | 0 | 0 | 0 | 115.2 | R316 Y317 I318 | N314-R316 VanDerWaalsContact C-N 3.26Å; N314-R316 PolarHBondContact O-N 3.13Å; N314-R316 VanDerWaalsContact O-N 3.1Å; N314-Y317 WeakPolarHBondContact O-CB 3.44Å; N314-Y317 PolarHBondContact O-N 3.44Å; N314-I318 PolarHBondContact O-N 3.16Å |
| 315 | Y | 91.5 | Very high | 91.4 | Very high | 41 Ų | 41 | 54.2 Ų | 54.2 | 16% | 0.161 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -45.6 | -45.3 | -179.8 | 175.1 | -104.3 | 0 | 0 | 0 | 113.8 | P308 E309 Q312 P313 I318 M319 P353 | P308-Y315 HydrophobicContact CB-CD2 4.22Å; P308-Y315 HydrophobicContact CB-CE2 4.25Å; P308-Y315 HydrophobicContact CG-CD2 4.27Å; P308-Y315 HydrophobicContact CG-CE2 3.98Å; E309-Y315 VanDerWaalsContact O-CD2 3.29Å; E309-Y315 WeakPolarHBondContact O-CD2 3.29Å; Q312-Y315 WeakPolarHBondContact O-CB 3.28Å; Q312-Y315 PolarHBondContact O-N 3.02Å; P313-Y315 PolarHBondContact O-N 3.25Å; P313-Y315 VanDerWaalsContact O-N 3.12Å; Y315-I318 PolarHBondContact O-N 3.36Å; Y315-M319 HydrophobicContact CD1-CG 4.29Å; Y315-M319 HydrophobicContact CD2-CG 4.01Å; Y315-M319 HydrophobicContact CE1-CG 3.85Å; Y315-M319 HydrophobicContact CE2-CG 3.55Å; Y315-M319 HydrophobicContact CE2-SD 4.08Å; Y315-M319 HydrophobicContact CG-CG 4.37Å; Y315-M319 VanDerWaalsContact CZ-CG 3.45Å; Y315-M319 WeakPolarHBondContact O-CB 3.44Å; Y315-M319 WeakPolarHBondContact O-CG 2.99Å; Y315-M319 PolarHBondContact O-N 3.19Å; Y315-P353 WeakPolarHBondContact OH-CA 3.28Å |
| 316 | R | 91.1 | Very high | 91.6 | Very high | 191 Ų | 191 | 54.1 Ų | 54.1 | 72% | 0.721 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -62.6 | -45.1 | 178.7 | -171.2 | 161.2 | 77.3 | 107.9 | -11.4 | 112.5 | N314 M319 D320 | N314-R316 VanDerWaalsContact C-N 3.26Å; N314-R316 PolarHBondContact O-N 3.13Å; N314-R316 VanDerWaalsContact O-N 3.1Å; R316-M319 PolarHBondContact O-N 3.01Å; R316-D320 WeakPolarHBondContact O-CB 3.38Å; R316-D320 PolarHBondContact O-N 2.94Å |
| 317 | Y | 92.8 | Very high | 91.6 | Very high | 86 Ų | 86 | 50.8 Ų | 50.8 | 34% | 0.337 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -62.5 | -43.8 | 176.1 | 174.9 | -96.3 | 0 | 0 | 0 | 111.9 | W262 D275 A278 N314 N321 | W262-Y317 WeakPolarHBondContact CH2-OH 3.39Å; D275-Y317 HydrophobicContact CB-CE1 4.41Å; D275-Y317 VanDerWaalsContact CB-OH 3.29Å; D275-Y317 WeakPolarHBondContact CB-OH 3.35Å; D275-Y317 PolarHBondContact OD2-OH 3.49Å; A278-Y317 HydrophobicContact CB-CD1 4.36Å; A278-Y317 HydrophobicContact CB-CE1 3.71Å; N314-Y317 WeakPolarHBondContact O-CB 3.44Å; N314-Y317 PolarHBondContact O-N 3.44Å; Y317-N321 VanDerWaalsContact CE2-ND2 3.35Å; Y317-N321 WeakPolarHBondContact CE2-ND2 3.23Å; Y317-N321 WeakPolarHBondContact O-CB 3.24Å; Y317-N321 PolarHBondContact O-N 3.25Å; Y317-N321 PolarHBondContact O-ND2 3.45Å |
| 318 | I | 93.7 | Very high | 91.6 | Very high | 19 Ų | 19 | 50.3 Ų | 50.3 | 10% | 0.097 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.2 | -46.8 | 177.6 | -62 | 169.4 | 0 | 0 | 0 | 110 | Y282 P308 N314 Y315 N321 L322 | Y282-I318 HydrophobicContact CD2-CG2 3.59Å; Y282-I318 HydrophobicContact CE2-CG2 3.65Å; P308-I318 HydrophobicContact CB-CG2 4.17Å; P308-I318 HydrophobicContact CG-CG2 4.02Å; N314-I318 PolarHBondContact O-N 3.16Å; Y315-I318 PolarHBondContact O-N 3.36Å; I318-N321 PolarHBondContact O-N 3.38Å; I318-L322 WeakPolarHBondContact O-CB 3.09Å; I318-L322 PolarHBondContact O-N 3.45Å |
| 319 | M | 93.3 | Very high | 91.6 | Very high | 3 Ų | 3 | 51.4 Ų | 51.4 | 2% | 0.015 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 178.8 | -78.3 | -60.5 | -73 | 0 | 0 | 112.9 | M307 P308 Y315 R316 L322 F323 P353 W357 | M307-M319 HydrophobicContact CE-CE 3.51Å; M307-M319 HydrophobicContact CE-SD 4.2Å; M307-M319 HydrophobicContact SD-CE 4.09Å; M307-M319 HydrophobicContact SD-SD 4.29Å; P308-M319 HydrophobicContact CG-CG 4.02Å; P308-M319 HydrophobicContact CG-SD 3.4Å; P308-M319 WeakPolarHBondContact CG-SD 3.4Å; Y315-M319 HydrophobicContact CD1-CG 4.29Å; Y315-M319 HydrophobicContact CD2-CG 4.01Å; Y315-M319 HydrophobicContact CE1-CG 3.85Å; Y315-M319 HydrophobicContact CE2-CG 3.55Å; Y315-M319 HydrophobicContact CE2-SD 4.08Å; Y315-M319 HydrophobicContact CG-CG 4.37Å; Y315-M319 VanDerWaalsContact CZ-CG 3.45Å; Y315-M319 WeakPolarHBondContact O-CB 3.44Å; Y315-M319 WeakPolarHBondContact O-CG 2.99Å; Y315-M319 PolarHBondContact O-N 3.19Å; R316-M319 PolarHBondContact O-N 3.01Å; M319-L322 PolarHBondContact O-N 2.85Å; M319-L322 HydrophobicContact SD-CD2 4.46Å; M319-F323 WeakPolarHBondContact O-CB 3.48Å; M319-F323 PolarHBondContact O-N 2.8Å; M319-P353 HydrophobicContact CE-CB 3.78Å; M319-P353 HydrophobicContact CE-CG 3.75Å; M319-W357 HydrophobicContact CB-CZ2 3.95Å; M319-W357 HydrophobicContact CE-CE3 4.32Å; M319-W357 HydrophobicContact CE-CH2 3.44Å; M319-W357 VanDerWaalsContact CE-CH2 3.44Å; M319-W357 HydrophobicContact CE-CZ2 3.86Å; M319-W357 HydrophobicContact CE-CZ3 3.71Å |
| 320 | D | 92.7 | Very high | 91.6 | Very high | 51 Ų | 51 | 48.2 Ų | 48.2 | 27% | 0.273 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -66.8 | -39.3 | 180 | -67.5 | -17.8 | 0 | 0 | 0 | 111.2 | R316 K324 W357 | R316-D320 WeakPolarHBondContact O-CB 3.38Å; R316-D320 PolarHBondContact O-N 2.94Å; D320-K324 WeakPolarHBondContact O-CD 3.47Å; D320-K324 VanDerWaalsContact O-CG 3.26Å; D320-K324 WeakPolarHBondContact O-CG 3.46Å; D320-K324 PolarHBondContact O-N 2.88Å; D320-W357 PolarHBondContact OD1-NE1 2.7Å |
| 321 | N | 93.8 | Very high | 91.6 | Very high | 5 Ų | 5 | 46.8 Ų | 46.8 | 3% | 0.027 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -67.6 | -41.4 | 172 | -78.5 | -78.3 | 0 | 0 | 0 | 112.2 | V274 D275 I279 Y317 I318 F323 K324 Y325 | V274-N321 WeakPolarHBondContact CA-OD1 3.38Å; V274-N321 HydrophobicContact CG1-CB 4.26Å; V274-N321 WeakPolarHBondContact CG1-O 3.31Å; D275-N321 PolarHBondContact N-OD1 3.14Å; I279-N321 HydrophobicContact CG2-CB 3.52Å; Y317-N321 VanDerWaalsContact CE2-ND2 3.35Å; Y317-N321 WeakPolarHBondContact CE2-ND2 3.23Å; Y317-N321 WeakPolarHBondContact O-CB 3.24Å; Y317-N321 PolarHBondContact O-N 3.25Å; Y317-N321 PolarHBondContact O-ND2 3.45Å; I318-N321 PolarHBondContact O-N 3.38Å; N321-F323 VanDerWaalsContact C-N 3.35Å; N321-F323 PolarHBondContact O-N 3.19Å; N321-K324 PolarHBondContact O-N 2.95Å; N321-Y325 WeakPolarHBondContact O-CB 3.31Å; N321-Y325 PolarHBondContact O-N 2.91Å |
| 322 | L | 94.7 | Very high | 91.7 | Very high | 3 Ų | 3 | 49.2 Ų | 49.2 | 2% | 0.016 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66 | -38.2 | 179.3 | -173.8 | 63.5 | 0 | 0 | 0 | 111.4 | I279 V285 M307 P308 I318 M319 Y325 V326 | I279-L322 HydrophobicContact CB-CD1 4.27Å; I279-L322 HydrophobicContact CG2-CB 4.17Å; V285-L322 HydrophobicContact CG1-CD1 3.78Å; V285-L322 HydrophobicContact CG1-CD2 4.27Å; V285-L322 HydrophobicContact CG1-CG 4.17Å; M307-L322 HydrophobicContact SD-CD2 4.28Å; P308-L322 HydrophobicContact CG-CD2 4.42Å; I318-L322 WeakPolarHBondContact O-CB 3.09Å; I318-L322 PolarHBondContact O-N 3.45Å; M319-L322 PolarHBondContact O-N 2.85Å; M319-L322 HydrophobicContact SD-CD2 4.46Å; L322-Y325 HydrophobicContact CD1-CD1 4.32Å; L322-Y325 WeakPolarHBondContact O-CB 3.46Å; L322-Y325 PolarHBondContact O-N 3.32Å; L322-V326 WeakPolarHBondContact O-CB 3.43Å; L322-V326 VanDerWaalsContact O-CG2 3.23Å; L322-V326 WeakPolarHBondContact O-CG2 3.41Å; L322-V326 PolarHBondContact O-N 3.45Å |
| 323 | F | 93.8 | Very high | 91.6 | Very high | 22 Ų | 22 | 48.4 Ų | 48.4 | 10% | 0.096 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.8 | -48.6 | 174.5 | 178 | -108.6 | 0 | 0 | 0 | 111.6 | M319 N321 Y325 V326 I327 W357 C361 Q364 I365 | M319-F323 WeakPolarHBondContact O-CB 3.48Å; M319-F323 PolarHBondContact O-N 2.8Å; N321-F323 VanDerWaalsContact C-N 3.35Å; N321-F323 PolarHBondContact O-N 3.19Å; F323-Y325 VanDerWaalsContact C-N 3.3Å; F323-Y325 PolarHBondContact O-N 3.42Å; F323-V326 PolarHBondContact O-N 2.95Å; F323-V326 VanDerWaalsContact O-N 3.12Å; F323-I327 HydrophobicContact CD1-CG1 4.33Å; F323-I327 HydrophobicContact CD2-CD1 4.42Å; F323-I327 HydrophobicContact CD2-CG1 4.12Å; F323-I327 HydrophobicContact CE1-CG1 3.82Å; F323-I327 HydrophobicContact CE2-CD1 3.63Å; F323-I327 HydrophobicContact CE2-CG1 3.57Å; F323-I327 HydrophobicContact CG-CG1 4.46Å; F323-I327 HydrophobicContact CZ-CD1 3.74Å; F323-I327 HydrophobicContact CZ-CG1 3.4Å; F323-I327 VanDerWaalsContact CZ-CG1 3.4Å; F323-I327 WeakPolarHBondContact O-CG1 3.4Å; F323-I327 PolarHBondContact O-N 2.84Å; F323-W357 HydrophobicContact CB-CH2 3.8Å; F323-W357 HydrophobicContact CB-CZ2 3.67Å; F323-W357 HydrophobicContact CD2-CH2 4.11Å; F323-W357 HydrophobicContact CG-CH2 4.14Å; F323-W357 HydrophobicContact CG-CZ2 4.18Å; F323-C361 HydrophobicContact CD2-CB 3.99Å; F323-C361 HydrophobicContact CE1-CB 4.16Å; F323-C361 HydrophobicContact CE2-CB 3.47Å; F323-C361 VanDerWaalsContact CE2-CB 3.47Å; F323-C361 HydrophobicContact CZ-CB 3.57Å; F323-C361 WeakPolarHBondContact CZ-O 3.37Å; F323-Q364 HydrophobicContact CE1-CB 3.86Å; F323-Q364 VanDerWaalsContact CE1-OE1 3.3Å; F323-Q364 HydrophobicContact CZ-CB 4.27Å; F323-I365 HydrophobicContact CZ-CG1 4.14Å |
| 324 | K | 93.3 | Very high | 91.3 | Very high | 63 Ų | 63 | 43.4 Ų | 43.4 | 27% | 0.274 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -58 | -41.5 | 174.4 | -69 | 167.2 | -179.7 | -179.3 | 0 | 112.1 | F267 H272 V274 D320 N321 I327 G328 | F267-K324 HydrophobicContact CE1-CB 4.37Å; F267-K324 HydrophobicContact CZ-CB 4.28Å; F267-K324 HydrophobicContact CZ-CG 4.21Å; H272-K324 HydrophobicContact CB-CD 4.45Å; V274-K324 HydrophobicContact CG2-CB 3.39Å; V274-K324 HydrophobicContact CG2-CD 4.08Å; V274-K324 HydrophobicContact CG2-CG 4.39Å; D320-K324 WeakPolarHBondContact O-CD 3.47Å; D320-K324 VanDerWaalsContact O-CG 3.26Å; D320-K324 WeakPolarHBondContact O-CG 3.46Å; D320-K324 PolarHBondContact O-N 2.88Å; N321-K324 PolarHBondContact O-N 2.95Å; K324-I327 PolarHBondContact O-N 2.83Å; K324-G328 PolarHBondContact O-N 2.83Å |
| 325 | Y | 94.1 | Very high | 90.4 | Very high | 35 Ų | 35 | 41.7 Ų | 41.7 | 14% | 0.137 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.7 | -45 | 173.5 | 173.9 | -105.6 | 0 | 0 | 0 | 112.3 | F265 M276 I279 K283 I286 N321 L322 F323 T329 | F265-Y325 HydrophobicContact CE2-CD2 4.04Å; F265-Y325 AromaticContact CZ-CD2 3.6Å; F265-Y325 HydrophobicContact CZ-CD2 3.6Å; F265-Y325 HydrophobicContact CZ-CE2 4.09Å; M276-Y325 HydrophobicContact CE-CD2 4.09Å; M276-Y325 HydrophobicContact CE-CE2 3.85Å; M276-Y325 HydrophobicContact SD-CD2 4.06Å; M276-Y325 HydrophobicContact SD-CE2 4.43Å; I279-Y325 VanDerWaalsContact CD1-CB 3.43Å; I279-Y325 HydrophobicContact CD1-CD1 4.07Å; I279-Y325 HydrophobicContact CD1-CD2 3.76Å; I279-Y325 HydrophobicContact CD1-CG 3.47Å; I279-Y325 VanDerWaalsContact CD1-CG 3.47Å; K283-Y325 HydrophobicContact CB-CE1 4.22Å; K283-Y325 HydrophobicContact CG-CE1 4.19Å; I286-Y325 HydrophobicContact CG2-CD1 4.19Å; I286-Y325 HydrophobicContact CG2-CE1 3.63Å; N321-Y325 WeakPolarHBondContact O-CB 3.31Å; N321-Y325 PolarHBondContact O-N 2.91Å; L322-Y325 HydrophobicContact CD1-CD1 4.32Å; L322-Y325 WeakPolarHBondContact O-CB 3.46Å; L322-Y325 PolarHBondContact O-N 3.32Å; F323-Y325 VanDerWaalsContact C-N 3.3Å; F323-Y325 PolarHBondContact O-N 3.42Å; Y325-T329 VanDerWaalsContact O-CB 3.25Å; Y325-T329 WeakPolarHBondContact O-CB 3.5Å; Y325-T329 PolarHBondContact O-N 3.49Å; Y325-T329 PolarHBondContact O-OG1 3.12Å |
| 326 | V | 94.1 | Very high | 89.9 | Confident | 13 Ų | 13 | 44.9 Ų | 44.9 | 8% | 0.079 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -63.4 | -49 | 177.8 | 166.4 | 0 | 0 | 0 | 0 | 110.5 | V285 I286 F302 L322 F323 T329 L330 | V285-V326 HydrophobicContact CG1-CG2 3.85Å; I286-V326 HydrophobicContact CB-CG2 4.36Å; I286-V326 HydrophobicContact CD1-CG1 4.17Å; I286-V326 HydrophobicContact CG2-CG2 4.1Å; F302-V326 HydrophobicContact CD2-CG1 4.47Å; F302-V326 HydrophobicContact CE2-CG1 4.17Å; F302-V326 HydrophobicContact CE2-CG2 4.04Å; L322-V326 WeakPolarHBondContact O-CB 3.43Å; L322-V326 VanDerWaalsContact O-CG2 3.23Å; L322-V326 WeakPolarHBondContact O-CG2 3.41Å; L322-V326 PolarHBondContact O-N 3.45Å; F323-V326 PolarHBondContact O-N 2.95Å; F323-V326 VanDerWaalsContact O-N 3.12Å; V326-T329 PolarHBondContact O-N 2.93Å; V326-L330 HydrophobicContact CG1-CD1 4.4Å; V326-L330 HydrophobicContact CG1-CG 4.47Å; V326-L330 VanDerWaalsContact O-CG 3.31Å; V326-L330 WeakPolarHBondContact O-CG 3.37Å; V326-L330 PolarHBondContact O-N 3.04Å |
| 327 | I | 92.2 | Very high | 89.8 | Confident | 3 Ų | 3 | 39.2 Ų | 39.2 | 2% | 0.015 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.5 | -45.5 | 178.6 | -61.7 | -50.3 | 0 | 0 | 0 | 111.6 | F267 F323 K324 T329 L330 E331 I365 L369 | F267-I327 HydrophobicContact CB-CG2 4.28Å; F267-I327 HydrophobicContact CD1-CG2 4.11Å; F267-I327 HydrophobicContact CD2-CG2 3.64Å; F267-I327 HydrophobicContact CE1-CB 4.34Å; F267-I327 HydrophobicContact CE1-CG2 4.26Å; F267-I327 HydrophobicContact CE2-CB 4.35Å; F267-I327 HydrophobicContact CE2-CG2 3.8Å; F267-I327 HydrophobicContact CG-CG2 3.79Å; F267-I327 HydrophobicContact CZ-CB 4.21Å; F267-I327 HydrophobicContact CZ-CG2 4.1Å; F323-I327 HydrophobicContact CD1-CG1 4.33Å; F323-I327 HydrophobicContact CD2-CD1 4.42Å; F323-I327 HydrophobicContact CD2-CG1 4.12Å; F323-I327 HydrophobicContact CE1-CG1 3.82Å; F323-I327 HydrophobicContact CE2-CD1 3.63Å; F323-I327 HydrophobicContact CE2-CG1 3.57Å; F323-I327 HydrophobicContact CG-CG1 4.46Å; F323-I327 HydrophobicContact CZ-CD1 3.74Å; F323-I327 HydrophobicContact CZ-CG1 3.4Å; F323-I327 VanDerWaalsContact CZ-CG1 3.4Å; F323-I327 WeakPolarHBondContact O-CG1 3.4Å; F323-I327 PolarHBondContact O-N 2.84Å; K324-I327 PolarHBondContact O-N 2.83Å; I327-T329 VanDerWaalsContact C-N 3.28Å; I327-T329 PolarHBondContact O-N 2.98Å; I327-L330 HydrophobicContact CD1-CD1 4Å; I327-L330 WeakPolarHBondContact O-CB 3.31Å; I327-L330 PolarHBondContact O-N 2.98Å; I327-E331 WeakPolarHBondContact O-CB 3.5Å; I327-E331 PolarHBondContact O-N 2.7Å; I327-I365 HydrophobicContact CD1-CD1 4.06Å; I327-I365 HydrophobicContact CD1-CG1 3.83Å; I327-I365 HydrophobicContact CD1-CG2 4.44Å; I327-L369 HydrophobicContact CG2-CD1 4.04Å |
| 328 | G | 91.8 | Very high | 89.8 | Confident | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.01 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.3 | -32.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | K324 L332 | K324-G328 PolarHBondContact O-N 2.83Å; G328-L332 VanDerWaalsContact O-CG 3.3Å; G328-L332 WeakPolarHBondContact O-CG 3.21Å; G328-L332 PolarHBondContact O-N 3.27Å |
| 329 | T | 91.6 | Very high | 89.8 | Confident | 25 Ų | 25 | 35.2 Ų | 35.2 | 15% | 0.153 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -73 | -42.1 | 173.6 | -57.6 | 0 | 0 | 0 | 0 | 111.6 | I286 Y325 V326 I327 E331 L332 L333 | I286-T329 HydrophobicContact CD1-CG2 3.99Å; I286-T329 HydrophobicContact CG1-CG2 4.38Å; I286-T329 HydrophobicContact CG2-CG2 4.46Å; Y325-T329 VanDerWaalsContact O-CB 3.25Å; Y325-T329 WeakPolarHBondContact O-CB 3.5Å; Y325-T329 PolarHBondContact O-N 3.49Å; Y325-T329 PolarHBondContact O-OG1 3.12Å; V326-T329 PolarHBondContact O-N 2.93Å; I327-T329 VanDerWaalsContact C-N 3.28Å; I327-T329 PolarHBondContact O-N 2.98Å; T329-E331 PolarHBondContact O-N 3.29Å; T329-L332 PolarHBondContact O-N 2.8Å; T329-L333 HydrophobicContact CG2-CD1 3.93Å; T329-L333 HydrophobicContact CG2-CG 4.49Å; T329-L333 VanDerWaalsContact O-CG 3.29Å; T329-L333 WeakPolarHBondContact O-CG 3.38Å; T329-L333 PolarHBondContact O-N 2.85Å; T329-L333 VanDerWaalsContact O-N 3.14Å |
| 330 | L | 90.8 | Very high | 89.8 | Confident | 11 Ų | 11 | 36.3 Ų | 36.3 | 6% | 0.058 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -55.6 | -44.5 | 171.5 | -71.6 | 179.4 | 0 | 0 | 0 | 110.2 | I286 I300 V326 I327 L332 L333 V334 Y338 L369 | I286-L330 HydrophobicContact CD1-CD2 4.01Å; I286-L330 HydrophobicContact CD1-CG 4.24Å; I300-L330 HydrophobicContact CB-CD2 4.39Å; I300-L330 HydrophobicContact CD1-CD2 3.45Å; I300-L330 VanDerWaalsContact CD1-CD2 3.45Å; I300-L330 HydrophobicContact CG1-CD2 4.49Å; I300-L330 HydrophobicContact CG2-CD2 3.82Å; V326-L330 HydrophobicContact CG1-CD1 4.4Å; V326-L330 HydrophobicContact CG1-CG 4.47Å; V326-L330 VanDerWaalsContact O-CG 3.31Å; V326-L330 WeakPolarHBondContact O-CG 3.37Å; V326-L330 PolarHBondContact O-N 3.04Å; I327-L330 HydrophobicContact CD1-CD1 4Å; I327-L330 WeakPolarHBondContact O-CB 3.31Å; I327-L330 PolarHBondContact O-N 2.98Å; L330-L332 PolarHBondContact O-N 2.75Å; L330-L333 PolarHBondContact O-N 2.83Å; L330-V334 VanDerWaalsContact O-CB 3.23Å; L330-V334 WeakPolarHBondContact O-CB 3.44Å; L330-V334 WeakPolarHBondContact O-CG2 3.44Å; L330-V334 PolarHBondContact O-N 2.81Å; L330-Y338 HydrophobicContact CD2-CE2 4.1Å; L330-L369 HydrophobicContact CB-CD1 4.32Å; L330-L369 HydrophobicContact CB-CD2 4.47Å |
| 331 | E | 89.3 | Confident | 89.9 | Confident | 36 Ų | 36 | 33.9 Ų | 33.9 | 17% | 0.168 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.6 | -40.6 | -176.7 | -159.9 | -176.6 | -148 | 0 | 0 | 113.9 | F267 I327 T329 L333 V334 R368 | F267-E331 WeakPolarHBondContact CA-OE2 3.42Å; F267-E331 WeakPolarHBondContact CB-OE2 3.4Å; I327-E331 WeakPolarHBondContact O-CB 3.5Å; I327-E331 PolarHBondContact O-N 2.7Å; T329-E331 PolarHBondContact O-N 3.29Å; E331-L333 VanDerWaalsContact C-N 3.3Å; E331-L333 PolarHBondContact O-N 2.77Å; E331-V334 PolarHBondContact O-N 2.86Å; E331-R368 IonicContact OE1-NH2 2.94Å; E331-R368 PolarHBondContact OE1-NH2 2.89Å; E331-R368 VanDerWaalsContact OE1-NH2 3.15Å |
| 332 | L | 87.5 | Confident | 90 | Very high | 125 Ų | 125 | 35.8 Ų | 35.8 | 65% | 0.654 | 19% | 0.189 | S | C | * | . | H | α-helix | trans | -67.4 | -29.2 | 175.3 | -68.1 | 168.1 | 0 | 0 | 0 | 112.8 | F265 G328 T329 L330 | F265-L332 HydrophobicContact CD1-CD1 4.48Å; F265-L332 HydrophobicContact CE1-CD1 4.29Å; G328-L332 VanDerWaalsContact O-CG 3.3Å; G328-L332 WeakPolarHBondContact O-CG 3.21Å; G328-L332 PolarHBondContact O-N 3.27Å; T329-L332 PolarHBondContact O-N 2.8Å; L330-L332 PolarHBondContact O-N 2.75Å |
| 333 | L | 84.7 | Confident | 90 | Very high | 54 Ų | 54 | 35.7 Ų | 35.7 | 28% | 0.283 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -88 | -20.2 | 178.8 | -66.4 | 174.1 | 0 | 0 | 0 | 113.4 | I300 T329 L330 E331 A335 | I300-L333 HydrophobicContact CD1-CB 3.95Å; I300-L333 HydrophobicContact CD1-CD1 4Å; I300-L333 HydrophobicContact CG1-CD1 4.28Å; T329-L333 HydrophobicContact CG2-CD1 3.93Å; T329-L333 HydrophobicContact CG2-CG 4.49Å; T329-L333 VanDerWaalsContact O-CG 3.29Å; T329-L333 WeakPolarHBondContact O-CG 3.38Å; T329-L333 PolarHBondContact O-N 2.85Å; T329-L333 VanDerWaalsContact O-N 3.14Å; L330-L333 PolarHBondContact O-N 2.83Å; E331-L333 VanDerWaalsContact C-N 3.3Å; E331-L333 PolarHBondContact O-N 2.77Å; L333-A335 PolarHBondContact O-N 3.07Å |
| 334 | V | 80.7 | Confident | 89.8 | Confident | 3 Ų | 3 | 35 Ų | 35 | 2% | 0.018 | 19% | 0.186 | C | C | . | . | trans | -100.4 | 86.3 | -173.6 | 177.3 | 0 | 0 | 0 | 0 | 110.3 | I300 L330 E331 E336 Y338 R368 L369 N372 | I300-V334 HydrophobicContact CD1-CG2 4.17Å; L330-V334 VanDerWaalsContact O-CB 3.23Å; L330-V334 WeakPolarHBondContact O-CB 3.44Å; L330-V334 WeakPolarHBondContact O-CG2 3.44Å; L330-V334 PolarHBondContact O-N 2.81Å; E331-V334 PolarHBondContact O-N 2.86Å; V334-E336 WeakPolarHBondContact CG1-O 3.42Å; V334-Y338 HydrophobicContact CB-CD1 4.17Å; V334-Y338 HydrophobicContact CB-CE1 4.38Å; V334-Y338 HydrophobicContact CG1-CD1 3.58Å; V334-Y338 HydrophobicContact CG1-CE1 3.78Å; V334-Y338 HydrophobicContact CG1-CG 4.41Å; V334-Y338 HydrophobicContact CG2-CD1 3.36Å; V334-Y338 HydrophobicContact CG2-CD2 3.78Å; V334-Y338 HydrophobicContact CG2-CE1 3.61Å; V334-Y338 HydrophobicContact CG2-CE2 3.97Å; V334-Y338 HydrophobicContact CG2-CG 3.45Å; V334-Y338 VanDerWaalsContact CG2-CG 3.45Å; V334-R368 PolarHBondContact O-NH1 3.47Å; V334-L369 HydrophobicContact CB-CD2 3.83Å; V334-L369 HydrophobicContact CG1-CD2 3.91Å; V334-L369 HydrophobicContact CG2-CD2 4.14Å; V334-N372 HydrophobicContact CG1-CB 3.88Å | ||
| 335 | A | 72.1 | Confident | 89.1 | Confident | 85 Ų | 85 | 32.1 Ų | 32.1 | 70% | 0.702 | 17% | 0.173 | S | C | * | . | S | Bend | trans | -74.2 | -61.1 | 163.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | L333 | L333-A335 PolarHBondContact O-N 3.07Š|
| 336 | E | 80.4 | Confident | 88.2 | Confident | 108 Ų | 108 | 32.9 Ų | 32.9 | 51% | 0.505 | 19% | 0.187 | S | C | . | . | S | Bend | trans | -115.6 | -122.6 | 179.8 | -61.8 | -169.4 | -179.1 | 0 | 0 | 111.4 | V334 N372 | V334-E336 WeakPolarHBondContact CG1-O 3.42Å; E336-N372 VanDerWaalsContact O-CB 3.24Å; E336-N372 WeakPolarHBondContact O-CB 3.36Å; E336-N372 PolarHBondContact O-ND2 3.23Å |
| 337 | N | 89.1 | Confident | 87.5 | Confident | 72 Ų | 72 | 33.6 Ų | 33.6 | 39% | 0.385 | 19% | 0.192 | S | C | . | . | trans | -89.9 | 151.2 | -178.4 | -54 | -87.5 | 0 | 0 | 0 | 111.4 | N297 N372 | N297-N337 VanDerWaalsContact CA-O 3.3Å; N297-N337 WeakPolarHBondContact CA-O 3.4Å; N297-N337 WeakPolarHBondContact OD1-CB 3.06Å; N297-N337 PolarHBondContact OD1-O 2.9Å; N337-N372 WeakPolarHBondContact CA-O 3.29Å | ||
| 338 | Y | 92.4 | Very high | 86.9 | Confident | 6 Ų | 6 | 36.6 Ų | 36.6 | 2% | 0.024 | 21% | 0.213 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -148.2 | 161.6 | -176.2 | 73.7 | -75.3 | 0 | 0 | 0 | 112.7 | A298 I300 L330 V334 I340 L369 N372 L373 K374 | A298-Y338 CarbonylContact O-C 3.6Å; A298-Y338 VanDerWaalsContact O-CA 3.28Å; A298-Y338 WeakPolarHBondContact O-CA 3.27Å; A298-Y338 WeakPolarHBondContact O-CB 3.41Å; I300-Y338 HydrophobicContact CD1-CD2 3.68Å; I300-Y338 HydrophobicContact CD1-CE2 4.16Å; I300-Y338 HydrophobicContact CD1-CG 4.46Å; I300-Y338 HydrophobicContact CG1-CD2 4.27Å; L330-Y338 HydrophobicContact CD2-CE2 4.1Å; V334-Y338 HydrophobicContact CB-CD1 4.17Å; V334-Y338 HydrophobicContact CB-CE1 4.38Å; V334-Y338 HydrophobicContact CG1-CD1 3.58Å; V334-Y338 HydrophobicContact CG1-CE1 3.78Å; V334-Y338 HydrophobicContact CG1-CG 4.41Å; V334-Y338 HydrophobicContact CG2-CD1 3.36Å; V334-Y338 HydrophobicContact CG2-CD2 3.78Å; V334-Y338 HydrophobicContact CG2-CE1 3.61Å; V334-Y338 HydrophobicContact CG2-CE2 3.97Å; V334-Y338 HydrophobicContact CG2-CG 3.45Å; V334-Y338 VanDerWaalsContact CG2-CG 3.45Å; Y338-I340 HydrophobicContact CD2-CG1 4.03Å; Y338-I340 HydrophobicContact CE2-CD1 3.77Å; Y338-I340 HydrophobicContact CE2-CG1 3.6Å; Y338-L369 WeakPolarHBondContact CE1-O 3.47Å; Y338-L369 PolarHBondContact OH-O 3.19Å; Y338-N372 HydrophobicContact CD1-CB 4.09Å; Y338-N372 HydrophobicContact CE1-CB 4.04Å; Y338-N372 PolarHBondContact N-O 2.89Å; Y338-N372 VanDerWaalsContact N-O 3.12Å; Y338-L373 HydrophobicContact CD2-CD1 4.15Å; Y338-L373 HydrophobicContact CE1-CB 3.89Å; Y338-L373 HydrophobicContact CE1-CD1 4.45Å; Y338-L373 VanDerWaalsContact CE1-N 3.29Å; Y338-L373 HydrophobicContact CE2-CD1 3.81Å; Y338-L373 CarbonylContact O-C 3.6Å; Y338-K374 WeakPolarHBondContact O-CB 3.25Å; Y338-K374 PolarHBondContact O-N 3.23Å |
| 339 | M | 92.7 | Very high | 86.4 | Confident | 16 Ų | 16 | 43.2 Ų | 43.2 | 8% | 0.079 | 24% | 0.237 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -119.3 | 136.7 | 176.8 | -70.8 | 173 | 56.6 | 0 | 0 | 110.3 | Y292 A298 I300 K374 S375 I377 V417 | Y292-M339 HydrophobicContact CD1-SD 4.41Å; Y292-M339 HydrophobicContact CD2-SD 4.34Å; Y292-M339 HydrophobicContact CG-SD 4.2Å; A298-M339 PolarHBondContact O-N 3.28Å; I300-M339 PolarHBondContact N-O 3.36Å; M339-K374 HydrophobicContact CG-CB 4.1Å; M339-K374 HydrophobicContact SD-CD 4.43Å; M339-S375 WeakPolarHBondContact CA-O 3.22Å; M339-I377 HydrophobicContact CE-CD1 3.63Å; M339-V417 HydrophobicContact CE-CG2 3.98Å |
| 340 | I | 94.9 | Very high | 86.1 | Confident | 26 Ų | 26 | 48.1 Ų | 48.1 | 13% | 0.133 | 26% | 0.257 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.1 | 126.8 | 171.5 | -63 | 172.3 | 0 | 0 | 0 | 109.1 | I300 F302 Y338 L373 S375 L376 I377 | I300-I340 CarbonylContact O-C 3.6Å; I300-I340 VanDerWaalsContact O-CA 3.29Å; I300-I340 WeakPolarHBondContact O-CA 3.06Å; F302-I340 HydrophobicContact CB-CG2 4.42Å; Y338-I340 HydrophobicContact CD2-CG1 4.03Å; Y338-I340 HydrophobicContact CE2-CD1 3.77Å; Y338-I340 HydrophobicContact CE2-CG1 3.6Å; I340-L373 HydrophobicContact CB-CD1 4.16Å; I340-L373 HydrophobicContact CD1-CD1 3.79Å; I340-L373 HydrophobicContact CG1-CD1 3.68Å; I340-S375 PolarHBondContact N-O 3.08Å; I340-L376 HydrophobicContact CB-CD1 3.7Å; I340-L376 HydrophobicContact CG2-CD1 3.51Å; I340-L376 CarbonylContact O-C 3.53Å; I340-L376 WeakPolarHBondContact O-CA 3.36Å; I340-I377 PolarHBondContact O-N 2.91Å |
| 341 | V | 95.3 | Very high | 85.7 | Confident | 0 Ų | 0 | 49.6 Ų | 49.6 | 0% | 0 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 104.4 | 167.3 | -179.4 | 0 | 0 | 0 | 0 | 108.3 | I299 I300 V301 F302 L343 I377 V379 L413 V417 | I299-V341 HydrophobicContact CG2-CG2 4.16Å; I300-V341 PolarHBondContact O-N 2.77Å; V301-V341 WeakPolarHBondContact CA-O 3.14Å; F302-V341 PolarHBondContact N-O 2.91Å; V341-L343 HydrophobicContact CG1-CD2 3.68Å; V341-L343 HydrophobicContact CG1-CG 4.2Å; V341-I377 CarbonylContact C-O 3.59Å; V341-V379 HydrophobicContact CG1-CG2 3.97Å; V341-L413 HydrophobicContact CG1-CD1 3.79Å; V341-L413 HydrophobicContact CG1-CD2 4.08Å; V341-L413 HydrophobicContact CG2-CD1 4.26Å; V341-V417 HydrophobicContact CG2-CG2 4.11Å |
| 342 | Y | 94.8 | Very high | 85.5 | Confident | 45 Ų | 45 | 48.7 Ų | 48.7 | 18% | 0.176 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.5 | 105.6 | 179.5 | -174.4 | -82.3 | 0 | 0 | 0 | 110 | F302 V304 N344 I377 I378 V379 I385 | F302-Y342 HydrophobicContact CB-CD2 4.29Å; F302-Y342 AromaticContact CD1-CD2 3.49Å; F302-Y342 HydrophobicContact CD1-CD2 3.49Å; F302-Y342 VanDerWaalsContact CD1-CD2 3.49Å; F302-Y342 AromaticContact CD1-CE2 3.45Å; F302-Y342 HydrophobicContact CD1-CE2 3.45Å; F302-Y342 VanDerWaalsContact CD1-CE2 3.45Å; F302-Y342 HydrophobicContact CD1-CG 4.47Å; F302-Y342 HydrophobicContact CE1-CD2 4.21Å; F302-Y342 AromaticContact CE1-CE2 3.7Å; F302-Y342 HydrophobicContact CE1-CE2 3.7Å; F302-Y342 HydrophobicContact CG-CD2 4.2Å; F302-Y342 HydrophobicContact CG-CE2 4.5Å; V304-Y342 HydrophobicContact CG2-CD1 4.12Å; V304-Y342 HydrophobicContact CG2-CD2 4.41Å; V304-Y342 HydrophobicContact CG2-CE1 3.44Å; V304-Y342 VanDerWaalsContact CG2-CE1 3.44Å; V304-Y342 HydrophobicContact CG2-CE2 3.8Å; V304-Y342 WeakPolarHBondContact CG2-OH 3.37Å; Y342-N344 HydrophobicContact CD1-CB 4.14Å; Y342-N344 HydrophobicContact CE1-CB 3.91Å; Y342-N344 PolarHBondContact O-N 3.36Å; Y342-I377 PolarHBondContact N-O 3.34Å; Y342-I378 HydrophobicContact CD1-CG2 4.11Å; Y342-V379 PolarHBondContact O-N 3.4Å; Y342-I385 HydrophobicContact CD1-CD1 4.46Å; Y342-I385 HydrophobicContact CE1-CD1 3.46Å; Y342-I385 VanDerWaalsContact CE1-CD1 3.46Å |
| 343 | L | 93.7 | Very high | 85.3 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | 99.5 | -177.5 | -57.8 | 178.9 | 0 | 0 | 0 | 111 | V301 F302 V304 V341 V379 L413 I424 I428 | V301-L343 HydrophobicContact CG1-CD1 3.54Å; V301-L343 HydrophobicContact CG1-CG 4.01Å; F302-L343 PolarHBondContact O-N 2.86Å; V304-L343 WeakPolarHBondContact CG2-O 3.37Å; V304-L343 PolarHBondContact N-O 3.08Å; V341-L343 HydrophobicContact CG1-CD2 3.68Å; V341-L343 HydrophobicContact CG1-CG 4.2Å; L343-V379 HydrophobicContact CD2-CB 3.82Å; L343-V379 HydrophobicContact CD2-CG1 4.11Å; L343-V379 HydrophobicContact CD2-CG2 3.82Å; L343-L413 HydrophobicContact CD2-CD2 4.31Å; L343-I424 HydrophobicContact CD1-CG1 4.43Å; L343-I428 HydrophobicContact CB-CD1 3.71Å; L343-I428 HydrophobicContact CD1-CD1 4.21Å |
| 344 | N | 89.8 | Confident | 85.4 | Confident | 9 Ų | 9 | 43.9 Ų | 43.9 | 5% | 0.048 | 24% | 0.244 | C | C | . | . | trans | -93.1 | -7.6 | -179.1 | -177.6 | 78.3 | 0 | 0 | 0 | 114 | Y342 T347 M352 V379 H380 S382 I385 | Y342-N344 HydrophobicContact CD1-CB 4.14Å; Y342-N344 HydrophobicContact CE1-CB 3.91Å; Y342-N344 PolarHBondContact O-N 3.36Å; N344-T347 WeakPolarHBondContact O-CB 3.41Å; N344-T347 PolarHBondContact O-N 3.34Å; N344-T347 PolarHBondContact O-OG1 3.05Å; N344-M352 WeakPolarHBondContact OD1-CE 3.31Å; N344-V379 WeakPolarHBondContact CB-O 3.48Å; N344-V379 PolarHBondContact N-O 3.31Å; N344-H380 WeakPolarHBondContact CB-O 3.23Å; N344-H380 PolarHBondContact ND2-O 3.29Å; N344-S382 WeakPolarHBondContact ND2-CB 3.45Å; N344-S382 PolarHBondContact ND2-N 2.84Å; N344-S382 VanDerWaalsContact ND2-N 3.1Å; N344-I385 HydrophobicContact CB-CD1 4.33Å; N344-I385 VanDerWaalsContact OD1-CD1 3.22Å; N344-I385 WeakPolarHBondContact OD1-CD1 3.36Å | ||
| 345 | G | 79.8 | Confident | 85.6 | Confident | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.01 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -52 | 148.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | T347 I428 | G345-T347 PolarHBondContact O-N 3.07Å; G345-T347 PolarHBondContact O-OG1 3.34Å; G345-T347 VanDerWaalsContact O-OG1 3.08Å; G345-I428 WeakPolarHBondContact O-CG1 3.49Å |
| 346 | A | 74.4 | Confident | 86.2 | Confident | 52 Ų | 52 | 45.1 Ų | 45.1 | 43% | 0.43 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.7 | 8.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | C427 F431 | A346-C427 HydrophobicContact CB-CB 4.14Å; A346-C427 WeakPolarHBondContact CB-O 3.24Å; A346-F431 HydrophobicContact CB-CB 4.02Å; A346-F431 HydrophobicContact CB-CD2 4.4Å; A346-F431 HydrophobicContact CB-CG 4.4Å |
| 347 | T | 79.4 | Confident | 86.6 | Confident | 28 Ų | 28 | 42.3 Ų | 42.3 | 17% | 0.172 | 24% | 0.236 | C | C | . | . | trans | -91.9 | 124.4 | -170.4 | -59 | 0 | 0 | 0 | 0 | 112.8 | V304 C305 N344 G345 K351 M352 | V304-T347 HydrophobicContact CB-CG2 4.05Å; V304-T347 HydrophobicContact CG1-CG2 3.83Å; C305-T347 PolarHBondContact N-OG1 2.81Å; N344-T347 WeakPolarHBondContact O-CB 3.41Å; N344-T347 PolarHBondContact O-N 3.34Å; N344-T347 PolarHBondContact O-OG1 3.05Å; G345-T347 PolarHBondContact O-N 3.07Å; G345-T347 PolarHBondContact O-OG1 3.34Å; G345-T347 VanDerWaalsContact O-OG1 3.08Å; T347-K351 HydrophobicContact CG2-CB 3.83Å; T347-K351 HydrophobicContact CG2-CD 4.4Å; T347-M352 HydrophobicContact CG2-CE 4.01Å | ||
| 348 | S | 80.5 | Confident | 86.5 | Confident | 65 Ų | 65 | 41.4 Ų | 41.4 | 46% | 0.455 | 23% | 0.231 | S | C | . | . | trans | -72 | 150.7 | 174.5 | -179.1 | 0 | 0 | 0 | 0 | 112.4 | K350 K351 | S348-K350 PolarHBondContact O-N 3.21Å; S348-K350 VanDerWaalsContact O-N 3.1Å; S348-K351 PolarHBondContact O-N 3.28Å | ||
| 349 | R | 81.6 | Confident | 86.2 | Confident | 140 Ų | 140 | 47.9 Ų | 47.9 | 53% | 0.528 | 26% | 0.256 | S | S | . | . | G | 310 helix | trans | -55.6 | -28.3 | 176 | -69.7 | -75 | -74.1 | 129.8 | -7.6 | 113 | K351 M352 F384 | R349-K351 PolarHBondContact O-N 2.84Å; R349-M352 WeakPolarHBondContact O-CB 3.38Å; R349-M352 PolarHBondContact O-N 2.8Å; R349-F384 VanDerWaalsContact CZ-CD2 3.47Å; R349-F384 VanDerWaalsContact CZ-CG 3.41Å |
| 350 | K | 83.9 | Confident | 85.9 | Confident | 129 Ų | 129 | 53.8 Ų | 53.8 | 56% | 0.561 | 28% | 0.281 | S | S | * | . | G | 310 helix | trans | -62.7 | -18.4 | 177.1 | -60.7 | -174.8 | -179.5 | -176.9 | 0 | 114.1 | S310 S348 | S310-K350 WeakPolarHBondContact CB-O 3.45Å; S310-K350 PolarHBondContact N-O 3.32Å; S310-K350 PolarHBondContact OG-O 3.1Å; S348-K350 PolarHBondContact O-N 3.21Å; S348-K350 VanDerWaalsContact O-N 3.1Å |
| 351 | K | 83.5 | Confident | 85.6 | Confident | 42 Ų | 42 | 52.8 Ų | 52.8 | 18% | 0.183 | 28% | 0.276 | C | S | . | . | G | 310 helix | trans | -91.9 | -1.9 | 175.4 | -71.4 | -173.7 | 170.5 | 177.7 | 0 | 113.7 | C305 M307 E309 T347 S348 R349 | C305-K351 PolarHBondContact O-NZ 3.34Å; M307-K351 HydrophobicContact CB-CB 4.22Å; M307-K351 WeakPolarHBondContact CE-O 3.22Å; M307-K351 WeakPolarHBondContact O-CD 3.42Å; M307-K351 VanDerWaalsContact O-CE 3.24Å; M307-K351 WeakPolarHBondContact O-CE 3.33Å; E309-K351 HydrophobicContact CG-CD 4.21Å; E309-K351 HydrophobicContact CG-CG 3.66Å; E309-K351 WeakPolarHBondContact OE1-CE 3.38Å; E309-K351 IonicContact OE1-NZ 2.7Å; T347-K351 HydrophobicContact CG2-CB 3.83Å; T347-K351 HydrophobicContact CG2-CD 4.4Å; S348-K351 PolarHBondContact O-N 3.28Å; R349-K351 PolarHBondContact O-N 2.84Å |
| 352 | M | 84.6 | Confident | 85.2 | Confident | 17 Ų | 17 | 55 Ų | 55 | 8% | 0.084 | 29% | 0.285 | C | S | . | . | S | Bend | trans | -93.5 | 124.6 | 179.9 | -66.8 | -69.2 | 167 | 0 | 0 | 110.6 | V304 N344 T347 R349 F384 I385 | V304-M352 HydrophobicContact CB-CE 4.49Å; V304-M352 HydrophobicContact CG1-CE 3.71Å; V304-M352 HydrophobicContact CG1-SD 4.28Å; N344-M352 WeakPolarHBondContact OD1-CE 3.31Å; T347-M352 HydrophobicContact CG2-CE 4.01Å; R349-M352 WeakPolarHBondContact O-CB 3.38Å; R349-M352 PolarHBondContact O-N 2.8Å; M352-F384 HydrophobicContact CB-CE1 4.18Å; M352-F384 HydrophobicContact CG-CD1 4.36Å; M352-F384 HydrophobicContact CG-CE1 4.42Å; M352-I385 HydrophobicContact CE-CD1 3.92Å; M352-I385 HydrophobicContact SD-CD1 4.38Å |
| 353 | P | 83.3 | Confident | 84.8 | Confident | 7 Ų | 7 | 58.4 Ų | 58.4 | 5% | 0.045 | 30% | 0.302 | C | S | . | . | P | Polyproline II helix | trans | -66.9 | 160.2 | 172.9 | 26.1 | -32.5 | 0 | 0 | 0 | 111.8 | M307 Y315 M319 W357 L358 | M307-P353 HydrophobicContact CE-CG 4.18Å; Y315-P353 WeakPolarHBondContact OH-CA 3.28Å; M319-P353 HydrophobicContact CE-CB 3.78Å; M319-P353 HydrophobicContact CE-CG 3.75Å; P353-W357 HydrophobicContact CB-CB 4.43Å; P353-W357 HydrophobicContact CB-CD2 3.89Å; P353-W357 HydrophobicContact CB-CE3 3.37Å; P353-W357 HydrophobicContact CB-CG 4.37Å; P353-W357 HydrophobicContact CB-CZ3 3.9Å; P353-W357 HydrophobicContact CG-CD2 4.44Å; P353-W357 HydrophobicContact CG-CE3 3.46Å; P353-W357 VanDerWaalsContact CG-CE3 3.46Å; P353-W357 HydrophobicContact CG-CZ3 3.55Å; P353-L358 HydrophobicContact CG-CD1 4.23Å; P353-L358 HydrophobicContact CG-CD2 3.75Å; P353-L358 HydrophobicContact CG-CG 3.88Å |
| 354 | A | 86.1 | Confident | 84.5 | Confident | 70 Ų | 70 | 63.8 Ų | 63.8 | 58% | 0.579 | 33% | 0.328 | S | S | * | . | P | Polyproline II helix | trans | -61.3 | 151 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | G356 W357 L358 | A354-G356 VanDerWaalsContact C-N 3.29Å; A354-G356 PolarHBondContact O-N 2.82Å; A354-W357 WeakPolarHBondContact O-CB 3.36Å; A354-W357 PolarHBondContact O-N 3.48Å; A354-L358 PolarHBondContact O-N 3.36Å |
| 355 | V | 84.8 | Confident | 84.4 | Confident | 69 Ų | 69 | 65 Ų | 65 | 42% | 0.418 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -57.4 | -41.3 | -178.9 | 178.7 | 0 | 0 | 0 | 0 | 111.9 | W357 L358 R359 F384 L388 | V355-W357 VanDerWaalsContact C-N 3.31Å; V355-W357 PolarHBondContact O-N 3.19Å; V355-L358 PolarHBondContact O-N 3.22Å; V355-R359 PolarHBondContact O-N 3.38Å; V355-F384 HydrophobicContact CG2-CE2 3.93Å; V355-F384 HydrophobicContact CG2-CZ 3.95Å; V355-L388 HydrophobicContact CB-CD1 4.37Å; V355-L388 HydrophobicContact CG1-CD1 3.69Å; V355-L388 HydrophobicContact CG2-CD1 4.07Å |
| 356 | G | 85.8 | Confident | 84.8 | Confident | 45 Ų | 45 | 67.4 Ų | 67.4 | 46% | 0.464 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.6 | -34.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | A354 K360 | A354-G356 VanDerWaalsContact C-N 3.29Å; A354-G356 PolarHBondContact O-N 2.82Å; G356-K360 WeakPolarHBondContact O-CG 3.4Å; G356-K360 PolarHBondContact O-N 3.25Å; G356-K360 VanDerWaalsContact O-N 3.1Å |
| 357 | W | 88.2 | Confident | 85.4 | Confident | 49 Ų | 49 | 72.8 Ų | 72.8 | 19% | 0.186 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -70.3 | -43.3 | 174.5 | -174.4 | 92.2 | 0 | 0 | 0 | 111.1 | M319 D320 F323 P353 A354 V355 R359 K360 C361 | M319-W357 HydrophobicContact CB-CZ2 3.95Å; M319-W357 HydrophobicContact CE-CE3 4.32Å; M319-W357 HydrophobicContact CE-CH2 3.44Å; M319-W357 VanDerWaalsContact CE-CH2 3.44Å; M319-W357 HydrophobicContact CE-CZ2 3.86Å; M319-W357 HydrophobicContact CE-CZ3 3.71Å; D320-W357 PolarHBondContact OD1-NE1 2.7Å; F323-W357 HydrophobicContact CB-CH2 3.8Å; F323-W357 HydrophobicContact CB-CZ2 3.67Å; F323-W357 HydrophobicContact CD2-CH2 4.11Å; F323-W357 HydrophobicContact CG-CH2 4.14Å; F323-W357 HydrophobicContact CG-CZ2 4.18Å; P353-W357 HydrophobicContact CB-CB 4.43Å; P353-W357 HydrophobicContact CB-CD2 3.89Å; P353-W357 HydrophobicContact CB-CE3 3.37Å; P353-W357 HydrophobicContact CB-CG 4.37Å; P353-W357 HydrophobicContact CB-CZ3 3.9Å; P353-W357 HydrophobicContact CG-CD2 4.44Å; P353-W357 HydrophobicContact CG-CE3 3.46Å; P353-W357 VanDerWaalsContact CG-CE3 3.46Å; P353-W357 HydrophobicContact CG-CZ3 3.55Å; A354-W357 WeakPolarHBondContact O-CB 3.36Å; A354-W357 PolarHBondContact O-N 3.48Å; V355-W357 VanDerWaalsContact C-N 3.31Å; V355-W357 PolarHBondContact O-N 3.19Å; W357-R359 VanDerWaalsContact C-N 3.3Å; W357-R359 PolarHBondContact O-N 3.19Å; W357-K360 PolarHBondContact O-N 2.97Å; W357-C361 HydrophobicContact CE3-CB 4.48Å; W357-C361 WeakPolarHBondContact CH2-SG 3.01Å; W357-C361 WeakPolarHBondContact CZ2-SG 3.22Å; W357-C361 HydrophobicContact CZ3-CB 4.4Å; W357-C361 WeakPolarHBondContact CZ3-SG 3.46Å; W357-C361 WeakPolarHBondContact O-CB 3.4Å; W357-C361 PolarHBondContact O-N 2.98Å; W357-C361 PolarHBondContact O-SG 3.46Å |
| 358 | L | 87.7 | Confident | 85.8 | Confident | 54 Ų | 54 | 75.7 Ų | 75.7 | 28% | 0.283 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -61.4 | -36.8 | 175.5 | -71.1 | 168.1 | 0 | 0 | 0 | 112.5 | P353 A354 V355 Y362 L388 | P353-L358 HydrophobicContact CG-CD1 4.23Å; P353-L358 HydrophobicContact CG-CD2 3.75Å; P353-L358 HydrophobicContact CG-CG 3.88Å; A354-L358 PolarHBondContact O-N 3.36Å; V355-L358 PolarHBondContact O-N 3.22Å; L358-Y362 PolarHBondContact O-N 3.42Å; L358-L388 HydrophobicContact CD1-CD2 3.53Å |
| 359 | R | 85.1 | Confident | 86.3 | Confident | 142 Ų | 142 | 72.6 Ų | 72.6 | 54% | 0.536 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62.8 | -49.5 | 172.2 | -176.4 | 179.3 | 178.7 | -176.9 | 0.2 | 111.6 | V355 W357 C361 Y362 Q363 | V355-R359 PolarHBondContact O-N 3.38Å; W357-R359 VanDerWaalsContact C-N 3.3Å; W357-R359 PolarHBondContact O-N 3.19Å; R359-C361 VanDerWaalsContact C-N 3.33Å; R359-C361 PolarHBondContact O-N 3.27Å; R359-Y362 PolarHBondContact O-N 2.95Å; R359-Q363 WeakPolarHBondContact O-CG 3.39Å; R359-Q363 PolarHBondContact O-N 3.33Å; R359-Q363 VanDerWaalsContact O-N 3.13Å |
| 360 | K | 87.1 | Confident | 86.6 | Confident | 139 Ų | 139 | 69.3 Ų | 69.3 | 60% | 0.604 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -59.9 | -42.5 | 176.6 | -73 | -179.4 | 179.5 | -172.3 | 0 | 111.6 | G356 W357 Q363 Q364 | G356-K360 WeakPolarHBondContact O-CG 3.4Å; G356-K360 PolarHBondContact O-N 3.25Å; G356-K360 VanDerWaalsContact O-N 3.1Å; W357-K360 PolarHBondContact O-N 2.97Å; K360-Q363 WeakPolarHBondContact O-CB 2.96Å; K360-Q363 PolarHBondContact O-N 3.49Å; K360-Q364 WeakPolarHBondContact O-CG 3.38Å; K360-Q364 PolarHBondContact O-N 3.43Å |
| 361 | C | 88.1 | Confident | 86.9 | Confident | 6 Ų | 6 | 68.7 Ų | 68.7 | 4% | 0.041 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -58.4 | -52 | 174.9 | -72.3 | 0 | 0 | 0 | 0 | 111.8 | F323 W357 R359 Q363 Q364 I365 | F323-C361 HydrophobicContact CD2-CB 3.99Å; F323-C361 HydrophobicContact CE1-CB 4.16Å; F323-C361 HydrophobicContact CE2-CB 3.47Å; F323-C361 VanDerWaalsContact CE2-CB 3.47Å; F323-C361 HydrophobicContact CZ-CB 3.57Å; F323-C361 WeakPolarHBondContact CZ-O 3.37Å; W357-C361 HydrophobicContact CE3-CB 4.48Å; W357-C361 WeakPolarHBondContact CH2-SG 3.01Å; W357-C361 WeakPolarHBondContact CZ2-SG 3.22Å; W357-C361 HydrophobicContact CZ3-CB 4.4Å; W357-C361 WeakPolarHBondContact CZ3-SG 3.46Å; W357-C361 WeakPolarHBondContact O-CB 3.4Å; W357-C361 PolarHBondContact O-N 2.98Å; W357-C361 PolarHBondContact O-SG 3.46Å; R359-C361 VanDerWaalsContact C-N 3.33Å; R359-C361 PolarHBondContact O-N 3.27Å; C361-Q363 PolarHBondContact O-N 3.07Å; C361-Q364 CarbonylContact O-C 3.5Å; C361-Q364 PolarHBondContact O-N 3.37Å; C361-I365 VanDerWaalsContact O-CG1 3.27Å; C361-I365 WeakPolarHBondContact O-CG1 3.36Å; C361-I365 PolarHBondContact O-N 3.48Å |
| 362 | Y | 86.9 | Confident | 87.2 | Confident | 47 Ų | 47 | 68.3 Ų | 68.3 | 18% | 0.184 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -58.5 | -32.2 | 178.1 | 176 | -99.6 | 0 | 0 | 0 | 113.3 | L358 R359 R370 I396 F400 | L358-Y362 PolarHBondContact O-N 3.42Å; R359-Y362 PolarHBondContact O-N 2.95Å; Y362-R370 HydrophobicContact CE2-CG 4.36Å; Y362-I396 HydrophobicContact CD1-CG1 4.46Å; Y362-I396 HydrophobicContact CE1-CG1 4.11Å; Y362-I396 HydrophobicContact CE2-CG1 4.49Å; Y362-F400 HydrophobicContact CE2-CD2 4.33Å; Y362-F400 HydrophobicContact CE2-CE2 4.32Å; Y362-F400 HydrophobicContact CE2-CG 4.48Å; Y362-F400 HydrophobicContact CE2-CZ 4.48Å |
| 363 | Q | 86.8 | Confident | 87.5 | Confident | 116 Ų | 116 | 67.7 Ų | 67.7 | 54% | 0.542 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -71 | -38.4 | 173.7 | -69.8 | 170.1 | -35.6 | 0 | 0 | 112.4 | R359 K360 C361 I365 | R359-Q363 WeakPolarHBondContact O-CG 3.39Å; R359-Q363 PolarHBondContact O-N 3.33Å; R359-Q363 VanDerWaalsContact O-N 3.13Å; K360-Q363 WeakPolarHBondContact O-CB 2.96Å; K360-Q363 PolarHBondContact O-N 3.49Å; C361-Q363 PolarHBondContact O-N 3.07Å; Q363-I365 VanDerWaalsContact C-N 3.34Å |
| 364 | Q | 86.3 | Confident | 87.9 | Confident | 113 Ų | 113 | 72.3 Ų | 72.3 | 53% | 0.528 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -73.3 | -17.4 | 176.3 | -73.3 | 178.4 | -16 | 0 | 0 | 114.2 | F323 K360 C361 D366 | F323-Q364 HydrophobicContact CE1-CB 3.86Å; F323-Q364 VanDerWaalsContact CE1-OE1 3.3Å; F323-Q364 HydrophobicContact CZ-CB 4.27Å; K360-Q364 WeakPolarHBondContact O-CG 3.38Å; K360-Q364 PolarHBondContact O-N 3.43Å; C361-Q364 CarbonylContact O-C 3.5Å; C361-Q364 PolarHBondContact O-N 3.37Å; Q364-D366 PolarHBondContact O-N 2.96Å |
| 365 | I | 88.8 | Confident | 88.3 | Confident | 34 Ų | 34 | 69.2 Ų | 69.2 | 17% | 0.174 | 32% | 0.317 | C | S | . | . | S | Bend | trans | -68.3 | 124.2 | 173.5 | -49.9 | -168.8 | 0 | 0 | 0 | 109.4 | F323 I327 C361 Q363 L369 R370 | F323-I365 HydrophobicContact CZ-CG1 4.14Å; I327-I365 HydrophobicContact CD1-CD1 4.06Å; I327-I365 HydrophobicContact CD1-CG1 3.83Å; I327-I365 HydrophobicContact CD1-CG2 4.44Å; C361-I365 VanDerWaalsContact O-CG1 3.27Å; C361-I365 WeakPolarHBondContact O-CG1 3.36Å; C361-I365 PolarHBondContact O-N 3.48Å; Q363-I365 VanDerWaalsContact C-N 3.34Å; I365-L369 HydrophobicContact CG2-CB 3.77Å; I365-L369 HydrophobicContact CG2-CD1 4.02Å; I365-R370 HydrophobicContact CB-CG 4.19Å; I365-R370 HydrophobicContact CG2-CG 3.88Å; I365-R370 PolarHBondContact O-NE 3.23Å; I365-R370 PolarHBondContact O-NH2 3.24Å |
| 366 | D | 88.4 | Confident | 88.8 | Confident | 51 Ų | 51 | 67 Ų | 67 | 27% | 0.273 | 30% | 0.303 | S | S | . | . | trans | -52.9 | 144.8 | 174.7 | 179.5 | 25.7 | 0 | 0 | 0 | 112.3 | Q364 R368 L369 R370 | Q364-D366 PolarHBondContact O-N 2.96Å; D366-R368 PolarHBondContact O-N 3.24Å; D366-R368 PolarHBondContact OD1-N 3.13Å; D366-R368 WeakPolarHBondContact OD2-CB 3.18Å; D366-R368 PolarHBondContact OD2-N 3.36Å; D366-L369 PolarHBondContact O-N 3.48Å; D366-R370 PolarHBondContact O-N 3.14Å | ||
| 367 | R | 87.1 | Confident | 89.2 | Confident | 166 Ų | 166 | 64.9 Ų | 64.9 | 63% | 0.626 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -56 | -32.8 | 174.5 | -173.7 | 178.9 | -177.6 | -131 | 9.9 | 111.5 | K371 | R367-K371 HydrophobicContact CG-CD 4.38Å; R367-K371 WeakPolarHBondContact O-CB 3.45Å; R367-K371 VanDerWaalsContact O-CG 3.31Å; R367-K371 WeakPolarHBondContact O-CG 3.3Å; R367-K371 PolarHBondContact O-N 3.45Å |
| 368 | R | 88.1 | Confident | 89.5 | Confident | 89 Ų | 89 | 62.8 Ų | 62.8 | 34% | 0.336 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -60.2 | -56.1 | 175.5 | -169.9 | 170.3 | 66 | 97.5 | -10.5 | 111.3 | E331 V334 D366 R370 K371 N372 | E331-R368 IonicContact OE1-NH2 2.94Å; E331-R368 PolarHBondContact OE1-NH2 2.89Å; E331-R368 VanDerWaalsContact OE1-NH2 3.15Å; V334-R368 PolarHBondContact O-NH1 3.47Å; D366-R368 PolarHBondContact O-N 3.24Å; D366-R368 PolarHBondContact OD1-N 3.13Å; D366-R368 WeakPolarHBondContact OD2-CB 3.18Å; D366-R368 PolarHBondContact OD2-N 3.36Å; R368-R370 VanDerWaalsContact C-N 3.34Å; R368-R370 PolarHBondContact O-N 3.46Å; R368-K371 WeakPolarHBondContact O-CB 3.33Å; R368-K371 PolarHBondContact O-N 3.39Å; R368-K371 VanDerWaalsContact O-N 3.08Å; R368-N372 WeakPolarHBondContact O-CB 3.25Å; R368-N372 PolarHBondContact O-N 2.81Å; R368-N372 PolarHBondContact O-OD1 2.91Å |
| 369 | L | 89.4 | Confident | 89.9 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -56.9 | -45.5 | 179.2 | -60.9 | 177.6 | 0 | 0 | 0 | 111.7 | I327 L330 V334 Y338 I365 D366 K371 N372 L373 | I327-L369 HydrophobicContact CG2-CD1 4.04Å; L330-L369 HydrophobicContact CB-CD1 4.32Å; L330-L369 HydrophobicContact CB-CD2 4.47Å; V334-L369 HydrophobicContact CB-CD2 3.83Å; V334-L369 HydrophobicContact CG1-CD2 3.91Å; V334-L369 HydrophobicContact CG2-CD2 4.14Å; Y338-L369 WeakPolarHBondContact CE1-O 3.47Å; Y338-L369 PolarHBondContact OH-O 3.19Å; I365-L369 HydrophobicContact CG2-CB 3.77Å; I365-L369 HydrophobicContact CG2-CD1 4.02Å; D366-L369 PolarHBondContact O-N 3.48Å; L369-K371 VanDerWaalsContact C-N 3.31Å; L369-K371 PolarHBondContact O-N 3.38Å; L369-N372 PolarHBondContact O-N 3.15Å; L369-L373 PolarHBondContact O-N 3.34Å |
| 370 | R | 89.4 | Confident | 90.2 | Very high | 71 Ų | 71 | 53.8 Ų | 53.8 | 27% | 0.268 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -63.3 | -32.2 | 177.7 | -71.7 | -178 | -78.3 | 164.5 | -9.3 | 113.7 | Y362 I365 D366 R368 K403 | Y362-R370 HydrophobicContact CE2-CG 4.36Å; I365-R370 HydrophobicContact CB-CG 4.19Å; I365-R370 HydrophobicContact CG2-CG 3.88Å; I365-R370 PolarHBondContact O-NE 3.23Å; I365-R370 PolarHBondContact O-NH2 3.24Å; D366-R370 PolarHBondContact O-N 3.14Å; R368-R370 VanDerWaalsContact C-N 3.34Å; R368-R370 PolarHBondContact O-N 3.46Å; R370-K403 PolarHBondContact O-NZ 3.06Å |
| 371 | K | 88.6 | Confident | 90.4 | Very high | 116 Ų | 116 | 47.6 Ų | 47.6 | 50% | 0.504 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -72.9 | -50.7 | 174 | -78.7 | 177.3 | 172.1 | -170.9 | 0 | 111.6 | R367 R368 L369 L373 K403 | R367-K371 HydrophobicContact CG-CD 4.38Å; R367-K371 WeakPolarHBondContact O-CB 3.45Å; R367-K371 VanDerWaalsContact O-CG 3.31Å; R367-K371 WeakPolarHBondContact O-CG 3.3Å; R367-K371 PolarHBondContact O-N 3.45Å; R368-K371 WeakPolarHBondContact O-CB 3.33Å; R368-K371 PolarHBondContact O-N 3.39Å; R368-K371 VanDerWaalsContact O-N 3.08Å; L369-K371 VanDerWaalsContact C-N 3.31Å; L369-K371 PolarHBondContact O-N 3.38Å; K371-L373 VanDerWaalsContact C-N 3.3Å; K371-L373 PolarHBondContact O-N 2.97Å; K371-K403 PolarHBondContact O-NZ 2.8Å |
| 372 | N | 89.7 | Confident | 90.4 | Very high | 34 Ų | 34 | 48.6 Ų | 48.6 | 18% | 0.182 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -70.2 | -20.3 | -172.8 | -74.6 | 27.5 | 0 | 0 | 0 | 114.3 | V334 E336 N337 Y338 R368 L369 K374 | V334-N372 HydrophobicContact CG1-CB 3.88Å; E336-N372 VanDerWaalsContact O-CB 3.24Å; E336-N372 WeakPolarHBondContact O-CB 3.36Å; E336-N372 PolarHBondContact O-ND2 3.23Å; N337-N372 WeakPolarHBondContact CA-O 3.29Å; Y338-N372 HydrophobicContact CD1-CB 4.09Å; Y338-N372 HydrophobicContact CE1-CB 4.04Å; Y338-N372 PolarHBondContact N-O 2.89Å; Y338-N372 VanDerWaalsContact N-O 3.12Å; R368-N372 WeakPolarHBondContact O-CB 3.25Å; R368-N372 PolarHBondContact O-N 2.81Å; R368-N372 PolarHBondContact O-OD1 2.91Å; L369-N372 PolarHBondContact O-N 3.15Å; N372-K374 PolarHBondContact O-N 2.81Å; N372-K374 VanDerWaalsContact O-N 3.13Å |
| 373 | L | 92.6 | Very high | 90.5 | Very high | 4 Ų | 4 | 56 Ų | 56 | 2% | 0.021 | 25% | 0.245 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -58.5 | 117.6 | 171.8 | -179.5 | 66 | 0 | 0 | 0 | 110.4 | Y338 I340 L369 K371 S375 L376 F400 K403 | Y338-L373 HydrophobicContact CD2-CD1 4.15Å; Y338-L373 HydrophobicContact CE1-CB 3.89Å; Y338-L373 HydrophobicContact CE1-CD1 4.45Å; Y338-L373 VanDerWaalsContact CE1-N 3.29Å; Y338-L373 HydrophobicContact CE2-CD1 3.81Å; Y338-L373 CarbonylContact O-C 3.6Å; I340-L373 HydrophobicContact CB-CD1 4.16Å; I340-L373 HydrophobicContact CD1-CD1 3.79Å; I340-L373 HydrophobicContact CG1-CD1 3.68Å; L369-L373 PolarHBondContact O-N 3.34Å; K371-L373 VanDerWaalsContact C-N 3.3Å; K371-L373 PolarHBondContact O-N 2.97Å; L373-S375 WeakPolarHBondContact CD1-O 3.12Å; L373-L376 HydrophobicContact CD2-CB 4.28Å; L373-F400 HydrophobicContact CD2-CD2 4.25Å; L373-F400 HydrophobicContact CD2-CE2 3.51Å; L373-F400 HydrophobicContact CD2-CZ 4Å; L373-K403 HydrophobicContact CB-CD 4.48Å; L373-K403 HydrophobicContact CG-CD 4.44Å; L373-K403 WeakPolarHBondContact O-CD 3.28Å; L373-K403 WeakPolarHBondContact O-CE 3.28Å; L373-K403 PolarHBondContact O-NZ 3.25Å |
| 374 | K | 92 | Very high | 90.5 | Very high | 103 Ų | 103 | 51.8 Ų | 51.8 | 45% | 0.448 | 22% | 0.224 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -81.7 | -44.4 | 176.9 | -174.5 | 177.4 | -178 | 179.1 | 0 | 111.7 | Y338 M339 N372 | Y338-K374 WeakPolarHBondContact O-CB 3.25Å; Y338-K374 PolarHBondContact O-N 3.23Å; M339-K374 HydrophobicContact CG-CB 4.1Å; M339-K374 HydrophobicContact SD-CD 4.43Å; N372-K374 PolarHBondContact O-N 2.81Å; N372-K374 VanDerWaalsContact O-N 3.13Å |
| 375 | S | 93.1 | Very high | 90.7 | Very high | 6 Ų | 6 | 46.8 Ų | 46.8 | 4% | 0.042 | 20% | 0.201 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -153.7 | 144.2 | 177.5 | -164.6 | 0 | 0 | 0 | 0 | 111.7 | M339 I340 L373 K403 | M339-S375 WeakPolarHBondContact CA-O 3.22Å; I340-S375 PolarHBondContact N-O 3.08Å; L373-S375 WeakPolarHBondContact CD1-O 3.12Å; S375-K403 CarbonylContact C-O 3.55Å; S375-K403 WeakPolarHBondContact CA-O 3.42Å; S375-K403 PolarHBondContact OG-O 2.84Å; S375-K403 VanDerWaalsContact OG-O 3.04Å |
| 376 | L | 94.7 | Very high | 90.8 | Very high | 22 Ų | 22 | 48.6 Ų | 48.6 | 12% | 0.115 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 103.1 | 168.9 | 173.7 | 59.4 | 0 | 0 | 0 | 108.1 | I340 L373 I378 F400 K403 V404 K405 | I340-L376 HydrophobicContact CB-CD1 3.7Å; I340-L376 HydrophobicContact CG2-CD1 3.51Å; I340-L376 CarbonylContact O-C 3.53Å; I340-L376 WeakPolarHBondContact O-CA 3.36Å; L373-L376 HydrophobicContact CD2-CB 4.28Å; L376-I378 HydrophobicContact CD1-CG1 4.46Å; L376-I378 HydrophobicContact CD2-CD1 4.35Å; L376-I378 HydrophobicContact CG-CD1 4.37Å; L376-I378 HydrophobicContact CG-CG1 4.07Å; L376-F400 HydrophobicContact CD2-CE1 4.43Å; L376-F400 HydrophobicContact CD2-CZ 4.27Å; L376-K403 PolarHBondContact N-O 3.46Å; L376-V404 HydrophobicContact CD2-CG2 4.32Å; L376-V404 CarbonylContact O-C 3.58Å; L376-V404 WeakPolarHBondContact O-CA 3.09Å; L376-K405 PolarHBondContact O-N 2.95Å |
| 377 | I | 95.2 | Very high | 90.9 | Very high | 1 Ų | 1 | 48.5 Ų | 48.5 | 1% | 0.005 | 21% | 0.207 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -93.5 | 112.8 | -179.7 | -61.1 | 169.2 | 0 | 0 | 0 | 108.3 | M339 I340 V341 Y342 V379 K405 V407 L413 L416 V417 | M339-I377 HydrophobicContact CE-CD1 3.63Å; I340-I377 PolarHBondContact O-N 2.91Å; V341-I377 CarbonylContact C-O 3.59Å; Y342-I377 PolarHBondContact N-O 3.34Å; I377-V379 HydrophobicContact CG2-CG2 4.09Å; I377-K405 HydrophobicContact CG1-CB 4.42Å; I377-V407 HydrophobicContact CG2-CB 4.17Å; I377-V407 HydrophobicContact CG2-CG2 3.62Å; I377-L413 HydrophobicContact CG2-CD1 3.87Å; I377-L416 HydrophobicContact CD1-CB 4.14Å; I377-L416 HydrophobicContact CD1-CD1 4.33Å; I377-V417 HydrophobicContact CD1-CG2 3.6Å |
| 378 | I | 95.1 | Very high | 90.9 | Very high | 4 Ų | 4 | 41.6 Ų | 41.6 | 2% | 0.021 | 18% | 0.183 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 108.6 | -179.2 | -60.7 | 176.9 | 0 | 0 | 0 | 108.8 | Y342 L376 P381 I385 L389 V404 K405 Y406 V407 | Y342-I378 HydrophobicContact CD1-CG2 4.11Å; L376-I378 HydrophobicContact CD1-CG1 4.46Å; L376-I378 HydrophobicContact CD2-CD1 4.35Å; L376-I378 HydrophobicContact CG-CD1 4.37Å; L376-I378 HydrophobicContact CG-CG1 4.07Å; I378-P381 HydrophobicContact CG2-CB 3.78Å; I378-P381 HydrophobicContact CG2-CG 4.03Å; I378-I385 HydrophobicContact CD1-CG2 4.1Å; I378-I385 HydrophobicContact CG2-CG2 4.21Å; I378-L389 HydrophobicContact CD1-CD1 3.41Å; I378-L389 VanDerWaalsContact CD1-CD1 3.41Å; I378-V404 HydrophobicContact CD1-CG1 3.75Å; I378-V404 HydrophobicContact CG1-CG1 4.44Å; I378-K405 PolarHBondContact N-O 3.4Å; I378-Y406 HydrophobicContact CB-CD1 4.05Å; I378-Y406 HydrophobicContact CB-CE1 4.47Å; I378-Y406 HydrophobicContact CD1-CD1 4.4Å; I378-Y406 HydrophobicContact CD1-CE1 3.99Å; I378-Y406 HydrophobicContact CG2-CD1 4.34Å; I378-V407 PolarHBondContact O-N 3.05Å |
| 379 | V | 94.5 | Very high | 90.9 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 18% | 0.175 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -93.7 | 128 | -175.2 | -176.1 | 0 | 0 | 0 | 0 | 109.8 | V341 Y342 L343 N344 I377 V407 L410 L413 | V341-V379 HydrophobicContact CG1-CG2 3.97Å; Y342-V379 PolarHBondContact O-N 3.4Å; L343-V379 HydrophobicContact CD2-CB 3.82Å; L343-V379 HydrophobicContact CD2-CG1 4.11Å; L343-V379 HydrophobicContact CD2-CG2 3.82Å; N344-V379 WeakPolarHBondContact CB-O 3.48Å; N344-V379 PolarHBondContact N-O 3.31Å; I377-V379 HydrophobicContact CG2-CG2 4.09Å; V379-V407 HydrophobicContact CG1-CG1 4.43Å; V379-V407 HydrophobicContact CG2-CB 4.37Å; V379-V407 HydrophobicContact CG2-CG1 4.36Å; V379-L410 HydrophobicContact CG1-CD2 3.76Å; V379-L413 HydrophobicContact CG2-CD1 3.87Å; V379-L413 HydrophobicContact CG2-CD2 4.03Å; V379-L413 HydrophobicContact CG2-CG 4.37Å |
| 380 | H | 92.3 | Very high | 90.9 | Very high | 8 Ų | 8 | 42.1 Ų | 42.1 | 4% | 0.037 | 20% | 0.201 | C | C | . | . | S | Bend | trans | 49.7 | 60.6 | -170.5 | -54.2 | -51.6 | 0 | 0 | 0 | 113.8 | N344 S382 V407 Y408 F431 D432 | N344-H380 WeakPolarHBondContact CB-O 3.23Å; N344-H380 PolarHBondContact ND2-O 3.29Å; H380-S382 PolarHBondContact O-N 3.25Å; H380-V407 PolarHBondContact N-O 2.93Å; H380-Y408 PolarHBondContact CE1-O 2.88Å; H380-Y408 PolarHBondContact ND1-O 3.08Å; H380-F431 HydrophobicContact CB-CD1 4.47Å; H380-F431 HydrophobicContact CB-CE1 3.91Å; H380-F431 AromaticContact CD2-CD1 3.73Å; H380-F431 AromaticContact CD2-CE1 3.99Å; H380-F431 AromaticContact CG-CE1 3.8Å; H380-D432 IonicContact CE1-OD1 3.99Å; H380-D432 PolarHBondContact CE1-OD1 2.81Å; H380-D432 IonicContact NE2-OD1 3.88Å |
| 381 | P | 91.2 | Very high | 90.8 | Very high | 8 Ų | 8 | 44.5 Ų | 44.5 | 5% | 0.052 | 22% | 0.218 | C | C | . | . | trans | -57.3 | 133.4 | -178 | -2.1 | 4.9 | 0 | 0 | 0 | 111.2 | I378 R386 Y406 V407 | I378-P381 HydrophobicContact CG2-CB 3.78Å; I378-P381 HydrophobicContact CG2-CG 4.03Å; P381-R386 HydrophobicContact CB-CG 4.13Å; P381-R386 PolarHBondContact O-NH1 3.41Å; P381-R386 PolarHBondContact O-NH2 2.78Å; P381-Y406 HydrophobicContact CB-CD1 4.04Å; P381-Y406 HydrophobicContact CB-CE1 4.49Å; P381-Y406 HydrophobicContact CG-CD1 3.65Å; P381-Y406 HydrophobicContact CG-CG 4.14Å; P381-V407 VanDerWaalsContact CD-O 3.27Å; P381-V407 WeakPolarHBondContact CD-O 3.26Å | ||
| 382 | S | 89.3 | Confident | 90.4 | Very high | 28 Ų | 28 | 40.3 Ų | 40.3 | 20% | 0.196 | 20% | 0.203 | C | C | . | . | trans | -73.4 | 158.3 | 168.7 | 61.4 | 0 | 0 | 0 | 0 | 110.3 | N344 H380 F384 I385 R386 | N344-S382 WeakPolarHBondContact ND2-CB 3.45Å; N344-S382 PolarHBondContact ND2-N 2.84Å; N344-S382 VanDerWaalsContact ND2-N 3.1Å; H380-S382 PolarHBondContact O-N 3.25Å; S382-F384 PolarHBondContact O-N 3.36Å; S382-I385 PolarHBondContact O-N 2.65Å; S382-I385 WeakPolarHBondContact OG-CG1 3.27Å; S382-I385 PolarHBondContact OG-N 2.85Å; S382-R386 PolarHBondContact O-N 2.77Å; S382-R386 PolarHBondContact O-NH1 3.25Å | ||
| 383 | W | 88.3 | Confident | 90.1 | Very high | 202 Ų | 202 | 44.8 Ų | 44.8 | 77% | 0.765 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -55.6 | -43.5 | 172.9 | 179.9 | 76.1 | 0 | 0 | 0 | 111.2 | I385 R386 T387 | W383-I385 PolarHBondContact O-N 3.36Å; W383-R386 PolarHBondContact O-N 2.88Å; W383-T387 PolarHBondContact O-N 2.82Å; W383-T387 PolarHBondContact O-OG1 3.37Å; W383-T387 VanDerWaalsContact O-OG1 3.1Å |
| 384 | F | 87.3 | Confident | 89.4 | Confident | 27 Ų | 27 | 49.5 Ų | 49.5 | 12% | 0.118 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -54.4 | -46.9 | 174.7 | 172.8 | -109.5 | 0 | 0 | 0 | 113.5 | R349 M352 V355 S382 R386 T387 L388 | R349-F384 VanDerWaalsContact CZ-CD2 3.47Å; R349-F384 VanDerWaalsContact CZ-CG 3.41Å; M352-F384 HydrophobicContact CB-CE1 4.18Å; M352-F384 HydrophobicContact CG-CD1 4.36Å; M352-F384 HydrophobicContact CG-CE1 4.42Å; V355-F384 HydrophobicContact CG2-CE2 3.93Å; V355-F384 HydrophobicContact CG2-CZ 3.95Å; S382-F384 PolarHBondContact O-N 3.36Å; F384-R386 VanDerWaalsContact C-N 3.35Å; F384-R386 PolarHBondContact O-N 3.1Å; F384-T387 PolarHBondContact O-N 2.71Å; F384-L388 HydrophobicContact CE1-CD2 4.12Å; F384-L388 HydrophobicContact CZ-CD2 4.24Å; F384-L388 WeakPolarHBondContact O-CB 3.45Å; F384-L388 PolarHBondContact O-N 3.25Å |
| 385 | I | 89.1 | Confident | 88.7 | Confident | 9 Ų | 9 | 51.2 Ų | 51.2 | 5% | 0.046 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.5 | -38.2 | -179 | -71.7 | 174.9 | 0 | 0 | 0 | 111.3 | Y342 N344 M352 I378 S382 W383 L389 | Y342-I385 HydrophobicContact CD1-CD1 4.46Å; Y342-I385 HydrophobicContact CE1-CD1 3.46Å; Y342-I385 VanDerWaalsContact CE1-CD1 3.46Å; N344-I385 HydrophobicContact CB-CD1 4.33Å; N344-I385 VanDerWaalsContact OD1-CD1 3.22Å; N344-I385 WeakPolarHBondContact OD1-CD1 3.36Å; M352-I385 HydrophobicContact CE-CD1 3.92Å; M352-I385 HydrophobicContact SD-CD1 4.38Å; I378-I385 HydrophobicContact CD1-CG2 4.1Å; I378-I385 HydrophobicContact CG2-CG2 4.21Å; S382-I385 PolarHBondContact O-N 2.65Å; S382-I385 WeakPolarHBondContact OG-CG1 3.27Å; S382-I385 PolarHBondContact OG-N 2.85Å; W383-I385 PolarHBondContact O-N 3.36Å; I385-L389 HydrophobicContact CG2-CD1 3.62Å; I385-L389 HydrophobicContact CG2-CG 4.37Å; I385-L389 WeakPolarHBondContact O-CB 3.37Å; I385-L389 WeakPolarHBondContact O-CD1 3.42Å; I385-L389 VanDerWaalsContact O-CG 3.31Å; I385-L389 WeakPolarHBondContact O-CG 3.43Å; I385-L389 PolarHBondContact O-N 3.49Å |
| 386 | R | 90.8 | Very high | 88.1 | Confident | 72 Ų | 72 | 52 Ų | 52 | 27% | 0.272 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -60.9 | -49.8 | 173.3 | -64.8 | -172.5 | -169.4 | 75.3 | 10.8 | 111.1 | P381 S382 W383 F384 L389 A390 Y408 | P381-R386 HydrophobicContact CB-CG 4.13Å; P381-R386 PolarHBondContact O-NH1 3.41Å; P381-R386 PolarHBondContact O-NH2 2.78Å; S382-R386 PolarHBondContact O-N 2.77Å; S382-R386 PolarHBondContact O-NH1 3.25Å; W383-R386 PolarHBondContact O-N 2.88Å; F384-R386 VanDerWaalsContact C-N 3.35Å; F384-R386 PolarHBondContact O-N 3.1Å; R386-L389 PolarHBondContact O-N 2.95Å; R386-A390 WeakPolarHBondContact O-CB 3.45Å; R386-A390 PolarHBondContact O-N 3.11Å; R386-Y408 PolarHBondContact NE-OH 3.48Å; R386-Y408 VanDerWaalsContact NE-OH 3.13Å; R386-Y408 PolarHBondContact NH2-OH 2.78Å |
| 387 | T | 90.6 | Very high | 87.5 | Confident | 48 Ų | 48 | 54.2 Ų | 54.2 | 29% | 0.294 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63 | -44.1 | 179 | -54.5 | 0 | 0 | 0 | 0 | 111.6 | W383 F384 L389 A390 L391 | W383-T387 PolarHBondContact O-N 2.82Å; W383-T387 PolarHBondContact O-OG1 3.37Å; W383-T387 VanDerWaalsContact O-OG1 3.1Å; F384-T387 PolarHBondContact O-N 2.71Å; T387-L389 PolarHBondContact O-N 3.17Å; T387-A390 PolarHBondContact O-N 3.13Å; T387-L391 HydrophobicContact CG2-CD1 3.88Å; T387-L391 HydrophobicContact CG2-CG 4.3Å; T387-L391 WeakPolarHBondContact O-CB 3.42Å; T387-L391 WeakPolarHBondContact O-CG 3.34Å; T387-L391 PolarHBondContact O-N 2.87Å |
| 388 | L | 87.9 | Confident | 87 | Confident | 22 Ų | 22 | 57.9 Ų | 57.9 | 12% | 0.115 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.5 | -49.2 | 176.6 | 173.7 | 64.8 | 0 | 0 | 0 | 111.6 | V355 L358 F384 A390 L391 T392 | V355-L388 HydrophobicContact CB-CD1 4.37Å; V355-L388 HydrophobicContact CG1-CD1 3.69Å; V355-L388 HydrophobicContact CG2-CD1 4.07Å; L358-L388 HydrophobicContact CD1-CD2 3.53Å; F384-L388 HydrophobicContact CE1-CD2 4.12Å; F384-L388 HydrophobicContact CZ-CD2 4.24Å; F384-L388 WeakPolarHBondContact O-CB 3.45Å; F384-L388 PolarHBondContact O-N 3.25Å; L388-A390 VanDerWaalsContact C-N 3.3Å; L388-A390 PolarHBondContact O-N 3.14Å; L388-L391 PolarHBondContact O-N 3.28Å; L388-T392 HydrophobicContact CD1-CG2 3.77Å; L388-T392 WeakPolarHBondContact O-CB 3.41Å; L388-T392 WeakPolarHBondContact O-CG2 3.28Å; L388-T392 PolarHBondContact O-N 3.46Å; L388-T392 PolarHBondContact O-OG1 2.81Å |
| 389 | L | 88.7 | Confident | 86.6 | Confident | 35 Ų | 35 | 65.3 Ų | 65.3 | 18% | 0.183 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -69.5 | -28.2 | -179.8 | -70.7 | 166.3 | 0 | 0 | 0 | 112.5 | I378 I385 R386 T387 K393 V404 Y406 | I378-L389 HydrophobicContact CD1-CD1 3.41Å; I378-L389 VanDerWaalsContact CD1-CD1 3.41Å; I385-L389 HydrophobicContact CG2-CD1 3.62Å; I385-L389 HydrophobicContact CG2-CG 4.37Å; I385-L389 WeakPolarHBondContact O-CB 3.37Å; I385-L389 WeakPolarHBondContact O-CD1 3.42Å; I385-L389 VanDerWaalsContact O-CG 3.31Å; I385-L389 WeakPolarHBondContact O-CG 3.43Å; I385-L389 PolarHBondContact O-N 3.49Å; R386-L389 PolarHBondContact O-N 2.95Å; T387-L389 PolarHBondContact O-N 3.17Å; L389-K393 WeakPolarHBondContact O-CB 3.48Å; L389-K393 PolarHBondContact O-N 2.9Å; L389-V404 HydrophobicContact CD1-CG1 4.23Å; L389-Y406 HydrophobicContact CD1-CE1 3.91Å; L389-Y406 WeakPolarHBondContact CD1-OH 3.48Å |
| 390 | A | 88.3 | Confident | 86.2 | Confident | 64 Ų | 64 | 66.7 Ų | 66.7 | 53% | 0.529 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -69.5 | -48.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | R386 T387 L388 K393 | R386-A390 WeakPolarHBondContact O-CB 3.45Å; R386-A390 PolarHBondContact O-N 3.11Å; T387-A390 PolarHBondContact O-N 3.13Å; L388-A390 VanDerWaalsContact C-N 3.3Å; L388-A390 PolarHBondContact O-N 3.14Å; A390-K393 WeakPolarHBondContact O-CB 3.31Å; A390-K393 PolarHBondContact O-N 2.89Å |
| 391 | L | 87 | Confident | 86 | Confident | 121 Ų | 121 | 67.8 Ų | 67.8 | 63% | 0.634 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -70.3 | -30.7 | -179.8 | -68.9 | 175.7 | 0 | 0 | 0 | 113.5 | T387 L388 P394 | T387-L391 HydrophobicContact CG2-CD1 3.88Å; T387-L391 HydrophobicContact CG2-CG 4.3Å; T387-L391 WeakPolarHBondContact O-CB 3.42Å; T387-L391 WeakPolarHBondContact O-CG 3.34Å; T387-L391 PolarHBondContact O-N 2.87Å; L388-L391 PolarHBondContact O-N 3.28Å; L391-P394 WeakPolarHBondContact O-CD 3.44Å |
| 392 | T | 81.2 | Confident | 86 | Confident | 29 Ų | 29 | 73.9 Ų | 73.9 | 18% | 0.178 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -86.9 | -8.6 | 177.1 | 54.1 | 0 | 0 | 0 | 0 | 113.5 | L388 P394 F395 I396 | L388-T392 HydrophobicContact CD1-CG2 3.77Å; L388-T392 WeakPolarHBondContact O-CB 3.41Å; L388-T392 WeakPolarHBondContact O-CG2 3.28Å; L388-T392 PolarHBondContact O-N 3.46Å; L388-T392 PolarHBondContact O-OG1 2.81Å; T392-P394 VanDerWaalsContact C-CD 3.48Å; T392-F395 PolarHBondContact O-N 2.85Å; T392-I396 WeakPolarHBondContact O-CG1 3.19Å; T392-I396 PolarHBondContact O-N 3.41Å; T392-I396 WeakPolarHBondContact OG1-CD1 3.24Å |
| 393 | K | 82.8 | Confident | 86.1 | Confident | 128 Ų | 128 | 74.4 Ų | 74.4 | 56% | 0.557 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.4 | -42.2 | 177.2 | -165.4 | 173.1 | -178.8 | -179.8 | 0 | 115.2 | L389 A390 F395 I396 | L389-K393 WeakPolarHBondContact O-CB 3.48Å; L389-K393 PolarHBondContact O-N 2.9Å; A390-K393 WeakPolarHBondContact O-CB 3.31Å; A390-K393 PolarHBondContact O-N 2.89Å; K393-F395 VanDerWaalsContact C-N 3.29Å; K393-F395 PolarHBondContact O-N 3.5Å; K393-I396 PolarHBondContact O-N 2.99Å |
| 394 | P | 79.1 | Confident | 86.4 | Confident | 102 Ų | 102 | 66 Ų | 66 | 66% | 0.662 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -21.7 | 176.4 | 25.9 | -34.7 | 0 | 0 | 0 | 114.2 | L391 T392 | L391-P394 WeakPolarHBondContact O-CD 3.44Å; T392-P394 VanDerWaalsContact C-CD 3.48Å |
| 395 | F | 76.2 | Confident | 86.7 | Confident | 139 Ų | 139 | 69.6 Ų | 69.6 | 61% | 0.61 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.1 | -9.9 | 179.9 | -56 | -75.1 | 0 | 0 | 0 | 113.3 | T392 K393 | T392-F395 PolarHBondContact O-N 2.85Å; K393-F395 VanDerWaalsContact C-N 3.29Å; K393-F395 PolarHBondContact O-N 3.5Å |
| 396 | I | 80.6 | Confident | 86.9 | Confident | 24 Ų | 24 | 73.5 Ų | 73.5 | 12% | 0.123 | 38% | 0.38 | C | S | . | . | S | Bend | trans | -105.2 | 142.2 | 179.2 | -68.8 | 173.5 | 0 | 0 | 0 | 107.9 | Y362 T392 K393 S398 F400 | Y362-I396 HydrophobicContact CD1-CG1 4.46Å; Y362-I396 HydrophobicContact CE1-CG1 4.11Å; Y362-I396 HydrophobicContact CE2-CG1 4.49Å; T392-I396 WeakPolarHBondContact O-CG1 3.19Å; T392-I396 PolarHBondContact O-N 3.41Å; T392-I396 WeakPolarHBondContact OG1-CD1 3.24Å; K393-I396 PolarHBondContact O-N 2.99Å; I396-S398 PolarHBondContact O-N 3.41Å; I396-F400 HydrophobicContact CG2-CB 3.74Å; I396-F400 HydrophobicContact CG2-CD1 3.44Å; I396-F400 VanDerWaalsContact CG2-CD1 3.44Å; I396-F400 HydrophobicContact CG2-CE1 4.34Å; I396-F400 HydrophobicContact CG2-CG 3.87Å |
| 397 | S | 82.7 | Confident | 87.1 | Confident | 68 Ų | 68 | 70.3 Ų | 70.3 | 48% | 0.476 | 37% | 0.368 | S | S | . | . | trans | -57.7 | 136.5 | 178 | -179.1 | 0 | 0 | 0 | 0 | 110.8 | K399 F400 S401 | S397-K399 PolarHBondContact O-N 3.33Å; S397-K399 VanDerWaalsContact O-N 3.16Å; S397-K399 PolarHBondContact OG-N 3.04Å; S397-F400 WeakPolarHBondContact O-CA 3.13Å; S397-F400 WeakPolarHBondContact O-CB 3.41Å; S397-F400 PolarHBondContact O-N 3.1Å; S397-S401 PolarHBondContact O-N 3Å | ||
| 398 | S | 84.1 | Confident | 87.1 | Confident | 77 Ų | 77 | 72.9 Ų | 72.9 | 54% | 0.538 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -51.6 | -39 | 173.7 | -178.5 | 0 | 0 | 0 | 0 | 111.7 | I396 F400 S401 Q402 | I396-S398 PolarHBondContact O-N 3.41Å; S398-F400 VanDerWaalsContact C-N 3.29Å; S398-F400 PolarHBondContact O-N 3.04Å; S398-S401 PolarHBondContact O-N 2.98Å; S398-Q402 VanDerWaalsContact O-CG 3.31Å; S398-Q402 WeakPolarHBondContact O-CG 3.22Å; S398-Q402 PolarHBondContact O-N 3.21Å; S398-Q402 PolarHBondContact OG-NE2 3.13Å |
| 399 | K | 86.1 | Confident | 87.3 | Confident | 160 Ų | 160 | 72.3 Ų | 72.3 | 70% | 0.696 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -66.9 | -23.4 | 175.1 | -65.2 | -161.9 | 179.1 | -175 | 0 | 114.2 | S397 K403 | S397-K399 PolarHBondContact O-N 3.33Å; S397-K399 VanDerWaalsContact O-N 3.16Å; S397-K399 PolarHBondContact OG-N 3.04Å; K399-K403 WeakPolarHBondContact O-CG 3.34Å |
| 400 | F | 87.8 | Confident | 87.5 | Confident | 29 Ų | 29 | 71.8 Ų | 71.8 | 13% | 0.127 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -80.3 | -41.6 | 170.2 | -175.8 | -79.1 | 0 | 0 | 0 | 111 | Y362 L373 L376 I396 S397 S398 Q402 K403 V404 | Y362-F400 HydrophobicContact CE2-CD2 4.33Å; Y362-F400 HydrophobicContact CE2-CE2 4.32Å; Y362-F400 HydrophobicContact CE2-CG 4.48Å; Y362-F400 HydrophobicContact CE2-CZ 4.48Å; L373-F400 HydrophobicContact CD2-CD2 4.25Å; L373-F400 HydrophobicContact CD2-CE2 3.51Å; L373-F400 HydrophobicContact CD2-CZ 4Å; L376-F400 HydrophobicContact CD2-CE1 4.43Å; L376-F400 HydrophobicContact CD2-CZ 4.27Å; I396-F400 HydrophobicContact CG2-CB 3.74Å; I396-F400 HydrophobicContact CG2-CD1 3.44Å; I396-F400 VanDerWaalsContact CG2-CD1 3.44Å; I396-F400 HydrophobicContact CG2-CE1 4.34Å; I396-F400 HydrophobicContact CG2-CG 3.87Å; S397-F400 WeakPolarHBondContact O-CA 3.13Å; S397-F400 WeakPolarHBondContact O-CB 3.41Å; S397-F400 PolarHBondContact O-N 3.1Å; S398-F400 VanDerWaalsContact C-N 3.29Å; S398-F400 PolarHBondContact O-N 3.04Å; F400-Q402 PolarHBondContact O-N 3.23Å; F400-K403 WeakPolarHBondContact O-CB 3.45Å; F400-K403 PolarHBondContact O-N 3Å; F400-V404 HydrophobicContact CD1-CG2 4.49Å; F400-V404 HydrophobicContact CE1-CG2 4.31Å |
| 401 | S | 87.2 | Confident | 87.6 | Confident | 31 Ų | 31 | 75.7 Ų | 75.7 | 22% | 0.217 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -57.9 | -36 | 176.2 | -62.4 | 0 | 0 | 0 | 0 | 112.3 | S397 S398 K403 V404 | S397-S401 PolarHBondContact O-N 3Å; S398-S401 PolarHBondContact O-N 2.98Å; S401-K403 PolarHBondContact O-N 3.31Å; S401-V404 PolarHBondContact O-N 3.1Å |
| 402 | Q | 90.6 | Very high | 87.9 | Confident | 137 Ų | 137 | 72.8 Ų | 72.8 | 64% | 0.64 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | -19.7 | 174.5 | -69.9 | 166.8 | 22.9 | 0 | 0 | 114.3 | S398 F400 V404 | S398-Q402 VanDerWaalsContact O-CG 3.31Å; S398-Q402 WeakPolarHBondContact O-CG 3.22Å; S398-Q402 PolarHBondContact O-N 3.21Å; S398-Q402 PolarHBondContact OG-NE2 3.13Å; F400-Q402 PolarHBondContact O-N 3.23Å; Q402-V404 VanDerWaalsContact C-N 3.34Å |
| 403 | K | 92.3 | Very high | 88.4 | Confident | 38 Ų | 38 | 71.4 Ų | 71.4 | 17% | 0.165 | 35% | 0.35 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.8 | -16.5 | 177.3 | -63.8 | 168.9 | 178.9 | -162.1 | 0 | 112.6 | R370 K371 L373 S375 L376 K399 F400 S401 | R370-K403 PolarHBondContact O-NZ 3.06Å; K371-K403 PolarHBondContact O-NZ 2.8Å; L373-K403 HydrophobicContact CB-CD 4.48Å; L373-K403 HydrophobicContact CG-CD 4.44Å; L373-K403 WeakPolarHBondContact O-CD 3.28Å; L373-K403 WeakPolarHBondContact O-CE 3.28Å; L373-K403 PolarHBondContact O-NZ 3.25Å; S375-K403 CarbonylContact C-O 3.55Å; S375-K403 WeakPolarHBondContact CA-O 3.42Å; S375-K403 PolarHBondContact OG-O 2.84Å; S375-K403 VanDerWaalsContact OG-O 3.04Å; L376-K403 PolarHBondContact N-O 3.46Å; K399-K403 WeakPolarHBondContact O-CG 3.34Å; F400-K403 WeakPolarHBondContact O-CB 3.45Å; F400-K403 PolarHBondContact O-N 3Å; S401-K403 PolarHBondContact O-N 3.31Å |
| 404 | V | 93.4 | Very high | 88.8 | Confident | 26 Ų | 26 | 67.8 Ų | 67.8 | 16% | 0.158 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.2 | 121.7 | -175.8 | -173.8 | 0 | 0 | 0 | 0 | 110.5 | L376 I378 L389 F400 S401 Q402 Y406 | L376-V404 HydrophobicContact CD2-CG2 4.32Å; L376-V404 CarbonylContact O-C 3.58Å; L376-V404 WeakPolarHBondContact O-CA 3.09Å; I378-V404 HydrophobicContact CD1-CG1 3.75Å; I378-V404 HydrophobicContact CG1-CG1 4.44Å; L389-V404 HydrophobicContact CD1-CG1 4.23Å; F400-V404 HydrophobicContact CD1-CG2 4.49Å; F400-V404 HydrophobicContact CE1-CG2 4.31Å; S401-V404 PolarHBondContact O-N 3.1Å; Q402-V404 VanDerWaalsContact C-N 3.34Å; V404-Y406 HydrophobicContact CG1-CE1 4Å |
| 405 | K | 94.1 | Very high | 89.4 | Confident | 102 Ų | 102 | 70.8 Ų | 70.8 | 44% | 0.443 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.1 | 136.7 | 174.3 | -63.9 | -174.7 | 179.7 | -175.4 | 0 | 109.6 | L376 I377 I378 | L376-K405 PolarHBondContact O-N 2.95Å; I377-K405 HydrophobicContact CG1-CB 4.42Å; I378-K405 PolarHBondContact N-O 3.4Å |
| 406 | Y | 94.6 | Very high | 90 | Very high | 91 Ų | 91 | 67.2 Ų | 67.2 | 36% | 0.357 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.5 | 126.2 | 176.9 | -60.4 | -60.9 | 0 | 0 | 0 | 110.2 | I378 P381 L389 V404 | I378-Y406 HydrophobicContact CB-CD1 4.05Å; I378-Y406 HydrophobicContact CB-CE1 4.47Å; I378-Y406 HydrophobicContact CD1-CD1 4.4Å; I378-Y406 HydrophobicContact CD1-CE1 3.99Å; I378-Y406 HydrophobicContact CG2-CD1 4.34Å; P381-Y406 HydrophobicContact CB-CD1 4.04Å; P381-Y406 HydrophobicContact CB-CE1 4.49Å; P381-Y406 HydrophobicContact CG-CD1 3.65Å; P381-Y406 HydrophobicContact CG-CG 4.14Å; L389-Y406 HydrophobicContact CD1-CE1 3.91Å; L389-Y406 WeakPolarHBondContact CD1-OH 3.48Å; V404-Y406 HydrophobicContact CG1-CE1 4Å |
| 407 | V | 94.2 | Very high | 90.3 | Very high | 5 Ų | 5 | 66.2 Ų | 66.2 | 3% | 0.03 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 137 | -178.7 | 165.1 | 0 | 0 | 0 | 0 | 109.4 | I377 I378 V379 H380 P381 S409 D412 L413 L416 | I377-V407 HydrophobicContact CG2-CB 4.17Å; I377-V407 HydrophobicContact CG2-CG2 3.62Å; I378-V407 PolarHBondContact O-N 3.05Å; V379-V407 HydrophobicContact CG1-CG1 4.43Å; V379-V407 HydrophobicContact CG2-CB 4.37Å; V379-V407 HydrophobicContact CG2-CG1 4.36Å; H380-V407 PolarHBondContact N-O 2.93Å; P381-V407 VanDerWaalsContact CD-O 3.27Å; P381-V407 WeakPolarHBondContact CD-O 3.26Å; V407-S409 WeakPolarHBondContact CG1-O 3.46Å; V407-D412 HydrophobicContact CG1-CB 4.08Å; V407-L413 HydrophobicContact CG1-CB 4.09Å; V407-L416 HydrophobicContact CG2-CD1 3.67Å |
| 408 | Y | 91.3 | Very high | 90.5 | Very high | 102 Ų | 102 | 65.5 Ų | 65.5 | 40% | 0.4 | 33% | 0.325 | S | S | . | . | trans | -112 | -20 | -167.5 | -73.1 | -98.6 | 0 | 0 | 0 | 113.6 | H380 R386 D412 K435 | H380-Y408 PolarHBondContact CE1-O 2.88Å; H380-Y408 PolarHBondContact ND1-O 3.08Å; R386-Y408 PolarHBondContact NE-OH 3.48Å; R386-Y408 VanDerWaalsContact NE-OH 3.13Å; R386-Y408 PolarHBondContact NH2-OH 2.78Å; Y408-D412 PolarHBondContact N-OD2 3.17Å; Y408-K435 PolarHBondContact O-NZ 2.95Å | ||
| 409 | S | 91.8 | Very high | 90.5 | Very high | 10 Ų | 10 | 64.6 Ų | 64.6 | 7% | 0.07 | 31% | 0.313 | C | S | . | . | S | Bend | trans | -128 | 160.2 | 167.6 | -173.9 | 0 | 0 | 0 | 0 | 112.1 | V407 K411 D412 L413 D432 | V407-S409 WeakPolarHBondContact CG1-O 3.46Å; S409-K411 PolarHBondContact O-N 3.39Å; S409-K411 PolarHBondContact OG-N 2.93Å; S409-D412 WeakPolarHBondContact CB-OD1 3.33Å; S409-D412 PolarHBondContact N-OD2 3.39Å; S409-L413 PolarHBondContact O-N 3.12Å; S409-D432 WeakPolarHBondContact CA-OD1 3.39Å; S409-D432 PolarHBondContact OG-OD1 2.99Å |
| 410 | L | 91.9 | Very high | 90.1 | Very high | 24 Ų | 24 | 64.7 Ų | 64.7 | 13% | 0.126 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -65.6 | -18.5 | 168.7 | -62.4 | -176.8 | 0 | 0 | 0 | 113.2 | V379 L413 A414 I424 I428 K429 D432 | V379-L410 HydrophobicContact CG1-CD2 3.76Å; L410-L413 HydrophobicContact CD2-CD2 4.33Å; L410-L413 WeakPolarHBondContact O-CB 3.36Å; L410-L413 PolarHBondContact O-N 2.89Å; L410-A414 PolarHBondContact O-N 2.82Å; L410-I424 HydrophobicContact CD1-CD1 4.02Å; L410-I424 HydrophobicContact CD1-CG2 4.26Å; L410-I424 HydrophobicContact CD2-CD1 3.83Å; L410-I424 HydrophobicContact CG-CD1 4.39Å; L410-I428 HydrophobicContact CD2-CG2 4.22Å; L410-K429 HydrophobicContact CD1-CG 4.29Å; L410-D432 HydrophobicContact CD1-CB 3.77Å; L410-D432 HydrophobicContact CG-CB 3.76Å; L410-D432 PolarHBondContact N-OD1 3.37Å |
| 411 | K | 91.9 | Very high | 89.6 | Confident | 147 Ų | 147 | 70.9 Ų | 70.9 | 64% | 0.639 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -67.8 | -53.3 | 174.1 | -64 | -177.1 | 179.8 | -176.9 | 0 | 111.5 | S409 L413 A414 E415 | S409-K411 PolarHBondContact O-N 3.39Å; S409-K411 PolarHBondContact OG-N 2.93Å; K411-L413 PolarHBondContact O-N 3.5Å; K411-L413 VanDerWaalsContact O-N 3.15Å; K411-A414 WeakPolarHBondContact O-CB 3.41Å; K411-A414 PolarHBondContact O-N 2.88Å; K411-E415 PolarHBondContact O-N 3.06Å |
| 412 | D | 91.9 | Very high | 89.5 | Confident | 59 Ų | 59 | 70 Ų | 70 | 32% | 0.316 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61.1 | -22.7 | 175.4 | 2.4 | -48.7 | 0 | 0 | 0 | 112.8 | V407 Y408 S409 L416 | V407-D412 HydrophobicContact CG1-CB 4.08Å; Y408-D412 PolarHBondContact N-OD2 3.17Å; S409-D412 WeakPolarHBondContact CB-OD1 3.33Å; S409-D412 PolarHBondContact N-OD2 3.39Å; D412-L416 WeakPolarHBondContact O-CG 3.5Å |
| 413 | L | 91.9 | Very high | 89.3 | Confident | 0 Ų | 0 | 66.7 Ų | 66.7 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -69.4 | -43.1 | 170.2 | 179.2 | 65.3 | 0 | 0 | 0 | 112 | V341 L343 I377 V379 V407 S409 L410 K411 E415 L416 V417 M419 I424 | V341-L413 HydrophobicContact CG1-CD1 3.79Å; V341-L413 HydrophobicContact CG1-CD2 4.08Å; V341-L413 HydrophobicContact CG2-CD1 4.26Å; L343-L413 HydrophobicContact CD2-CD2 4.31Å; I377-L413 HydrophobicContact CG2-CD1 3.87Å; V379-L413 HydrophobicContact CG2-CD1 3.87Å; V379-L413 HydrophobicContact CG2-CD2 4.03Å; V379-L413 HydrophobicContact CG2-CG 4.37Å; V407-L413 HydrophobicContact CG1-CB 4.09Å; S409-L413 PolarHBondContact O-N 3.12Å; L410-L413 HydrophobicContact CD2-CD2 4.33Å; L410-L413 WeakPolarHBondContact O-CB 3.36Å; L410-L413 PolarHBondContact O-N 2.89Å; K411-L413 PolarHBondContact O-N 3.5Å; K411-L413 VanDerWaalsContact O-N 3.15Å; L413-E415 VanDerWaalsContact C-N 3.26Å; L413-E415 PolarHBondContact O-N 3.21Å; L413-L416 PolarHBondContact O-N 3.33Å; L413-V417 HydrophobicContact CD1-CG2 4.16Å; L413-V417 PolarHBondContact O-N 2.82Å; L413-M419 HydrophobicContact CD2-SD 4.11Å; L413-M419 HydrophobicContact CG-SD 4.12Å; L413-I424 HydrophobicContact CD2-CD1 4.27Å |
| 414 | A | 91.4 | Very high | 89.2 | Confident | 52 Ų | 52 | 66 Ų | 66 | 43% | 0.43 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -67.4 | -25.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | L410 K411 L416 M419 | L410-A414 PolarHBondContact O-N 2.82Å; K411-A414 WeakPolarHBondContact O-CB 3.41Å; K411-A414 PolarHBondContact O-N 2.88Å; A414-L416 VanDerWaalsContact C-N 3.29Å; A414-M419 HydrophobicContact CB-CG 3.54Å; A414-M419 HydrophobicContact CB-SD 4.41Å |
| 415 | E | 91.1 | Very high | 89.1 | Confident | 166 Ų | 166 | 65.4 Ų | 65.4 | 78% | 0.776 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.8 | -23 | 171 | -65.5 | 177.1 | -170.4 | 0 | 0 | 112.9 | K411 L413 | K411-E415 PolarHBondContact O-N 3.06Å; L413-E415 VanDerWaalsContact C-N 3.26Å; L413-E415 PolarHBondContact O-N 3.21Å |
| 416 | L | 88.3 | Confident | 88.9 | Confident | 63 Ų | 63 | 65.5 Ų | 65.5 | 33% | 0.33 | 33% | 0.325 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.8 | -24.3 | -175.7 | -66.3 | 174.3 | 0 | 0 | 0 | 113.9 | I377 V407 D412 L413 A414 | I377-L416 HydrophobicContact CD1-CB 4.14Å; I377-L416 HydrophobicContact CD1-CD1 4.33Å; V407-L416 HydrophobicContact CG2-CD1 3.67Å; D412-L416 WeakPolarHBondContact O-CG 3.5Å; L413-L416 PolarHBondContact O-N 3.33Å; A414-L416 VanDerWaalsContact C-N 3.29Å |
| 417 | V | 88.8 | Confident | 88.7 | Confident | 3 Ų | 3 | 63.5 Ų | 63.5 | 2% | 0.018 | 32% | 0.324 | C | S | . | . | S | Bend | trans | -143.9 | 132.4 | -170.2 | -174.8 | 0 | 0 | 0 | 0 | 109.8 | I299 M339 V341 I377 L413 M419 V422 | I299-V417 HydrophobicContact CD1-CG1 3.69Å; I299-V417 HydrophobicContact CG1-CG1 4.19Å; I299-V417 HydrophobicContact CG2-CG1 3.85Å; M339-V417 HydrophobicContact CE-CG2 3.98Å; V341-V417 HydrophobicContact CG2-CG2 4.11Å; I377-V417 HydrophobicContact CD1-CG2 3.6Å; L413-V417 HydrophobicContact CD1-CG2 4.16Å; L413-V417 PolarHBondContact O-N 2.82Å; V417-M419 PolarHBondContact O-N 3.21Å; V417-V422 HydrophobicContact CG1-CG2 4.13Å |
| 418 | P | 85.4 | Confident | 88.5 | Confident | 53 Ų | 53 | 63.2 Ų | 63.2 | 34% | 0.344 | 32% | 0.323 | S | S | . | . | trans | -61.8 | 121.2 | 174.2 | 26.2 | -34.1 | 0 | 0 | 0 | 110.3 | I299 E420 V422 | I299-P418 HydrophobicContact CD1-CG 3.76Å; P418-E420 PolarHBondContact O-N 3.37Å; P418-V422 WeakPolarHBondContact O-CG2 3.42Å | ||
| 419 | M | 83.6 | Confident | 88.5 | Confident | 58 Ų | 58 | 62.6 Ų | 62.6 | 29% | 0.286 | 32% | 0.322 | S | S | . | . | trans | -83.6 | -8.3 | -170.2 | -73.1 | -56.3 | -51.9 | 0 | 0 | 114.9 | L413 A414 V417 Y421 V422 I424 | L413-M419 HydrophobicContact CD2-SD 4.11Å; L413-M419 HydrophobicContact CG-SD 4.12Å; A414-M419 HydrophobicContact CB-CG 3.54Å; A414-M419 HydrophobicContact CB-SD 4.41Å; V417-M419 PolarHBondContact O-N 3.21Å; M419-Y421 VanDerWaalsContact C-N 3.25Å; M419-Y421 PolarHBondContact O-N 3.01Å; M419-Y421 VanDerWaalsContact O-N 3.15Å; M419-V422 HydrophobicContact CE-CB 3.67Å; M419-V422 HydrophobicContact CE-CG1 3.67Å; M419-V422 PolarHBondContact O-N 3.2Å; M419-V422 VanDerWaalsContact O-N 3.14Å; M419-V422 HydrophobicContact SD-CB 4.13Å; M419-V422 HydrophobicContact SD-CG1 4.19Å; M419-V422 HydrophobicContact SD-CG2 4.39Å; M419-I424 HydrophobicContact CE-CD1 3.39Å; M419-I424 HydrophobicContact CE-CG1 3.89Å | ||
| 420 | E | 78.3 | Confident | 88.5 | Confident | 163 Ų | 163 | 68 Ų | 68 | 76% | 0.762 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -34.9 | -170 | -64.3 | 174.4 | -174.5 | 0 | 0 | 114 | P418 | P418-E420 PolarHBondContact O-N 3.37Š|
| 421 | Y | 77.9 | Confident | 88.5 | Confident | 159 Ų | 159 | 71.1 Ų | 71.1 | 62% | 0.624 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -114.8 | 4.3 | -179.1 | -54.3 | -75.5 | 0 | 0 | 0 | 113.2 | M419 A423 | M419-Y421 VanDerWaalsContact C-N 3.25Å; M419-Y421 PolarHBondContact O-N 3.01Å; M419-Y421 VanDerWaalsContact O-N 3.15Å; Y421-A423 PolarHBondContact O-N 3.29Å |
| 422 | V | 85.8 | Confident | 88.5 | Confident | 11 Ų | 11 | 64.8 Ų | 64.8 | 7% | 0.067 | 33% | 0.332 | C | S | . | . | trans | -86 | 93.3 | -176.4 | 178.4 | 0 | 0 | 0 | 0 | 109.8 | G289 V301 V417 P418 M419 I424 | G289-V422 WeakPolarHBondContact O-CG2 3.36Å; V301-V422 HydrophobicContact CG2-CG1 3.94Å; V417-V422 HydrophobicContact CG1-CG2 4.13Å; P418-V422 WeakPolarHBondContact O-CG2 3.42Å; M419-V422 HydrophobicContact CE-CB 3.67Å; M419-V422 HydrophobicContact CE-CG1 3.67Å; M419-V422 PolarHBondContact O-N 3.2Å; M419-V422 VanDerWaalsContact O-N 3.14Å; M419-V422 HydrophobicContact SD-CB 4.13Å; M419-V422 HydrophobicContact SD-CG1 4.19Å; M419-V422 HydrophobicContact SD-CG2 4.39Å; V422-I424 HydrophobicContact CG1-CG1 4.09Å; V422-I424 PolarHBondContact O-N 2.93Å | ||
| 423 | A | 85.2 | Confident | 88.4 | Confident | 69 Ų | 69 | 64.7 Ų | 64.7 | 57% | 0.57 | 34% | 0.339 | S | S | * | . | trans | -69.3 | 85.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y421 P425 | Y421-A423 PolarHBondContact O-N 3.29Å; A423-P425 WeakPolarHBondContact O-CD 3.25Å | ||
| 424 | I | 90.8 | Very high | 88.3 | Confident | 22 Ų | 22 | 67.4 Ų | 67.4 | 11% | 0.113 | 35% | 0.352 | C | S | . | . | trans | -74 | 125.2 | 173.1 | -59.7 | -178.7 | 0 | 0 | 0 | 110.3 | L343 L410 L413 M419 V422 I428 K429 | L343-I424 HydrophobicContact CD1-CG1 4.43Å; L410-I424 HydrophobicContact CD1-CD1 4.02Å; L410-I424 HydrophobicContact CD1-CG2 4.26Å; L410-I424 HydrophobicContact CD2-CD1 3.83Å; L410-I424 HydrophobicContact CG-CD1 4.39Å; L413-I424 HydrophobicContact CD2-CD1 4.27Å; M419-I424 HydrophobicContact CE-CD1 3.39Å; M419-I424 HydrophobicContact CE-CG1 3.89Å; V422-I424 HydrophobicContact CG1-CG1 4.09Å; V422-I424 PolarHBondContact O-N 2.93Å; I424-I428 HydrophobicContact CG2-CB 4.01Å; I424-I428 HydrophobicContact CG2-CG2 3.83Å; I424-K429 HydrophobicContact CB-CG 4.4Å; I424-K429 HydrophobicContact CG2-CG 3.77Å; I424-K429 VanDerWaalsContact O-CE 3.22Å; I424-K429 WeakPolarHBondContact O-CE 3.47Å | ||
| 425 | P | 91.4 | Very high | 88.1 | Confident | 15 Ų | 15 | 68.6 Ų | 68.6 | 10% | 0.097 | 35% | 0.348 | C | S | . | . | trans | -63.3 | 142.6 | 174 | -23.1 | 35.2 | 0 | 0 | 0 | 113.3 | A303 F306 A423 C427 I428 K429 | A303-P425 HydrophobicContact CB-CG 3.94Å; F306-P425 HydrophobicContact CD2-CG 4.46Å; F306-P425 HydrophobicContact CE2-CB 4.1Å; F306-P425 HydrophobicContact CE2-CG 3.51Å; F306-P425 HydrophobicContact CZ-CB 3.8Å; F306-P425 HydrophobicContact CZ-CG 3.75Å; A423-P425 WeakPolarHBondContact O-CD 3.25Å; P425-C427 VanDerWaalsContact C-N 3.31Å; P425-C427 PolarHBondContact O-N 2.84Å; P425-I428 HydrophobicContact CB-CD1 4.06Å; P425-I428 HydrophobicContact CG-CD1 3.86Å; P425-I428 WeakPolarHBondContact O-CB 3.42Å; P425-I428 PolarHBondContact O-N 2.81Å; P425-K429 PolarHBondContact O-N 3.48Å | ||
| 426 | E | 89.8 | Confident | 87.9 | Confident | 103 Ų | 103 | 62.6 Ų | 62.6 | 48% | 0.481 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.1 | -34.8 | -171 | -159.3 | 53.9 | -132.7 | 0 | 0 | 113.8 | I428 K429 Q430 | E426-I428 PolarHBondContact O-N 3.14Å; E426-K429 PolarHBondContact O-N 2.86Å; E426-K429 VanDerWaalsContact O-N 3.13Å; E426-K429 WeakPolarHBondContact OE2-CD 3.07Å; E426-K429 WeakPolarHBondContact OE2-CE 3.12Å; E426-K429 IonicContact OE2-NZ 2.82Å; E426-K429 PolarHBondContact OE2-NZ 3.19Å; E426-Q430 WeakPolarHBondContact O-CG 3.42Å; E426-Q430 PolarHBondContact O-N 3.03Å |
| 427 | C | 89.3 | Confident | 87.8 | Confident | 49 Ų | 49 | 66.3 Ų | 66.3 | 33% | 0.331 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -60.2 | -30.5 | 174.7 | 57.7 | 0 | 0 | 0 | 0 | 113.2 | A346 P425 F431 | A346-C427 HydrophobicContact CB-CB 4.14Å; A346-C427 WeakPolarHBondContact CB-O 3.24Å; P425-C427 VanDerWaalsContact C-N 3.31Å; P425-C427 PolarHBondContact O-N 2.84Å; C427-F431 WeakPolarHBondContact O-CB 3.47Å; C427-F431 PolarHBondContact O-N 2.7Å; C427-F431 VanDerWaalsContact O-N 3.12Å |
| 428 | I | 91.1 | Very high | 87.7 | Confident | 0 Ų | 0 | 71.7 Ų | 71.7 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -76.4 | -38.4 | 176.2 | -70.8 | 152.3 | 0 | 0 | 0 | 110.7 | L343 G345 L410 I424 P425 E426 F431 D432 | L343-I428 HydrophobicContact CB-CD1 3.71Å; L343-I428 HydrophobicContact CD1-CD1 4.21Å; G345-I428 WeakPolarHBondContact O-CG1 3.49Å; L410-I428 HydrophobicContact CD2-CG2 4.22Å; I424-I428 HydrophobicContact CG2-CB 4.01Å; I424-I428 HydrophobicContact CG2-CG2 3.83Å; P425-I428 HydrophobicContact CB-CD1 4.06Å; P425-I428 HydrophobicContact CG-CD1 3.86Å; P425-I428 WeakPolarHBondContact O-CB 3.42Å; P425-I428 PolarHBondContact O-N 2.81Å; E426-I428 PolarHBondContact O-N 3.14Å; I428-F431 PolarHBondContact O-N 2.95Å; I428-D432 PolarHBondContact O-N 3.3Å |
| 429 | K | 91.8 | Very high | 87.5 | Confident | 88 Ų | 88 | 72.3 Ų | 72.3 | 38% | 0.383 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -63 | -44.8 | 174.1 | -55.8 | -173.9 | -157.4 | 152.9 | 0 | 111.6 | L410 I424 P425 E426 F431 D432 A433 | L410-K429 HydrophobicContact CD1-CG 4.29Å; I424-K429 HydrophobicContact CB-CG 4.4Å; I424-K429 HydrophobicContact CG2-CG 3.77Å; I424-K429 VanDerWaalsContact O-CE 3.22Å; I424-K429 WeakPolarHBondContact O-CE 3.47Å; P425-K429 PolarHBondContact O-N 3.48Å; E426-K429 PolarHBondContact O-N 2.86Å; E426-K429 VanDerWaalsContact O-N 3.13Å; E426-K429 WeakPolarHBondContact OE2-CD 3.07Å; E426-K429 WeakPolarHBondContact OE2-CE 3.12Å; E426-K429 IonicContact OE2-NZ 2.82Å; E426-K429 PolarHBondContact OE2-NZ 3.19Å; K429-F431 VanDerWaalsContact C-N 3.3Å; K429-F431 PolarHBondContact O-N 3.28Å; K429-D432 PolarHBondContact O-N 2.96Å; K429-A433 WeakPolarHBondContact O-CB 3.37Å; K429-A433 PolarHBondContact O-N 3.45Å |
| 430 | Q | 91.4 | Very high | 87.5 | Confident | 125 Ų | 125 | 74.1 Ų | 74.1 | 58% | 0.584 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -60.2 | -40.2 | 174.9 | -68.8 | 173.1 | 9.5 | 0 | 0 | 111.9 | E426 A433 E434 | E426-Q430 WeakPolarHBondContact O-CG 3.42Å; E426-Q430 PolarHBondContact O-N 3.03Å; Q430-A433 PolarHBondContact O-N 3.37Å; Q430-E434 WeakPolarHBondContact O-CB 3.35Å; Q430-E434 PolarHBondContact O-N 2.78Å |
| 431 | F | 90.9 | Very high | 87.8 | Confident | 88 Ų | 88 | 72.4 Ų | 72.4 | 39% | 0.386 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -66.9 | -42.6 | 176.3 | 178.8 | -88.1 | 0 | 0 | 0 | 112.9 | A346 H380 C427 I428 K429 K435 | A346-F431 HydrophobicContact CB-CB 4.02Å; A346-F431 HydrophobicContact CB-CD2 4.4Å; A346-F431 HydrophobicContact CB-CG 4.4Å; H380-F431 HydrophobicContact CB-CD1 4.47Å; H380-F431 HydrophobicContact CB-CE1 3.91Å; H380-F431 AromaticContact CD2-CD1 3.73Å; H380-F431 AromaticContact CD2-CE1 3.99Å; H380-F431 AromaticContact CG-CE1 3.8Å; C427-F431 WeakPolarHBondContact O-CB 3.47Å; C427-F431 PolarHBondContact O-N 2.7Å; C427-F431 VanDerWaalsContact O-N 3.12Å; I428-F431 PolarHBondContact O-N 2.95Å; K429-F431 VanDerWaalsContact C-N 3.3Å; K429-F431 PolarHBondContact O-N 3.28Å; F431-K435 VanDerWaalsContact O-CB 3.28Å; F431-K435 WeakPolarHBondContact O-CB 3.4Å; F431-K435 PolarHBondContact O-N 3.41Å |
| 432 | D | 92 | Very high | 87.9 | Confident | 15 Ų | 15 | 73.6 Ų | 73.6 | 8% | 0.08 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -61.1 | -48 | 173.1 | -176.6 | 73.9 | 0 | 0 | 0 | 110.9 | H380 S409 L410 I428 K429 E434 K435 N436 | H380-D432 IonicContact CE1-OD1 3.99Å; H380-D432 PolarHBondContact CE1-OD1 2.81Å; H380-D432 IonicContact NE2-OD1 3.88Å; S409-D432 WeakPolarHBondContact CA-OD1 3.39Å; S409-D432 PolarHBondContact OG-OD1 2.99Å; L410-D432 HydrophobicContact CD1-CB 3.77Å; L410-D432 HydrophobicContact CG-CB 3.76Å; L410-D432 PolarHBondContact N-OD1 3.37Å; I428-D432 PolarHBondContact O-N 3.3Å; K429-D432 PolarHBondContact O-N 2.96Å; D432-E434 PolarHBondContact O-N 2.83Å; D432-K435 PolarHBondContact O-N 3.07Å; D432-N436 WeakPolarHBondContact O-CB 3.5Å; D432-N436 PolarHBondContact O-N 3.45Å; D432-N436 PolarHBondContact O-ND2 2.88Å; D432-N436 PolarHBondContact OD2-ND2 3.03Å |
| 433 | A | 90.6 | Very high | 87.9 | Confident | 56 Ų | 56 | 76.4 Ų | 76.4 | 46% | 0.463 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -57.8 | -46.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | K429 Q430 N436 R437 | K429-A433 WeakPolarHBondContact O-CB 3.37Å; K429-A433 PolarHBondContact O-N 3.45Å; Q430-A433 PolarHBondContact O-N 3.37Å; A433-N436 PolarHBondContact O-N 3.01Å; A433-R437 WeakPolarHBondContact O-CB 3.35Å; A433-R437 PolarHBondContact O-N 3.36Å |
| 434 | E | 90 | Very high | 87.8 | Confident | 58 Ų | 58 | 77.8 Ų | 77.8 | 27% | 0.271 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -67.4 | -35.9 | 177.9 | 178 | 55.9 | -166.2 | 0 | 0 | 112.5 | Q430 D432 R437 K438 | Q430-E434 WeakPolarHBondContact O-CB 3.35Å; Q430-E434 PolarHBondContact O-N 2.78Å; D432-E434 PolarHBondContact O-N 2.83Å; E434-R437 IonicContact OE1-NH2 3.58Å; E434-R437 PolarHBondContact OE1-NH2 2.71Å; E434-R437 IonicContact OE2-CZ 2.63Å; E434-R437 IonicContact OE2-NE 3.17Å; E434-R437 PolarHBondContact OE2-NE 2.98Å; E434-R437 IonicContact OE2-NH2 2.62Å; E434-R437 PolarHBondContact OE2-NH2 3.12Å; E434-K438 HydrophobicContact CG-CD 4.4Å; E434-K438 WeakPolarHBondContact O-CG 3.29Å; E434-K438 PolarHBondContact O-N 2.89Å; E434-K438 WeakPolarHBondContact OE1-CE 3.47Å; E434-K438 IonicContact OE1-NZ 3.57Å; E434-K438 PolarHBondContact OE1-NZ 3.38Å |
| 435 | K | 86.9 | Confident | 87.4 | Confident | 77 Ų | 77 | 83.9 Ų | 83.9 | 34% | 0.335 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -67.9 | -44.1 | 175.4 | -171.6 | -170.2 | 169.4 | -158.6 | 0 | 111.5 | Y408 F431 D432 K438 S439 | Y408-K435 PolarHBondContact O-NZ 2.95Å; F431-K435 VanDerWaalsContact O-CB 3.28Å; F431-K435 WeakPolarHBondContact O-CB 3.4Å; F431-K435 PolarHBondContact O-N 3.41Å; D432-K435 PolarHBondContact O-N 3.07Å; K435-K438 PolarHBondContact O-N 2.86Å; K435-S439 PolarHBondContact O-N 2.96Å |
| 436 | N | 86.3 | Confident | 87 | Confident | 40 Ų | 40 | 88.5 Ų | 88.5 | 21% | 0.214 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -62.4 | -44.1 | 175.4 | -65.5 | -22.3 | 0 | 0 | 0 | 110.6 | D432 A433 K438 S439 N440 | D432-N436 WeakPolarHBondContact O-CB 3.5Å; D432-N436 PolarHBondContact O-N 3.45Å; D432-N436 PolarHBondContact O-ND2 2.88Å; D432-N436 PolarHBondContact OD2-ND2 3.03Å; A433-N436 PolarHBondContact O-N 3.01Å; N436-K438 VanDerWaalsContact C-N 3.32Å; N436-K438 PolarHBondContact O-N 3.02Å; N436-S439 WeakPolarHBondContact O-CB 3.47Å; N436-S439 PolarHBondContact O-N 3.33Å; N436-S439 VanDerWaalsContact O-N 3.09Å; N436-N440 PolarHBondContact O-N 3.42Å; N436-N440 PolarHBondContact O-OD1 3.1Å |
| 437 | R | 87.3 | Confident | 86.7 | Confident | 140 Ų | 140 | 88.1 Ų | 88.1 | 53% | 0.528 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -57.7 | -41.8 | 174.8 | -171 | 175.2 | 74.5 | 142.9 | 3.3 | 112.4 | A433 E434 K441 | A433-R437 WeakPolarHBondContact O-CB 3.35Å; A433-R437 PolarHBondContact O-N 3.36Å; E434-R437 IonicContact OE1-NH2 3.58Å; E434-R437 PolarHBondContact OE1-NH2 2.71Å; E434-R437 IonicContact OE2-CZ 2.63Å; E434-R437 IonicContact OE2-NE 3.17Å; E434-R437 PolarHBondContact OE2-NE 2.98Å; E434-R437 IonicContact OE2-NH2 2.62Å; E434-R437 PolarHBondContact OE2-NH2 3.12Å; R437-K441 WeakPolarHBondContact O-CG 3.29Å; R437-K441 PolarHBondContact O-N 2.76Å |
| 438 | K | 85.9 | Confident | 86.3 | Confident | 117 Ų | 117 | 89.4 Ų | 89.4 | 51% | 0.509 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -69.7 | -34 | 174.8 | -78.6 | 168.6 | 168.9 | 143 | 0 | 113.2 | E434 K435 N436 R442 | E434-K438 HydrophobicContact CG-CD 4.4Å; E434-K438 WeakPolarHBondContact O-CG 3.29Å; E434-K438 PolarHBondContact O-N 2.89Å; E434-K438 WeakPolarHBondContact OE1-CE 3.47Å; E434-K438 IonicContact OE1-NZ 3.57Å; E434-K438 PolarHBondContact OE1-NZ 3.38Å; K435-K438 PolarHBondContact O-N 2.86Å; N436-K438 VanDerWaalsContact C-N 3.32Å; N436-K438 PolarHBondContact O-N 3.02Å; K438-R442 WeakPolarHBondContact O-CG 2.82Å; K438-R442 PolarHBondContact O-N 3.4Å |
| 439 | S | 82.2 | Confident | 85.8 | Confident | 65 Ų | 65 | 90.9 Ų | 90.9 | 46% | 0.455 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.3 | -50.9 | 176.5 | -159.8 | 0 | 0 | 0 | 0 | 111 | K435 N436 K441 R442 V443 | K435-S439 PolarHBondContact O-N 2.96Å; N436-S439 WeakPolarHBondContact O-CB 3.47Å; N436-S439 PolarHBondContact O-N 3.33Å; N436-S439 VanDerWaalsContact O-N 3.09Å; S439-K441 PolarHBondContact O-N 3.36Å; S439-R442 WeakPolarHBondContact O-CB 3.45Å; S439-R442 PolarHBondContact O-N 2.79Å; S439-R442 VanDerWaalsContact O-N 3.14Å; S439-V443 PolarHBondContact O-N 3.25Å |
| 440 | N | 82.8 | Confident | 85.2 | Confident | 97 Ų | 97 | 92.7 Ų | 92.7 | 52% | 0.519 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -59.4 | -48.6 | -179.2 | -66.4 | 12.4 | 0 | 0 | 0 | 111.1 | N436 R442 V443 D444 | N436-N440 PolarHBondContact O-N 3.42Å; N436-N440 PolarHBondContact O-OD1 3.1Å; N440-R442 PolarHBondContact O-N 3.42Å; N440-R442 VanDerWaalsContact O-N 3.07Å; N440-V443 CarbonylContact O-C 3.47Å; N440-V443 WeakPolarHBondContact O-CA 3.41Å; N440-V443 WeakPolarHBondContact O-CB 3.35Å; N440-V443 PolarHBondContact O-N 3.04Å; N440-D444 PolarHBondContact O-N 2.72Å |
| 441 | K | 83.9 | Confident | 84.8 | Confident | 126 Ų | 126 | 91.2 Ų | 91.2 | 55% | 0.548 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -53.6 | -33.5 | 176.8 | -77 | -178.7 | 175 | -164.7 | 0 | 114.3 | R437 S439 Q445 | R437-K441 WeakPolarHBondContact O-CG 3.29Å; R437-K441 PolarHBondContact O-N 2.76Å; S439-K441 PolarHBondContact O-N 3.36Å; K441-Q445 VanDerWaalsContact O-CB 3.28Å; K441-Q445 WeakPolarHBondContact O-CB 3.44Å; K441-Q445 PolarHBondContact O-N 3.42Å; K441-Q445 VanDerWaalsContact O-N 3.11Å |
| 442 | R | 81.4 | Confident | 84.1 | Confident | 185 Ų | 185 | 93.8 Ų | 93.8 | 70% | 0.698 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -73.3 | -41.1 | 176.4 | -71.5 | 172.4 | 175.8 | -166.1 | -4.1 | 111.7 | K438 S439 N440 Q445 E446 | K438-R442 WeakPolarHBondContact O-CG 2.82Å; K438-R442 PolarHBondContact O-N 3.4Å; S439-R442 WeakPolarHBondContact O-CB 3.45Å; S439-R442 PolarHBondContact O-N 2.79Å; S439-R442 VanDerWaalsContact O-N 3.14Å; N440-R442 PolarHBondContact O-N 3.42Å; N440-R442 VanDerWaalsContact O-N 3.07Å; R442-Q445 PolarHBondContact O-N 3.08Å; R442-E446 WeakPolarHBondContact O-CB 3.41Å; R442-E446 PolarHBondContact O-N 3.14Å |
| 443 | V | 84.3 | Confident | 83.2 | Confident | 70 Ų | 70 | 100.1 Ų | 100.1 | 42% | 0.424 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.9 | -46 | 175.5 | 176.1 | 0 | 0 | 0 | 0 | 110.3 | S439 N440 Q445 E446 I447 | S439-V443 PolarHBondContact O-N 3.25Å; N440-V443 CarbonylContact O-C 3.47Å; N440-V443 WeakPolarHBondContact O-CA 3.41Å; N440-V443 WeakPolarHBondContact O-CB 3.35Å; N440-V443 PolarHBondContact O-N 3.04Å; V443-Q445 VanDerWaalsContact C-N 3.33Å; V443-Q445 PolarHBondContact O-N 2.83Å; V443-E446 PolarHBondContact O-N 2.87Å; V443-I447 HydrophobicContact CG1-CD1 3.74Å; V443-I447 HydrophobicContact CG1-CG1 4.42Å; V443-I447 VanDerWaalsContact O-CG1 3.27Å; V443-I447 WeakPolarHBondContact O-CG1 3.37Å; V443-I447 PolarHBondContact O-N 3.41Å |
| 444 | D | 83.7 | Confident | 82.5 | Confident | 98 Ų | 98 | 100.3 Ų | 100.3 | 52% | 0.524 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.8 | -43 | 177.1 | -56.5 | -32.4 | 0 | 0 | 0 | 111.3 | N440 I447 S448 | N440-D444 PolarHBondContact O-N 2.72Å; D444-I447 PolarHBondContact O-N 3.39Å; D444-S448 WeakPolarHBondContact O-CB 3.47Å; D444-S448 PolarHBondContact O-N 2.99Å |
| 445 | Q | 82.9 | Confident | 81.7 | Confident | 149 Ų | 149 | 100.9 Ų | 100.9 | 70% | 0.696 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -68.2 | -37.6 | 177.4 | -169.8 | 173 | 21.5 | 0 | 0 | 112.6 | K441 R442 V443 G449 | K441-Q445 VanDerWaalsContact O-CB 3.28Å; K441-Q445 WeakPolarHBondContact O-CB 3.44Å; K441-Q445 PolarHBondContact O-N 3.42Å; K441-Q445 VanDerWaalsContact O-N 3.11Å; R442-Q445 PolarHBondContact O-N 3.08Å; V443-Q445 VanDerWaalsContact C-N 3.33Å; V443-Q445 PolarHBondContact O-N 2.83Å; Q445-G449 PolarHBondContact O-N 3.39Å |
| 446 | E | 82.9 | Confident | 81.1 | Confident | 113 Ų | 113 | 101.5 Ų | 101.5 | 53% | 0.528 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.7 | -41 | 175.1 | -168.4 | -170.7 | 143 | 0 | 0 | 111.8 | R442 V443 K450 | R442-E446 WeakPolarHBondContact O-CB 3.41Å; R442-E446 PolarHBondContact O-N 3.14Å; V443-E446 PolarHBondContact O-N 2.87Å; E446-K450 HydrophobicContact CG-CD 4.3Å; E446-K450 WeakPolarHBondContact O-CB 3.39Å; E446-K450 WeakPolarHBondContact O-CG 3.5Å; E446-K450 PolarHBondContact O-N 3.14Å; E446-K450 WeakPolarHBondContact OE1-CE 3.48Å; E446-K450 IonicContact OE1-NZ 3.65Å; E446-K450 PolarHBondContact OE1-NZ 3.11Å |
| 447 | I | 82.9 | Confident | 80.4 | Confident | 95 Ų | 95 | 103.2 Ų | 103.2 | 49% | 0.487 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.5 | -46.8 | 175.1 | -67.2 | 166.9 | 0 | 0 | 0 | 110 | V443 D444 G449 K450 V451 | V443-I447 HydrophobicContact CG1-CD1 3.74Å; V443-I447 HydrophobicContact CG1-CG1 4.42Å; V443-I447 VanDerWaalsContact O-CG1 3.27Å; V443-I447 WeakPolarHBondContact O-CG1 3.37Å; V443-I447 PolarHBondContact O-N 3.41Å; D444-I447 PolarHBondContact O-N 3.39Å; I447-G449 PolarHBondContact O-N 3.3Å; I447-K450 PolarHBondContact O-N 3.25Å; I447-V451 HydrophobicContact CG2-CG2 4.44Å; I447-V451 WeakPolarHBondContact O-CG2 3.45Å; I447-V451 PolarHBondContact O-N 2.82Å |
| 448 | S | 81.2 | Confident | 79.7 | Confident | 75 Ų | 75 | 101.8 Ų | 101.8 | 52% | 0.524 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -57.4 | -48.7 | 177.2 | -167.7 | 0 | 0 | 0 | 0 | 111.7 | D444 K450 V451 E452 | D444-S448 WeakPolarHBondContact O-CB 3.47Å; D444-S448 PolarHBondContact O-N 2.99Å; S448-K450 VanDerWaalsContact C-N 3.33Å; S448-K450 PolarHBondContact O-N 2.58Å; S448-V451 PolarHBondContact O-N 2.94Å; S448-E452 WeakPolarHBondContact O-CB 3.36Å; S448-E452 PolarHBondContact O-N 2.92Å |
| 449 | G | 80.8 | Confident | 78.9 | Confident | 31 Ų | 31 | 101.7 Ų | 101.7 | 32% | 0.32 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.5 | -33.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q445 I447 M453 | Q445-G449 PolarHBondContact O-N 3.39Å; I447-G449 PolarHBondContact O-N 3.3Å; G449-M453 WeakPolarHBondContact O-CG 3.37Å; G449-M453 PolarHBondContact O-N 3.25Å |
| 450 | K | 79.3 | Confident | 77.7 | Confident | 126 Ų | 126 | 111.6 Ų | 111.6 | 55% | 0.548 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -69.6 | -38.8 | 173.8 | -80.6 | 172.7 | 170.8 | 171.8 | 0 | 112.7 | E446 I447 S448 A454 | E446-K450 HydrophobicContact CG-CD 4.3Å; E446-K450 WeakPolarHBondContact O-CB 3.39Å; E446-K450 WeakPolarHBondContact O-CG 3.5Å; E446-K450 PolarHBondContact O-N 3.14Å; E446-K450 WeakPolarHBondContact OE1-CE 3.48Å; E446-K450 IonicContact OE1-NZ 3.65Å; E446-K450 PolarHBondContact OE1-NZ 3.11Å; I447-K450 PolarHBondContact O-N 3.25Å; S448-K450 VanDerWaalsContact C-N 3.33Å; S448-K450 PolarHBondContact O-N 2.58Å; K450-A454 VanDerWaalsContact O-CB 3.24Å; K450-A454 WeakPolarHBondContact O-CB 3.22Å; K450-A454 PolarHBondContact O-N 2.96Å |
| 451 | V | 81.7 | Confident | 77.5 | Confident | 95 Ų | 95 | 112.3 Ų | 112.3 | 58% | 0.576 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -66.6 | -42.3 | 175.2 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | I447 S448 A454 A455 | I447-V451 HydrophobicContact CG2-CG2 4.44Å; I447-V451 WeakPolarHBondContact O-CG2 3.45Å; I447-V451 PolarHBondContact O-N 2.82Å; S448-V451 PolarHBondContact O-N 2.94Å; V451-A454 PolarHBondContact O-N 3.46Å; V451-A455 WeakPolarHBondContact O-CB 3.46Å; V451-A455 PolarHBondContact O-N 3.47Å |
| 452 | E | 76.8 | Confident | 77.1 | Confident | 142 Ų | 142 | 111.6 Ų | 111.6 | 66% | 0.664 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -64 | -46 | 177.9 | -168.3 | 174.3 | 176.5 | 0 | 0 | 112.1 | S448 A454 A455 A456 | S448-E452 WeakPolarHBondContact O-CB 3.36Å; S448-E452 PolarHBondContact O-N 2.92Å; E452-A454 PolarHBondContact O-N 3.3Å; E452-A455 PolarHBondContact O-N 3.47Å; E452-A456 WeakPolarHBondContact O-CB 3.33Å; E452-A456 PolarHBondContact O-N 2.97Å |
| 453 | M | 74.1 | Confident | 76.9 | Confident | 147 Ų | 147 | 107.5 Ų | 107.5 | 72% | 0.724 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -68 | -31.3 | 174.7 | -71.3 | -139.3 | -67.4 | 0 | 0 | 113.6 | G449 A457 | G449-M453 WeakPolarHBondContact O-CG 3.37Å; G449-M453 PolarHBondContact O-N 3.25Å; M453-A457 WeakPolarHBondContact O-CB 3.47Å; M453-A457 PolarHBondContact O-N 2.86Å |
| 454 | A | 75.1 | Confident | 76.4 | Confident | 60 Ų | 60 | 109.7 Ų | 109.7 | 50% | 0.496 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -69.8 | -38.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | K450 V451 E452 A457 | K450-A454 VanDerWaalsContact O-CB 3.24Å; K450-A454 WeakPolarHBondContact O-CB 3.22Å; K450-A454 PolarHBondContact O-N 2.96Å; V451-A454 PolarHBondContact O-N 3.46Å; E452-A454 PolarHBondContact O-N 3.3Å; A454-A457 PolarHBondContact O-N 3.07Å |
| 455 | A | 73.4 | Confident | 76 | Confident | 71 Ų | 71 | 110.4 Ų | 110.4 | 59% | 0.587 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -66.7 | -37.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | V451 E452 A457 | V451-A455 WeakPolarHBondContact O-CB 3.46Å; V451-A455 PolarHBondContact O-N 3.47Å; E452-A455 PolarHBondContact O-N 3.47Å; A455-A457 PolarHBondContact O-N 2.77Å |
| 456 | A | 73.4 | Confident | 75.5 | Confident | 90 Ų | 90 | 107.9 Ų | 107.9 | 74% | 0.744 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -9.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | E452 | E452-A456 WeakPolarHBondContact O-CB 3.33Å; E452-A456 PolarHBondContact O-N 2.97Å |
| 457 | A | 72.9 | Confident | 75 | Confident | 75 Ų | 75 | 107.5 Ų | 107.5 | 62% | 0.62 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.1 | 5 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | M453 A454 A455 P459 | M453-A457 WeakPolarHBondContact O-CB 3.47Å; M453-A457 PolarHBondContact O-N 2.86Å; A454-A457 PolarHBondContact O-N 3.07Å; A455-A457 PolarHBondContact O-N 2.77Å; A457-P459 WeakPolarHBondContact O-CD 3.3Å |
| 458 | V | 72 | Confident | 74.4 | Confident | 111 Ų | 111 | 108.5 Ų | 108.5 | 67% | 0.673 | 65% | 0.653 | S | S | * | * | trans | -90.7 | 112.3 | 174.4 | -176.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 459 | P | 69.1 | Low | 73.8 | Confident | 114 Ų | 114 | 111.3 Ų | 111.3 | 74% | 0.74 | 66% | 0.664 | S | S | * | * | trans | -73.7 | 146.4 | 173.1 | 31.1 | -33.9 | 0 | 0 | 0 | 111.3 | A457 | A457-P459 WeakPolarHBondContact O-CD 3.3Š| ||
| 460 | E | 57.3 | Low | 73.2 | Confident | 273 Ų | 273 | 118.5 Ų | 118.5 | 100% | 1.276 | 70% | 0.695 | S | S | * | * | trans | -68.4 | 0 | 170 | -70.1 | -169.6 | 128.1 | 0 | 0 | 113.1 |
Retrieved 460 of 460 residues in 335.3 ms
(Link to these results)