| 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 | 30 | Very low | 30.6 | Very low | 220 Ų | 220 | 137.9 Ų | 137.9 | 100% | 1.084 | 80% | 0.797 | S | S | * | * | 0 | 120.5 | 0 | -73.1 | 129.1 | 174.2 | 0 | 0 | 106.8 | |||||
| 2 | M | 29.8 | Very low | 30.3 | Very low | 156 Ų | 156 | 143.8 Ų | 143.8 | 77% | 0.768 | 81% | 0.807 | S | S | * | * | 74.5 | 130 | 66 | -67.3 | 148.6 | 143.9 | 0 | 0 | 110.8 | |||||
| 3 | E | 30.5 | Very low | 30.3 | Very low | 129 Ų | 129 | 152 Ų | 152 | 60% | 0.603 | 82% | 0.817 | S | S | * | * | cis | -161.7 | 167.3 | 2.5 | -124.7 | 174.3 | 140.2 | 0 | 0 | 113.6 | ||||
| 4 | K | 35.8 | Very low | 30.1 | Very low | 172 Ų | 172 | 159.6 Ų | 159.6 | 75% | 0.748 | 83% | 0.828 | S | S | * | * | trans | 21.5 | 156.1 | 135.7 | -74.2 | 174.3 | -163 | 157.8 | 0 | 121.6 | ||||
| 5 | S | 32.3 | Very low | 29.9 | Very low | 107 Ų | 107 | 154.1 Ų | 154.1 | 75% | 0.748 | 83% | 0.827 | S | S | * | * | cis | -178.8 | 158.6 | -1.8 | 45.5 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 6 | G | 31.8 | Very low | 29.7 | Very low | 76 Ų | 76 | 159.7 Ų | 159.7 | 78% | 0.784 | 83% | 0.832 | S | S | * | * | trans | 86.4 | 157.6 | 145.9 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 7 | S | 31.8 | Very low | 29.6 | Very low | 115 Ų | 115 | 159.5 Ų | 159.5 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | cis | -161.4 | 158.4 | -14.3 | 39.4 | 0 | 0 | 0 | 0 | 107 | ||||
| 8 | E | 26.5 | Very low | 29.7 | Very low | 174 Ų | 174 | 157.9 Ų | 157.9 | 81% | 0.813 | 83% | 0.831 | S | S | * | * | -158.2 | 147.1 | 56.2 | -74.7 | 179.5 | 91.7 | 0 | 0 | 109.4 | |||||
| 9 | M | 31.2 | Very low | 29.7 | Very low | 187 Ų | 187 | 157.1 Ų | 157.1 | 92% | 0.921 | 83% | 0.833 | S | S | * | * | 53.9 | 138.7 | 82.7 | -67.7 | -169.7 | 169.8 | 0 | 0 | 115.8 | |||||
| 10 | S | 29.2 | Very low | 29.6 | Very low | 111 Ų | 111 | 156.4 Ų | 156.4 | 78% | 0.776 | 83% | 0.829 | S | S | * | * | cis | -151.2 | 140.6 | 10.8 | -173.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 11 | G | 27.7 | Very low | 29.5 | Very low | 70 Ų | 70 | 156.3 Ų | 156.3 | 72% | 0.722 | 83% | 0.829 | S | S | * | * | 103.5 | 144.6 | 81.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 12 | K | 27.6 | Very low | 30.2 | Very low | 209 Ų | 209 | 151.2 Ų | 151.2 | 91% | 0.909 | 81% | 0.813 | S | S | * | * | cis | -149.4 | 160.7 | 9 | -78.4 | 167.8 | 175.2 | 163.3 | 0 | 111.4 | ||||
| 13 | R | 29.8 | Very low | 30.3 | Very low | 250 Ų | 250 | 151.5 Ų | 151.5 | 94% | 0.943 | 82% | 0.817 | S | S | * | * | trans | -117.8 | 147.2 | 167.3 | -88.9 | -178.3 | 165.2 | -166.1 | -2.9 | 111.6 | ||||
| 14 | R | 27.6 | Very low | 30.3 | Very low | 258 Ų | 258 | 155.3 Ų | 155.3 | 97% | 0.974 | 83% | 0.832 | S | S | * | * | trans | -151.9 | 148.7 | 152.2 | -70.2 | -172.6 | 173.7 | 173.4 | -4.1 | 106.4 | ||||
| 15 | G | 27.1 | Very low | 30.1 | Very low | 78 Ų | 78 | 151.8 Ų | 151.8 | 80% | 0.804 | 83% | 0.829 | S | S | * | * | cis | 141.9 | 113.9 | 1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 16 | R | 27.1 | Very low | 30 | Very low | 243 Ų | 243 | 154.7 Ų | 154.7 | 92% | 0.917 | 84% | 0.835 | S | S | * | * | trans | -126.7 | 126.6 | -178.6 | 178.8 | -179.8 | -77.5 | -172.6 | -3.7 | 109.8 | ||||
| 17 | N | 27.3 | Very low | 29.8 | Very low | 157 Ų | 157 | 155.4 Ų | 155.4 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | trans | -102 | 161.7 | 177.6 | -88.3 | 26.1 | 0 | 0 | 0 | 112.2 | ||||
| 18 | T | 31.5 | Very low | 29.8 | Very low | 130 Ų | 130 | 156.3 Ų | 156.3 | 80% | 0.798 | 83% | 0.834 | S | S | * | * | trans | -115 | 148.5 | 172.1 | 45.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 19 | V | 29.3 | Very low | 29.9 | Very low | 143 Ų | 143 | 156.3 Ų | 156.3 | 87% | 0.867 | 84% | 0.84 | S | S | * | * | trans | -149.4 | 150.4 | 167.7 | -170.5 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 20 | N | 27.6 | Very low | 29.7 | Very low | 142 Ų | 142 | 150.6 Ų | 150.6 | 76% | 0.759 | 83% | 0.829 | S | S | * | * | trans | -113.5 | 147 | -169.8 | -61.5 | -14.3 | 0 | 0 | 0 | 114.4 | ||||
| 21 | N | 28.6 | Very low | 29.7 | Very low | 156 Ų | 156 | 152.4 Ų | 152.4 | 83% | 0.834 | 83% | 0.83 | S | S | * | * | trans | 61.6 | 175.3 | 148 | -116.1 | 12.2 | 0 | 0 | 0 | 118.6 | ||||
| 22 | P | 44.3 | Very low | 29.9 | Very low | 113 Ų | 113 | 154.8 Ų | 154.8 | 73% | 0.734 | 84% | 0.835 | S | S | * | * | cis | -130.4 | -175 | -6.3 | 41.6 | -24.6 | 0 | 0 | 0 | 116.1 | ||||
| 23 | N | 32.6 | Very low | 30.2 | Very low | 162 Ų | 162 | 151.5 Ų | 151.5 | 87% | 0.866 | 83% | 0.828 | S | S | * | * | trans | -43.6 | 146.8 | 172.9 | -83.3 | -15.1 | 0 | 0 | 0 | 116.6 | ||||
| 24 | K | 30.8 | Very low | 30.2 | Very low | 208 Ų | 208 | 146.2 Ų | 146.2 | 90% | 0.904 | 82% | 0.818 | S | S | * | * | trans | -152.5 | 133 | 141.4 | -157.7 | 174 | -174.6 | -178.5 | 0 | 112.5 | ||||
| 25 | S | 31 | Very low | 30.3 | Very low | 99 Ų | 99 | 138.3 Ų | 138.3 | 69% | 0.692 | 80% | 0.802 | S | S | * | * | trans | -113.6 | 150.6 | 167.7 | 52.7 | 0 | 0 | 0 | 0 | 110 | ||||
| 26 | L | 28.9 | Very low | 30.5 | Very low | 167 Ų | 167 | 144.7 Ų | 144.7 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | trans | -179 | 156.4 | 131 | -141.2 | 67.3 | 0 | 0 | 0 | 113.5 | ||||
| 27 | A | 28 | Very low | 31 | Very low | 91 Ų | 91 | 140.3 Ų | 140.3 | 75% | 0.752 | 79% | 0.792 | S | S | * | * | trans | 67.7 | 110.5 | 144.8 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 28 | T | 31.7 | Very low | 31.7 | Very low | 134 Ų | 134 | 141.4 Ų | 141.4 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | trans | -89.5 | 122.2 | 155.8 | 48.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 29 | N | 29.6 | Very low | 31.7 | Very low | 175 Ų | 175 | 138.7 Ų | 138.7 | 94% | 0.936 | 79% | 0.79 | S | S | * | * | trans | 178.2 | 148.8 | 150.6 | -105.7 | -8.2 | 0 | 0 | 0 | 109.3 | ||||
| 30 | G | 26.6 | Very low | 32.1 | Very low | 66 Ų | 66 | 137.3 Ų | 137.3 | 68% | 0.68 | 79% | 0.787 | S | S | * | * | cis | -176.7 | 159.4 | -5.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 31 | N | 30.3 | Very low | 33.1 | Very low | 150 Ų | 150 | 136.4 Ų | 136.4 | 80% | 0.802 | 79% | 0.791 | S | S | * | * | trans | -6.9 | 129.6 | 171.5 | 179.3 | 49.3 | 0 | 0 | 0 | 120.1 | ||||
| 32 | S | 30.5 | Very low | 33.5 | Very low | 119 Ų | 119 | 132.6 Ų | 132.6 | 83% | 0.832 | 79% | 0.79 | S | S | * | * | trans | -155.8 | 153.3 | 140.6 | -83.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 33 | N | 33.8 | Very low | 33.1 | Very low | 141 Ų | 141 | 133 Ų | 133 | 75% | 0.754 | 80% | 0.795 | S | S | * | * | trans | -97.2 | -174 | -168.1 | -168.8 | 22.4 | 0 | 0 | 0 | 112.9 | ||||
| 34 | N | 30.3 | Very low | 34.1 | Very low | 139 Ų | 139 | 130.8 Ų | 130.8 | 74% | 0.743 | 79% | 0.792 | S | S | * | * | trans | 83.7 | 151.4 | 168.4 | -60 | -3.9 | 0 | 0 | 0 | 115 | ||||
| 35 | S | 30.3 | Very low | 34.5 | Very low | 91 Ų | 91 | 126.4 Ų | 126.4 | 64% | 0.636 | 79% | 0.788 | S | S | * | * | cis | -174.7 | 152.2 | -9.9 | 161.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 36 | W | 30.3 | Very low | 35.6 | Very low | 213 Ų | 213 | 128.5 Ų | 128.5 | 81% | 0.807 | 79% | 0.791 | S | S | * | * | trans | 10.4 | 140.3 | 146.3 | -57.4 | 80.3 | 0 | 0 | 0 | 119 | ||||
| 37 | E | 38 | Very low | 36.3 | Very low | 151 Ų | 151 | 127.2 Ų | 127.2 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | cis | -168.5 | -147.9 | 0.2 | -152 | 175.4 | -167.6 | 0 | 0 | 109 | ||||
| 38 | E | 40.9 | Very low | 37.1 | Very low | 180 Ų | 180 | 130.1 Ų | 130.1 | 84% | 0.841 | 78% | 0.783 | S | S | * | * | trans | -19.1 | 157.8 | 174 | -52 | -167.7 | 122.9 | 0 | 0 | 122.3 | ||||
| 39 | G | 32.6 | Very low | 37.5 | Very low | 73 Ų | 73 | 131.1 Ų | 131.1 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | 158.5 | 88.8 | 151.3 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 40 | S | 38.1 | Very low | 38.5 | Very low | 114 Ų | 114 | 127 Ų | 127 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | trans | 39.8 | 102.8 | 144.6 | -58 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 41 | S | 47.5 | Very low | 39.5 | Very low | 122 Ų | 122 | 129 Ų | 129 | 85% | 0.853 | 78% | 0.78 | S | S | * | * | 20.9 | 132.3 | 127.1 | 62 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 42 | G | 37.3 | Very low | 40.9 | Very low | 77 Ų | 77 | 125.9 Ų | 125.9 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | -164.1 | 125.1 | 161.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 43 | S | 35.2 | Very low | 42.6 | Very low | 122 Ų | 122 | 122.2 Ų | 122.2 | 85% | 0.853 | 77% | 0.765 | S | S | * | * | trans | 69.4 | 114.6 | 168.3 | -151.2 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 44 | S | 54.3 | Low | 44.3 | Very low | 115 Ų | 115 | 123.9 Ų | 123.9 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -93.5 | 134.4 | 155 | 177.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 45 | S | 40.1 | Very low | 46.6 | Very low | 116 Ų | 116 | 126.1 Ų | 126.1 | 81% | 0.811 | 77% | 0.769 | S | S | * | * | trans | -151.4 | 83.4 | 165.5 | -169 | 0 | 0 | 0 | 0 | 109 | ||||
| 46 | D | 53.7 | Low | 48.9 | Very low | 143 Ų | 143 | 127.3 Ų | 127.3 | 77% | 0.765 | 77% | 0.772 | S | S | * | * | trans | -77.4 | 120.7 | 160.4 | -168.1 | 26.1 | 0 | 0 | 0 | 107.4 | ||||
| 47 | D | 43.4 | Very low | 51.3 | Low | 140 Ų | 140 | 118.1 Ų | 118.1 | 75% | 0.749 | 74% | 0.743 | S | S | * | * | trans | 179.9 | 158 | 134.4 | -112.3 | -47.8 | 0 | 0 | 0 | 114.1 | ||||
| 48 | E | 45.1 | Very low | 53.4 | Low | 151 Ų | 151 | 116.2 Ų | 116.2 | 71% | 0.706 | 74% | 0.742 | S | S | * | * | trans | 61.9 | 122.9 | 161.1 | -71.4 | -159.1 | 113.4 | 0 | 0 | 122.9 | ||||
| 49 | H | 40.3 | Very low | 55.3 | Low | 155 Ų | 155 | 114.1 Ų | 114.1 | 72% | 0.718 | 73% | 0.732 | S | S | * | * | trans | 65.4 | 95.6 | 152.2 | -55.4 | -41.2 | 0 | 0 | 0 | 121.6 | S51 | H49-S51 VanDerWaalsContact C-N 3.29Å; H49-S51 PolarHBondContact O-N 3.43Å | ||
| 50 | G | 49.3 | Very low | 57.7 | Low | 88 Ų | 88 | 116.4 Ų | 116.4 | 91% | 0.907 | 72% | 0.719 | S | S | * | * | 77.7 | -2.6 | 100.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | G52 | G50-G52 PolarHBondContact O-N 3.46Å; G50-G52 VanDerWaalsContact O-N 3.1Å | |||
| 51 | S | 48.9 | Very low | 59.9 | Low | 108 Ų | 108 | 116.8 Ų | 116.8 | 76% | 0.755 | 71% | 0.708 | S | S | * | * | trans | -73.2 | 101.9 | 174.2 | -173.4 | 0 | 0 | 0 | 0 | 111.3 | H49 G53 | H49-S51 VanDerWaalsContact C-N 3.29Å; H49-S51 PolarHBondContact O-N 3.43Å; S51-G53 PolarHBondContact O-N 3.39Å | ||
| 52 | G | 58 | Low | 61.5 | Low | 85 Ų | 85 | 115.2 Ų | 115.2 | 88% | 0.876 | 70% | 0.703 | S | S | * | * | trans | -69.9 | 30.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | G50 | G50-G52 PolarHBondContact O-N 3.46Å; G50-G52 VanDerWaalsContact O-N 3.1Å | ||
| 53 | G | 66.9 | Low | 63.7 | Low | 43 Ų | 43 | 119.1 Ų | 119.1 | 44% | 0.443 | 71% | 0.705 | S | S | . | * | trans | -65.6 | 137.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | S51 R55 | S51-G53 PolarHBondContact O-N 3.39Å; G53-R55 PolarHBondContact O-N 3.33Å | ||
| 54 | M | 69.5 | Low | 66 | Low | 176 Ų | 176 | 119.5 Ų | 119.5 | 87% | 0.867 | 70% | 0.701 | S | S | * | * | trans | -61.4 | 118.9 | 175.1 | -69.2 | 147.6 | 64 | 0 | 0 | 109.2 | V56 | M54-V56 PolarHBondContact O-N 2.76Å; M54-V56 VanDerWaalsContact O-N 3.09Å | ||
| 55 | R | 79.1 | Confident | 67.4 | Low | 186 Ų | 186 | 119.2 Ų | 119.2 | 70% | 0.702 | 70% | 0.697 | S | S | * | * | trans | -73.1 | 102.2 | -179.3 | -64.4 | -178.2 | -178.3 | -113.3 | -0.8 | 109.1 | G53 Y60 | G53-R55 PolarHBondContact O-N 3.33Å; R55-Y60 HydrophobicContact CB-CD1 3.93Å; R55-Y60 HydrophobicContact CB-CD2 3.91Å; R55-Y60 HydrophobicContact CB-CE1 4.25Å; R55-Y60 HydrophobicContact CB-CE2 4.23Å; R55-Y60 HydrophobicContact CB-CG 3.74Å; R55-Y60 WeakPolarHBondContact O-CB 3.45Å | ||
| 56 | V | 78.3 | Confident | 69.6 | Low | 116 Ų | 116 | 121.3 Ų | 121.3 | 70% | 0.703 | 70% | 0.699 | S | S | * | * | trans | -109.9 | 129.7 | -180 | 179.7 | 0 | 0 | 0 | 0 | 109.4 | M54 | M54-V56 PolarHBondContact O-N 2.76Å; M54-V56 VanDerWaalsContact O-N 3.09Å | ||
| 57 | G | 81.4 | Confident | 71.1 | Confident | 19 Ų | 19 | 123.3 Ų | 123.3 | 20% | 0.196 | 70% | 0.697 | C | S | . | * | S | Bend | trans | 159.6 | 160.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q59 Y60 Q61 | G57-Q59 VanDerWaalsContact CA-OE1 3.27Å; G57-Q59 PolarHBondContact O-N 3.07Å; G57-Y60 CarbonylContact O-C 3.55Å; G57-Y60 PolarHBondContact O-N 2.97Å; G57-Q61 WeakPolarHBondContact O-CG 3.27Å; G57-Q61 PolarHBondContact O-N 2.78Å |
| 58 | T | 80.8 | Confident | 73.2 | Confident | 112 Ų | 112 | 119.9 Ų | 119.9 | 69% | 0.687 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -62.1 | -33 | -179.6 | 47.8 | 0 | 0 | 0 | 0 | 112.2 | Y60 Q61 | T58-Y60 PolarHBondContact O-N 3.34Å; T58-Q61 PolarHBondContact O-N 2.75Å |
| 59 | Q | 81.6 | Confident | 75.3 | Confident | 136 Ų | 136 | 116.6 Ų | 116.6 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | G | 310 helix | trans | -71.4 | -5 | 173.4 | 77.7 | -78.5 | 41.2 | 0 | 0 | 114.5 | G57 | G57-Q59 VanDerWaalsContact CA-OE1 3.27Å; G57-Q59 PolarHBondContact O-N 3.07Å |
| 60 | Y | 83.5 | Confident | 77.4 | Confident | 120 Ų | 120 | 116.8 Ų | 116.8 | 47% | 0.471 | 67% | 0.671 | S | S | . | * | G | 310 helix | trans | -120.4 | 4.5 | 176.9 | -59 | -62 | 0 | 0 | 0 | 112.9 | R55 G57 T58 | R55-Y60 HydrophobicContact CB-CD1 3.93Å; R55-Y60 HydrophobicContact CB-CD2 3.91Å; R55-Y60 HydrophobicContact CB-CE1 4.25Å; R55-Y60 HydrophobicContact CB-CE2 4.23Å; R55-Y60 HydrophobicContact CB-CG 3.74Å; R55-Y60 WeakPolarHBondContact O-CB 3.45Å; G57-Y60 CarbonylContact O-C 3.55Å; G57-Y60 PolarHBondContact O-N 2.97Å; T58-Y60 PolarHBondContact O-N 3.34Å |
| 61 | Q | 83 | Confident | 79 | Confident | 122 Ų | 122 | 118.1 Ų | 118.1 | 57% | 0.57 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -107.1 | 150.8 | 174.6 | -71.1 | 171.7 | 5.8 | 0 | 0 | 109.3 | G57 T58 L63 | G57-Q61 WeakPolarHBondContact O-CG 3.27Å; G57-Q61 PolarHBondContact O-N 2.78Å; T58-Q61 PolarHBondContact O-N 2.75Å; Q61-L63 PolarHBondContact O-N 3.03Å |
| 62 | A | 81.7 | Confident | 80.6 | Confident | 90 Ų | 90 | 114.2 Ų | 114.2 | 74% | 0.744 | 63% | 0.631 | S | S | * | * | trans | -69.9 | 125.6 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | V64 | A62-V64 PolarHBondContact O-N 2.88Š| ||
| 63 | L | 83.6 | Confident | 81.7 | Confident | 159 Ų | 159 | 115.6 Ų | 115.6 | 83% | 0.832 | 61% | 0.613 | S | S | * | * | trans | -67.9 | 104.3 | 164.7 | -64.9 | 178.1 | 0 | 0 | 0 | 107.5 | Q61 P65 | Q61-L63 PolarHBondContact O-N 3.03Å; L63-P65 WeakPolarHBondContact O-CD 3.29Å | ||
| 64 | V | 83.5 | Confident | 82.3 | Confident | 129 Ų | 129 | 116.1 Ų | 116.1 | 78% | 0.782 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 119.3 | 172.9 | -177.7 | 0 | 0 | 0 | 0 | 107.3 | A62 | A62-V64 PolarHBondContact O-N 2.88Š|
| 65 | P | 83.1 | Confident | 82.5 | Confident | 110 Ų | 110 | 109.8 Ų | 109.8 | 71% | 0.714 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 154.7 | 174.4 | -19.3 | 33.2 | 0 | 0 | 0 | 111.2 | L63 | L63-P65 WeakPolarHBondContact O-CD 3.29Š|
| 66 | D | 86.8 | Confident | 82.1 | Confident | 159 Ų | 159 | 107.7 Ų | 107.7 | 85% | 0.85 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 156.3 | 169.4 | -69.8 | -58.6 | 0 | 0 | 0 | 111.6 | D68 | D66-D68 PolarHBondContact O-N 3.14Å; D66-D68 VanDerWaalsContact O-N 3.13Å |
| 67 | Y | 85.4 | Confident | 82 | Confident | 186 Ų | 186 | 108.5 Ų | 108.5 | 73% | 0.729 | 58% | 0.583 | S | S | * | * | trans | -67.9 | 111.1 | -176.6 | 177 | -94.1 | 0 | 0 | 0 | 111.8 | P69 A72 | Y67-P69 HydrophobicContact CE1-CB 4.03Å; Y67-A72 HydrophobicContact CE2-CB 3.96Å; Y67-A72 WeakPolarHBondContact OH-CB 3.47Å | ||
| 68 | D | 88 | Confident | 81.7 | Confident | 68 Ų | 68 | 115.7 Ų | 115.7 | 36% | 0.364 | 60% | 0.604 | S | S | . | * | trans | -96.6 | 115.8 | 174.2 | -176.7 | -37.9 | 0 | 0 | 0 | 110.3 | D66 E70 I71 A72 | D66-D68 PolarHBondContact O-N 3.14Å; D66-D68 VanDerWaalsContact O-N 3.13Å; D68-E70 WeakPolarHBondContact OD1-CA 3.4Å; D68-E70 WeakPolarHBondContact OD1-CB 3.4Å; D68-E70 PolarHBondContact OD1-N 3.05Å; D68-I71 HydrophobicContact CB-CB 4Å; D68-I71 HydrophobicContact CB-CD1 3.92Å; D68-I71 HydrophobicContact CB-CG1 4.05Å; D68-I71 PolarHBondContact OD1-N 3.28Å; D68-I71 WeakPolarHBondContact OD2-CD1 3.48Å; D68-A72 WeakPolarHBondContact O-CB 3.26Å; D68-A72 PolarHBondContact O-N 2.79Å | ||
| 69 | P | 87.8 | Confident | 80.6 | Confident | 82 Ų | 82 | 118.4 Ų | 118.4 | 53% | 0.532 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -72.6 | -23.9 | -178.7 | 30.1 | -35.1 | 0 | 0 | 0 | 113.7 | Y67 K73 | Y67-P69 HydrophobicContact CE1-CB 4.03Å; P69-K73 WeakPolarHBondContact O-CB 3.5Å; P69-K73 PolarHBondContact O-N 2.92Å; P69-K73 VanDerWaalsContact O-N 3.08Å |
| 70 | E | 85.4 | Confident | 79.7 | Confident | 158 Ų | 158 | 119.3 Ų | 119.3 | 74% | 0.738 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -76.6 | -41.7 | 176.3 | -62.2 | -163.9 | 166.8 | 0 | 0 | 110.5 | D68 A72 K73 A74 | D68-E70 WeakPolarHBondContact OD1-CA 3.4Å; D68-E70 WeakPolarHBondContact OD1-CB 3.4Å; D68-E70 PolarHBondContact OD1-N 3.05Å; E70-A72 VanDerWaalsContact C-N 3.34Å; E70-K73 PolarHBondContact O-N 2.95Å; E70-A74 VanDerWaalsContact O-CB 3.25Å; E70-A74 WeakPolarHBondContact O-CB 3.49Å; E70-A74 PolarHBondContact O-N 3.04Å |
| 71 | I | 83.9 | Confident | 79 | Confident | 117 Ų | 117 | 119.4 Ų | 119.4 | 60% | 0.6 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -64.4 | -39.3 | 173.3 | -64.7 | 176.6 | 0 | 0 | 0 | 111 | D68 A74 A75 | D68-I71 HydrophobicContact CB-CB 4Å; D68-I71 HydrophobicContact CB-CD1 3.92Å; D68-I71 HydrophobicContact CB-CG1 4.05Å; D68-I71 PolarHBondContact OD1-N 3.28Å; D68-I71 WeakPolarHBondContact OD2-CD1 3.48Å; I71-A74 PolarHBondContact O-N 3.33Å; I71-A75 PolarHBondContact O-N 2.85Å |
| 72 | A | 80.6 | Confident | 78.4 | Confident | 26 Ų | 26 | 117.1 Ų | 117.1 | 22% | 0.215 | 64% | 0.641 | C | S | . | * | H | α-helix | trans | -60.4 | -51.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y67 D68 E70 A74 A75 E76 | Y67-A72 HydrophobicContact CE2-CB 3.96Å; Y67-A72 WeakPolarHBondContact OH-CB 3.47Å; D68-A72 WeakPolarHBondContact O-CB 3.26Å; D68-A72 PolarHBondContact O-N 2.79Å; E70-A72 VanDerWaalsContact C-N 3.34Å; A72-A74 PolarHBondContact O-N 3.16Å; A72-A75 WeakPolarHBondContact O-CA 3.2Å; A72-A75 WeakPolarHBondContact O-CB 3.36Å; A72-A75 PolarHBondContact O-N 3.19Å; A72-E76 PolarHBondContact O-N 3.44Å; A72-E76 VanDerWaalsContact O-N 3.11Å |
| 73 | K | 82.1 | Confident | 78.3 | Confident | 113 Ų | 113 | 120.6 Ų | 120.6 | 49% | 0.491 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -61.1 | -41.2 | 177.4 | -173.1 | 172.8 | 179 | -69.7 | 0 | 112.5 | P69 E70 A75 E76 E77 | P69-K73 WeakPolarHBondContact O-CB 3.5Å; P69-K73 PolarHBondContact O-N 2.92Å; P69-K73 VanDerWaalsContact O-N 3.08Å; E70-K73 PolarHBondContact O-N 2.95Å; K73-A75 PolarHBondContact O-N 3.33Å; K73-E76 PolarHBondContact O-N 2.98Å; K73-E76 VanDerWaalsContact O-N 3.15Å; K73-E77 IonicContact NZ-OE1 2.6Å; K73-E77 PolarHBondContact NZ-OE1 3.08Å; K73-E77 IonicContact NZ-OE2 3.76Å; K73-E77 WeakPolarHBondContact O-CG 3.37Å; K73-E77 PolarHBondContact O-N 2.91Å |
| 74 | A | 79.5 | Confident | 78.2 | Confident | 55 Ų | 55 | 117.8 Ų | 117.8 | 46% | 0.455 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -70.3 | -10.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | E70 I71 A72 R78 | E70-A74 VanDerWaalsContact O-CB 3.25Å; E70-A74 WeakPolarHBondContact O-CB 3.49Å; E70-A74 PolarHBondContact O-N 3.04Å; I71-A74 PolarHBondContact O-N 3.33Å; A72-A74 PolarHBondContact O-N 3.16Å; A74-R78 WeakPolarHBondContact O-CG 3.36Å |
| 75 | A | 72.8 | Confident | 78.2 | Confident | 43 Ų | 43 | 115 Ų | 115 | 36% | 0.355 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -89.2 | -34.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | I71 A72 K73 | I71-A75 PolarHBondContact O-N 2.85Å; A72-A75 WeakPolarHBondContact O-CA 3.2Å; A72-A75 WeakPolarHBondContact O-CB 3.36Å; A72-A75 PolarHBondContact O-N 3.19Å; K73-A75 PolarHBondContact O-N 3.33Å |
| 76 | E | 72.4 | Confident | 78.5 | Confident | 142 Ų | 142 | 112.6 Ų | 112.6 | 66% | 0.664 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67.8 | -35 | 172.4 | -66.6 | -179.1 | 165.3 | 0 | 0 | 112.2 | A72 K73 R78 | A72-E76 PolarHBondContact O-N 3.44Å; A72-E76 VanDerWaalsContact O-N 3.11Å; K73-E76 PolarHBondContact O-N 2.98Å; K73-E76 VanDerWaalsContact O-N 3.15Å; E76-R78 PolarHBondContact O-N 2.95Å; E76-R78 VanDerWaalsContact O-N 3.14Å |
| 77 | E | 75.1 | Confident | 78.7 | Confident | 132 Ų | 132 | 109 Ų | 109 | 62% | 0.617 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | 17.7 | -179.9 | -69.7 | 178 | 171.8 | 0 | 0 | 114.8 | K73 | K73-E77 IonicContact NZ-OE1 2.6Å; K73-E77 PolarHBondContact NZ-OE1 3.08Å; K73-E77 IonicContact NZ-OE2 3.76Å; K73-E77 WeakPolarHBondContact O-CG 3.37Å; K73-E77 PolarHBondContact O-N 2.91Å |
| 78 | R | 76.1 | Confident | 78.8 | Confident | 171 Ų | 171 | 105.3 Ų | 105.3 | 65% | 0.645 | 57% | 0.568 | S | S | * | * | trans | -89.5 | 131.4 | -176.4 | -71.9 | -179 | 171 | -178.6 | -4.4 | 113.5 | A74 E76 N80 L81 | A74-R78 WeakPolarHBondContact O-CG 3.36Å; E76-R78 PolarHBondContact O-N 2.95Å; E76-R78 VanDerWaalsContact O-N 3.14Å; R78-N80 PolarHBondContact O-N 3.43Å; R78-L81 WeakPolarHBondContact O-CG 3.43Å; R78-L81 PolarHBondContact O-N 3.03Å | ||
| 79 | D | 57.3 | Low | 78.5 | Confident | 168 Ų | 168 | 103.5 Ų | 103.5 | 90% | 0.898 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.8 | -20.9 | 175 | -62.9 | -43.4 | 0 | 0 | 0 | 115.2 | ||
| 80 | N | 61.3 | Low | 78.2 | Confident | 156 Ų | 156 | 105.7 Ų | 105.7 | 83% | 0.834 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.4 | 46.7 | -178.7 | -66.8 | -60 | 0 | 0 | 0 | 112.3 | R78 G82 | R78-N80 PolarHBondContact O-N 3.43Å; N80-G82 PolarHBondContact O-N 3.04Å |
| 81 | L | 70.8 | Confident | 78 | Confident | 122 Ų | 122 | 105.4 Ų | 105.4 | 64% | 0.639 | 58% | 0.578 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 134.4 | 167.1 | -77.9 | 168.4 | 0 | 0 | 0 | 110.6 | R78 | R78-L81 WeakPolarHBondContact O-CG 3.43Å; R78-L81 PolarHBondContact O-N 3.03Å |
| 82 | G | 70.4 | Confident | 78 | Confident | 74 Ų | 74 | 101.6 Ų | 101.6 | 76% | 0.763 | 56% | 0.559 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 133.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111 | N80 L84 | N80-G82 PolarHBondContact O-N 3.04Å; G82-L84 PolarHBondContact O-N 2.96Å |
| 83 | M | 78.1 | Confident | 78.4 | Confident | 163 Ų | 163 | 103.1 Ų | 103.1 | 80% | 0.803 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 120.1 | 177.3 | -176.6 | 172.1 | 69.7 | 0 | 0 | 110.4 | V85 | M83-V85 HydrophobicContact CE-CG1 3.84Å; M83-V85 HydrophobicContact CG-CG1 4.46Å; M83-V85 PolarHBondContact O-N 2.99Å; M83-V85 VanDerWaalsContact O-N 3.11Å |
| 84 | L | 83 | Confident | 78.7 | Confident | 100 Ų | 100 | 105.2 Ų | 105.2 | 52% | 0.524 | 58% | 0.583 | S | S | . | * | trans | -72.4 | 103 | 178.2 | -179.1 | 62.2 | 0 | 0 | 0 | 110.3 | G82 W86 L87 F120 | G82-L84 PolarHBondContact O-N 2.96Å; L84-W86 WeakPolarHBondContact CD1-O 3.4Å; L84-L87 HydrophobicContact CD1-CD2 3.98Å; L84-L87 HydrophobicContact CD1-CG 4.09Å; L84-L87 HydrophobicContact CD2-CD1 3.95Å; L84-L87 HydrophobicContact CD2-CD2 4.45Å; L84-L87 HydrophobicContact CD2-CG 4.01Å; L84-L87 HydrophobicContact CG-CG 4.38Å; L84-F120 HydrophobicContact CD2-CE1 4.22Å; L84-F120 HydrophobicContact CD2-CZ 3.78Å; L84-F120 HydrophobicContact CG-CE1 3.97Å; L84-F120 HydrophobicContact CG-CZ 3.96Å; L84-F120 VanDerWaalsContact O-CE1 3.32Å; L84-F120 WeakPolarHBondContact O-CE1 3.4Å | ||
| 85 | V | 82.3 | Confident | 79.3 | Confident | 70 Ų | 70 | 106.1 Ų | 106.1 | 42% | 0.424 | 59% | 0.591 | S | S | . | * | trans | -93.8 | -18.2 | -178.3 | -67.6 | 0 | 0 | 0 | 0 | 114.3 | M83 G117 | M83-V85 HydrophobicContact CE-CG1 3.84Å; M83-V85 HydrophobicContact CG-CG1 4.46Å; M83-V85 PolarHBondContact O-N 2.99Å; M83-V85 VanDerWaalsContact O-N 3.11Å; V85-G117 VanDerWaalsContact O-CA 3.29Å; V85-G117 WeakPolarHBondContact O-CA 3.34Å | ||
| 86 | W | 90.6 | Very high | 80.2 | Confident | 60 Ų | 60 | 110.1 Ų | 110.1 | 23% | 0.227 | 60% | 0.6 | C | S | . | * | trans | -155.6 | 143.2 | 178.4 | 177.9 | -113.1 | 0 | 0 | 0 | 111.9 | L84 L92 L97 L116 L119 F120 H124 | L84-W86 WeakPolarHBondContact CD1-O 3.4Å; W86-L92 HydrophobicContact CH2-CD2 4.48Å; W86-L97 HydrophobicContact CH2-CD1 3.98Å; W86-L97 HydrophobicContact CH2-CD2 4.21Å; W86-L97 HydrophobicContact CZ2-CD1 4.49Å; W86-L97 HydrophobicContact CZ2-CD2 3.95Å; W86-L116 HydrophobicContact CB-CB 4.46Å; W86-L116 HydrophobicContact CD2-CB 4.04Å; W86-L116 HydrophobicContact CD2-CD1 4.45Å; W86-L116 HydrophobicContact CD2-CD2 3.91Å; W86-L116 HydrophobicContact CD2-CG 4.35Å; W86-L116 HydrophobicContact CE3-CB 3.77Å; W86-L116 HydrophobicContact CE3-CD2 3.83Å; W86-L116 HydrophobicContact CE3-CG 4.35Å; W86-L116 VanDerWaalsContact CE3-O 3.32Å; W86-L116 HydrophobicContact CG-CB 4.34Å; W86-L116 HydrophobicContact CG-CD1 4.42Å; W86-L116 HydrophobicContact CH2-CD2 3.76Å; W86-L116 HydrophobicContact CZ2-CD2 3.82Å; W86-L116 HydrophobicContact CZ3-CB 4.35Å; W86-L116 HydrophobicContact CZ3-CD2 3.77Å; W86-L119 HydrophobicContact CH2-CD2 4.1Å; W86-L119 HydrophobicContact CZ3-CB 4.25Å; W86-L119 HydrophobicContact CZ3-CD2 4.09Å; W86-L119 HydrophobicContact CZ3-CG 4.22Å; W86-F120 HydrophobicContact CE3-CB 4.01Å; W86-F120 HydrophobicContact CZ3-CB 4.5Å; W86-H124 AromaticContact CH2-CD2 3.58Å; W86-H124 AromaticContact CH2-NE2 3.79Å; W86-H124 AromaticContact CZ3-CD2 3.61Å; W86-H124 AromaticContact CZ3-NE2 3.65Å | ||
| 87 | L | 89.3 | Confident | 81.1 | Confident | 84 Ų | 84 | 104.9 Ų | 104.9 | 44% | 0.44 | 58% | 0.576 | S | S | . | * | trans | -131.8 | 139.6 | 158.9 | -72 | 178.5 | 0 | 0 | 0 | 108.5 | L84 F120 H124 | L84-L87 HydrophobicContact CD1-CD2 3.98Å; L84-L87 HydrophobicContact CD1-CG 4.09Å; L84-L87 HydrophobicContact CD2-CD1 3.95Å; L84-L87 HydrophobicContact CD2-CD2 4.45Å; L84-L87 HydrophobicContact CD2-CG 4.01Å; L84-L87 HydrophobicContact CG-CG 4.38Å; L87-F120 HydrophobicContact CB-CD2 4.37Å; L87-F120 HydrophobicContact CB-CE2 3.91Å; L87-F120 HydrophobicContact CD1-CE2 4.08Å; L87-F120 HydrophobicContact CD1-CZ 4.31Å; L87-F120 HydrophobicContact CG-CE2 4.01Å; L87-F120 HydrophobicContact CG-CZ 4.31Å; L87-H124 PolarHBondContact O-CE1 3.3Å; L87-H124 PolarHBondContact O-NE2 3.05Å | ||
| 88 | P | 87.4 | Confident | 82 | Confident | 107 Ų | 107 | 103.2 Ų | 103.2 | 70% | 0.695 | 57% | 0.572 | S | S | * | * | trans | -60.8 | 142.5 | 167.8 | -21.4 | 33.5 | 0 | 0 | 0 | 111.6 | ||||
| 89 | S | 83.6 | Confident | 82.9 | Confident | 30 Ų | 30 | 101 Ų | 101 | 21% | 0.21 | 57% | 0.569 | C | S | . | * | trans | -112.2 | 127.1 | 174.4 | 179.4 | 0 | 0 | 0 | 0 | 110.7 | N91 L92 H124 | S89-N91 PolarHBondContact O-N 2.9Å; S89-L92 PolarHBondContact O-N 3.27Å; S89-H124 VanDerWaalsContact CB-CG 3.46Å | ||
| 90 | P | 81.3 | Confident | 84.7 | Confident | 128 Ų | 128 | 93.2 Ų | 93.2 | 83% | 0.831 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69 | -14.1 | -179.2 | 30.2 | -36.4 | 0 | 0 | 0 | 113.2 | ||
| 91 | N | 80.6 | Confident | 86.2 | Confident | 153 Ų | 153 | 86.8 Ų | 86.8 | 82% | 0.818 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | 1 | -178.6 | -62.7 | -26.9 | 0 | 0 | 0 | 112.9 | S89 | S89-N91 PolarHBondContact O-N 2.9Š|
| 92 | L | 84.2 | Confident | 87.3 | Confident | 37 Ų | 37 | 82.8 Ų | 82.8 | 19% | 0.194 | 48% | 0.477 | C | S | . | . | S | Bend | trans | -108.5 | 118.5 | -176.7 | -168.3 | 68.2 | 0 | 0 | 0 | 110.8 | W86 S89 L97 L119 I126 | W86-L92 HydrophobicContact CH2-CD2 4.48Å; S89-L92 PolarHBondContact O-N 3.27Å; L92-L97 HydrophobicContact CD2-CB 4.08Å; L92-L97 HydrophobicContact CD2-CD1 4Å; L92-L97 HydrophobicContact CD2-CD2 4.47Å; L92-L97 HydrophobicContact CD2-CG 4.42Å; L92-L119 HydrophobicContact CD2-CD2 3.92Å; L92-I126 HydrophobicContact CD1-CD1 3.85Å; L92-I126 HydrophobicContact CD1-CG1 4.22Å |
| 93 | A | 89.1 | Confident | 88.4 | Confident | 58 Ų | 58 | 81.1 Ų | 81.1 | 48% | 0.479 | 45% | 0.45 | S | S | . | . | trans | -71.9 | 129.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | A95 K96 L97 | A93-A95 VanDerWaalsContact C-N 3.34Å; A93-A95 PolarHBondContact O-N 2.71Å; A93-K96 HydrophobicContact CB-CG 4.46Å; A93-K96 WeakPolarHBondContact O-CB 3.49Å; A93-K96 PolarHBondContact O-N 2.67Å; A93-L97 PolarHBondContact O-N 3.49Å | ||
| 94 | E | 87.5 | Confident | 89 | Confident | 156 Ų | 156 | 73.3 Ų | 73.3 | 73% | 0.729 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -50.7 | -47.3 | -175.7 | -168.1 | 169.9 | -151.6 | 0 | 0 | 112.9 | K96 L97 D98 | E94-K96 PolarHBondContact O-N 3.02Å; E94-K96 VanDerWaalsContact O-N 3.15Å; E94-L97 WeakPolarHBondContact O-CA 3.45Å; E94-L97 VanDerWaalsContact O-CB 3.3Å; E94-L97 WeakPolarHBondContact O-CB 3.45Å; E94-L97 PolarHBondContact O-N 3.36Å; E94-D98 PolarHBondContact O-N 2.93Å |
| 95 | A | 92.1 | Very high | 89.2 | Confident | 75 Ų | 75 | 75.2 Ų | 75.2 | 62% | 0.62 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -59.8 | -28.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | A93 E99 | A93-A95 VanDerWaalsContact C-N 3.34Å; A93-A95 PolarHBondContact O-N 2.71Å; A95-E99 PolarHBondContact O-N 2.98Å |
| 96 | K | 91.9 | Very high | 89.6 | Confident | 127 Ų | 127 | 79.7 Ų | 79.7 | 55% | 0.552 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -79.4 | -28.8 | 174.2 | -66.6 | -169.6 | 174 | -169.3 | 0 | 112.2 | A93 E94 Y100 I126 | A93-K96 HydrophobicContact CB-CG 4.46Å; A93-K96 WeakPolarHBondContact O-CB 3.49Å; A93-K96 PolarHBondContact O-N 2.67Å; E94-K96 PolarHBondContact O-N 3.02Å; E94-K96 VanDerWaalsContact O-N 3.15Å; K96-Y100 WeakPolarHBondContact O-CB 3.4Å; K96-Y100 PolarHBondContact O-N 3.39Å; K96-Y100 VanDerWaalsContact O-N 3.07Å; K96-I126 HydrophobicContact CB-CD1 3.8Å; K96-I126 WeakPolarHBondContact O-CD1 3.47Å |
| 97 | L | 92 | Very high | 89.4 | Confident | 31 Ų | 31 | 84 Ų | 84 | 16% | 0.162 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -68.7 | -43.8 | 172.7 | 178.6 | 60 | 0 | 0 | 0 | 110.3 | W86 L92 A93 E94 Y100 I101 L116 L119 | W86-L97 HydrophobicContact CH2-CD1 3.98Å; W86-L97 HydrophobicContact CH2-CD2 4.21Å; W86-L97 HydrophobicContact CZ2-CD1 4.49Å; W86-L97 HydrophobicContact CZ2-CD2 3.95Å; L92-L97 HydrophobicContact CD2-CB 4.08Å; L92-L97 HydrophobicContact CD2-CD1 4Å; L92-L97 HydrophobicContact CD2-CD2 4.47Å; L92-L97 HydrophobicContact CD2-CG 4.42Å; A93-L97 PolarHBondContact O-N 3.49Å; E94-L97 WeakPolarHBondContact O-CA 3.45Å; E94-L97 VanDerWaalsContact O-CB 3.3Å; E94-L97 WeakPolarHBondContact O-CB 3.45Å; E94-L97 PolarHBondContact O-N 3.36Å; L97-Y100 HydrophobicContact CD1-CD1 4.44Å; L97-Y100 PolarHBondContact O-N 2.9Å; L97-I101 HydrophobicContact CD1-CD1 4.04Å; L97-I101 HydrophobicContact CD1-CG1 4.33Å; L97-I101 HydrophobicContact CG-CD1 3.93Å; L97-I101 VanDerWaalsContact O-CG1 3.28Å; L97-I101 WeakPolarHBondContact O-CG1 3.35Å; L97-I101 PolarHBondContact O-N 3.47Å; L97-L116 HydrophobicContact CD1-CD2 3.83Å; L97-L116 HydrophobicContact CD2-CD2 4.44Å; L97-L119 HydrophobicContact CD1-CD2 3.41Å; L97-L119 VanDerWaalsContact CD1-CD2 3.41Å |
| 98 | D | 93.2 | Very high | 89.1 | Confident | 98 Ų | 98 | 82 Ų | 82 | 52% | 0.524 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -60.5 | -46.9 | 174.6 | -71.9 | -31.6 | 0 | 0 | 0 | 112.2 | E94 Y100 I101 A102 | E94-D98 PolarHBondContact O-N 2.93Å; D98-Y100 VanDerWaalsContact C-N 3.35Å; D98-Y100 PolarHBondContact O-N 3.17Å; D98-I101 PolarHBondContact O-N 3.14Å; D98-A102 WeakPolarHBondContact O-CB 3.48Å; D98-A102 PolarHBondContact O-N 2.97Å |
| 99 | E | 94.7 | Very high | 88.8 | Confident | 125 Ų | 125 | 79.8 Ų | 79.8 | 58% | 0.584 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -58.8 | -44.6 | 175.8 | -177.1 | 177.7 | -163.7 | 0 | 0 | 111.8 | A95 A102 I103 | A95-E99 PolarHBondContact O-N 2.98Å; E99-A102 PolarHBondContact O-N 2.7Å; E99-I103 HydrophobicContact CG-CD1 4.04Å; E99-I103 VanDerWaalsContact O-CG1 3.3Å; E99-I103 WeakPolarHBondContact O-CG1 3.26Å; E99-I103 PolarHBondContact O-N 2.74Å |
| 100 | Y | 94.8 | Very high | 88.9 | Confident | 3 Ų | 3 | 78.7 Ų | 78.7 | 1% | 0.012 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -62.6 | -44.5 | 175.5 | 165.1 | -93 | 0 | 0 | 0 | 112.6 | K96 L97 D98 A102 I103 A104 A115 L119 I126 S129 L130 L133 | K96-Y100 WeakPolarHBondContact O-CB 3.4Å; K96-Y100 PolarHBondContact O-N 3.39Å; K96-Y100 VanDerWaalsContact O-N 3.07Å; L97-Y100 HydrophobicContact CD1-CD1 4.44Å; L97-Y100 PolarHBondContact O-N 2.9Å; D98-Y100 VanDerWaalsContact C-N 3.35Å; D98-Y100 PolarHBondContact O-N 3.17Å; Y100-A102 VanDerWaalsContact C-N 3.34Å; Y100-A102 PolarHBondContact O-N 3.39Å; Y100-I103 PolarHBondContact O-N 3.31Å; Y100-A104 WeakPolarHBondContact O-CB 3.49Å; Y100-A104 PolarHBondContact O-N 3.44Å; Y100-A115 HydrophobicContact CE1-CB 4.11Å; Y100-A115 VanDerWaalsContact CE1-O 3.26Å; Y100-A115 WeakPolarHBondContact CE1-O 3.38Å; Y100-A115 PolarHBondContact OH-O 3.46Å; Y100-L119 HydrophobicContact CD1-CB 4.43Å; Y100-L119 HydrophobicContact CD1-CD2 3.8Å; Y100-L119 HydrophobicContact CE1-CB 3.69Å; Y100-L119 HydrophobicContact CE1-CD2 3.89Å; Y100-L119 HydrophobicContact CE1-CG 4.26Å; Y100-L119 HydrophobicContact CG-CD2 4.43Å; Y100-I126 HydrophobicContact CD2-CG2 4.15Å; Y100-I126 HydrophobicContact CG-CG1 4.46Å; Y100-S129 PolarHBondContact OH-OG 3Å; Y100-L130 HydrophobicContact CD2-CD2 3.59Å; Y100-L130 HydrophobicContact CD2-CG 3.91Å; Y100-L130 HydrophobicContact CE2-CD2 3.9Å; Y100-L130 HydrophobicContact CE2-CG 4.24Å; Y100-L133 HydrophobicContact CE2-CD1 4.2Å |
| 101 | I | 93.5 | Very high | 89 | Confident | 21 Ų | 21 | 76.2 Ų | 76.2 | 11% | 0.108 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -64.1 | -40.7 | 177.9 | -68.7 | 165.3 | 0 | 0 | 0 | 110.6 | L97 D98 A104 K105 M112 L116 | L97-I101 HydrophobicContact CD1-CD1 4.04Å; L97-I101 HydrophobicContact CD1-CG1 4.33Å; L97-I101 HydrophobicContact CG-CD1 3.93Å; L97-I101 VanDerWaalsContact O-CG1 3.28Å; L97-I101 WeakPolarHBondContact O-CG1 3.35Å; L97-I101 PolarHBondContact O-N 3.47Å; D98-I101 PolarHBondContact O-N 3.14Å; I101-A104 PolarHBondContact O-N 2.99Å; I101-K105 VanDerWaalsContact O-CB 3.28Å; I101-K105 WeakPolarHBondContact O-CB 3.17Å; I101-K105 PolarHBondContact O-N 3.35Å; I101-M112 HydrophobicContact CG2-CE 4.2Å; I101-M112 HydrophobicContact CG2-CG 4.42Å; I101-L116 HydrophobicContact CD1-CD2 4Å; I101-L116 HydrophobicContact CD1-CG 4.49Å |
| 102 | A | 94.1 | Very high | 89.3 | Confident | 39 Ų | 39 | 74.6 Ų | 74.6 | 32% | 0.322 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.6 | -48 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | D98 E99 Y100 A104 K105 E106 | D98-A102 WeakPolarHBondContact O-CB 3.48Å; D98-A102 PolarHBondContact O-N 2.97Å; E99-A102 PolarHBondContact O-N 2.7Å; Y100-A102 VanDerWaalsContact C-N 3.34Å; Y100-A102 PolarHBondContact O-N 3.39Å; A102-A104 PolarHBondContact O-N 2.73Å; A102-K105 PolarHBondContact O-N 3.4Å; A102-E106 VanDerWaalsContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CG 3.2Å; A102-E106 PolarHBondContact O-N 3.38Å |
| 103 | I | 92.9 | Very high | 89.5 | Confident | 38 Ų | 38 | 79.8 Ų | 79.8 | 20% | 0.195 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -60.4 | -47 | 177.3 | -69.8 | 165.3 | 0 | 0 | 0 | 111.6 | E99 Y100 K105 K107 L130 | E99-I103 HydrophobicContact CG-CD1 4.04Å; E99-I103 VanDerWaalsContact O-CG1 3.3Å; E99-I103 WeakPolarHBondContact O-CG1 3.26Å; E99-I103 PolarHBondContact O-N 2.74Å; Y100-I103 PolarHBondContact O-N 3.31Å; I103-K105 VanDerWaalsContact C-N 3.33Å; I103-K105 PolarHBondContact O-N 3.41Å; I103-K107 HydrophobicContact CG2-CD 4.2Å; I103-K107 WeakPolarHBondContact O-CB 3.46Å; I103-K107 PolarHBondContact O-N 3.48Å; I103-L130 HydrophobicContact CB-CD2 4.23Å; I103-L130 HydrophobicContact CG2-CD2 3.59Å |
| 104 | A | 91 | Very high | 89.5 | Confident | 0 Ų | 0 | 80.8 Ų | 80.8 | 0% | 0 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -61.7 | -40.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y100 I101 A102 H108 G109 Y110 A115 L133 | Y100-A104 WeakPolarHBondContact O-CB 3.49Å; Y100-A104 PolarHBondContact O-N 3.44Å; I101-A104 PolarHBondContact O-N 2.99Å; A102-A104 PolarHBondContact O-N 2.73Å; A104-H108 CarbonylContact O-C 3.37Å; A104-H108 WeakPolarHBondContact O-CA 3.26Å; A104-H108 WeakPolarHBondContact O-CB 3.26Å; A104-H108 PolarHBondContact O-N 3.43Å; A104-G109 PolarHBondContact O-N 3.48Å; A104-Y110 HydrophobicContact CB-CG 4.47Å; A104-Y110 PolarHBondContact O-N 3.05Å; A104-Y110 VanDerWaalsContact O-N 3.08Å; A104-A115 HydrophobicContact CB-CB 3.72Å; A104-L133 HydrophobicContact CB-CD1 3.72Å; A104-L133 HydrophobicContact CB-CD2 3.97Å |
| 105 | K | 88.2 | Confident | 89.6 | Confident | 140 Ų | 140 | 73.4 Ų | 73.4 | 61% | 0.609 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -72.3 | -50.4 | 178.3 | -175.9 | -175.6 | 175.4 | -168.9 | 0 | 112.6 | I101 A102 I103 G109 Y110 | I101-K105 VanDerWaalsContact O-CB 3.28Å; I101-K105 WeakPolarHBondContact O-CB 3.17Å; I101-K105 PolarHBondContact O-N 3.35Å; A102-K105 PolarHBondContact O-N 3.4Å; I103-K105 VanDerWaalsContact C-N 3.33Å; I103-K105 PolarHBondContact O-N 3.41Å; K105-G109 WeakPolarHBondContact O-CA 3.43Å; K105-G109 PolarHBondContact O-N 3.25Å; K105-G109 VanDerWaalsContact O-N 3.12Å; K105-Y110 WeakPolarHBondContact CA-O 3.27Å |
| 106 | E | 88.7 | Confident | 89.6 | Confident | 163 Ų | 163 | 71.2 Ų | 71.2 | 76% | 0.762 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -79.7 | -32.7 | -169.9 | -67.1 | -178.6 | 176.7 | 0 | 0 | 113.6 | A102 | A102-E106 VanDerWaalsContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CB 3.31Å; A102-E106 WeakPolarHBondContact O-CG 3.2Å; A102-E106 PolarHBondContact O-N 3.38Å |
| 107 | K | 86.5 | Confident | 89.6 | Confident | 150 Ų | 150 | 66.1 Ų | 66.1 | 65% | 0.652 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -99.5 | -24.3 | -178.7 | -57.7 | -172.1 | -169.3 | 170.6 | 0 | 114 | I103 | I103-K107 HydrophobicContact CG2-CD 4.2Å; I103-K107 WeakPolarHBondContact O-CB 3.46Å; I103-K107 PolarHBondContact O-N 3.48Å |
| 108 | H | 83.5 | Confident | 89.5 | Confident | 44 Ų | 44 | 66 Ų | 66 | 20% | 0.204 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -127.1 | 1.4 | -172.7 | -53.4 | -78.3 | 0 | 0 | 0 | 113.9 | A104 Y110 L133 | A104-H108 CarbonylContact O-C 3.37Å; A104-H108 WeakPolarHBondContact O-CA 3.26Å; A104-H108 WeakPolarHBondContact O-CB 3.26Å; A104-H108 PolarHBondContact O-N 3.43Å; H108-Y110 VanDerWaalsContact C-N 3.26Å; H108-Y110 HydrophobicContact CB-CD2 3.57Å; H108-Y110 HydrophobicContact CB-CE2 3.7Å; H108-Y110 WeakPolarHBondContact O-CD2 3.43Å; H108-Y110 PolarHBondContact O-N 3.19Å; H108-L133 HydrophobicContact CB-CB 4.41Å |
| 109 | G | 80.7 | Confident | 89.5 | Confident | 59 Ų | 59 | 61.4 Ų | 61.4 | 61% | 0.608 | 32% | 0.316 | S | S | * | . | trans | 70.7 | 13.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | A104 K105 | A104-G109 PolarHBondContact O-N 3.48Å; K105-G109 WeakPolarHBondContact O-CA 3.43Å; K105-G109 PolarHBondContact O-N 3.25Å; K105-G109 VanDerWaalsContact O-N 3.12Å | ||
| 110 | Y | 85.6 | Confident | 89.4 | Confident | 7 Ų | 7 | 58.1 Ų | 58.1 | 3% | 0.027 | 30% | 0.3 | C | S | . | . | trans | -69.9 | 139.9 | -179.4 | -78.2 | -118.2 | 0 | 0 | 0 | 111.3 | A104 K105 H108 Q114 M118 L133 F136 T137 | A104-Y110 HydrophobicContact CB-CG 4.47Å; A104-Y110 PolarHBondContact O-N 3.05Å; A104-Y110 VanDerWaalsContact O-N 3.08Å; K105-Y110 WeakPolarHBondContact CA-O 3.27Å; H108-Y110 VanDerWaalsContact C-N 3.26Å; H108-Y110 HydrophobicContact CB-CD2 3.57Å; H108-Y110 HydrophobicContact CB-CE2 3.7Å; H108-Y110 WeakPolarHBondContact O-CD2 3.43Å; H108-Y110 PolarHBondContact O-N 3.19Å; Y110-Q114 HydrophobicContact CD1-CB 3.73Å; Y110-Q114 HydrophobicContact CG-CB 4.49Å; Y110-M118 HydrophobicContact CE1-CE 4Å; Y110-L133 HydrophobicContact CD1-CD2 3.87Å; Y110-L133 HydrophobicContact CD2-CD2 3.86Å; Y110-L133 HydrophobicContact CE1-CD2 3.61Å; Y110-L133 HydrophobicContact CE2-CB 4.32Å; Y110-L133 HydrophobicContact CE2-CD2 3.57Å; Y110-L133 HydrophobicContact CG-CD2 4.01Å; Y110-L133 VanDerWaalsContact CZ-CD2 3.44Å; Y110-L133 PolarHBondContact OH-O 2.86Å; Y110-F136 WeakPolarHBondContact OH-CB 3.38Å; Y110-F136 PolarHBondContact OH-O 3.03Å; Y110-T137 PolarHBondContact OH-N 3.01Å | ||
| 111 | N | 84.6 | Confident | 89.2 | Confident | 77 Ų | 77 | 67.9 Ų | 67.9 | 41% | 0.412 | 34% | 0.337 | S | S | . | . | trans | -73.7 | 164.2 | 162.8 | 88.1 | 37.4 | 0 | 0 | 0 | 110.6 | E113 Q114 A115 | N111-E113 PolarHBondContact O-N 3.03Å; N111-E113 WeakPolarHBondContact OD1-CA 3.47Å; N111-E113 WeakPolarHBondContact OD1-CB 3.36Å; N111-E113 PolarHBondContact OD1-N 2.92Å; N111-Q114 VanDerWaalsContact CG-OE1 3.24Å; N111-Q114 PolarHBondContact ND2-OE1 3.31Å; N111-Q114 PolarHBondContact O-N 2.98Å; N111-Q114 PolarHBondContact OD1-N 3.26Å; N111-A115 PolarHBondContact O-N 3.35Å | ||
| 112 | M | 87.2 | Confident | 89.2 | Confident | 119 Ų | 119 | 68.4 Ų | 68.4 | 59% | 0.586 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -60.1 | -41.9 | -175.6 | -179.2 | 176.9 | -83.9 | 0 | 0 | 113.1 | I101 A115 L116 | I101-M112 HydrophobicContact CG2-CE 4.2Å; I101-M112 HydrophobicContact CG2-CG 4.42Å; M112-A115 PolarHBondContact O-N 3.39Å; M112-L116 HydrophobicContact CG-CD1 4.16Å; M112-L116 WeakPolarHBondContact O-CB 3.35Å; M112-L116 VanDerWaalsContact O-CG 3.25Å; M112-L116 WeakPolarHBondContact O-CG 3.38Å; M112-L116 PolarHBondContact O-N 3.42Å |
| 113 | E | 88.6 | Confident | 89.1 | Confident | 146 Ų | 146 | 75.3 Ų | 75.3 | 68% | 0.682 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -68.4 | -37.1 | 179.3 | -60.3 | -179.9 | 166.4 | 0 | 0 | 111.7 | N111 G117 | N111-E113 PolarHBondContact O-N 3.03Å; N111-E113 WeakPolarHBondContact OD1-CA 3.47Å; N111-E113 WeakPolarHBondContact OD1-CB 3.36Å; N111-E113 PolarHBondContact OD1-N 2.92Å; E113-G117 PolarHBondContact O-N 3.34Å |
| 114 | Q | 87.8 | Confident | 89.1 | Confident | 79 Ų | 79 | 75.1 Ų | 75.1 | 37% | 0.369 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -66.4 | -42.2 | 174.3 | -67.5 | 169.1 | -45 | 0 | 0 | 111.6 | Y110 N111 G117 M118 | Y110-Q114 HydrophobicContact CD1-CB 3.73Å; Y110-Q114 HydrophobicContact CG-CB 4.49Å; N111-Q114 VanDerWaalsContact CG-OE1 3.24Å; N111-Q114 PolarHBondContact ND2-OE1 3.31Å; N111-Q114 PolarHBondContact O-N 2.98Å; N111-Q114 PolarHBondContact OD1-N 3.26Å; Q114-G117 PolarHBondContact O-N 3.13Å; Q114-M118 WeakPolarHBondContact O-CB 3.35Å; Q114-M118 PolarHBondContact O-N 2.91Å |
| 115 | A | 91.1 | Very high | 89.1 | Confident | 1 Ų | 1 | 77.8 Ų | 77.8 | 1% | 0.008 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.6 | -45.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y100 A104 N111 M112 M118 L119 | Y100-A115 HydrophobicContact CE1-CB 4.11Å; Y100-A115 VanDerWaalsContact CE1-O 3.26Å; Y100-A115 WeakPolarHBondContact CE1-O 3.38Å; Y100-A115 PolarHBondContact OH-O 3.46Å; A104-A115 HydrophobicContact CB-CB 3.72Å; N111-A115 PolarHBondContact O-N 3.35Å; M112-A115 PolarHBondContact O-N 3.39Å; A115-M118 PolarHBondContact O-N 3.34Å; A115-L119 WeakPolarHBondContact O-CB 3.37Å; A115-L119 PolarHBondContact O-N 3.48Å |
| 116 | L | 91.8 | Very high | 89.3 | Confident | 28 Ų | 28 | 72.8 Ų | 72.8 | 15% | 0.147 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -62.3 | -43.9 | 174.1 | -70.8 | 176.7 | 0 | 0 | 0 | 111.9 | W86 L97 I101 M112 M118 L119 F120 | W86-L116 HydrophobicContact CB-CB 4.46Å; W86-L116 HydrophobicContact CD2-CB 4.04Å; W86-L116 HydrophobicContact CD2-CD1 4.45Å; W86-L116 HydrophobicContact CD2-CD2 3.91Å; W86-L116 HydrophobicContact CD2-CG 4.35Å; W86-L116 HydrophobicContact CE3-CB 3.77Å; W86-L116 HydrophobicContact CE3-CD2 3.83Å; W86-L116 HydrophobicContact CE3-CG 4.35Å; W86-L116 VanDerWaalsContact CE3-O 3.32Å; W86-L116 HydrophobicContact CG-CB 4.34Å; W86-L116 HydrophobicContact CG-CD1 4.42Å; W86-L116 HydrophobicContact CH2-CD2 3.76Å; W86-L116 HydrophobicContact CZ2-CD2 3.82Å; W86-L116 HydrophobicContact CZ3-CB 4.35Å; W86-L116 HydrophobicContact CZ3-CD2 3.77Å; L97-L116 HydrophobicContact CD1-CD2 3.83Å; L97-L116 HydrophobicContact CD2-CD2 4.44Å; I101-L116 HydrophobicContact CD1-CD2 4Å; I101-L116 HydrophobicContact CD1-CG 4.49Å; M112-L116 HydrophobicContact CG-CD1 4.16Å; M112-L116 WeakPolarHBondContact O-CB 3.35Å; M112-L116 VanDerWaalsContact O-CG 3.25Å; M112-L116 WeakPolarHBondContact O-CG 3.38Å; M112-L116 PolarHBondContact O-N 3.42Å; L116-M118 PolarHBondContact O-N 3Å; L116-L119 PolarHBondContact O-N 2.8Å; L116-F120 WeakPolarHBondContact O-CB 3.19Å; L116-F120 PolarHBondContact O-N 3Å |
| 117 | G | 90.8 | Very high | 89.4 | Confident | 20 Ų | 20 | 72.5 Ų | 72.5 | 21% | 0.206 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59.9 | -44.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | V85 E113 Q114 F120 W121 | V85-G117 VanDerWaalsContact O-CA 3.29Å; V85-G117 WeakPolarHBondContact O-CA 3.34Å; E113-G117 PolarHBondContact O-N 3.34Å; Q114-G117 PolarHBondContact O-N 3.13Å; G117-F120 PolarHBondContact O-N 3.31Å; G117-W121 WeakPolarHBondContact O-CB 3.2Å; G117-W121 PolarHBondContact O-N 3.11Å |
| 118 | M | 90.9 | Very high | 89.7 | Confident | 30 Ų | 30 | 71.6 Ų | 71.6 | 15% | 0.148 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.8 | -46.2 | 173.8 | -164.1 | 61.8 | 67 | 0 | 0 | 110.9 | Y110 Q114 A115 L116 F120 W121 H122 S129 L133 F136 | Y110-M118 HydrophobicContact CE1-CE 4Å; Q114-M118 WeakPolarHBondContact O-CB 3.35Å; Q114-M118 PolarHBondContact O-N 2.91Å; A115-M118 PolarHBondContact O-N 3.34Å; L116-M118 PolarHBondContact O-N 3Å; M118-F120 VanDerWaalsContact C-N 3.32Å; M118-F120 PolarHBondContact O-N 2.87Å; M118-W121 WeakPolarHBondContact O-CB 3.33Å; M118-W121 PolarHBondContact O-N 3.2Å; M118-H122 PolarHBondContact O-CD2 3.11Å; M118-H122 PolarHBondContact O-N 2.98Å; M118-S129 WeakPolarHBondContact CG-OG 3.4Å; M118-L133 HydrophobicContact CG-CD2 4.36Å; M118-F136 HydrophobicContact CE-CB 3.52Å; M118-F136 HydrophobicContact CE-CD2 4.08Å; M118-F136 HydrophobicContact CE-CG 3.96Å; M118-F136 HydrophobicContact SD-CD2 4.19Å |
| 119 | L | 93.1 | Very high | 90.1 | Very high | 0 Ų | 0 | 69.5 Ų | 69.5 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -64.9 | -35.6 | 179.5 | -175.7 | 60.5 | 0 | 0 | 0 | 112.7 | W86 L92 L97 Y100 A115 L116 H122 K123 H124 I126 S129 | W86-L119 HydrophobicContact CH2-CD2 4.1Å; W86-L119 HydrophobicContact CZ3-CB 4.25Å; W86-L119 HydrophobicContact CZ3-CD2 4.09Å; W86-L119 HydrophobicContact CZ3-CG 4.22Å; L92-L119 HydrophobicContact CD2-CD2 3.92Å; L97-L119 HydrophobicContact CD1-CD2 3.41Å; L97-L119 VanDerWaalsContact CD1-CD2 3.41Å; Y100-L119 HydrophobicContact CD1-CB 4.43Å; Y100-L119 HydrophobicContact CD1-CD2 3.8Å; Y100-L119 HydrophobicContact CE1-CB 3.69Å; Y100-L119 HydrophobicContact CE1-CD2 3.89Å; Y100-L119 HydrophobicContact CE1-CG 4.26Å; Y100-L119 HydrophobicContact CG-CD2 4.43Å; A115-L119 WeakPolarHBondContact O-CB 3.37Å; A115-L119 PolarHBondContact O-N 3.48Å; L116-L119 PolarHBondContact O-N 2.8Å; L119-H122 PolarHBondContact O-N 2.8Å; L119-K123 PolarHBondContact O-N 3.18Å; L119-H124 WeakPolarHBondContact O-CA 3.25Å; L119-H124 PolarHBondContact O-N 3.43Å; L119-I126 HydrophobicContact CD1-CG1 3.96Å; L119-S129 WeakPolarHBondContact CA-OG 3.4Å; L119-S129 PolarHBondContact N-OG 3.47Å |
| 120 | F | 93 | Very high | 90.6 | Very high | 56 Ų | 56 | 69.1 Ų | 69.1 | 25% | 0.246 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -66.1 | -43.2 | 173.4 | -179.7 | -119.9 | 0 | 0 | 0 | 111.7 | L84 W86 L87 L116 G117 M118 H122 K123 H124 | L84-F120 HydrophobicContact CD2-CE1 4.22Å; L84-F120 HydrophobicContact CD2-CZ 3.78Å; L84-F120 HydrophobicContact CG-CE1 3.97Å; L84-F120 HydrophobicContact CG-CZ 3.96Å; L84-F120 VanDerWaalsContact O-CE1 3.32Å; L84-F120 WeakPolarHBondContact O-CE1 3.4Å; W86-F120 HydrophobicContact CE3-CB 4.01Å; W86-F120 HydrophobicContact CZ3-CB 4.5Å; L87-F120 HydrophobicContact CB-CD2 4.37Å; L87-F120 HydrophobicContact CB-CE2 3.91Å; L87-F120 HydrophobicContact CD1-CE2 4.08Å; L87-F120 HydrophobicContact CD1-CZ 4.31Å; L87-F120 HydrophobicContact CG-CE2 4.01Å; L87-F120 HydrophobicContact CG-CZ 4.31Å; L116-F120 WeakPolarHBondContact O-CB 3.19Å; L116-F120 PolarHBondContact O-N 3Å; G117-F120 PolarHBondContact O-N 3.31Å; M118-F120 VanDerWaalsContact C-N 3.32Å; M118-F120 PolarHBondContact O-N 2.87Å; F120-H122 VanDerWaalsContact C-N 3.3Å; F120-H122 PolarHBondContact O-N 3.34Å; F120-K123 WeakPolarHBondContact O-CA 3.28Å; F120-K123 PolarHBondContact O-N 2.86Å; F120-H124 AromaticContact CD2-CE1 3.86Å |
| 121 | W | 90.7 | Very high | 90.9 | Very high | 208 Ų | 208 | 71.9 Ų | 71.9 | 79% | 0.788 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -56.4 | -42.8 | 174.3 | -171.1 | -86.8 | 0 | 0 | 0 | 112 | G117 M118 K123 | G117-W121 WeakPolarHBondContact O-CB 3.2Å; G117-W121 PolarHBondContact O-N 3.11Å; M118-W121 WeakPolarHBondContact O-CB 3.33Å; M118-W121 PolarHBondContact O-N 3.2Å; W121-K123 PolarHBondContact O-N 3.38Å |
| 122 | H | 92.1 | Very high | 91.1 | Very high | 32 Ų | 32 | 70.5 Ų | 70.5 | 15% | 0.148 | 34% | 0.34 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80 | 16.3 | 174.2 | -66.3 | -76.7 | 0 | 0 | 0 | 114.5 | M118 L119 F120 H124 N125 K128 D132 | M118-H122 PolarHBondContact O-CD2 3.11Å; M118-H122 PolarHBondContact O-N 2.98Å; L119-H122 PolarHBondContact O-N 2.8Å; F120-H122 VanDerWaalsContact C-N 3.3Å; F120-H122 PolarHBondContact O-N 3.34Å; H122-H124 VanDerWaalsContact C-N 3.3Å; H122-H124 PolarHBondContact O-N 3.49Å; H122-N125 VanDerWaalsContact O-CB 3.28Å; H122-N125 WeakPolarHBondContact O-CB 3.23Å; H122-N125 PolarHBondContact O-N 3.24Å; H122-N125 VanDerWaalsContact O-N 3.11Å; H122-K128 HydrophobicContact CB-CB 4.34Å; H122-D132 IonicContact CE1-OD2 3.19Å; H122-D132 PolarHBondContact CE1-OD2 2.97Å; H122-D132 IonicContact NE2-OD2 3.85Å |
| 123 | K | 91.6 | Very high | 91 | Very high | 184 Ų | 184 | 64.9 Ų | 64.9 | 80% | 0.8 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.9 | 44.2 | 178.7 | -55 | -176.7 | -178.5 | -177.1 | 0 | 112.7 | L119 F120 W121 N125 | L119-K123 PolarHBondContact O-N 3.18Å; F120-K123 WeakPolarHBondContact O-CA 3.28Å; F120-K123 PolarHBondContact O-N 2.86Å; W121-K123 PolarHBondContact O-N 3.38Å; K123-N125 PolarHBondContact O-N 2.86Å |
| 124 | H | 93.1 | Very high | 90.8 | Very high | 35 Ų | 35 | 61.1 Ų | 61.1 | 16% | 0.162 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 63.6 | 14.8 | -178.3 | -51.1 | 93.1 | 0 | 0 | 0 | 115.6 | W86 L87 S89 L119 F120 H122 I126 | W86-H124 AromaticContact CH2-CD2 3.58Å; W86-H124 AromaticContact CH2-NE2 3.79Å; W86-H124 AromaticContact CZ3-CD2 3.61Å; W86-H124 AromaticContact CZ3-NE2 3.65Å; L87-H124 PolarHBondContact O-CE1 3.3Å; L87-H124 PolarHBondContact O-NE2 3.05Å; S89-H124 VanDerWaalsContact CB-CG 3.46Å; L119-H124 WeakPolarHBondContact O-CA 3.25Å; L119-H124 PolarHBondContact O-N 3.43Å; F120-H124 AromaticContact CD2-CE1 3.86Å; H122-H124 VanDerWaalsContact C-N 3.3Å; H122-H124 PolarHBondContact O-N 3.49Å; H124-I126 PolarHBondContact O-N 3.4Å |
| 125 | N | 91.5 | Very high | 90.3 | Very high | 56 Ų | 56 | 62.8 Ų | 62.8 | 30% | 0.299 | 31% | 0.312 | S | S | . | . | trans | -80.8 | 101.8 | 172.6 | -171.9 | -68.8 | 0 | 0 | 0 | 110.6 | H122 K123 E127 K128 S129 | H122-N125 VanDerWaalsContact O-CB 3.28Å; H122-N125 WeakPolarHBondContact O-CB 3.23Å; H122-N125 PolarHBondContact O-N 3.24Å; H122-N125 VanDerWaalsContact O-N 3.11Å; K123-N125 PolarHBondContact O-N 2.86Å; N125-E127 PolarHBondContact O-N 3.46Å; N125-E127 PolarHBondContact OD1-N 3.11Å; N125-K128 HydrophobicContact CB-CB 4.37Å; N125-K128 HydrophobicContact CB-CD 4.38Å; N125-K128 WeakPolarHBondContact OD1-CB 3.3Å; N125-K128 WeakPolarHBondContact OD1-CG 3.39Å; N125-K128 PolarHBondContact OD1-N 3.03Å; N125-S129 WeakPolarHBondContact O-CB 3.14Å; N125-S129 PolarHBondContact O-N 2.85Å; N125-S129 VanDerWaalsContact O-N 3.11Å | ||
| 126 | I | 92 | Very high | 89.5 | Confident | 35 Ų | 35 | 68.4 Ų | 68.4 | 18% | 0.179 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -55 | -47.3 | 178.6 | -72.9 | 176.4 | 0 | 0 | 0 | 111.7 | L92 K96 Y100 L119 H124 K128 S129 L130 | L92-I126 HydrophobicContact CD1-CD1 3.85Å; L92-I126 HydrophobicContact CD1-CG1 4.22Å; K96-I126 HydrophobicContact CB-CD1 3.8Å; K96-I126 WeakPolarHBondContact O-CD1 3.47Å; Y100-I126 HydrophobicContact CD2-CG2 4.15Å; Y100-I126 HydrophobicContact CG-CG1 4.46Å; L119-I126 HydrophobicContact CD1-CG1 3.96Å; H124-I126 PolarHBondContact O-N 3.4Å; I126-K128 PolarHBondContact O-N 3.34Å; I126-S129 PolarHBondContact O-N 2.9Å; I126-L130 HydrophobicContact CG2-CD1 3.63Å; I126-L130 HydrophobicContact CG2-CG 3.98Å; I126-L130 WeakPolarHBondContact O-CB 3.29Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 3.06Å |
| 127 | E | 92.1 | Very high | 88.1 | Confident | 156 Ų | 156 | 70 Ų | 70 | 73% | 0.729 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -61.7 | -44.7 | -172.8 | -65.6 | 166.6 | -174.3 | 0 | 0 | 112.3 | N125 A131 | N125-E127 PolarHBondContact O-N 3.46Å; N125-E127 PolarHBondContact OD1-N 3.11Å; E127-A131 PolarHBondContact O-N 2.94Å; E127-A131 VanDerWaalsContact O-N 3.1Å |
| 128 | K | 91.3 | Very high | 86.4 | Confident | 131 Ų | 131 | 71 Ų | 71 | 57% | 0.57 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -66.3 | -44.1 | 175 | -69.1 | 180 | -178.3 | -171.1 | 0 | 111.5 | H122 N125 I126 L130 A131 D132 | H122-K128 HydrophobicContact CB-CB 4.34Å; N125-K128 HydrophobicContact CB-CB 4.37Å; N125-K128 HydrophobicContact CB-CD 4.38Å; N125-K128 WeakPolarHBondContact OD1-CB 3.3Å; N125-K128 WeakPolarHBondContact OD1-CG 3.39Å; N125-K128 PolarHBondContact OD1-N 3.03Å; I126-K128 PolarHBondContact O-N 3.34Å; K128-L130 PolarHBondContact O-N 3.39Å; K128-A131 PolarHBondContact O-N 3.42Å; K128-D132 PolarHBondContact O-N 2.83Å; K128-D132 VanDerWaalsContact O-N 3.17Å |
| 129 | S | 92.9 | Very high | 84.4 | Confident | 0 Ų | 0 | 79.1 Ų | 79.1 | 0% | 0 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -60 | -45.4 | 177.5 | -154.4 | 0 | 0 | 0 | 0 | 111.4 | Y100 M118 L119 N125 I126 A131 D132 L133 | Y100-S129 PolarHBondContact OH-OG 3Å; M118-S129 WeakPolarHBondContact CG-OG 3.4Å; L119-S129 WeakPolarHBondContact CA-OG 3.4Å; L119-S129 PolarHBondContact N-OG 3.47Å; N125-S129 WeakPolarHBondContact O-CB 3.14Å; N125-S129 PolarHBondContact O-N 2.85Å; N125-S129 VanDerWaalsContact O-N 3.11Å; I126-S129 PolarHBondContact O-N 2.9Å; S129-A131 VanDerWaalsContact C-N 3.33Å; S129-A131 PolarHBondContact O-N 3.19Å; S129-D132 PolarHBondContact O-N 2.86Å; S129-L133 WeakPolarHBondContact O-CG 3.29Å; S129-L133 PolarHBondContact O-N 3.16Å |
| 130 | L | 91.6 | Very high | 82.6 | Confident | 52 Ų | 52 | 83.4 Ų | 83.4 | 27% | 0.272 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.5 | -35.2 | 176.1 | -72.7 | 179.5 | 0 | 0 | 0 | 113.3 | Y100 I103 I126 K128 D132 L133 | Y100-L130 HydrophobicContact CD2-CD2 3.59Å; Y100-L130 HydrophobicContact CD2-CG 3.91Å; Y100-L130 HydrophobicContact CE2-CD2 3.9Å; Y100-L130 HydrophobicContact CE2-CG 4.24Å; I103-L130 HydrophobicContact CB-CD2 4.23Å; I103-L130 HydrophobicContact CG2-CD2 3.59Å; I126-L130 HydrophobicContact CG2-CD1 3.63Å; I126-L130 HydrophobicContact CG2-CG 3.98Å; I126-L130 WeakPolarHBondContact O-CB 3.29Å; I126-L130 WeakPolarHBondContact O-CG 3.35Å; I126-L130 PolarHBondContact O-N 3.06Å; K128-L130 PolarHBondContact O-N 3.39Å; L130-D132 VanDerWaalsContact C-N 3.32Å; L130-L133 HydrophobicContact CD2-CD1 3.7Å |
| 131 | A | 90.9 | Very high | 81 | Confident | 65 Ų | 65 | 85.5 Ų | 85.5 | 54% | 0.537 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -69.1 | -29.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | E127 K128 S129 P134 | E127-A131 PolarHBondContact O-N 2.94Å; E127-A131 VanDerWaalsContact O-N 3.1Å; K128-A131 PolarHBondContact O-N 3.42Å; S129-A131 VanDerWaalsContact C-N 3.33Å; S129-A131 PolarHBondContact O-N 3.19Å; A131-P134 WeakPolarHBondContact O-CD 3.48Å |
| 132 | D | 88.7 | Confident | 80.1 | Confident | 48 Ų | 48 | 83 Ų | 83 | 26% | 0.257 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -98.2 | -13 | -178.6 | -84.1 | -46.2 | 0 | 0 | 0 | 114.6 | H122 K128 S129 L130 P134 N135 F136 | H122-D132 IonicContact CE1-OD2 3.19Å; H122-D132 PolarHBondContact CE1-OD2 2.97Å; H122-D132 IonicContact NE2-OD2 3.85Å; K128-D132 PolarHBondContact O-N 2.83Å; K128-D132 VanDerWaalsContact O-N 3.17Å; S129-D132 PolarHBondContact O-N 2.86Å; L130-D132 VanDerWaalsContact C-N 3.32Å; D132-P134 VanDerWaalsContact C-CD 3.4Å; D132-P134 VanDerWaalsContact C-N 3.33Å; D132-N135 WeakPolarHBondContact O-CB 3.34Å; D132-N135 PolarHBondContact O-N 2.9Å; D132-N135 PolarHBondContact OD1-ND2 2.73Å; D132-F136 HydrophobicContact CB-CD2 4.01Å; D132-F136 HydrophobicContact CB-CE2 4.04Å; D132-F136 WeakPolarHBondContact O-CD2 3.41Å; D132-F136 PolarHBondContact O-N 3.07Å; D132-F136 VanDerWaalsContact O-N 3.1Å |
| 133 | L | 86.7 | Confident | 79.6 | Confident | 0 Ų | 0 | 83.1 Ų | 83.1 | 0% | 0 | 42% | 0.423 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -49.7 | -41.6 | 170.5 | -76.6 | 175.5 | 0 | 0 | 0 | 114.2 | Y100 A104 H108 Y110 M118 S129 L130 N135 T137 | Y100-L133 HydrophobicContact CE2-CD1 4.2Å; A104-L133 HydrophobicContact CB-CD1 3.72Å; A104-L133 HydrophobicContact CB-CD2 3.97Å; H108-L133 HydrophobicContact CB-CB 4.41Å; Y110-L133 HydrophobicContact CD1-CD2 3.87Å; Y110-L133 HydrophobicContact CD2-CD2 3.86Å; Y110-L133 HydrophobicContact CE1-CD2 3.61Å; Y110-L133 HydrophobicContact CE2-CB 4.32Å; Y110-L133 HydrophobicContact CE2-CD2 3.57Å; Y110-L133 HydrophobicContact CG-CD2 4.01Å; Y110-L133 VanDerWaalsContact CZ-CD2 3.44Å; Y110-L133 PolarHBondContact OH-O 2.86Å; M118-L133 HydrophobicContact CG-CD2 4.36Å; S129-L133 WeakPolarHBondContact O-CG 3.29Å; S129-L133 PolarHBondContact O-N 3.16Å; L130-L133 HydrophobicContact CD2-CD1 3.7Å; L133-N135 VanDerWaalsContact C-N 3.34Å; L133-T137 PolarHBondContact O-N 3.36Å; L133-T137 PolarHBondContact O-OG1 3.06Å |
| 134 | P | 82.5 | Confident | 79.2 | Confident | 68 Ų | 68 | 77.2 Ų | 77.2 | 44% | 0.442 | 40% | 0.402 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -39.4 | 173.9 | -19.2 | 31.9 | 0 | 0 | 0 | 112.6 | A131 D132 F136 T137 | A131-P134 WeakPolarHBondContact O-CD 3.48Å; D132-P134 VanDerWaalsContact C-CD 3.4Å; D132-P134 VanDerWaalsContact C-N 3.33Å; P134-F136 VanDerWaalsContact C-N 3.34Å; P134-F136 PolarHBondContact O-N 2.89Å; P134-T137 WeakPolarHBondContact CA-OG1 3.46Å; P134-T137 PolarHBondContact O-N 2.96Å; P134-T137 PolarHBondContact O-OG1 3.16Å |
| 135 | N | 78.5 | Confident | 78.6 | Confident | 113 Ų | 113 | 80.1 Ų | 80.1 | 60% | 0.604 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.4 | -29.8 | -173 | -59.7 | -27.9 | 0 | 0 | 0 | 112.5 | D132 L133 | D132-N135 WeakPolarHBondContact O-CB 3.34Å; D132-N135 PolarHBondContact O-N 2.9Å; D132-N135 PolarHBondContact OD1-ND2 2.73Å; L133-N135 VanDerWaalsContact C-N 3.34Å |
| 136 | F | 74.1 | Confident | 78.2 | Confident | 119 Ų | 119 | 83.3 Ų | 83.3 | 52% | 0.522 | 44% | 0.435 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.8 | 15.5 | 179.9 | -62.3 | -72.8 | 0 | 0 | 0 | 113.7 | Y110 M118 D132 P134 P138 | Y110-F136 WeakPolarHBondContact OH-CB 3.38Å; Y110-F136 PolarHBondContact OH-O 3.03Å; M118-F136 HydrophobicContact CE-CB 3.52Å; M118-F136 HydrophobicContact CE-CD2 4.08Å; M118-F136 HydrophobicContact CE-CG 3.96Å; M118-F136 HydrophobicContact SD-CD2 4.19Å; D132-F136 HydrophobicContact CB-CD2 4.01Å; D132-F136 HydrophobicContact CB-CE2 4.04Å; D132-F136 WeakPolarHBondContact O-CD2 3.41Å; D132-F136 PolarHBondContact O-N 3.07Å; D132-F136 VanDerWaalsContact O-N 3.1Å; P134-F136 VanDerWaalsContact C-N 3.34Å; P134-F136 PolarHBondContact O-N 2.89Å; F136-P138 WeakPolarHBondContact O-CD 3.42Å |
| 137 | T | 62.8 | Low | 78.2 | Confident | 63 Ų | 63 | 82.6 Ų | 82.6 | 39% | 0.387 | 43% | 0.432 | S | S | . | . | trans | -52.4 | 113.2 | -179.5 | -67.8 | 0 | 0 | 0 | 0 | 109.7 | Y110 L133 P134 F139 | Y110-T137 PolarHBondContact OH-N 3.01Å; L133-T137 PolarHBondContact O-N 3.36Å; L133-T137 PolarHBondContact O-OG1 3.06Å; P134-T137 WeakPolarHBondContact CA-OG1 3.46Å; P134-T137 PolarHBondContact O-N 2.96Å; P134-T137 PolarHBondContact O-OG1 3.16Å; T137-F139 PolarHBondContact O-N 2.91Å | ||
| 138 | P | 55.5 | Low | 78 | Confident | 41 Ų | 41 | 79.2 Ų | 79.2 | 27% | 0.266 | 42% | 0.415 | S | S | . | . | trans | -70.6 | 133.9 | -171.6 | 27 | -33.5 | 0 | 0 | 0 | 110.3 | F136 P140 | F136-P138 WeakPolarHBondContact O-CD 3.42Å; P138-P140 WeakPolarHBondContact O-CD 3.35Å | ||
| 139 | F | 47.4 | Very low | 78 | Confident | 200 Ų | 200 | 77.4 Ų | 77.4 | 88% | 0.877 | 41% | 0.414 | S | S | * | . | trans | -54.2 | 124.9 | 167.3 | -91.8 | -90.6 | 0 | 0 | 0 | 109.3 | T137 D141 | T137-F139 PolarHBondContact O-N 2.91Å; F139-D141 PolarHBondContact O-N 3.28Å | ||
| 140 | P | 55.8 | Low | 77.9 | Confident | 89 Ų | 89 | 80.7 Ų | 80.7 | 58% | 0.578 | 43% | 0.432 | S | S | * | . | trans | -65.7 | 107.6 | -177.1 | -24.4 | 35 | 0 | 0 | 0 | 112.9 | P138 E142 K172 | P138-P140 WeakPolarHBondContact O-CD 3.35Å; P140-E142 HydrophobicContact CB-CB 4.2Å; P140-E142 PolarHBondContact O-N 3.23Å; P140-K172 PolarHBondContact O-NZ 3.12Å | ||
| 141 | D | 59.3 | Low | 78 | Confident | 101 Ų | 101 | 78.2 Ų | 78.2 | 54% | 0.54 | 42% | 0.419 | S | S | . | . | trans | -72.1 | -0.1 | 158.7 | -162.4 | 33.9 | 0 | 0 | 0 | 110.8 | F139 S176 R179 | F139-D141 PolarHBondContact O-N 3.28Å; D141-S176 PolarHBondContact OD1-OG 3.44Å; D141-R179 IonicContact OD1-NH2 3.9Å; D141-R179 IonicContact OD2-NH2 2.65Å; D141-R179 PolarHBondContact OD2-NH2 3.25Å | ||
| 142 | E | 71.9 | Confident | 78.1 | Confident | 156 Ų | 156 | 78.6 Ų | 78.6 | 73% | 0.729 | 41% | 0.409 | S | S | * | . | S | Bend | trans | -59.8 | 140.9 | 160.9 | -62.8 | -150.8 | 145.8 | 0 | 0 | 110.7 | P140 K172 | P140-E142 HydrophobicContact CB-CB 4.2Å; P140-E142 PolarHBondContact O-N 3.23Å; E142-K172 PolarHBondContact O-NZ 3.16Å |
| 143 | W | 81.2 | Confident | 78.2 | Confident | 33 Ų | 33 | 80.4 Ų | 80.4 | 13% | 0.125 | 42% | 0.416 | C | S | . | . | trans | -88.2 | 118.6 | 170.1 | -80.1 | 66.8 | 0 | 0 | 0 | 107.8 | D147 K148 F151 L169 K172 S176 L177 F180 | W143-D147 HydrophobicContact CD2-CB 4.36Å; W143-D147 HydrophobicContact CE3-CB 3.61Å; W143-D147 HydrophobicContact CZ3-CB 4.09Å; W143-K148 HydrophobicContact CB-CG 4.27Å; W143-K148 HydrophobicContact CE3-CG 4.3Å; W143-K148 PolarHBondContact O-NZ 2.88Å; W143-F151 HydrophobicContact CH2-CB 4.19Å; W143-F151 AromaticContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CG 4.22Å; W143-F151 HydrophobicContact CZ3-CB 3.68Å; W143-F151 HydrophobicContact CZ3-CD2 4.18Å; W143-F151 HydrophobicContact CZ3-CG 4.1Å; W143-L169 HydrophobicContact CH2-CD1 4.15Å; W143-L169 HydrophobicContact CZ3-CD1 4.05Å; W143-K172 HydrophobicContact CZ2-CB 4.39Å; W143-K172 HydrophobicContact CZ2-CG 4.4Å; W143-S176 PolarHBondContact NE1-OG 3.08Å; W143-L177 HydrophobicContact CH2-CD2 3.65Å; W143-L177 HydrophobicContact CZ2-CD2 4.07Å; W143-F180 HydrophobicContact CB-CE2 4.48Å; W143-F180 HydrophobicContact CD2-CB 4.22Å; W143-F180 HydrophobicContact CD2-CD1 4.43Å; W143-F180 AromaticContact CD2-CD2 3.52Å; W143-F180 HydrophobicContact CD2-CD2 3.52Å; W143-F180 AromaticContact CD2-CE2 3.99Å; W143-F180 HydrophobicContact CD2-CE2 3.99Å; W143-F180 AromaticContact CD2-CG 3.79Å; W143-F180 HydrophobicContact CD2-CG 3.79Å; W143-F180 AromaticContact CE2-CD2 3.79Å; W143-F180 AromaticContact CE2-CG 3.71Å; W143-F180 HydrophobicContact CE3-CD1 4.04Å; W143-F180 AromaticContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CE1 4.19Å; W143-F180 AromaticContact CE3-CE2 3.96Å; W143-F180 HydrophobicContact CE3-CE2 3.96Å; W143-F180 AromaticContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CZ 4.16Å; W143-F180 AromaticContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CE2 4.22Å; W143-F180 HydrophobicContact CH2-CB 3.84Å; W143-F180 AromaticContact CH2-CD1 3.85Å; W143-F180 HydrophobicContact CH2-CD1 3.85Å; W143-F180 AromaticContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CZ2-CB 3.4Å; W143-F180 HydrophobicContact CZ2-CD1 4.26Å; W143-F180 HydrophobicContact CZ2-CD2 4.29Å; W143-F180 AromaticContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ3-CB 4.42Å; W143-F180 AromaticContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD2 4.3Å; W143-F180 HydrophobicContact CZ3-CE1 4.1Å; W143-F180 AromaticContact CZ3-CG 3.88Å; W143-F180 HydrophobicContact CZ3-CG 3.88Å | ||
| 144 | T | 83.7 | Confident | 78.5 | Confident | 60 Ų | 60 | 80.4 Ų | 80.4 | 37% | 0.368 | 42% | 0.416 | S | S | . | . | trans | -68 | -177.1 | 174.9 | 64.5 | 0 | 0 | 0 | 0 | 111 | E146 D147 K148 | T144-E146 WeakPolarHBondContact CB-OE2 3.43Å; T144-E146 PolarHBondContact OG1-OE2 3.14Å; T144-D147 PolarHBondContact N-OD2 3.1Å; T144-D147 WeakPolarHBondContact OG1-CB 3.36Å; T144-D147 PolarHBondContact OG1-N 2.77Å; T144-D147 PolarHBondContact OG1-OD2 3.05Å; T144-K148 WeakPolarHBondContact O-CD 3.32Å; T144-K148 WeakPolarHBondContact O-CE 3.43Å; T144-K148 WeakPolarHBondContact O-CG 3.4Å; T144-K148 PolarHBondContact O-NZ 3.49Å | ||
| 145 | V | 80.6 | Confident | 79 | Confident | 97 Ų | 97 | 79.2 Ų | 79.2 | 59% | 0.588 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -76.8 | -37.2 | 173 | 179.2 | 0 | 0 | 0 | 0 | 109.2 | K148 V149 | V145-K148 WeakPolarHBondContact O-CB 3.43Å; V145-K148 PolarHBondContact O-N 2.82Å; V145-V149 WeakPolarHBondContact O-CG2 3.5Å; V145-V149 PolarHBondContact O-N 2.95Å |
| 146 | E | 83.4 | Confident | 79.5 | Confident | 122 Ų | 122 | 77.1 Ų | 77.1 | 57% | 0.57 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -60.3 | -48.4 | 176.9 | -60.1 | 63.9 | -144.5 | 0 | 0 | 110.3 | T144 K148 V149 L150 | T144-E146 WeakPolarHBondContact CB-OE2 3.43Å; T144-E146 PolarHBondContact OG1-OE2 3.14Å; E146-K148 VanDerWaalsContact C-N 3.29Å; E146-K148 PolarHBondContact O-N 3.07Å; E146-V149 PolarHBondContact O-N 3.02Å; E146-L150 WeakPolarHBondContact O-CB 3.25Å; E146-L150 WeakPolarHBondContact O-CG 3.36Å; E146-L150 PolarHBondContact O-N 2.9Å |
| 147 | D | 90.8 | Very high | 80.2 | Confident | 21 Ų | 21 | 78.2 Ų | 78.2 | 11% | 0.112 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -56 | -43.4 | 175.2 | -70.8 | -35.9 | 0 | 0 | 0 | 111.8 | W143 T144 L150 F151 L169 K172 | W143-D147 HydrophobicContact CD2-CB 4.36Å; W143-D147 HydrophobicContact CE3-CB 3.61Å; W143-D147 HydrophobicContact CZ3-CB 4.09Å; T144-D147 PolarHBondContact N-OD2 3.1Å; T144-D147 WeakPolarHBondContact OG1-CB 3.36Å; T144-D147 PolarHBondContact OG1-N 2.77Å; T144-D147 PolarHBondContact OG1-OD2 3.05Å; D147-L150 PolarHBondContact O-N 2.89Å; D147-F151 WeakPolarHBondContact O-CB 3.4Å; D147-F151 PolarHBondContact O-N 3.4Å; D147-L169 HydrophobicContact CB-CD2 4.42Å; D147-K172 VanDerWaalsContact OD1-CE 3.31Å; D147-K172 WeakPolarHBondContact OD1-CE 3.38Å; D147-K172 WeakPolarHBondContact OD2-CE 3.49Å; D147-K172 IonicContact OD2-NZ 3.8Å; D147-K172 PolarHBondContact OD2-NZ 2.68Å |
| 148 | K | 89.4 | Confident | 81.5 | Confident | 85 Ų | 85 | 78 Ų | 78 | 37% | 0.37 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.9 | -40.3 | -177.6 | -64.9 | 172.3 | -171.7 | 104.1 | 0 | 111 | W143 T144 V145 E146 E152 F180 | W143-K148 HydrophobicContact CB-CG 4.27Å; W143-K148 HydrophobicContact CE3-CG 4.3Å; W143-K148 PolarHBondContact O-NZ 2.88Å; T144-K148 WeakPolarHBondContact O-CD 3.32Å; T144-K148 WeakPolarHBondContact O-CE 3.43Å; T144-K148 WeakPolarHBondContact O-CG 3.4Å; T144-K148 PolarHBondContact O-NZ 3.49Å; V145-K148 WeakPolarHBondContact O-CB 3.43Å; V145-K148 PolarHBondContact O-N 2.82Å; E146-K148 VanDerWaalsContact C-N 3.29Å; E146-K148 PolarHBondContact O-N 3.07Å; K148-E152 WeakPolarHBondContact O-CB 3.47Å; K148-E152 PolarHBondContact O-N 2.65Å; K148-F180 HydrophobicContact CB-CZ 4.26Å; K148-F180 HydrophobicContact CG-CE2 4.02Å; K148-F180 HydrophobicContact CG-CZ 3.75Å |
| 149 | V | 90.6 | Very high | 83.2 | Confident | 92 Ų | 92 | 77.3 Ų | 77.3 | 56% | 0.558 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -67.8 | -44.7 | 175.4 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | V145 E146 F151 E152 Q153 | V145-V149 WeakPolarHBondContact O-CG2 3.5Å; V145-V149 PolarHBondContact O-N 2.95Å; E146-V149 PolarHBondContact O-N 3.02Å; V149-F151 PolarHBondContact O-N 3.29Å; V149-E152 PolarHBondContact O-N 3.42Å; V149-Q153 WeakPolarHBondContact O-CB 3.17Å; V149-Q153 PolarHBondContact O-N 3Å |
| 150 | L | 91.6 | Very high | 85.3 | Confident | 69 Ų | 69 | 74.4 Ų | 74.4 | 36% | 0.361 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.3 | -40 | 176.2 | -76.3 | 169.6 | 0 | 0 | 0 | 112.2 | E146 D147 G154 M168 L169 | E146-L150 WeakPolarHBondContact O-CB 3.25Å; E146-L150 WeakPolarHBondContact O-CG 3.36Å; E146-L150 PolarHBondContact O-N 2.9Å; D147-L150 PolarHBondContact O-N 2.89Å; L150-G154 PolarHBondContact O-N 2.93Å; L150-M168 HydrophobicContact CD2-CE 4.16Å; L150-L169 HydrophobicContact CB-CD1 4.37Å; L150-L169 HydrophobicContact CB-CD2 3.77Å; L150-L169 HydrophobicContact CB-CG 4.06Å; L150-L169 HydrophobicContact CD1-CD2 3.8Å; L150-L169 HydrophobicContact CG-CD2 4.45Å |
| 151 | F | 93.3 | Very high | 87 | Confident | 0 Ų | 0 | 73.9 Ų | 73.9 | 0% | 0 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.6 | -43.8 | 173.1 | 177.2 | -83.4 | 0 | 0 | 0 | 112.2 | W143 D147 V149 Q153 G154 F155 F162 I165 L169 L177 F180 Y181 W184 | W143-F151 HydrophobicContact CH2-CB 4.19Å; W143-F151 AromaticContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CD2 3.84Å; W143-F151 HydrophobicContact CH2-CG 4.22Å; W143-F151 HydrophobicContact CZ3-CB 3.68Å; W143-F151 HydrophobicContact CZ3-CD2 4.18Å; W143-F151 HydrophobicContact CZ3-CG 4.1Å; D147-F151 WeakPolarHBondContact O-CB 3.4Å; D147-F151 PolarHBondContact O-N 3.4Å; V149-F151 PolarHBondContact O-N 3.29Å; F151-Q153 VanDerWaalsContact C-N 3.33Å; F151-Q153 PolarHBondContact O-N 3.4Å; F151-G154 PolarHBondContact O-N 2.82Å; F151-F155 HydrophobicContact CE1-CB 4.33Å; F151-F155 HydrophobicContact CZ-CD2 4.33Å; F151-F155 WeakPolarHBondContact O-CB 3.29Å; F151-F155 PolarHBondContact O-N 3.43Å; F151-F162 HydrophobicContact CE2-CE1 4.18Å; F151-F162 HydrophobicContact CZ-CE1 4.34Å; F151-I165 HydrophobicContact CD2-CG2 3.94Å; F151-I165 HydrophobicContact CE2-CD1 4.3Å; F151-I165 HydrophobicContact CE2-CG2 4.48Å; F151-L169 HydrophobicContact CB-CD1 3.86Å; F151-L177 HydrophobicContact CD2-CD2 4.24Å; F151-L177 HydrophobicContact CE2-CB 4.42Å; F151-F180 HydrophobicContact CB-CD1 4.48Å; F151-F180 HydrophobicContact CB-CE1 4.34Å; F151-F180 AromaticContact CD1-CD1 3.61Å; F151-F180 HydrophobicContact CD1-CD1 3.61Å; F151-F180 AromaticContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD2-CD1 4.03Å; F151-F180 AromaticContact CE1-CD1 3.75Å; F151-F180 HydrophobicContact CE1-CD1 3.75Å; F151-F180 AromaticContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE2-CD1 4.15Å; F151-F180 AromaticContact CG-CD1 3.77Å; F151-F180 HydrophobicContact CG-CD1 3.77Å; F151-F180 AromaticContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CZ-CD1 4.03Å; F151-Y181 HydrophobicContact CZ-CD2 4.31Å; F151-W184 HydrophobicContact CE1-CD2 4.1Å; F151-W184 AromaticContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CH2 4.44Å; F151-W184 HydrophobicContact CE1-CZ3 4.14Å |
| 152 | E | 92.4 | Very high | 88.7 | Confident | 73 Ų | 73 | 70.5 Ų | 70.5 | 34% | 0.341 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.3 | -40.5 | 177.9 | -177.5 | 148.8 | 146.9 | 0 | 0 | 111.3 | K148 V149 S156 W184 R188 | K148-E152 WeakPolarHBondContact O-CB 3.47Å; K148-E152 PolarHBondContact O-N 2.65Å; V149-E152 PolarHBondContact O-N 3.42Å; E152-S156 WeakPolarHBondContact O-CB 3.17Å; E152-S156 PolarHBondContact O-N 3.37Å; E152-W184 HydrophobicContact CB-CZ2 4.26Å; E152-W184 HydrophobicContact CG-CZ2 3.97Å; E152-W184 VanDerWaalsContact OE2-CZ2 3.32Å; E152-W184 WeakPolarHBondContact OE2-CZ2 3.22Å; E152-W184 PolarHBondContact OE2-NE1 3Å; E152-R188 IonicContact OE1-CZ 3.31Å; E152-R188 IonicContact OE1-NE 3.07Å; E152-R188 PolarHBondContact OE1-NE 3.24Å; E152-R188 IonicContact OE1-NH2 2.73Å; E152-R188 PolarHBondContact OE1-NH2 2.91Å; E152-R188 IonicContact OE2-CZ 2.74Å; E152-R188 IonicContact OE2-NE 2.73Å; E152-R188 PolarHBondContact OE2-NE 3.23Å; E152-R188 VanDerWaalsContact OE2-NE 3.09Å; E152-R188 IonicContact OE2-NH2 3.68Å |
| 153 | Q | 91.1 | Very high | 89.8 | Confident | 87 Ų | 87 | 69.1 Ų | 69.1 | 41% | 0.407 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -67.2 | -49.3 | 175.1 | -167.7 | 63.4 | 71.2 | 0 | 0 | 111.9 | V149 F151 F155 S156 F157 M168 | V149-Q153 WeakPolarHBondContact O-CB 3.17Å; V149-Q153 PolarHBondContact O-N 3Å; F151-Q153 VanDerWaalsContact C-N 3.33Å; F151-Q153 PolarHBondContact O-N 3.4Å; Q153-F155 PolarHBondContact O-N 3.42Å; Q153-S156 PolarHBondContact NE2-OG 3.25Å; Q153-S156 VanDerWaalsContact NE2-OG 3.11Å; Q153-S156 PolarHBondContact O-N 3.18Å; Q153-S156 VanDerWaalsContact O-N 3.12Å; Q153-S156 PolarHBondContact O-OG 3.4Å; Q153-F157 HydrophobicContact CG-CD2 4.14Å; Q153-F157 HydrophobicContact CG-CE2 3.81Å; Q153-F157 WeakPolarHBondContact O-CD2 3.49Å; Q153-F157 PolarHBondContact O-N 3.49Å; Q153-F157 VanDerWaalsContact O-N 3.15Å; Q153-M168 HydrophobicContact CB-CE 4.44Å; Q153-M168 HydrophobicContact CG-CE 4.4Å |
| 154 | G | 92.1 | Very high | 90.4 | Very high | 0 Ų | 0 | 73.3 Ų | 73.3 | 0% | 0 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -62.3 | -39.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L150 F151 S156 F157 H158 | L150-G154 PolarHBondContact O-N 2.93Å; F151-G154 PolarHBondContact O-N 2.82Å; G154-S156 VanDerWaalsContact C-N 3.34Å; G154-F157 PolarHBondContact O-N 3.17Å; G154-H158 VanDerWaalsContact O-CB 3.29Å; G154-H158 WeakPolarHBondContact O-CB 3.48Å; G154-H158 PolarHBondContact O-N 3.23Å |
| 155 | F | 93 | Very high | 90.8 | Very high | 42 Ų | 42 | 70.4 Ų | 70.4 | 18% | 0.184 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -67.1 | -33.6 | 173.5 | -170.3 | -86.1 | 0 | 0 | 0 | 112 | F151 Q153 G159 K160 I165 Y181 W184 | F151-F155 HydrophobicContact CE1-CB 4.33Å; F151-F155 HydrophobicContact CZ-CD2 4.33Å; F151-F155 WeakPolarHBondContact O-CB 3.29Å; F151-F155 PolarHBondContact O-N 3.43Å; Q153-F155 PolarHBondContact O-N 3.42Å; F155-G159 WeakPolarHBondContact CD2-O 3.33Å; F155-G159 WeakPolarHBondContact CE2-O 3.45Å; F155-G159 WeakPolarHBondContact O-CA 3.45Å; F155-G159 PolarHBondContact O-N 3.13Å; F155-K160 HydrophobicContact CE2-CG 4.06Å; F155-K160 HydrophobicContact CZ-CG 4.33Å; F155-I165 HydrophobicContact CB-CD1 4.1Å; F155-I165 HydrophobicContact CD2-CD1 4.05Å; F155-Y181 HydrophobicContact CD2-CD2 4.23Å; F155-Y181 HydrophobicContact CD2-CE2 4.35Å; F155-Y181 AromaticContact CE2-CD2 3.67Å; F155-Y181 HydrophobicContact CE2-CD2 3.67Å; F155-Y181 AromaticContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CE2-CE2 3.41Å; F155-Y181 VanDerWaalsContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CZ-CD2 4.23Å; F155-Y181 AromaticContact CZ-CE2 3.55Å; F155-Y181 HydrophobicContact CZ-CE2 3.55Å; F155-W184 AromaticContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CZ3 4.08Å; F155-W184 HydrophobicContact CE1-CH2 4.22Å; F155-W184 HydrophobicContact CE1-CZ3 4.23Å; F155-W184 HydrophobicContact CG-CH2 4.14Å; F155-W184 HydrophobicContact CG-CZ3 4.33Å |
| 156 | S | 89 | Confident | 91.5 | Very high | 69 Ų | 69 | 68.4 Ų | 68.4 | 48% | 0.483 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -67 | -37.9 | 176.1 | 79.1 | 0 | 0 | 0 | 0 | 113.1 | E152 Q153 G154 | E152-S156 WeakPolarHBondContact O-CB 3.17Å; E152-S156 PolarHBondContact O-N 3.37Å; Q153-S156 PolarHBondContact NE2-OG 3.25Å; Q153-S156 VanDerWaalsContact NE2-OG 3.11Å; Q153-S156 PolarHBondContact O-N 3.18Å; Q153-S156 VanDerWaalsContact O-N 3.12Å; Q153-S156 PolarHBondContact O-OG 3.4Å; G154-S156 VanDerWaalsContact C-N 3.34Å |
| 157 | F | 88.7 | Confident | 91.9 | Very high | 143 Ų | 143 | 68.9 Ų | 68.9 | 63% | 0.627 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -85.3 | -31.1 | 178.4 | -69.5 | -52 | 0 | 0 | 0 | 114.1 | Q153 G154 | Q153-F157 HydrophobicContact CG-CD2 4.14Å; Q153-F157 HydrophobicContact CG-CE2 3.81Å; Q153-F157 WeakPolarHBondContact O-CD2 3.49Å; Q153-F157 PolarHBondContact O-N 3.49Å; Q153-F157 VanDerWaalsContact O-N 3.15Å; G154-F157 PolarHBondContact O-N 3.17Å |
| 158 | H | 91.8 | Very high | 91.8 | Very high | 57 Ų | 57 | 70.8 Ų | 70.8 | 26% | 0.264 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -124.1 | 0.3 | -167 | -54.7 | -44.9 | 0 | 0 | 0 | 114 | G154 K160 T161 R164 | G154-H158 VanDerWaalsContact O-CB 3.29Å; G154-H158 WeakPolarHBondContact O-CB 3.48Å; G154-H158 PolarHBondContact O-N 3.23Å; H158-K160 PolarHBondContact O-N 3.33Å; H158-T161 WeakPolarHBondContact O-CB 3.37Å; H158-T161 PolarHBondContact O-N 2.89Å; H158-T161 VanDerWaalsContact O-N 3.15Å; H158-T161 PolarHBondContact O-OG1 3.49Å; H158-R164 HydrophobicContact CB-CB 4.29Å; H158-R164 HydrophobicContact CB-CG 3.9Å; H158-R164 WeakPolarHBondContact CD2-CG 3.33Å; H158-R164 VanDerWaalsContact CG-CG 3.43Å; H158-R164 PolarHBondContact NE2-NE 3.37Å |
| 159 | G | 89.4 | Confident | 91.8 | Very high | 27 Ų | 27 | 67 Ų | 67 | 28% | 0.278 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.4 | -133.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | F155 T161 I165 | F155-G159 WeakPolarHBondContact CD2-O 3.33Å; F155-G159 WeakPolarHBondContact CE2-O 3.45Å; F155-G159 WeakPolarHBondContact O-CA 3.45Å; F155-G159 PolarHBondContact O-N 3.13Å; G159-T161 PolarHBondContact O-N 3.18Å; G159-I165 WeakPolarHBondContact O-CD1 3.32Å |
| 160 | K | 91.8 | Very high | 91.6 | Very high | 140 Ų | 140 | 66.8 Ų | 66.8 | 61% | 0.609 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.1 | 15.3 | 179.1 | -63.2 | 179.7 | -178.5 | 174.2 | 0 | 114.1 | F155 H158 F162 Y181 | F155-K160 HydrophobicContact CE2-CG 4.06Å; F155-K160 HydrophobicContact CZ-CG 4.33Å; H158-K160 PolarHBondContact O-N 3.33Å; K160-F162 HydrophobicContact CB-CE2 4.27Å; K160-F162 WeakPolarHBondContact O-CD2 3.18Å; K160-F162 PolarHBondContact O-N 3.46Å; K160-Y181 WeakPolarHBondContact CE-OH 3.23Å |
| 161 | T | 92.8 | Very high | 91.3 | Very high | 77 Ų | 77 | 70.3 Ų | 70.3 | 47% | 0.472 | 35% | 0.351 | S | S | . | . | trans | -81.2 | 70.5 | -178.1 | -44.3 | 0 | 0 | 0 | 0 | 109.6 | H158 G159 H163 R164 I165 | H158-T161 WeakPolarHBondContact O-CB 3.37Å; H158-T161 PolarHBondContact O-N 2.89Å; H158-T161 VanDerWaalsContact O-N 3.15Å; H158-T161 PolarHBondContact O-OG1 3.49Å; G159-T161 PolarHBondContact O-N 3.18Å; T161-H163 VanDerWaalsContact C-N 3.26Å; T161-H163 PolarHBondContact O-N 3.19Å; T161-H163 VanDerWaalsContact O-N 3.17Å; T161-R164 HydrophobicContact CG2-CB 3.79Å; T161-R164 WeakPolarHBondContact O-CA 3.43Å; T161-R164 WeakPolarHBondContact O-CB 3.4Å; T161-R164 PolarHBondContact O-N 3.34Å; T161-I165 PolarHBondContact O-N 2.87Å; T161-I165 VanDerWaalsContact O-N 3.1Å | ||
| 162 | F | 94.7 | Very high | 91 | Very high | 30 Ų | 30 | 71.2 Ų | 71.2 | 13% | 0.132 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -56.6 | -35.4 | -170.6 | -67.4 | -72.3 | 0 | 0 | 0 | 113.8 | F151 K160 R164 I165 Q166 I174 L177 V178 Y181 | F151-F162 HydrophobicContact CE2-CE1 4.18Å; F151-F162 HydrophobicContact CZ-CE1 4.34Å; K160-F162 HydrophobicContact CB-CE2 4.27Å; K160-F162 WeakPolarHBondContact O-CD2 3.18Å; K160-F162 PolarHBondContact O-N 3.46Å; F162-R164 PolarHBondContact O-N 2.82Å; F162-I165 HydrophobicContact CD1-CD1 4.1Å; F162-I165 HydrophobicContact CE1-CD1 4.44Å; F162-I165 PolarHBondContact O-N 3.3Å; F162-Q166 WeakPolarHBondContact O-CB 3.21Å; F162-Q166 PolarHBondContact O-N 3.42Å; F162-I174 HydrophobicContact CB-CG2 4.19Å; F162-L177 HydrophobicContact CD1-CB 3.93Å; F162-V178 HydrophobicContact CD1-CG2 4.19Å; F162-V178 HydrophobicContact CD2-CG2 3.75Å; F162-V178 HydrophobicContact CE1-CG2 4.25Å; F162-V178 HydrophobicContact CE2-CG2 3.82Å; F162-V178 HydrophobicContact CG-CG2 3.94Å; F162-V178 HydrophobicContact CZ-CG2 4.07Å; F162-Y181 HydrophobicContact CE1-CG 4.26Å; F162-Y181 HydrophobicContact CZ-CD1 4.11Å; F162-Y181 HydrophobicContact CZ-CD2 4.32Å; F162-Y181 AromaticContact CZ-CG 3.81Å; F162-Y181 HydrophobicContact CZ-CG 3.81Å |
| 163 | H | 94.5 | Very high | 91 | Very high | 128 Ų | 128 | 70.5 Ų | 70.5 | 59% | 0.593 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -57.9 | -32.3 | 172.1 | -57.7 | 104.5 | 0 | 0 | 0 | 113.5 | T161 I174 | T161-H163 VanDerWaalsContact C-N 3.26Å; T161-H163 PolarHBondContact O-N 3.19Å; T161-H163 VanDerWaalsContact O-N 3.17Å; H163-I174 VanDerWaalsContact CD2-CD1 3.45Å; H163-I174 WeakPolarHBondContact CD2-CD1 3.21Å |
| 164 | R | 93.5 | Very high | 91 | Very high | 120 Ų | 120 | 69.3 Ų | 69.3 | 45% | 0.453 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -84.9 | -30.7 | 177.1 | -178.7 | 58.4 | 175.3 | -157.4 | -6.1 | 112.1 | H158 T161 F162 Q166 Q167 | H158-R164 HydrophobicContact CB-CB 4.29Å; H158-R164 HydrophobicContact CB-CG 3.9Å; H158-R164 WeakPolarHBondContact CD2-CG 3.33Å; H158-R164 VanDerWaalsContact CG-CG 3.43Å; H158-R164 PolarHBondContact NE2-NE 3.37Å; T161-R164 HydrophobicContact CG2-CB 3.79Å; T161-R164 WeakPolarHBondContact O-CA 3.43Å; T161-R164 WeakPolarHBondContact O-CB 3.4Å; T161-R164 PolarHBondContact O-N 3.34Å; F162-R164 PolarHBondContact O-N 2.82Å; R164-Q166 VanDerWaalsContact C-N 3.31Å; R164-Q167 PolarHBondContact O-N 3.33Å |
| 165 | I | 93.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 72 Ų | 72 | 0% | 0 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.3 | -39.4 | 168.1 | -58.3 | 177.4 | 0 | 0 | 0 | 110.2 | F151 F155 G159 T161 F162 Q167 M168 L169 L177 | F151-I165 HydrophobicContact CD2-CG2 3.94Å; F151-I165 HydrophobicContact CE2-CD1 4.3Å; F151-I165 HydrophobicContact CE2-CG2 4.48Å; F155-I165 HydrophobicContact CB-CD1 4.1Å; F155-I165 HydrophobicContact CD2-CD1 4.05Å; G159-I165 WeakPolarHBondContact O-CD1 3.32Å; T161-I165 PolarHBondContact O-N 2.87Å; T161-I165 VanDerWaalsContact O-N 3.1Å; F162-I165 HydrophobicContact CD1-CD1 4.1Å; F162-I165 HydrophobicContact CE1-CD1 4.44Å; F162-I165 PolarHBondContact O-N 3.3Å; I165-Q167 PolarHBondContact O-N 2.94Å; I165-M168 WeakPolarHBondContact O-CA 3.41Å; I165-M168 WeakPolarHBondContact O-CB 3.46Å; I165-M168 PolarHBondContact O-N 3.19Å; I165-L169 HydrophobicContact CG2-CD1 4.38Å; I165-L169 PolarHBondContact O-N 2.96Å; I165-L177 HydrophobicContact CB-CD1 4.36Å; I165-L177 HydrophobicContact CG2-CD1 4.34Å; I165-L177 HydrophobicContact CG2-CD2 4.45Å |
| 166 | Q | 94.4 | Very high | 90.8 | Very high | 55 Ų | 55 | 70.1 Ų | 70.1 | 26% | 0.257 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.2 | -26.1 | 177 | -163.4 | -178.1 | 2.5 | 0 | 0 | 112.8 | F162 R164 M168 L169 P170 L177 | F162-Q166 WeakPolarHBondContact O-CB 3.21Å; F162-Q166 PolarHBondContact O-N 3.42Å; R164-Q166 VanDerWaalsContact C-N 3.31Å; Q166-M168 PolarHBondContact O-N 3.25Å; Q166-L169 CarbonylContact O-C 3.03Å; Q166-L169 PolarHBondContact O-N 3.16Å; Q166-P170 WeakPolarHBondContact O-CA 3.27Å; Q166-P170 VanDerWaalsContact O-N 3.07Å; Q166-L177 HydrophobicContact CB-CD1 3.8Å; Q166-L177 HydrophobicContact CG-CD1 4.34Å |
| 167 | Q | 93.1 | Very high | 91 | Very high | 131 Ų | 131 | 66.9 Ų | 66.9 | 61% | 0.612 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.7 | -14.8 | 173 | -66.7 | 173.8 | -0.9 | 0 | 0 | 113.1 | R164 I165 | R164-Q167 PolarHBondContact O-N 3.33Å; I165-Q167 PolarHBondContact O-N 2.94Å |
| 168 | M | 87 | Confident | 91.2 | Very high | 61 Ų | 61 | 62.3 Ų | 62.3 | 30% | 0.3 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.4 | -8.8 | 170.3 | -59.1 | 176.5 | 61.6 | 0 | 0 | 113 | L150 Q153 I165 Q166 | L150-M168 HydrophobicContact CD2-CE 4.16Å; Q153-M168 HydrophobicContact CB-CE 4.44Å; Q153-M168 HydrophobicContact CG-CE 4.4Å; I165-M168 WeakPolarHBondContact O-CA 3.41Å; I165-M168 WeakPolarHBondContact O-CB 3.46Å; I165-M168 PolarHBondContact O-N 3.19Å; Q166-M168 PolarHBondContact O-N 3.25Å |
| 169 | L | 90.1 | Very high | 91 | Very high | 5 Ų | 5 | 66.2 Ų | 66.2 | 3% | 0.026 | 34% | 0.342 | C | S | . | . | trans | -143.4 | 66.1 | -176.8 | -72.9 | 176 | 0 | 0 | 0 | 109.3 | W143 D147 L150 F151 I165 Q166 D171 K172 L177 | W143-L169 HydrophobicContact CH2-CD1 4.15Å; W143-L169 HydrophobicContact CZ3-CD1 4.05Å; D147-L169 HydrophobicContact CB-CD2 4.42Å; L150-L169 HydrophobicContact CB-CD1 4.37Å; L150-L169 HydrophobicContact CB-CD2 3.77Å; L150-L169 HydrophobicContact CB-CG 4.06Å; L150-L169 HydrophobicContact CD1-CD2 3.8Å; L150-L169 HydrophobicContact CG-CD2 4.45Å; F151-L169 HydrophobicContact CB-CD1 3.86Å; I165-L169 HydrophobicContact CG2-CD1 4.38Å; I165-L169 PolarHBondContact O-N 2.96Å; Q166-L169 CarbonylContact O-C 3.03Å; Q166-L169 PolarHBondContact O-N 3.16Å; L169-D171 VanDerWaalsContact C-N 3.26Å; L169-D171 PolarHBondContact O-N 3.39Å; L169-K172 HydrophobicContact CB-CB 4.23Å; L169-K172 HydrophobicContact CB-CG 4.29Å; L169-K172 PolarHBondContact O-N 3.27Å; L169-K172 VanDerWaalsContact O-N 3.17Å; L169-L177 HydrophobicContact CB-CD2 4.36Å; L169-L177 HydrophobicContact CD1-CD2 4Å | ||
| 170 | P | 86.3 | Confident | 91.1 | Very high | 88 Ų | 88 | 66.1 Ų | 66.1 | 57% | 0.571 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -38.3 | -171.2 | 23.5 | -33.3 | 0 | 0 | 0 | 112.1 | Q166 K172 | Q166-P170 WeakPolarHBondContact O-CA 3.27Å; Q166-P170 VanDerWaalsContact O-N 3.07Å; P170-K172 VanDerWaalsContact C-N 3.27Å; P170-K172 PolarHBondContact O-N 3.27Å |
| 171 | D | 84.4 | Confident | 91.1 | Very high | 143 Ų | 143 | 60 Ų | 60 | 77% | 0.765 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -14.5 | -176.6 | -45.8 | -60.6 | 0 | 0 | 0 | 113.3 | L169 | L169-D171 VanDerWaalsContact C-N 3.26Å; L169-D171 PolarHBondContact O-N 3.39Å |
| 172 | K | 87.6 | Confident | 90.8 | Very high | 20 Ų | 20 | 63.7 Ų | 63.7 | 9% | 0.087 | 31% | 0.313 | C | S | . | . | S | Bend | trans | -98 | 101.9 | 177.5 | -54.5 | -54.3 | -176.4 | -176.6 | 0 | 109.8 | P140 E142 W143 D147 L169 P170 L177 | P140-K172 PolarHBondContact O-NZ 3.12Å; E142-K172 PolarHBondContact O-NZ 3.16Å; W143-K172 HydrophobicContact CZ2-CB 4.39Å; W143-K172 HydrophobicContact CZ2-CG 4.4Å; D147-K172 VanDerWaalsContact OD1-CE 3.31Å; D147-K172 WeakPolarHBondContact OD1-CE 3.38Å; D147-K172 WeakPolarHBondContact OD2-CE 3.49Å; D147-K172 IonicContact OD2-NZ 3.8Å; D147-K172 PolarHBondContact OD2-NZ 2.68Å; L169-K172 HydrophobicContact CB-CB 4.23Å; L169-K172 HydrophobicContact CB-CG 4.29Å; L169-K172 PolarHBondContact O-N 3.27Å; L169-K172 VanDerWaalsContact O-N 3.17Å; P170-K172 VanDerWaalsContact C-N 3.27Å; P170-K172 PolarHBondContact O-N 3.27Å; K172-L177 HydrophobicContact CB-CD2 3.67Å; K172-L177 HydrophobicContact CB-CG 4.4Å; K172-L177 WeakPolarHBondContact O-CG 3.39Å |
| 173 | S | 92 | Very high | 90.1 | Very high | 57 Ų | 57 | 65.3 Ų | 65.3 | 40% | 0.399 | 33% | 0.328 | S | S | . | . | trans | -51.6 | 149.8 | 176.4 | 67.5 | 0 | 0 | 0 | 0 | 112.9 | A175 S176 L177 | S173-A175 PolarHBondContact O-N 3.4Å; S173-S176 WeakPolarHBondContact O-CA 3.46Å; S173-S176 WeakPolarHBondContact O-CB 3.41Å; S173-S176 PolarHBondContact O-N 2.93Å; S173-S176 PolarHBondContact OG-N 3.04Å; S173-L177 PolarHBondContact O-N 3.39Å | ||
| 174 | I | 91.6 | Very high | 89.7 | Confident | 62 Ų | 62 | 60.7 Ų | 60.7 | 32% | 0.318 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -50.1 | -37.5 | 178.1 | -56 | 165.9 | 0 | 0 | 0 | 111.6 | F162 H163 L177 V178 | F162-I174 HydrophobicContact CB-CG2 4.19Å; H163-I174 VanDerWaalsContact CD2-CD1 3.45Å; H163-I174 WeakPolarHBondContact CD2-CD1 3.21Å; I174-L177 PolarHBondContact O-N 2.6Å; I174-V178 HydrophobicContact CG2-CG2 4.4Å; I174-V178 WeakPolarHBondContact O-CB 3.47Å; I174-V178 VanDerWaalsContact O-CG2 3.3Å; I174-V178 WeakPolarHBondContact O-CG2 3.35Å; I174-V178 PolarHBondContact O-N 2.9Å |
| 175 | A | 90.8 | Very high | 89.1 | Confident | 56 Ų | 56 | 60.2 Ų | 60.2 | 46% | 0.463 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.8 | -43.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S173 V178 R179 | S173-A175 PolarHBondContact O-N 3.4Å; A175-V178 PolarHBondContact O-N 3.47Å; A175-R179 VanDerWaalsContact O-CG 3.31Å; A175-R179 WeakPolarHBondContact O-CG 3.48Å; A175-R179 PolarHBondContact O-N 2.56Å |
| 176 | S | 90.5 | Very high | 87.9 | Confident | 4 Ų | 4 | 68.6 Ų | 68.6 | 3% | 0.028 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -66.3 | -42.6 | 175 | -157.4 | 0 | 0 | 0 | 0 | 111.5 | D141 W143 S173 V178 R179 F180 | D141-S176 PolarHBondContact OD1-OG 3.44Å; W143-S176 PolarHBondContact NE1-OG 3.08Å; S173-S176 WeakPolarHBondContact O-CA 3.46Å; S173-S176 WeakPolarHBondContact O-CB 3.41Å; S173-S176 PolarHBondContact O-N 2.93Å; S173-S176 PolarHBondContact OG-N 3.04Å; S176-V178 VanDerWaalsContact C-N 3.32Å; S176-V178 PolarHBondContact O-N 2.87Å; S176-R179 PolarHBondContact O-N 3.36Å; S176-F180 WeakPolarHBondContact O-CB 3.44Å; S176-F180 PolarHBondContact O-N 3.05Å |
| 177 | L | 92.8 | Very high | 86.3 | Confident | 0 Ų | 0 | 70.8 Ų | 70.8 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -57.3 | -41.9 | 174.2 | -57.8 | -177.6 | 0 | 0 | 0 | 112.4 | W143 F151 F162 I165 Q166 L169 K172 S173 I174 Y181 | W143-L177 HydrophobicContact CH2-CD2 3.65Å; W143-L177 HydrophobicContact CZ2-CD2 4.07Å; F151-L177 HydrophobicContact CD2-CD2 4.24Å; F151-L177 HydrophobicContact CE2-CB 4.42Å; F162-L177 HydrophobicContact CD1-CB 3.93Å; I165-L177 HydrophobicContact CB-CD1 4.36Å; I165-L177 HydrophobicContact CG2-CD1 4.34Å; I165-L177 HydrophobicContact CG2-CD2 4.45Å; Q166-L177 HydrophobicContact CB-CD1 3.8Å; Q166-L177 HydrophobicContact CG-CD1 4.34Å; L169-L177 HydrophobicContact CB-CD2 4.36Å; L169-L177 HydrophobicContact CD1-CD2 4Å; K172-L177 HydrophobicContact CB-CD2 3.67Å; K172-L177 HydrophobicContact CB-CG 4.4Å; K172-L177 WeakPolarHBondContact O-CG 3.39Å; S173-L177 PolarHBondContact O-N 3.39Å; I174-L177 PolarHBondContact O-N 2.6Å; L177-Y181 WeakPolarHBondContact O-CB 3.5Å; L177-Y181 PolarHBondContact O-N 2.88Å |
| 178 | V | 93.1 | Very high | 84.7 | Confident | 47 Ų | 47 | 67.7 Ų | 67.7 | 29% | 0.285 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -73 | -38.8 | 178.2 | 171.2 | 0 | 0 | 0 | 0 | 111.9 | F162 I174 A175 S176 Y181 Y182 | F162-V178 HydrophobicContact CD1-CG2 4.19Å; F162-V178 HydrophobicContact CD2-CG2 3.75Å; F162-V178 HydrophobicContact CE1-CG2 4.25Å; F162-V178 HydrophobicContact CE2-CG2 3.82Å; F162-V178 HydrophobicContact CG-CG2 3.94Å; F162-V178 HydrophobicContact CZ-CG2 4.07Å; I174-V178 HydrophobicContact CG2-CG2 4.4Å; I174-V178 WeakPolarHBondContact O-CB 3.47Å; I174-V178 VanDerWaalsContact O-CG2 3.3Å; I174-V178 WeakPolarHBondContact O-CG2 3.35Å; I174-V178 PolarHBondContact O-N 2.9Å; A175-V178 PolarHBondContact O-N 3.47Å; S176-V178 VanDerWaalsContact C-N 3.32Å; S176-V178 PolarHBondContact O-N 2.87Å; V178-Y181 PolarHBondContact O-N 3.49Å; V178-Y182 HydrophobicContact CG1-CD2 4.11Å; V178-Y182 HydrophobicContact CG1-CE2 3.92Å; V178-Y182 VanDerWaalsContact O-CD2 3.27Å; V178-Y182 WeakPolarHBondContact O-CD2 3.48Å; V178-Y182 PolarHBondContact O-N 2.78Å |
| 179 | R | 88.1 | Confident | 83.1 | Confident | 140 Ų | 140 | 69.7 Ų | 69.7 | 53% | 0.528 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -58.4 | -49 | 171.5 | -74 | -172.5 | -56.6 | -112.1 | 16.5 | 110.6 | D141 A175 S176 Y182 S183 | D141-R179 IonicContact OD1-NH2 3.9Å; D141-R179 IonicContact OD2-NH2 2.65Å; D141-R179 PolarHBondContact OD2-NH2 3.25Å; A175-R179 VanDerWaalsContact O-CG 3.31Å; A175-R179 WeakPolarHBondContact O-CG 3.48Å; A175-R179 PolarHBondContact O-N 2.56Å; S176-R179 PolarHBondContact O-N 3.36Å; R179-Y182 PolarHBondContact O-N 2.87Å; R179-S183 PolarHBondContact O-N 3.15Å |
| 180 | F | 90.1 | Very high | 81 | Confident | 24 Ų | 24 | 78.8 Ų | 78.8 | 11% | 0.105 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.5 | -41.1 | 179.5 | -173.8 | -97.4 | 0 | 0 | 0 | 112.4 | W143 K148 F151 S176 Y182 S183 W184 | W143-F180 HydrophobicContact CB-CE2 4.48Å; W143-F180 HydrophobicContact CD2-CB 4.22Å; W143-F180 HydrophobicContact CD2-CD1 4.43Å; W143-F180 AromaticContact CD2-CD2 3.52Å; W143-F180 HydrophobicContact CD2-CD2 3.52Å; W143-F180 AromaticContact CD2-CE2 3.99Å; W143-F180 HydrophobicContact CD2-CE2 3.99Å; W143-F180 AromaticContact CD2-CG 3.79Å; W143-F180 HydrophobicContact CD2-CG 3.79Å; W143-F180 AromaticContact CE2-CD2 3.79Å; W143-F180 AromaticContact CE2-CG 3.71Å; W143-F180 HydrophobicContact CE3-CD1 4.04Å; W143-F180 AromaticContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CD2 3.8Å; W143-F180 HydrophobicContact CE3-CE1 4.19Å; W143-F180 AromaticContact CE3-CE2 3.96Å; W143-F180 HydrophobicContact CE3-CE2 3.96Å; W143-F180 AromaticContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CG 3.86Å; W143-F180 HydrophobicContact CE3-CZ 4.16Å; W143-F180 AromaticContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CD2 3.86Å; W143-F180 HydrophobicContact CG-CE2 4.22Å; W143-F180 HydrophobicContact CH2-CB 3.84Å; W143-F180 AromaticContact CH2-CD1 3.85Å; W143-F180 HydrophobicContact CH2-CD1 3.85Å; W143-F180 AromaticContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CH2-CG 3.8Å; W143-F180 HydrophobicContact CZ2-CB 3.4Å; W143-F180 HydrophobicContact CZ2-CD1 4.26Å; W143-F180 HydrophobicContact CZ2-CD2 4.29Å; W143-F180 AromaticContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ2-CG 3.73Å; W143-F180 HydrophobicContact CZ3-CB 4.42Å; W143-F180 AromaticContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD1 3.75Å; W143-F180 HydrophobicContact CZ3-CD2 4.3Å; W143-F180 HydrophobicContact CZ3-CE1 4.1Å; W143-F180 AromaticContact CZ3-CG 3.88Å; W143-F180 HydrophobicContact CZ3-CG 3.88Å; K148-F180 HydrophobicContact CB-CZ 4.26Å; K148-F180 HydrophobicContact CG-CE2 4.02Å; K148-F180 HydrophobicContact CG-CZ 3.75Å; F151-F180 HydrophobicContact CB-CD1 4.48Å; F151-F180 HydrophobicContact CB-CE1 4.34Å; F151-F180 AromaticContact CD1-CD1 3.61Å; F151-F180 HydrophobicContact CD1-CD1 3.61Å; F151-F180 AromaticContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD1-CE1 3.51Å; F151-F180 HydrophobicContact CD2-CD1 4.03Å; F151-F180 AromaticContact CE1-CD1 3.75Å; F151-F180 HydrophobicContact CE1-CD1 3.75Å; F151-F180 AromaticContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE1-CE1 3.94Å; F151-F180 HydrophobicContact CE2-CD1 4.15Å; F151-F180 AromaticContact CG-CD1 3.77Å; F151-F180 HydrophobicContact CG-CD1 3.77Å; F151-F180 AromaticContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CG-CE1 3.91Å; F151-F180 HydrophobicContact CZ-CD1 4.03Å; S176-F180 WeakPolarHBondContact O-CB 3.44Å; S176-F180 PolarHBondContact O-N 3.05Å; F180-Y182 VanDerWaalsContact C-N 3.28Å; F180-Y182 PolarHBondContact O-N 3.44Å; F180-S183 PolarHBondContact O-N 2.72Å; F180-S183 PolarHBondContact O-OG 3.15Å; F180-W184 HydrophobicContact CD1-CB 4.16Å; F180-W184 HydrophobicContact CE1-CB 3.74Å; F180-W184 AromaticContact CE1-CD1 3.92Å; F180-W184 AromaticContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CZ-CB 3.96Å; F180-W184 HydrophobicContact CZ-CG 4.22Å; F180-W184 VanDerWaalsContact O-CB 3.25Å; F180-W184 WeakPolarHBondContact O-CB 3.43Å; F180-W184 PolarHBondContact O-N 3.18Å |
| 181 | Y | 91.7 | Very high | 79.3 | Confident | 13 Ų | 13 | 80.4 Ų | 80.4 | 5% | 0.051 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -51.8 | -45.6 | 174.2 | 174.1 | -110.2 | 0 | 0 | 0 | 112.6 | F151 F155 K160 F162 L177 V178 W184 K185 | F151-Y181 HydrophobicContact CZ-CD2 4.31Å; F155-Y181 HydrophobicContact CD2-CD2 4.23Å; F155-Y181 HydrophobicContact CD2-CE2 4.35Å; F155-Y181 AromaticContact CE2-CD2 3.67Å; F155-Y181 HydrophobicContact CE2-CD2 3.67Å; F155-Y181 AromaticContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CE2-CE2 3.41Å; F155-Y181 VanDerWaalsContact CE2-CE2 3.41Å; F155-Y181 HydrophobicContact CZ-CD2 4.23Å; F155-Y181 AromaticContact CZ-CE2 3.55Å; F155-Y181 HydrophobicContact CZ-CE2 3.55Å; K160-Y181 WeakPolarHBondContact CE-OH 3.23Å; F162-Y181 HydrophobicContact CE1-CG 4.26Å; F162-Y181 HydrophobicContact CZ-CD1 4.11Å; F162-Y181 HydrophobicContact CZ-CD2 4.32Å; F162-Y181 AromaticContact CZ-CG 3.81Å; F162-Y181 HydrophobicContact CZ-CG 3.81Å; L177-Y181 WeakPolarHBondContact O-CB 3.5Å; L177-Y181 PolarHBondContact O-N 2.88Å; V178-Y181 PolarHBondContact O-N 3.49Å; Y181-W184 HydrophobicContact CD2-CE3 4.36Å; Y181-W184 HydrophobicContact CD2-CZ3 4.31Å; Y181-W184 HydrophobicContact CE2-CZ3 4.4Å; Y181-K185 HydrophobicContact CE1-CD 4.21Å; Y181-K185 HydrophobicContact CE2-CB 4.4Å; Y181-K185 HydrophobicContact CE2-CD 4.45Å; Y181-K185 WeakPolarHBondContact O-CB 3.34Å; Y181-K185 PolarHBondContact O-N 2.86Å |
| 182 | Y | 87.6 | Confident | 77.5 | Confident | 153 Ų | 153 | 75.5 Ų | 75.5 | 60% | 0.6 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -75.6 | -27.9 | -176.5 | -76.9 | -67.4 | 0 | 0 | 0 | 114 | V178 R179 F180 | V178-Y182 HydrophobicContact CG1-CD2 4.11Å; V178-Y182 HydrophobicContact CG1-CE2 3.92Å; V178-Y182 VanDerWaalsContact O-CD2 3.27Å; V178-Y182 WeakPolarHBondContact O-CD2 3.48Å; V178-Y182 PolarHBondContact O-N 2.78Å; R179-Y182 PolarHBondContact O-N 2.87Å; F180-Y182 VanDerWaalsContact C-N 3.28Å; F180-Y182 PolarHBondContact O-N 3.44Å |
| 183 | S | 80.4 | Confident | 75.7 | Confident | 65 Ų | 65 | 79.4 Ų | 79.4 | 46% | 0.455 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -76 | -50.1 | 171.7 | 58.5 | 0 | 0 | 0 | 0 | 111.7 | R179 F180 K185 K186 | R179-S183 PolarHBondContact O-N 3.15Å; F180-S183 PolarHBondContact O-N 2.72Å; F180-S183 PolarHBondContact O-OG 3.15Å; S183-K185 PolarHBondContact O-N 3.18Å; S183-K186 WeakPolarHBondContact O-CB 3.44Å; S183-K186 PolarHBondContact O-N 3.27Å; S183-K186 VanDerWaalsContact O-N 3.15Å |
| 184 | W | 85.3 | Confident | 73.5 | Confident | 31 Ų | 31 | 82.1 Ų | 82.1 | 12% | 0.117 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -61.8 | -42.3 | 179.2 | 170.2 | 92.3 | 0 | 0 | 0 | 113 | F151 E152 F155 F180 Y181 K186 T187 R188 | F151-W184 HydrophobicContact CE1-CD2 4.1Å; F151-W184 AromaticContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CE3 3.95Å; F151-W184 HydrophobicContact CE1-CH2 4.44Å; F151-W184 HydrophobicContact CE1-CZ3 4.14Å; E152-W184 HydrophobicContact CB-CZ2 4.26Å; E152-W184 HydrophobicContact CG-CZ2 3.97Å; E152-W184 VanDerWaalsContact OE2-CZ2 3.32Å; E152-W184 WeakPolarHBondContact OE2-CZ2 3.22Å; E152-W184 PolarHBondContact OE2-NE1 3Å; F155-W184 AromaticContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CH2 3.74Å; F155-W184 HydrophobicContact CD1-CZ3 4.08Å; F155-W184 HydrophobicContact CE1-CH2 4.22Å; F155-W184 HydrophobicContact CE1-CZ3 4.23Å; F155-W184 HydrophobicContact CG-CH2 4.14Å; F155-W184 HydrophobicContact CG-CZ3 4.33Å; F180-W184 HydrophobicContact CD1-CB 4.16Å; F180-W184 HydrophobicContact CE1-CB 3.74Å; F180-W184 AromaticContact CE1-CD1 3.92Å; F180-W184 AromaticContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CE1-CG 3.88Å; F180-W184 HydrophobicContact CZ-CB 3.96Å; F180-W184 HydrophobicContact CZ-CG 4.22Å; F180-W184 VanDerWaalsContact O-CB 3.25Å; F180-W184 WeakPolarHBondContact O-CB 3.43Å; F180-W184 PolarHBondContact O-N 3.18Å; Y181-W184 HydrophobicContact CD2-CE3 4.36Å; Y181-W184 HydrophobicContact CD2-CZ3 4.31Å; Y181-W184 HydrophobicContact CE2-CZ3 4.4Å; W184-K186 PolarHBondContact O-N 2.83Å; W184-T187 PolarHBondContact O-N 3.46Å; W184-T187 PolarHBondContact O-OG1 2.92Å; W184-T187 VanDerWaalsContact O-OG1 3.05Å; W184-R188 WeakPolarHBondContact O-CB 3.39Å; W184-R188 PolarHBondContact O-N 3.17Å |
| 185 | K | 80.8 | Confident | 71.8 | Confident | 110 Ų | 110 | 83.6 Ų | 83.6 | 48% | 0.478 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.3 | -32.6 | 176 | -173 | -159.8 | 179.8 | -171.9 | 0 | 112.1 | Y181 S183 T187 | Y181-K185 HydrophobicContact CE1-CD 4.21Å; Y181-K185 HydrophobicContact CE2-CB 4.4Å; Y181-K185 HydrophobicContact CE2-CD 4.45Å; Y181-K185 WeakPolarHBondContact O-CB 3.34Å; Y181-K185 PolarHBondContact O-N 2.86Å; S183-K185 PolarHBondContact O-N 3.18Å; K185-T187 VanDerWaalsContact C-N 3.29Å; K185-T187 PolarHBondContact O-N 3.1Å |
| 186 | K | 68.5 | Low | 70.1 | Confident | 175 Ų | 175 | 90.8 Ų | 90.8 | 76% | 0.761 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -71.5 | -22.7 | -177.3 | -166.6 | 177.1 | 179.2 | -176.4 | 0 | 112.6 | S183 W184 | S183-K186 WeakPolarHBondContact O-CB 3.44Å; S183-K186 PolarHBondContact O-N 3.27Å; S183-K186 VanDerWaalsContact O-N 3.15Å; W184-K186 PolarHBondContact O-N 2.83Å |
| 187 | T | 59.8 | Low | 68.5 | Low | 101 Ų | 101 | 96.3 Ų | 96.3 | 62% | 0.62 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -100.4 | -34 | 178 | 50.7 | 0 | 0 | 0 | 0 | 113.6 | W184 K185 S189 | W184-T187 PolarHBondContact O-N 3.46Å; W184-T187 PolarHBondContact O-OG1 2.92Å; W184-T187 VanDerWaalsContact O-OG1 3.05Å; K185-T187 VanDerWaalsContact C-N 3.29Å; K185-T187 PolarHBondContact O-N 3.1Å; T187-S189 VanDerWaalsContact C-N 3.27Å; T187-S189 PolarHBondContact O-N 3.21Å |
| 188 | R | 61.1 | Low | 66.9 | Low | 67 Ų | 67 | 99.2 Ų | 99.2 | 25% | 0.253 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -68.7 | -17.3 | -173.5 | -158.7 | 168.6 | -171.2 | -110.8 | -0.3 | 114.9 | E152 W184 K190 | E152-R188 IonicContact OE1-CZ 3.31Å; E152-R188 IonicContact OE1-NE 3.07Å; E152-R188 PolarHBondContact OE1-NE 3.24Å; E152-R188 IonicContact OE1-NH2 2.73Å; E152-R188 PolarHBondContact OE1-NH2 2.91Å; E152-R188 IonicContact OE2-CZ 2.74Å; E152-R188 IonicContact OE2-NE 2.73Å; E152-R188 PolarHBondContact OE2-NE 3.23Å; E152-R188 VanDerWaalsContact OE2-NE 3.09Å; E152-R188 IonicContact OE2-NH2 3.68Å; W184-R188 WeakPolarHBondContact O-CB 3.39Å; W184-R188 PolarHBondContact O-N 3.17Å; R188-K190 PolarHBondContact O-N 3.05Å; R188-K190 VanDerWaalsContact O-N 3.08Å |
| 189 | S | 53.2 | Low | 65.4 | Low | 103 Ų | 103 | 105.7 Ų | 105.7 | 72% | 0.72 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.1 | 9.2 | -174 | 55.6 | 0 | 0 | 0 | 0 | 116.1 | T187 | T187-S189 VanDerWaalsContact C-N 3.27Å; T187-S189 PolarHBondContact O-N 3.21Å |
| 190 | K | 45.8 | Very low | 63.9 | Low | 195 Ų | 195 | 104.6 Ų | 104.6 | 85% | 0.848 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.5 | -6.2 | -178.5 | -121.4 | -177.7 | -178.5 | -175.8 | 0 | 116 | R188 | R188-K190 PolarHBondContact O-N 3.05Å; R188-K190 VanDerWaalsContact O-N 3.08Å |
| 191 | T | 50.9 | Low | 62.2 | Low | 123 Ų | 123 | 110.4 Ų | 110.4 | 76% | 0.755 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -143.3 | -11.6 | -167.7 | 44.3 | 0 | 0 | 0 | 0 | 117.7 | ||
| 192 | S | 45.7 | Very low | 60.7 | Low | 40 Ų | 40 | 115.7 Ų | 115.7 | 28% | 0.28 | 56% | 0.563 | S | S | . | * | trans | -83.6 | 123 | -171.2 | -169 | 0 | 0 | 0 | 0 | 115.1 | M194 | S192-M194 VanDerWaalsContact C-N 3.26Å; S192-M194 PolarHBondContact O-N 3.33Å; S192-M194 PolarHBondContact OG-N 3.35Å | ||
| 193 | V | 49.6 | Very low | 59.2 | Low | 102 Ų | 102 | 117.3 Ų | 117.3 | 62% | 0.618 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | -24.3 | 170.2 | 179.1 | 0 | 0 | 0 | 0 | 112 | D195 R196 | V193-D195 VanDerWaalsContact C-N 3.31Å; V193-D195 PolarHBondContact O-N 3.17Å; V193-R196 WeakPolarHBondContact O-CB 3.4Å; V193-R196 PolarHBondContact O-N 3.49Å |
| 194 | M | 46.9 | Very low | 58 | Low | 113 Ų | 113 | 118.5 Ų | 118.5 | 56% | 0.557 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -64.9 | -32.1 | -174.4 | -58.5 | 175.6 | 78.1 | 0 | 0 | 112.9 | S192 R196 H197 A198 | S192-M194 VanDerWaalsContact C-N 3.26Å; S192-M194 PolarHBondContact O-N 3.33Å; S192-M194 PolarHBondContact OG-N 3.35Å; M194-R196 PolarHBondContact O-N 3.35Å; M194-R196 VanDerWaalsContact O-N 3.14Å; M194-H197 PolarHBondContact O-N 3.1Å; M194-A198 PolarHBondContact O-N 3.5Å |
| 195 | D | 55.2 | Low | 56.6 | Low | 94 Ų | 94 | 125.3 Ų | 125.3 | 50% | 0.503 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -59.5 | -23.6 | 173.9 | -105.4 | 23.8 | 0 | 0 | 0 | 112.4 | V193 R199 | V193-D195 VanDerWaalsContact C-N 3.31Å; V193-D195 PolarHBondContact O-N 3.17Å; D195-R199 VanDerWaalsContact O-CG 3.25Å; D195-R199 WeakPolarHBondContact O-CG 3.11Å; D195-R199 PolarHBondContact O-N 3.3Å |
| 196 | R | 54.9 | Low | 55.2 | Low | 206 Ų | 206 | 124.7 Ų | 124.7 | 78% | 0.777 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -74.2 | -37.1 | 174.2 | -147.5 | 179 | -163.2 | -166 | 5.4 | 111.7 | V193 M194 K200 | V193-R196 WeakPolarHBondContact O-CB 3.4Å; V193-R196 PolarHBondContact O-N 3.49Å; M194-R196 PolarHBondContact O-N 3.35Å; M194-R196 VanDerWaalsContact O-N 3.14Å; R196-K200 PolarHBondContact O-N 3.24Å; R196-K200 VanDerWaalsContact O-N 3.1Å |
| 197 | H | 58.1 | Low | 54.1 | Low | 121 Ų | 121 | 121.9 Ų | 121.9 | 56% | 0.56 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -76.4 | -39.8 | 177.6 | -72.9 | -98.1 | 0 | 0 | 0 | 112.3 | M194 R199 K200 Q201 | M194-H197 PolarHBondContact O-N 3.1Å; H197-R199 VanDerWaalsContact C-N 3.25Å; H197-R199 PolarHBondContact O-N 3.47Å; H197-K200 WeakPolarHBondContact O-CA 3.47Å; H197-K200 WeakPolarHBondContact O-CB 3.15Å; H197-K200 PolarHBondContact O-N 2.86Å; H197-Q201 PolarHBondContact O-N 2.55Å |
| 198 | A | 58.2 | Low | 53.6 | Low | 60 Ų | 60 | 120.9 Ų | 120.9 | 50% | 0.496 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -59.6 | -36.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | M194 K202 | M194-A198 PolarHBondContact O-N 3.5Å; A198-K202 PolarHBondContact O-N 3.39Å |
| 199 | R | 61.2 | Low | 52.8 | Low | 184 Ų | 184 | 123.8 Ų | 123.8 | 69% | 0.694 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -71.9 | -31.1 | 171.4 | -68.9 | 175.4 | -163.2 | -149.3 | 6.5 | 113.1 | D195 H197 R203 | D195-R199 VanDerWaalsContact O-CG 3.25Å; D195-R199 WeakPolarHBondContact O-CG 3.11Å; D195-R199 PolarHBondContact O-N 3.3Å; H197-R199 VanDerWaalsContact C-N 3.25Å; H197-R199 PolarHBondContact O-N 3.47Å; R199-R203 WeakPolarHBondContact O-CB 3.49Å; R199-R203 PolarHBondContact O-N 3.42Å; R199-R203 VanDerWaalsContact O-N 3.12Å |
| 200 | K | 56.2 | Low | 52.2 | Low | 117 Ų | 117 | 125.9 Ų | 125.9 | 51% | 0.509 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -67.3 | -51.8 | 177.2 | -165.7 | 175.4 | -174.6 | -84.5 | 0 | 111.3 | R196 H197 K202 R203 E204 | R196-K200 PolarHBondContact O-N 3.24Å; R196-K200 VanDerWaalsContact O-N 3.1Å; H197-K200 WeakPolarHBondContact O-CA 3.47Å; H197-K200 WeakPolarHBondContact O-CB 3.15Å; H197-K200 PolarHBondContact O-N 2.86Å; K200-K202 VanDerWaalsContact C-N 3.3Å; K200-K202 PolarHBondContact O-N 3.34Å; K200-R203 WeakPolarHBondContact O-CA 3.38Å; K200-R203 WeakPolarHBondContact O-CB 3.48Å; K200-R203 PolarHBondContact O-N 3.17Å; K200-E204 HydrophobicContact CG-CG 4.45Å; K200-E204 IonicContact NZ-OE1 3.33Å; K200-E204 PolarHBondContact NZ-OE1 3.1Å; K200-E204 WeakPolarHBondContact O-CG 3.3Å; K200-E204 PolarHBondContact O-N 2.77Å |
| 201 | Q | 55.5 | Low | 52 | Low | 146 Ų | 146 | 124.4 Ų | 124.4 | 68% | 0.682 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -58.5 | -39 | 176.3 | -85.1 | -172.9 | -19.7 | 0 | 0 | 113 | H197 R203 E204 R205 | H197-Q201 PolarHBondContact O-N 2.55Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 2.92Å; Q201-E204 PolarHBondContact O-N 3.42Å; Q201-R205 PolarHBondContact O-N 2.85Å; Q201-R205 VanDerWaalsContact O-N 3.08Å |
| 202 | K | 59.6 | Low | 51.7 | Low | 124 Ų | 124 | 122.4 Ų | 122.4 | 54% | 0.539 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -62.4 | -42.2 | 174.9 | -174 | 173.8 | 177.9 | -70.5 | 0 | 111.5 | A198 K200 R205 E206 | A198-K202 PolarHBondContact O-N 3.39Å; K200-K202 VanDerWaalsContact C-N 3.3Å; K200-K202 PolarHBondContact O-N 3.34Å; K202-R205 PolarHBondContact O-N 3.21Å; K202-E206 IonicContact NZ-OE1 3.31Å; K202-E206 PolarHBondContact NZ-OE1 3.38Å; K202-E206 IonicContact NZ-OE2 2.95Å; K202-E206 PolarHBondContact NZ-OE2 3.24Å; K202-E206 WeakPolarHBondContact O-CG 3.36Å; K202-E206 PolarHBondContact O-N 2.89Å |
| 203 | R | 57.3 | Low | 51.5 | Low | 187 Ų | 187 | 129.5 Ų | 129.5 | 71% | 0.706 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -69.9 | -37 | 179.4 | -152 | 178.2 | -166.3 | -160.5 | 0.4 | 112.7 | R199 K200 Q201 R205 E206 Q207 | R199-R203 WeakPolarHBondContact O-CB 3.49Å; R199-R203 PolarHBondContact O-N 3.42Å; R199-R203 VanDerWaalsContact O-N 3.12Å; K200-R203 WeakPolarHBondContact O-CA 3.38Å; K200-R203 WeakPolarHBondContact O-CB 3.48Å; K200-R203 PolarHBondContact O-N 3.17Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 2.92Å; R203-R205 VanDerWaalsContact C-N 3.34Å; R203-E206 PolarHBondContact O-N 3.21Å; R203-Q207 VanDerWaalsContact O-CB 3.25Å; R203-Q207 WeakPolarHBondContact O-CB 3.46Å; R203-Q207 PolarHBondContact O-N 2.98Å |
| 204 | E | 54.3 | Low | 50.7 | Low | 89 Ų | 89 | 133.4 Ų | 133.4 | 42% | 0.416 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -65.4 | -36.8 | 175.5 | -72 | 165.6 | 150.3 | 0 | 0 | 111.8 | K200 Q201 S208 | K200-E204 HydrophobicContact CG-CG 4.45Å; K200-E204 IonicContact NZ-OE1 3.33Å; K200-E204 PolarHBondContact NZ-OE1 3.1Å; K200-E204 WeakPolarHBondContact O-CG 3.3Å; K200-E204 PolarHBondContact O-N 2.77Å; Q201-E204 PolarHBondContact O-N 3.42Å; E204-S208 PolarHBondContact O-N 3.28Å; E204-S208 PolarHBondContact O-OG 3.42Å |
| 205 | R | 55.8 | Low | 50 | Low | 175 Ų | 175 | 135.4 Ų | 135.4 | 66% | 0.66 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -71.1 | -39.6 | 173.6 | -175.7 | 174.8 | 177.2 | 163.9 | 4.2 | 113.2 | Q201 K202 R203 Q207 S208 | Q201-R205 PolarHBondContact O-N 2.85Å; Q201-R205 VanDerWaalsContact O-N 3.08Å; K202-R205 PolarHBondContact O-N 3.21Å; R203-R205 VanDerWaalsContact C-N 3.34Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; R205-S208 PolarHBondContact O-N 3.08Å; R205-S208 PolarHBondContact O-OG 3.43Å |
| 206 | E | 52.3 | Low | 48.8 | Very low | 97 Ų | 97 | 138.7 Ų | 138.7 | 45% | 0.453 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -67.4 | -35.6 | 175.4 | -71.6 | 174.1 | 141.4 | 0 | 0 | 111.1 | K202 R203 S208 E209 | K202-E206 IonicContact NZ-OE1 3.31Å; K202-E206 PolarHBondContact NZ-OE1 3.38Å; K202-E206 IonicContact NZ-OE2 2.95Å; K202-E206 PolarHBondContact NZ-OE2 3.24Å; K202-E206 WeakPolarHBondContact O-CG 3.36Å; K202-E206 PolarHBondContact O-N 2.89Å; R203-E206 PolarHBondContact O-N 3.21Å; E206-S208 PolarHBondContact O-N 3.49Å; E206-E209 PolarHBondContact O-N 2.96Å |
| 207 | Q | 45.1 | Very low | 47.6 | Very low | 115 Ų | 115 | 132 Ų | 132 | 54% | 0.537 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -72.9 | -24.4 | 178.1 | -169.2 | 166 | -0.3 | 0 | 0 | 113.6 | R203 R205 E209 | R203-Q207 VanDerWaalsContact O-CB 3.25Å; R203-Q207 WeakPolarHBondContact O-CB 3.46Å; R203-Q207 PolarHBondContact O-N 2.98Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; Q207-E209 VanDerWaalsContact C-N 3.3Å |
| 208 | S | 48.4 | Very low | 46.1 | Very low | 81 Ų | 81 | 134.2 Ų | 134.2 | 57% | 0.566 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -78.1 | -8.5 | 173.5 | 55.4 | 0 | 0 | 0 | 0 | 114.9 | E204 R205 E206 | E204-S208 PolarHBondContact O-N 3.28Å; E204-S208 PolarHBondContact O-OG 3.42Å; R205-S208 PolarHBondContact O-N 3.08Å; R205-S208 PolarHBondContact O-OG 3.43Å; E206-S208 PolarHBondContact O-N 3.49Å |
| 209 | E | 45.5 | Very low | 44.9 | Very low | 128 Ų | 128 | 134.9 Ų | 134.9 | 60% | 0.598 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -96.9 | -20.5 | 178.3 | -69.6 | 174.1 | -179.9 | 0 | 0 | 112.1 | E206 Q207 | E206-E209 PolarHBondContact O-N 2.96Å; Q207-E209 VanDerWaalsContact C-N 3.3Å |
| 210 | D | 39.3 | Very low | 43.8 | Very low | 147 Ų | 147 | 131.7 Ų | 131.7 | 79% | 0.786 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -84.8 | -21.3 | 178.3 | -83.7 | -25.7 | 0 | 0 | 0 | 114.5 | A212 | D210-A212 PolarHBondContact O-N 3.26Å |
| 211 | E | 42.3 | Very low | 42.5 | Very low | 164 Ų | 164 | 131.5 Ų | 131.5 | 77% | 0.766 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -89.4 | 9.4 | -176.6 | -70 | -172.9 | 174.5 | 0 | 0 | 114.4 | ||
| 212 | A | 43.6 | Very low | 41.3 | Very low | 81 Ų | 81 | 131.4 Ų | 131.4 | 67% | 0.669 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -103.8 | -10.4 | -171.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | D210 | D210-A212 PolarHBondContact O-N 3.26Š|
| 213 | E | 42.1 | Very low | 40.1 | Very low | 189 Ų | 189 | 132.2 Ų | 132.2 | 88% | 0.883 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -116.7 | 56 | -176.9 | -71.6 | -158.6 | 156.3 | 0 | 0 | 114.5 | ||
| 214 | E | 33.8 | Very low | 39 | Very low | 184 Ų | 184 | 132 Ų | 132 | 86% | 0.86 | 73% | 0.725 | S | S | * | * | trans | -160.1 | 90.4 | 154.7 | -126.5 | 177.6 | -143.1 | 0 | 0 | 115.2 | ||||
| 215 | T | 31.9 | Very low | 37.9 | Very low | 154 Ų | 154 | 137.6 Ų | 137.6 | 95% | 0.945 | 74% | 0.744 | S | S | * | * | trans | 171.4 | 162.9 | 132.4 | 31.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 216 | N | 30 | Very low | 36.9 | Very low | 163 Ų | 163 | 135.8 Ų | 135.8 | 87% | 0.872 | 75% | 0.747 | S | S | * | * | trans | -127.7 | 129.3 | -150.1 | -177.3 | 25.9 | 0 | 0 | 0 | 115.3 | ||||
| 217 | G | 28.2 | Very low | 36.2 | Very low | 66 Ų | 66 | 135.4 Ų | 135.4 | 68% | 0.68 | 75% | 0.753 | S | S | * | * | trans | 72.6 | 116.8 | 138.2 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 218 | N | 27.1 | Very low | 35.4 | Very low | 168 Ų | 168 | 136.6 Ų | 136.6 | 90% | 0.898 | 76% | 0.763 | S | S | * | * | -158 | 161.5 | 114.5 | -154.4 | 22.8 | 0 | 0 | 0 | 112.5 | |||||
| 219 | A | 32.8 | Very low | 34.6 | Very low | 73 Ų | 73 | 140.8 Ų | 140.8 | 60% | 0.603 | 77% | 0.771 | S | S | * | * | trans | -124.1 | 178.8 | 172 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 220 | P | 39.6 | Very low | 33.8 | Very low | 118 Ų | 118 | 141 Ų | 141 | 77% | 0.766 | 77% | 0.772 | S | S | * | * | cis | -142.8 | -149.6 | 17.9 | 45 | -23.3 | 0 | 0 | 0 | 114.8 | ||||
| 221 | S | 28.7 | Very low | 33.4 | Very low | 112 Ų | 112 | 140.7 Ų | 140.7 | 78% | 0.783 | 77% | 0.766 | S | S | * | * | trans | 71.7 | 120.1 | -176.2 | 63.1 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 222 | D | 30.1 | Very low | 33 | Very low | 145 Ų | 145 | 139.8 Ų | 139.8 | 78% | 0.775 | 76% | 0.76 | S | S | * | * | cis | 96.5 | 94.4 | 28.1 | -172.1 | 31.2 | 0 | 0 | 0 | 113.8 | ||||
| 223 | V | 34.4 | Very low | 32.2 | Very low | 141 Ų | 141 | 144.6 Ų | 144.6 | 86% | 0.855 | 77% | 0.765 | S | S | * | * | trans | -153.8 | 126.4 | 156.5 | -159.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 224 | E | 34.4 | Very low | 31.5 | Very low | 181 Ų | 181 | 141.7 Ų | 141.7 | 85% | 0.846 | 75% | 0.752 | S | S | * | * | trans | -85.4 | 136.4 | 165.9 | -66.4 | -175.3 | 123.6 | 0 | 0 | 111.2 | ||||
| 225 | Y | 30 | Very low | 31.1 | Very low | 208 Ų | 208 | 140.8 Ų | 140.8 | 82% | 0.816 | 75% | 0.752 | S | S | * | * | trans | -162.4 | 132.4 | 150.5 | -156.6 | -126 | 0 | 0 | 0 | 113.5 | P227 | Y225-P227 HydrophobicContact CD1-CG 4.26Å; Y225-P227 HydrophobicContact CE1-CG 3.54Å | ||
| 226 | D | 34.6 | Very low | 30.9 | Very low | 136 Ų | 136 | 137.2 Ų | 137.2 | 73% | 0.727 | 75% | 0.746 | S | S | * | * | trans | -138.6 | 127.4 | 166.4 | 173.4 | 5.4 | 0 | 0 | 0 | 108.1 | N228 | D226-N228 PolarHBondContact OD1-N 3.3Š| ||
| 227 | P | 39.4 | Very low | 30.5 | Very low | 90 Ų | 90 | 134.5 Ų | 134.5 | 58% | 0.584 | 75% | 0.746 | S | S | * | * | trans | -138.2 | 106.2 | 145.3 | 36.3 | -21.8 | 0 | 0 | 0 | 113.7 | Y225 K229 | Y225-P227 HydrophobicContact CD1-CG 4.26Å; Y225-P227 HydrophobicContact CE1-CG 3.54Å; P227-K229 PolarHBondContact O-N 2.88Å | ||
| 228 | N | 28 | Very low | 30.6 | Very low | 139 Ų | 139 | 136.1 Ų | 136.1 | 74% | 0.743 | 75% | 0.753 | S | S | * | * | trans | -49.2 | 122.2 | 159.2 | 169.3 | 34.7 | 0 | 0 | 0 | 114.7 | D226 | D226-N228 PolarHBondContact OD1-N 3.3Š| ||
| 229 | K | 31.1 | Very low | 30.9 | Very low | 170 Ų | 170 | 133.8 Ų | 133.8 | 74% | 0.739 | 75% | 0.747 | S | S | * | * | trans | -159.9 | 118.9 | 146 | -142 | 156.1 | -174.6 | 172.6 | 0 | 111 | P227 | P227-K229 PolarHBondContact O-N 2.88Š| ||
| 230 | E | 29.1 | Very low | 30.6 | Very low | 132 Ų | 132 | 139 Ų | 139 | 62% | 0.617 | 76% | 0.759 | S | S | * | * | 54.8 | 128 | 89.6 | -105 | 178.7 | 176.2 | 0 | 0 | 112.8 | |||||
| 231 | E | 31.6 | Very low | 30.1 | Very low | 140 Ų | 140 | 143 Ų | 143 | 65% | 0.654 | 76% | 0.764 | S | S | * | * | cis | -148.2 | 170.6 | 24.6 | -66.8 | -161.1 | 171.6 | 0 | 0 | 110.7 | ||||
| 232 | K | 32.1 | Very low | 30.1 | Very low | 146 Ų | 146 | 146.5 Ų | 146.5 | 64% | 0.635 | 77% | 0.768 | S | S | * | * | cis | -170.3 | 177.4 | -16.9 | -101.5 | 174.5 | -160.5 | 147.5 | 0 | 107.4 | ||||
| 233 | K | 28.6 | Very low | 29.9 | Very low | 182 Ų | 182 | 148.7 Ų | 148.7 | 79% | 0.791 | 77% | 0.774 | S | S | * | * | trans | 70.2 | 142.6 | 161.4 | -80.4 | -165.5 | 167.5 | -136.7 | 0 | 118 | ||||
| 234 | E | 26.5 | Very low | 29.9 | Very low | 128 Ų | 128 | 147.9 Ų | 147.9 | 60% | 0.598 | 77% | 0.771 | S | S | * | * | cis | -130.9 | 142.5 | -8.8 | -71.1 | -141.9 | 157.2 | 0 | 0 | 109.3 | ||||
| 235 | L | 26.1 | Very low | 29.6 | Very low | 164 Ų | 164 | 148.6 Ų | 148.6 | 86% | 0.859 | 77% | 0.772 | S | S | * | * | 41.7 | 129.9 | 94.7 | -49 | 174.4 | 0 | 0 | 0 | 115.1 | |||||
| 236 | G | 26.2 | Very low | 29.7 | Very low | 80 Ų | 80 | 144.8 Ų | 144.8 | 83% | 0.825 | 77% | 0.773 | S | S | * | * | cis | -173.4 | 171.7 | -2 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 237 | A | 23.1 | Very low | 29.3 | Very low | 106 Ų | 106 | 146.5 Ų | 146.5 | 88% | 0.876 | 78% | 0.781 | S | S | * | * | trans | -130.5 | 123.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 238 | A | 29.2 | Very low | 28.9 | Very low | 99 Ų | 99 | 146.9 Ų | 146.9 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -177.3 | 167.5 | 167.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 239 | P | 34.1 | Very low | 29 | Very low | 120 Ų | 120 | 146.4 Ų | 146.4 | 78% | 0.779 | 79% | 0.793 | S | S | * | * | cis | -121.5 | 156.4 | -9.3 | 33.2 | -17.2 | 0 | 0 | 0 | 114.2 | ||||
| 240 | E | 25.5 | Very low | 28.9 | Very low | 182 Ų | 182 | 144.9 Ų | 144.9 | 85% | 0.85 | 80% | 0.798 | S | S | * | * | trans | -90.1 | 143 | 160.8 | -171.6 | 170 | -153.6 | 0 | 0 | 109.2 | ||||
| 241 | K | 30.2 | Very low | 29 | Very low | 202 Ų | 202 | 147 Ų | 147 | 88% | 0.878 | 81% | 0.808 | S | S | * | * | trans | -96.2 | 141.2 | 179.6 | -74 | -172.2 | 176.7 | -175.5 | 0 | 111.6 | ||||
| 242 | Q | 27.2 | Very low | 28.9 | Very low | 185 Ų | 185 | 149.7 Ų | 149.7 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | trans | -127 | 144.5 | 165.6 | -64.3 | -174.6 | 5 | 0 | 0 | 109.9 | ||||
| 243 | E | 27.9 | Very low | 28.7 | Very low | 192 Ų | 192 | 148.9 Ų | 148.9 | 90% | 0.897 | 83% | 0.827 | S | S | * | * | trans | -102.2 | 146.4 | 174.4 | -68 | -177.1 | 119.5 | 0 | 0 | 111.2 | ||||
| 244 | P | 32.9 | Very low | 28.7 | Very low | 123 Ų | 123 | 146.4 Ų | 146.4 | 80% | 0.799 | 83% | 0.828 | S | S | * | * | trans | -82.5 | 162.2 | 178.4 | 34.4 | -35.8 | 0 | 0 | 0 | 113.2 | ||||
| 245 | K | 28.5 | Very low | 28.9 | Very low | 196 Ų | 196 | 147.7 Ų | 147.7 | 85% | 0.852 | 84% | 0.844 | S | S | * | * | trans | -128.8 | 149.2 | 162.4 | -78.6 | -173.1 | 177 | 179.5 | 0 | 110.4 | ||||
| 246 | P | 31.7 | Very low | 29 | Very low | 129 Ų | 129 | 143.3 Ų | 143.3 | 84% | 0.838 | 84% | 0.839 | S | S | * | * | trans | -77 | 155.9 | -168.1 | 30.6 | -36.6 | 0 | 0 | 0 | 113.9 | ||||
| 247 | L | 26.7 | Very low | 29.2 | Very low | 172 Ų | 172 | 146.6 Ų | 146.6 | 90% | 0.901 | 84% | 0.842 | S | S | * | * | trans | -88.4 | 141.2 | 169.4 | -74.3 | 158.2 | 0 | 0 | 0 | 110.5 | ||||
| 248 | A | 30.1 | Very low | 29.7 | Very low | 98 Ų | 98 | 146.1 Ų | 146.1 | 81% | 0.81 | 84% | 0.839 | S | S | * | * | trans | -141.5 | 124.8 | 163.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 249 | V | 30.1 | Very low | 29.8 | Very low | 129 Ų | 129 | 150.7 Ų | 150.7 | 78% | 0.782 | 84% | 0.843 | S | S | * | * | trans | -98.9 | 122.7 | -177.7 | 175.5 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 250 | V | 29.8 | Very low | 29.7 | Very low | 138 Ų | 138 | 153.9 Ų | 153.9 | 84% | 0.836 | 85% | 0.845 | S | S | * | * | trans | -135.5 | 126.3 | 164.6 | 179.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 251 | Q | 30.6 | Very low | 29.8 | Very low | 176 Ų | 176 | 153.9 Ų | 153.9 | 82% | 0.822 | 85% | 0.85 | S | S | * | * | trans | -77.9 | 148.1 | -179 | -60.6 | 174.1 | 4.7 | 0 | 0 | 110.9 | ||||
| 252 | K | 29.4 | Very low | 29.8 | Very low | 196 Ų | 196 | 149.3 Ų | 149.3 | 85% | 0.852 | 84% | 0.839 | S | S | * | * | trans | -106.3 | 133.2 | 168.4 | -75.3 | -175 | 175.6 | -177.4 | 0 | 110 | ||||
| 253 | P | 29.4 | Very low | 30 | Very low | 130 Ų | 130 | 148 Ų | 148 | 84% | 0.844 | 83% | 0.832 | S | S | * | * | trans | -68.6 | 154.6 | 158.5 | 31.1 | -33 | 0 | 0 | 0 | 110.5 | ||||
| 254 | T | 28 | Very low | 30.2 | Very low | 130 Ų | 130 | 145 Ų | 145 | 80% | 0.798 | 83% | 0.827 | S | S | * | * | trans | -96.9 | 130.4 | -168.5 | 50.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 255 | T | 30 | Very low | 30.1 | Very low | 154 Ų | 154 | 146 Ų | 146 | 95% | 0.945 | 82% | 0.819 | S | S | * | * | trans | -178.7 | 151.1 | 145.5 | 17.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 256 | G | 27.9 | Very low | 30.5 | Very low | 72 Ų | 72 | 146.3 Ų | 146.3 | 74% | 0.742 | 82% | 0.82 | S | S | * | * | cis | 176.9 | 11.3 | -1.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 257 | V | 31.2 | Very low | 30.5 | Very low | 149 Ų | 149 | 146.7 Ų | 146.7 | 90% | 0.903 | 81% | 0.811 | S | S | * | * | trans | -136.2 | 139.5 | 176.3 | -174.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 258 | A | 33.3 | Very low | 31.1 | Very low | 97 Ų | 97 | 144.2 Ų | 144.2 | 80% | 0.802 | 81% | 0.805 | S | S | * | * | trans | -124 | 121 | -175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 259 | E | 30.5 | Very low | 31.5 | Very low | 194 Ų | 194 | 148.9 Ų | 148.9 | 91% | 0.907 | 81% | 0.81 | S | S | * | * | trans | -118.3 | 148.9 | 159.7 | -74.4 | -152.1 | 120.4 | 0 | 0 | 110.8 | L261 | E259-L261 PolarHBondContact O-N 3.47Š| ||
| 260 | K | 33.1 | Very low | 31.9 | Very low | 188 Ų | 188 | 145.8 Ų | 145.8 | 82% | 0.817 | 80% | 0.804 | S | S | * | * | trans | -105 | 81.6 | -151.3 | -167.4 | -177.2 | -175.7 | 179.8 | 0 | 112.3 | T262 | K260-T262 HydrophobicContact CD-CG2 4.49Å; K260-T262 HydrophobicContact CG-CG2 4.24Å; K260-T262 PolarHBondContact O-N 2.89Å | ||
| 261 | L | 27.8 | Very low | 32.4 | Very low | 182 Ų | 182 | 145.1 Ų | 145.1 | 95% | 0.953 | 80% | 0.802 | S | S | * | * | trans | -67.2 | 94.1 | 171.1 | -91.2 | 167.6 | 0 | 0 | 0 | 111.2 | E259 H263 | E259-L261 PolarHBondContact O-N 3.47Å; L261-H263 PolarHBondContact O-N 3.42Å | ||
| 262 | T | 30.4 | Very low | 33.1 | Very low | 106 Ų | 106 | 143.6 Ų | 143.6 | 65% | 0.65 | 81% | 0.808 | S | S | * | * | trans | -73.5 | 121.6 | -179.3 | 50.2 | 0 | 0 | 0 | 0 | 112.3 | K260 V264 | K260-T262 HydrophobicContact CD-CG2 4.49Å; K260-T262 HydrophobicContact CG-CG2 4.24Å; K260-T262 PolarHBondContact O-N 2.89Å; T262-V264 PolarHBondContact O-N 2.91Å | ||
| 263 | H | 30.4 | Very low | 33.9 | Very low | 156 Ų | 156 | 136.9 Ų | 136.9 | 72% | 0.722 | 79% | 0.794 | S | S | * | * | trans | -24.1 | 121.6 | 159.8 | 166 | 60.5 | 0 | 0 | 0 | 114.6 | L261 K265 | L261-H263 PolarHBondContact O-N 3.42Å; H263-K265 PolarHBondContact O-N 3.22Å | ||
| 264 | V | 31.7 | Very low | 35 | Very low | 131 Ų | 131 | 140.5 Ų | 140.5 | 79% | 0.794 | 80% | 0.797 | S | S | * | * | trans | -72.8 | 93.2 | 169.1 | 179.6 | 0 | 0 | 0 | 0 | 108.8 | T262 | T262-V264 PolarHBondContact O-N 2.91Š| ||
| 265 | K | 31.8 | Very low | 35.7 | Very low | 144 Ų | 144 | 140 Ų | 140 | 63% | 0.626 | 79% | 0.789 | S | S | * | * | trans | -65.1 | 130.4 | 171.2 | -160.2 | -170.4 | -175 | -159.4 | 0 | 109.2 | H263 E267 | H263-K265 PolarHBondContact O-N 3.22Å; K265-E267 WeakPolarHBondContact CE-OE1 3.48Å; K265-E267 IonicContact NZ-OE1 3.09Å; K265-E267 PolarHBondContact NZ-OE1 3.35Å | ||
| 266 | K | 37.5 | Very low | 36.8 | Very low | 202 Ų | 202 | 140.1 Ų | 140.1 | 88% | 0.878 | 78% | 0.783 | S | S | * | * | trans | -103.8 | 109.6 | -178.4 | -172.2 | -175.4 | -179.5 | -171.3 | 0 | 109.3 | ||||
| 267 | E | 31.7 | Very low | 38.1 | Very low | 137 Ų | 137 | 143.9 Ų | 143.9 | 64% | 0.64 | 78% | 0.781 | S | S | * | * | trans | -113.9 | 161.6 | 177.8 | -101.7 | 173.3 | -153.4 | 0 | 0 | 111.9 | K265 | K265-E267 WeakPolarHBondContact CE-OE1 3.48Å; K265-E267 IonicContact NZ-OE1 3.09Å; K265-E267 PolarHBondContact NZ-OE1 3.35Å | ||
| 268 | P | 39.2 | Very low | 39 | Very low | 120 Ų | 120 | 146 Ų | 146 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | trans | -76.1 | 156.9 | -155.9 | 29.1 | -36 | 0 | 0 | 0 | 114.5 | ||||
| 269 | Q | 37.2 | Very low | 40 | Very low | 196 Ų | 196 | 145.4 Ų | 145.4 | 92% | 0.916 | 77% | 0.768 | S | S | * | * | trans | -82.2 | 120.7 | 171.3 | -73.1 | -179.5 | -27.7 | 0 | 0 | 110.4 | ||||
| 270 | G | 39.1 | Very low | 41.2 | Very low | 63 Ų | 63 | 145.1 Ų | 145.1 | 65% | 0.649 | 76% | 0.763 | S | S | * | * | trans | -69.9 | 174.3 | 160.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 271 | P | 40.3 | Very low | 43 | Very low | 124 Ų | 124 | 145 Ų | 145 | 81% | 0.805 | 76% | 0.763 | S | S | * | * | trans | -66 | 154.3 | -167.2 | 25.2 | -34.8 | 0 | 0 | 0 | 114.4 | G273 | P271-G273 VanDerWaalsContact C-N 3.31Å; P271-G273 PolarHBondContact O-N 3.44Å | ||
| 272 | P | 45.7 | Very low | 45.6 | Very low | 144 Ų | 144 | 144.9 Ų | 144.9 | 94% | 0.935 | 76% | 0.755 | S | S | * | * | trans | -79.8 | 64.8 | -168.7 | 33.7 | -37.6 | 0 | 0 | 0 | 114 | ||||
| 273 | G | 46.9 | Very low | 48.4 | Very low | 55 Ų | 55 | 142.8 Ų | 142.8 | 57% | 0.567 | 74% | 0.743 | S | S | * | * | trans | -104.6 | 121.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | P271 | P271-G273 VanDerWaalsContact C-N 3.31Å; P271-G273 PolarHBondContact O-N 3.44Å | ||
| 274 | K | 50.9 | Low | 51.3 | Low | 207 Ų | 207 | 139.9 Ų | 139.9 | 90% | 0.9 | 74% | 0.738 | S | S | * | * | trans | 50 | 87.8 | 153.4 | -54.9 | 170.6 | -174.4 | 172.9 | 0 | 116.9 | ||||
| 275 | N | 43.8 | Very low | 54.1 | Low | 118 Ų | 118 | 144.2 Ų | 144.2 | 63% | 0.631 | 75% | 0.746 | S | S | * | * | trans | -155.1 | 40.2 | 169.8 | -119.3 | -68.2 | 0 | 0 | 0 | 118 | H277 R278 | N275-H277 PolarHBondContact O-N 2.94Å; N275-R278 PolarHBondContact O-N 3.48Å | ||
| 276 | L | 52.6 | Low | 56.9 | Low | 157 Ų | 157 | 140.2 Ų | 140.2 | 82% | 0.822 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -58 | -22.4 | -179.2 | -173.6 | 57.4 | 0 | 0 | 0 | 114.5 | ||
| 277 | H | 54.6 | Low | 59.6 | Low | 152 Ų | 152 | 135.5 Ų | 135.5 | 70% | 0.704 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -80.8 | -17.5 | -176.9 | -66.8 | -103.7 | 0 | 0 | 0 | 114.4 | N275 A279 | N275-H277 PolarHBondContact O-N 2.94Å; H277-A279 VanDerWaalsContact C-N 3.26Å; H277-A279 PolarHBondContact O-N 3.02Å |
| 278 | R | 50.1 | Low | 62.4 | Low | 193 Ų | 193 | 136.7 Ų | 136.7 | 73% | 0.728 | 73% | 0.733 | S | S | * | * | G | 310 helix | trans | -72.5 | -17.7 | -175.9 | -162 | 170.9 | -176.2 | 177 | 2.2 | 113.6 | N275 K280 | N275-R278 PolarHBondContact O-N 3.48Å; R278-K280 PolarHBondContact O-N 2.95Å |
| 279 | A | 54 | Low | 65 | Low | 84 Ų | 84 | 136.4 Ų | 136.4 | 69% | 0.694 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -63.5 | -25.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | H277 K281 | H277-A279 VanDerWaalsContact C-N 3.26Å; H277-A279 PolarHBondContact O-N 3.02Å; A279-K281 PolarHBondContact O-N 3.37Å |
| 280 | K | 57.6 | Low | 67.6 | Low | 188 Ų | 188 | 129.5 Ų | 129.5 | 82% | 0.817 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -77.4 | 4.8 | -176.4 | -58.9 | -169 | 178.9 | -171.9 | 0 | 115 | R278 | R278-K280 PolarHBondContact O-N 2.95Š|
| 281 | K | 70.7 | Confident | 70.1 | Confident | 185 Ų | 185 | 134.2 Ų | 134.2 | 80% | 0.804 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -113 | 24.7 | -173.8 | -64.1 | -166 | 175.2 | -169.8 | 0 | 114.6 | A279 | A279-K281 PolarHBondContact O-N 3.37Š|
| 282 | K | 81.3 | Confident | 72.7 | Confident | 180 Ų | 180 | 130.6 Ų | 130.6 | 78% | 0.783 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -127.8 | 146.4 | 174.1 | -67.1 | -170.9 | 177.4 | -172.8 | 0 | 110 | ||
| 283 | P | 88.4 | Confident | 74.9 | Confident | 62 Ų | 62 | 128 Ų | 128 | 40% | 0.403 | 67% | 0.667 | S | S | . | * | P | Polyproline II helix | trans | -62.9 | 158.7 | 173.9 | 28.1 | -35.2 | 0 | 0 | 0 | 111.2 | M287 L289 | P283-M287 HydrophobicContact CB-CB 4.31Å; P283-M287 HydrophobicContact CB-CG 4.3Å; P283-M287 WeakPolarHBondContact CG-O 3.41Å; P283-L289 HydrophobicContact CB-CD1 4.29Å |
| 284 | P | 93.1 | Very high | 77 | Confident | 96 Ų | 96 | 128.8 Ų | 128.8 | 62% | 0.623 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 152.5 | 175.4 | -27.4 | 35.5 | 0 | 0 | 0 | 113.3 | G286 M287 | P284-G286 PolarHBondContact O-N 3.15Å; P284-G286 VanDerWaalsContact O-N 3.12Å; P284-M287 HydrophobicContact CB-CB 4.16Å; P284-M287 HydrophobicContact CG-CB 4.45Å; P284-M287 WeakPolarHBondContact O-CB 3.31Å; P284-M287 PolarHBondContact O-N 2.95Å |
| 285 | K | 89.8 | Confident | 79 | Confident | 221 Ų | 221 | 121 Ų | 121 | 96% | 0.961 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.8 | 118.1 | -179.6 | -178.3 | 62.1 | 176 | 174.4 | 0 | 110.3 | ||
| 286 | G | 91.4 | Very high | 81.2 | Confident | 60 Ų | 60 | 117.7 Ų | 117.7 | 62% | 0.619 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 98.6 | -16.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | P284 H288 | P284-G286 PolarHBondContact O-N 3.15Å; P284-G286 VanDerWaalsContact O-N 3.12Å; G286-H288 PolarHBondContact O-CE1 3.12Å; G286-H288 PolarHBondContact O-ND1 3.01Å; G286-H288 VanDerWaalsContact O-ND1 3.12Å |
| 287 | M | 93 | Very high | 83 | Confident | 103 Ų | 103 | 114.4 Ų | 114.4 | 51% | 0.507 | 61% | 0.605 | S | S | . | * | trans | -86.6 | 127.6 | 172.3 | -174.6 | 58.6 | 68.7 | 0 | 0 | 109.9 | P283 P284 L289 | P283-M287 HydrophobicContact CB-CB 4.31Å; P283-M287 HydrophobicContact CB-CG 4.3Å; P283-M287 WeakPolarHBondContact CG-O 3.41Å; P284-M287 HydrophobicContact CB-CB 4.16Å; P284-M287 HydrophobicContact CG-CB 4.45Å; P284-M287 WeakPolarHBondContact O-CB 3.31Å; P284-M287 PolarHBondContact O-N 2.95Å; M287-L289 HydrophobicContact CG-CD1 4.16Å; M287-L289 HydrophobicContact CG-CG 4.06Å; M287-L289 HydrophobicContact SD-CD2 4.49Å; M287-L289 HydrophobicContact SD-CG 4.48Å | ||
| 288 | H | 91.6 | Very high | 84.7 | Confident | 162 Ų | 162 | 111.2 Ų | 111.2 | 75% | 0.75 | 60% | 0.6 | S | S | * | * | trans | -114.7 | 118.6 | -179.9 | -59.7 | 88.2 | 0 | 0 | 0 | 108.4 | G286 | G286-H288 PolarHBondContact O-CE1 3.12Å; G286-H288 PolarHBondContact O-ND1 3.01Å; G286-H288 VanDerWaalsContact O-ND1 3.12Å | ||
| 289 | L | 92.3 | Very high | 86.6 | Confident | 114 Ų | 114 | 107 Ų | 107 | 60% | 0.597 | 60% | 0.595 | S | S | * | * | trans | -136.3 | 112.6 | 179.2 | -64.5 | 173.5 | 0 | 0 | 0 | 107.6 | P283 M287 | P283-L289 HydrophobicContact CB-CD1 4.29Å; M287-L289 HydrophobicContact CG-CD1 4.16Å; M287-L289 HydrophobicContact CG-CG 4.06Å; M287-L289 HydrophobicContact SD-CD2 4.49Å; M287-L289 HydrophobicContact SD-CG 4.48Å | ||
| 290 | S | 92.4 | Very high | 88.3 | Confident | 52 Ų | 52 | 105.9 Ų | 105.9 | 36% | 0.364 | 58% | 0.583 | S | S | . | * | trans | -116.5 | 156.7 | 169.3 | 93.3 | 0 | 0 | 0 | 0 | 110.8 | G292 D293 V294 | S290-G292 PolarHBondContact O-N 2.99Å; S290-G292 PolarHBondContact OG-N 3.33Å; S290-D293 WeakPolarHBondContact CB-OD2 3.34Å; S290-D293 PolarHBondContact O-N 3.3Å; S290-D293 PolarHBondContact OG-N 2.97Å; S290-D293 PolarHBondContact OG-OD2 2.98Å; S290-V294 WeakPolarHBondContact O-CG2 3.41Å; S290-V294 PolarHBondContact O-N 3.1Å | ||
| 291 | Q | 91.9 | Very high | 89.6 | Confident | 161 Ų | 161 | 103.9 Ų | 103.9 | 75% | 0.752 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -63.1 | -31.3 | 177.8 | -172.6 | 63.1 | 26.2 | 0 | 0 | 112 | A295 | Q291-A295 VanDerWaalsContact O-CB 3.23Å; Q291-A295 WeakPolarHBondContact O-CB 3.49Å; Q291-A295 PolarHBondContact O-N 3.46Å; Q291-A295 VanDerWaalsContact O-N 3.1Å |
| 292 | G | 93.9 | Very high | 90.6 | Very high | 48 Ų | 48 | 99.3 Ų | 99.3 | 50% | 0.495 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -69.3 | -50.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | S290 V294 A295 A296 | S290-G292 PolarHBondContact O-N 2.99Å; S290-G292 PolarHBondContact OG-N 3.33Å; G292-V294 PolarHBondContact O-N 3Å; G292-A295 PolarHBondContact O-N 2.85Å; G292-A296 WeakPolarHBondContact O-CB 3.2Å; G292-A296 PolarHBondContact O-N 3.33Å |
| 293 | D | 92.4 | Very high | 91.1 | Very high | 91 Ų | 91 | 91.4 Ų | 91.4 | 49% | 0.487 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.4 | -44.6 | -178.4 | -46.1 | -48.3 | 0 | 0 | 0 | 111 | S290 A295 A296 M297 | S290-D293 WeakPolarHBondContact CB-OD2 3.34Å; S290-D293 PolarHBondContact O-N 3.3Å; S290-D293 PolarHBondContact OG-N 2.97Å; S290-D293 PolarHBondContact OG-OD2 2.98Å; D293-A295 PolarHBondContact O-N 3.48Å; D293-A296 PolarHBondContact O-N 3.11Å; D293-M297 WeakPolarHBondContact O-CB 3.49Å; D293-M297 WeakPolarHBondContact O-CG 3.47Å; D293-M297 PolarHBondContact O-N 2.68Å |
| 294 | V | 91.4 | Very high | 91.2 | Very high | 71 Ų | 71 | 89.8 Ų | 89.8 | 43% | 0.43 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.9 | -43.2 | 178 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | S290 G292 S298 | S290-V294 WeakPolarHBondContact O-CG2 3.41Å; S290-V294 PolarHBondContact O-N 3.1Å; G292-V294 PolarHBondContact O-N 3Å; V294-S298 VanDerWaalsContact O-CB 3.31Å; V294-S298 WeakPolarHBondContact O-CB 3.42Å; V294-S298 PolarHBondContact O-N 3.12Å; V294-S298 PolarHBondContact O-OG 3.32Å |
| 295 | A | 92.3 | Very high | 91.2 | Very high | 44 Ų | 44 | 88.6 Ų | 88.6 | 36% | 0.364 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.6 | -49.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q291 G292 D293 M297 S298 T299 | Q291-A295 VanDerWaalsContact O-CB 3.23Å; Q291-A295 WeakPolarHBondContact O-CB 3.49Å; Q291-A295 PolarHBondContact O-N 3.46Å; Q291-A295 VanDerWaalsContact O-N 3.1Å; G292-A295 PolarHBondContact O-N 2.85Å; D293-A295 PolarHBondContact O-N 3.48Å; A295-M297 PolarHBondContact O-N 3.26Å; A295-S298 PolarHBondContact O-N 3.47Å; A295-S298 PolarHBondContact O-OG 2.8Å; A295-T299 WeakPolarHBondContact O-CG2 3.49Å; A295-T299 PolarHBondContact O-N 3.29Å |
| 296 | A | 89.8 | Confident | 91.4 | Very high | 47 Ų | 47 | 80 Ų | 80 | 39% | 0.388 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -56.9 | -49.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G292 D293 S298 T299 | G292-A296 WeakPolarHBondContact O-CB 3.2Å; G292-A296 PolarHBondContact O-N 3.33Å; D293-A296 PolarHBondContact O-N 3.11Å; A296-S298 VanDerWaalsContact C-N 3.31Å; A296-S298 PolarHBondContact O-N 3.21Å; A296-T299 PolarHBondContact O-OG1 3.45Å |
| 297 | M | 90.1 | Very high | 91.5 | Very high | 89 Ų | 89 | 80 Ų | 80 | 44% | 0.438 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.6 | -24.6 | -179.7 | -69.5 | -179.3 | 70.6 | 0 | 0 | 114 | D293 A295 A304 | D293-M297 WeakPolarHBondContact O-CB 3.49Å; D293-M297 WeakPolarHBondContact O-CG 3.47Å; D293-M297 PolarHBondContact O-N 2.68Å; A295-M297 PolarHBondContact O-N 3.26Å; M297-A304 HydrophobicContact CB-CB 4.23Å; M297-A304 HydrophobicContact CE-CB 3.85Å; M297-A304 HydrophobicContact CG-CB 4.49Å |
| 298 | S | 91.3 | Very high | 91.6 | Very high | 84 Ų | 84 | 80.1 Ų | 80.1 | 59% | 0.587 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -96.9 | -2.8 | -177.9 | 59.1 | 0 | 0 | 0 | 0 | 114.7 | V294 A295 A296 S300 | V294-S298 VanDerWaalsContact O-CB 3.31Å; V294-S298 WeakPolarHBondContact O-CB 3.42Å; V294-S298 PolarHBondContact O-N 3.12Å; V294-S298 PolarHBondContact O-OG 3.32Å; A295-S298 PolarHBondContact O-N 3.47Å; A295-S298 PolarHBondContact O-OG 2.8Å; A296-S298 VanDerWaalsContact C-N 3.31Å; A296-S298 PolarHBondContact O-N 3.21Å; S298-S300 PolarHBondContact O-N 2.83Å |
| 299 | T | 90 | Very high | 91.8 | Very high | 104 Ų | 104 | 80.4 Ų | 80.4 | 64% | 0.638 | 49% | 0.485 | S | S | * | . | S | Bend | trans | -56.6 | -31.6 | -179.1 | 53.4 | 0 | 0 | 0 | 0 | 114.7 | A295 A296 A303 | A295-T299 WeakPolarHBondContact O-CG2 3.49Å; A295-T299 PolarHBondContact O-N 3.29Å; A296-T299 PolarHBondContact O-OG1 3.45Å; T299-A303 WeakPolarHBondContact OG1-CB 3.39Å |
| 300 | S | 89.8 | Confident | 92 | Very high | 62 Ų | 62 | 79.8 Ų | 79.8 | 43% | 0.434 | 48% | 0.48 | S | S | . | . | S | Bend | trans | -163.5 | 162 | 173.3 | 62.6 | 0 | 0 | 0 | 0 | 111.3 | S298 A303 | S298-S300 PolarHBondContact O-N 2.83Å; S300-A303 WeakPolarHBondContact O-CB 3.26Å; S300-A303 PolarHBondContact O-N 2.88Å |
| 301 | T | 84.5 | Confident | 92.1 | Very high | 145 Ų | 145 | 83 Ų | 83 | 89% | 0.89 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.7 | -42.3 | 180 | -40.6 | 0 | 0 | 0 | 0 | 115 | ||
| 302 | P | 92.4 | Very high | 92.4 | Very high | 89 Ų | 89 | 79.9 Ų | 79.9 | 58% | 0.578 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -9.8 | 175.6 | 33.1 | -37.2 | 0 | 0 | 0 | 114.8 | A304 V305 G306 | P302-A304 PolarHBondContact O-N 2.94Å; P302-V305 PolarHBondContact O-N 2.84Å; P302-V305 VanDerWaalsContact O-N 3.11Å; P302-G306 PolarHBondContact O-N 3.41Å |
| 303 | A | 90.8 | Very high | 92.5 | Very high | 15 Ų | 15 | 84.2 Ų | 84.2 | 12% | 0.124 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -59 | -47.7 | -168.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | T299 S300 V305 G306 V307 | T299-A303 WeakPolarHBondContact OG1-CB 3.39Å; S300-A303 WeakPolarHBondContact O-CB 3.26Å; S300-A303 PolarHBondContact O-N 2.88Å; A303-V305 VanDerWaalsContact C-N 3.27Å; A303-V305 PolarHBondContact O-N 3.5Å; A303-G306 WeakPolarHBondContact O-CA 3.36Å; A303-G306 PolarHBondContact O-N 2.95Å; A303-G306 VanDerWaalsContact O-N 3.07Å; A303-V307 WeakPolarHBondContact O-CG2 3.2Å; A303-V307 PolarHBondContact O-N 3.05Å |
| 304 | A | 90.6 | Very high | 92.8 | Very high | 28 Ų | 28 | 84.4 Ų | 84.4 | 23% | 0.231 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -56.5 | -39.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | M297 P302 L308 | M297-A304 HydrophobicContact CB-CB 4.23Å; M297-A304 HydrophobicContact CE-CB 3.85Å; M297-A304 HydrophobicContact CG-CB 4.49Å; P302-A304 PolarHBondContact O-N 2.94Å; A304-L308 WeakPolarHBondContact O-CG 3.45Å; A304-L308 PolarHBondContact O-N 3.12Å; A304-L308 VanDerWaalsContact O-N 3.16Å |
| 305 | V | 93.5 | Very high | 93.1 | Very high | 71 Ų | 71 | 84.9 Ų | 84.9 | 43% | 0.43 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -72.6 | -34.3 | 177.5 | -176.1 | 0 | 0 | 0 | 0 | 111.3 | P302 A303 R309 | P302-V305 PolarHBondContact O-N 2.84Å; P302-V305 VanDerWaalsContact O-N 3.11Å; A303-V305 VanDerWaalsContact C-N 3.27Å; A303-V305 PolarHBondContact O-N 3.5Å; V305-R309 WeakPolarHBondContact O-CB 3.46Å; V305-R309 WeakPolarHBondContact O-CG 3.25Å; V305-R309 PolarHBondContact O-N 3.37Å; V305-R309 VanDerWaalsContact O-N 3.1Å |
| 306 | G | 94.2 | Very high | 93.4 | Very high | 41 Ų | 41 | 86.8 Ų | 86.8 | 42% | 0.423 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.9 | -48.5 | 173 | 0 | 0 | 0 | 0 | 0 | 112.6 | P302 A303 L308 R309 Q310 | P302-G306 PolarHBondContact O-N 3.41Å; A303-G306 WeakPolarHBondContact O-CA 3.36Å; A303-G306 PolarHBondContact O-N 2.95Å; A303-G306 VanDerWaalsContact O-N 3.07Å; G306-L308 PolarHBondContact O-N 3.24Å; G306-R309 PolarHBondContact O-N 3.17Å; G306-Q310 PolarHBondContact O-N 2.81Å |
| 307 | V | 93.8 | Very high | 93.8 | Very high | 60 Ų | 60 | 85.5 Ų | 85.5 | 36% | 0.364 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.1 | -46.6 | 177.6 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | A303 R309 Q310 M311 | A303-V307 WeakPolarHBondContact O-CG2 3.2Å; A303-V307 PolarHBondContact O-N 3.05Å; V307-R309 PolarHBondContact O-N 3.17Å; V307-Q310 WeakPolarHBondContact O-CB 3.48Å; V307-Q310 PolarHBondContact O-N 3.28Å; V307-M311 WeakPolarHBondContact O-CG 3.33Å; V307-M311 PolarHBondContact O-N 3.39Å; V307-M311 VanDerWaalsContact O-N 3.09Å |
| 308 | L | 94 | Very high | 94.2 | Very high | 104 Ų | 104 | 85.7 Ų | 85.7 | 55% | 0.545 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 178 | -70.4 | 170.9 | 0 | 0 | 0 | 112 | A304 G306 Q310 M311 D312 | A304-L308 WeakPolarHBondContact O-CG 3.45Å; A304-L308 PolarHBondContact O-N 3.12Å; A304-L308 VanDerWaalsContact O-N 3.16Å; G306-L308 PolarHBondContact O-N 3.24Å; L308-Q310 VanDerWaalsContact C-N 3.32Å; L308-Q310 PolarHBondContact O-N 2.64Å; L308-M311 PolarHBondContact O-N 3.18Å; L308-D312 PolarHBondContact O-N 2.96Å |
| 309 | R | 95.7 | Very high | 94.5 | Very high | 168 Ų | 168 | 87.2 Ų | 87.2 | 63% | 0.634 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.1 | -36.8 | 176.4 | -76.6 | 177.1 | 176.5 | 152.8 | 0.1 | 113.1 | V305 G306 V307 D312 M313 | V305-R309 WeakPolarHBondContact O-CB 3.46Å; V305-R309 WeakPolarHBondContact O-CG 3.25Å; V305-R309 PolarHBondContact O-N 3.37Å; V305-R309 VanDerWaalsContact O-N 3.1Å; G306-R309 PolarHBondContact O-N 3.17Å; V307-R309 PolarHBondContact O-N 3.17Å; R309-D312 PolarHBondContact O-N 3.07Å; R309-M313 WeakPolarHBondContact O-CG 3.14Å; R309-M313 PolarHBondContact O-N 3.38Å |
| 310 | Q | 96.4 | Very high | 94.9 | Very high | 102 Ų | 102 | 90.3 Ų | 90.3 | 48% | 0.477 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | 174.4 | 178.6 | 59.8 | 29.2 | 0 | 0 | 110.8 | G306 V307 L308 D312 M313 E314 | G306-Q310 PolarHBondContact O-N 2.81Å; V307-Q310 WeakPolarHBondContact O-CB 3.48Å; V307-Q310 PolarHBondContact O-N 3.28Å; L308-Q310 VanDerWaalsContact C-N 3.32Å; L308-Q310 PolarHBondContact O-N 2.64Å; Q310-D312 PolarHBondContact O-N 2.96Å; Q310-M313 PolarHBondContact O-N 3.29Å; Q310-E314 PolarHBondContact NE2-OE1 3.47Å; Q310-E314 PolarHBondContact O-N 2.92Å |
| 311 | M | 95.9 | Very high | 95.3 | Very high | 118 Ų | 118 | 93.1 Ų | 93.1 | 58% | 0.581 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.1 | -35.5 | 177.1 | -58.1 | -151.3 | 100.4 | 0 | 0 | 112.7 | V307 L308 E314 L315 | V307-M311 WeakPolarHBondContact O-CG 3.33Å; V307-M311 PolarHBondContact O-N 3.39Å; V307-M311 VanDerWaalsContact O-N 3.09Å; L308-M311 PolarHBondContact O-N 3.18Å; M311-E314 PolarHBondContact O-N 2.92Å; M311-L315 VanDerWaalsContact O-CB 3.26Å; M311-L315 WeakPolarHBondContact O-CB 3.33Å; M311-L315 PolarHBondContact O-N 3.09Å |
| 312 | D | 97.5 | Very high | 95.9 | Very high | 97 Ų | 97 | 90.3 Ų | 90.3 | 52% | 0.519 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | 172.3 | -77.3 | -38.5 | 0 | 0 | 0 | 111.9 | L308 R309 Q310 L315 V316 | L308-D312 PolarHBondContact O-N 2.96Å; R309-D312 PolarHBondContact O-N 3.07Å; Q310-D312 PolarHBondContact O-N 2.96Å; D312-L315 PolarHBondContact O-N 3.25Å; D312-V316 WeakPolarHBondContact O-CG2 3.32Å; D312-V316 PolarHBondContact O-N 2.94Å |
| 313 | M | 97.2 | Very high | 96.2 | Very high | 139 Ų | 139 | 91.7 Ų | 91.7 | 69% | 0.685 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -66.2 | -40.1 | 176.8 | -72.6 | -172.8 | 70.6 | 0 | 0 | 112.3 | R309 Q310 V316 G317 | R309-M313 WeakPolarHBondContact O-CG 3.14Å; R309-M313 PolarHBondContact O-N 3.38Å; Q310-M313 PolarHBondContact O-N 3.29Å; M313-V316 PolarHBondContact O-N 3.17Å; M313-G317 PolarHBondContact O-N 3.39Å |
| 314 | E | 98.1 | Very high | 96.6 | Very high | 94 Ų | 94 | 94.6 Ų | 94.6 | 44% | 0.439 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.4 | -43 | 173 | -74.6 | 174.4 | -156.8 | 0 | 0 | 111.8 | Q310 M311 V316 G317 I318 | Q310-E314 PolarHBondContact NE2-OE1 3.47Å; Q310-E314 PolarHBondContact O-N 2.92Å; M311-E314 PolarHBondContact O-N 2.92Å; E314-V316 VanDerWaalsContact C-N 3.33Å; E314-V316 PolarHBondContact O-N 3.11Å; E314-G317 WeakPolarHBondContact O-CA 3.35Å; E314-G317 PolarHBondContact O-N 3.16Å; E314-G317 VanDerWaalsContact O-N 3.1Å; E314-I318 WeakPolarHBondContact O-CG1 3.44Å; E314-I318 PolarHBondContact O-N 3.49Å |
| 315 | L | 97.4 | Very high | 96.9 | Very high | 81 Ų | 81 | 97.2 Ų | 97.2 | 42% | 0.424 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.3 | -41.2 | 175.5 | -179.8 | 63.3 | 0 | 0 | 0 | 111.8 | M311 D312 K319 | M311-L315 VanDerWaalsContact O-CB 3.26Å; M311-L315 WeakPolarHBondContact O-CB 3.33Å; M311-L315 PolarHBondContact O-N 3.09Å; D312-L315 PolarHBondContact O-N 3.25Å; L315-K319 HydrophobicContact CD1-CD 4.49Å; L315-K319 HydrophobicContact CG-CD 4.23Å; L315-K319 WeakPolarHBondContact O-CB 3.49Å; L315-K319 WeakPolarHBondContact O-CD 3.33Å; L315-K319 WeakPolarHBondContact O-CG 3.27Å; L315-K319 PolarHBondContact O-N 3.47Å |
| 316 | V | 97.9 | Very high | 97.2 | Very high | 85 Ų | 85 | 100.1 Ų | 100.1 | 52% | 0.515 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.2 | -36.9 | 173.5 | 170.7 | 0 | 0 | 0 | 0 | 111.6 | D312 M313 E314 R320 | D312-V316 WeakPolarHBondContact O-CG2 3.32Å; D312-V316 PolarHBondContact O-N 2.94Å; M313-V316 PolarHBondContact O-N 3.17Å; E314-V316 VanDerWaalsContact C-N 3.33Å; E314-V316 PolarHBondContact O-N 3.11Å; V316-R320 WeakPolarHBondContact O-CB 3.49Å; V316-R320 PolarHBondContact O-N 3.39Å |
| 317 | G | 98.3 | Very high | 97.3 | Very high | 20 Ų | 20 | 105.5 Ų | 105.5 | 21% | 0.206 | 52% | 0.515 | C | S | . | . | H | α-helix | trans | -58.1 | -53.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | M313 E314 R320 Q321 | M313-G317 PolarHBondContact O-N 3.39Å; E314-G317 WeakPolarHBondContact O-CA 3.35Å; E314-G317 PolarHBondContact O-N 3.16Å; E314-G317 VanDerWaalsContact O-N 3.1Å; G317-R320 PolarHBondContact O-N 3.34Å; G317-Q321 PolarHBondContact O-N 3.1Å |
| 318 | I | 98.4 | Very high | 97.5 | Very high | 92 Ų | 92 | 107.2 Ų | 107.2 | 47% | 0.472 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -43 | 179 | -66.5 | 166.1 | 0 | 0 | 0 | 110.8 | E314 R320 Q321 I322 | E314-I318 WeakPolarHBondContact O-CG1 3.44Å; E314-I318 PolarHBondContact O-N 3.49Å; I318-R320 VanDerWaalsContact C-N 3.33Å; I318-R320 PolarHBondContact O-N 2.98Å; I318-Q321 PolarHBondContact O-N 3.24Å; I318-I322 HydrophobicContact CG2-CD1 3.83Å; I318-I322 HydrophobicContact CG2-CG1 4.42Å; I318-I322 WeakPolarHBondContact O-CG1 3.31Å; I318-I322 PolarHBondContact O-N 2.99Å |
| 319 | K | 97.9 | Very high | 97.7 | Very high | 117 Ų | 117 | 106.2 Ų | 106.2 | 51% | 0.509 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -56.9 | -43.9 | 174.4 | -78.4 | 169 | 179 | 173.4 | 0 | 112 | L315 I322 Q323 | L315-K319 HydrophobicContact CD1-CD 4.49Å; L315-K319 HydrophobicContact CG-CD 4.23Å; L315-K319 WeakPolarHBondContact O-CB 3.49Å; L315-K319 WeakPolarHBondContact O-CD 3.33Å; L315-K319 WeakPolarHBondContact O-CG 3.27Å; L315-K319 PolarHBondContact O-N 3.47Å; K319-I322 PolarHBondContact O-N 3.38Å; K319-Q323 WeakPolarHBondContact O-CG 3.37Å; K319-Q323 PolarHBondContact O-N 3.44Å; K319-Q323 VanDerWaalsContact O-N 3.17Å |
| 320 | R | 98.2 | Very high | 97.8 | Very high | 168 Ų | 168 | 101.8 Ų | 101.8 | 63% | 0.634 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.9 | -42.6 | 176.2 | -176.8 | 175.7 | 64.8 | -99.9 | 2.4 | 112.1 | V316 G317 I318 I322 Q323 S324 | V316-R320 WeakPolarHBondContact O-CB 3.49Å; V316-R320 PolarHBondContact O-N 3.39Å; G317-R320 PolarHBondContact O-N 3.34Å; I318-R320 VanDerWaalsContact C-N 3.33Å; I318-R320 PolarHBondContact O-N 2.98Å; R320-I322 PolarHBondContact O-N 2.87Å; R320-Q323 PolarHBondContact O-N 2.97Å; R320-S324 PolarHBondContact O-N 2.96Å; R320-S324 VanDerWaalsContact O-N 3.08Å |
| 321 | Q | 98.2 | Very high | 97.9 | Very high | 121 Ų | 121 | 98.8 Ų | 98.8 | 57% | 0.565 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.6 | -42.3 | 176.1 | -172.6 | 180 | 2.9 | 0 | 0 | 111.8 | G317 I318 Q323 S324 I325 | G317-Q321 PolarHBondContact O-N 3.1Å; I318-Q321 PolarHBondContact O-N 3.24Å; Q321-Q323 VanDerWaalsContact C-N 3.34Å; Q321-Q323 PolarHBondContact O-N 2.95Å; Q321-S324 PolarHBondContact O-N 2.88Å; Q321-I325 HydrophobicContact CG-CD1 4.01Å; Q321-I325 WeakPolarHBondContact O-CG1 3.31Å; Q321-I325 PolarHBondContact O-N 3.41Å |
| 322 | I | 98.4 | Very high | 98 | Very high | 87 Ų | 87 | 97.1 Ų | 97.1 | 45% | 0.446 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.9 | -42 | 175.6 | -71.3 | 165.5 | 0 | 0 | 0 | 111.4 | I318 K319 R320 I325 K326 | I318-I322 HydrophobicContact CG2-CD1 3.83Å; I318-I322 HydrophobicContact CG2-CG1 4.42Å; I318-I322 WeakPolarHBondContact O-CG1 3.31Å; I318-I322 PolarHBondContact O-N 2.99Å; K319-I322 PolarHBondContact O-N 3.38Å; R320-I322 PolarHBondContact O-N 2.87Å; I322-I325 PolarHBondContact O-N 3.02Å; I322-K326 HydrophobicContact CG2-CD 4.44Å; I322-K326 WeakPolarHBondContact O-CB 3.41Å; I322-K326 WeakPolarHBondContact O-CG 2.88Å; I322-K326 PolarHBondContact O-N 3.14Å |
| 323 | Q | 98.2 | Very high | 98 | Very high | 118 Ų | 118 | 100.1 Ų | 100.1 | 55% | 0.551 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -67.3 | -39.6 | 177.7 | -63.3 | -68 | 27.7 | 0 | 0 | 112.3 | K319 R320 Q321 K326 Q327 | K319-Q323 WeakPolarHBondContact O-CG 3.37Å; K319-Q323 PolarHBondContact O-N 3.44Å; K319-Q323 VanDerWaalsContact O-N 3.17Å; R320-Q323 PolarHBondContact O-N 2.97Å; Q321-Q323 VanDerWaalsContact C-N 3.34Å; Q321-Q323 PolarHBondContact O-N 2.95Å; Q323-K326 PolarHBondContact O-N 3Å; Q323-Q327 PolarHBondContact O-N 3.31Å |
| 324 | S | 98.2 | Very high | 97.9 | Very high | 76 Ų | 76 | 100.6 Ų | 100.6 | 53% | 0.531 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.4 | -44.2 | 173.7 | 177.4 | 0 | 0 | 0 | 0 | 112.1 | R320 Q321 Q327 N328 | R320-S324 PolarHBondContact O-N 2.96Å; R320-S324 VanDerWaalsContact O-N 3.08Å; Q321-S324 PolarHBondContact O-N 2.88Å; S324-Q327 PolarHBondContact O-N 3.26Å; S324-N328 PolarHBondContact O-N 3.45Å |
| 325 | I | 98.4 | Very high | 97.8 | Very high | 82 Ų | 82 | 104.2 Ų | 104.2 | 42% | 0.421 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.9 | -42 | 175.3 | -67.5 | 167.6 | 0 | 0 | 0 | 111 | Q321 I322 N328 N329 | Q321-I325 HydrophobicContact CG-CD1 4.01Å; Q321-I325 WeakPolarHBondContact O-CG1 3.31Å; Q321-I325 PolarHBondContact O-N 3.41Å; I322-I325 PolarHBondContact O-N 3.02Å; I325-N328 PolarHBondContact O-N 3.17Å; I325-N329 VanDerWaalsContact O-CB 3.27Å; I325-N329 WeakPolarHBondContact O-CB 3.37Å; I325-N329 PolarHBondContact O-N 2.98Å; I325-N329 PolarHBondContact O-OD1 3.25Å |
| 326 | K | 98.4 | Very high | 97.7 | Very high | 133 Ų | 133 | 106.5 Ų | 106.5 | 58% | 0.578 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -58.6 | -47.5 | 174.9 | -82.5 | -177.5 | 169.5 | -167.1 | 0 | 112 | I322 Q323 N329 S330 | I322-K326 HydrophobicContact CG2-CD 4.44Å; I322-K326 WeakPolarHBondContact O-CB 3.41Å; I322-K326 WeakPolarHBondContact O-CG 2.88Å; I322-K326 PolarHBondContact O-N 3.14Å; Q323-K326 PolarHBondContact O-N 3Å; K326-N329 PolarHBondContact O-N 3.33Å; K326-S330 WeakPolarHBondContact O-CB 3.35Å; K326-S330 PolarHBondContact O-N 3.04Å |
| 327 | Q | 97.6 | Very high | 97.5 | Very high | 153 Ų | 153 | 109.2 Ų | 109.2 | 72% | 0.715 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -63.4 | -46.4 | -179.8 | -171.4 | 177.6 | 7.2 | 0 | 0 | 111.5 | Q323 S324 S330 A331 | Q323-Q327 PolarHBondContact O-N 3.31Å; S324-Q327 PolarHBondContact O-N 3.26Å; Q327-S330 WeakPolarHBondContact O-CB 3.44Å; Q327-S330 PolarHBondContact O-N 3.32Å; Q327-A331 PolarHBondContact O-N 3.49Å; Q327-A331 VanDerWaalsContact O-N 3.15Å |
| 328 | N | 98.3 | Very high | 97 | Very high | 96 Ų | 96 | 113.3 Ų | 113.3 | 51% | 0.513 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.7 | -45 | 177.3 | -170.3 | 43.4 | 0 | 0 | 0 | 111.9 | S324 I325 S330 A331 L332 | S324-N328 PolarHBondContact O-N 3.45Å; I325-N328 PolarHBondContact O-N 3.17Å; N328-S330 VanDerWaalsContact C-N 3.26Å; N328-S330 PolarHBondContact O-N 3.24Å; N328-A331 PolarHBondContact O-N 2.65Å; N328-L332 WeakPolarHBondContact O-CG 3.38Å; N328-L332 PolarHBondContact O-N 3.09Å |
| 329 | N | 97.9 | Very high | 96.7 | Very high | 84 Ų | 84 | 110.8 Ų | 110.8 | 45% | 0.449 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.9 | -29.7 | 176.7 | -71.1 | 2.4 | 0 | 0 | 0 | 112.4 | I325 K326 L332 K333 | I325-N329 VanDerWaalsContact O-CB 3.27Å; I325-N329 WeakPolarHBondContact O-CB 3.37Å; I325-N329 PolarHBondContact O-N 2.98Å; I325-N329 PolarHBondContact O-OD1 3.25Å; K326-N329 PolarHBondContact O-N 3.33Å; N329-L332 PolarHBondContact O-N 2.81Å; N329-K333 WeakPolarHBondContact O-CG 3.06Å; N329-K333 PolarHBondContact O-N 2.95Å |
| 330 | S | 97.6 | Very high | 96.6 | Very high | 75 Ų | 75 | 110 Ų | 110 | 52% | 0.524 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.9 | -48.3 | 173.2 | -159.3 | 0 | 0 | 0 | 0 | 111.3 | K326 Q327 N328 L332 K333 E334 | K326-S330 WeakPolarHBondContact O-CB 3.35Å; K326-S330 PolarHBondContact O-N 3.04Å; Q327-S330 WeakPolarHBondContact O-CB 3.44Å; Q327-S330 PolarHBondContact O-N 3.32Å; N328-S330 VanDerWaalsContact C-N 3.26Å; N328-S330 PolarHBondContact O-N 3.24Å; S330-L332 VanDerWaalsContact C-N 3.29Å; S330-L332 PolarHBondContact O-N 3.44Å; S330-K333 WeakPolarHBondContact O-CB 3.47Å; S330-K333 PolarHBondContact O-N 2.95Å; S330-K333 VanDerWaalsContact O-N 3.16Å; S330-E334 PolarHBondContact O-N 2.87Å |
| 331 | A | 97.5 | Very high | 96.2 | Very high | 39 Ų | 39 | 107 Ų | 107 | 32% | 0.322 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66 | -29.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113 | Q327 N328 K335 | Q327-A331 PolarHBondContact O-N 3.49Å; Q327-A331 VanDerWaalsContact O-N 3.15Å; N328-A331 PolarHBondContact O-N 2.65Å; A331-K335 WeakPolarHBondContact O-CG 3.33Å; A331-K335 PolarHBondContact O-N 3.36Å |
| 332 | L | 97.8 | Very high | 95.9 | Very high | 83 Ų | 83 | 107.5 Ų | 107.5 | 44% | 0.435 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -72.7 | -35.4 | 171.8 | -69.9 | 173.5 | 0 | 0 | 0 | 112.6 | N328 N329 S330 L336 | N328-L332 WeakPolarHBondContact O-CG 3.38Å; N328-L332 PolarHBondContact O-N 3.09Å; N329-L332 PolarHBondContact O-N 2.81Å; S330-L332 VanDerWaalsContact C-N 3.29Å; S330-L332 PolarHBondContact O-N 3.44Å; L332-L336 WeakPolarHBondContact O-CG 3.38Å |
| 333 | K | 97.3 | Very high | 95.6 | Very high | 159 Ų | 159 | 111.2 Ų | 111.2 | 69% | 0.691 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -66 | -45 | 172.3 | -80.6 | -174.9 | 71.4 | -157.6 | 0 | 112 | N329 S330 K335 L336 D337 | N329-K333 WeakPolarHBondContact O-CG 3.06Å; N329-K333 PolarHBondContact O-N 2.95Å; S330-K333 WeakPolarHBondContact O-CB 3.47Å; S330-K333 PolarHBondContact O-N 2.95Å; S330-K333 VanDerWaalsContact O-N 3.16Å; K333-K335 VanDerWaalsContact C-N 3.29Å; K333-K335 PolarHBondContact O-N 2.98Å; K333-L336 CarbonylContact O-C 3.42Å; K333-L336 WeakPolarHBondContact O-CA 3.39Å; K333-L336 PolarHBondContact O-N 2.81Å; K333-D337 PolarHBondContact O-N 3.12Å; K333-D337 VanDerWaalsContact O-N 3.12Å |
| 334 | E | 96.8 | Very high | 95.4 | Very high | 150 Ų | 150 | 113.3 Ų | 113.3 | 70% | 0.701 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -57 | -42.3 | 177.7 | -174.6 | -177.9 | 175.3 | 0 | 0 | 111.7 | S330 L336 D337 | S330-E334 PolarHBondContact O-N 2.87Å; E334-L336 PolarHBondContact O-N 2.95Å; E334-L336 VanDerWaalsContact O-N 3.16Å; E334-D337 WeakPolarHBondContact O-CB 3.21Å; E334-D337 PolarHBondContact O-N 3.24Å |
| 335 | K | 96.1 | Very high | 95.1 | Very high | 170 Ų | 170 | 115.4 Ų | 115.4 | 74% | 0.739 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.5 | -11.9 | 173.4 | -73.4 | 174.7 | 179.3 | -177.1 | 0 | 115 | A331 K333 | A331-K335 WeakPolarHBondContact O-CG 3.33Å; A331-K335 PolarHBondContact O-N 3.36Å; K333-K335 VanDerWaalsContact C-N 3.29Å; K333-K335 PolarHBondContact O-N 2.98Å |
| 336 | L | 95.3 | Very high | 94.8 | Very high | 128 Ų | 128 | 116.8 Ų | 116.8 | 67% | 0.67 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.7 | 7 | -179.3 | -65.2 | 173.7 | 0 | 0 | 0 | 112.5 | L332 K333 E334 V338 G339 | L332-L336 WeakPolarHBondContact O-CG 3.38Å; K333-L336 CarbonylContact O-C 3.42Å; K333-L336 WeakPolarHBondContact O-CA 3.39Å; K333-L336 PolarHBondContact O-N 2.81Å; E334-L336 PolarHBondContact O-N 2.95Å; E334-L336 VanDerWaalsContact O-N 3.16Å; L336-V338 VanDerWaalsContact C-N 3.29Å; L336-V338 PolarHBondContact O-N 2.89Å; L336-G339 WeakPolarHBondContact O-CA 3.25Å; L336-G339 PolarHBondContact O-N 2.91Å |
| 337 | D | 92.3 | Very high | 94.3 | Very high | 143 Ų | 143 | 117.9 Ų | 117.9 | 77% | 0.765 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | -34.5 | -174.5 | -166.5 | 69.5 | 0 | 0 | 0 | 113 | K333 E334 G339 | K333-D337 PolarHBondContact O-N 3.12Å; K333-D337 VanDerWaalsContact O-N 3.12Å; E334-D337 WeakPolarHBondContact O-CB 3.21Å; E334-D337 PolarHBondContact O-N 3.24Å; D337-G339 PolarHBondContact O-N 2.92Å |
| 338 | V | 89.3 | Confident | 93.9 | Very high | 105 Ų | 105 | 115.8 Ų | 115.8 | 64% | 0.636 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | -12.9 | 174.5 | -175.9 | 0 | 0 | 0 | 0 | 112.7 | L336 N342 | L336-V338 VanDerWaalsContact C-N 3.29Å; L336-V338 PolarHBondContact O-N 2.89Å; V338-N342 WeakPolarHBondContact CG1-ND2 3.48Å |
| 339 | G | 91.9 | Very high | 93.3 | Very high | 40 Ų | 40 | 118.2 Ų | 118.2 | 41% | 0.412 | 63% | 0.628 | S | S | . | * | trans | 62.4 | -149.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | L336 D337 | L336-G339 WeakPolarHBondContact O-CA 3.25Å; L336-G339 PolarHBondContact O-N 2.91Å; D337-G339 PolarHBondContact O-N 2.92Å | ||
| 340 | V | 94.7 | Very high | 92.9 | Very high | 99 Ų | 99 | 119.1 Ų | 119.1 | 60% | 0.6 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -123.7 | 0.1 | 177.2 | -63.3 | 0 | 0 | 0 | 0 | 113.6 | N342 F343 R344 | V340-N342 VanDerWaalsContact C-N 3.31Å; V340-N342 PolarHBondContact O-N 3.34Å; V340-F343 CarbonylContact O-C 3.52Å; V340-F343 WeakPolarHBondContact O-CA 3.33Å; V340-F343 WeakPolarHBondContact O-CB 3.35Å; V340-F343 PolarHBondContact O-N 3.43Å; V340-R344 PolarHBondContact O-N 3.27Å |
| 341 | D | 90.4 | Very high | 92.7 | Very high | 105 Ų | 105 | 124.9 Ų | 124.9 | 56% | 0.561 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -70.2 | -27.4 | -170.6 | -62.7 | -60 | 0 | 0 | 0 | 113.2 | F343 R344 | D341-F343 PolarHBondContact O-N 3.41Å; D341-R344 WeakPolarHBondContact O-CB 3.46Å; D341-R344 PolarHBondContact O-N 3.28Å; D341-R344 VanDerWaalsContact O-N 3.13Å; D341-R344 IonicContact OD1-CZ 2.7Å; D341-R344 IonicContact OD1-NE 3.45Å; D341-R344 PolarHBondContact OD1-NE 2.79Å; D341-R344 IonicContact OD1-NH2 3.63Å |
| 342 | N | 90.8 | Very high | 92.5 | Very high | 133 Ų | 133 | 129.6 Ų | 129.6 | 71% | 0.711 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -64.6 | -14.2 | 168.6 | -67.1 | -46.4 | 0 | 0 | 0 | 113.8 | V338 V340 | V338-N342 WeakPolarHBondContact CG1-ND2 3.48Å; V340-N342 VanDerWaalsContact C-N 3.31Å; V340-N342 PolarHBondContact O-N 3.34Å |
| 343 | F | 92.6 | Very high | 92.3 | Very high | 165 Ų | 165 | 128.8 Ų | 128.8 | 72% | 0.724 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -110 | 1.4 | 176.5 | -53 | -80.1 | 0 | 0 | 0 | 112.5 | V340 D341 V345 | V340-F343 CarbonylContact O-C 3.52Å; V340-F343 WeakPolarHBondContact O-CA 3.33Å; V340-F343 WeakPolarHBondContact O-CB 3.35Å; V340-F343 PolarHBondContact O-N 3.43Å; D341-F343 PolarHBondContact O-N 3.41Å; F343-V345 PolarHBondContact O-N 3.31Å |
| 344 | R | 93.5 | Very high | 92.2 | Very high | 161 Ų | 161 | 127.1 Ų | 127.1 | 61% | 0.608 | 66% | 0.658 | S | S | * | * | trans | -78 | 105.3 | 179.9 | -179 | -173.3 | -74.2 | -91 | 2.7 | 110.2 | V340 D341 | V340-R344 PolarHBondContact O-N 3.27Å; D341-R344 WeakPolarHBondContact O-CB 3.46Å; D341-R344 PolarHBondContact O-N 3.28Å; D341-R344 VanDerWaalsContact O-N 3.13Å; D341-R344 IonicContact OD1-CZ 2.7Å; D341-R344 IonicContact OD1-NE 3.45Å; D341-R344 PolarHBondContact OD1-NE 2.79Å; D341-R344 IonicContact OD1-NH2 3.63Å | ||
| 345 | V | 92.8 | Very high | 92.2 | Very high | 120 Ų | 120 | 129 Ų | 129 | 73% | 0.727 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 138.9 | 169.6 | -175.3 | 0 | 0 | 0 | 0 | 109.8 | F343 | F343-V345 PolarHBondContact O-N 3.31Š|
| 346 | P | 91.6 | Very high | 92.3 | Very high | 111 Ų | 111 | 123 Ų | 123 | 72% | 0.721 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 142.2 | 175.9 | -24.9 | 35.1 | 0 | 0 | 0 | 113.7 | V348 | P346-V348 PolarHBondContact O-N 3.31Š|
| 347 | E | 88.6 | Confident | 92.4 | Very high | 156 Ų | 156 | 119.4 Ų | 119.4 | 73% | 0.729 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 116.9 | -179.9 | -70.8 | 177.8 | -169.8 | 0 | 0 | 112.6 | N349 | E347-N349 PolarHBondContact O-N 3.03Å; E347-N349 PolarHBondContact O-ND2 3.45Å |
| 348 | V | 88.6 | Confident | 92.7 | Very high | 110 Ų | 110 | 117.6 Ų | 117.6 | 67% | 0.667 | 61% | 0.609 | S | S | * | * | trans | -86 | 89 | -176.4 | 178 | 0 | 0 | 0 | 0 | 110.7 | P346 Q350 | P346-V348 PolarHBondContact O-N 3.31Å; V348-Q350 HydrophobicContact CG1-CG 3.99Å; V348-Q350 PolarHBondContact O-N 3.31Å | ||
| 349 | N | 85.2 | Confident | 93 | Very high | 147 Ų | 147 | 119.4 Ų | 119.4 | 79% | 0.786 | 61% | 0.61 | S | S | * | * | trans | -77.2 | 82 | -178.9 | -82.6 | -89.9 | 0 | 0 | 0 | 112.7 | E347 | E347-N349 PolarHBondContact O-N 3.03Å; E347-N349 PolarHBondContact O-ND2 3.45Å | ||
| 350 | Q | 89.9 | Confident | 93.3 | Very high | 103 Ų | 103 | 118.1 Ų | 118.1 | 48% | 0.481 | 59% | 0.594 | S | S | . | * | P | Polyproline II helix | trans | -89.7 | 154.2 | 171.9 | -73.2 | -175.9 | 54.5 | 0 | 0 | 112.6 | V348 N384 | V348-Q350 HydrophobicContact CG1-CG 3.99Å; V348-Q350 PolarHBondContact O-N 3.31Å; Q350-N384 HydrophobicContact CB-CB 4.32Å |
| 351 | K | 93.1 | Very high | 93.5 | Very high | 195 Ų | 195 | 114.8 Ų | 114.8 | 85% | 0.848 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 134.8 | 173.8 | -67.2 | -177.1 | 179.6 | 179.2 | 0 | 110.1 | N353 | K351-N353 PolarHBondContact O-N 3.18Š|
| 352 | F | 94.6 | Very high | 93.8 | Very high | 138 Ų | 138 | 114.3 Ų | 114.3 | 61% | 0.605 | 57% | 0.568 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 135.7 | 177.5 | -63.2 | -60.5 | 0 | 0 | 0 | 112.4 | N384 K385 | F352-N384 CarbonylContact C-O 3.56Å; F352-N384 VanDerWaalsContact CA-O 3.29Å; F352-N384 WeakPolarHBondContact CA-O 3.26Å; F352-K385 VanDerWaalsContact CD1-C 3.46Å; F352-K385 WeakPolarHBondContact CE1-O 3.32Å |
| 353 | N | 93.9 | Very high | 94.1 | Very high | 66 Ų | 66 | 111 Ų | 111 | 35% | 0.353 | 55% | 0.55 | S | S | . | * | trans | -122.6 | 136.1 | -177.4 | -173.9 | -5.1 | 0 | 0 | 0 | 110.6 | K351 R355 N384 K385 Q389 | K351-N353 PolarHBondContact O-N 3.18Å; N353-R355 PolarHBondContact OD1-N 3.46Å; N353-N384 PolarHBondContact N-O 3.21Å; N353-K385 WeakPolarHBondContact O-CD 3.32Å; N353-Q389 PolarHBondContact O-NE2 3.48Å | ||
| 354 | T | 95.1 | Very high | 94.4 | Very high | 125 Ų | 125 | 103.1 Ų | 103.1 | 77% | 0.767 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -83.1 | -20.8 | 179.7 | 53.7 | 0 | 0 | 0 | 0 | 114 | ||
| 355 | R | 96.8 | Very high | 94.6 | Very high | 189 Ų | 189 | 96.8 Ų | 96.8 | 71% | 0.713 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -78.1 | 141.5 | 174.2 | -171.9 | 173.6 | -63.1 | -81.8 | -1.4 | 109.9 | N353 K385 | N353-R355 PolarHBondContact OD1-N 3.46Å; R355-K385 WeakPolarHBondContact O-CE 3.32Å; R355-K385 PolarHBondContact O-NZ 3.42Å |
| 356 | W | 97.6 | Very high | 94.8 | Very high | 43 Ų | 43 | 97.1 Ų | 97.1 | 16% | 0.163 | 49% | 0.489 | C | S | . | . | trans | -104.5 | 115.4 | 171.4 | -75.6 | 90.8 | 0 | 0 | 0 | 109.9 | E360 Q361 A364 I382 K385 Q389 F393 | W356-E360 VanDerWaalsContact CA-OE2 3.26Å; W356-E360 WeakPolarHBondContact CA-OE2 3.47Å; W356-E360 HydrophobicContact CE3-CB 3.93Å; W356-E360 HydrophobicContact CZ3-CB 4.3Å; W356-Q361 HydrophobicContact CB-CG 4.07Å; W356-Q361 HydrophobicContact CE3-CG 4.14Å; W356-Q361 PolarHBondContact O-NE2 3.05Å; W356-A364 HydrophobicContact CH2-CB 4.44Å; W356-A364 HydrophobicContact CZ3-CB 3.98Å; W356-I382 HydrophobicContact CH2-CD1 4Å; W356-I382 HydrophobicContact CZ3-CD1 4.06Å; W356-K385 HydrophobicContact CD2-CD 4.15Å; W356-K385 VanDerWaalsContact CD2-CE 3.46Å; W356-K385 HydrophobicContact CE3-CD 4.38Å; W356-K385 HydrophobicContact CE3-CG 4.45Å; W356-K385 HydrophobicContact CH2-CB 4.21Å; W356-K385 HydrophobicContact CH2-CD 3.98Å; W356-K385 HydrophobicContact CH2-CG 3.64Å; W356-K385 HydrophobicContact CZ2-CB 4.38Å; W356-K385 HydrophobicContact CZ2-CD 3.68Å; W356-K385 HydrophobicContact CZ2-CG 3.85Å; W356-K385 HydrophobicContact CZ3-CD 4.31Å; W356-K385 HydrophobicContact CZ3-CG 3.95Å; W356-Q389 HydrophobicContact CZ2-CB 4.39Å; W356-F393 HydrophobicContact CD2-CD2 4.13Å; W356-F393 HydrophobicContact CE3-CD2 4.1Å; W356-F393 HydrophobicContact CE3-CE2 4.42Å; W356-F393 HydrophobicContact CH2-CB 3.89Å; W356-F393 HydrophobicContact CH2-CD2 4.1Å; W356-F393 AromaticContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CZ2-CB 3.61Å; W356-F393 HydrophobicContact CZ2-CD2 4.14Å; W356-F393 HydrophobicContact CZ2-CG 4.08Å; W356-F393 HydrophobicContact CZ3-CD2 4.08Å; W356-F393 HydrophobicContact CZ3-CE2 4.5Å; W356-F393 HydrophobicContact CZ3-CG 4.33Å | ||
| 357 | T | 97.4 | Very high | 95.1 | Very high | 54 Ų | 54 | 92 Ų | 92 | 33% | 0.331 | 46% | 0.455 | S | S | . | . | trans | -78.4 | 165.5 | 169.9 | 74.3 | 0 | 0 | 0 | 0 | 110.5 | E359 E360 Q361 | T357-E359 VanDerWaalsContact C-N 3.29Å; T357-E359 PolarHBondContact O-N 3.08Å; T357-E360 PolarHBondContact N-OE2 3.49Å; T357-E360 PolarHBondContact O-N 3.23Å; T357-E360 VanDerWaalsContact OG1-CG 3.23Å; T357-E360 WeakPolarHBondContact OG1-CG 3.34Å; T357-E360 PolarHBondContact OG1-N 3.06Å; T357-E360 VanDerWaalsContact OG1-N 3.1Å; T357-Q361 WeakPolarHBondContact O-CG 3.47Å; T357-Q361 PolarHBondContact O-N 3.49Å; T357-Q361 VanDerWaalsContact O-N 3.13Å; T357-Q361 PolarHBondContact O-NE2 2.9Å | ||
| 358 | T | 97.3 | Very high | 95.5 | Very high | 105 Ų | 105 | 84.5 Ų | 84.5 | 64% | 0.644 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -63.7 | -37.4 | 175.6 | -46.3 | 0 | 0 | 0 | 0 | 111.6 | Q361 L362 | T358-Q361 PolarHBondContact O-N 2.94Å; T358-L362 HydrophobicContact CG2-CD1 4.31Å; T358-L362 WeakPolarHBondContact O-CG 3.4Å; T358-L362 PolarHBondContact O-N 3.31Å |
| 359 | E | 97.6 | Very high | 95.9 | Very high | 142 Ų | 142 | 82.2 Ų | 82.2 | 66% | 0.664 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -61 | -50.1 | 175.3 | 179.7 | 177.9 | -156.6 | 0 | 0 | 111.7 | T357 Q361 L362 L363 | T357-E359 VanDerWaalsContact C-N 3.29Å; T357-E359 PolarHBondContact O-N 3.08Å; E359-Q361 VanDerWaalsContact C-N 3.27Å; E359-Q361 PolarHBondContact O-N 3.25Å; E359-L362 PolarHBondContact O-N 3.23Å; E359-L363 HydrophobicContact CG-CD1 4.2Å; E359-L363 WeakPolarHBondContact O-CB 3.41Å; E359-L363 WeakPolarHBondContact O-CG 3.44Å; E359-L363 PolarHBondContact O-N 3.25Å |
| 360 | E | 97.6 | Very high | 96.4 | Very high | 14 Ų | 14 | 81.4 Ų | 81.4 | 7% | 0.065 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.3 | -34.4 | 177.2 | -68.3 | 164.4 | 169.3 | 0 | 0 | 112.5 | W356 T357 A364 I382 N384 K385 | W356-E360 VanDerWaalsContact CA-OE2 3.26Å; W356-E360 WeakPolarHBondContact CA-OE2 3.47Å; W356-E360 HydrophobicContact CE3-CB 3.93Å; W356-E360 HydrophobicContact CZ3-CB 4.3Å; T357-E360 PolarHBondContact N-OE2 3.49Å; T357-E360 PolarHBondContact O-N 3.23Å; T357-E360 VanDerWaalsContact OG1-CG 3.23Å; T357-E360 WeakPolarHBondContact OG1-CG 3.34Å; T357-E360 PolarHBondContact OG1-N 3.06Å; T357-E360 VanDerWaalsContact OG1-N 3.1Å; E360-A364 VanDerWaalsContact O-CB 3.31Å; E360-A364 WeakPolarHBondContact O-CB 3.47Å; E360-A364 PolarHBondContact O-N 3.26Å; E360-I382 HydrophobicContact CB-CG2 4.31Å; E360-I382 HydrophobicContact CG-CG2 4.26Å; E360-N384 PolarHBondContact OE1-ND2 3.15Å; E360-N384 PolarHBondContact OE1-OD1 3.44Å; E360-K385 IonicContact OE1-NZ 2.97Å; E360-K385 PolarHBondContact OE1-NZ 2.88Å; E360-K385 VanDerWaalsContact OE1-NZ 3.07Å; E360-K385 WeakPolarHBondContact OE2-CE 3.44Å; E360-K385 IonicContact OE2-NZ 3.27Å; E360-K385 PolarHBondContact OE2-NZ 3.23Å |
| 361 | Q | 97.6 | Very high | 96.7 | Very high | 29 Ų | 29 | 80.4 Ų | 80.4 | 14% | 0.136 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -69.8 | -42.3 | 176.2 | -68.9 | 168.6 | 64.6 | 0 | 0 | 111.6 | W356 T357 T358 E359 A364 V365 F393 Y397 F401 | W356-Q361 HydrophobicContact CB-CG 4.07Å; W356-Q361 HydrophobicContact CE3-CG 4.14Å; W356-Q361 PolarHBondContact O-NE2 3.05Å; T357-Q361 WeakPolarHBondContact O-CG 3.47Å; T357-Q361 PolarHBondContact O-N 3.49Å; T357-Q361 VanDerWaalsContact O-N 3.13Å; T357-Q361 PolarHBondContact O-NE2 2.9Å; T358-Q361 PolarHBondContact O-N 2.94Å; E359-Q361 VanDerWaalsContact C-N 3.27Å; E359-Q361 PolarHBondContact O-N 3.25Å; Q361-A364 PolarHBondContact O-N 3.01Å; Q361-V365 WeakPolarHBondContact O-CG2 3.39Å; Q361-V365 PolarHBondContact O-N 2.86Å; Q361-F393 HydrophobicContact CB-CE2 4.25Å; Q361-F393 HydrophobicContact CB-CZ 4.49Å; Q361-F393 HydrophobicContact CG-CE2 3.93Å; Q361-Y397 HydrophobicContact CG-CE1 4.41Å; Q361-F401 HydrophobicContact CB-CE2 4.02Å; Q361-F401 HydrophobicContact CB-CZ 4.11Å; Q361-F401 HydrophobicContact CG-CE2 4.48Å |
| 362 | L | 97.7 | Very high | 96.9 | Very high | 94 Ų | 94 | 71.1 Ų | 71.1 | 49% | 0.492 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -69.3 | -36.7 | 176.2 | -69 | 171.4 | 0 | 0 | 0 | 112.1 | T358 E359 Q366 | T358-L362 HydrophobicContact CG2-CD1 4.31Å; T358-L362 WeakPolarHBondContact O-CG 3.4Å; T358-L362 PolarHBondContact O-N 3.31Å; E359-L362 PolarHBondContact O-N 3.23Å; L362-Q366 WeakPolarHBondContact O-CG 3.4Å; L362-Q366 PolarHBondContact O-N 2.61Å; L362-Q366 VanDerWaalsContact O-N 3.11Å; L362-Q366 PolarHBondContact O-NE2 3.28Å |
| 363 | L | 98 | Very high | 96.9 | Very high | 63 Ų | 63 | 70.3 Ų | 70.3 | 33% | 0.33 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.5 | -42.5 | 170.8 | -73.7 | 172.5 | 0 | 0 | 0 | 111.2 | E359 Q366 A367 | E359-L363 HydrophobicContact CG-CD1 4.2Å; E359-L363 WeakPolarHBondContact O-CB 3.41Å; E359-L363 WeakPolarHBondContact O-CG 3.44Å; E359-L363 PolarHBondContact O-N 3.25Å; L363-Q366 PolarHBondContact O-N 3.27Å; L363-A367 VanDerWaalsContact O-CB 3.27Å; L363-A367 WeakPolarHBondContact O-CB 3.46Å; L363-A367 PolarHBondContact O-N 3.18Å |
| 364 | A | 97.8 | Very high | 97.1 | Very high | 0 Ų | 0 | 71.1 Ų | 71.1 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.5 | -47.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | W356 E360 Q361 Q366 A367 I368 I382 F393 | W356-A364 HydrophobicContact CH2-CB 4.44Å; W356-A364 HydrophobicContact CZ3-CB 3.98Å; E360-A364 VanDerWaalsContact O-CB 3.31Å; E360-A364 WeakPolarHBondContact O-CB 3.47Å; E360-A364 PolarHBondContact O-N 3.26Å; Q361-A364 PolarHBondContact O-N 3.01Å; A364-Q366 PolarHBondContact O-N 3.35Å; A364-A367 PolarHBondContact O-N 3.02Å; A364-I368 WeakPolarHBondContact O-CG1 3.33Å; A364-I368 PolarHBondContact O-N 3.1Å; A364-I382 HydrophobicContact CB-CD1 3.77Å; A364-F393 HydrophobicContact CB-CD1 3.96Å; A364-F393 HydrophobicContact CB-CE1 3.53Å; A364-F393 HydrophobicContact CB-CZ 3.85Å |
| 365 | V | 97.9 | Very high | 97.2 | Very high | 29 Ų | 29 | 67.6 Ų | 67.6 | 18% | 0.176 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.1 | -44.1 | 177.9 | 175.6 | 0 | 0 | 0 | 0 | 111.7 | Q361 A367 I368 R369 F393 F401 L403 V406 | Q361-V365 WeakPolarHBondContact O-CG2 3.39Å; Q361-V365 PolarHBondContact O-N 2.86Å; V365-A367 PolarHBondContact O-N 3.02Å; V365-I368 PolarHBondContact O-N 2.96Å; V365-R369 PolarHBondContact O-N 2.96Å; V365-F393 HydrophobicContact CG2-CZ 4.33Å; V365-F401 HydrophobicContact CG2-CB 3.71Å; V365-F401 HydrophobicContact CG2-CD1 4.43Å; V365-F401 HydrophobicContact CG2-CD2 3.63Å; V365-F401 HydrophobicContact CG2-CE2 4.32Å; V365-F401 HydrophobicContact CG2-CG 3.7Å; V365-L403 HydrophobicContact CG2-CD2 4.13Å; V365-V406 HydrophobicContact CG1-CG2 4.47Å |
| 366 | Q | 97.5 | Very high | 97.3 | Very high | 126 Ų | 126 | 63.2 Ų | 63.2 | 59% | 0.589 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -64.4 | -38.2 | 175.9 | -73.3 | 168.8 | 92.2 | 0 | 0 | 112.6 | L362 L363 A364 R369 K370 | L362-Q366 WeakPolarHBondContact O-CG 3.4Å; L362-Q366 PolarHBondContact O-N 2.61Å; L362-Q366 VanDerWaalsContact O-N 3.11Å; L362-Q366 PolarHBondContact O-NE2 3.28Å; L363-Q366 PolarHBondContact O-N 3.27Å; A364-Q366 PolarHBondContact O-N 3.35Å; Q366-R369 PolarHBondContact O-N 3.22Å; Q366-K370 WeakPolarHBondContact O-CB 3.45Å; Q366-K370 PolarHBondContact O-N 3.12Å |
| 367 | A | 97.8 | Very high | 97.3 | Very high | 3 Ų | 3 | 62 Ų | 62 | 3% | 0.025 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.8 | -40.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | L363 A364 V365 R369 K370 Y371 I378 V381 | L363-A367 VanDerWaalsContact O-CB 3.27Å; L363-A367 WeakPolarHBondContact O-CB 3.46Å; L363-A367 PolarHBondContact O-N 3.18Å; A364-A367 PolarHBondContact O-N 3.02Å; V365-A367 PolarHBondContact O-N 3.02Å; A367-R369 VanDerWaalsContact C-N 3.31Å; A367-R369 PolarHBondContact O-N 3.17Å; A367-K370 PolarHBondContact O-N 3.2Å; A367-K370 VanDerWaalsContact O-N 3.11Å; A367-Y371 HydrophobicContact CB-CD2 4.18Å; A367-Y371 WeakPolarHBondContact O-CB 3.43Å; A367-Y371 VanDerWaalsContact O-CD2 3.26Å; A367-Y371 WeakPolarHBondContact O-CD2 3.43Å; A367-Y371 PolarHBondContact O-N 2.76Å; A367-I378 HydrophobicContact CB-CB 4.22Å; A367-I378 HydrophobicContact CB-CG1 3.88Å; A367-I378 HydrophobicContact CB-CG2 3.96Å; A367-V381 HydrophobicContact CB-CB 4.43Å; A367-V381 HydrophobicContact CB-CG1 4.11Å |
| 368 | I | 97 | Very high | 97.3 | Very high | 0 Ų | 0 | 59.5 Ų | 59.5 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -59.3 | -44.1 | 172.8 | -66.2 | 168 | 0 | 0 | 0 | 110.4 | A364 V365 K370 G372 I378 F393 F394 L403 V406 L407 | A364-I368 WeakPolarHBondContact O-CG1 3.33Å; A364-I368 PolarHBondContact O-N 3.1Å; V365-I368 PolarHBondContact O-N 2.96Å; I368-K370 PolarHBondContact O-N 3.3Å; I368-G372 VanDerWaalsContact O-CA 3.26Å; I368-G372 WeakPolarHBondContact O-CA 3.45Å; I368-G372 PolarHBondContact O-N 3.27Å; I368-I378 HydrophobicContact CG1-CD1 3.87Å; I368-F393 HydrophobicContact CD1-CD1 4.18Å; I368-F393 HydrophobicContact CD1-CE1 3.95Å; I368-F394 HydrophobicContact CB-CZ 4.14Å; I368-F394 HydrophobicContact CD1-CD1 4.36Å; I368-F394 HydrophobicContact CD1-CD2 4.07Å; I368-F394 HydrophobicContact CD1-CE1 3.93Å; I368-F394 HydrophobicContact CD1-CE2 3.63Å; I368-F394 HydrophobicContact CD1-CG 4.45Å; I368-F394 HydrophobicContact CD1-CZ 3.59Å; I368-F394 HydrophobicContact CG1-CE1 4.13Å; I368-F394 HydrophobicContact CG1-CE2 3.61Å; I368-F394 HydrophobicContact CG1-CZ 3.41Å; I368-F394 VanDerWaalsContact CG1-CZ 3.41Å; I368-F394 HydrophobicContact CG2-CE1 3.8Å; I368-F394 HydrophobicContact CG2-CZ 3.67Å; I368-L403 HydrophobicContact CD1-CD1 4.16Å; I368-L403 HydrophobicContact CD1-CD2 3.9Å; I368-V406 HydrophobicContact CB-CG1 4.45Å; I368-V406 HydrophobicContact CG2-CG1 4.01Å; I368-L407 HydrophobicContact CG2-CD2 4.05Å; I368-L407 HydrophobicContact CG2-CG 4.18Å |
| 369 | R | 96.3 | Very high | 97.3 | Very high | 62 Ų | 62 | 54.7 Ų | 54.7 | 23% | 0.234 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.1 | -22.3 | 177.1 | -173.6 | 49 | -175.9 | 77.8 | -0.9 | 114.4 | V365 Q366 A367 V406 E409 E413 | V365-R369 PolarHBondContact O-N 2.96Å; Q366-R369 PolarHBondContact O-N 3.22Å; A367-R369 VanDerWaalsContact C-N 3.31Å; A367-R369 PolarHBondContact O-N 3.17Å; R369-V406 HydrophobicContact CB-CG1 3.62Å; R369-V406 HydrophobicContact CG-CG1 4.27Å; R369-E409 IonicContact CZ-OE2 2.65Å; R369-E409 VanDerWaalsContact CZ-OE2 3.27Å; R369-E409 VanDerWaalsContact NE-CB 3.31Å; R369-E409 IonicContact NE-OE2 3.34Å; R369-E409 PolarHBondContact NE-OE2 3.02Å; R369-E409 IonicContact NH2-OE2 3.64Å; R369-E409 PolarHBondContact NH2-OE2 3.06Å; R369-E413 IonicContact CZ-OE1 3.81Å; R369-E413 IonicContact CZ-OE2 2.88Å; R369-E413 IonicContact NH1-OE1 2.67Å; R369-E413 PolarHBondContact NH1-OE1 2.79Å; R369-E413 IonicContact NH1-OE2 2.71Å; R369-E413 PolarHBondContact NH1-OE2 3.19Å; R369-E413 IonicContact NH2-OE1 3.15Å; R369-E413 PolarHBondContact NH2-OE1 3.08Å; R369-E413 IonicContact NH2-OE2 3.03Å |
| 370 | K | 96.2 | Very high | 97.2 | Very high | 130 Ų | 130 | 52.9 Ų | 52.9 | 57% | 0.565 | 25% | 0.25 | S | S | * | . | H | α-helix | trans | -103.5 | -32.4 | -175.7 | -175.6 | 170.3 | 179.7 | 61.2 | 0 | 114.2 | Q366 A367 I368 W410 | Q366-K370 WeakPolarHBondContact O-CB 3.45Å; Q366-K370 PolarHBondContact O-N 3.12Å; A367-K370 PolarHBondContact O-N 3.2Å; A367-K370 VanDerWaalsContact O-N 3.11Å; I368-K370 PolarHBondContact O-N 3.3Å; K370-W410 VanDerWaalsContact C-CD1 3.5Å; K370-W410 PolarHBondContact O-NE1 3.08Å; K370-W410 VanDerWaalsContact O-NE1 3.11Å |
| 371 | Y | 96.8 | Very high | 97.2 | Very high | 81 Ų | 81 | 55.4 Ų | 55.4 | 32% | 0.318 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -120.1 | 0.7 | -172.7 | -57.3 | -76.6 | 0 | 0 | 0 | 113 | A367 R373 D374 A377 V381 | A367-Y371 HydrophobicContact CB-CD2 4.18Å; A367-Y371 WeakPolarHBondContact O-CB 3.43Å; A367-Y371 VanDerWaalsContact O-CD2 3.26Å; A367-Y371 WeakPolarHBondContact O-CD2 3.43Å; A367-Y371 PolarHBondContact O-N 2.76Å; Y371-R373 PolarHBondContact O-N 2.94Å; Y371-D374 PolarHBondContact O-N 3.01Å; Y371-A377 HydrophobicContact CD1-CB 3.79Å; Y371-A377 HydrophobicContact CD2-CB 4.45Å; Y371-A377 HydrophobicContact CE1-CB 4.27Å; Y371-A377 HydrophobicContact CG-CB 3.9Å; Y371-V381 HydrophobicContact CE2-CG2 3.88Å |
| 372 | G | 95.8 | Very high | 97.1 | Very high | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 26% | 0.263 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 61.3 | -107.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | I368 F394 W410 | I368-G372 VanDerWaalsContact O-CA 3.26Å; I368-G372 WeakPolarHBondContact O-CA 3.45Å; I368-G372 PolarHBondContact O-N 3.27Å; G372-F394 WeakPolarHBondContact O-CZ 3.34Å; G372-W410 VanDerWaalsContact CA-CD2 3.41Å |
| 373 | R | 96.3 | Very high | 97 | Very high | 121 Ų | 121 | 51.4 Ų | 51.4 | 46% | 0.457 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.2 | 15.8 | 179.7 | -59 | -178.3 | -169.7 | 78.4 | -5.1 | 113.5 | Y371 F375 L407 E411 | Y371-R373 PolarHBondContact O-N 2.94Å; R373-F375 HydrophobicContact CB-CE2 4.4Å; R373-F375 HydrophobicContact CB-CZ 4.18Å; R373-F375 WeakPolarHBondContact O-CD2 3.39Å; R373-F375 WeakPolarHBondContact O-CE2 3.28Å; R373-F375 PolarHBondContact O-N 3.4Å; R373-L407 HydrophobicContact CG-CD2 3.72Å; R373-E411 IonicContact CZ-OE1 2.78Å; R373-E411 IonicContact NH1-OE1 3.69Å; R373-E411 PolarHBondContact NH1-OE1 2.92Å; R373-E411 IonicContact NH2-OE1 2.56Å; R373-E411 PolarHBondContact NH2-OE1 3.26Å |
| 374 | D | 97.4 | Very high | 96.9 | Very high | 83 Ų | 83 | 49.4 Ų | 49.4 | 44% | 0.444 | 24% | 0.242 | S | C | . | . | trans | -72.6 | 84.2 | 166.9 | -169.9 | -20.2 | 0 | 0 | 0 | 110.2 | Y371 Q376 A377 I378 | Y371-D374 PolarHBondContact O-N 3.01Å; D374-Q376 PolarHBondContact O-N 2.81Å; D374-Q376 VanDerWaalsContact O-N 3.16Å; D374-Q376 WeakPolarHBondContact OD1-CA 3.31Å; D374-Q376 WeakPolarHBondContact OD1-CB 3.47Å; D374-Q376 PolarHBondContact OD1-N 2.84Å; D374-A377 HydrophobicContact CB-CB 4.06Å; D374-A377 PolarHBondContact O-N 3.49Å; D374-A377 PolarHBondContact OD1-N 3.1Å; D374-I378 WeakPolarHBondContact O-CD1 3.3Å; D374-I378 VanDerWaalsContact O-CG1 3.25Å; D374-I378 WeakPolarHBondContact O-CG1 3.48Å; D374-I378 PolarHBondContact O-N 3.48Å | ||
| 375 | F | 97.6 | Very high | 96.9 | Very high | 51 Ų | 51 | 49.4 Ų | 49.4 | 22% | 0.224 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -63 | -16.3 | 178.6 | -51.8 | -69.7 | 0 | 0 | 0 | 113.4 | R373 S379 V387 V390 K391 F394 | R373-F375 HydrophobicContact CB-CE2 4.4Å; R373-F375 HydrophobicContact CB-CZ 4.18Å; R373-F375 WeakPolarHBondContact O-CD2 3.39Å; R373-F375 WeakPolarHBondContact O-CE2 3.28Å; R373-F375 PolarHBondContact O-N 3.4Å; F375-S379 WeakPolarHBondContact O-CB 3.37Å; F375-S379 PolarHBondContact O-N 3.46Å; F375-S379 VanDerWaalsContact O-N 3.16Å; F375-V387 HydrophobicContact CB-CG1 3.78Å; F375-V390 HydrophobicContact CB-CG1 4.49Å; F375-V390 HydrophobicContact CD1-CG1 4.12Å; F375-K391 HydrophobicContact CB-CG 4.48Å; F375-K391 HydrophobicContact CD1-CG 3.87Å; F375-K391 HydrophobicContact CD2-CD 4.44Å; F375-K391 HydrophobicContact CD2-CG 4.07Å; F375-K391 HydrophobicContact CE1-CG 4.04Å; F375-K391 HydrophobicContact CE2-CG 4.23Å; F375-K391 HydrophobicContact CG-CG 3.89Å; F375-K391 HydrophobicContact CZ-CG 4.21Å; F375-F394 AromaticContact CD1-CD2 3.95Å; F375-F394 HydrophobicContact CD1-CD2 3.95Å; F375-F394 AromaticContact CD1-CE2 3.69Å; F375-F394 HydrophobicContact CD1-CE2 3.69Å; F375-F394 AromaticContact CE1-CD2 3.56Å; F375-F394 HydrophobicContact CE1-CD2 3.56Å; F375-F394 AromaticContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CE2 3.46Å; F375-F394 VanDerWaalsContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CG 4.21Å; F375-F394 HydrophobicContact CE1-CZ 4.04Å |
| 376 | Q | 97.9 | Very high | 96.9 | Very high | 98 Ų | 98 | 49.6 Ų | 49.6 | 46% | 0.458 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -80.6 | -52.8 | 175.3 | -176.4 | 61.2 | 59.4 | 0 | 0 | 109.8 | D374 I378 S379 D380 V387 | D374-Q376 PolarHBondContact O-N 2.81Å; D374-Q376 VanDerWaalsContact O-N 3.16Å; D374-Q376 WeakPolarHBondContact OD1-CA 3.31Å; D374-Q376 WeakPolarHBondContact OD1-CB 3.47Å; D374-Q376 PolarHBondContact OD1-N 2.84Å; Q376-I378 PolarHBondContact O-N 3.2Å; Q376-S379 CarbonylContact O-C 3.6Å; Q376-S379 WeakPolarHBondContact O-CA 3.29Å; Q376-S379 WeakPolarHBondContact O-CB 3.48Å; Q376-S379 PolarHBondContact O-N 2.95Å; Q376-D380 VanDerWaalsContact NE2-CG 3.29Å; Q376-D380 PolarHBondContact NE2-OD1 3.37Å; Q376-D380 PolarHBondContact NE2-OD2 3.42Å; Q376-D380 VanDerWaalsContact NE2-OD2 3.07Å; Q376-D380 VanDerWaalsContact O-CG 3.22Å; Q376-D380 PolarHBondContact O-N 3.37Å; Q376-V387 VanDerWaalsContact OE1-CG2 3.3Å |
| 377 | A | 97.8 | Very high | 96.9 | Very high | 18 Ų | 18 | 45.7 Ų | 45.7 | 15% | 0.149 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -56.1 | -38.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y371 D374 D380 V381 | Y371-A377 HydrophobicContact CD1-CB 3.79Å; Y371-A377 HydrophobicContact CD2-CB 4.45Å; Y371-A377 HydrophobicContact CE1-CB 4.27Å; Y371-A377 HydrophobicContact CG-CB 3.9Å; D374-A377 HydrophobicContact CB-CB 4.06Å; D374-A377 PolarHBondContact O-N 3.49Å; D374-A377 PolarHBondContact OD1-N 3.1Å; A377-D380 PolarHBondContact O-N 3.18Å; A377-V381 WeakPolarHBondContact O-CB 3.46Å; A377-V381 VanDerWaalsContact O-CG2 3.29Å; A377-V381 WeakPolarHBondContact O-CG2 3.25Å; A377-V381 PolarHBondContact O-N 3.17Å |
| 378 | I | 97.8 | Very high | 96.9 | Very high | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -67.5 | -38.4 | 173.8 | -61.7 | 160.8 | 0 | 0 | 0 | 111.5 | A367 I368 D374 Q376 D380 I382 V390 F394 | A367-I378 HydrophobicContact CB-CB 4.22Å; A367-I378 HydrophobicContact CB-CG1 3.88Å; A367-I378 HydrophobicContact CB-CG2 3.96Å; I368-I378 HydrophobicContact CG1-CD1 3.87Å; D374-I378 WeakPolarHBondContact O-CD1 3.3Å; D374-I378 VanDerWaalsContact O-CG1 3.25Å; D374-I378 WeakPolarHBondContact O-CG1 3.48Å; D374-I378 PolarHBondContact O-N 3.48Å; Q376-I378 PolarHBondContact O-N 3.2Å; I378-D380 VanDerWaalsContact C-N 3.33Å; I378-I382 HydrophobicContact CG2-CD1 3.88Å; I378-I382 WeakPolarHBondContact O-CD1 3.43Å; I378-I382 VanDerWaalsContact O-CG1 3.28Å; I378-I382 WeakPolarHBondContact O-CG1 3.43Å; I378-I382 PolarHBondContact O-N 3.46Å; I378-V390 HydrophobicContact CB-CG1 3.98Å; I378-V390 HydrophobicContact CG2-CB 4.5Å; I378-V390 HydrophobicContact CG2-CG1 3.46Å; I378-V390 VanDerWaalsContact CG2-CG1 3.46Å; I378-V390 HydrophobicContact CG2-CG2 4.17Å; I378-F394 HydrophobicContact CD1-CE2 4.05Å; I378-F394 HydrophobicContact CD1-CZ 4.31Å |
| 379 | S | 97.1 | Very high | 96.9 | Very high | 5 Ų | 5 | 51.6 Ų | 51.6 | 4% | 0.035 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -58.8 | -45.9 | 173.5 | -148.6 | 0 | 0 | 0 | 0 | 111.2 | F375 Q376 I382 G383 K385 S386 V387 | F375-S379 WeakPolarHBondContact O-CB 3.37Å; F375-S379 PolarHBondContact O-N 3.46Å; F375-S379 VanDerWaalsContact O-N 3.16Å; Q376-S379 CarbonylContact O-C 3.6Å; Q376-S379 WeakPolarHBondContact O-CA 3.29Å; Q376-S379 WeakPolarHBondContact O-CB 3.48Å; Q376-S379 PolarHBondContact O-N 2.95Å; S379-I382 PolarHBondContact O-N 3.39Å; S379-G383 PolarHBondContact O-N 3.04Å; S379-K385 PolarHBondContact OG-O 3.48Å; S379-S386 VanDerWaalsContact OG-CA 3.3Å; S379-S386 WeakPolarHBondContact OG-CA 3.41Å; S379-V387 PolarHBondContact OG-N 2.93Å |
| 380 | D | 96.2 | Very high | 97 | Very high | 104 Ų | 104 | 48.6 Ų | 48.6 | 56% | 0.556 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -73.5 | -36.2 | -173.4 | -60.5 | -29.2 | 0 | 0 | 0 | 112 | Q376 A377 I378 I382 G383 | Q376-D380 VanDerWaalsContact NE2-CG 3.29Å; Q376-D380 PolarHBondContact NE2-OD1 3.37Å; Q376-D380 PolarHBondContact NE2-OD2 3.42Å; Q376-D380 VanDerWaalsContact NE2-OD2 3.07Å; Q376-D380 VanDerWaalsContact O-CG 3.22Å; Q376-D380 PolarHBondContact O-N 3.37Å; A377-D380 PolarHBondContact O-N 3.18Å; I378-D380 VanDerWaalsContact C-N 3.33Å; D380-I382 VanDerWaalsContact C-N 3.34Å; D380-G383 PolarHBondContact O-N 3.36Å |
| 381 | V | 96.1 | Very high | 97.1 | Very high | 67 Ų | 67 | 46.9 Ų | 46.9 | 41% | 0.406 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -66.3 | -33.5 | 173.8 | 166.9 | 0 | 0 | 0 | 0 | 112.5 | A367 Y371 A377 | A367-V381 HydrophobicContact CB-CB 4.43Å; A367-V381 HydrophobicContact CB-CG1 4.11Å; Y371-V381 HydrophobicContact CE2-CG2 3.88Å; A377-V381 WeakPolarHBondContact O-CB 3.46Å; A377-V381 VanDerWaalsContact O-CG2 3.29Å; A377-V381 WeakPolarHBondContact O-CG2 3.25Å; A377-V381 PolarHBondContact O-N 3.17Å |
| 382 | I | 96.4 | Very high | 97.1 | Very high | 12 Ų | 12 | 47.1 Ų | 47.1 | 6% | 0.062 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -82.6 | -27.1 | 174.8 | -55.1 | 160.4 | 0 | 0 | 0 | 110.9 | W356 E360 A364 I378 S379 D380 N384 K385 V390 | W356-I382 HydrophobicContact CH2-CD1 4Å; W356-I382 HydrophobicContact CZ3-CD1 4.06Å; E360-I382 HydrophobicContact CB-CG2 4.31Å; E360-I382 HydrophobicContact CG-CG2 4.26Å; A364-I382 HydrophobicContact CB-CD1 3.77Å; I378-I382 HydrophobicContact CG2-CD1 3.88Å; I378-I382 WeakPolarHBondContact O-CD1 3.43Å; I378-I382 VanDerWaalsContact O-CG1 3.28Å; I378-I382 WeakPolarHBondContact O-CG1 3.43Å; I378-I382 PolarHBondContact O-N 3.46Å; S379-I382 PolarHBondContact O-N 3.39Å; D380-I382 VanDerWaalsContact C-N 3.34Å; I382-N384 PolarHBondContact O-N 3.11Å; I382-K385 HydrophobicContact CB-CB 4.4Å; I382-K385 HydrophobicContact CB-CG 4.37Å; I382-K385 HydrophobicContact CG2-CB 4.05Å; I382-K385 HydrophobicContact CG2-CG 3.52Å; I382-V390 HydrophobicContact CD1-CG2 4.23Å |
| 383 | G | 95.3 | Very high | 97.2 | Very high | 26 Ų | 26 | 47.2 Ų | 47.2 | 27% | 0.268 | 25% | 0.251 | S | S | . | . | S | Bend | trans | 71.1 | -32.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | S379 D380 | S379-G383 PolarHBondContact O-N 3.04Å; D380-G383 PolarHBondContact O-N 3.36Å |
| 384 | N | 96.6 | Very high | 97.2 | Very high | 21 Ų | 21 | 42.6 Ų | 42.6 | 11% | 0.112 | 23% | 0.234 | C | C | . | . | S | Bend | trans | -115 | 11.9 | -177.7 | 79 | 18.5 | 0 | 0 | 0 | 114.2 | Q350 F352 N353 E360 I382 | Q350-N384 HydrophobicContact CB-CB 4.32Å; F352-N384 CarbonylContact C-O 3.56Å; F352-N384 VanDerWaalsContact CA-O 3.29Å; F352-N384 WeakPolarHBondContact CA-O 3.26Å; N353-N384 PolarHBondContact N-O 3.21Å; E360-N384 PolarHBondContact OE1-ND2 3.15Å; E360-N384 PolarHBondContact OE1-OD1 3.44Å; I382-N384 PolarHBondContact O-N 3.11Å |
| 385 | K | 97.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 24% | 0.241 | C | C | . | . | S | Bend | trans | -118.7 | 143.3 | 172.4 | -61.3 | -67.1 | 179.6 | -79.5 | 0 | 109.1 | F352 N353 R355 W356 E360 S379 I382 Q389 V390 | F352-K385 VanDerWaalsContact CD1-C 3.46Å; F352-K385 WeakPolarHBondContact CE1-O 3.32Å; N353-K385 WeakPolarHBondContact O-CD 3.32Å; R355-K385 WeakPolarHBondContact O-CE 3.32Å; R355-K385 PolarHBondContact O-NZ 3.42Å; W356-K385 HydrophobicContact CD2-CD 4.15Å; W356-K385 VanDerWaalsContact CD2-CE 3.46Å; W356-K385 HydrophobicContact CE3-CD 4.38Å; W356-K385 HydrophobicContact CE3-CG 4.45Å; W356-K385 HydrophobicContact CH2-CB 4.21Å; W356-K385 HydrophobicContact CH2-CD 3.98Å; W356-K385 HydrophobicContact CH2-CG 3.64Å; W356-K385 HydrophobicContact CZ2-CB 4.38Å; W356-K385 HydrophobicContact CZ2-CD 3.68Å; W356-K385 HydrophobicContact CZ2-CG 3.85Å; W356-K385 HydrophobicContact CZ3-CD 4.31Å; W356-K385 HydrophobicContact CZ3-CG 3.95Å; E360-K385 IonicContact OE1-NZ 2.97Å; E360-K385 PolarHBondContact OE1-NZ 2.88Å; E360-K385 VanDerWaalsContact OE1-NZ 3.07Å; E360-K385 WeakPolarHBondContact OE2-CE 3.44Å; E360-K385 IonicContact OE2-NZ 3.27Å; E360-K385 PolarHBondContact OE2-NZ 3.23Å; S379-K385 PolarHBondContact OG-O 3.48Å; I382-K385 HydrophobicContact CB-CB 4.4Å; I382-K385 HydrophobicContact CB-CG 4.37Å; I382-K385 HydrophobicContact CG2-CB 4.05Å; I382-K385 HydrophobicContact CG2-CG 3.52Å; K385-Q389 HydrophobicContact CB-CB 4.45Å; K385-Q389 HydrophobicContact CD-CB 4.47Å; K385-V390 HydrophobicContact CB-CG2 4.35Å |
| 386 | S | 97.1 | Very high | 97.1 | Very high | 34 Ų | 34 | 45.9 Ų | 45.9 | 24% | 0.238 | 26% | 0.258 | C | S | . | . | trans | -91.3 | 158.8 | 173.5 | 74.8 | 0 | 0 | 0 | 0 | 111.8 | S379 V388 Q389 V390 | S379-S386 VanDerWaalsContact OG-CA 3.3Å; S379-S386 WeakPolarHBondContact OG-CA 3.41Å; S386-V388 PolarHBondContact O-N 3.43Å; S386-Q389 WeakPolarHBondContact O-CA 3.34Å; S386-Q389 WeakPolarHBondContact O-CB 3.46Å; S386-Q389 PolarHBondContact O-N 2.99Å; S386-Q389 PolarHBondContact OG-OE1 2.9Å; S386-V390 PolarHBondContact O-N 3.26Å | ||
| 387 | V | 97.8 | Very high | 97 | Very high | 43 Ų | 43 | 42.9 Ų | 42.9 | 26% | 0.261 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -47 | -39.2 | 177.2 | 179.5 | 0 | 0 | 0 | 0 | 112.9 | F375 Q376 S379 V390 K391 | F375-V387 HydrophobicContact CB-CG1 3.78Å; Q376-V387 VanDerWaalsContact OE1-CG2 3.3Å; S379-V387 PolarHBondContact OG-N 2.93Å; V387-V390 PolarHBondContact O-N 3.2Å; V387-K391 WeakPolarHBondContact O-CG 3.43Å; V387-K391 PolarHBondContact O-N 2.84Å |
| 388 | V | 97.7 | Very high | 96.8 | Very high | 95 Ų | 95 | 48.3 Ų | 48.3 | 58% | 0.576 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -68.8 | -39.1 | 177.6 | -178.8 | 0 | 0 | 0 | 0 | 111.6 | S386 V390 K391 N392 | S386-V388 PolarHBondContact O-N 3.43Å; V388-V390 VanDerWaalsContact C-N 3.34Å; V388-K391 PolarHBondContact O-N 3.35Å; V388-N392 WeakPolarHBondContact O-CB 3.28Å; V388-N392 VanDerWaalsContact O-CG 3.23Å; V388-N392 PolarHBondContact O-N 2.95Å; V388-N392 PolarHBondContact O-ND2 2.98Å |
| 389 | Q | 97.7 | Very high | 96.8 | Very high | 32 Ų | 32 | 59.4 Ų | 59.4 | 15% | 0.15 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -67.8 | -36 | 175.1 | -61.1 | 175.6 | -70.4 | 0 | 0 | 111.5 | N353 W356 K385 S386 N392 F393 | N353-Q389 PolarHBondContact O-NE2 3.48Å; W356-Q389 HydrophobicContact CZ2-CB 4.39Å; K385-Q389 HydrophobicContact CB-CB 4.45Å; K385-Q389 HydrophobicContact CD-CB 4.47Å; S386-Q389 WeakPolarHBondContact O-CA 3.34Å; S386-Q389 WeakPolarHBondContact O-CB 3.46Å; S386-Q389 PolarHBondContact O-N 2.99Å; S386-Q389 PolarHBondContact OG-OE1 2.9Å; Q389-N392 PolarHBondContact O-N 3.46Å; Q389-F393 WeakPolarHBondContact O-CB 3.43Å; Q389-F393 PolarHBondContact O-N 3.49Å |
| 390 | V | 98.2 | Very high | 96.7 | Very high | 0 Ų | 0 | 66.2 Ų | 66.2 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -65.2 | -47.3 | 173.6 | 178.2 | 0 | 0 | 0 | 0 | 111 | F375 I378 I382 K385 S386 V387 V388 N392 F393 F394 | F375-V390 HydrophobicContact CB-CG1 4.49Å; F375-V390 HydrophobicContact CD1-CG1 4.12Å; I378-V390 HydrophobicContact CB-CG1 3.98Å; I378-V390 HydrophobicContact CG2-CB 4.5Å; I378-V390 HydrophobicContact CG2-CG1 3.46Å; I378-V390 VanDerWaalsContact CG2-CG1 3.46Å; I378-V390 HydrophobicContact CG2-CG2 4.17Å; I382-V390 HydrophobicContact CD1-CG2 4.23Å; K385-V390 HydrophobicContact CB-CG2 4.35Å; S386-V390 PolarHBondContact O-N 3.26Å; V387-V390 PolarHBondContact O-N 3.2Å; V388-V390 VanDerWaalsContact C-N 3.34Å; V390-N392 VanDerWaalsContact C-N 3.29Å; V390-N392 PolarHBondContact O-N 2.92Å; V390-F393 WeakPolarHBondContact O-CB 3.46Å; V390-F393 PolarHBondContact O-N 2.9Å; V390-F394 HydrophobicContact CG1-CD2 4.28Å; V390-F394 HydrophobicContact CG1-CE2 4.25Å; V390-F394 PolarHBondContact O-N 2.82Å |
| 391 | K | 97.6 | Very high | 96.6 | Very high | 94 Ų | 94 | 64.1 Ų | 64.1 | 41% | 0.409 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -56.8 | -42.3 | 173.2 | -75.5 | -172.2 | 173.2 | -163.1 | 0 | 112.2 | F375 V387 V388 F393 F394 V395 | F375-K391 HydrophobicContact CB-CG 4.48Å; F375-K391 HydrophobicContact CD1-CG 3.87Å; F375-K391 HydrophobicContact CD2-CD 4.44Å; F375-K391 HydrophobicContact CD2-CG 4.07Å; F375-K391 HydrophobicContact CE1-CG 4.04Å; F375-K391 HydrophobicContact CE2-CG 4.23Å; F375-K391 HydrophobicContact CG-CG 3.89Å; F375-K391 HydrophobicContact CZ-CG 4.21Å; V387-K391 WeakPolarHBondContact O-CG 3.43Å; V387-K391 PolarHBondContact O-N 2.84Å; V388-K391 PolarHBondContact O-N 3.35Å; K391-F393 VanDerWaalsContact C-N 3.34Å; K391-F393 PolarHBondContact O-N 3.39Å; K391-F394 WeakPolarHBondContact O-CB 3.28Å; K391-F394 PolarHBondContact O-N 2.96Å; K391-V395 PolarHBondContact O-N 3.39Å |
| 392 | N | 97.4 | Very high | 96.6 | Very high | 86 Ų | 86 | 64.6 Ų | 64.6 | 46% | 0.46 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -68 | -31.3 | 175.5 | -69.9 | -14.7 | 0 | 0 | 0 | 112.7 | V388 Q389 V390 N396 | V388-N392 WeakPolarHBondContact O-CB 3.28Å; V388-N392 VanDerWaalsContact O-CG 3.23Å; V388-N392 PolarHBondContact O-N 2.95Å; V388-N392 PolarHBondContact O-ND2 2.98Å; Q389-N392 PolarHBondContact O-N 3.46Å; V390-N392 VanDerWaalsContact C-N 3.29Å; V390-N392 PolarHBondContact O-N 2.92Å; N392-N396 VanDerWaalsContact O-CB 3.26Å; N392-N396 WeakPolarHBondContact O-CB 3.43Å; N392-N396 VanDerWaalsContact O-CG 3.24Å; N392-N396 PolarHBondContact O-N 3.31Å; N392-N396 PolarHBondContact O-ND2 3.21Å |
| 393 | F | 97.8 | Very high | 96.6 | Very high | 1 Ų | 1 | 64.1 Ų | 64.1 | 0% | 0.004 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -64.1 | -46.1 | 173.3 | 174.7 | -96.3 | 0 | 0 | 0 | 111.3 | W356 Q361 A364 V365 I368 Q389 V390 K391 V395 N396 Y397 F401 L403 | W356-F393 HydrophobicContact CD2-CD2 4.13Å; W356-F393 HydrophobicContact CE3-CD2 4.1Å; W356-F393 HydrophobicContact CE3-CE2 4.42Å; W356-F393 HydrophobicContact CH2-CB 3.89Å; W356-F393 HydrophobicContact CH2-CD2 4.1Å; W356-F393 AromaticContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CH2-CG 3.97Å; W356-F393 HydrophobicContact CZ2-CB 3.61Å; W356-F393 HydrophobicContact CZ2-CD2 4.14Å; W356-F393 HydrophobicContact CZ2-CG 4.08Å; W356-F393 HydrophobicContact CZ3-CD2 4.08Å; W356-F393 HydrophobicContact CZ3-CE2 4.5Å; W356-F393 HydrophobicContact CZ3-CG 4.33Å; Q361-F393 HydrophobicContact CB-CE2 4.25Å; Q361-F393 HydrophobicContact CB-CZ 4.49Å; Q361-F393 HydrophobicContact CG-CE2 3.93Å; A364-F393 HydrophobicContact CB-CD1 3.96Å; A364-F393 HydrophobicContact CB-CE1 3.53Å; A364-F393 HydrophobicContact CB-CZ 3.85Å; V365-F393 HydrophobicContact CG2-CZ 4.33Å; I368-F393 HydrophobicContact CD1-CD1 4.18Å; I368-F393 HydrophobicContact CD1-CE1 3.95Å; Q389-F393 WeakPolarHBondContact O-CB 3.43Å; Q389-F393 PolarHBondContact O-N 3.49Å; V390-F393 WeakPolarHBondContact O-CB 3.46Å; V390-F393 PolarHBondContact O-N 2.9Å; K391-F393 VanDerWaalsContact C-N 3.34Å; K391-F393 PolarHBondContact O-N 3.39Å; F393-V395 VanDerWaalsContact C-N 3.31Å; F393-V395 PolarHBondContact O-N 2.84Å; F393-N396 PolarHBondContact O-N 3.03Å; F393-Y397 HydrophobicContact CD2-CD1 4.37Å; F393-Y397 AromaticContact CD2-CD2 3.27Å; F393-Y397 HydrophobicContact CD2-CD2 3.27Å; F393-Y397 AromaticContact CD2-CE2 3.6Å; F393-Y397 HydrophobicContact CD2-CE2 3.6Å; F393-Y397 AromaticContact CD2-CG 3.7Å; F393-Y397 HydrophobicContact CD2-CG 3.7Å; F393-Y397 AromaticContact CE2-CD1 3.76Å; F393-Y397 HydrophobicContact CE2-CD1 3.76Å; F393-Y397 AromaticContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CE1 4.09Å; F393-Y397 AromaticContact CE2-CE2 3.91Å; F393-Y397 HydrophobicContact CE2-CE2 3.91Å; F393-Y397 AromaticContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CE2-CG 3.43Å; F393-Y397 VanDerWaalsContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CG-CD2 4.07Å; F393-Y397 HydrophobicContact CZ-CD1 4.45Å; F393-Y397 HydrophobicContact CZ-CG 4.11Å; F393-Y397 WeakPolarHBondContact O-CB 3.45Å; F393-Y397 WeakPolarHBondContact O-CD2 3.37Å; F393-Y397 PolarHBondContact O-N 3.11Å; F393-F401 HydrophobicContact CE2-CD2 4.27Å; F393-F401 AromaticContact CE2-CE2 3.93Å; F393-F401 HydrophobicContact CE2-CE2 3.93Å; F393-F401 AromaticContact CZ-CD2 3.68Å; F393-F401 HydrophobicContact CZ-CD2 3.68Å; F393-F401 AromaticContact CZ-CE2 3.7Å; F393-F401 HydrophobicContact CZ-CE2 3.7Å; F393-L403 HydrophobicContact CE1-CD1 4.35Å |
| 394 | F | 96.3 | Very high | 96.6 | Very high | 24 Ų | 24 | 66.2 Ų | 66.2 | 11% | 0.105 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -50.3 | -49.6 | 174.6 | -95 | -89.8 | 0 | 0 | 0 | 112.3 | I368 G372 F375 I378 V390 K391 R398 L403 L407 | I368-F394 HydrophobicContact CB-CZ 4.14Å; I368-F394 HydrophobicContact CD1-CD1 4.36Å; I368-F394 HydrophobicContact CD1-CD2 4.07Å; I368-F394 HydrophobicContact CD1-CE1 3.93Å; I368-F394 HydrophobicContact CD1-CE2 3.63Å; I368-F394 HydrophobicContact CD1-CG 4.45Å; I368-F394 HydrophobicContact CD1-CZ 3.59Å; I368-F394 HydrophobicContact CG1-CE1 4.13Å; I368-F394 HydrophobicContact CG1-CE2 3.61Å; I368-F394 HydrophobicContact CG1-CZ 3.41Å; I368-F394 VanDerWaalsContact CG1-CZ 3.41Å; I368-F394 HydrophobicContact CG2-CE1 3.8Å; I368-F394 HydrophobicContact CG2-CZ 3.67Å; G372-F394 WeakPolarHBondContact O-CZ 3.34Å; F375-F394 AromaticContact CD1-CD2 3.95Å; F375-F394 HydrophobicContact CD1-CD2 3.95Å; F375-F394 AromaticContact CD1-CE2 3.69Å; F375-F394 HydrophobicContact CD1-CE2 3.69Å; F375-F394 AromaticContact CE1-CD2 3.56Å; F375-F394 HydrophobicContact CE1-CD2 3.56Å; F375-F394 AromaticContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CE2 3.46Å; F375-F394 VanDerWaalsContact CE1-CE2 3.46Å; F375-F394 HydrophobicContact CE1-CG 4.21Å; F375-F394 HydrophobicContact CE1-CZ 4.04Å; I378-F394 HydrophobicContact CD1-CE2 4.05Å; I378-F394 HydrophobicContact CD1-CZ 4.31Å; V390-F394 HydrophobicContact CG1-CD2 4.28Å; V390-F394 HydrophobicContact CG1-CE2 4.25Å; V390-F394 PolarHBondContact O-N 2.82Å; K391-F394 WeakPolarHBondContact O-CB 3.28Å; K391-F394 PolarHBondContact O-N 2.96Å; F394-R398 WeakPolarHBondContact O-CA 3.5Å; F394-R398 VanDerWaalsContact O-CB 3.29Å; F394-R398 WeakPolarHBondContact O-CB 3.25Å; F394-R398 PolarHBondContact O-N 2.83Å; F394-L403 HydrophobicContact CD1-CD1 4.19Å; F394-L403 HydrophobicContact CG-CD1 4.5Å; F394-L407 HydrophobicContact CE1-CD1 3.91Å; F394-L407 HydrophobicContact CE1-CD2 4.21Å; F394-L407 HydrophobicContact CE1-CG 4.24Å |
| 395 | V | 96.4 | Very high | 96.6 | Very high | 99 Ų | 99 | 70.3 Ų | 70.3 | 60% | 0.6 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -67.7 | -51.5 | 179.3 | -178.9 | 0 | 0 | 0 | 0 | 111.3 | K391 F393 Y397 | K391-V395 PolarHBondContact O-N 3.39Å; F393-V395 VanDerWaalsContact C-N 3.31Å; F393-V395 PolarHBondContact O-N 2.84Å; V395-Y397 VanDerWaalsContact C-N 3.28Å; V395-Y397 PolarHBondContact O-N 3.21Å |
| 396 | N | 96.1 | Very high | 96.5 | Very high | 105 Ų | 105 | 71.3 Ų | 71.3 | 56% | 0.561 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -72 | -17.4 | -172 | -69.3 | -37.8 | 0 | 0 | 0 | 114.4 | N392 F393 R400 | N392-N396 VanDerWaalsContact O-CB 3.26Å; N392-N396 WeakPolarHBondContact O-CB 3.43Å; N392-N396 VanDerWaalsContact O-CG 3.24Å; N392-N396 PolarHBondContact O-N 3.31Å; N392-N396 PolarHBondContact O-ND2 3.21Å; F393-N396 PolarHBondContact O-N 3.03Å; N396-R400 PolarHBondContact O-NH2 2.84Å |
| 397 | Y | 95.7 | Very high | 96.4 | Very high | 35 Ų | 35 | 70 Ų | 70 | 14% | 0.137 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -120.1 | -1 | -178 | -68 | -102.9 | 0 | 0 | 0 | 113.9 | Q361 F393 V395 R399 R400 F401 | Q361-Y397 HydrophobicContact CG-CE1 4.41Å; F393-Y397 HydrophobicContact CD2-CD1 4.37Å; F393-Y397 AromaticContact CD2-CD2 3.27Å; F393-Y397 HydrophobicContact CD2-CD2 3.27Å; F393-Y397 AromaticContact CD2-CE2 3.6Å; F393-Y397 HydrophobicContact CD2-CE2 3.6Å; F393-Y397 AromaticContact CD2-CG 3.7Å; F393-Y397 HydrophobicContact CD2-CG 3.7Å; F393-Y397 AromaticContact CE2-CD1 3.76Å; F393-Y397 HydrophobicContact CE2-CD1 3.76Å; F393-Y397 AromaticContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CD2 3.52Å; F393-Y397 HydrophobicContact CE2-CE1 4.09Å; F393-Y397 AromaticContact CE2-CE2 3.91Å; F393-Y397 HydrophobicContact CE2-CE2 3.91Å; F393-Y397 AromaticContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CE2-CG 3.43Å; F393-Y397 VanDerWaalsContact CE2-CG 3.43Å; F393-Y397 HydrophobicContact CG-CD2 4.07Å; F393-Y397 HydrophobicContact CZ-CD1 4.45Å; F393-Y397 HydrophobicContact CZ-CG 4.11Å; F393-Y397 WeakPolarHBondContact O-CB 3.45Å; F393-Y397 WeakPolarHBondContact O-CD2 3.37Å; F393-Y397 PolarHBondContact O-N 3.11Å; V395-Y397 VanDerWaalsContact C-N 3.28Å; V395-Y397 PolarHBondContact O-N 3.21Å; Y397-R399 PolarHBondContact O-N 3.42Å; Y397-R399 VanDerWaalsContact O-N 3.14Å; Y397-R400 VanDerWaalsContact CD1-NH2 3.25Å; Y397-R400 VanDerWaalsContact CE1-CZ 3.42Å; Y397-R400 VanDerWaalsContact CE1-NH1 3.26Å; Y397-R400 PolarHBondContact O-N 3.22Å; Y397-F401 AromaticContact CD1-CD2 3.87Å; Y397-F401 HydrophobicContact CD1-CD2 3.87Å; Y397-F401 AromaticContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CZ 4.09Å; Y397-F401 AromaticContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CZ 4.47Å; Y397-F401 HydrophobicContact CG-CD2 4.26Å; Y397-F401 HydrophobicContact CG-CE2 4.09Å; Y397-F401 PolarHBondContact O-N 3.11Å; Y397-F401 VanDerWaalsContact O-N 3.16Å |
| 398 | R | 95.1 | Very high | 96.2 | Very high | 131 Ų | 131 | 74.2 Ų | 74.2 | 49% | 0.494 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -38.2 | -57.1 | -178.7 | -167.6 | 173.3 | 174.8 | 134.3 | 1.2 | 114.4 | F394 N402 L403 D404 | F394-R398 WeakPolarHBondContact O-CA 3.5Å; F394-R398 VanDerWaalsContact O-CB 3.29Å; F394-R398 WeakPolarHBondContact O-CB 3.25Å; F394-R398 PolarHBondContact O-N 2.83Å; R398-N402 PolarHBondContact O-N 3.26Å; R398-L403 PolarHBondContact O-N 3.35Å; R398-D404 VanDerWaalsContact CZ-CG 3.49Å; R398-D404 IonicContact CZ-OD1 3.15Å; R398-D404 IonicContact CZ-OD2 3.68Å; R398-D404 VanDerWaalsContact NE-CG 3.29Å; R398-D404 IonicContact NE-OD1 2.99Å; R398-D404 PolarHBondContact NE-OD1 3.42Å; R398-D404 IonicContact NE-OD2 2.6Å; R398-D404 PolarHBondContact NE-OD2 2.9Å; R398-D404 IonicContact NH1-OD1 2.75Å; R398-D404 IonicContact NH2-OD1 2.78Å; R398-D404 PolarHBondContact NH2-OD1 3.26Å; R398-D404 IonicContact NH2-OD2 3.17Å; R398-D404 PolarHBondContact NH2-OD2 3.28Å |
| 399 | R | 96.2 | Very high | 96 | Very high | 234 Ų | 234 | 74.6 Ų | 74.6 | 88% | 0.883 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.3 | -9.8 | -178.1 | -61.9 | -173.9 | -177 | -179.5 | 0.9 | 114.9 | Y397 | Y397-R399 PolarHBondContact O-N 3.42Å; Y397-R399 VanDerWaalsContact O-N 3.14Å |
| 400 | R | 94.9 | Very high | 95.9 | Very high | 148 Ų | 148 | 75.1 Ų | 75.1 | 56% | 0.558 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.5 | -21.5 | -176.8 | -74 | -171.7 | -73.1 | 150.4 | -3.3 | 113.5 | N396 Y397 | N396-R400 PolarHBondContact O-NH2 2.84Å; Y397-R400 VanDerWaalsContact CD1-NH2 3.25Å; Y397-R400 VanDerWaalsContact CE1-CZ 3.42Å; Y397-R400 VanDerWaalsContact CE1-NH1 3.26Å; Y397-R400 PolarHBondContact O-N 3.22Å |
| 401 | F | 95.8 | Very high | 95.7 | Very high | 60 Ų | 60 | 79 Ų | 79 | 26% | 0.263 | 36% | 0.36 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -127.9 | 24.2 | 175.1 | -59.5 | -47.1 | 0 | 0 | 0 | 111.9 | Q361 V365 F393 Y397 L403 | Q361-F401 HydrophobicContact CB-CE2 4.02Å; Q361-F401 HydrophobicContact CB-CZ 4.11Å; Q361-F401 HydrophobicContact CG-CE2 4.48Å; V365-F401 HydrophobicContact CG2-CB 3.71Å; V365-F401 HydrophobicContact CG2-CD1 4.43Å; V365-F401 HydrophobicContact CG2-CD2 3.63Å; V365-F401 HydrophobicContact CG2-CE2 4.32Å; V365-F401 HydrophobicContact CG2-CG 3.7Å; F393-F401 HydrophobicContact CE2-CD2 4.27Å; F393-F401 AromaticContact CE2-CE2 3.93Å; F393-F401 HydrophobicContact CE2-CE2 3.93Å; F393-F401 AromaticContact CZ-CD2 3.68Å; F393-F401 HydrophobicContact CZ-CD2 3.68Å; F393-F401 AromaticContact CZ-CE2 3.7Å; F393-F401 HydrophobicContact CZ-CE2 3.7Å; Y397-F401 AromaticContact CD1-CD2 3.87Å; Y397-F401 HydrophobicContact CD1-CD2 3.87Å; Y397-F401 AromaticContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CE2 3.33Å; Y397-F401 HydrophobicContact CD1-CZ 4.09Å; Y397-F401 AromaticContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CE2 3.99Å; Y397-F401 HydrophobicContact CE1-CZ 4.47Å; Y397-F401 HydrophobicContact CG-CD2 4.26Å; Y397-F401 HydrophobicContact CG-CE2 4.09Å; Y397-F401 PolarHBondContact O-N 3.11Å; Y397-F401 VanDerWaalsContact O-N 3.16Å; F401-L403 HydrophobicContact CB-CD2 3.81Å; F401-L403 HydrophobicContact CB-CG 4.26Å; F401-L403 PolarHBondContact O-N 2.93Å |
| 402 | N | 95.8 | Very high | 95.4 | Very high | 77 Ų | 77 | 78.5 Ų | 78.5 | 41% | 0.412 | 37% | 0.374 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 42.3 | 45.7 | 178.3 | -65.9 | 52.3 | 0 | 0 | 0 | 113.6 | R398 D404 E405 V406 | R398-N402 PolarHBondContact O-N 3.26Å; N402-D404 PolarHBondContact O-N 2.99Å; N402-E405 HydrophobicContact CB-CB 4.42Å; N402-E405 HydrophobicContact CB-CG 4.5Å; N402-E405 PolarHBondContact ND2-OE1 3.18Å; N402-E405 PolarHBondContact ND2-OE2 3.43Å; N402-E405 WeakPolarHBondContact O-CB 3.36Å; N402-E405 PolarHBondContact O-N 2.9Å; N402-V406 PolarHBondContact O-N 2.76Å |
| 403 | L | 95.9 | Very high | 95 | Very high | 1 Ų | 1 | 80.2 Ų | 80.2 | 1% | 0.005 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -62.3 | -17.9 | -166.9 | -62.6 | -177.5 | 0 | 0 | 0 | 113.7 | V365 I368 F393 F394 R398 F401 L407 | V365-L403 HydrophobicContact CG2-CD2 4.13Å; I368-L403 HydrophobicContact CD1-CD1 4.16Å; I368-L403 HydrophobicContact CD1-CD2 3.9Å; F393-L403 HydrophobicContact CE1-CD1 4.35Å; F394-L403 HydrophobicContact CD1-CD1 4.19Å; F394-L403 HydrophobicContact CG-CD1 4.5Å; R398-L403 PolarHBondContact O-N 3.35Å; F401-L403 HydrophobicContact CB-CD2 3.81Å; F401-L403 HydrophobicContact CB-CG 4.26Å; F401-L403 PolarHBondContact O-N 2.93Å; L403-L407 WeakPolarHBondContact O-CB 3.3Å; L403-L407 WeakPolarHBondContact O-CD1 3.36Å; L403-L407 WeakPolarHBondContact O-CG 3.44Å; L403-L407 PolarHBondContact O-N 3.14Å |
| 404 | D | 95.3 | Very high | 94.3 | Very high | 70 Ų | 70 | 85 Ų | 85 | 37% | 0.374 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -73.2 | -40.4 | 174.5 | -64.1 | -26.5 | 0 | 0 | 0 | 112.1 | R398 N402 L407 Q408 | R398-D404 VanDerWaalsContact CZ-CG 3.49Å; R398-D404 IonicContact CZ-OD1 3.15Å; R398-D404 IonicContact CZ-OD2 3.68Å; R398-D404 VanDerWaalsContact NE-CG 3.29Å; R398-D404 IonicContact NE-OD1 2.99Å; R398-D404 PolarHBondContact NE-OD1 3.42Å; R398-D404 IonicContact NE-OD2 2.6Å; R398-D404 PolarHBondContact NE-OD2 2.9Å; R398-D404 IonicContact NH1-OD1 2.75Å; R398-D404 IonicContact NH2-OD1 2.78Å; R398-D404 PolarHBondContact NH2-OD1 3.26Å; R398-D404 IonicContact NH2-OD2 3.17Å; R398-D404 PolarHBondContact NH2-OD2 3.28Å; N402-D404 PolarHBondContact O-N 2.99Å; D404-L407 PolarHBondContact O-N 2.6Å; D404-Q408 WeakPolarHBondContact O-CB 3.45Å; D404-Q408 PolarHBondContact O-N 3.4Å |
| 405 | E | 96.1 | Very high | 92.8 | Very high | 108 Ų | 108 | 85.5 Ų | 85.5 | 51% | 0.505 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -66.9 | -43.5 | 172.9 | -67.5 | 153.9 | -133.5 | 0 | 0 | 110.2 | N402 L407 Q408 E409 | N402-E405 HydrophobicContact CB-CB 4.42Å; N402-E405 HydrophobicContact CB-CG 4.5Å; N402-E405 PolarHBondContact ND2-OE1 3.18Å; N402-E405 PolarHBondContact ND2-OE2 3.43Å; N402-E405 WeakPolarHBondContact O-CB 3.36Å; N402-E405 PolarHBondContact O-N 2.9Å; E405-L407 VanDerWaalsContact C-N 3.28Å; E405-L407 PolarHBondContact O-N 3.45Å; E405-Q408 WeakPolarHBondContact O-CB 3.47Å; E405-Q408 PolarHBondContact O-N 3.33Å; E405-Q408 VanDerWaalsContact O-N 3.08Å; E405-E409 PolarHBondContact O-N 3.07Å |
| 406 | V | 95.9 | Very high | 90.8 | Very high | 20 Ų | 20 | 89.2 Ų | 89.2 | 12% | 0.121 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -60.6 | -36.5 | 176.8 | -178 | 0 | 0 | 0 | 0 | 112 | V365 I368 R369 N402 W410 | V365-V406 HydrophobicContact CG1-CG2 4.47Å; I368-V406 HydrophobicContact CB-CG1 4.45Å; I368-V406 HydrophobicContact CG2-CG1 4.01Å; R369-V406 HydrophobicContact CB-CG1 3.62Å; R369-V406 HydrophobicContact CG-CG1 4.27Å; N402-V406 PolarHBondContact O-N 2.76Å; V406-W410 PolarHBondContact O-N 3.42Å |
| 407 | L | 94.7 | Very high | 88.6 | Confident | 8 Ų | 8 | 92.7 Ų | 92.7 | 4% | 0.042 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -71.9 | -40.9 | 172.3 | -78.8 | 170.2 | 0 | 0 | 0 | 112.2 | I368 R373 F394 L403 D404 E405 E409 W410 E411 | I368-L407 HydrophobicContact CG2-CD2 4.05Å; I368-L407 HydrophobicContact CG2-CG 4.18Å; R373-L407 HydrophobicContact CG-CD2 3.72Å; F394-L407 HydrophobicContact CE1-CD1 3.91Å; F394-L407 HydrophobicContact CE1-CD2 4.21Å; F394-L407 HydrophobicContact CE1-CG 4.24Å; L403-L407 WeakPolarHBondContact O-CB 3.3Å; L403-L407 WeakPolarHBondContact O-CD1 3.36Å; L403-L407 WeakPolarHBondContact O-CG 3.44Å; L403-L407 PolarHBondContact O-N 3.14Å; D404-L407 PolarHBondContact O-N 2.6Å; E405-L407 VanDerWaalsContact C-N 3.28Å; E405-L407 PolarHBondContact O-N 3.45Å; L407-E409 VanDerWaalsContact C-N 3.33Å; L407-E409 PolarHBondContact O-N 3.25Å; L407-W410 PolarHBondContact O-N 3.47Å; L407-E411 WeakPolarHBondContact O-CG 3.43Å; L407-E411 PolarHBondContact O-N 2.94Å |
| 408 | Q | 94.6 | Very high | 86.3 | Confident | 131 Ų | 131 | 93.1 Ų | 93.1 | 61% | 0.612 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -62.6 | -39.2 | 178.3 | -173.8 | 177.6 | 1.6 | 0 | 0 | 111.9 | D404 E405 E411 A412 | D404-Q408 WeakPolarHBondContact O-CB 3.45Å; D404-Q408 PolarHBondContact O-N 3.4Å; E405-Q408 WeakPolarHBondContact O-CB 3.47Å; E405-Q408 PolarHBondContact O-N 3.33Å; E405-Q408 VanDerWaalsContact O-N 3.08Å; Q408-E411 PolarHBondContact O-N 3.24Å; Q408-A412 WeakPolarHBondContact O-CB 3.42Å; Q408-A412 PolarHBondContact O-N 3.19Å |
| 409 | E | 93.4 | Very high | 84 | Confident | 102 Ų | 102 | 90.1 Ų | 90.1 | 48% | 0.477 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.9 | -41.4 | 172.3 | -72.5 | -173 | -150.6 | 0 | 0 | 112.4 | R369 E405 L407 A412 E413 | R369-E409 IonicContact CZ-OE2 2.65Å; R369-E409 VanDerWaalsContact CZ-OE2 3.27Å; R369-E409 VanDerWaalsContact NE-CB 3.31Å; R369-E409 IonicContact NE-OE2 3.34Å; R369-E409 PolarHBondContact NE-OE2 3.02Å; R369-E409 IonicContact NH2-OE2 3.64Å; R369-E409 PolarHBondContact NH2-OE2 3.06Å; E405-E409 PolarHBondContact O-N 3.07Å; L407-E409 VanDerWaalsContact C-N 3.33Å; L407-E409 PolarHBondContact O-N 3.25Å; E409-A412 PolarHBondContact O-N 3.29Å; E409-E413 PolarHBondContact O-N 2.94Å; E409-E413 VanDerWaalsContact O-N 3.14Å |
| 410 | W | 94.6 | Very high | 81.5 | Confident | 43 Ų | 43 | 83.5 Ų | 83.5 | 16% | 0.163 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 175.8 | 178.5 | 84.2 | 0 | 0 | 0 | 111.8 | K370 G372 V406 L407 A412 E413 H414 | K370-W410 VanDerWaalsContact C-CD1 3.5Å; K370-W410 PolarHBondContact O-NE1 3.08Å; K370-W410 VanDerWaalsContact O-NE1 3.11Å; G372-W410 VanDerWaalsContact CA-CD2 3.41Å; V406-W410 PolarHBondContact O-N 3.42Å; L407-W410 PolarHBondContact O-N 3.47Å; W410-A412 VanDerWaalsContact C-N 3.33Å; W410-A412 PolarHBondContact O-N 2.81Å; W410-E413 PolarHBondContact O-N 2.86Å; W410-H414 AromaticContact CD1-CE1 3.39Å; W410-H414 AromaticContact CD1-ND1 3.35Å; W410-H414 AromaticContact CE2-CG 3.78Å; W410-H414 AromaticContact CE2-ND1 3.76Å; W410-H414 AromaticContact CG-ND1 3.82Å; W410-H414 HydrophobicContact CZ2-CB 4.2Å; W410-H414 AromaticContact NE1-CD2 3.84Å; W410-H414 AromaticContact NE1-CE1 3.34Å; W410-H414 PolarHBondContact NE1-CE1 2.96Å; W410-H414 VanDerWaalsContact NE1-CE1 3.34Å; W410-H414 AromaticContact NE1-CG 3.65Å; W410-H414 AromaticContact NE1-ND1 3.31Å; W410-H414 PolarHBondContact NE1-ND1 3.11Å; W410-H414 AromaticContact NE1-NE2 3.65Å; W410-H414 WeakPolarHBondContact O-CB 3.46Å; W410-H414 PolarHBondContact O-N 3.15Å; W410-H414 PolarHBondContact O-ND1 3.39Å |
| 411 | E | 93.4 | Very high | 79.1 | Confident | 81 Ų | 81 | 86 Ų | 86 | 38% | 0.379 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -63.6 | -36.3 | 175.9 | -72.2 | 172.3 | -163.5 | 0 | 0 | 112.3 | R373 L407 Q408 G415 | R373-E411 IonicContact CZ-OE1 2.78Å; R373-E411 IonicContact NH1-OE1 3.69Å; R373-E411 PolarHBondContact NH1-OE1 2.92Å; R373-E411 IonicContact NH2-OE1 2.56Å; R373-E411 PolarHBondContact NH2-OE1 3.26Å; L407-E411 WeakPolarHBondContact O-CG 3.43Å; L407-E411 PolarHBondContact O-N 2.94Å; Q408-E411 PolarHBondContact O-N 3.24Å; E411-G415 WeakPolarHBondContact O-CA 3.37Å; E411-G415 PolarHBondContact O-N 3.15Å |
| 412 | A | 92.1 | Very high | 76.3 | Confident | 84 Ų | 84 | 86 Ų | 86 | 69% | 0.694 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -68.2 | -35.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | Q408 E409 W410 | Q408-A412 WeakPolarHBondContact O-CB 3.42Å; Q408-A412 PolarHBondContact O-N 3.19Å; E409-A412 PolarHBondContact O-N 3.29Å; W410-A412 VanDerWaalsContact C-N 3.33Å; W410-A412 PolarHBondContact O-N 2.81Å |
| 413 | E | 89.6 | Confident | 73.3 | Confident | 123 Ų | 123 | 85.8 Ų | 85.8 | 58% | 0.575 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -78.2 | -38.3 | 177.2 | -75.8 | 177.8 | 178.3 | 0 | 0 | 113.7 | R369 E409 W410 | R369-E413 IonicContact CZ-OE1 3.81Å; R369-E413 IonicContact CZ-OE2 2.88Å; R369-E413 IonicContact NH1-OE1 2.67Å; R369-E413 PolarHBondContact NH1-OE1 2.79Å; R369-E413 IonicContact NH1-OE2 2.71Å; R369-E413 PolarHBondContact NH1-OE2 3.19Å; R369-E413 IonicContact NH2-OE1 3.15Å; R369-E413 PolarHBondContact NH2-OE1 3.08Å; R369-E413 IonicContact NH2-OE2 3.03Å; E409-E413 PolarHBondContact O-N 2.94Å; E409-E413 VanDerWaalsContact O-N 3.14Å; W410-E413 PolarHBondContact O-N 2.86Å |
| 414 | H | 82.9 | Confident | 70.7 | Confident | 100 Ų | 100 | 93.4 Ų | 93.4 | 46% | 0.463 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -96.6 | -11.8 | -172.1 | -63.3 | 74.2 | 0 | 0 | 0 | 113.3 | W410 | W410-H414 AromaticContact CD1-CE1 3.39Å; W410-H414 AromaticContact CD1-ND1 3.35Å; W410-H414 AromaticContact CE2-CG 3.78Å; W410-H414 AromaticContact CE2-ND1 3.76Å; W410-H414 AromaticContact CG-ND1 3.82Å; W410-H414 HydrophobicContact CZ2-CB 4.2Å; W410-H414 AromaticContact NE1-CD2 3.84Å; W410-H414 AromaticContact NE1-CE1 3.34Å; W410-H414 PolarHBondContact NE1-CE1 2.96Å; W410-H414 VanDerWaalsContact NE1-CE1 3.34Å; W410-H414 AromaticContact NE1-CG 3.65Å; W410-H414 AromaticContact NE1-ND1 3.31Å; W410-H414 PolarHBondContact NE1-ND1 3.11Å; W410-H414 AromaticContact NE1-NE2 3.65Å; W410-H414 WeakPolarHBondContact O-CB 3.46Å; W410-H414 PolarHBondContact O-N 3.15Å; W410-H414 PolarHBondContact O-ND1 3.39Å |
| 415 | G | 64.5 | Low | 68.1 | Low | 36 Ų | 36 | 98.7 Ų | 98.7 | 37% | 0.371 | 56% | 0.559 | S | S | . | * | trans | 74.1 | 171.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | E411 E417 | E411-G415 WeakPolarHBondContact O-CA 3.37Å; E411-G415 PolarHBondContact O-N 3.15Å; G415-E417 PolarHBondContact O-N 3.13Å | ||
| 416 | M | 55.2 | Low | 65.4 | Low | 176 Ų | 176 | 101.8 Ų | 101.8 | 87% | 0.867 | 57% | 0.571 | S | S | * | * | G | 310 helix | trans | -74.8 | 9 | -168.9 | -155.4 | 173.7 | 178.3 | 0 | 0 | 114.8 | G418 A419 | M416-G418 VanDerWaalsContact C-N 3.3Å; M416-G418 PolarHBondContact O-N 3.04Å; M416-A419 HydrophobicContact CG-CB 4.41Å |
| 417 | E | 49.2 | Very low | 62.7 | Low | 179 Ų | 179 | 108.7 Ų | 108.7 | 84% | 0.836 | 60% | 0.604 | S | S | * | * | G | 310 helix | trans | -67.8 | -28.2 | 177.5 | -64.1 | -158 | 141.2 | 0 | 0 | 113 | G415 A419 | G415-E417 PolarHBondContact O-N 3.13Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.1Å |
| 418 | G | 47.8 | Very low | 60.1 | Low | 43 Ų | 43 | 114.8 Ų | 114.8 | 44% | 0.443 | 64% | 0.637 | S | S | . | * | G | 310 helix | trans | -67.9 | -26.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | M416 A420 K421 | M416-G418 VanDerWaalsContact C-N 3.3Å; M416-G418 PolarHBondContact O-N 3.04Å; G418-A420 VanDerWaalsContact C-N 3.26Å; G418-A420 PolarHBondContact O-N 3.21Å; G418-K421 PolarHBondContact O-N 3.34Å |
| 419 | A | 46.4 | Very low | 57.3 | Low | 68 Ų | 68 | 114.3 Ų | 114.3 | 56% | 0.562 | 64% | 0.643 | S | S | * | * | G | 310 helix | trans | -64.3 | -28.6 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | M416 E417 K421 | M416-A419 HydrophobicContact CG-CB 4.41Å; E417-A419 VanDerWaalsContact C-N 3.32Å; E417-A419 PolarHBondContact O-N 3.1Å; A419-K421 PolarHBondContact O-N 2.97Å |
| 420 | A | 42.9 | Very low | 54.3 | Low | 96 Ų | 96 | 114.5 Ų | 114.5 | 79% | 0.793 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -76.7 | 1.6 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | G418 | G418-A420 VanDerWaalsContact C-N 3.26Å; G418-A420 PolarHBondContact O-N 3.21Å |
| 421 | K | 44.1 | Very low | 51.5 | Low | 199 Ų | 199 | 118 Ų | 118 | 87% | 0.865 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -125.6 | -8.6 | 178.9 | -77.1 | -177.4 | 177.2 | 172.9 | 0 | 115.4 | G418 A419 G423 | G418-K421 PolarHBondContact O-N 3.34Å; A419-K421 PolarHBondContact O-N 2.97Å; K421-G423 PolarHBondContact O-N 3.25Å |
| 422 | G | 38.7 | Very low | 48.4 | Very low | 60 Ų | 60 | 119.4 Ų | 119.4 | 62% | 0.619 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -88.3 | 96.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 423 | G | 32.8 | Very low | 45.9 | Very low | 74 Ų | 74 | 121 Ų | 121 | 76% | 0.763 | 71% | 0.706 | S | S | * | * | trans | -58.6 | 139.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | K421 E425 | K421-G423 PolarHBondContact O-N 3.25Å; G423-E425 PolarHBondContact O-N 3.38Å | ||
| 424 | E | 41.6 | Very low | 43.3 | Very low | 161 Ų | 161 | 121.1 Ų | 121.1 | 75% | 0.752 | 72% | 0.715 | S | S | * | * | trans | -67.7 | 98.7 | -173.6 | -70 | -176.9 | 94.6 | 0 | 0 | 113.2 | K426 | E424-K426 IonicContact OE1-NZ 3.34Å; E424-K426 PolarHBondContact OE1-NZ 3.07Å | ||
| 425 | E | 40.5 | Very low | 41.1 | Very low | 180 Ų | 180 | 125.5 Ų | 125.5 | 84% | 0.841 | 74% | 0.736 | S | S | * | * | trans | -96.1 | 78 | 152.1 | -73.4 | -168.8 | 141.2 | 0 | 0 | 109.4 | G423 M427 | G423-E425 PolarHBondContact O-N 3.38Å; E425-M427 PolarHBondContact O-N 2.85Å | ||
| 426 | K | 38.8 | Very low | 39.5 | Very low | 173 Ų | 173 | 132 Ų | 132 | 75% | 0.752 | 76% | 0.762 | S | S | * | * | trans | -66.2 | 93.9 | 166.5 | -94.3 | 178.4 | 177.2 | 152.5 | 0 | 109.6 | E424 D428 | E424-K426 IonicContact OE1-NZ 3.34Å; E424-K426 PolarHBondContact OE1-NZ 3.07Å; K426-D428 VanDerWaalsContact C-N 3.32Å; K426-D428 PolarHBondContact O-N 2.92Å; K426-D428 VanDerWaalsContact O-N 3.07Å | ||
| 427 | M | 37.9 | Very low | 38.3 | Very low | 165 Ų | 165 | 127.5 Ų | 127.5 | 81% | 0.813 | 76% | 0.76 | S | S | * | * | trans | -81.1 | 80.7 | 171.1 | -150.6 | 174.1 | -154.8 | 0 | 0 | 109.9 | E425 T429 | E425-M427 PolarHBondContact O-N 2.85Å; M427-T429 PolarHBondContact O-N 3.09Å | ||
| 428 | D | 40.5 | Very low | 37.6 | Very low | 137 Ų | 137 | 123.6 Ų | 123.6 | 73% | 0.733 | 76% | 0.759 | S | S | * | * | trans | -71 | 119.2 | 177.1 | -167.8 | -13 | 0 | 0 | 0 | 110.9 | K426 S430 | K426-D428 VanDerWaalsContact C-N 3.32Å; K426-D428 PolarHBondContact O-N 2.92Å; K426-D428 VanDerWaalsContact O-N 3.07Å; D428-S430 PolarHBondContact OD1-N 3.19Å | ||
| 429 | T | 36.1 | Very low | 36.9 | Very low | 121 Ų | 121 | 128.4 Ų | 128.4 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | trans | -152 | 63.9 | 172.2 | 39.2 | 0 | 0 | 0 | 0 | 110.9 | M427 P431 | M427-T429 PolarHBondContact O-N 3.09Å; T429-P431 VanDerWaalsContact O-CD 3.27Å; T429-P431 WeakPolarHBondContact O-CD 3.42Å | ||
| 430 | S | 29.9 | Very low | 36.3 | Very low | 106 Ų | 106 | 132.5 Ų | 132.5 | 74% | 0.741 | 79% | 0.792 | S | S | * | * | trans | -87.3 | 109.7 | 163.6 | -68.5 | 0 | 0 | 0 | 0 | 111.1 | D428 S432 | D428-S430 PolarHBondContact OD1-N 3.19Å; S430-S432 PolarHBondContact O-N 3.33Å | ||
| 431 | P | 37.1 | Very low | 36.3 | Very low | 117 Ų | 117 | 133 Ų | 133 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 120.5 | 167.4 | 30.5 | -31.9 | 0 | 0 | 0 | 109.3 | T429 P433 | T429-P431 VanDerWaalsContact O-CD 3.27Å; T429-P431 WeakPolarHBondContact O-CD 3.42Å; P431-P433 WeakPolarHBondContact O-CD 3.36Å |
| 432 | S | 26.9 | Very low | 35.9 | Very low | 109 Ų | 109 | 129.8 Ų | 129.8 | 76% | 0.762 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -82 | 128 | 177.3 | 177.9 | 0 | 0 | 0 | 0 | 111.3 | S430 | S430-S432 PolarHBondContact O-N 3.33Š|
| 433 | P | 40.9 | Very low | 36.6 | Very low | 119 Ų | 119 | 132.1 Ų | 132.1 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 132.4 | 159 | 34.1 | -28.4 | 0 | 0 | 0 | 110.2 | P431 | P431-P433 WeakPolarHBondContact O-CD 3.36Š|
| 434 | T | 35.7 | Very low | 37 | Very low | 125 Ų | 125 | 134.6 Ų | 134.6 | 77% | 0.767 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 134.5 | 167 | 47.9 | 0 | 0 | 0 | 0 | 110.7 | ||
| 435 | E | 35.1 | Very low | 36.5 | Very low | 192 Ų | 192 | 135.6 Ų | 135.6 | 90% | 0.897 | 80% | 0.796 | S | S | * | * | -173.1 | 162.1 | 125.3 | -105.7 | 174 | -170.1 | 0 | 0 | 111.8 | |||||
| 436 | D | 32.2 | Very low | 36.2 | Very low | 172 Ų | 172 | 132.9 Ų | 132.9 | 92% | 0.92 | 79% | 0.787 | S | S | * | * | trans | -82 | 155.9 | -172.1 | -68.3 | -79.8 | 0 | 0 | 0 | 114.4 | ||||
| 437 | G | 29.5 | Very low | 35.9 | Very low | 81 Ų | 81 | 133.5 Ų | 133.5 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | 169.9 | 99.6 | 168.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 438 | A | 34.8 | Very low | 35.7 | Very low | 97 Ų | 97 | 133.6 Ų | 133.6 | 80% | 0.802 | 79% | 0.788 | S | S | * | * | trans | -101.1 | 128.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 439 | T | 31.8 | Very low | 35.4 | Very low | 144 Ų | 144 | 135.8 Ų | 135.8 | 88% | 0.883 | 80% | 0.795 | S | S | * | * | trans | -166.7 | 132.1 | 143.2 | 27.6 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 440 | N | 34 | Very low | 35.4 | Very low | 154 Ų | 154 | 138 Ų | 138 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | trans | -86.4 | 169.8 | 150 | -91.1 | -44.3 | 0 | 0 | 0 | 108.3 | ||||
| 441 | P | 44.1 | Very low | 35.7 | Very low | 108 Ų | 108 | 138 Ų | 138 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | cis | -147.9 | 174.4 | 25 | 44 | -24.7 | 0 | 0 | 0 | 119.1 | ||||
| 442 | V | 35.4 | Very low | 35.6 | Very low | 131 Ų | 131 | 136.8 Ų | 136.8 | 79% | 0.794 | 79% | 0.791 | S | S | * | * | trans | 70.1 | 141.7 | 141.6 | 157.4 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 443 | P | 52.2 | Low | 36 | Very low | 108 Ų | 108 | 138.9 Ų | 138.9 | 70% | 0.701 | 79% | 0.793 | S | S | * | * | trans | -101.7 | 177.1 | 179.6 | 41.6 | -38.1 | 0 | 0 | 0 | 114.4 | ||||
| 444 | P | 41.5 | Very low | 35.8 | Very low | 127 Ų | 127 | 138.7 Ų | 138.7 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | trans | -116.1 | 163.5 | 156.8 | 38.1 | -28 | 0 | 0 | 0 | 114 | ||||
| 445 | E | 32.1 | Very low | 35.8 | Very low | 182 Ų | 182 | 140.9 Ų | 140.9 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -102.4 | -173.9 | -179.2 | -61.9 | 171.9 | 106.1 | 0 | 0 | 113 | ||||
| 446 | D | 34.8 | Very low | 35.9 | Very low | 123 Ų | 123 | 135.4 Ų | 135.4 | 66% | 0.658 | 78% | 0.778 | S | S | * | * | trans | 62.8 | 110.7 | 151.4 | -92.8 | -0.9 | 0 | 0 | 0 | 121.2 | ||||
| 447 | Q | 32.5 | Very low | 36.2 | Very low | 185 Ų | 185 | 134.4 Ų | 134.4 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | -168.2 | 135.2 | 98.1 | -91.4 | 143.6 | 101 | 0 | 0 | 107.7 | |||||
| 448 | K | 32.2 | Very low | 36.7 | Very low | 167 Ų | 167 | 138.9 Ų | 138.9 | 73% | 0.726 | 77% | 0.767 | S | S | * | * | cis | 83.7 | 96 | 30.5 | -147.8 | -162.7 | -159.6 | -167.6 | 0 | 114.8 | ||||
| 449 | E | 35.7 | Very low | 37.7 | Very low | 184 Ų | 184 | 139 Ų | 139 | 86% | 0.86 | 76% | 0.76 | S | S | * | * | trans | -159.1 | 120.5 | 144.2 | -105.5 | 171.1 | -163.2 | 0 | 0 | 104.3 | ||||
| 450 | E | 35.2 | Very low | 38.1 | Very low | 167 Ų | 167 | 139.8 Ų | 139.8 | 78% | 0.78 | 76% | 0.758 | S | S | * | * | 47.4 | 126.4 | 75.6 | -73.9 | -170.4 | -174.4 | 0 | 0 | 112.6 | |||||
| 451 | S | 36 | Very low | 38.6 | Very low | 105 Ų | 105 | 136.5 Ų | 136.5 | 73% | 0.734 | 75% | 0.751 | S | S | * | * | cis | -163.4 | -172 | 3.9 | 61.4 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 452 | S | 34.6 | Very low | 38.8 | Very low | 93 Ų | 93 | 140.9 Ų | 140.9 | 65% | 0.65 | 79% | 0.785 | S | S | * | * | cis | -160.5 | 152.2 | 13.9 | 38 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 453 | L | 34.8 | Very low | 39 | Very low | 153 Ų | 153 | 141.4 Ų | 141.4 | 80% | 0.801 | 78% | 0.784 | S | S | * | * | trans | 50.3 | 135.2 | 156.1 | -76.9 | 85.4 | 0 | 0 | 0 | 120.8 | ||||
| 454 | V | 38.5 | Very low | 38.3 | Very low | 115 Ų | 115 | 143.1 Ų | 143.1 | 70% | 0.697 | 79% | 0.789 | S | S | * | * | cis | 73.1 | 124.3 | 44 | 176.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 455 | E | 35.4 | Very low | 38.1 | Very low | 171 Ų | 171 | 144 Ų | 144 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | cis | -148.6 | -172.5 | 10 | -138.2 | 172.3 | 73.8 | 0 | 0 | 108 | ||||
| 456 | A | 37.5 | Very low | 38.4 | Very low | 76 Ų | 76 | 141.8 Ų | 141.8 | 63% | 0.628 | 78% | 0.783 | S | S | * | * | cis | -159.2 | -169.6 | 10.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 457 | Q | 36.8 | Very low | 38.7 | Very low | 151 Ų | 151 | 142.9 Ų | 142.9 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | trans | -35 | 137.7 | 165.1 | -88.9 | 66.2 | 0.7 | 0 | 0 | 115.2 | ||||
| 458 | Q | 39.8 | Very low | 39.1 | Very low | 175 Ų | 175 | 140.1 Ų | 140.1 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | 56.6 | 152.3 | 73.9 | -81.3 | -170.3 | 13.2 | 0 | 0 | 115.6 | |||||
| 459 | P | 56 | Low | 39.6 | Very low | 101 Ų | 101 | 138.2 Ų | 138.2 | 66% | 0.656 | 79% | 0.79 | S | S | * | * | cis | -140.5 | -166.3 | -12.2 | 35.2 | -12.7 | 0 | 0 | 0 | 115 | ||||
| 460 | L | 40.2 | Very low | 39.8 | Very low | 160 Ų | 160 | 134.7 Ų | 134.7 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | trans | 79.8 | 116.4 | 149.5 | -81.2 | 166.5 | 0 | 0 | 0 | 122.4 | ||||
| 461 | A | 44.5 | Very low | 40.2 | Very low | 84 Ų | 84 | 132 Ų | 132 | 69% | 0.694 | 79% | 0.785 | S | S | * | * | 56.8 | 115.7 | 128.7 | 0 | 0 | 0 | 0 | 0 | 122.2 | |||||
| 462 | S | 48.7 | Very low | 40.6 | Very low | 200 Ų | 200 | 134.5 Ų | 134.5 | 100% | 1.399 | 79% | 0.79 | S | S | * | * | -147.1 | 0 | 112.2 | -71.3 | 0 | 0 | 0 | 0 | 109.9 |
Retrieved 462 of 462 residues in 2233.9 ms
(Link to these results)